| 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 | 37.5 | Very low | 31.9 | Very low | 245 Ų | 245 | 149 Ų | 149 | 100% | 1.207 | 82% | 0.822 | S | S | * | * | 0 | 114.1 | 0 | -60.2 | 159 | 178.3 | 0 | 0 | 105.3 | |||||
| 2 | G | 30.9 | Very low | 32.1 | Very low | 69 Ų | 69 | 146 Ų | 146 | 71% | 0.711 | 82% | 0.815 | S | S | * | * | cis | 87.6 | 136.6 | 15.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 3 | I | 36.3 | Very low | 31.8 | Very low | 150 Ų | 150 | 143.1 Ų | 143.1 | 77% | 0.769 | 81% | 0.81 | S | S | * | * | cis | -158.5 | 170 | 11.4 | -109.5 | 164.3 | 0 | 0 | 0 | 109.4 | ||||
| 4 | N | 34.6 | Very low | 31.4 | Very low | 154 Ų | 154 | 143.1 Ų | 143.1 | 82% | 0.824 | 82% | 0.815 | S | S | * | * | trans | 74.2 | 138.4 | 179.3 | -54.8 | -29.1 | 0 | 0 | 0 | 116.4 | ||||
| 5 | G | 30.7 | Very low | 31.2 | Very low | 69 Ų | 69 | 145.7 Ų | 145.7 | 71% | 0.711 | 82% | 0.817 | S | S | * | * | cis | 104.3 | 121.3 | -12.8 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 6 | I | 36.3 | Very low | 30.9 | Very low | 176 Ų | 176 | 149.4 Ų | 149.4 | 90% | 0.903 | 82% | 0.822 | S | S | * | * | trans | -158.7 | 150.4 | 160 | -105.2 | 161.5 | 0 | 0 | 0 | 108.3 | ||||
| 7 | E | 32.2 | Very low | 30.6 | Very low | 163 Ų | 163 | 147.5 Ų | 147.5 | 76% | 0.762 | 82% | 0.822 | S | S | * | * | trans | -116.6 | 153.2 | -171 | -82.4 | -176.9 | 104.5 | 0 | 0 | 114.6 | ||||
| 8 | I | 31.4 | Very low | 30.4 | Very low | 137 Ų | 137 | 152 Ų | 152 | 70% | 0.703 | 82% | 0.824 | S | S | * | * | trans | 44.5 | 121.7 | 136.4 | -57.3 | 168.1 | 0 | 0 | 0 | 119.4 | ||||
| 9 | Q | 25.9 | Very low | 30.1 | Very low | 196 Ų | 196 | 150.4 Ų | 150.4 | 92% | 0.916 | 82% | 0.82 | S | S | * | * | -149.5 | 164 | 122.6 | -117.3 | -172.8 | 48.7 | 0 | 0 | 112.5 | |||||
| 10 | A | 27.1 | Very low | 30 | Very low | 82 Ų | 82 | 151.7 Ų | 151.7 | 68% | 0.678 | 82% | 0.82 | S | S | * | * | trans | -154.6 | 164.2 | -166.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 11 | K | 27.6 | Very low | 29.8 | Very low | 198 Ų | 198 | 153.1 Ų | 153.1 | 86% | 0.861 | 82% | 0.822 | S | S | * | * | trans | 69.4 | 164.8 | 171.5 | -83.6 | -175.2 | 176.7 | -177.7 | 0 | 115.6 | ||||
| 12 | P | 34.6 | Very low | 30 | Very low | 113 Ų | 113 | 147.5 Ų | 147.5 | 73% | 0.734 | 80% | 0.804 | S | S | * | * | cis | -120.3 | 163.9 | 8.3 | 40.9 | -28.4 | 0 | 0 | 0 | 116.9 | ||||
| 13 | S | 27.8 | Very low | 29.7 | Very low | 108 Ų | 108 | 147.7 Ų | 147.7 | 76% | 0.755 | 81% | 0.805 | S | S | * | * | trans | -83 | 149.3 | 160.3 | 51.6 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 14 | T | 27.3 | Very low | 29.3 | Very low | 144 Ų | 144 | 146 Ų | 146 | 88% | 0.883 | 81% | 0.814 | S | S | * | * | trans | -133.6 | 133.3 | 167.6 | -51.4 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 15 | E | 27.7 | Very low | 29 | Very low | 181 Ų | 181 | 146.5 Ų | 146.5 | 85% | 0.846 | 81% | 0.811 | S | S | * | * | trans | -128.1 | 136.5 | -176.8 | 175.9 | -172.7 | -167.5 | 0 | 0 | 109.4 | ||||
| 16 | K | 27.2 | Very low | 29.5 | Very low | 206 Ų | 206 | 148.3 Ų | 148.3 | 90% | 0.896 | 81% | 0.81 | S | S | * | * | trans | 165.5 | 152.7 | 166.1 | -98.5 | 168.9 | -179.3 | -176.8 | 0 | 109 | ||||
| 17 | S | 25 | Very low | 29.1 | Very low | 117 Ų | 117 | 147.9 Ų | 147.9 | 82% | 0.818 | 81% | 0.805 | S | S | * | * | cis | -157.8 | 155.6 | -20.1 | -167 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 18 | R | 26.9 | Very low | 28.8 | Very low | 228 Ų | 228 | 149.4 Ų | 149.4 | 86% | 0.86 | 81% | 0.814 | S | S | * | * | trans | -89 | 139.1 | -178.3 | 169.4 | -159.3 | -160.5 | 163.8 | 5.1 | 113.2 | ||||
| 19 | T | 25.5 | Very low | 28.7 | Very low | 121 Ų | 121 | 151.2 Ų | 151.2 | 74% | 0.742 | 82% | 0.819 | S | S | * | * | trans | 172.1 | 156.8 | 149 | 32.2 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 20 | E | 26.7 | Very low | 29.6 | Very low | 176 Ų | 176 | 145.8 Ų | 145.8 | 82% | 0.822 | 80% | 0.801 | S | S | * | * | cis | -157.7 | -174 | -32.2 | -124.4 | 174 | 146.5 | 0 | 0 | 110 | ||||
| 21 | Q | 27.8 | Very low | 29.7 | Very low | 183 Ų | 183 | 151.7 Ų | 151.7 | 86% | 0.855 | 81% | 0.806 | S | S | * | * | trans | -84.3 | -169 | -176 | -52.5 | 179.7 | -54.4 | 0 | 0 | 112.7 | ||||
| 22 | P | 40.3 | Very low | 29.8 | Very low | 127 Ų | 127 | 148.9 Ų | 148.9 | 83% | 0.825 | 80% | 0.8 | S | S | * | * | cis | -137.7 | -175.4 | -8.3 | 41.3 | -23 | 0 | 0 | 0 | 115.8 | ||||
| 23 | G | 25.4 | Very low | 29.4 | Very low | 73 Ų | 73 | 147.6 Ų | 147.6 | 75% | 0.753 | 80% | 0.799 | S | S | * | * | trans | 135.8 | 119.3 | 134.8 | 0 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 24 | A | 26.9 | Very low | 30.6 | Very low | 114 Ų | 114 | 148.3 Ų | 148.3 | 94% | 0.942 | 80% | 0.802 | S | S | * | * | trans | 74.9 | 137.3 | 143 | 0 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 25 | E | 29.9 | Very low | 31.7 | Very low | 165 Ų | 165 | 146.3 Ų | 146.3 | 77% | 0.771 | 79% | 0.791 | S | S | * | * | trans | -109.5 | 176.1 | 170.1 | -155.5 | -167.2 | -112.3 | 0 | 0 | 108.5 | Q27 | E25-Q27 PolarHBondContact OE2-N 3.43Š| ||
| 26 | P | 40.3 | Very low | 31.6 | Very low | 107 Ų | 107 | 146.6 Ų | 146.6 | 70% | 0.695 | 79% | 0.792 | S | S | * | * | -155.7 | 145.2 | 90.1 | 38.4 | -18.4 | 0 | 0 | 0 | 118.5 | |||||
| 27 | Q | 27.1 | Very low | 31.6 | Very low | 167 Ų | 167 | 141.1 Ų | 141.1 | 78% | 0.78 | 79% | 0.785 | S | S | * | * | trans | 52 | 126.8 | 132.6 | -59.5 | 178.5 | -13.2 | 0 | 0 | 123 | E25 | E25-Q27 PolarHBondContact OE2-N 3.43Š| ||
| 28 | M | 25.8 | Very low | 31.6 | Very low | 194 Ų | 194 | 143.8 Ų | 143.8 | 96% | 0.956 | 79% | 0.79 | S | S | * | * | -158.4 | 151.8 | 104.4 | -105.2 | -173.6 | -173 | 0 | 0 | 112.7 | |||||
| 29 | E | 29.2 | Very low | 31.5 | Very low | 175 Ų | 175 | 135.8 Ų | 135.8 | 82% | 0.818 | 78% | 0.779 | S | S | * | * | trans | -152.9 | -171.3 | -174.4 | -136.1 | -136.9 | 123.4 | 0 | 0 | 106.1 | ||||
| 30 | P | 46.6 | Very low | 31.4 | Very low | 82 Ų | 82 | 135.2 Ų | 135.2 | 53% | 0.532 | 78% | 0.78 | S | S | . | * | cis | -141.9 | -162.5 | -0.3 | 36.6 | -12.1 | 0 | 0 | 0 | 115.6 | ||||
| 31 | R | 28.6 | Very low | 31.4 | Very low | 207 Ų | 207 | 135.4 Ų | 135.4 | 78% | 0.781 | 78% | 0.778 | S | S | * | * | trans | 81.2 | 150.9 | 151 | -69.1 | 174.8 | -172.3 | -153.9 | -0.7 | 120.4 | ||||
| 32 | D | 28.4 | Very low | 31.3 | Very low | 138 Ų | 138 | 133.5 Ų | 133.5 | 74% | 0.738 | 77% | 0.773 | S | S | * | * | cis | -158.5 | 174.3 | -5.8 | -110.6 | -25.2 | 0 | 0 | 0 | 112.2 | ||||
| 33 | A | 26.5 | Very low | 30.6 | Very low | 87 Ų | 87 | 131.1 Ų | 131.1 | 72% | 0.719 | 77% | 0.773 | S | S | * | * | trans | -159 | 176.7 | 170.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 34 | P | 53.7 | Low | 30.6 | Very low | 123 Ų | 123 | 136.9 Ų | 136.9 | 80% | 0.799 | 78% | 0.78 | S | S | * | * | cis | -115.2 | -113.8 | -16.7 | 22.9 | 3.4 | 0 | 0 | 0 | 109.1 | ||||
| 35 | P | 49.9 | Very low | 31.2 | Very low | 102 Ų | 102 | 137.2 Ų | 137.2 | 66% | 0.662 | 77% | 0.772 | S | S | * | * | cis | -134.6 | 175.9 | -37.3 | 40.3 | -22.2 | 0 | 0 | 0 | 117.5 | ||||
| 36 | E | 27.1 | Very low | 30.9 | Very low | 187 Ų | 187 | 134.1 Ų | 134.1 | 87% | 0.874 | 78% | 0.775 | S | S | * | * | trans | 70.9 | 152.3 | 144.2 | -88.6 | -179.4 | -175.7 | 0 | 0 | 126.3 | ||||
| 37 | A | 26.7 | Very low | 30.2 | Very low | 90 Ų | 90 | 132.2 Ų | 132.2 | 74% | 0.744 | 78% | 0.775 | S | S | * | * | trans | 74.7 | 109.7 | 149.9 | 0 | 0 | 0 | 0 | 0 | 124.2 | ||||
| 38 | D | 25.2 | Very low | 30.1 | Very low | 173 Ų | 173 | 128.7 Ų | 128.7 | 93% | 0.925 | 77% | 0.769 | S | S | * | * | 54.9 | 162.8 | 123.6 | -152.7 | 11.7 | 0 | 0 | 0 | 122.6 | |||||
| 39 | G | 24.7 | Very low | 30.1 | Very low | 60 Ų | 60 | 127.6 Ų | 127.6 | 62% | 0.619 | 76% | 0.761 | S | S | * | * | trans | 111.2 | 74.2 | 152.7 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 40 | S | 23.5 | Very low | 29.7 | Very low | 110 Ų | 110 | 124 Ų | 124 | 77% | 0.769 | 75% | 0.754 | S | S | * | * | trans | 22.1 | 139.9 | 137.6 | -68.3 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 41 | K | 25.6 | Very low | 28.6 | Very low | 180 Ų | 180 | 128.9 Ų | 128.9 | 78% | 0.783 | 77% | 0.767 | S | S | * | * | trans | 74.4 | 155.8 | 149.6 | -70.5 | 175.7 | 166.3 | -154.7 | 0 | 118.3 | ||||
| 42 | D | 25.9 | Very low | 28.4 | Very low | 142 Ų | 142 | 126.1 Ų | 126.1 | 76% | 0.759 | 77% | 0.766 | S | S | * | * | cis | -153.5 | 164.2 | -9.7 | -106.9 | -33 | 0 | 0 | 0 | 107.8 | ||||
| 43 | G | 26 | Very low | 28.1 | Very low | 78 Ų | 78 | 123.3 Ų | 123.3 | 80% | 0.804 | 76% | 0.762 | S | S | * | * | trans | 133.4 | 76 | 161.9 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 44 | Q | 24.2 | Very low | 27.9 | Very low | 194 Ų | 194 | 127.8 Ų | 127.8 | 91% | 0.907 | 77% | 0.765 | S | S | * | * | trans | -98.6 | 177.9 | 154.6 | -106.7 | 177.6 | -12.8 | 0 | 0 | 109.1 | ||||
| 45 | P | 39.8 | Very low | 26.5 | Very low | 121 Ų | 121 | 129 Ų | 129 | 79% | 0.786 | 76% | 0.76 | S | S | * | * | cis | -131 | -162.2 | 23.2 | 44.4 | -25.3 | 0 | 0 | 0 | 112.6 | ||||
| 46 | A | 24.7 | Very low | 25.2 | Very low | 99 Ų | 99 | 130.4 Ų | 130.4 | 82% | 0.818 | 76% | 0.762 | S | S | * | * | cis | -147.2 | 171.6 | 6.1 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 47 | G | 24.3 | Very low | 25 | Very low | 68 Ų | 68 | 129.6 Ų | 129.6 | 70% | 0.701 | 76% | 0.764 | S | S | * | * | cis | 179.3 | 174.2 | -0.3 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 48 | S | 25.2 | Very low | 24.8 | Very low | 93 Ų | 93 | 129.7 Ų | 129.7 | 65% | 0.65 | 77% | 0.765 | S | S | * | * | cis | -154 | 138 | -3.5 | -92.7 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 49 | E | 25.8 | Very low | 24.8 | Very low | 171 Ų | 171 | 128.5 Ų | 128.5 | 80% | 0.799 | 76% | 0.763 | S | S | * | * | 45.4 | 154.7 | 121.2 | -55.7 | 165.4 | 99.6 | 0 | 0 | 121.9 | |||||
| 50 | C | 22.1 | Very low | 24.7 | Very low | 98 Ų | 98 | 133.5 Ų | 133.5 | 66% | 0.662 | 77% | 0.771 | S | S | * | * | cis | -165.1 | 155.9 | -22.9 | -101.7 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 51 | K | 23.3 | Very low | 24.7 | Very low | 186 Ų | 186 | 136.6 Ų | 136.6 | 81% | 0.809 | 78% | 0.778 | S | S | * | * | cis | 91.2 | 144.8 | 14 | -153.7 | -163.3 | -179.9 | -175.1 | 0 | 115.3 | ||||
| 52 | I | 24.4 | Very low | 24.7 | Very low | 148 Ų | 148 | 134.1 Ų | 134.1 | 76% | 0.759 | 77% | 0.772 | S | S | * | * | trans | 85 | 158 | 169.6 | -55 | 169 | 0 | 0 | 0 | 115.3 | ||||
| 53 | A | 22.4 | Very low | 24.6 | Very low | 79 Ų | 79 | 135.3 Ų | 135.3 | 65% | 0.653 | 78% | 0.778 | S | S | * | * | 176.3 | 156.4 | -70.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 54 | K | 22.6 | Very low | 24.5 | Very low | 182 Ų | 182 | 135 Ų | 135 | 79% | 0.791 | 78% | 0.775 | S | S | * | * | trans | 62.3 | 175 | 171.6 | -73.8 | 178.1 | 131.8 | -138.1 | 0 | 114.7 | ||||
| 55 | E | 22.7 | Very low | 24.5 | Very low | 147 Ų | 147 | 135.2 Ų | 135.2 | 69% | 0.687 | 78% | 0.776 | S | S | * | * | cis | -145.1 | -165.8 | 11 | -155.3 | 135.7 | -122 | 0 | 0 | 112.7 | ||||
| 56 | D | 22.4 | Very low | 23.7 | Very low | 132 Ų | 132 | 135.5 Ų | 135.5 | 71% | 0.706 | 78% | 0.781 | S | S | * | * | trans | -71 | 156.6 | -169.2 | -54.9 | -80.7 | 0 | 0 | 0 | 116.5 | ||||
| 57 | N | 24.1 | Very low | 23.7 | Very low | 170 Ų | 170 | 140.3 Ų | 140.3 | 91% | 0.909 | 78% | 0.784 | S | S | * | * | -173.3 | 163.3 | 116.2 | -105 | -73.1 | 0 | 0 | 0 | 113.3 | |||||
| 58 | A | 22.3 | Very low | 24.4 | Very low | 93 Ų | 93 | 142.2 Ų | 142.2 | 77% | 0.769 | 78% | 0.784 | S | S | * | * | trans | -115.5 | 140.8 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 59 | V | 24.4 | Very low | 24.2 | Very low | 147 Ų | 147 | 144 Ų | 144 | 89% | 0.891 | 79% | 0.791 | S | S | * | * | trans | -139.5 | 134.6 | 163.9 | -178.4 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 60 | Q | 22.4 | Very low | 24.2 | Very low | 165 Ų | 165 | 143.5 Ų | 143.5 | 77% | 0.771 | 79% | 0.793 | S | S | * | * | trans | -82.6 | 153.5 | 175 | -59.2 | 168.1 | -75.1 | 0 | 0 | 111 | ||||
| 61 | L | 24.6 | Very low | 24.2 | Very low | 175 Ų | 175 | 144.4 Ų | 144.4 | 92% | 0.916 | 80% | 0.8 | S | S | * | * | trans | -151.6 | 153.8 | 132.4 | -108.5 | 170.6 | 0 | 0 | 0 | 109.3 | ||||
| 62 | I | 24.6 | Very low | 24.3 | Very low | 129 Ų | 129 | 140.3 Ų | 140.3 | 66% | 0.662 | 80% | 0.801 | S | S | * | * | trans | -125.9 | 147.8 | -173.2 | -60.5 | 170.7 | 0 | 0 | 0 | 107.9 | ||||
| 63 | D | 24.5 | Very low | 24.4 | Very low | 166 Ų | 166 | 138.7 Ų | 138.7 | 89% | 0.888 | 80% | 0.803 | S | S | * | * | trans | 138.4 | 145.5 | 159 | -73.1 | -17.4 | 0 | 0 | 0 | 109.9 | ||||
| 64 | G | 24 | Very low | 25.1 | Very low | 73 Ų | 73 | 140.1 Ų | 140.1 | 75% | 0.753 | 81% | 0.806 | S | S | * | * | cis | -164.9 | 168.6 | -3 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 65 | E | 24.3 | Very low | 25.1 | Very low | 198 Ų | 198 | 138.8 Ų | 138.8 | 93% | 0.925 | 81% | 0.807 | S | S | * | * | trans | -72.4 | 150 | -169.4 | -64.4 | 174.4 | 80.3 | 0 | 0 | 115.4 | ||||
| 66 | S | 22.6 | Very low | 25.3 | Very low | 127 Ų | 127 | 136.5 Ų | 136.5 | 89% | 0.888 | 81% | 0.813 | S | S | * | * | -170 | 152.9 | 128.5 | 31.6 | 0 | 0 | 0 | 0 | 114.2 | |||||
| 67 | K | 24 | Very low | 25.6 | Very low | 199 Ų | 199 | 140 Ų | 140 | 87% | 0.865 | 83% | 0.825 | S | S | * | * | trans | -146.3 | 167.6 | 177.3 | -135.7 | -173.6 | -177.3 | 179.3 | 0 | 106 | ||||
| 68 | P | 39 | Very low | 25.7 | Very low | 109 Ų | 109 | 136.6 Ų | 136.6 | 71% | 0.708 | 82% | 0.821 | S | S | * | * | cis | -117.2 | -158.9 | -14.5 | 38.2 | -20.7 | 0 | 0 | 0 | 111.1 | ||||
| 69 | T | 22.2 | Very low | 25.9 | Very low | 131 Ų | 131 | 135.5 Ų | 135.5 | 80% | 0.804 | 82% | 0.819 | S | S | * | * | -179.2 | 170.4 | 95.3 | -63.9 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 70 | L | 25.5 | Very low | 25.9 | Very low | 159 Ų | 159 | 135 Ų | 135 | 83% | 0.832 | 82% | 0.816 | S | S | * | * | trans | -79.2 | 178.8 | -170 | -112.1 | 70.3 | 0 | 0 | 0 | 117.4 | ||||
| 71 | S | 22.9 | Very low | 26.1 | Very low | 118 Ų | 118 | 135.6 Ų | 135.6 | 83% | 0.825 | 82% | 0.819 | S | S | * | * | trans | 83.1 | 145.9 | 160.3 | 76.6 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 72 | A | 25.3 | Very low | 26.2 | Very low | 99 Ų | 99 | 135 Ų | 135 | 82% | 0.818 | 82% | 0.816 | S | S | * | * | cis | -159.4 | 161.3 | -19.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 73 | S | 25.9 | Very low | 26.3 | Very low | 114 Ų | 114 | 137.9 Ų | 137.9 | 80% | 0.797 | 83% | 0.826 | S | S | * | * | trans | -82.4 | 165.9 | 167.7 | -36 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 74 | P | 36.7 | Very low | 26.5 | Very low | 110 Ų | 110 | 138.3 Ų | 138.3 | 71% | 0.714 | 83% | 0.825 | S | S | * | * | -135.9 | -162.1 | 50.8 | 35.2 | -11 | 0 | 0 | 0 | 112.3 | |||||
| 75 | D | 22.7 | Very low | 26.6 | Very low | 153 Ų | 153 | 143.8 Ų | 143.8 | 82% | 0.818 | 83% | 0.831 | S | S | * | * | cis | -143.3 | 150.7 | 10.9 | -71.5 | -76.6 | 0 | 0 | 0 | 111.4 | ||||
| 76 | A | 26.6 | Very low | 26.9 | Very low | 99 Ų | 99 | 138.2 Ų | 138.2 | 82% | 0.818 | 83% | 0.827 | S | S | * | * | trans | -171.5 | 108.1 | 150 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 77 | E | 28.1 | Very low | 27.2 | Very low | 205 Ų | 205 | 141.2 Ų | 141.2 | 96% | 0.958 | 83% | 0.827 | S | S | * | * | trans | 29.9 | 129.7 | 157 | -56.4 | -167.3 | 138.3 | 0 | 0 | 122.2 | ||||
| 78 | A | 26.3 | Very low | 27.6 | Very low | 99 Ų | 99 | 134.8 Ų | 134.8 | 82% | 0.818 | 82% | 0.816 | S | S | * | * | trans | -99.4 | 121.5 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 79 | G | 26.6 | Very low | 27.5 | Very low | 71 Ų | 71 | 136.2 Ų | 136.2 | 73% | 0.732 | 83% | 0.826 | S | S | * | * | trans | -95.2 | 111.9 | 159.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | Q81 | G79-Q81 PolarHBondContact O-N 2.82Š| ||
| 80 | V | 26.1 | Very low | 29.2 | Very low | 136 Ų | 136 | 132.8 Ų | 132.8 | 82% | 0.824 | 82% | 0.816 | S | S | * | * | trans | -72.4 | 96.6 | -176.2 | -177.7 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 81 | Q | 26 | Very low | 31.1 | Very low | 178 Ų | 178 | 129.3 Ų | 129.3 | 83% | 0.832 | 80% | 0.795 | S | S | * | * | trans | -89.8 | 132.9 | 158.3 | -68.1 | -168.9 | -4.1 | 0 | 0 | 109.2 | G79 E83 | G79-Q81 PolarHBondContact O-N 2.82Å; Q81-E83 PolarHBondContact O-N 2.74Å | ||
| 82 | L | 26.8 | Very low | 33.5 | Very low | 162 Ų | 162 | 129.6 Ų | 129.6 | 85% | 0.848 | 79% | 0.791 | S | S | * | * | trans | -77.8 | 104.8 | 178.8 | -152.4 | 85.1 | 0 | 0 | 0 | 109 | M84 | L82-M84 PolarHBondContact O-N 3.09Š| ||
| 83 | E | 25.5 | Very low | 36.1 | Very low | 189 Ų | 189 | 125.5 Ų | 125.5 | 88% | 0.883 | 76% | 0.756 | S | S | * | * | trans | -66.7 | 102.4 | 177.1 | -71.5 | -163.7 | 123.3 | 0 | 0 | 111.1 | Q81 | Q81-E83 PolarHBondContact O-N 2.74Š| ||
| 84 | M | 28.7 | Very low | 38.5 | Very low | 175 Ų | 175 | 123.6 Ų | 123.6 | 86% | 0.862 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 142.5 | 158.9 | -72.1 | -142.3 | -52.9 | 0 | 0 | 109.8 | L82 G86 | L82-M84 PolarHBondContact O-N 3.09Å; M84-G86 PolarHBondContact O-N 2.98Å |
| 85 | H | 27.9 | Very low | 40.6 | Very low | 188 Ų | 188 | 120.3 Ų | 120.3 | 87% | 0.87 | 72% | 0.716 | S | S | * | * | P | Polyproline II helix | trans | -49.2 | 133.6 | -178.1 | -89 | 25.5 | 0 | 0 | 0 | 113.4 | Q87 | H85-Q87 PolarHBondContact O-N 2.81Š|
| 86 | G | 29.5 | Very low | 43.5 | Very low | 82 Ų | 82 | 113.6 Ų | 113.6 | 85% | 0.845 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 123 | -169.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | M84 | M84-G86 PolarHBondContact O-N 2.98Š|
| 87 | Q | 29.3 | Very low | 46.4 | Very low | 190 Ų | 190 | 112 Ų | 112 | 89% | 0.888 | 68% | 0.676 | S | S | * | * | P | Polyproline II helix | trans | -91.6 | 134.5 | 155.2 | -64.7 | -175.4 | -2.4 | 0 | 0 | 108.2 | H85 | H85-Q87 PolarHBondContact O-N 2.81Š|
| 88 | G | 32.4 | Very low | 49.4 | Very low | 63 Ų | 63 | 108.9 Ų | 108.9 | 65% | 0.649 | 66% | 0.656 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 161.3 | 173 | 0 | 0 | 0 | 0 | 0 | 111.9 | G90 | G88-G90 PolarHBondContact O-N 2.75Š|
| 89 | P | 37.7 | Very low | 52.6 | Low | 140 Ų | 140 | 104.2 Ų | 104.2 | 91% | 0.909 | 62% | 0.617 | S | S | * | * | trans | -59.1 | 103.3 | -174.5 | 24.3 | -34.4 | 0 | 0 | 0 | 111.2 | ||||
| 90 | G | 56.1 | Low | 55.8 | Low | 58 Ų | 58 | 106.3 Ų | 106.3 | 60% | 0.598 | 60% | 0.603 | S | S | * | * | trans | -62.4 | 145 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111 | G88 V92 | G88-G90 PolarHBondContact O-N 2.75Å; G90-V92 PolarHBondContact O-N 2.79Å | ||
| 91 | F | 66.9 | Low | 59.1 | Low | 86 Ų | 86 | 103 Ų | 103 | 38% | 0.377 | 58% | 0.58 | S | S | . | * | trans | -58.3 | 112.1 | 179.8 | 176.2 | -94.1 | 0 | 0 | 0 | 111.2 | P93 H222 L283 L284 | F91-P93 HydrophobicContact CD1-CG 4.29Å; F91-P93 HydrophobicContact CE1-CB 4.21Å; F91-P93 HydrophobicContact CE1-CG 3.91Å; F91-H222 WeakPolarHBondContact CZ-O 3.44Å; F91-L283 HydrophobicContact CE2-CB 3.78Å; F91-L283 WeakPolarHBondContact CE2-O 3.07Å; F91-L283 HydrophobicContact CZ-CB 3.52Å; F91-L283 HydrophobicContact CZ-CD1 4.28Å; F91-L284 HydrophobicContact CB-CD2 4.18Å; F91-L284 HydrophobicContact CD1-CD2 3.36Å; F91-L284 HydrophobicContact CD1-CG 4.21Å; F91-L284 HydrophobicContact CD2-CD2 4.34Å; F91-L284 HydrophobicContact CE1-CD2 3.75Å; F91-L284 HydrophobicContact CE1-CG 4.09Å; F91-L284 HydrophobicContact CG-CD2 3.69Å; F91-L284 HydrophobicContact CZ-CD2 4.4Å | ||
| 92 | V | 72.8 | Confident | 62.4 | Low | 124 Ų | 124 | 94.6 Ų | 94.6 | 75% | 0.752 | 54% | 0.541 | S | S | * | . | trans | -94.3 | 118.7 | 171.9 | -175.8 | 0 | 0 | 0 | 0 | 108.1 | G90 | G90-V92 PolarHBondContact O-N 2.79Š| ||
| 93 | P | 79 | Confident | 65.7 | Low | 14 Ų | 14 | 87 Ų | 87 | 9% | 0.091 | 50% | 0.502 | C | S | . | . | trans | -62.9 | 149.4 | 175.2 | -21.4 | 33.3 | 0 | 0 | 0 | 112 | F91 E95 Y223 R225 | F91-P93 HydrophobicContact CD1-CG 4.29Å; F91-P93 HydrophobicContact CE1-CB 4.21Å; F91-P93 HydrophobicContact CE1-CG 3.91Å; P93-E95 VanDerWaalsContact C-N 3.27Å; P93-E95 PolarHBondContact O-N 2.9Å; P93-Y223 VanDerWaalsContact CB-O 3.32Å; P93-Y223 WeakPolarHBondContact CB-O 3.41Å; P93-R225 HydrophobicContact CG-CB 3.9Å | ||
| 94 | P | 76.6 | Confident | 69.1 | Low | 73 Ų | 73 | 83.4 Ų | 83.4 | 47% | 0.474 | 48% | 0.483 | S | S | . | . | trans | -72.2 | -10 | -176.5 | 29 | -37.7 | 0 | 0 | 0 | 115.5 | G96 Y223 L283 | P94-G96 PolarHBondContact O-N 3.45Å; P94-Y223 HydrophobicContact CG-CD1 3.75Å; P94-Y223 HydrophobicContact CG-CE1 4.36Å; P94-L283 HydrophobicContact CG-CD1 3.81Å | ||
| 95 | E | 81.1 | Confident | 72.4 | Confident | 42 Ų | 42 | 75.1 Ų | 75.1 | 20% | 0.196 | 44% | 0.442 | C | S | . | . | trans | 51.7 | 23.5 | 176.6 | -62.8 | -67.2 | 167.1 | 0 | 0 | 115.7 | P93 Y223 F224 R225 Q226 | P93-E95 VanDerWaalsContact C-N 3.27Å; P93-E95 PolarHBondContact O-N 2.9Å; E95-Y223 WeakPolarHBondContact CA-O 3.21Å; E95-Y223 PolarHBondContact N-O 3.06Å; E95-F224 VanDerWaalsContact C-CE1 3.5Å; E95-R225 WeakPolarHBondContact OE1-CA 3.15Å; E95-R225 PolarHBondContact OE1-N 3.36Å; E95-Q226 PolarHBondContact OE1-N 2.66Å | ||
| 96 | G | 83.5 | Confident | 75.6 | Confident | 11 Ų | 11 | 66.1 Ų | 66.1 | 11% | 0.113 | 40% | 0.401 | C | S | . | . | S | Bend | trans | 165.1 | -149.1 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | P94 W98 G99 | P94-G96 PolarHBondContact O-N 3.45Å; G96-W98 PolarHBondContact O-N 3.4Å; G96-G99 PolarHBondContact O-N 2.96Å |
| 97 | G | 88.6 | Confident | 78.9 | Confident | 66 Ų | 66 | 63.5 Ų | 63.5 | 68% | 0.68 | 37% | 0.368 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.8 | -124 | -177.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | G99 W100 | G97-G99 PolarHBondContact O-N 2.6Å; G97-W100 PolarHBondContact O-N 3.44Å |
| 98 | W | 91.1 | Very high | 82.1 | Confident | 140 Ų | 140 | 57.1 Ų | 57.1 | 53% | 0.53 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -54.8 | -22.5 | 175.3 | -167.6 | -85 | 0 | 0 | 0 | 113.6 | G96 W100 L101 V102 Y223 T279 | G96-W98 PolarHBondContact O-N 3.4Å; W98-W100 PolarHBondContact O-N 2.8Å; W98-L101 HydrophobicContact CD2-CD2 4.24Å; W98-L101 HydrophobicContact CE3-CD2 4.22Å; W98-L101 HydrophobicContact CH2-CD2 3.71Å; W98-L101 HydrophobicContact CZ2-CD2 3.71Å; W98-L101 HydrophobicContact CZ3-CD2 3.97Å; W98-L101 PolarHBondContact O-N 2.83Å; W98-L101 VanDerWaalsContact O-N 3.12Å; W98-V102 PolarHBondContact O-N 3.21Å; W98-V102 VanDerWaalsContact O-N 3.17Å; W98-Y223 HydrophobicContact CB-CE1 4.32Å; W98-Y223 AromaticContact CD1-CZ 3.97Å; W98-T279 PolarHBondContact NE1-O 3.49Å |
| 99 | G | 91.5 | Very high | 85.2 | Confident | 0 Ų | 0 | 54.1 Ų | 54.1 | 0% | 0 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -52.9 | -38.8 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | G96 G97 L101 V102 V103 | G96-G99 PolarHBondContact O-N 2.96Å; G97-G99 PolarHBondContact O-N 2.6Å; G99-L101 PolarHBondContact O-N 3Å; G99-V102 CarbonylContact O-C 3.47Å; G99-V102 WeakPolarHBondContact O-CA 3.45Å; G99-V102 WeakPolarHBondContact O-CB 3.36Å; G99-V102 PolarHBondContact O-N 2.97Å; G99-V102 VanDerWaalsContact O-N 3.13Å; G99-V103 WeakPolarHBondContact O-CG2 3.33Å; G99-V103 PolarHBondContact O-N 3.42Å |
| 100 | W | 94.6 | Very high | 87.9 | Confident | 115 Ų | 115 | 47.6 Ų | 47.6 | 44% | 0.436 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -69.4 | -29.6 | 179.2 | -71.1 | 109.3 | 0 | 0 | 0 | 114 | G97 W98 V102 V103 F104 F224 V231 | G97-W100 PolarHBondContact O-N 3.44Å; W98-W100 PolarHBondContact O-N 2.8Å; W100-V102 VanDerWaalsContact C-N 3.34Å; W100-V103 HydrophobicContact CE3-CB 4.17Å; W100-V103 HydrophobicContact CE3-CG1 4.31Å; W100-V103 HydrophobicContact CE3-CG2 4.06Å; W100-V103 HydrophobicContact CZ3-CG1 4.42Å; W100-V103 HydrophobicContact CZ3-CG2 4.44Å; W100-V103 PolarHBondContact O-N 3.38Å; W100-F104 PolarHBondContact O-N 3.27Å; W100-F224 HydrophobicContact CD2-CZ 4.42Å; W100-V231 HydrophobicContact CH2-CG2 4.36Å |
| 101 | L | 95.4 | Very high | 89.8 | Confident | 67 Ų | 67 | 44.9 Ų | 44.9 | 35% | 0.351 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -69.2 | -36.7 | 170.8 | -177.7 | 61.6 | 0 | 0 | 0 | 111 | W98 G99 F104 A105 T279 | W98-L101 HydrophobicContact CD2-CD2 4.24Å; W98-L101 HydrophobicContact CE3-CD2 4.22Å; W98-L101 HydrophobicContact CH2-CD2 3.71Å; W98-L101 HydrophobicContact CZ2-CD2 3.71Å; W98-L101 HydrophobicContact CZ3-CD2 3.97Å; W98-L101 PolarHBondContact O-N 2.83Å; W98-L101 VanDerWaalsContact O-N 3.12Å; G99-L101 PolarHBondContact O-N 3Å; L101-F104 PolarHBondContact O-N 2.86Å; L101-A105 WeakPolarHBondContact O-CB 3.48Å; L101-A105 PolarHBondContact O-N 3.21Å; L101-T279 HydrophobicContact CD2-CG2 3.96Å; L101-T279 HydrophobicContact CG-CG2 4.02Å |
| 102 | V | 95.3 | Very high | 91.1 | Very high | 1 Ų | 1 | 40.8 Ų | 40.8 | 1% | 0.006 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -66.2 | -37.8 | 171.6 | 172.9 | 0 | 0 | 0 | 0 | 111.3 | W98 G99 W100 A105 A106 I219 Y223 F280 | W98-V102 PolarHBondContact O-N 3.21Å; W98-V102 VanDerWaalsContact O-N 3.17Å; G99-V102 CarbonylContact O-C 3.47Å; G99-V102 WeakPolarHBondContact O-CA 3.45Å; G99-V102 WeakPolarHBondContact O-CB 3.36Å; G99-V102 PolarHBondContact O-N 2.97Å; G99-V102 VanDerWaalsContact O-N 3.13Å; W100-V102 VanDerWaalsContact C-N 3.34Å; V102-A105 PolarHBondContact O-N 3.16Å; V102-A106 WeakPolarHBondContact O-CB 3.15Å; V102-A106 PolarHBondContact O-N 3.43Å; V102-I219 HydrophobicContact CG1-CB 4.4Å; V102-I219 HydrophobicContact CG1-CG1 3.89Å; V102-I219 HydrophobicContact CG1-CG2 3.62Å; V102-Y223 HydrophobicContact CG1-CD2 4.4Å; V102-Y223 HydrophobicContact CG1-CE2 4.45Å; V102-Y223 HydrophobicContact CG2-CE2 3.99Å; V102-F280 HydrophobicContact CG1-CD1 3.87Å; V102-F280 HydrophobicContact CG1-CE1 4.11Å; V102-F280 HydrophobicContact CG2-CD1 4.39Å |
| 103 | V | 96.3 | Very high | 92.2 | Very high | 4 Ų | 4 | 34.9 Ų | 34.9 | 2% | 0.024 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -60.6 | -46 | 170.9 | 178.9 | 0 | 0 | 0 | 0 | 110.9 | G99 W100 A106 T107 F224 V231 V234 V235 | G99-V103 WeakPolarHBondContact O-CG2 3.33Å; G99-V103 PolarHBondContact O-N 3.42Å; W100-V103 HydrophobicContact CE3-CB 4.17Å; W100-V103 HydrophobicContact CE3-CG1 4.31Å; W100-V103 HydrophobicContact CE3-CG2 4.06Å; W100-V103 HydrophobicContact CZ3-CG1 4.42Å; W100-V103 HydrophobicContact CZ3-CG2 4.44Å; W100-V103 PolarHBondContact O-N 3.38Å; V103-A106 PolarHBondContact O-N 3.18Å; V103-T107 VanDerWaalsContact O-CB 3.31Å; V103-T107 WeakPolarHBondContact O-CB 3.46Å; V103-T107 PolarHBondContact O-N 3.39Å; V103-T107 PolarHBondContact O-OG1 3.17Å; V103-F224 HydrophobicContact CG2-CE2 3.71Å; V103-F224 HydrophobicContact CG2-CZ 4.15Å; V103-V231 HydrophobicContact CG2-CB 4.44Å; V103-V231 HydrophobicContact CG2-CG1 3.5Å; V103-V231 HydrophobicContact CG2-CG2 4.18Å; V103-V234 HydrophobicContact CG1-CB 4.31Å; V103-V234 HydrophobicContact CG1-CG1 3.82Å; V103-V235 HydrophobicContact CG1-CG2 4.04Å |
| 104 | F | 96.8 | Very high | 92.9 | Very high | 113 Ų | 113 | 35.3 Ų | 35.3 | 50% | 0.496 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -60.4 | -47.2 | 176.5 | 177.1 | -97.4 | 0 | 0 | 0 | 111.9 | W100 L101 A106 T107 W108 L276 | W100-F104 PolarHBondContact O-N 3.27Å; L101-F104 PolarHBondContact O-N 2.86Å; F104-A106 PolarHBondContact O-N 3.26Å; F104-T107 WeakPolarHBondContact O-CB 3.39Å; F104-T107 PolarHBondContact O-N 3.26Å; F104-W108 PolarHBondContact O-N 3.09Å; F104-L276 HydrophobicContact CD1-CD2 4.2Å; F104-L276 HydrophobicContact CE1-CD1 4.27Å; F104-L276 HydrophobicContact CE1-CD2 4.01Å |
| 105 | A | 97.1 | Very high | 93.6 | Very high | 0 Ų | 0 | 31.9 Ų | 31.9 | 0% | 0 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -62.3 | -38.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | L101 V102 C109 Q273 L276 T279 F280 | L101-A105 WeakPolarHBondContact O-CB 3.48Å; L101-A105 PolarHBondContact O-N 3.21Å; V102-A105 PolarHBondContact O-N 3.16Å; A105-C109 WeakPolarHBondContact O-CB 3.4Å; A105-C109 PolarHBondContact O-N 3.06Å; A105-Q273 PolarHBondContact O-OE1 3.15Å; A105-L276 HydrophobicContact CB-CB 3.86Å; A105-T279 WeakPolarHBondContact CB-OG1 3.26Å; A105-F280 HydrophobicContact CB-CD1 4.42Å; A105-F280 HydrophobicContact CB-CE1 3.72Å |
| 106 | A | 96.6 | Very high | 94.1 | Very high | 0 Ų | 0 | 29.9 Ų | 29.9 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -71.4 | -37.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | V102 V103 F104 W108 C109 N110 S216 L220 V235 | V102-A106 WeakPolarHBondContact O-CB 3.15Å; V102-A106 PolarHBondContact O-N 3.43Å; V103-A106 PolarHBondContact O-N 3.18Å; F104-A106 PolarHBondContact O-N 3.26Å; A106-W108 VanDerWaalsContact C-N 3.34Å; A106-W108 PolarHBondContact O-N 3.5Å; A106-C109 WeakPolarHBondContact O-CB 3.19Å; A106-C109 PolarHBondContact O-N 2.94Å; A106-N110 WeakPolarHBondContact O-CB 3.39Å; A106-N110 PolarHBondContact O-N 2.92Å; A106-S216 WeakPolarHBondContact CB-O 3.44Å; A106-L220 HydrophobicContact CB-CD2 3.98Å; A106-V235 HydrophobicContact CB-CG1 3.98Å; A106-V235 HydrophobicContact CB-CG2 3.74Å |
| 107 | T | 97.1 | Very high | 94.5 | Very high | 26 Ų | 26 | 30 Ų | 30 | 16% | 0.16 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -61.5 | -41 | 173.7 | -53.6 | 0 | 0 | 0 | 0 | 111.1 | V103 F104 G111 | V103-T107 VanDerWaalsContact O-CB 3.31Å; V103-T107 WeakPolarHBondContact O-CB 3.46Å; V103-T107 PolarHBondContact O-N 3.39Å; V103-T107 PolarHBondContact O-OG1 3.17Å; F104-T107 WeakPolarHBondContact O-CB 3.39Å; F104-T107 PolarHBondContact O-N 3.26Å; T107-G111 WeakPolarHBondContact O-CA 3.33Å; T107-G111 PolarHBondContact O-N 3.25Å |
| 108 | W | 97.6 | Very high | 94.4 | Very high | 56 Ų | 56 | 31.1 Ų | 31.1 | 21% | 0.212 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -65.2 | -45.3 | 172.3 | -175.9 | -82.8 | 0 | 0 | 0 | 111.7 | F104 A106 N110 G111 S112 F242 F269 V272 L276 | F104-W108 PolarHBondContact O-N 3.09Å; A106-W108 VanDerWaalsContact C-N 3.34Å; A106-W108 PolarHBondContact O-N 3.5Å; W108-N110 PolarHBondContact O-N 3.02Å; W108-G111 PolarHBondContact O-N 3.39Å; W108-S112 WeakPolarHBondContact O-CB 3.42Å; W108-S112 PolarHBondContact O-N 3.48Å; W108-S112 PolarHBondContact O-OG 3.27Å; W108-F242 HydrophobicContact CD2-CZ 4.29Å; W108-F242 HydrophobicContact CE3-CE1 4.42Å; W108-F242 AromaticContact CE3-CZ 3.75Å; W108-F242 HydrophobicContact CE3-CZ 3.75Å; W108-F242 HydrophobicContact CH2-CZ 4.46Å; W108-F242 HydrophobicContact CZ3-CE1 4.35Å; W108-F242 AromaticContact CZ3-CZ 3.85Å; W108-F242 HydrophobicContact CZ3-CZ 3.85Å; W108-F269 HydrophobicContact CH2-CD1 4.31Å; W108-F269 HydrophobicContact CH2-CE1 4.45Å; W108-F269 HydrophobicContact CZ2-CB 4.32Å; W108-F269 AromaticContact CZ2-CD1 3.9Å; W108-F269 HydrophobicContact CZ2-CD1 3.9Å; W108-F269 HydrophobicContact CZ2-CE1 4.48Å; W108-F269 HydrophobicContact CZ2-CG 4.12Å; W108-F269 PolarHBondContact NE1-O 3.35Å; W108-V272 HydrophobicContact CD2-CG1 4.2Å; W108-V272 HydrophobicContact CH2-CG1 4.44Å; W108-V272 HydrophobicContact CZ2-CB 4.04Å; W108-V272 HydrophobicContact CZ2-CG1 3.75Å; W108-L276 HydrophobicContact CB-CD1 3.59Å; W108-L276 HydrophobicContact CD2-CD1 4.05Å; W108-L276 HydrophobicContact CG-CD1 3.47Å; W108-L276 VanDerWaalsContact CG-CD1 3.47Å |
| 109 | C | 96.9 | Very high | 94.2 | Very high | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -54.8 | -52.7 | 178 | -169 | 0 | 0 | 0 | 0 | 112.4 | A105 A106 S112 I113 A212 Q273 | A105-C109 WeakPolarHBondContact O-CB 3.4Å; A105-C109 PolarHBondContact O-N 3.06Å; A106-C109 WeakPolarHBondContact O-CB 3.19Å; A106-C109 PolarHBondContact O-N 2.94Å; C109-S112 PolarHBondContact O-OG 2.98Å; C109-I113 WeakPolarHBondContact O-CB 3.49Å; C109-I113 WeakPolarHBondContact O-CD1 3.34Å; C109-I113 VanDerWaalsContact O-CG1 3.25Å; C109-I113 WeakPolarHBondContact O-CG1 3.43Å; C109-I113 PolarHBondContact O-N 3.44Å; C109-A212 VanDerWaalsContact SG-C 3.57Å; C109-A212 PolarHBondContact SG-O 3.24Å; C109-A212 VanDerWaalsContact SG-O 3.39Å; C109-Q273 VanDerWaalsContact CA-OE1 3.26Å; C109-Q273 HydrophobicContact CB-CG 4.22Å; C109-Q273 VanDerWaalsContact CB-NE2 3.32Å; C109-Q273 PolarHBondContact SG-NE2 3.18Å; C109-Q273 VanDerWaalsContact SG-NE2 3.39Å |
| 110 | N | 95.4 | Very high | 93.9 | Very high | 4 Ų | 4 | 25.5 Ų | 25.5 | 2% | 0.021 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -71 | -35.4 | -178.8 | -170.6 | 64.5 | 0 | 0 | 0 | 111.4 | A106 W108 F114 F213 V235 T236 A239 | A106-N110 WeakPolarHBondContact O-CB 3.39Å; A106-N110 PolarHBondContact O-N 2.92Å; W108-N110 PolarHBondContact O-N 3.02Å; N110-F114 WeakPolarHBondContact O-CD2 3.27Å; N110-F114 PolarHBondContact O-N 2.67Å; N110-F114 VanDerWaalsContact OD1-CD2 3.26Å; N110-F114 WeakPolarHBondContact OD1-CD2 3.47Å; N110-F114 VanDerWaalsContact OD1-CE2 3.25Å; N110-F114 WeakPolarHBondContact OD1-CE2 3.4Å; N110-F213 VanDerWaalsContact OD1-CE2 3.3Å; N110-F213 WeakPolarHBondContact OD1-CE2 3.31Å; N110-V235 HydrophobicContact CB-CG1 3.93Å; N110-V235 PolarHBondContact ND2-O 3.42Å; N110-T236 WeakPolarHBondContact ND2-CA 3.1Å; N110-A239 VanDerWaalsContact ND2-CB 3.32Å; N110-A239 WeakPolarHBondContact ND2-CB 3.41Å |
| 111 | G | 95.1 | Very high | 93.2 | Very high | 0 Ų | 0 | 22.4 Ų | 22.4 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -60.5 | -56 | 173 | 0 | 0 | 0 | 0 | 0 | 113.2 | T107 W108 G115 F242 | T107-G111 WeakPolarHBondContact O-CA 3.33Å; T107-G111 PolarHBondContact O-N 3.25Å; W108-G111 PolarHBondContact O-N 3.39Å; G111-G115 VanDerWaalsContact O-CA 3.31Å; G111-G115 WeakPolarHBondContact O-CA 2.79Å; G111-G115 PolarHBondContact O-N 3.15Å; G111-F242 VanDerWaalsContact C-CD1 3.45Å; G111-F242 VanDerWaalsContact C-CG 3.48Å; G111-F242 WeakPolarHBondContact O-CB 3.12Å; G111-F242 WeakPolarHBondContact O-CD1 3.49Å; G111-F242 WeakPolarHBondContact O-CG 3.29Å |
| 112 | S | 95.6 | Very high | 92.7 | Very high | 0 Ų | 0 | 21 Ų | 21 | 0% | 0 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -66.1 | -44.9 | -176.1 | 64.8 | 0 | 0 | 0 | 0 | 112.3 | W108 C109 I116 | W108-S112 WeakPolarHBondContact O-CB 3.42Å; W108-S112 PolarHBondContact O-N 3.48Å; W108-S112 PolarHBondContact O-OG 3.27Å; C109-S112 PolarHBondContact O-OG 2.98Å; S112-I116 WeakPolarHBondContact O-CB 3.49Å; S112-I116 WeakPolarHBondContact O-CD1 3.43Å; S112-I116 WeakPolarHBondContact O-CG1 3.46Å; S112-I116 PolarHBondContact O-N 3.28Å |
| 113 | I | 95.6 | Very high | 92.2 | Very high | 0 Ų | 0 | 21 Ų | 21 | 0% | 0 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -63.5 | -55.9 | -177.1 | -67.7 | 169.1 | 0 | 0 | 0 | 110.9 | C109 I116 Q117 I154 S209 A212 F213 M270 | C109-I113 WeakPolarHBondContact O-CB 3.49Å; C109-I113 WeakPolarHBondContact O-CD1 3.34Å; C109-I113 VanDerWaalsContact O-CG1 3.25Å; C109-I113 WeakPolarHBondContact O-CG1 3.43Å; C109-I113 PolarHBondContact O-N 3.44Å; I113-I116 PolarHBondContact O-N 3.5Å; I113-Q117 WeakPolarHBondContact O-CB 3.02Å; I113-Q117 PolarHBondContact O-N 3.03Å; I113-Q117 VanDerWaalsContact O-N 3.07Å; I113-I154 HydrophobicContact CG2-CD1 3.74Å; I113-I154 HydrophobicContact CG2-CG1 4.46Å; I113-S209 WeakPolarHBondContact CD1-O 3.43Å; I113-A212 HydrophobicContact CD1-CB 4.16Å; I113-F213 HydrophobicContact CD1-CB 3.97Å; I113-M270 HydrophobicContact CD1-CE 4.14Å; I113-M270 HydrophobicContact CG1-CE 3.74Å; I113-M270 HydrophobicContact CG1-SD 4.21Å |
| 114 | F | 92.2 | Very high | 91.6 | Very high | 24 Ų | 24 | 22.6 Ų | 22.6 | 11% | 0.105 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -74.1 | -29.3 | -179.6 | -71 | -67.6 | 0 | 0 | 0 | 112.8 | N110 Q117 N118 M151 F155 F213 A239 | N110-F114 WeakPolarHBondContact O-CD2 3.27Å; N110-F114 PolarHBondContact O-N 2.67Å; N110-F114 VanDerWaalsContact OD1-CD2 3.26Å; N110-F114 WeakPolarHBondContact OD1-CD2 3.47Å; N110-F114 VanDerWaalsContact OD1-CE2 3.25Å; N110-F114 WeakPolarHBondContact OD1-CE2 3.4Å; F114-Q117 PolarHBondContact O-N 3.37Å; F114-N118 VanDerWaalsContact O-CB 3.23Å; F114-N118 WeakPolarHBondContact O-CB 3.24Å; F114-N118 PolarHBondContact O-N 2.93Å; F114-N118 PolarHBondContact O-ND2 3.39Å; F114-M151 HydrophobicContact CD1-CE 4.38Å; F114-M151 HydrophobicContact CE1-CE 4.14Å; F114-M151 HydrophobicContact CE1-SD 4.22Å; F114-F155 AromaticContact CE1-CE2 3.99Å; F114-F155 HydrophobicContact CE1-CE2 3.99Å; F114-F155 AromaticContact CE1-CZ 3.76Å; F114-F155 HydrophobicContact CE1-CZ 3.76Å; F114-F155 HydrophobicContact CZ-CE1 4.49Å; F114-F155 HydrophobicContact CZ-CE2 4.29Å; F114-F155 AromaticContact CZ-CZ 3.7Å; F114-F155 HydrophobicContact CZ-CZ 3.7Å; F114-F213 HydrophobicContact CE2-CD2 4.12Å; F114-F213 HydrophobicContact CE2-CE1 4.37Å; F114-F213 AromaticContact CE2-CE2 3.72Å; F114-F213 HydrophobicContact CE2-CE2 3.72Å; F114-F213 AromaticContact CE2-CZ 3.84Å; F114-F213 HydrophobicContact CE2-CZ 3.84Å; F114-F213 HydrophobicContact CZ-CE1 4.21Å; F114-F213 HydrophobicContact CZ-CE2 4.36Å; F114-F213 HydrophobicContact CZ-CZ 4.04Å; F114-A239 HydrophobicContact CB-CB 3.88Å; F114-A239 HydrophobicContact CD2-CB 4.26Å; F114-A239 HydrophobicContact CG-CB 4.42Å |
| 115 | G | 92.3 | Very high | 91 | Very high | 0 Ų | 0 | 20.5 Ų | 20.5 | 0% | 0 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -58.4 | -52 | 170.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | G111 Q117 S119 L246 | G111-G115 VanDerWaalsContact O-CA 3.31Å; G111-G115 WeakPolarHBondContact O-CA 2.79Å; G111-G115 PolarHBondContact O-N 3.15Å; G115-Q117 VanDerWaalsContact C-N 3.33Å; G115-Q117 PolarHBondContact O-N 2.96Å; G115-S119 VanDerWaalsContact O-CB 3.26Å; G115-S119 WeakPolarHBondContact O-CB 3.32Å; G115-S119 PolarHBondContact O-N 3.43Å; G115-S119 PolarHBondContact O-OG 2.98Å; G115-L246 VanDerWaalsContact C-CD2 3.49Å |
| 116 | I | 92.5 | Very high | 90.4 | Very high | 0 Ų | 0 | 21.2 Ų | 21.2 | 0% | 0 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -58.9 | -47.1 | 176.8 | -72.9 | 166.6 | 0 | 0 | 0 | 110.4 | S112 I113 S119 F120 L185 Y201 F205 L246 L266 M270 | S112-I116 WeakPolarHBondContact O-CB 3.49Å; S112-I116 WeakPolarHBondContact O-CD1 3.43Å; S112-I116 WeakPolarHBondContact O-CG1 3.46Å; S112-I116 PolarHBondContact O-N 3.28Å; I113-I116 PolarHBondContact O-N 3.5Å; I116-S119 PolarHBondContact O-N 3.49Å; I116-F120 PolarHBondContact O-N 3.21Å; I116-L185 HydrophobicContact CD1-CD1 4.05Å; I116-Y201 HydrophobicContact CG2-CE2 4.39Å; I116-Y201 WeakPolarHBondContact CG2-OH 3.44Å; I116-F205 HydrophobicContact CB-CZ 4.28Å; I116-F205 HydrophobicContact CD1-CE2 4.43Å; I116-F205 HydrophobicContact CD1-CZ 4.38Å; I116-F205 HydrophobicContact CG2-CE1 4.04Å; I116-F205 HydrophobicContact CG2-CZ 3.72Å; I116-L246 HydrophobicContact CG1-CD2 3.85Å; I116-L266 HydrophobicContact CD1-CB 4.17Å; I116-L266 HydrophobicContact CD1-CD2 4.45Å; I116-L266 HydrophobicContact CG1-CB 4.44Å; I116-L266 HydrophobicContact CG1-CD1 4.28Å; I116-L266 HydrophobicContact CG1-CD2 3.98Å; I116-L266 HydrophobicContact CG1-CG 4.45Å; I116-L266 HydrophobicContact CG2-CD1 4.34Å; I116-M270 HydrophobicContact CD1-SD 4.44Å |
| 117 | Q | 90.9 | Very high | 89.7 | Confident | 15 Ų | 15 | 21.2 Ų | 21.2 | 7% | 0.07 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -69.1 | -36.7 | -174.6 | -170.9 | 55.9 | 69.4 | 0 | 0 | 113.6 | I113 F114 G115 F120 G147 M151 | I113-Q117 WeakPolarHBondContact O-CB 3.02Å; I113-Q117 PolarHBondContact O-N 3.03Å; I113-Q117 VanDerWaalsContact O-N 3.07Å; F114-Q117 PolarHBondContact O-N 3.37Å; G115-Q117 VanDerWaalsContact C-N 3.33Å; G115-Q117 PolarHBondContact O-N 2.96Å; Q117-F120 VanDerWaalsContact O-CB 3.23Å; Q117-F120 WeakPolarHBondContact O-CB 3.14Å; Q117-F120 PolarHBondContact O-N 3.15Å; Q117-G147 PolarHBondContact NE2-O 3.29Å; Q117-M151 HydrophobicContact CG-CB 3.94Å; Q117-M151 HydrophobicContact CG-CG 4.21Å; Q117-M151 HydrophobicContact CG-SD 3.51Å; Q117-M151 VanDerWaalsContact CG-SD 3.51Å |
| 118 | N | 86.6 | Confident | 89.1 | Confident | 88 Ų | 88 | 20.7 Ų | 20.7 | 47% | 0.471 | 12% | 0.117 | S | C | . | . | H | α-helix | trans | -77.2 | -26.9 | 174.5 | -67 | -22 | 0 | 0 | 0 | 111.9 | F114 F120 S243 | F114-N118 VanDerWaalsContact O-CB 3.23Å; F114-N118 WeakPolarHBondContact O-CB 3.24Å; F114-N118 PolarHBondContact O-N 2.93Å; F114-N118 PolarHBondContact O-ND2 3.39Å; N118-F120 PolarHBondContact O-N 3.04Å; N118-S243 PolarHBondContact ND2-OG 3.5Å |
| 119 | S | 87.6 | Confident | 88.3 | Confident | 2 Ų | 2 | 25.5 Ų | 25.5 | 1% | 0.014 | 14% | 0.139 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -72.8 | -0.5 | 170.8 | -54.4 | 0 | 0 | 0 | 0 | 113.5 | G115 I116 G121 I122 L123 P247 L250 | G115-S119 VanDerWaalsContact O-CB 3.26Å; G115-S119 WeakPolarHBondContact O-CB 3.32Å; G115-S119 PolarHBondContact O-N 3.43Å; G115-S119 PolarHBondContact O-OG 2.98Å; I116-S119 PolarHBondContact O-N 3.49Å; S119-G121 PolarHBondContact O-N 3.07Å; S119-G121 VanDerWaalsContact O-N 3.1Å; S119-I122 PolarHBondContact O-N 2.94Å; S119-I122 VanDerWaalsContact O-N 3.11Å; S119-L123 PolarHBondContact O-N 3.45Å; S119-P247 WeakPolarHBondContact OG-CD 3.41Å; S119-P247 WeakPolarHBondContact OG-CG 3.42Å; S119-L250 VanDerWaalsContact CB-CD1 3.43Å |
| 120 | F | 84.5 | Confident | 87.4 | Confident | 21 Ų | 21 | 29.7 Ų | 29.7 | 9% | 0.092 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -62 | -20.3 | -175.4 | -173.3 | -97.3 | 0 | 0 | 0 | 113.9 | I116 Q117 N118 I122 L123 H124 L127 V146 Y201 | I116-F120 PolarHBondContact O-N 3.21Å; Q117-F120 VanDerWaalsContact O-CB 3.23Å; Q117-F120 WeakPolarHBondContact O-CB 3.14Å; Q117-F120 PolarHBondContact O-N 3.15Å; N118-F120 PolarHBondContact O-N 3.04Å; F120-I122 VanDerWaalsContact C-N 3.31Å; F120-I122 PolarHBondContact O-N 3.43Å; F120-L123 HydrophobicContact CD2-CB 3.96Å; F120-L123 HydrophobicContact CD2-CD1 4.26Å; F120-L123 HydrophobicContact CE2-CB 4.28Å; F120-L123 PolarHBondContact O-N 3.03Å; F120-H124 HydrophobicContact CD1-CB 4.19Å; F120-H124 HydrophobicContact CE1-CB 3.77Å; F120-H124 HydrophobicContact CZ-CB 4.19Å; F120-H124 VanDerWaalsContact O-CB 3.22Å; F120-H124 WeakPolarHBondContact O-CB 3.47Å; F120-H124 PolarHBondContact O-N 3.18Å; F120-L127 HydrophobicContact CE2-CD1 3.82Å; F120-L127 HydrophobicContact CZ-CD1 3.89Å; F120-V146 HydrophobicContact CE2-CB 4.31Å; F120-V146 HydrophobicContact CE2-CG1 4.26Å; F120-V146 HydrophobicContact CZ-CB 3.99Å; F120-V146 HydrophobicContact CZ-CG1 4.43Å; F120-Y201 AromaticContact CD2-CE1 3.9Å; F120-Y201 HydrophobicContact CD2-CE1 3.9Å; F120-Y201 AromaticContact CD2-CZ 3.96Å; F120-Y201 HydrophobicContact CE2-CE1 4.05Å |
| 121 | G | 80.6 | Confident | 86.1 | Confident | 50 Ų | 50 | 32.2 Ų | 32.2 | 52% | 0.515 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -60.5 | -36.7 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | S119 T125 | S119-G121 PolarHBondContact O-N 3.07Å; S119-G121 VanDerWaalsContact O-N 3.1Å; G121-T125 PolarHBondContact O-N 3.42Å; G121-T125 VanDerWaalsContact O-N 3.14Å; G121-T125 PolarHBondContact O-OG1 2.87Å |
| 122 | I | 83.9 | Confident | 84.5 | Confident | 38 Ų | 38 | 33.8 Ų | 33.8 | 20% | 0.195 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -74.5 | -45.4 | 176 | -59.2 | 174.2 | 0 | 0 | 0 | 109.6 | S119 F120 H124 T125 M126 P247 L250 D251 D255 | S119-I122 PolarHBondContact O-N 2.94Å; S119-I122 VanDerWaalsContact O-N 3.11Å; F120-I122 VanDerWaalsContact C-N 3.31Å; F120-I122 PolarHBondContact O-N 3.43Å; I122-H124 VanDerWaalsContact C-N 3.3Å; I122-H124 PolarHBondContact O-N 3.29Å; I122-T125 WeakPolarHBondContact O-CB 3.34Å; I122-T125 PolarHBondContact O-N 3.17Å; I122-T125 VanDerWaalsContact O-N 3.1Å; I122-M126 HydrophobicContact CG2-CE 4.12Å; I122-M126 PolarHBondContact O-N 3.35Å; I122-P247 HydrophobicContact CD1-CB 3.74Å; I122-P247 WeakPolarHBondContact CD1-O 3.2Å; I122-L250 HydrophobicContact CD1-CB 4.35Å; I122-L250 HydrophobicContact CG2-CB 4.44Å; I122-D251 HydrophobicContact CD1-CB 4.29Å; I122-D255 WeakPolarHBondContact CG2-OD1 3.36Å |
| 123 | L | 85.4 | Confident | 82.8 | Confident | 0 Ų | 0 | 40.3 Ų | 40.3 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -58.5 | -40.5 | 175.4 | -68.9 | 166.5 | 0 | 0 | 0 | 112 | S119 F120 M126 L127 Y201 L259 T262 F263 L266 | S119-L123 PolarHBondContact O-N 3.45Å; F120-L123 HydrophobicContact CD2-CB 3.96Å; F120-L123 HydrophobicContact CD2-CD1 4.26Å; F120-L123 HydrophobicContact CE2-CB 4.28Å; F120-L123 PolarHBondContact O-N 3.03Å; L123-M126 HydrophobicContact CD2-SD 4.45Å; L123-M126 PolarHBondContact O-N 3.07Å; L123-L127 VanDerWaalsContact O-CB 3.31Å; L123-L127 WeakPolarHBondContact O-CB 3.23Å; L123-L127 WeakPolarHBondContact O-CD1 3.43Å; L123-L127 WeakPolarHBondContact O-CG 3.26Å; L123-L127 PolarHBondContact O-N 2.88Å; L123-Y201 HydrophobicContact CD1-CE2 4.46Å; L123-L259 HydrophobicContact CD2-CD1 4.42Å; L123-T262 HydrophobicContact CD2-CG2 3.61Å; L123-F263 HydrophobicContact CD2-CE1 4.01Å; L123-F263 HydrophobicContact CD2-CZ 4.3Å; L123-L266 HydrophobicContact CD1-CD1 4.03Å; L123-L266 HydrophobicContact CD2-CD1 4.24Å |
| 124 | H | 84.2 | Confident | 81 | Confident | 37 Ų | 37 | 45.6 Ų | 45.6 | 17% | 0.171 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -60 | -48 | 173.2 | 177.3 | -87.4 | 0 | 0 | 0 | 110.9 | F120 I122 M126 L127 V128 Q140 A144 | F120-H124 HydrophobicContact CD1-CB 4.19Å; F120-H124 HydrophobicContact CE1-CB 3.77Å; F120-H124 HydrophobicContact CZ-CB 4.19Å; F120-H124 VanDerWaalsContact O-CB 3.22Å; F120-H124 WeakPolarHBondContact O-CB 3.47Å; F120-H124 PolarHBondContact O-N 3.18Å; I122-H124 VanDerWaalsContact C-N 3.3Å; I122-H124 PolarHBondContact O-N 3.29Å; H124-M126 VanDerWaalsContact C-N 3.31Å; H124-M126 PolarHBondContact O-N 3.08Å; H124-L127 WeakPolarHBondContact O-CB 3.43Å; H124-L127 PolarHBondContact O-N 3.42Å; H124-L127 VanDerWaalsContact O-N 3.13Å; H124-V128 WeakPolarHBondContact O-CB 3.45Å; H124-V128 VanDerWaalsContact O-CG2 3.29Å; H124-V128 WeakPolarHBondContact O-CG2 3.31Å; H124-V128 PolarHBondContact O-N 3.2Å; H124-Q140 PolarHBondContact CE1-OE1 2.53Å; H124-Q140 PolarHBondContact NE2-O 3.27Å; H124-Q140 VanDerWaalsContact NE2-O 3.1Å; H124-A144 PolarHBondContact CD2-N 3.08Å |
| 125 | T | 83.5 | Confident | 79.3 | Confident | 69 Ų | 69 | 53.3 Ų | 53.3 | 42% | 0.423 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -59.6 | -38.6 | 176.6 | -55 | 0 | 0 | 0 | 0 | 112.3 | G121 I122 K129 | G121-T125 PolarHBondContact O-N 3.42Å; G121-T125 VanDerWaalsContact O-N 3.14Å; G121-T125 PolarHBondContact O-OG1 2.87Å; I122-T125 WeakPolarHBondContact O-CB 3.34Å; I122-T125 PolarHBondContact O-N 3.17Å; I122-T125 VanDerWaalsContact O-N 3.1Å; T125-K129 WeakPolarHBondContact O-CD 3.31Å; T125-K129 VanDerWaalsContact O-CG 3.28Å; T125-K129 WeakPolarHBondContact O-CG 3.05Å; T125-K129 PolarHBondContact O-N 2.62Å |
| 126 | M | 83.4 | Confident | 78.1 | Confident | 15 Ų | 15 | 56 Ų | 56 | 7% | 0.074 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -67.2 | -47.2 | 171.4 | -64 | -178.1 | -174 | 0 | 0 | 112.5 | I122 L123 H124 V128 K129 E130 D255 L259 T262 | I122-M126 HydrophobicContact CG2-CE 4.12Å; I122-M126 PolarHBondContact O-N 3.35Å; L123-M126 HydrophobicContact CD2-SD 4.45Å; L123-M126 PolarHBondContact O-N 3.07Å; H124-M126 VanDerWaalsContact C-N 3.31Å; H124-M126 PolarHBondContact O-N 3.08Å; M126-V128 VanDerWaalsContact C-N 3.29Å; M126-V128 PolarHBondContact O-N 3.41Å; M126-K129 WeakPolarHBondContact O-CB 3.22Å; M126-K129 PolarHBondContact O-N 3.06Å; M126-E130 PolarHBondContact O-N 3.47Å; M126-D255 HydrophobicContact CE-CB 4.2Å; M126-D255 WeakPolarHBondContact CE-OD1 3.48Å; M126-L259 HydrophobicContact CB-CD1 3.76Å; M126-L259 HydrophobicContact CG-CD1 4.46Å; M126-L259 HydrophobicContact SD-CB 4.49Å; M126-L259 HydrophobicContact SD-CD1 3.74Å; M126-T262 HydrophobicContact CE-CG2 3.94Å; M126-T262 HydrophobicContact SD-CG2 4.07Å |
| 127 | L | 83.5 | Confident | 76.7 | Confident | 0 Ų | 0 | 64.1 Ų | 64.1 | 0% | 0 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -59.6 | -39.7 | -178.7 | -75.9 | 162.4 | 0 | 0 | 0 | 111.5 | F120 L123 H124 E130 H131 V143 R197 L259 F263 | F120-L127 HydrophobicContact CE2-CD1 3.82Å; F120-L127 HydrophobicContact CZ-CD1 3.89Å; L123-L127 VanDerWaalsContact O-CB 3.31Å; L123-L127 WeakPolarHBondContact O-CB 3.23Å; L123-L127 WeakPolarHBondContact O-CD1 3.43Å; L123-L127 WeakPolarHBondContact O-CG 3.26Å; L123-L127 PolarHBondContact O-N 2.88Å; H124-L127 WeakPolarHBondContact O-CB 3.43Å; H124-L127 PolarHBondContact O-N 3.42Å; H124-L127 VanDerWaalsContact O-N 3.13Å; L127-E130 PolarHBondContact O-N 3.09Å; L127-H131 WeakPolarHBondContact O-CB 3.44Å; L127-H131 PolarHBondContact O-N 3.23Å; L127-H131 VanDerWaalsContact O-N 3.09Å; L127-V143 HydrophobicContact CB-CG1 3.33Å; L127-V143 HydrophobicContact CD1-CG1 3.95Å; L127-V143 HydrophobicContact CG-CG1 4.23Å; L127-R197 VanDerWaalsContact CD2-NH1 3.34Å; L127-L259 HydrophobicContact CD2-CD1 4.45Å; L127-L259 HydrophobicContact CD2-CD2 3.73Å; L127-L259 HydrophobicContact CG-CD1 4.32Å; L127-L259 HydrophobicContact CG-CD2 4.28Å; L127-F263 HydrophobicContact CD2-CE2 4.47Å; L127-F263 HydrophobicContact CD2-CZ 4.47Å |
| 128 | V | 83.3 | Confident | 75.4 | Confident | 16 Ų | 16 | 67.4 Ų | 67.4 | 10% | 0.097 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -62.6 | -48.9 | 174.5 | 166.9 | 0 | 0 | 0 | 0 | 111.2 | H124 M126 E130 H131 T132 Q140 V143 | H124-V128 WeakPolarHBondContact O-CB 3.45Å; H124-V128 VanDerWaalsContact O-CG2 3.29Å; H124-V128 WeakPolarHBondContact O-CG2 3.31Å; H124-V128 PolarHBondContact O-N 3.2Å; M126-V128 VanDerWaalsContact C-N 3.29Å; M126-V128 PolarHBondContact O-N 3.41Å; V128-E130 PolarHBondContact O-N 3.31Å; V128-E130 VanDerWaalsContact O-N 3.15Å; V128-H131 PolarHBondContact O-N 3.48Å; V128-T132 PolarHBondContact O-N 3.32Å; V128-T132 VanDerWaalsContact O-N 3.11Å; V128-Q140 VanDerWaalsContact CG2-OE1 3.26Å; V128-V143 HydrophobicContact CG2-CB 4.18Å; V128-V143 HydrophobicContact CG2-CG1 4.14Å; V128-V143 HydrophobicContact CG2-CG2 4.26Å |
| 129 | K | 81.1 | Confident | 74.6 | Confident | 156 Ų | 156 | 64 Ų | 64 | 68% | 0.678 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -58.8 | -25.1 | 178.2 | -72.2 | 166.9 | -178.8 | 172.1 | 0 | 113.6 | T125 M126 | T125-K129 WeakPolarHBondContact O-CD 3.31Å; T125-K129 VanDerWaalsContact O-CG 3.28Å; T125-K129 WeakPolarHBondContact O-CG 3.05Å; T125-K129 PolarHBondContact O-N 2.62Å; M126-K129 WeakPolarHBondContact O-CB 3.22Å; M126-K129 PolarHBondContact O-N 3.06Å |
| 130 | E | 77.3 | Confident | 73.8 | Confident | 89 Ų | 89 | 67.3 Ų | 67.3 | 42% | 0.416 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -94.5 | -28.8 | -178.6 | -163.2 | -176.6 | 98 | 0 | 0 | 113.5 | M126 L127 V128 R197 L259 | M126-E130 PolarHBondContact O-N 3.47Å; L127-E130 PolarHBondContact O-N 3.09Å; V128-E130 PolarHBondContact O-N 3.31Å; V128-E130 VanDerWaalsContact O-N 3.15Å; E130-R197 IonicContact OE1-CZ 3.82Å; E130-R197 IonicContact OE1-NH1 2.83Å; E130-R197 PolarHBondContact OE1-NH1 3.46Å; E130-R197 IonicContact OE1-NH2 2.82Å; E130-R197 PolarHBondContact OE1-NH2 2.88Å; E130-L259 WeakPolarHBondContact OE2-CB 3.48Å; E130-L259 WeakPolarHBondContact OE2-CD2 3.39Å |
| 131 | H | 69.1 | Low | 73.5 | Confident | 56 Ų | 56 | 72.5 Ų | 72.5 | 26% | 0.259 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -119.2 | 5.6 | -169.1 | -83.7 | 84.6 | 0 | 0 | 0 | 115.9 | L127 V128 N192 L194 R197 | L127-H131 WeakPolarHBondContact O-CB 3.44Å; L127-H131 PolarHBondContact O-N 3.23Å; L127-H131 VanDerWaalsContact O-N 3.09Å; V128-H131 PolarHBondContact O-N 3.48Å; H131-N192 PolarHBondContact NE2-O 2.98Å; H131-L194 HydrophobicContact CB-CD1 4.44Å; H131-L194 HydrophobicContact CB-CD2 3.99Å; H131-L194 HydrophobicContact CB-CG 4.3Å; H131-R197 PolarHBondContact CE1-NH1 3.41Å; H131-R197 PolarHBondContact ND1-NH1 3.39Å |
| 132 | T | 61.7 | Low | 73.5 | Confident | 34 Ų | 34 | 73.7 Ų | 73.7 | 21% | 0.209 | 37% | 0.372 | C | S | . | . | trans | -154 | 141.3 | -179.6 | -39.1 | 0 | 0 | 0 | 0 | 114.2 | V128 D136 | V128-T132 PolarHBondContact O-N 3.32Å; V128-T132 VanDerWaalsContact O-N 3.11Å; T132-D136 HydrophobicContact CG2-CB 4.14Å | ||
| 133 | D | 59.7 | Low | 73.5 | Confident | 136 Ų | 136 | 71.9 Ų | 71.9 | 73% | 0.727 | 36% | 0.362 | S | S | * | . | trans | -58.6 | 135.1 | 156 | -63.5 | -67.5 | 0 | 0 | 0 | 110.3 | E135 D136 | D133-E135 PolarHBondContact O-N 3.18Å; D133-D136 PolarHBondContact O-N 3.06Å | ||
| 134 | P | 57.1 | Low | 73.5 | Confident | 111 Ų | 111 | 73.8 Ų | 73.8 | 72% | 0.721 | 38% | 0.378 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.6 | -8.3 | -164.5 | 23.8 | -34.3 | 0 | 0 | 0 | 116.2 | ||
| 135 | E | 57.1 | Low | 73.6 | Confident | 187 Ų | 187 | 77.7 Ų | 77.7 | 87% | 0.874 | 39% | 0.391 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.6 | -14.2 | -175.5 | -59.4 | -169.5 | 150.4 | 0 | 0 | 114.8 | D133 Q137 | D133-E135 PolarHBondContact O-N 3.18Å; E135-Q137 PolarHBondContact O-N 3.04Å |
| 136 | D | 67.6 | Low | 73.8 | Confident | 57 Ų | 57 | 74.4 Ų | 74.4 | 31% | 0.305 | 37% | 0.371 | S | S | . | . | trans | -85.4 | 96.5 | -179.7 | 179.5 | 31 | 0 | 0 | 0 | 113.7 | T132 D133 T138 S139 Q140 K142 | T132-D136 HydrophobicContact CG2-CB 4.14Å; D133-D136 PolarHBondContact O-N 3.06Å; D136-T138 PolarHBondContact O-N 3.26Å; D136-T138 WeakPolarHBondContact OD1-CA 3.49Å; D136-T138 WeakPolarHBondContact OD1-CB 3.45Å; D136-T138 PolarHBondContact OD1-N 3.47Å; D136-T138 PolarHBondContact OD1-OG1 3.07Å; D136-S139 PolarHBondContact O-N 3.39Å; D136-S139 VanDerWaalsContact OD2-CB 3.22Å; D136-S139 WeakPolarHBondContact OD2-CB 3.47Å; D136-S139 PolarHBondContact OD2-N 3.15Å; D136-S139 VanDerWaalsContact OD2-N 3.17Å; D136-S139 PolarHBondContact OD2-OG 3.31Å; D136-Q140 PolarHBondContact O-N 3.13Å; D136-K142 IonicContact OD2-NZ 2.66Å | ||
| 137 | Q | 63.1 | Low | 73.9 | Confident | 169 Ų | 169 | 73.8 Ų | 73.8 | 79% | 0.79 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -53 | -33.2 | 170.2 | -71.2 | -169.4 | -17 | 0 | 0 | 113.4 | E135 S139 Q140 F141 | E135-Q137 PolarHBondContact O-N 3.04Å; Q137-S139 PolarHBondContact O-N 2.98Å; Q137-Q140 PolarHBondContact O-N 3.28Å; Q137-F141 PolarHBondContact O-N 3.4Å |
| 138 | T | 62.3 | Low | 74.1 | Confident | 85 Ų | 85 | 76.3 Ų | 76.3 | 52% | 0.521 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -61.4 | -30.3 | -179.5 | -31 | 0 | 0 | 0 | 0 | 111.4 | D136 K142 | D136-T138 PolarHBondContact O-N 3.26Å; D136-T138 WeakPolarHBondContact OD1-CA 3.49Å; D136-T138 WeakPolarHBondContact OD1-CB 3.45Å; D136-T138 PolarHBondContact OD1-N 3.47Å; D136-T138 PolarHBondContact OD1-OG1 3.07Å; T138-K142 WeakPolarHBondContact O-CE 3.39Å; T138-K142 VanDerWaalsContact O-CG 3.29Å; T138-K142 WeakPolarHBondContact O-CG 3.35Å; T138-K142 PolarHBondContact O-N 3Å |
| 139 | S | 69.7 | Low | 74.5 | Confident | 16 Ų | 16 | 78.1 Ų | 78.1 | 11% | 0.112 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -93.2 | -29.6 | -176.9 | -64 | 0 | 0 | 0 | 0 | 113.6 | D136 Q137 F141 K142 V143 | D136-S139 PolarHBondContact O-N 3.39Å; D136-S139 VanDerWaalsContact OD2-CB 3.22Å; D136-S139 WeakPolarHBondContact OD2-CB 3.47Å; D136-S139 PolarHBondContact OD2-N 3.15Å; D136-S139 VanDerWaalsContact OD2-N 3.17Å; D136-S139 PolarHBondContact OD2-OG 3.31Å; Q137-S139 PolarHBondContact O-N 2.98Å; S139-F141 PolarHBondContact O-N 3.13Å; S139-K142 WeakPolarHBondContact O-CB 3.35Å; S139-K142 PolarHBondContact O-N 3.09Å; S139-K142 VanDerWaalsContact O-N 3.16Å; S139-K142 PolarHBondContact OG-NZ 3.08Å; S139-V143 WeakPolarHBondContact O-CG2 3.33Å; S139-V143 PolarHBondContact O-N 3.27Å |
| 140 | Q | 72.4 | Confident | 75 | Confident | 72 Ų | 72 | 70.7 Ų | 70.7 | 34% | 0.336 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -50.3 | -47 | 163.6 | -67.7 | -76.8 | 0.1 | 0 | 0 | 111.4 | H124 V128 D136 Q137 V143 A144 | H124-Q140 PolarHBondContact CE1-OE1 2.53Å; H124-Q140 PolarHBondContact NE2-O 3.27Å; H124-Q140 VanDerWaalsContact NE2-O 3.1Å; V128-Q140 VanDerWaalsContact CG2-OE1 3.26Å; D136-Q140 PolarHBondContact O-N 3.13Å; Q137-Q140 PolarHBondContact O-N 3.28Å; Q140-V143 PolarHBondContact O-N 3.47Å; Q140-A144 PolarHBondContact O-N 3.22Å |
| 141 | F | 77.1 | Confident | 75.6 | Confident | 130 Ų | 130 | 68 Ų | 68 | 57% | 0.57 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -64.3 | -44.8 | 176.5 | -179.5 | -107.2 | 0 | 0 | 0 | 112.7 | Q137 S139 V143 A144 W145 | Q137-F141 PolarHBondContact O-N 3.4Å; S139-F141 PolarHBondContact O-N 3.13Å; F141-V143 VanDerWaalsContact C-N 3.34Å; F141-V143 PolarHBondContact O-N 3.39Å; F141-A144 WeakPolarHBondContact O-CB 2.99Å; F141-A144 PolarHBondContact O-N 3.03Å; F141-W145 AromaticContact CD1-NE1 3.88Å; F141-W145 AromaticContact CE1-CD1 3.94Å; F141-W145 AromaticContact CE1-NE1 3.23Å; F141-W145 AromaticContact CE2-NE1 3.71Å; F141-W145 HydrophobicContact CZ-CZ2 4.26Å; F141-W145 AromaticContact CZ-NE1 3.15Å; F141-W145 VanDerWaalsContact O-CD1 3.3Å; F141-W145 PolarHBondContact O-N 3.35Å |
| 142 | K | 80.1 | Confident | 76.6 | Confident | 75 Ų | 75 | 66 Ų | 66 | 33% | 0.326 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -55.3 | -47.5 | 174.8 | -69.8 | 163.4 | -148.6 | 149.4 | 0 | 111.2 | D136 T138 S139 A144 W145 Y198 | D136-K142 IonicContact OD2-NZ 2.66Å; T138-K142 WeakPolarHBondContact O-CE 3.39Å; T138-K142 VanDerWaalsContact O-CG 3.29Å; T138-K142 WeakPolarHBondContact O-CG 3.35Å; T138-K142 PolarHBondContact O-N 3Å; S139-K142 WeakPolarHBondContact O-CB 3.35Å; S139-K142 PolarHBondContact O-N 3.09Å; S139-K142 VanDerWaalsContact O-N 3.16Å; S139-K142 PolarHBondContact OG-NZ 3.08Å; K142-A144 VanDerWaalsContact C-N 3.31Å; K142-A144 PolarHBondContact O-N 3.32Å; K142-W145 PolarHBondContact O-N 3.1Å; K142-Y198 WeakPolarHBondContact CB-OH 3.46Å; K142-Y198 WeakPolarHBondContact O-CE1 3.46Å; K142-Y198 PolarHBondContact O-OH 3.47Å; K142-Y198 VanDerWaalsContact O-OH 3.06Å |
| 143 | V | 84.7 | Confident | 78.1 | Confident | 0 Ų | 0 | 66.3 Ų | 66.3 | 0% | 0 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -64.1 | -35.7 | -179.7 | -179.8 | 0 | 0 | 0 | 0 | 111.9 | L127 V128 S139 Q140 F141 W145 V146 L194 | L127-V143 HydrophobicContact CB-CG1 3.33Å; L127-V143 HydrophobicContact CD1-CG1 3.95Å; L127-V143 HydrophobicContact CG-CG1 4.23Å; V128-V143 HydrophobicContact CG2-CB 4.18Å; V128-V143 HydrophobicContact CG2-CG1 4.14Å; V128-V143 HydrophobicContact CG2-CG2 4.26Å; S139-V143 WeakPolarHBondContact O-CG2 3.33Å; S139-V143 PolarHBondContact O-N 3.27Å; Q140-V143 PolarHBondContact O-N 3.47Å; F141-V143 VanDerWaalsContact C-N 3.34Å; F141-V143 PolarHBondContact O-N 3.39Å; V143-W145 VanDerWaalsContact C-N 3.26Å; V143-W145 PolarHBondContact O-N 2.96Å; V143-V146 WeakPolarHBondContact O-CB 3.28Å; V143-V146 WeakPolarHBondContact O-CG2 3.44Å; V143-V146 PolarHBondContact O-N 3.13Å; V143-V146 VanDerWaalsContact O-N 3.14Å; V143-L194 HydrophobicContact CG2-CD1 4.32Å; V143-L194 HydrophobicContact CG2-CD2 4.08Å |
| 144 | A | 84.9 | Confident | 79.7 | Confident | 40 Ų | 40 | 59.9 Ų | 59.9 | 33% | 0.331 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -60.6 | -33 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | H124 Q140 F141 K142 V146 G147 A148 | H124-A144 PolarHBondContact CD2-N 3.08Å; Q140-A144 PolarHBondContact O-N 3.22Å; F141-A144 WeakPolarHBondContact O-CB 2.99Å; F141-A144 PolarHBondContact O-N 3.03Å; K142-A144 VanDerWaalsContact C-N 3.31Å; K142-A144 PolarHBondContact O-N 3.32Å; A144-V146 PolarHBondContact O-N 3.22Å; A144-G147 PolarHBondContact O-N 3.19Å; A144-A148 PolarHBondContact O-N 3.19Å |
| 145 | W | 86.3 | Confident | 81.4 | Confident | 118 Ų | 118 | 55.3 Ų | 55.3 | 45% | 0.447 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -61.5 | -25.9 | 176.6 | -81.1 | 96.6 | 0 | 0 | 0 | 113.9 | F141 K142 V143 G147 A148 L149 Y198 | F141-W145 AromaticContact CD1-NE1 3.88Å; F141-W145 AromaticContact CE1-CD1 3.94Å; F141-W145 AromaticContact CE1-NE1 3.23Å; F141-W145 AromaticContact CE2-NE1 3.71Å; F141-W145 HydrophobicContact CZ-CZ2 4.26Å; F141-W145 AromaticContact CZ-NE1 3.15Å; F141-W145 VanDerWaalsContact O-CD1 3.3Å; F141-W145 PolarHBondContact O-N 3.35Å; K142-W145 PolarHBondContact O-N 3.1Å; V143-W145 VanDerWaalsContact C-N 3.26Å; V143-W145 PolarHBondContact O-N 2.96Å; W145-G147 VanDerWaalsContact C-N 3.32Å; W145-G147 PolarHBondContact O-N 3.41Å; W145-A148 PolarHBondContact O-N 3.11Å; W145-L149 HydrophobicContact CE3-CD2 4.43Å; W145-L149 HydrophobicContact CE3-CG 4.29Å; W145-L149 VanDerWaalsContact O-CB 3.29Å; W145-L149 WeakPolarHBondContact O-CB 3.47Å; W145-L149 WeakPolarHBondContact O-CD1 3.31Å; W145-L149 WeakPolarHBondContact O-CG 3.11Å; W145-L149 PolarHBondContact O-N 3.38Å; W145-Y198 HydrophobicContact CB-CE1 3.89Å |
| 146 | V | 87.9 | Confident | 83.1 | Confident | 0 Ų | 0 | 52 Ų | 52 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -58.3 | -46.1 | 176.7 | -178.5 | 0 | 0 | 0 | 0 | 110.7 | F120 V143 A144 A150 R197 Y198 Y201 | F120-V146 HydrophobicContact CE2-CB 4.31Å; F120-V146 HydrophobicContact CE2-CG1 4.26Å; F120-V146 HydrophobicContact CZ-CB 3.99Å; F120-V146 HydrophobicContact CZ-CG1 4.43Å; V143-V146 WeakPolarHBondContact O-CB 3.28Å; V143-V146 WeakPolarHBondContact O-CG2 3.44Å; V143-V146 PolarHBondContact O-N 3.13Å; V143-V146 VanDerWaalsContact O-N 3.14Å; A144-V146 PolarHBondContact O-N 3.22Å; V146-A150 PolarHBondContact O-N 3.44Å; V146-R197 HydrophobicContact CG1-CB 4.34Å; V146-R197 HydrophobicContact CG2-CB 4.38Å; V146-Y198 HydrophobicContact CB-CD1 4.37Å; V146-Y198 HydrophobicContact CG2-CD1 3.58Å; V146-Y198 HydrophobicContact CG2-CE1 3.61Å; V146-Y201 HydrophobicContact CG1-CD1 3.66Å; V146-Y201 HydrophobicContact CG1-CG 3.98Å; V146-Y201 WeakPolarHBondContact O-CD1 3.33Å |
| 147 | G | 86.3 | Confident | 84.4 | Confident | 2 Ų | 2 | 50.1 Ų | 50.1 | 2% | 0.021 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -78.4 | -37.1 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | Q117 A144 W145 A150 M151 | Q117-G147 PolarHBondContact NE2-O 3.29Å; A144-G147 PolarHBondContact O-N 3.19Å; W145-G147 VanDerWaalsContact C-N 3.32Å; W145-G147 PolarHBondContact O-N 3.41Å; G147-A150 PolarHBondContact O-N 3.29Å; G147-M151 PolarHBondContact O-N 3.15Å; G147-M151 VanDerWaalsContact O-N 3.11Å |
| 148 | A | 87.5 | Confident | 85.9 | Confident | 53 Ų | 53 | 42.1 Ų | 42.1 | 44% | 0.438 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -64.1 | -40.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112 | A144 W145 G152 | A144-A148 PolarHBondContact O-N 3.19Å; W145-A148 PolarHBondContact O-N 3.11Å; A148-G152 PolarHBondContact O-N 3.16Å |
| 149 | L | 90.5 | Very high | 87.3 | Confident | 54 Ų | 54 | 39.4 Ų | 39.4 | 28% | 0.283 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -62.1 | -44.5 | 174.1 | -72.8 | 169.6 | 0 | 0 | 0 | 111.6 | W145 M151 G152 M153 Y198 | W145-L149 HydrophobicContact CE3-CD2 4.43Å; W145-L149 HydrophobicContact CE3-CG 4.29Å; W145-L149 VanDerWaalsContact O-CB 3.29Å; W145-L149 WeakPolarHBondContact O-CB 3.47Å; W145-L149 WeakPolarHBondContact O-CD1 3.31Å; W145-L149 WeakPolarHBondContact O-CG 3.11Å; W145-L149 PolarHBondContact O-N 3.38Å; L149-M151 PolarHBondContact O-N 3.33Å; L149-G152 PolarHBondContact O-N 3.11Å; L149-M153 WeakPolarHBondContact O-CB 3.28Å; L149-M153 WeakPolarHBondContact O-CG 3.5Å; L149-M153 PolarHBondContact O-N 3.38Å; L149-Y198 HydrophobicContact CD1-CD1 4.03Å; L149-Y198 HydrophobicContact CD1-CG 4.24Å |
| 150 | A | 92.6 | Very high | 88.4 | Confident | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -59.9 | -48.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112 | V146 G147 M153 I154 Y201 G202 F205 | V146-A150 PolarHBondContact O-N 3.44Å; G147-A150 PolarHBondContact O-N 3.29Å; A150-M153 PolarHBondContact O-N 3.4Å; A150-I154 WeakPolarHBondContact O-CG1 3.46Å; A150-I154 PolarHBondContact O-N 3.42Å; A150-I154 VanDerWaalsContact O-N 3.15Å; A150-Y201 HydrophobicContact CB-CD1 3.72Å; A150-Y201 HydrophobicContact CB-CE1 3.52Å; A150-G202 WeakPolarHBondContact CA-O 3.5Å; A150-F205 HydrophobicContact CB-CD1 4.29Å |
| 151 | M | 90 | Very high | 89.4 | Confident | 33 Ų | 33 | 38 Ų | 38 | 16% | 0.163 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -61.9 | -46.1 | 176.6 | -171.7 | 58.8 | 155.3 | 0 | 0 | 111.8 | F114 Q117 G147 L149 M153 I154 F155 F350 | F114-M151 HydrophobicContact CD1-CE 4.38Å; F114-M151 HydrophobicContact CE1-CE 4.14Å; F114-M151 HydrophobicContact CE1-SD 4.22Å; Q117-M151 HydrophobicContact CG-CB 3.94Å; Q117-M151 HydrophobicContact CG-CG 4.21Å; Q117-M151 HydrophobicContact CG-SD 3.51Å; Q117-M151 VanDerWaalsContact CG-SD 3.51Å; G147-M151 PolarHBondContact O-N 3.15Å; G147-M151 VanDerWaalsContact O-N 3.11Å; L149-M151 PolarHBondContact O-N 3.33Å; M151-M153 PolarHBondContact O-N 2.97Å; M151-I154 PolarHBondContact O-N 2.81Å; M151-F155 HydrophobicContact CE-CE2 3.9Å; M151-F155 WeakPolarHBondContact O-CD2 3.36Å; M151-F155 HydrophobicContact SD-CD2 4.42Å; M151-F155 HydrophobicContact SD-CE2 3.77Å; M151-F350 HydrophobicContact CE-CE1 4.39Å; M151-F350 HydrophobicContact CE-CZ 3.94Å |
| 152 | G | 90.2 | Very high | 90 | Very high | 15 Ų | 15 | 31.8 Ų | 31.8 | 16% | 0.155 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -59.8 | -45.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | A148 L149 I154 F155 F156 | A148-G152 PolarHBondContact O-N 3.16Å; L149-G152 PolarHBondContact O-N 3.11Å; G152-I154 VanDerWaalsContact C-N 3.35Å; G152-I154 PolarHBondContact O-N 2.96Å; G152-F155 PolarHBondContact O-N 3.23Å; G152-F156 WeakPolarHBondContact O-CB 3.48Å; G152-F156 PolarHBondContact O-N 3.22Å |
| 153 | M | 92.8 | Very high | 90.3 | Very high | 40 Ų | 40 | 29.2 Ų | 29.2 | 20% | 0.197 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -67.7 | -29.8 | -178.6 | -68.8 | -58 | -64.7 | 0 | 0 | 113.3 | L149 A150 M151 F155 F156 C157 C207 | L149-M153 WeakPolarHBondContact O-CB 3.28Å; L149-M153 WeakPolarHBondContact O-CG 3.5Å; L149-M153 PolarHBondContact O-N 3.38Å; A150-M153 PolarHBondContact O-N 3.4Å; M151-M153 PolarHBondContact O-N 2.97Å; M153-F155 VanDerWaalsContact C-N 3.31Å; M153-F155 PolarHBondContact O-N 3.31Å; M153-F156 HydrophobicContact SD-CD1 4.27Å; M153-C157 VanDerWaalsContact CE-SG 3.56Å; M153-C157 WeakPolarHBondContact O-CB 3.49Å; M153-C157 PolarHBondContact O-N 2.88Å; M153-C157 VanDerWaalsContact O-N 3.17Å; M153-C207 WeakPolarHBondContact CE-SG 3.22Å |
| 154 | I | 94.1 | Very high | 90.5 | Very high | 0 Ų | 0 | 33.4 Ų | 33.4 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -56.9 | -44.4 | 173.8 | -73.6 | 162.7 | 0 | 0 | 0 | 111.3 | I113 A150 M151 G152 S158 S210 F213 | I113-I154 HydrophobicContact CG2-CD1 3.74Å; I113-I154 HydrophobicContact CG2-CG1 4.46Å; A150-I154 WeakPolarHBondContact O-CG1 3.46Å; A150-I154 PolarHBondContact O-N 3.42Å; A150-I154 VanDerWaalsContact O-N 3.15Å; M151-I154 PolarHBondContact O-N 2.81Å; G152-I154 VanDerWaalsContact C-N 3.35Å; G152-I154 PolarHBondContact O-N 2.96Å; I154-S158 PolarHBondContact O-OG 3.3Å; I154-S210 WeakPolarHBondContact O-CB 3.22Å; I154-S210 PolarHBondContact O-OG 3.24Å; I154-F213 HydrophobicContact CG2-CD1 4.21Å |
| 155 | F | 92.8 | Very high | 90.8 | Very high | 16 Ų | 16 | 31.7 Ų | 31.7 | 7% | 0.07 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -88.2 | -39.8 | -179.4 | -66.9 | -82.5 | 0 | 0 | 0 | 112.9 | F114 M151 G152 M153 C157 S158 F213 L466 G467 M473 | F114-F155 AromaticContact CE1-CE2 3.99Å; F114-F155 HydrophobicContact CE1-CE2 3.99Å; F114-F155 AromaticContact CE1-CZ 3.76Å; F114-F155 HydrophobicContact CE1-CZ 3.76Å; F114-F155 HydrophobicContact CZ-CE1 4.49Å; F114-F155 HydrophobicContact CZ-CE2 4.29Å; F114-F155 AromaticContact CZ-CZ 3.7Å; F114-F155 HydrophobicContact CZ-CZ 3.7Å; M151-F155 HydrophobicContact CE-CE2 3.9Å; M151-F155 WeakPolarHBondContact O-CD2 3.36Å; M151-F155 HydrophobicContact SD-CD2 4.42Å; M151-F155 HydrophobicContact SD-CE2 3.77Å; G152-F155 PolarHBondContact O-N 3.23Å; M153-F155 VanDerWaalsContact C-N 3.31Å; M153-F155 PolarHBondContact O-N 3.31Å; F155-C157 VanDerWaalsContact C-N 3.31Å; F155-C157 PolarHBondContact O-N 3.41Å; F155-S158 VanDerWaalsContact O-CB 3.31Å; F155-S158 WeakPolarHBondContact O-CB 3.17Å; F155-S158 PolarHBondContact O-N 3.27Å; F155-S158 VanDerWaalsContact O-N 3.14Å; F155-S158 PolarHBondContact O-OG 2.82Å; F155-F213 HydrophobicContact CE1-CE1 4.38Å; F155-L466 HydrophobicContact CD1-CB 4.22Å; F155-L466 HydrophobicContact CD1-CD2 3.66Å; F155-L466 HydrophobicContact CE1-CD2 3.68Å; F155-G467 WeakPolarHBondContact O-CA 3.24Å; F155-M473 HydrophobicContact CD1-CE 4.28Å; F155-M473 HydrophobicContact CD2-CE 3.67Å; F155-M473 HydrophobicContact CE1-CE 4.23Å; F155-M473 HydrophobicContact CE2-CE 3.62Å; F155-M473 HydrophobicContact CG-CE 4.03Å; F155-M473 HydrophobicContact CZ-CE 3.92Å |
| 156 | F | 92.9 | Very high | 90.7 | Very high | 118 Ų | 118 | 28.1 Ų | 28.1 | 52% | 0.518 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -64.4 | -32.6 | -176.9 | -177 | -103.1 | 0 | 0 | 0 | 113 | G152 M153 P159 | G152-F156 WeakPolarHBondContact O-CB 3.48Å; G152-F156 PolarHBondContact O-N 3.22Å; M153-F156 HydrophobicContact SD-CD1 4.27Å; F156-P159 WeakPolarHBondContact O-CD 3.29Å |
| 157 | C | 93.9 | Very high | 90.5 | Very high | 17 Ų | 17 | 32.5 Ų | 32.5 | 12% | 0.115 | 18% | 0.175 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -78.8 | -13.6 | 176 | -78.7 | 0 | 0 | 0 | 0 | 114.8 | M153 F155 P159 V160 V161 S210 | M153-C157 VanDerWaalsContact CE-SG 3.56Å; M153-C157 WeakPolarHBondContact O-CB 3.49Å; M153-C157 PolarHBondContact O-N 2.88Å; M153-C157 VanDerWaalsContact O-N 3.17Å; F155-C157 VanDerWaalsContact C-N 3.31Å; F155-C157 PolarHBondContact O-N 3.41Å; C157-P159 VanDerWaalsContact C-CD 3.48Å; C157-V160 WeakPolarHBondContact O-CA 3.31Å; C157-V160 WeakPolarHBondContact O-CB 3.42Å; C157-V160 PolarHBondContact O-N 3.49Å; C157-V161 PolarHBondContact O-N 3.27Å; C157-S210 WeakPolarHBondContact CB-OG 3.22Å |
| 158 | S | 94.3 | Very high | 90.4 | Very high | 0 Ų | 0 | 36.9 Ų | 36.9 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -53.4 | -41.6 | -175 | -59.6 | 0 | 0 | 0 | 0 | 114.8 | I154 F155 V160 V161 S162 S210 Q214 G463 L466 | I154-S158 PolarHBondContact O-OG 3.3Å; F155-S158 VanDerWaalsContact O-CB 3.31Å; F155-S158 WeakPolarHBondContact O-CB 3.17Å; F155-S158 PolarHBondContact O-N 3.27Å; F155-S158 VanDerWaalsContact O-N 3.14Å; F155-S158 PolarHBondContact O-OG 2.82Å; S158-V160 PolarHBondContact O-N 3.22Å; S158-V160 VanDerWaalsContact O-N 3.16Å; S158-V161 PolarHBondContact O-N 2.98Å; S158-S162 PolarHBondContact O-N 3.05Å; S158-S162 PolarHBondContact O-OG 3.06Å; S158-S210 PolarHBondContact N-OG 2.95Å; S158-Q214 VanDerWaalsContact C-OE1 3.29Å; S158-Q214 PolarHBondContact O-OE1 2.84Å; S158-G463 CarbonylContact C-O 3.6Å; S158-G463 WeakPolarHBondContact CB-O 3.34Å; S158-L466 WeakPolarHBondContact OG-CB 3.43Å |
| 159 | P | 92.3 | Very high | 90.5 | Very high | 28 Ų | 28 | 34.5 Ų | 34.5 | 18% | 0.182 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -53 | -38.3 | 172.7 | -28.9 | 37.3 | 0 | 0 | 0 | 113.8 | F156 C157 S162 G463 Y464 | F156-P159 WeakPolarHBondContact O-CD 3.29Å; C157-P159 VanDerWaalsContact C-CD 3.48Å; P159-S162 WeakPolarHBondContact CA-OG 3.4Å; P159-S162 PolarHBondContact O-OG 2.85Å; P159-G463 VanDerWaalsContact CD-O 3.28Å; P159-G463 WeakPolarHBondContact CD-O 3.39Å; P159-G463 WeakPolarHBondContact CG-O 3.41Å; P159-Y464 HydrophobicContact CB-CD1 3.9Å; P159-Y464 HydrophobicContact CB-CE1 4.14Å; P159-Y464 HydrophobicContact CG-CD1 4.4Å |
| 160 | V | 92.4 | Very high | 90.5 | Very high | 59 Ų | 59 | 32.1 Ų | 32.1 | 36% | 0.358 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -72.5 | -43.1 | 176.4 | -173.8 | 0 | 0 | 0 | 0 | 110.8 | C157 S158 S162 M163 F164 F211 | C157-V160 WeakPolarHBondContact O-CA 3.31Å; C157-V160 WeakPolarHBondContact O-CB 3.42Å; C157-V160 PolarHBondContact O-N 3.49Å; S158-V160 PolarHBondContact O-N 3.22Å; S158-V160 VanDerWaalsContact O-N 3.16Å; V160-S162 VanDerWaalsContact C-N 3.27Å; V160-S162 PolarHBondContact O-N 3.26Å; V160-M163 HydrophobicContact CB-CE 4.4Å; V160-M163 HydrophobicContact CG1-CE 4.4Å; V160-M163 HydrophobicContact CG2-CE 4.43Å; V160-M163 PolarHBondContact O-N 3.39Å; V160-M163 VanDerWaalsContact O-N 3.11Å; V160-F164 HydrophobicContact CG1-CD2 4.1Å; V160-F164 HydrophobicContact CG1-CE2 3.93Å; V160-F164 WeakPolarHBondContact O-CD2 3.47Å; V160-F164 PolarHBondContact O-N 2.86Å; V160-F211 HydrophobicContact CG1-CZ 4.41Å |
| 161 | V | 93.3 | Very high | 90.6 | Very high | 0 Ų | 0 | 36.6 Ų | 36.6 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -59.2 | -37.1 | 178.1 | -179 | 0 | 0 | 0 | 0 | 111.7 | C157 S158 M163 F164 T165 T173 F211 Q214 P215 | C157-V161 PolarHBondContact O-N 3.27Å; S158-V161 PolarHBondContact O-N 2.98Å; V161-M163 PolarHBondContact O-N 2.71Å; V161-F164 PolarHBondContact O-N 3.45Å; V161-T165 WeakPolarHBondContact O-CB 3.43Å; V161-T165 PolarHBondContact O-N 2.99Å; V161-T165 PolarHBondContact O-OG1 3.18Å; V161-T173 HydrophobicContact CG1-CG2 3.96Å; V161-F211 HydrophobicContact CG2-CB 4.34Å; V161-F211 HydrophobicContact CG2-CD1 4.27Å; V161-F211 HydrophobicContact CG2-CD2 3.51Å; V161-F211 HydrophobicContact CG2-CE1 4.48Å; V161-F211 HydrophobicContact CG2-CE2 3.76Å; V161-F211 HydrophobicContact CG2-CG 3.78Å; V161-F211 HydrophobicContact CG2-CZ 4.24Å; V161-Q214 HydrophobicContact CB-CB 4.5Å; V161-Q214 HydrophobicContact CG1-CB 3.91Å; V161-Q214 HydrophobicContact CG1-CG 4.35Å; V161-P215 HydrophobicContact CG1-CG 4.19Å |
| 162 | S | 90.4 | Very high | 90.8 | Very high | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -55.7 | -48.5 | 173.2 | 5.3 | 0 | 0 | 0 | 0 | 112.7 | S158 P159 V160 F164 T165 D166 Q214 | S158-S162 PolarHBondContact O-N 3.05Å; S158-S162 PolarHBondContact O-OG 3.06Å; P159-S162 WeakPolarHBondContact CA-OG 3.4Å; P159-S162 PolarHBondContact O-OG 2.85Å; V160-S162 VanDerWaalsContact C-N 3.27Å; V160-S162 PolarHBondContact O-N 3.26Å; S162-F164 VanDerWaalsContact C-N 3.28Å; S162-F164 PolarHBondContact O-N 3.42Å; S162-T165 WeakPolarHBondContact O-CB 3.49Å; S162-T165 PolarHBondContact O-N 3.5Å; S162-T165 VanDerWaalsContact O-N 3.1Å; S162-D166 PolarHBondContact O-N 3.28Å; S162-Q214 VanDerWaalsContact CA-NE2 3.29Å; S162-Q214 PolarHBondContact OG-NE2 3.33Å |
| 163 | M | 86.9 | Confident | 91 | Very high | 21 Ų | 21 | 40.9 Ų | 40.9 | 10% | 0.103 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -62.2 | -37.7 | -178.7 | -64.4 | -175.4 | -74.5 | 0 | 0 | 111.8 | V160 V161 H167 F325 | V160-M163 HydrophobicContact CB-CE 4.4Å; V160-M163 HydrophobicContact CG1-CE 4.4Å; V160-M163 HydrophobicContact CG2-CE 4.43Å; V160-M163 PolarHBondContact O-N 3.39Å; V160-M163 VanDerWaalsContact O-N 3.11Å; V161-M163 PolarHBondContact O-N 2.71Å; M163-H167 WeakPolarHBondContact O-CB 3.18Å; M163-H167 PolarHBondContact O-N 3.23Å; M163-F325 HydrophobicContact CE-CD2 4Å; M163-F325 HydrophobicContact CE-CE1 4.49Å; M163-F325 HydrophobicContact CE-CE2 3.54Å; M163-F325 HydrophobicContact CE-CZ 3.82Å; M163-F325 HydrophobicContact SD-CD2 3.58Å; M163-F325 VanDerWaalsContact SD-CD2 3.58Å; M163-F325 HydrophobicContact SD-CE2 3.8Å; M163-F325 HydrophobicContact SD-CG 4.02Å; M163-F325 HydrophobicContact SD-CZ 4.38Å |
| 164 | F | 88.9 | Confident | 91.2 | Very high | 87 Ų | 87 | 39 Ų | 39 | 38% | 0.382 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -72.1 | -36.9 | 174.3 | -79.8 | -110.7 | 0 | 0 | 0 | 112.2 | V160 V161 S162 H167 F168 T173 F211 | V160-F164 HydrophobicContact CG1-CD2 4.1Å; V160-F164 HydrophobicContact CG1-CE2 3.93Å; V160-F164 WeakPolarHBondContact O-CD2 3.47Å; V160-F164 PolarHBondContact O-N 2.86Å; V161-F164 PolarHBondContact O-N 3.45Å; S162-F164 VanDerWaalsContact C-N 3.28Å; S162-F164 PolarHBondContact O-N 3.42Å; F164-H167 PolarHBondContact O-N 3.11Å; F164-F168 HydrophobicContact CB-CD2 4.2Å; F164-F168 AromaticContact CD1-CD2 3.67Å; F164-F168 HydrophobicContact CD1-CD2 3.67Å; F164-F168 AromaticContact CD1-CE2 3.48Å; F164-F168 HydrophobicContact CD1-CE2 3.48Å; F164-F168 VanDerWaalsContact CD1-CE2 3.48Å; F164-F168 HydrophobicContact CE1-CD2 4.45Å; F164-F168 AromaticContact CE1-CE2 3.81Å; F164-F168 HydrophobicContact CE1-CE2 3.81Å; F164-F168 HydrophobicContact CG-CD2 4.23Å; F164-F168 HydrophobicContact CG-CE2 4.25Å; F164-F168 WeakPolarHBondContact O-CB 3.37Å; F164-F168 PolarHBondContact O-N 3.39Å; F164-T173 HydrophobicContact CB-CG2 4Å; F164-T173 PolarHBondContact O-OG1 3.14Å; F164-T173 VanDerWaalsContact O-OG1 3.14Å; F164-F211 HydrophobicContact CB-CE1 3.9Å; F164-F211 AromaticContact CD1-CE1 3.88Å; F164-F211 HydrophobicContact CD1-CE1 3.88Å; F164-F211 HydrophobicContact CD1-CZ 4.5Å; F164-F211 HydrophobicContact CD2-CE1 4.2Å; F164-F211 HydrophobicContact CD2-CZ 4.25Å; F164-F211 HydrophobicContact CE1-CE1 4.47Å; F164-F211 AromaticContact CG-CE1 3.73Å; F164-F211 HydrophobicContact CG-CE1 3.73Å; F164-F211 HydrophobicContact CG-CZ 4.24Å |
| 165 | T | 89.9 | Confident | 91.3 | Very high | 4 Ų | 4 | 40.8 Ų | 40.8 | 3% | 0.025 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -62 | -42.2 | 176.5 | -57.9 | 0 | 0 | 0 | 0 | 111.8 | V161 S162 G169 P215 V218 | V161-T165 WeakPolarHBondContact O-CB 3.43Å; V161-T165 PolarHBondContact O-N 2.99Å; V161-T165 PolarHBondContact O-OG1 3.18Å; S162-T165 WeakPolarHBondContact O-CB 3.49Å; S162-T165 PolarHBondContact O-N 3.5Å; S162-T165 VanDerWaalsContact O-N 3.1Å; T165-G169 CarbonylContact O-C 3.56Å; T165-G169 WeakPolarHBondContact O-CA 3.5Å; T165-G169 PolarHBondContact O-N 3.01Å; T165-P215 HydrophobicContact CG2-CB 4.4Å; T165-P215 HydrophobicContact CG2-CG 4.47Å; T165-V218 HydrophobicContact CG2-CG1 4.39Å |
| 166 | D | 84.9 | Confident | 91.5 | Very high | 44 Ų | 44 | 43.8 Ų | 43.8 | 24% | 0.235 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -73.2 | -31.4 | -179.8 | -70.3 | 14.1 | 0 | 0 | 0 | 113.1 | S162 T286 S459 Q460 | S162-D166 PolarHBondContact O-N 3.28Å; D166-T286 WeakPolarHBondContact O-CG2 3.33Å; D166-S459 WeakPolarHBondContact OD1-CB 3.32Å; D166-S459 PolarHBondContact OD1-OG 3.33Å; D166-Q460 WeakPolarHBondContact OD2-CG 3.48Å; D166-Q460 PolarHBondContact OD2-NE2 3.28Å |
| 167 | H | 82.6 | Confident | 91.7 | Very high | 92 Ų | 92 | 38.2 Ų | 38.2 | 43% | 0.426 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -90.1 | -47.3 | -176.5 | -174 | 75.1 | 0 | 0 | 0 | 112.9 | M163 F164 Y324 | M163-H167 WeakPolarHBondContact O-CB 3.18Å; M163-H167 PolarHBondContact O-N 3.23Å; F164-H167 PolarHBondContact O-N 3.11Å; H167-Y324 AromaticContact ND1-CE1 3.75Å; H167-Y324 AromaticContact ND1-CZ 3.95Å |
| 168 | F | 85.4 | Confident | 91.9 | Very high | 93 Ų | 93 | 37.4 Ų | 37.4 | 41% | 0.408 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -94.3 | -12.2 | -177.7 | -62.2 | -69.5 | 0 | 0 | 0 | 113.7 | F164 K172 | F164-F168 HydrophobicContact CB-CD2 4.2Å; F164-F168 AromaticContact CD1-CD2 3.67Å; F164-F168 HydrophobicContact CD1-CD2 3.67Å; F164-F168 AromaticContact CD1-CE2 3.48Å; F164-F168 HydrophobicContact CD1-CE2 3.48Å; F164-F168 VanDerWaalsContact CD1-CE2 3.48Å; F164-F168 HydrophobicContact CE1-CD2 4.45Å; F164-F168 AromaticContact CE1-CE2 3.81Å; F164-F168 HydrophobicContact CE1-CE2 3.81Å; F164-F168 HydrophobicContact CG-CD2 4.23Å; F164-F168 HydrophobicContact CG-CE2 4.25Å; F164-F168 WeakPolarHBondContact O-CB 3.37Å; F164-F168 PolarHBondContact O-N 3.39Å; F168-K172 HydrophobicContact CB-CB 4.04Å; F168-K172 HydrophobicContact CB-CD 4.26Å; F168-K172 WeakPolarHBondContact O-CD 3.31Å |
| 169 | G | 88.5 | Confident | 92.1 | Very high | 4 Ų | 4 | 39.1 Ų | 39.1 | 4% | 0.041 | 20% | 0.201 | C | C | . | . | trans | 80.9 | 148.7 | -175.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | T165 R171 K172 T173 | T165-G169 CarbonylContact O-C 3.56Å; T165-G169 WeakPolarHBondContact O-CA 3.5Å; T165-G169 PolarHBondContact O-N 3.01Å; G169-R171 PolarHBondContact O-N 3.46Å; G169-K172 PolarHBondContact O-N 3.11Å; G169-K172 VanDerWaalsContact O-N 3.13Å; G169-T173 PolarHBondContact O-N 3.44Å; G169-T173 PolarHBondContact O-OG1 3.3Å | ||
| 170 | C | 90.7 | Very high | 92.4 | Very high | 4 Ų | 4 | 40.4 Ų | 40.4 | 3% | 0.027 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -47.6 | -40.4 | -173 | -64 | 0 | 0 | 0 | 0 | 114.4 | A174 P215 I219 | C170-A174 VanDerWaalsContact O-CB 3.24Å; C170-A174 WeakPolarHBondContact O-CB 3.42Å; C170-A174 PolarHBondContact O-N 2.84Å; C170-P215 HydrophobicContact CB-CB 4.04Å; C170-I219 HydrophobicContact CB-CB 4.39Å; C170-I219 HydrophobicContact CB-CD1 4.16Å |
| 171 | R | 94.7 | Very high | 92.6 | Very high | 94 Ų | 94 | 37.6 Ų | 37.6 | 36% | 0.355 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -59.1 | -54.1 | -179.6 | -171.5 | -177.8 | -71.3 | -163 | -13.7 | 112.8 | G169 A174 V175 L278 F280 | G169-R171 PolarHBondContact O-N 3.46Å; R171-A174 PolarHBondContact O-N 3.14Å; R171-V175 HydrophobicContact CG-CG2 4.4Å; R171-V175 WeakPolarHBondContact O-CB 3.46Å; R171-V175 VanDerWaalsContact O-CG2 3.23Å; R171-V175 WeakPolarHBondContact O-CG2 3.43Å; R171-V175 PolarHBondContact O-N 2.93Å; R171-L278 PolarHBondContact NE-O 3.44Å; R171-L278 PolarHBondContact NH2-O 3.35Å; R171-L278 VanDerWaalsContact NH2-O 3.09Å; R171-F280 HydrophobicContact CB-CB 4.47Å; R171-F280 WeakPolarHBondContact CB-O 3.34Å; R171-F280 PolarHBondContact NE-O 3.18Å; R171-F280 PolarHBondContact NH2-O 3.3Å |
| 172 | K | 94.1 | Very high | 92.9 | Very high | 133 Ų | 133 | 39.8 Ų | 39.8 | 58% | 0.578 | 20% | 0.201 | S | C | * | . | H | α-helix | trans | -66.3 | -45.1 | -172.7 | -63.8 | -173.9 | -169.7 | 170.1 | 0 | 109.8 | F168 G169 A174 V175 C176 | F168-K172 HydrophobicContact CB-CB 4.04Å; F168-K172 HydrophobicContact CB-CD 4.26Å; F168-K172 WeakPolarHBondContact O-CD 3.31Å; G169-K172 PolarHBondContact O-N 3.11Å; G169-K172 VanDerWaalsContact O-N 3.13Å; K172-A174 PolarHBondContact O-N 3.34Å; K172-V175 PolarHBondContact O-N 3.33Å; K172-C176 WeakPolarHBondContact O-CB 3.42Å; K172-C176 PolarHBondContact O-N 3.33Å; K172-C176 PolarHBondContact O-SG 3.18Å |
| 173 | T | 95.1 | Very high | 93.2 | Very high | 5 Ų | 5 | 43.9 Ų | 43.9 | 3% | 0.031 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -58.8 | -47.7 | 177.4 | -48.3 | 0 | 0 | 0 | 0 | 111.5 | V161 F164 G169 G177 F211 P215 | V161-T173 HydrophobicContact CG1-CG2 3.96Å; F164-T173 HydrophobicContact CB-CG2 4Å; F164-T173 PolarHBondContact O-OG1 3.14Å; F164-T173 VanDerWaalsContact O-OG1 3.14Å; G169-T173 PolarHBondContact O-N 3.44Å; G169-T173 PolarHBondContact O-OG1 3.3Å; T173-G177 PolarHBondContact O-N 3.1Å; T173-F211 CarbonylContact C-O 3.57Å; T173-F211 HydrophobicContact CG2-CD1 3.65Å; T173-F211 HydrophobicContact CG2-CE1 4.24Å; T173-P215 HydrophobicContact CG2-CG 3.86Å |
| 174 | A | 96.4 | Very high | 93.7 | Very high | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -66 | -44.2 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | C170 R171 K172 G177 A178 F211 P215 A277 F280 | C170-A174 VanDerWaalsContact O-CB 3.24Å; C170-A174 WeakPolarHBondContact O-CB 3.42Å; C170-A174 PolarHBondContact O-N 2.84Å; R171-A174 PolarHBondContact O-N 3.14Å; K172-A174 PolarHBondContact O-N 3.34Å; A174-G177 PolarHBondContact O-N 2.87Å; A174-A178 WeakPolarHBondContact O-CB 3.48Å; A174-A178 PolarHBondContact O-N 3.2Å; A174-F211 WeakPolarHBondContact CA-O 3.47Å; A174-P215 HydrophobicContact CB-CB 4.1Å; A174-P215 HydrophobicContact CB-CG 4.36Å; A174-A277 HydrophobicContact CB-CB 3.81Å; A174-F280 HydrophobicContact CB-CD2 3.81Å; A174-F280 HydrophobicContact CB-CE2 3.72Å |
| 175 | V | 97.3 | Very high | 94.1 | Very high | 38 Ų | 38 | 38.8 Ų | 38.8 | 23% | 0.23 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -65.2 | -45.1 | 178.8 | 174.1 | 0 | 0 | 0 | 0 | 110.6 | R171 K172 A178 A179 A277 L278 | R171-V175 HydrophobicContact CG-CG2 4.4Å; R171-V175 WeakPolarHBondContact O-CB 3.46Å; R171-V175 VanDerWaalsContact O-CG2 3.23Å; R171-V175 WeakPolarHBondContact O-CG2 3.43Å; R171-V175 PolarHBondContact O-N 2.93Å; K172-V175 PolarHBondContact O-N 3.33Å; V175-A178 PolarHBondContact O-N 3.2Å; V175-A179 WeakPolarHBondContact O-CB 3.48Å; V175-A179 PolarHBondContact O-N 3.38Å; V175-A277 HydrophobicContact CG2-CB 3.64Å; V175-L278 HydrophobicContact CG1-CD2 4.49Å; V175-L278 HydrophobicContact CG2-CD2 3.84Å; V175-L278 HydrophobicContact CG2-CG 4.22Å |
| 176 | C | 96.9 | Very high | 94.4 | Very high | 78 Ų | 78 | 41.1 Ų | 41.1 | 53% | 0.527 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -64.1 | -41.4 | 175.9 | -69.3 | 0 | 0 | 0 | 0 | 112 | K172 A179 V180 | K172-C176 WeakPolarHBondContact O-CB 3.42Å; K172-C176 PolarHBondContact O-N 3.33Å; K172-C176 PolarHBondContact O-SG 3.18Å; C176-A179 PolarHBondContact O-N 2.99Å; C176-V180 WeakPolarHBondContact O-CB 3.13Å; C176-V180 VanDerWaalsContact O-CG2 3.31Å; C176-V180 WeakPolarHBondContact O-CG2 3.3Å; C176-V180 PolarHBondContact O-N 2.97Å |
| 177 | G | 97.3 | Very high | 94.9 | Very high | 1 Ų | 1 | 41.8 Ų | 41.8 | 1% | 0.01 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -59.8 | -50.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | T173 A174 A179 V180 A181 G208 | T173-G177 PolarHBondContact O-N 3.1Å; A174-G177 PolarHBondContact O-N 2.87Å; G177-A179 VanDerWaalsContact C-N 3.33Å; G177-A179 PolarHBondContact O-N 3.13Å; G177-V180 PolarHBondContact O-N 3.36Å; G177-A181 WeakPolarHBondContact O-CB 3.24Å; G177-A181 PolarHBondContact O-N 2.74Å; G177-G208 CarbonylContact C-O 3.53Å; G177-G208 VanDerWaalsContact CA-O 3.25Å; G177-G208 WeakPolarHBondContact CA-O 3.35Å; G177-G208 CarbonylContact O-C 3.58Å; G177-G208 VanDerWaalsContact O-C 3.29Å; G177-G208 WeakPolarHBondContact O-CA 3.41Å; G177-G208 VanDerWaalsContact O-O 3.07Å |
| 178 | A | 97.9 | Very high | 95.6 | Very high | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -63.4 | -37.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | A174 V175 A181 F182 A212 Q273 A274 | A174-A178 WeakPolarHBondContact O-CB 3.48Å; A174-A178 PolarHBondContact O-N 3.2Å; V175-A178 PolarHBondContact O-N 3.2Å; A178-A181 PolarHBondContact O-N 3.24Å; A178-F182 WeakPolarHBondContact O-CB 3.24Å; A178-F182 PolarHBondContact O-N 3.47Å; A178-A212 HydrophobicContact CB-CB 4.26Å; A178-Q273 HydrophobicContact CB-CB 4.33Å; A178-Q273 HydrophobicContact CB-CG 3.95Å; A178-A274 HydrophobicContact CB-CB 3.69Å |
| 179 | A | 97.9 | Very high | 96 | Very high | 37 Ų | 37 | 33 Ų | 33 | 31% | 0.306 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -65.7 | -41 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | V175 C176 G177 F182 I183 | V175-A179 WeakPolarHBondContact O-CB 3.48Å; V175-A179 PolarHBondContact O-N 3.38Å; C176-A179 PolarHBondContact O-N 2.99Å; G177-A179 VanDerWaalsContact C-N 3.33Å; G177-A179 PolarHBondContact O-N 3.13Å; A179-F182 PolarHBondContact O-N 3.38Å; A179-I183 VanDerWaalsContact O-CG1 3.3Å; A179-I183 WeakPolarHBondContact O-CG1 3.19Å; A179-I183 PolarHBondContact O-N 3.25Å |
| 180 | V | 98 | Very high | 96.2 | Very high | 55 Ų | 55 | 39.3 Ų | 39.3 | 33% | 0.333 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -65 | -39.4 | 173.6 | 168.8 | 0 | 0 | 0 | 0 | 111.3 | C176 G177 I183 G184 L204 | C176-V180 WeakPolarHBondContact O-CB 3.13Å; C176-V180 VanDerWaalsContact O-CG2 3.31Å; C176-V180 WeakPolarHBondContact O-CG2 3.3Å; C176-V180 PolarHBondContact O-N 2.97Å; G177-V180 PolarHBondContact O-N 3.36Å; V180-I183 PolarHBondContact O-N 3.14Å; V180-G184 PolarHBondContact O-N 3.17Å; V180-L204 HydrophobicContact CG1-CD1 3.62Å; V180-L204 HydrophobicContact CG1-CG 4.17Å |
| 181 | A | 97.9 | Very high | 96.2 | Very high | 0 Ų | 0 | 39.1 Ų | 39.1 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -66.4 | -41.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | G177 A178 G184 L185 F205 M270 | G177-A181 WeakPolarHBondContact O-CB 3.24Å; G177-A181 PolarHBondContact O-N 2.74Å; A178-A181 PolarHBondContact O-N 3.24Å; A181-G184 PolarHBondContact O-N 3.23Å; A181-L185 PolarHBondContact O-N 3.09Å; A181-F205 HydrophobicContact CB-CD2 3.95Å; A181-F205 HydrophobicContact CB-CE2 4.46Å; A181-M270 HydrophobicContact CB-CB 4.24Å; A181-M270 HydrophobicContact CB-CE 3.52Å; A181-M270 HydrophobicContact CB-CG 4.1Å |
| 182 | F | 98.3 | Very high | 95.7 | Very high | 46 Ų | 46 | 40.8 Ų | 40.8 | 20% | 0.202 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -57.5 | -49.9 | 171.4 | 165.4 | -115.6 | 0 | 0 | 0 | 111.3 | A178 A179 G184 L185 L186 S267 M270 L271 | A178-F182 WeakPolarHBondContact O-CB 3.24Å; A178-F182 PolarHBondContact O-N 3.47Å; A179-F182 PolarHBondContact O-N 3.38Å; F182-G184 VanDerWaalsContact C-N 3.35Å; F182-G184 PolarHBondContact O-N 3.19Å; F182-L185 PolarHBondContact O-N 3.39Å; F182-L186 HydrophobicContact CE1-CD2 4.27Å; F182-L186 HydrophobicContact CE2-CD2 4.19Å; F182-L186 HydrophobicContact CZ-CD2 3.77Å; F182-L186 VanDerWaalsContact O-CB 3.24Å; F182-L186 WeakPolarHBondContact O-CB 3.22Å; F182-L186 PolarHBondContact O-N 2.92Å; F182-S267 WeakPolarHBondContact CD2-O 3.34Å; F182-M270 HydrophobicContact CB-CB 4.13Å; F182-L271 HydrophobicContact CD1-CD1 4.38Å; F182-L271 HydrophobicContact CD2-CB 3.92Å; F182-L271 HydrophobicContact CE1-CD1 4.37Å; F182-L271 HydrophobicContact CE2-CB 4.18Å; F182-L271 HydrophobicContact CE2-CD2 4.33Å; F182-L271 HydrophobicContact CG-CB 4.31Å; F182-L271 HydrophobicContact CZ-CD2 4.4Å |
| 183 | I | 97.7 | Very high | 95.3 | Very high | 86 Ų | 86 | 37.1 Ų | 37.1 | 44% | 0.441 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -61.1 | -43.5 | 176.5 | -67.1 | 164.4 | 0 | 0 | 0 | 110.6 | A179 V180 L185 L186 T187 L204 | A179-I183 VanDerWaalsContact O-CG1 3.3Å; A179-I183 WeakPolarHBondContact O-CG1 3.19Å; A179-I183 PolarHBondContact O-N 3.25Å; V180-I183 PolarHBondContact O-N 3.14Å; I183-L185 PolarHBondContact O-N 3.25Å; I183-L186 PolarHBondContact O-N 3.14Å; I183-T187 WeakPolarHBondContact O-CB 3.5Å; I183-T187 PolarHBondContact O-N 3.29Å; I183-T187 PolarHBondContact O-OG1 3.02Å; I183-L204 HydrophobicContact CG2-CD2 4.41Å |
| 184 | G | 97.3 | Very high | 94.9 | Very high | 0 Ų | 0 | 38.1 Ų | 38.1 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -54.8 | -52.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | V180 A181 F182 T188 T200 | V180-G184 PolarHBondContact O-N 3.17Å; A181-G184 PolarHBondContact O-N 3.23Å; F182-G184 VanDerWaalsContact C-N 3.35Å; F182-G184 PolarHBondContact O-N 3.19Å; G184-T188 WeakPolarHBondContact O-CB 3.29Å; G184-T188 PolarHBondContact O-N 3.25Å; G184-T188 PolarHBondContact O-OG1 3.38Å; G184-T200 CarbonylContact C-O 3.29Å; G184-T200 WeakPolarHBondContact CA-O 3.4Å |
| 185 | L | 96.4 | Very high | 94.5 | Very high | 0 Ų | 0 | 44.2 Ų | 44.2 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -67 | -42.4 | 177.5 | -66.2 | 176 | 0 | 0 | 0 | 112.4 | I116 A181 F182 I183 T188 S189 Y201 F205 F263 L266 M270 | I116-L185 HydrophobicContact CD1-CD1 4.05Å; A181-L185 PolarHBondContact O-N 3.09Å; F182-L185 PolarHBondContact O-N 3.39Å; I183-L185 PolarHBondContact O-N 3.25Å; L185-T188 WeakPolarHBondContact O-CB 3.48Å; L185-T188 PolarHBondContact O-N 3.06Å; L185-S189 PolarHBondContact O-N 3.04Å; L185-S189 VanDerWaalsContact O-N 3.1Å; L185-Y201 HydrophobicContact CD2-CD2 3.65Å; L185-Y201 HydrophobicContact CD2-CE2 3.68Å; L185-F205 HydrophobicContact CD1-CD2 3.71Å; L185-F205 HydrophobicContact CD1-CE2 3.69Å; L185-F205 HydrophobicContact CD2-CB 4.24Å; L185-F205 HydrophobicContact CD2-CD1 4.17Å; L185-F205 HydrophobicContact CD2-CD2 3.76Å; L185-F205 HydrophobicContact CD2-CE2 4.15Å; L185-F205 HydrophobicContact CD2-CG 3.78Å; L185-F205 HydrophobicContact CG-CB 4.31Å; L185-F205 HydrophobicContact CG-CD2 3.5Å; L185-F205 HydrophobicContact CG-CE2 4Å; L185-F205 HydrophobicContact CG-CG 3.95Å; L185-F263 HydrophobicContact CD2-CD1 4.4Å; L185-L266 HydrophobicContact CD1-CB 4.17Å; L185-L266 WeakPolarHBondContact CD1-O 3.22Å; L185-M270 HydrophobicContact CD1-CG 3.74Å |
| 186 | L | 97 | Very high | 94.3 | Very high | 54 Ų | 54 | 46 Ų | 46 | 28% | 0.283 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -63.2 | -45.2 | 179.6 | -177.1 | 61 | 0 | 0 | 0 | 111.6 | F182 I183 T188 S189 F190 Q264 | F182-L186 HydrophobicContact CE1-CD2 4.27Å; F182-L186 HydrophobicContact CE2-CD2 4.19Å; F182-L186 HydrophobicContact CZ-CD2 3.77Å; F182-L186 VanDerWaalsContact O-CB 3.24Å; F182-L186 WeakPolarHBondContact O-CB 3.22Å; F182-L186 PolarHBondContact O-N 2.92Å; I183-L186 PolarHBondContact O-N 3.14Å; L186-T188 VanDerWaalsContact C-N 3.32Å; L186-T188 PolarHBondContact O-N 3.31Å; L186-S189 WeakPolarHBondContact O-CB 3.17Å; L186-S189 PolarHBondContact O-N 3.4Å; L186-S189 PolarHBondContact O-OG 2.87Å; L186-F190 HydrophobicContact CD1-CE2 4.04Å; L186-F190 HydrophobicContact CG-CE2 4.27Å; L186-F190 WeakPolarHBondContact O-CD2 3.46Å; L186-F190 WeakPolarHBondContact O-CE2 3.41Å; L186-Q264 HydrophobicContact CD1-CG 4.2Å |
| 187 | T | 96.3 | Very high | 94 | Very high | 57 Ų | 57 | 42.3 Ų | 42.3 | 35% | 0.35 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -67.3 | -32.7 | 174.4 | -53 | 0 | 0 | 0 | 0 | 111.8 | I183 S189 F190 A191 T200 | I183-T187 WeakPolarHBondContact O-CB 3.5Å; I183-T187 PolarHBondContact O-N 3.29Å; I183-T187 PolarHBondContact O-OG1 3.02Å; T187-S189 PolarHBondContact O-N 2.91Å; T187-F190 PolarHBondContact O-N 3.04Å; T187-F190 VanDerWaalsContact O-N 3.12Å; T187-A191 PolarHBondContact O-N 2.92Å; T187-T200 HydrophobicContact CG2-CG2 3.73Å |
| 188 | T | 95.6 | Very high | 93.8 | Very high | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -58.6 | -35.1 | 171.9 | -55.2 | 0 | 0 | 0 | 0 | 111.7 | G184 L185 L186 F190 A191 R197 T200 Y201 F263 | G184-T188 WeakPolarHBondContact O-CB 3.29Å; G184-T188 PolarHBondContact O-N 3.25Å; G184-T188 PolarHBondContact O-OG1 3.38Å; L185-T188 WeakPolarHBondContact O-CB 3.48Å; L185-T188 PolarHBondContact O-N 3.06Å; L186-T188 VanDerWaalsContact C-N 3.32Å; L186-T188 PolarHBondContact O-N 3.31Å; T188-F190 PolarHBondContact O-N 2.92Å; T188-F190 VanDerWaalsContact O-N 3.16Å; T188-A191 WeakPolarHBondContact O-CB 3.41Å; T188-A191 PolarHBondContact O-N 2.88Å; T188-R197 HydrophobicContact CG2-CG 4.31Å; T188-T200 WeakPolarHBondContact CA-OG1 3.36Å; T188-T200 WeakPolarHBondContact CB-OG1 3.42Å; T188-T200 WeakPolarHBondContact OG1-CB 3.44Å; T188-T200 PolarHBondContact OG1-OG1 3.28Å; T188-Y201 HydrophobicContact CG2-CD2 4.39Å; T188-Y201 PolarHBondContact OG1-N 2.94Å; T188-F263 HydrophobicContact CG2-CD1 4.01Å; T188-F263 HydrophobicContact CG2-CD2 3.71Å; T188-F263 HydrophobicContact CG2-CE1 3.9Å; T188-F263 HydrophobicContact CG2-CE2 3.56Å; T188-F263 HydrophobicContact CG2-CG 3.94Å; T188-F263 HydrophobicContact CG2-CZ 3.68Å |
| 189 | S | 94.8 | Very high | 93.7 | Very high | 1 Ų | 1 | 50.2 Ų | 50.2 | 1% | 0.007 | 26% | 0.262 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62.3 | -21.7 | 177.5 | 80.4 | 0 | 0 | 0 | 0 | 115 | L185 L186 T187 S260 Q264 | L185-S189 PolarHBondContact O-N 3.04Å; L185-S189 VanDerWaalsContact O-N 3.1Å; L186-S189 WeakPolarHBondContact O-CB 3.17Å; L186-S189 PolarHBondContact O-N 3.4Å; L186-S189 PolarHBondContact O-OG 2.87Å; T187-S189 PolarHBondContact O-N 2.91Å; S189-S260 VanDerWaalsContact CB-O 3.29Å; S189-S260 WeakPolarHBondContact CB-O 3.44Å; S189-S260 VanDerWaalsContact O-CB 3.26Å; S189-S260 WeakPolarHBondContact O-CB 3.45Å; S189-S260 PolarHBondContact O-OG 3.27Å; S189-Q264 WeakPolarHBondContact OG-CG 3.32Å; S189-Q264 PolarHBondContact OG-NE2 3.46Å |
| 190 | F | 93.1 | Very high | 93.7 | Very high | 136 Ų | 136 | 48.6 Ų | 48.6 | 60% | 0.596 | 25% | 0.248 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -106.4 | 3 | 177.2 | -54 | -72.5 | 0 | 0 | 0 | 112.7 | L186 T187 T188 N192 | L186-F190 HydrophobicContact CD1-CE2 4.04Å; L186-F190 HydrophobicContact CG-CE2 4.27Å; L186-F190 WeakPolarHBondContact O-CD2 3.46Å; L186-F190 WeakPolarHBondContact O-CE2 3.41Å; T187-F190 PolarHBondContact O-N 3.04Å; T187-F190 VanDerWaalsContact O-N 3.12Å; T188-F190 PolarHBondContact O-N 2.92Å; T188-F190 VanDerWaalsContact O-N 3.16Å; F190-N192 PolarHBondContact O-N 2.91Å |
| 191 | A | 90 | Very high | 93.5 | Very high | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 23% | 0.232 | C | C | . | . | trans | -85.2 | 99.9 | -173.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | T187 T188 S193 L196 R197 | T187-A191 PolarHBondContact O-N 2.92Å; T188-A191 WeakPolarHBondContact O-CB 3.41Å; T188-A191 PolarHBondContact O-N 2.88Å; A191-S193 VanDerWaalsContact C-N 3.27Å; A191-S193 PolarHBondContact O-N 3.38Å; A191-L196 HydrophobicContact CB-CB 4.14Å; A191-L196 HydrophobicContact CB-CD2 3.74Å; A191-L196 HydrophobicContact CB-CG 3.69Å; A191-R197 HydrophobicContact CB-CG 3.87Å; A191-R197 PolarHBondContact O-NE 2.94Å; A191-R197 PolarHBondContact O-NH2 2.94Å | ||
| 192 | N | 84.3 | Confident | 93.3 | Very high | 130 Ų | 130 | 46 Ų | 46 | 70% | 0.695 | 23% | 0.232 | S | C | * | . | trans | -80.9 | 3.8 | -177.1 | -61.2 | -18.4 | 0 | 0 | 0 | 114.8 | H131 F190 | H131-N192 PolarHBondContact NE2-O 2.98Å; F190-N192 PolarHBondContact O-N 2.91Å | ||
| 193 | S | 86.4 | Confident | 93.2 | Very high | 55 Ų | 55 | 47.2 Ų | 47.2 | 39% | 0.385 | 24% | 0.24 | S | C | . | . | S | Bend | trans | -131.9 | 138.1 | -175.8 | 171.8 | 0 | 0 | 0 | 0 | 111.6 | A191 I195 L196 R197 | A191-S193 VanDerWaalsContact C-N 3.27Å; A191-S193 PolarHBondContact O-N 3.38Å; S193-I195 PolarHBondContact O-N 3.43Å; S193-I195 PolarHBondContact OG-N 2.94Å; S193-L196 WeakPolarHBondContact O-CB 3.4Å; S193-L196 PolarHBondContact O-N 3.46Å; S193-R197 PolarHBondContact O-N 3.38Å |
| 194 | L | 85.6 | Confident | 93.2 | Very high | 27 Ų | 27 | 45.3 Ų | 45.3 | 14% | 0.141 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -56.8 | -36.5 | 176.9 | -63.8 | 179.7 | 0 | 0 | 0 | 112.6 | H131 V143 L196 R197 Y198 | H131-L194 HydrophobicContact CB-CD1 4.44Å; H131-L194 HydrophobicContact CB-CD2 3.99Å; H131-L194 HydrophobicContact CB-CG 4.3Å; V143-L194 HydrophobicContact CG2-CD1 4.32Å; V143-L194 HydrophobicContact CG2-CD2 4.08Å; L194-L196 VanDerWaalsContact C-N 3.32Å; L194-L196 PolarHBondContact O-N 2.95Å; L194-R197 PolarHBondContact O-N 3.2Å; L194-R197 VanDerWaalsContact O-N 3.16Å; L194-Y198 WeakPolarHBondContact O-CD2 3.25Å; L194-Y198 PolarHBondContact O-N 3.46Å |
| 195 | I | 89.2 | Confident | 93.2 | Very high | 128 Ų | 128 | 45.3 Ų | 45.3 | 66% | 0.656 | 23% | 0.231 | S | C | * | . | H | α-helix | trans | -63.6 | -41 | 177.2 | -60.8 | 175.1 | 0 | 0 | 0 | 110.7 | S193 Y198 F199 | S193-I195 PolarHBondContact O-N 3.43Å; S193-I195 PolarHBondContact OG-N 2.94Å; I195-Y198 PolarHBondContact O-N 3.12Å; I195-F199 PolarHBondContact O-N 3.5Å |
| 196 | L | 91.4 | Very high | 93.2 | Very high | 74 Ų | 74 | 45.3 Ų | 45.3 | 39% | 0.387 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -68.8 | -36 | 175.8 | -173.4 | 57.2 | 0 | 0 | 0 | 110.9 | A191 S193 L194 F199 T200 | A191-L196 HydrophobicContact CB-CB 4.14Å; A191-L196 HydrophobicContact CB-CD2 3.74Å; A191-L196 HydrophobicContact CB-CG 3.69Å; S193-L196 WeakPolarHBondContact O-CB 3.4Å; S193-L196 PolarHBondContact O-N 3.46Å; L194-L196 VanDerWaalsContact C-N 3.32Å; L194-L196 PolarHBondContact O-N 2.95Å; L196-F199 PolarHBondContact O-N 3.27Å; L196-F199 VanDerWaalsContact O-N 3.16Å; L196-T200 HydrophobicContact CD1-CG2 3.92Å; L196-T200 HydrophobicContact CG-CG2 4.17Å; L196-T200 WeakPolarHBondContact O-CG2 3.47Å; L196-T200 PolarHBondContact O-N 3.44Å; L196-T200 PolarHBondContact O-OG1 3.16Å; L196-T200 VanDerWaalsContact O-OG1 3.1Å |
| 197 | R | 92.4 | Very high | 93.2 | Very high | 1 Ų | 1 | 44 Ų | 44 | 0% | 0.004 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -66.7 | -37.2 | 174.7 | -66.5 | 179.4 | 178.3 | 174.6 | -3.3 | 113.1 | L127 E130 H131 V146 T188 A191 S193 L194 F199 Y201 G202 | L127-R197 VanDerWaalsContact CD2-NH1 3.34Å; E130-R197 IonicContact OE1-CZ 3.82Å; E130-R197 IonicContact OE1-NH1 2.83Å; E130-R197 PolarHBondContact OE1-NH1 3.46Å; E130-R197 IonicContact OE1-NH2 2.82Å; E130-R197 PolarHBondContact OE1-NH2 2.88Å; H131-R197 PolarHBondContact CE1-NH1 3.41Å; H131-R197 PolarHBondContact ND1-NH1 3.39Å; V146-R197 HydrophobicContact CG1-CB 4.34Å; V146-R197 HydrophobicContact CG2-CB 4.38Å; T188-R197 HydrophobicContact CG2-CG 4.31Å; A191-R197 HydrophobicContact CB-CG 3.87Å; A191-R197 PolarHBondContact O-NE 2.94Å; A191-R197 PolarHBondContact O-NH2 2.94Å; S193-R197 PolarHBondContact O-N 3.38Å; L194-R197 PolarHBondContact O-N 3.2Å; L194-R197 VanDerWaalsContact O-N 3.16Å; R197-F199 VanDerWaalsContact C-N 3.25Å; R197-F199 PolarHBondContact O-N 2.95Å; R197-Y201 WeakPolarHBondContact O-CB 3.37Å; R197-Y201 PolarHBondContact O-N 2.92Å; R197-G202 PolarHBondContact O-N 3.48Å |
| 198 | Y | 92.9 | Very high | 93.2 | Very high | 57 Ų | 57 | 41.4 Ų | 41.4 | 22% | 0.224 | 21% | 0.21 | C | C | . | . | I | π-helix | trans | -58 | -39.7 | 169.5 | -60.5 | -39.5 | 0 | 0 | 0 | 111.6 | K142 W145 V146 L149 L194 I195 G202 I203 | K142-Y198 WeakPolarHBondContact CB-OH 3.46Å; K142-Y198 WeakPolarHBondContact O-CE1 3.46Å; K142-Y198 PolarHBondContact O-OH 3.47Å; K142-Y198 VanDerWaalsContact O-OH 3.06Å; W145-Y198 HydrophobicContact CB-CE1 3.89Å; V146-Y198 HydrophobicContact CB-CD1 4.37Å; V146-Y198 HydrophobicContact CG2-CD1 3.58Å; V146-Y198 HydrophobicContact CG2-CE1 3.61Å; L149-Y198 HydrophobicContact CD1-CD1 4.03Å; L149-Y198 HydrophobicContact CD1-CG 4.24Å; L194-Y198 WeakPolarHBondContact O-CD2 3.25Å; L194-Y198 PolarHBondContact O-N 3.46Å; I195-Y198 PolarHBondContact O-N 3.12Å; Y198-G202 CarbonylContact O-C 3.14Å; Y198-G202 WeakPolarHBondContact O-CA 3.11Å; Y198-G202 PolarHBondContact O-N 3.26Å; Y198-I203 PolarHBondContact O-N 2.95Å |
| 199 | F | 95.6 | Very high | 93.3 | Very high | 111 Ų | 111 | 41.4 Ų | 41.4 | 49% | 0.487 | 21% | 0.21 | S | C | . | . | I | π-helix | trans | -74.7 | -47.2 | 178.6 | -177 | -102.6 | 0 | 0 | 0 | 112.8 | I195 L196 R197 I203 L204 | I195-F199 PolarHBondContact O-N 3.5Å; L196-F199 PolarHBondContact O-N 3.27Å; L196-F199 VanDerWaalsContact O-N 3.16Å; R197-F199 VanDerWaalsContact C-N 3.25Å; R197-F199 PolarHBondContact O-N 2.95Å; F199-I203 HydrophobicContact CD2-CD1 4.4Å; F199-I203 PolarHBondContact O-N 2.99Å; F199-L204 WeakPolarHBondContact O-CB 3.28Å; F199-L204 PolarHBondContact O-N 3.29Å |
| 200 | T | 96.6 | Very high | 93.4 | Very high | 2 Ų | 2 | 41.3 Ų | 41.3 | 1% | 0.012 | 21% | 0.209 | C | C | . | . | I | π-helix | trans | -80.9 | -42.2 | -172.5 | 60.2 | 0 | 0 | 0 | 0 | 113.3 | G184 T187 T188 L196 L204 F205 | G184-T200 CarbonylContact C-O 3.29Å; G184-T200 WeakPolarHBondContact CA-O 3.4Å; T187-T200 HydrophobicContact CG2-CG2 3.73Å; T188-T200 WeakPolarHBondContact CA-OG1 3.36Å; T188-T200 WeakPolarHBondContact CB-OG1 3.42Å; T188-T200 WeakPolarHBondContact OG1-CB 3.44Å; T188-T200 PolarHBondContact OG1-OG1 3.28Å; L196-T200 HydrophobicContact CD1-CG2 3.92Å; L196-T200 HydrophobicContact CG-CG2 4.17Å; L196-T200 WeakPolarHBondContact O-CG2 3.47Å; L196-T200 PolarHBondContact O-N 3.44Å; L196-T200 PolarHBondContact O-OG1 3.16Å; L196-T200 VanDerWaalsContact O-OG1 3.1Å; T200-L204 WeakPolarHBondContact O-CB 3.45Å; T200-F205 PolarHBondContact O-N 2.85Å |
| 201 | Y | 95 | Very high | 93.5 | Very high | 0 Ų | 0 | 36.8 Ų | 36.8 | 0% | 0 | 19% | 0.189 | C | C | . | . | I | π-helix | trans | -89.5 | -51.4 | 178.2 | -171.7 | -83.3 | 0 | 0 | 0 | 110.9 | I116 F120 L123 V146 A150 L185 T188 R197 F205 G206 F263 | I116-Y201 HydrophobicContact CG2-CE2 4.39Å; I116-Y201 WeakPolarHBondContact CG2-OH 3.44Å; F120-Y201 AromaticContact CD2-CE1 3.9Å; F120-Y201 HydrophobicContact CD2-CE1 3.9Å; F120-Y201 AromaticContact CD2-CZ 3.96Å; F120-Y201 HydrophobicContact CE2-CE1 4.05Å; L123-Y201 HydrophobicContact CD1-CE2 4.46Å; V146-Y201 HydrophobicContact CG1-CD1 3.66Å; V146-Y201 HydrophobicContact CG1-CG 3.98Å; V146-Y201 WeakPolarHBondContact O-CD1 3.33Å; A150-Y201 HydrophobicContact CB-CD1 3.72Å; A150-Y201 HydrophobicContact CB-CE1 3.52Å; L185-Y201 HydrophobicContact CD2-CD2 3.65Å; L185-Y201 HydrophobicContact CD2-CE2 3.68Å; T188-Y201 HydrophobicContact CG2-CD2 4.39Å; T188-Y201 PolarHBondContact OG1-N 2.94Å; R197-Y201 WeakPolarHBondContact O-CB 3.37Å; R197-Y201 PolarHBondContact O-N 2.92Å; Y201-F205 HydrophobicContact CD2-CD1 4.36Å; Y201-F205 HydrophobicContact CE1-CD1 4.39Å; Y201-F205 HydrophobicContact CE2-CD1 4.22Å; Y201-F205 HydrophobicContact CE2-CE1 4.33Å; Y201-F205 WeakPolarHBondContact O-CB 3.26Å; Y201-G206 PolarHBondContact O-N 3.32Å; Y201-F263 HydrophobicContact CD2-CD1 4.25Å; Y201-F263 AromaticContact CD2-CE1 3.6Å; Y201-F263 HydrophobicContact CD2-CE1 3.6Å; Y201-F263 HydrophobicContact CD2-CZ 4.35Å; Y201-F263 HydrophobicContact CE2-CD1 4.4Å; Y201-F263 AromaticContact CE2-CE1 3.72Å; Y201-F263 HydrophobicContact CE2-CE1 3.72Å |
| 202 | G | 93.8 | Very high | 93.9 | Very high | 0 Ų | 0 | 36.8 Ų | 36.8 | 0% | 0 | 19% | 0.189 | C | C | . | . | I | π-helix | trans | -63.1 | -64.1 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | A150 R197 Y198 G206 | A150-G202 WeakPolarHBondContact CA-O 3.5Å; R197-G202 PolarHBondContact O-N 3.48Å; Y198-G202 CarbonylContact O-C 3.14Å; Y198-G202 WeakPolarHBondContact O-CA 3.11Å; Y198-G202 PolarHBondContact O-N 3.26Å; G202-G206 PolarHBondContact O-N 2.95Å |
| 203 | I | 95.5 | Very high | 94.4 | Very high | 73 Ų | 73 | 31.1 Ų | 31.1 | 37% | 0.374 | 16% | 0.158 | S | C | . | . | I | π-helix | trans | -81.3 | -55.5 | -174.3 | -61.4 | 173 | 0 | 0 | 0 | 111.8 | Y198 F199 C207 | Y198-I203 PolarHBondContact O-N 2.95Å; F199-I203 HydrophobicContact CD2-CD1 4.4Å; F199-I203 PolarHBondContact O-N 2.99Å; I203-C207 WeakPolarHBondContact O-CB 3.13Å; I203-C207 PolarHBondContact O-N 3.5Å; I203-C207 PolarHBondContact O-SG 2.95Å |
| 204 | L | 96.9 | Very high | 94.8 | Very high | 46 Ų | 46 | 28.5 Ų | 28.5 | 24% | 0.241 | 14% | 0.14 | C | C | . | . | I | π-helix | trans | -72.7 | -47.9 | -167.8 | -169.9 | 62.2 | 0 | 0 | 0 | 112.7 | V180 I183 F199 T200 G208 | V180-L204 HydrophobicContact CG1-CD1 3.62Å; V180-L204 HydrophobicContact CG1-CG 4.17Å; I183-L204 HydrophobicContact CG2-CD2 4.41Å; F199-L204 WeakPolarHBondContact O-CB 3.28Å; F199-L204 PolarHBondContact O-N 3.29Å; T200-L204 WeakPolarHBondContact O-CB 3.45Å; L204-G208 PolarHBondContact O-N 3.3Å |
| 205 | F | 97.4 | Very high | 95.2 | Very high | 0 Ų | 0 | 27.2 Ų | 27.2 | 0% | 0 | 13% | 0.133 | C | C | . | . | I | π-helix | trans | -67.8 | -38.9 | 172.7 | 161.6 | -100.9 | 0 | 0 | 0 | 112.6 | I116 A150 A181 L185 T200 Y201 G208 S209 M270 | I116-F205 HydrophobicContact CB-CZ 4.28Å; I116-F205 HydrophobicContact CD1-CE2 4.43Å; I116-F205 HydrophobicContact CD1-CZ 4.38Å; I116-F205 HydrophobicContact CG2-CE1 4.04Å; I116-F205 HydrophobicContact CG2-CZ 3.72Å; A150-F205 HydrophobicContact CB-CD1 4.29Å; A181-F205 HydrophobicContact CB-CD2 3.95Å; A181-F205 HydrophobicContact CB-CE2 4.46Å; L185-F205 HydrophobicContact CD1-CD2 3.71Å; L185-F205 HydrophobicContact CD1-CE2 3.69Å; L185-F205 HydrophobicContact CD2-CB 4.24Å; L185-F205 HydrophobicContact CD2-CD1 4.17Å; L185-F205 HydrophobicContact CD2-CD2 3.76Å; L185-F205 HydrophobicContact CD2-CE2 4.15Å; L185-F205 HydrophobicContact CD2-CG 3.78Å; L185-F205 HydrophobicContact CG-CB 4.31Å; L185-F205 HydrophobicContact CG-CD2 3.5Å; L185-F205 HydrophobicContact CG-CE2 4Å; L185-F205 HydrophobicContact CG-CG 3.95Å; T200-F205 PolarHBondContact O-N 2.85Å; Y201-F205 HydrophobicContact CD2-CD1 4.36Å; Y201-F205 HydrophobicContact CE1-CD1 4.39Å; Y201-F205 HydrophobicContact CE2-CD1 4.22Å; Y201-F205 HydrophobicContact CE2-CE1 4.33Å; Y201-F205 WeakPolarHBondContact O-CB 3.26Å; F205-G208 PolarHBondContact O-N 3.48Å; F205-S209 WeakPolarHBondContact CD2-OG 3.29Å; F205-S209 WeakPolarHBondContact CE2-OG 3.25Å; F205-S209 WeakPolarHBondContact CZ-OG 3.23Å; F205-S209 WeakPolarHBondContact O-CB 3.32Å; F205-S209 PolarHBondContact O-N 3.5Å; F205-S209 PolarHBondContact O-OG 2.87Å; F205-M270 HydrophobicContact CE2-CE 4.5Å; F205-M270 HydrophobicContact CE2-CG 4.19Å; F205-M270 HydrophobicContact CE2-SD 4.31Å |
| 206 | G | 96.4 | Very high | 95.4 | Very high | 0 Ų | 0 | 21.1 Ų | 21.1 | 0% | 0 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -59.9 | -49.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | Y201 G202 S209 S210 | Y201-G206 PolarHBondContact O-N 3.32Å; G202-G206 PolarHBondContact O-N 2.95Å; G206-S209 PolarHBondContact O-N 3.23Å; G206-S210 PolarHBondContact O-N 3.1Å |
| 207 | C | 96.9 | Very high | 95.5 | Very high | 27 Ų | 27 | 18 Ų | 18 | 18% | 0.182 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -59.1 | -51.9 | 173 | -75.9 | 0 | 0 | 0 | 0 | 112.2 | M153 I203 S209 S210 F211 | M153-C207 WeakPolarHBondContact CE-SG 3.22Å; I203-C207 WeakPolarHBondContact O-CB 3.13Å; I203-C207 PolarHBondContact O-N 3.5Å; I203-C207 PolarHBondContact O-SG 2.95Å; C207-S209 VanDerWaalsContact C-N 3.27Å; C207-S209 PolarHBondContact O-N 3.27Å; C207-S210 VanDerWaalsContact O-CB 3.28Å; C207-S210 WeakPolarHBondContact O-CB 3.25Å; C207-S210 PolarHBondContact O-N 3.18Å; C207-S210 VanDerWaalsContact O-N 3.12Å; C207-F211 WeakPolarHBondContact O-CD2 3.38Å; C207-F211 PolarHBondContact O-N 2.88Å |
| 208 | G | 97.4 | Very high | 95.4 | Very high | 1 Ų | 1 | 18.2 Ų | 18.2 | 1% | 0.01 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -58.3 | -41.5 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | G177 L204 F205 F211 A212 | G177-G208 CarbonylContact C-O 3.53Å; G177-G208 VanDerWaalsContact CA-O 3.25Å; G177-G208 WeakPolarHBondContact CA-O 3.35Å; G177-G208 CarbonylContact O-C 3.58Å; G177-G208 VanDerWaalsContact O-C 3.29Å; G177-G208 WeakPolarHBondContact O-CA 3.41Å; G177-G208 VanDerWaalsContact O-O 3.07Å; L204-G208 PolarHBondContact O-N 3.3Å; F205-G208 PolarHBondContact O-N 3.48Å; G208-F211 PolarHBondContact O-N 2.88Å; G208-A212 PolarHBondContact O-N 3.05Å |
| 209 | S | 97.1 | Very high | 95.4 | Very high | 0 Ų | 0 | 15.5 Ų | 15.5 | 0% | 0 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -64.6 | -40.9 | 175.2 | -64.5 | 0 | 0 | 0 | 0 | 112.1 | I113 F205 G206 C207 F211 A212 F213 | I113-S209 WeakPolarHBondContact CD1-O 3.43Å; F205-S209 WeakPolarHBondContact CD2-OG 3.29Å; F205-S209 WeakPolarHBondContact CE2-OG 3.25Å; F205-S209 WeakPolarHBondContact CZ-OG 3.23Å; F205-S209 WeakPolarHBondContact O-CB 3.32Å; F205-S209 PolarHBondContact O-N 3.5Å; F205-S209 PolarHBondContact O-OG 2.87Å; G206-S209 PolarHBondContact O-N 3.23Å; C207-S209 VanDerWaalsContact C-N 3.27Å; C207-S209 PolarHBondContact O-N 3.27Å; S209-F211 VanDerWaalsContact C-N 3.34Å; S209-F211 PolarHBondContact O-N 3.36Å; S209-A212 PolarHBondContact O-N 3.47Å; S209-F213 WeakPolarHBondContact O-CB 3.4Å; S209-F213 PolarHBondContact O-N 3.25Å |
| 210 | S | 96.9 | Very high | 95.2 | Very high | 0 Ų | 0 | 10.2 Ų | 10.2 | 0% | 0 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -55.1 | -48.9 | 170.7 | -161.3 | 0 | 0 | 0 | 0 | 111.8 | I154 C157 S158 G206 C207 A212 F213 Q214 | I154-S210 WeakPolarHBondContact O-CB 3.22Å; I154-S210 PolarHBondContact O-OG 3.24Å; C157-S210 WeakPolarHBondContact CB-OG 3.22Å; S158-S210 PolarHBondContact N-OG 2.95Å; G206-S210 PolarHBondContact O-N 3.1Å; C207-S210 VanDerWaalsContact O-CB 3.28Å; C207-S210 WeakPolarHBondContact O-CB 3.25Å; C207-S210 PolarHBondContact O-N 3.18Å; C207-S210 VanDerWaalsContact O-N 3.12Å; S210-A212 VanDerWaalsContact C-N 3.27Å; S210-A212 PolarHBondContact O-N 3.14Å; S210-F213 PolarHBondContact O-N 3.1Å; S210-Q214 PolarHBondContact O-N 3Å |
| 211 | F | 96.6 | Very high | 94.8 | Very high | 41 Ų | 41 | 10.4 Ų | 10.4 | 18% | 0.18 | 6% | 0.056 | C | C | . | . | H | α-helix | trans | -65.2 | -25.1 | 179.4 | -88.7 | -100.5 | 0 | 0 | 0 | 113.6 | V160 V161 F164 T173 A174 C207 G208 S209 P215 | V160-F211 HydrophobicContact CG1-CZ 4.41Å; V161-F211 HydrophobicContact CG2-CB 4.34Å; V161-F211 HydrophobicContact CG2-CD1 4.27Å; V161-F211 HydrophobicContact CG2-CD2 3.51Å; V161-F211 HydrophobicContact CG2-CE1 4.48Å; V161-F211 HydrophobicContact CG2-CE2 3.76Å; V161-F211 HydrophobicContact CG2-CG 3.78Å; V161-F211 HydrophobicContact CG2-CZ 4.24Å; F164-F211 HydrophobicContact CB-CE1 3.9Å; F164-F211 AromaticContact CD1-CE1 3.88Å; F164-F211 HydrophobicContact CD1-CE1 3.88Å; F164-F211 HydrophobicContact CD1-CZ 4.5Å; F164-F211 HydrophobicContact CD2-CE1 4.2Å; F164-F211 HydrophobicContact CD2-CZ 4.25Å; F164-F211 HydrophobicContact CE1-CE1 4.47Å; F164-F211 AromaticContact CG-CE1 3.73Å; F164-F211 HydrophobicContact CG-CE1 3.73Å; F164-F211 HydrophobicContact CG-CZ 4.24Å; T173-F211 CarbonylContact C-O 3.57Å; T173-F211 HydrophobicContact CG2-CD1 3.65Å; T173-F211 HydrophobicContact CG2-CE1 4.24Å; A174-F211 WeakPolarHBondContact CA-O 3.47Å; C207-F211 WeakPolarHBondContact O-CD2 3.38Å; C207-F211 PolarHBondContact O-N 2.88Å; G208-F211 PolarHBondContact O-N 2.88Å; S209-F211 VanDerWaalsContact C-N 3.34Å; S209-F211 PolarHBondContact O-N 3.36Å; F211-P215 VanDerWaalsContact O-CD 3.3Å; F211-P215 WeakPolarHBondContact O-CD 3.48Å; F211-P215 VanDerWaalsContact O-CG 3.29Å; F211-P215 WeakPolarHBondContact O-CG 3.4Å |
| 212 | A | 96.8 | Very high | 94.5 | Very high | 0 Ų | 0 | 11.3 Ų | 11.3 | 0% | 0 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -84.7 | -43.9 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | C109 I113 A178 G208 S209 S210 | C109-A212 VanDerWaalsContact SG-C 3.57Å; C109-A212 PolarHBondContact SG-O 3.24Å; C109-A212 VanDerWaalsContact SG-O 3.39Å; I113-A212 HydrophobicContact CD1-CB 4.16Å; A178-A212 HydrophobicContact CB-CB 4.26Å; G208-A212 PolarHBondContact O-N 3.05Å; S209-A212 PolarHBondContact O-N 3.47Å; S210-A212 VanDerWaalsContact C-N 3.27Å; S210-A212 PolarHBondContact O-N 3.14Å |
| 213 | F | 95.7 | Very high | 94.3 | Very high | 10 Ų | 10 | 11.6 Ų | 11.6 | 4% | 0.044 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -64.9 | -57.4 | -172.5 | 169.1 | -128.7 | 0 | 0 | 0 | 112.8 | N110 I113 F114 I154 F155 S209 S210 S216 L217 L466 | N110-F213 VanDerWaalsContact OD1-CE2 3.3Å; N110-F213 WeakPolarHBondContact OD1-CE2 3.31Å; I113-F213 HydrophobicContact CD1-CB 3.97Å; F114-F213 HydrophobicContact CE2-CD2 4.12Å; F114-F213 HydrophobicContact CE2-CE1 4.37Å; F114-F213 AromaticContact CE2-CE2 3.72Å; F114-F213 HydrophobicContact CE2-CE2 3.72Å; F114-F213 AromaticContact CE2-CZ 3.84Å; F114-F213 HydrophobicContact CE2-CZ 3.84Å; F114-F213 HydrophobicContact CZ-CE1 4.21Å; F114-F213 HydrophobicContact CZ-CE2 4.36Å; F114-F213 HydrophobicContact CZ-CZ 4.04Å; I154-F213 HydrophobicContact CG2-CD1 4.21Å; F155-F213 HydrophobicContact CE1-CE1 4.38Å; S209-F213 WeakPolarHBondContact O-CB 3.4Å; S209-F213 PolarHBondContact O-N 3.25Å; S210-F213 PolarHBondContact O-N 3.1Å; F213-S216 WeakPolarHBondContact O-CB 3.2Å; F213-S216 PolarHBondContact O-N 2.98Å; F213-S216 PolarHBondContact O-OG 2.9Å; F213-L217 HydrophobicContact CD2-CG 4.47Å; F213-L217 HydrophobicContact CE1-CD1 4.36Å; F213-L217 HydrophobicContact CE2-CD1 3.77Å; F213-L217 HydrophobicContact CE2-CD2 4.12Å; F213-L217 HydrophobicContact CE2-CG 3.97Å; F213-L217 HydrophobicContact CZ-CD1 3.66Å; F213-L217 HydrophobicContact CZ-CG 4.37Å; F213-L217 PolarHBondContact O-N 3.38Å; F213-L466 HydrophobicContact CE1-CD1 3.93Å; F213-L466 HydrophobicContact CE1-CD2 4.15Å |
| 214 | Q | 94.3 | Very high | 94 | Very high | 0 Ų | 0 | 8.2 Ų | 8.2 | 0% | 0 | 4% | 0.044 | C | C | . | . | H | α-helix | trans | -62 | -44.8 | -172.1 | 172.8 | 177.3 | -15.2 | 0 | 0 | 113.7 | S158 V161 S162 S210 S216 L217 V218 S459 I462 | S158-Q214 VanDerWaalsContact C-OE1 3.29Å; S158-Q214 PolarHBondContact O-OE1 2.84Å; V161-Q214 HydrophobicContact CB-CB 4.5Å; V161-Q214 HydrophobicContact CG1-CB 3.91Å; V161-Q214 HydrophobicContact CG1-CG 4.35Å; S162-Q214 VanDerWaalsContact CA-NE2 3.29Å; S162-Q214 PolarHBondContact OG-NE2 3.33Å; S210-Q214 PolarHBondContact O-N 3Å; Q214-S216 PolarHBondContact O-N 3.39Å; Q214-L217 PolarHBondContact O-N 3.15Å; Q214-V218 HydrophobicContact CG-CG2 4.3Å; Q214-V218 WeakPolarHBondContact O-CG2 3.49Å; Q214-V218 PolarHBondContact O-N 3.03Å; Q214-V218 VanDerWaalsContact O-N 3.12Å; Q214-S459 PolarHBondContact NE2-O 3.36Å; Q214-I462 HydrophobicContact CG-CG2 4.29Å |
| 215 | P | 93.9 | Very high | 93.5 | Very high | 0 Ų | 0 | 14.9 Ų | 14.9 | 0% | 0 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -60.3 | -27.8 | 175.4 | -22.7 | 32.9 | 0 | 0 | 0 | 113.4 | V161 T165 C170 T173 A174 F211 L217 V218 I219 | V161-P215 HydrophobicContact CG1-CG 4.19Å; T165-P215 HydrophobicContact CG2-CB 4.4Å; T165-P215 HydrophobicContact CG2-CG 4.47Å; C170-P215 HydrophobicContact CB-CB 4.04Å; T173-P215 HydrophobicContact CG2-CG 3.86Å; A174-P215 HydrophobicContact CB-CB 4.1Å; A174-P215 HydrophobicContact CB-CG 4.36Å; F211-P215 VanDerWaalsContact O-CD 3.3Å; F211-P215 WeakPolarHBondContact O-CD 3.48Å; F211-P215 VanDerWaalsContact O-CG 3.29Å; F211-P215 WeakPolarHBondContact O-CG 3.4Å; P215-L217 VanDerWaalsContact C-N 3.29Å; P215-L217 PolarHBondContact O-N 3.47Å; P215-V218 PolarHBondContact O-N 3.34Å; P215-I219 WeakPolarHBondContact O-CB 3.48Å; P215-I219 WeakPolarHBondContact O-CG2 3.23Å; P215-I219 PolarHBondContact O-N 3.17Å |
| 216 | S | 94.6 | Very high | 93 | Very high | 0 Ų | 0 | 21.7 Ų | 21.7 | 0% | 0 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -69.5 | -24.5 | 177.1 | 84.5 | 0 | 0 | 0 | 0 | 113.3 | A106 F213 Q214 L220 | A106-S216 WeakPolarHBondContact CB-O 3.44Å; F213-S216 WeakPolarHBondContact O-CB 3.2Å; F213-S216 PolarHBondContact O-N 2.98Å; F213-S216 PolarHBondContact O-OG 2.9Å; Q214-S216 PolarHBondContact O-N 3.39Å; S216-L220 WeakPolarHBondContact O-CG 3.4Å |
| 217 | L | 92.3 | Very high | 92.7 | Very high | 10 Ų | 10 | 27.8 Ų | 27.8 | 5% | 0.052 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -81.6 | -43.9 | 169.7 | -58.9 | -177.8 | 0 | 0 | 0 | 111.6 | F213 Q214 P215 I219 L220 V235 I462 | F213-L217 HydrophobicContact CD2-CG 4.47Å; F213-L217 HydrophobicContact CE1-CD1 4.36Å; F213-L217 HydrophobicContact CE2-CD1 3.77Å; F213-L217 HydrophobicContact CE2-CD2 4.12Å; F213-L217 HydrophobicContact CE2-CG 3.97Å; F213-L217 HydrophobicContact CZ-CD1 3.66Å; F213-L217 HydrophobicContact CZ-CG 4.37Å; F213-L217 PolarHBondContact O-N 3.38Å; Q214-L217 PolarHBondContact O-N 3.15Å; P215-L217 VanDerWaalsContact C-N 3.29Å; P215-L217 PolarHBondContact O-N 3.47Å; L217-I219 PolarHBondContact O-N 3.43Å; L217-L220 WeakPolarHBondContact O-CB 3.26Å; L217-L220 WeakPolarHBondContact O-CG 3.03Å; L217-L220 PolarHBondContact O-N 3.02Å; L217-V235 HydrophobicContact CD2-CG1 4.39Å; L217-I462 HydrophobicContact CD1-CG2 4.28Å |
| 218 | V | 91.5 | Very high | 92.4 | Very high | 4 Ų | 4 | 27 Ų | 27 | 2% | 0.024 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -62.4 | -44 | -177.2 | 175.7 | 0 | 0 | 0 | 0 | 111.4 | T165 Q214 P215 L220 G221 H222 I462 | T165-V218 HydrophobicContact CG2-CG1 4.39Å; Q214-V218 HydrophobicContact CG-CG2 4.3Å; Q214-V218 WeakPolarHBondContact O-CG2 3.49Å; Q214-V218 PolarHBondContact O-N 3.03Å; Q214-V218 VanDerWaalsContact O-N 3.12Å; P215-V218 PolarHBondContact O-N 3.34Å; V218-L220 PolarHBondContact O-N 2.95Å; V218-L220 VanDerWaalsContact O-N 3.15Å; V218-G221 PolarHBondContact O-N 3.45Å; V218-H222 PolarHBondContact O-CD2 3.44Å; V218-I462 HydrophobicContact CG2-CD1 4.32Å |
| 219 | I | 92.1 | Very high | 92.1 | Very high | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 11% | 0.114 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -62.1 | -24.6 | -177.3 | -165 | 64.9 | 0 | 0 | 0 | 113 | V102 C170 P215 L217 G221 H222 Y223 F280 | V102-I219 HydrophobicContact CG1-CB 4.4Å; V102-I219 HydrophobicContact CG1-CG1 3.89Å; V102-I219 HydrophobicContact CG1-CG2 3.62Å; C170-I219 HydrophobicContact CB-CB 4.39Å; C170-I219 HydrophobicContact CB-CD1 4.16Å; P215-I219 WeakPolarHBondContact O-CB 3.48Å; P215-I219 WeakPolarHBondContact O-CG2 3.23Å; P215-I219 PolarHBondContact O-N 3.17Å; L217-I219 PolarHBondContact O-N 3.43Å; I219-G221 VanDerWaalsContact C-N 3.33Å; I219-G221 PolarHBondContact O-N 3.11Å; I219-H222 HydrophobicContact CD1-CB 4.17Å; I219-H222 WeakPolarHBondContact O-CB 3.31Å; I219-H222 PolarHBondContact O-N 3.32Å; I219-Y223 HydrophobicContact CD1-CE2 4.17Å; I219-Y223 HydrophobicContact CG1-CD2 4.29Å; I219-Y223 HydrophobicContact CG1-CE2 4.12Å; I219-Y223 WeakPolarHBondContact O-CD2 3.48Å; I219-F280 HydrophobicContact CD1-CB 4.5Å; I219-F280 HydrophobicContact CG1-CB 4.15Å; I219-F280 HydrophobicContact CG1-CG 4.33Å; I219-F280 HydrophobicContact CG2-CD1 4.14Å; I219-F280 HydrophobicContact CG2-CD2 4.42Å; I219-F280 HydrophobicContact CG2-CE1 4.17Å; I219-F280 HydrophobicContact CG2-CE2 4.46Å; I219-F280 HydrophobicContact CG2-CG 4.27Å; I219-F280 HydrophobicContact CG2-CZ 4.34Å |
| 220 | L | 91.9 | Very high | 92 | Very high | 1 Ų | 1 | 29.2 Ų | 29.2 | 1% | 0.005 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -60.6 | -43.9 | 178.4 | -52.1 | 177.9 | 0 | 0 | 0 | 111.2 | A106 S216 L217 V218 H222 Y223 F224 L228 V231 N232 V235 | A106-L220 HydrophobicContact CB-CD2 3.98Å; S216-L220 WeakPolarHBondContact O-CG 3.4Å; L217-L220 WeakPolarHBondContact O-CB 3.26Å; L217-L220 WeakPolarHBondContact O-CG 3.03Å; L217-L220 PolarHBondContact O-N 3.02Å; V218-L220 PolarHBondContact O-N 2.95Å; V218-L220 VanDerWaalsContact O-N 3.15Å; L220-H222 PolarHBondContact O-N 3.41Å; L220-Y223 PolarHBondContact O-N 2.82Å; L220-F224 PolarHBondContact O-N 2.94Å; L220-L228 HydrophobicContact CB-CD1 3.87Å; L220-V231 HydrophobicContact CB-CG1 4.1Å; L220-V231 HydrophobicContact CD1-CG1 4.19Å; L220-V231 HydrophobicContact CD2-CG1 3.9Å; L220-V231 HydrophobicContact CG-CG1 4.26Å; L220-N232 HydrophobicContact CD1-CB 4.49Å; L220-V235 HydrophobicContact CD1-CB 4.24Å; L220-V235 HydrophobicContact CD1-CG1 4.46Å; L220-V235 HydrophobicContact CD1-CG2 3.88Å; L220-V235 HydrophobicContact CD2-CG2 4.08Å |
| 221 | G | 88.1 | Confident | 91.9 | Very high | 6 Ų | 6 | 29.2 Ų | 29.2 | 6% | 0.062 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -71 | -6.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | V218 I219 F224 | V218-G221 PolarHBondContact O-N 3.45Å; I219-G221 VanDerWaalsContact C-N 3.33Å; I219-G221 PolarHBondContact O-N 3.11Å; G221-F224 WeakPolarHBondContact CA-O 3.16Å |
| 222 | H | 88.1 | Confident | 91.8 | Very high | 18 Ų | 18 | 27.3 Ų | 27.3 | 8% | 0.083 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -84.3 | -21 | 169.6 | -63.2 | -147.1 | 0 | 0 | 0 | 111.5 | F91 V218 I219 L220 L284 | F91-H222 WeakPolarHBondContact CZ-O 3.44Å; V218-H222 PolarHBondContact O-CD2 3.44Å; I219-H222 HydrophobicContact CD1-CB 4.17Å; I219-H222 WeakPolarHBondContact O-CB 3.31Å; I219-H222 PolarHBondContact O-N 3.32Å; L220-H222 PolarHBondContact O-N 3.41Å; H222-L284 HydrophobicContact CB-CD1 4.43Å |
| 223 | Y | 89 | Confident | 91.7 | Very high | 7 Ų | 7 | 27.3 Ų | 27.3 | 3% | 0.027 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -107.7 | -32.8 | -176.8 | -80.7 | -92.8 | 0 | 0 | 0 | 113.6 | P93 P94 E95 W98 V102 I219 L220 K281 L283 | P93-Y223 VanDerWaalsContact CB-O 3.32Å; P93-Y223 WeakPolarHBondContact CB-O 3.41Å; P94-Y223 HydrophobicContact CG-CD1 3.75Å; P94-Y223 HydrophobicContact CG-CE1 4.36Å; E95-Y223 WeakPolarHBondContact CA-O 3.21Å; E95-Y223 PolarHBondContact N-O 3.06Å; W98-Y223 HydrophobicContact CB-CE1 4.32Å; W98-Y223 AromaticContact CD1-CZ 3.97Å; V102-Y223 HydrophobicContact CG1-CD2 4.4Å; V102-Y223 HydrophobicContact CG1-CE2 4.45Å; V102-Y223 HydrophobicContact CG2-CE2 3.99Å; I219-Y223 HydrophobicContact CD1-CE2 4.17Å; I219-Y223 HydrophobicContact CG1-CD2 4.29Å; I219-Y223 HydrophobicContact CG1-CE2 4.12Å; I219-Y223 WeakPolarHBondContact O-CD2 3.48Å; L220-Y223 PolarHBondContact O-N 2.82Å; Y223-K281 WeakPolarHBondContact CE2-O 3.35Å; Y223-K281 WeakPolarHBondContact OH-CB 3.36Å; Y223-K281 PolarHBondContact OH-O 2.65Å; Y223-L283 HydrophobicContact CD1-CD1 3.89Å; Y223-L283 HydrophobicContact CD2-CD1 4.3Å; Y223-L283 HydrophobicContact CE1-CD1 3.67Å; Y223-L283 HydrophobicContact CE1-CG 4.39Å; Y223-L283 HydrophobicContact CE2-CD1 4.08Å; Y223-L283 HydrophobicContact CE2-CG 4.16Å; Y223-L283 HydrophobicContact CG-CD1 4.22Å |
| 224 | F | 90.2 | Very high | 91.7 | Very high | 1 Ų | 1 | 29 Ų | 29 | 0% | 0.004 | 13% | 0.128 | C | C | . | . | trans | -132.9 | 136.5 | -174.5 | -55.2 | -86.9 | 0 | 0 | 0 | 110.8 | E95 W100 V103 L220 G221 R227 V231 | E95-F224 VanDerWaalsContact C-CE1 3.5Å; W100-F224 HydrophobicContact CD2-CZ 4.42Å; V103-F224 HydrophobicContact CG2-CE2 3.71Å; V103-F224 HydrophobicContact CG2-CZ 4.15Å; L220-F224 PolarHBondContact O-N 2.94Å; G221-F224 WeakPolarHBondContact CA-O 3.16Å; F224-R227 HydrophobicContact CD1-CB 4.38Å; F224-V231 HydrophobicContact CB-CG2 4.46Å; F224-V231 HydrophobicContact CD1-CG2 4Å; F224-V231 HydrophobicContact CD2-CB 4.27Å; F224-V231 HydrophobicContact CD2-CG1 3.87Å; F224-V231 HydrophobicContact CD2-CG2 3.84Å; F224-V231 HydrophobicContact CE1-CG2 4.11Å; F224-V231 HydrophobicContact CE2-CG1 4.13Å; F224-V231 HydrophobicContact CE2-CG2 3.97Å; F224-V231 HydrophobicContact CG-CB 4.46Å; F224-V231 HydrophobicContact CG-CG2 3.85Å; F224-V231 HydrophobicContact CZ-CG2 4.09Å | ||
| 225 | R | 86.4 | Confident | 91.8 | Very high | 187 Ų | 187 | 29 Ų | 29 | 71% | 0.706 | 13% | 0.128 | S | C | * | . | S | Bend | trans | -129.6 | -38.2 | 174.8 | 174.2 | 179.6 | -179 | -174.7 | -0.2 | 111.2 | P93 E95 | P93-R225 HydrophobicContact CG-CB 3.9Å; E95-R225 WeakPolarHBondContact OE1-CA 3.15Å; E95-R225 PolarHBondContact OE1-N 3.36Å |
| 226 | Q | 86.2 | Confident | 91.7 | Very high | 142 Ų | 142 | 29.5 Ų | 29.5 | 66% | 0.664 | 13% | 0.131 | S | C | * | . | S | Bend | trans | -77.1 | -30.9 | 173.8 | -63.1 | -173.6 | 0.3 | 0 | 0 | 112.7 | E95 D393 | E95-Q226 PolarHBondContact OE1-N 2.66Å; Q226-D393 WeakPolarHBondContact O-CB 3.21Å |
| 227 | R | 90.1 | Very high | 91.7 | Very high | 128 Ų | 128 | 29.8 Ų | 29.8 | 48% | 0.483 | 13% | 0.134 | S | C | . | . | S | Bend | trans | -114.9 | 22.7 | -174.9 | -55 | -174.1 | -174 | -158.3 | 2.2 | 113.6 | F224 L230 V231 D393 | F224-R227 HydrophobicContact CD1-CB 4.38Å; R227-L230 PolarHBondContact O-N 3.47Å; R227-V231 WeakPolarHBondContact O-CB 3.26Å; R227-V231 WeakPolarHBondContact O-CG2 3.48Å; R227-V231 PolarHBondContact O-N 2.97Å; R227-D393 VanDerWaalsContact CA-OD2 3.26Å; R227-D393 WeakPolarHBondContact CA-OD2 3.29Å |
| 228 | L | 90.5 | Very high | 91.7 | Very high | 12 Ų | 12 | 29.4 Ų | 29.4 | 6% | 0.063 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -70.6 | -32.3 | -169.5 | -176.2 | 57.8 | 0 | 0 | 0 | 112.4 | L220 N232 D393 P447 F450 | L220-L228 HydrophobicContact CB-CD1 3.87Å; L228-N232 WeakPolarHBondContact O-CB 3.11Å; L228-N232 PolarHBondContact O-N 2.85Å; L228-D393 PolarHBondContact N-OD1 3.47Å; L228-P447 HydrophobicContact CG-CG 4.4Å; L228-F450 HydrophobicContact CD2-CB 3.99Å; L228-F450 HydrophobicContact CD2-CD1 4.47Å; L228-F450 HydrophobicContact CD2-CD2 3.79Å; L228-F450 HydrophobicContact CD2-CE2 4.42Å; L228-F450 HydrophobicContact CD2-CG 3.84Å |
| 229 | G | 92.1 | Very high | 91.6 | Very high | 0 Ų | 0 | 29.4 Ų | 29.4 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -65.8 | -49.6 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112 | G233 G389 D393 T443 | G229-G233 PolarHBondContact O-N 2.94Å; G229-G389 VanDerWaalsContact C-C 3.49Å; G229-G389 VanDerWaalsContact C-CA 3.41Å; G229-G389 CarbonylContact C-O 3.59Å; G229-G389 VanDerWaalsContact C-O 3.27Å; G229-G389 WeakPolarHBondContact O-CA 3.19Å; G229-D393 WeakPolarHBondContact CA-OD1 3.49Å; G229-D393 PolarHBondContact N-OD1 3.02Å; G229-D393 PolarHBondContact N-OD2 2.91Å; G229-T443 VanDerWaalsContact O-CG2 3.28Å; G229-T443 WeakPolarHBondContact O-CG2 3.45Å |
| 230 | L | 94 | Very high | 91.5 | Very high | 46 Ų | 46 | 29.8 Ų | 29.8 | 24% | 0.241 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -61.3 | -44.9 | 175.6 | 174.7 | 61.6 | 0 | 0 | 0 | 111.5 | R227 G233 V234 G389 K390 D393 | R227-L230 PolarHBondContact O-N 3.47Å; L230-G233 CarbonylContact O-C 3.51Å; L230-G233 WeakPolarHBondContact O-CA 3.44Å; L230-G233 PolarHBondContact O-N 3.16Å; L230-G233 VanDerWaalsContact O-N 3.16Å; L230-V234 HydrophobicContact CD1-CG2 4.47Å; L230-V234 WeakPolarHBondContact O-CG2 3.35Å; L230-V234 PolarHBondContact O-N 3.45Å; L230-G389 PolarHBondContact N-O 3.42Å; L230-K390 HydrophobicContact CD1-CB 4.32Å; L230-D393 VanDerWaalsContact CB-OD2 3.23Å; L230-D393 WeakPolarHBondContact CB-OD2 3.45Å; L230-D393 PolarHBondContact N-OD2 2.88Å |
| 231 | V | 95.1 | Very high | 91.5 | Very high | 0 Ų | 0 | 35.7 Ų | 35.7 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -66.5 | -44.6 | -179.7 | 163.9 | 0 | 0 | 0 | 0 | 111.7 | W100 V103 L220 F224 R227 G233 V234 V235 | W100-V231 HydrophobicContact CH2-CG2 4.36Å; V103-V231 HydrophobicContact CG2-CB 4.44Å; V103-V231 HydrophobicContact CG2-CG1 3.5Å; V103-V231 HydrophobicContact CG2-CG2 4.18Å; L220-V231 HydrophobicContact CB-CG1 4.1Å; L220-V231 HydrophobicContact CD1-CG1 4.19Å; L220-V231 HydrophobicContact CD2-CG1 3.9Å; L220-V231 HydrophobicContact CG-CG1 4.26Å; F224-V231 HydrophobicContact CB-CG2 4.46Å; F224-V231 HydrophobicContact CD1-CG2 4Å; F224-V231 HydrophobicContact CD2-CB 4.27Å; F224-V231 HydrophobicContact CD2-CG1 3.87Å; F224-V231 HydrophobicContact CD2-CG2 3.84Å; F224-V231 HydrophobicContact CE1-CG2 4.11Å; F224-V231 HydrophobicContact CE2-CG1 4.13Å; F224-V231 HydrophobicContact CE2-CG2 3.97Å; F224-V231 HydrophobicContact CG-CB 4.46Å; F224-V231 HydrophobicContact CG-CG2 3.85Å; F224-V231 HydrophobicContact CZ-CG2 4.09Å; R227-V231 WeakPolarHBondContact O-CB 3.26Å; R227-V231 WeakPolarHBondContact O-CG2 3.48Å; R227-V231 PolarHBondContact O-N 2.97Å; V231-G233 PolarHBondContact O-N 2.75Å; V231-V234 PolarHBondContact O-N 3.05Å; V231-V235 WeakPolarHBondContact O-CG2 3.46Å; V231-V235 PolarHBondContact O-N 3.31Å; V231-V235 VanDerWaalsContact O-N 3.08Å |
| 232 | N | 94.3 | Very high | 91.6 | Very high | 2 Ų | 2 | 37.8 Ų | 37.8 | 1% | 0.011 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -63.4 | -33.4 | 171.8 | -167.6 | 55.1 | 0 | 0 | 0 | 111.3 | L220 L228 V235 T236 T443 | L220-N232 HydrophobicContact CD1-CB 4.49Å; L228-N232 WeakPolarHBondContact O-CB 3.11Å; L228-N232 PolarHBondContact O-N 2.85Å; N232-V235 PolarHBondContact O-N 3.27Å; N232-T236 WeakPolarHBondContact O-CB 3.31Å; N232-T236 VanDerWaalsContact O-CG2 3.29Å; N232-T236 WeakPolarHBondContact O-CG2 3.23Å; N232-T236 PolarHBondContact O-N 3.38Å; N232-T236 PolarHBondContact O-OG1 3.14Å; N232-T443 PolarHBondContact ND2-O 3.14Å |
| 233 | G | 95 | Very high | 91.6 | Very high | 0 Ų | 0 | 38.1 Ų | 38.1 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -63.8 | -41.7 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | G229 L230 V231 T236 A237 R385 T443 | G229-G233 PolarHBondContact O-N 2.94Å; L230-G233 CarbonylContact O-C 3.51Å; L230-G233 WeakPolarHBondContact O-CA 3.44Å; L230-G233 PolarHBondContact O-N 3.16Å; L230-G233 VanDerWaalsContact O-N 3.16Å; V231-G233 PolarHBondContact O-N 2.75Å; G233-T236 WeakPolarHBondContact CA-OG1 3.43Å; G233-T236 PolarHBondContact O-OG1 3.29Å; G233-A237 WeakPolarHBondContact O-CB 3.35Å; G233-A237 PolarHBondContact O-N 3.31Å; G233-R385 VanDerWaalsContact CA-O 3.32Å; G233-R385 WeakPolarHBondContact CA-O 3.46Å; G233-T443 VanDerWaalsContact CA-CG2 3.43Å |
| 234 | V | 96.4 | Very high | 91.3 | Very high | 44 Ų | 44 | 41.5 Ų | 41.5 | 27% | 0.267 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -65.4 | -48.6 | 174.3 | 171.3 | 0 | 0 | 0 | 0 | 111 | V103 L230 V231 T236 A237 G238 L386 | V103-V234 HydrophobicContact CG1-CB 4.31Å; V103-V234 HydrophobicContact CG1-CG1 3.82Å; L230-V234 HydrophobicContact CD1-CG2 4.47Å; L230-V234 WeakPolarHBondContact O-CG2 3.35Å; L230-V234 PolarHBondContact O-N 3.45Å; V231-V234 PolarHBondContact O-N 3.05Å; V234-T236 VanDerWaalsContact C-N 3.34Å; V234-T236 PolarHBondContact O-N 3.2Å; V234-A237 PolarHBondContact O-N 2.82Å; V234-G238 PolarHBondContact O-N 3.35Å; V234-G238 VanDerWaalsContact O-N 3.09Å; V234-L386 HydrophobicContact CB-CD2 4.4Å; V234-L386 HydrophobicContact CG2-CD2 3.77Å |
| 235 | V | 95.5 | Very high | 91.2 | Very high | 0 Ų | 0 | 43.4 Ų | 43.4 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -60.3 | -44.3 | 178.3 | 171 | 0 | 0 | 0 | 0 | 111.3 | V103 A106 N110 L217 L220 V231 N232 G238 | V103-V235 HydrophobicContact CG1-CG2 4.04Å; A106-V235 HydrophobicContact CB-CG1 3.98Å; A106-V235 HydrophobicContact CB-CG2 3.74Å; N110-V235 HydrophobicContact CB-CG1 3.93Å; N110-V235 PolarHBondContact ND2-O 3.42Å; L217-V235 HydrophobicContact CD2-CG1 4.39Å; L220-V235 HydrophobicContact CD1-CB 4.24Å; L220-V235 HydrophobicContact CD1-CG1 4.46Å; L220-V235 HydrophobicContact CD1-CG2 3.88Å; L220-V235 HydrophobicContact CD2-CG2 4.08Å; V231-V235 WeakPolarHBondContact O-CG2 3.46Å; V231-V235 PolarHBondContact O-N 3.31Å; V231-V235 VanDerWaalsContact O-N 3.08Å; N232-V235 PolarHBondContact O-N 3.27Å; V235-G238 PolarHBondContact O-N 3.47Å |
| 236 | T | 93.1 | Very high | 91.3 | Very high | 11 Ų | 11 | 34.8 Ų | 34.8 | 7% | 0.067 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -72.7 | -34.2 | 178.9 | 55.7 | 0 | 0 | 0 | 0 | 113.1 | N110 N232 G233 V234 G238 A239 R385 T443 | N110-T236 WeakPolarHBondContact ND2-CA 3.1Å; N232-T236 WeakPolarHBondContact O-CB 3.31Å; N232-T236 VanDerWaalsContact O-CG2 3.29Å; N232-T236 WeakPolarHBondContact O-CG2 3.23Å; N232-T236 PolarHBondContact O-N 3.38Å; N232-T236 PolarHBondContact O-OG1 3.14Å; G233-T236 WeakPolarHBondContact CA-OG1 3.43Å; G233-T236 PolarHBondContact O-OG1 3.29Å; V234-T236 VanDerWaalsContact C-N 3.34Å; V234-T236 PolarHBondContact O-N 3.2Å; T236-G238 VanDerWaalsContact C-N 3.27Å; T236-G238 PolarHBondContact O-N 2.99Å; T236-A239 PolarHBondContact O-N 3.14Å; T236-R385 VanDerWaalsContact C-CD 3.5Å; T236-R385 WeakPolarHBondContact O-CD 3.48Å; T236-R385 PolarHBondContact O-NH1 3.04Å; T236-T443 PolarHBondContact OG1-OG1 3.45Å |
| 237 | A | 94.1 | Very high | 91.3 | Very high | 6 Ų | 6 | 29.5 Ų | 29.5 | 5% | 0.05 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -65.2 | -29 | 173 | 0 | 0 | 0 | 0 | 0 | 112.7 | G233 V234 A239 S240 L241 R385 L386 | G233-A237 WeakPolarHBondContact O-CB 3.35Å; G233-A237 PolarHBondContact O-N 3.31Å; V234-A237 PolarHBondContact O-N 2.82Å; A237-A239 PolarHBondContact O-N 2.96Å; A237-S240 WeakPolarHBondContact O-CB 3.38Å; A237-S240 PolarHBondContact O-N 2.83Å; A237-L241 PolarHBondContact O-N 3.42Å; A237-L241 VanDerWaalsContact O-N 3.15Å; A237-R385 HydrophobicContact CB-CB 4.12Å; A237-L386 HydrophobicContact CB-CD1 4.46Å; A237-L386 HydrophobicContact CB-CD2 3.87Å; A237-L386 HydrophobicContact CB-CG 3.89Å |
| 238 | G | 91.9 | Very high | 91.1 | Very high | 3 Ų | 3 | 27.6 Ų | 27.6 | 3% | 0.031 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -54.7 | -37.6 | 172 | 0 | 0 | 0 | 0 | 0 | 113.8 | V234 V235 T236 S240 L241 F242 | V234-G238 PolarHBondContact O-N 3.35Å; V234-G238 VanDerWaalsContact O-N 3.09Å; V235-G238 PolarHBondContact O-N 3.47Å; T236-G238 VanDerWaalsContact C-N 3.27Å; T236-G238 PolarHBondContact O-N 2.99Å; G238-S240 PolarHBondContact O-N 3.42Å; G238-L241 PolarHBondContact O-N 3.34Å; G238-F242 WeakPolarHBondContact O-CD2 3.34Å; G238-F242 PolarHBondContact O-N 2.89Å |
| 239 | A | 90.7 | Very high | 90.9 | Very high | 4 Ų | 4 | 30.2 Ų | 30.2 | 3% | 0.033 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -63.4 | -38.3 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | N110 F114 T236 A237 S243 | N110-A239 VanDerWaalsContact ND2-CB 3.32Å; N110-A239 WeakPolarHBondContact ND2-CB 3.41Å; F114-A239 HydrophobicContact CB-CB 3.88Å; F114-A239 HydrophobicContact CD2-CB 4.26Å; F114-A239 HydrophobicContact CG-CB 4.42Å; T236-A239 PolarHBondContact O-N 3.14Å; A237-A239 PolarHBondContact O-N 2.96Å; A239-S243 WeakPolarHBondContact O-CB 3.48Å; A239-S243 PolarHBondContact O-N 3.38Å; A239-S243 PolarHBondContact O-OG 2.92Å |
| 240 | S | 89.8 | Confident | 90.6 | Very high | 7 Ų | 7 | 30.2 Ų | 30.2 | 5% | 0.049 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -64.8 | -45.3 | 176.3 | -57.9 | 0 | 0 | 0 | 0 | 111.4 | A237 G238 S243 M244 G378 | A237-S240 WeakPolarHBondContact O-CB 3.38Å; A237-S240 PolarHBondContact O-N 2.83Å; G238-S240 PolarHBondContact O-N 3.42Å; S240-S243 PolarHBondContact O-N 2.98Å; S240-M244 WeakPolarHBondContact O-CG 3.47Å; S240-M244 PolarHBondContact O-N 3.03Å; S240-G378 WeakPolarHBondContact CB-O 3.19Å; S240-G378 PolarHBondContact OG-O 2.65Å |
| 241 | L | 90.9 | Very high | 90 | Very high | 126 Ų | 126 | 31.9 Ų | 31.9 | 66% | 0.66 | 19% | 0.186 | S | C | * | . | H | α-helix | trans | -61.2 | -46.3 | 177.9 | -66.2 | 173.3 | 0 | 0 | 0 | 112 | A237 G238 M244 G245 | A237-L241 PolarHBondContact O-N 3.42Å; A237-L241 VanDerWaalsContact O-N 3.15Å; G238-L241 PolarHBondContact O-N 3.34Å; L241-M244 PolarHBondContact O-N 2.95Å; L241-G245 PolarHBondContact O-N 3.44Å |
| 242 | F | 91.3 | Very high | 89.3 | Confident | 49 Ų | 49 | 40.5 Ų | 40.5 | 22% | 0.215 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -67.3 | -35.5 | 175.7 | -86.9 | -114.1 | 0 | 0 | 0 | 112.4 | W108 G111 G238 M244 G245 L246 F269 | W108-F242 HydrophobicContact CD2-CZ 4.29Å; W108-F242 HydrophobicContact CE3-CE1 4.42Å; W108-F242 AromaticContact CE3-CZ 3.75Å; W108-F242 HydrophobicContact CE3-CZ 3.75Å; W108-F242 HydrophobicContact CH2-CZ 4.46Å; W108-F242 HydrophobicContact CZ3-CE1 4.35Å; W108-F242 AromaticContact CZ3-CZ 3.85Å; W108-F242 HydrophobicContact CZ3-CZ 3.85Å; G111-F242 VanDerWaalsContact C-CD1 3.45Å; G111-F242 VanDerWaalsContact C-CG 3.48Å; G111-F242 WeakPolarHBondContact O-CB 3.12Å; G111-F242 WeakPolarHBondContact O-CD1 3.49Å; G111-F242 WeakPolarHBondContact O-CG 3.29Å; G238-F242 WeakPolarHBondContact O-CD2 3.34Å; G238-F242 PolarHBondContact O-N 2.89Å; F242-M244 PolarHBondContact O-N 2.8Å; F242-G245 PolarHBondContact O-N 3.06Å; F242-L246 WeakPolarHBondContact O-CB 3.49Å; F242-L246 PolarHBondContact O-N 3.27Å; F242-F269 HydrophobicContact CD1-CE1 4.44Å; F242-F269 HydrophobicContact CE1-CD1 4.16Å; F242-F269 AromaticContact CE1-CE1 3.99Å; F242-F269 HydrophobicContact CE1-CE1 3.99Å |
| 243 | S | 86.1 | Confident | 88.1 | Confident | 26 Ų | 26 | 45.7 Ų | 45.7 | 18% | 0.182 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -70.4 | -20.1 | 177.2 | -56.9 | 0 | 0 | 0 | 0 | 113.4 | N118 A239 S240 P247 | N118-S243 PolarHBondContact ND2-OG 3.5Å; A239-S243 WeakPolarHBondContact O-CB 3.48Å; A239-S243 PolarHBondContact O-N 3.38Å; A239-S243 PolarHBondContact O-OG 2.92Å; S240-S243 PolarHBondContact O-N 2.98Å; S243-P247 VanDerWaalsContact O-CD 3.25Å; S243-P247 WeakPolarHBondContact O-CD 3.29Å; S243-P247 VanDerWaalsContact O-CG 3.22Å; S243-P247 WeakPolarHBondContact O-CG 3.18Å |
| 244 | M | 84.4 | Confident | 87 | Confident | 78 Ų | 78 | 46 Ų | 46 | 38% | 0.384 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -89.5 | -40 | 171.9 | -68.9 | 173 | 60.5 | 0 | 0 | 111.9 | S240 L241 F242 V375 A379 | S240-M244 WeakPolarHBondContact O-CG 3.47Å; S240-M244 PolarHBondContact O-N 3.03Å; L241-M244 PolarHBondContact O-N 2.95Å; F242-M244 PolarHBondContact O-N 2.8Å; M244-V375 HydrophobicContact CE-CG1 4.12Å; M244-A379 HydrophobicContact CE-CB 4.25Å; M244-A379 HydrophobicContact SD-CB 4.07Å |
| 245 | G | 87.6 | Confident | 85.8 | Confident | 41 Ų | 41 | 46 Ų | 46 | 42% | 0.423 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -81.3 | -39.2 | -176.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | L241 F242 V248 L249 | L241-G245 PolarHBondContact O-N 3.44Å; F242-G245 PolarHBondContact O-N 3.06Å; G245-V248 PolarHBondContact O-N 3.26Å; G245-L249 WeakPolarHBondContact O-CB 3.47Å; G245-L249 PolarHBondContact O-N 2.93Å |
| 246 | L | 89 | Confident | 85 | Confident | 5 Ų | 5 | 51 Ų | 51 | 3% | 0.026 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -68.1 | -38.6 | -174.3 | -168.9 | 64 | 0 | 0 | 0 | 113.7 | G115 I116 F242 V248 L249 L250 L266 F269 | G115-L246 VanDerWaalsContact C-CD2 3.49Å; I116-L246 HydrophobicContact CG1-CD2 3.85Å; F242-L246 WeakPolarHBondContact O-CB 3.49Å; F242-L246 PolarHBondContact O-N 3.27Å; L246-V248 VanDerWaalsContact C-N 3.32Å; L246-V248 PolarHBondContact O-N 2.95Å; L246-L249 HydrophobicContact CD1-CB 4.49Å; L246-L249 HydrophobicContact CD1-CD2 3.98Å; L246-L249 PolarHBondContact O-N 2.53Å; L246-L250 HydrophobicContact CG-CD1 3.99Å; L246-L250 HydrophobicContact CG-CG 4.41Å; L246-L250 WeakPolarHBondContact O-CD1 3.26Å; L246-L250 VanDerWaalsContact O-CG 3.3Å; L246-L250 WeakPolarHBondContact O-CG 3.4Å; L246-L250 PolarHBondContact O-N 3.08Å; L246-L266 HydrophobicContact CD1-CD2 4.17Å; L246-L266 HydrophobicContact CD2-CD2 4.12Å; L246-F269 HydrophobicContact CD1-CE1 4.04Å; L246-F269 HydrophobicContact CD1-CZ 3.98Å |
| 247 | P | 85.4 | Confident | 84.5 | Confident | 31 Ų | 31 | 55 Ų | 55 | 20% | 0.201 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -59.6 | -41.6 | 174.3 | -25.2 | 34.7 | 0 | 0 | 0 | 112.7 | S119 I122 S243 L250 D251 | S119-P247 WeakPolarHBondContact OG-CD 3.41Å; S119-P247 WeakPolarHBondContact OG-CG 3.42Å; I122-P247 HydrophobicContact CD1-CB 3.74Å; I122-P247 WeakPolarHBondContact CD1-O 3.2Å; S243-P247 VanDerWaalsContact O-CD 3.25Å; S243-P247 WeakPolarHBondContact O-CD 3.29Å; S243-P247 VanDerWaalsContact O-CG 3.22Å; S243-P247 WeakPolarHBondContact O-CG 3.18Å; P247-L250 PolarHBondContact O-N 3Å; P247-D251 WeakPolarHBondContact O-CB 3.33Å; P247-D251 PolarHBondContact O-N 3.02Å |
| 248 | V | 86.5 | Confident | 84.1 | Confident | 88 Ų | 88 | 56.3 Ų | 56.3 | 53% | 0.533 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -69.1 | -37.7 | 178.1 | -177 | 0 | 0 | 0 | 0 | 111.5 | G245 L246 L250 R252 | G245-V248 PolarHBondContact O-N 3.26Å; L246-V248 VanDerWaalsContact C-N 3.32Å; L246-V248 PolarHBondContact O-N 2.95Å; V248-L250 VanDerWaalsContact C-N 3.31Å; V248-R252 HydrophobicContact CG1-CG 4.26Å; V248-R252 WeakPolarHBondContact O-CB 3.47Å; V248-R252 WeakPolarHBondContact O-CG 3.47Å; V248-R252 PolarHBondContact O-N 2.82Å; V248-R252 VanDerWaalsContact O-N 3.12Å |
| 249 | L | 86.6 | Confident | 83.9 | Confident | 67 Ų | 67 | 56.6 Ų | 56.6 | 35% | 0.351 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -63.3 | -37 | 172.9 | 176.8 | 57.5 | 0 | 0 | 0 | 111.6 | G245 L246 L253 I254 F269 | G245-L249 WeakPolarHBondContact O-CB 3.47Å; G245-L249 PolarHBondContact O-N 2.93Å; L246-L249 HydrophobicContact CD1-CB 4.49Å; L246-L249 HydrophobicContact CD1-CD2 3.98Å; L246-L249 PolarHBondContact O-N 2.53Å; L249-L253 HydrophobicContact CD1-CB 4.17Å; L249-L253 HydrophobicContact CD1-CD1 3.61Å; L249-L253 WeakPolarHBondContact O-CB 3.36Å; L249-L253 PolarHBondContact O-N 3.38Å; L249-I254 HydrophobicContact CG-CD1 4.08Å; L249-I254 WeakPolarHBondContact O-CG1 3.45Å; L249-F269 HydrophobicContact CD2-CZ 4.26Å |
| 250 | L | 84.8 | Confident | 83.8 | Confident | 0 Ų | 0 | 58.6 Ų | 58.6 | 0% | 0 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -67.7 | -61.8 | 175.6 | -71.9 | 160.5 | 0 | 0 | 0 | 111 | S119 I122 L246 P247 V248 R252 L253 I254 D255 T262 L266 | S119-L250 VanDerWaalsContact CB-CD1 3.43Å; I122-L250 HydrophobicContact CD1-CB 4.35Å; I122-L250 HydrophobicContact CG2-CB 4.44Å; L246-L250 HydrophobicContact CG-CD1 3.99Å; L246-L250 HydrophobicContact CG-CG 4.41Å; L246-L250 WeakPolarHBondContact O-CD1 3.26Å; L246-L250 VanDerWaalsContact O-CG 3.3Å; L246-L250 WeakPolarHBondContact O-CG 3.4Å; L246-L250 PolarHBondContact O-N 3.08Å; P247-L250 PolarHBondContact O-N 3Å; V248-L250 VanDerWaalsContact C-N 3.31Å; L250-R252 VanDerWaalsContact C-N 3.27Å; L250-R252 PolarHBondContact O-N 3.04Å; L250-R252 VanDerWaalsContact O-N 3.16Å; L250-L253 PolarHBondContact O-N 2.63Å; L250-I254 HydrophobicContact CD2-CB 4.22Å; L250-I254 HydrophobicContact CD2-CD1 3.94Å; L250-I254 HydrophobicContact CD2-CG2 4.23Å; L250-I254 HydrophobicContact CG-CD1 4.5Å; L250-I254 WeakPolarHBondContact O-CA 3.5Å; L250-I254 PolarHBondContact O-N 2.82Å; L250-D255 PolarHBondContact O-N 2.85Å; L250-T262 HydrophobicContact CD2-CG2 3.46Å; L250-T262 VanDerWaalsContact CD2-CG2 3.46Å; L250-L266 HydrophobicContact CD2-CD1 4.43Å; L250-L266 HydrophobicContact CD2-CD2 4.3Å |
| 251 | D | 81.5 | Confident | 83.9 | Confident | 81 Ų | 81 | 65.2 Ų | 65.2 | 43% | 0.433 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -49.3 | -42.6 | -178.5 | 175 | 74.5 | 0 | 0 | 0 | 113.4 | I122 P247 D255 | I122-D251 HydrophobicContact CD1-CB 4.29Å; P247-D251 WeakPolarHBondContact O-CB 3.33Å; P247-D251 PolarHBondContact O-N 3.02Å; D251-D255 WeakPolarHBondContact CA-OD1 3.25Å; D251-D255 PolarHBondContact N-OD1 3.47Å |
| 252 | R | 79.9 | Confident | 83.9 | Confident | 181 Ų | 181 | 59.2 Ų | 59.2 | 68% | 0.683 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -94.5 | -26.3 | -171.3 | -61.2 | -55.6 | -176.7 | 91.3 | 0 | 115.9 | V248 L250 | V248-R252 HydrophobicContact CG1-CG 4.26Å; V248-R252 WeakPolarHBondContact O-CB 3.47Å; V248-R252 WeakPolarHBondContact O-CG 3.47Å; V248-R252 PolarHBondContact O-N 2.82Å; V248-R252 VanDerWaalsContact O-N 3.12Å; L250-R252 VanDerWaalsContact C-N 3.27Å; L250-R252 PolarHBondContact O-N 3.04Å; L250-R252 VanDerWaalsContact O-N 3.16Å |
| 253 | L | 69.3 | Low | 84 | Confident | 111 Ų | 111 | 56.9 Ų | 56.9 | 58% | 0.581 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -128.4 | -10.6 | -168.1 | -69.8 | 161.3 | 0 | 0 | 0 | 113.6 | L249 L250 L257 | L249-L253 HydrophobicContact CD1-CB 4.17Å; L249-L253 HydrophobicContact CD1-CD1 3.61Å; L249-L253 WeakPolarHBondContact O-CB 3.36Å; L249-L253 PolarHBondContact O-N 3.38Å; L250-L253 PolarHBondContact O-N 2.63Å; L253-L257 WeakPolarHBondContact O-CD1 3.42Å |
| 254 | I | 71.3 | Confident | 84.5 | Confident | 7 Ų | 7 | 57.6 Ų | 57.6 | 4% | 0.036 | 31% | 0.31 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -127.9 | -34.6 | -171.3 | -52 | 175.7 | 0 | 0 | 0 | 112.4 | L249 L250 L257 G258 T262 I265 | L249-I254 HydrophobicContact CG-CD1 4.08Å; L249-I254 WeakPolarHBondContact O-CG1 3.45Å; L250-I254 HydrophobicContact CD2-CB 4.22Å; L250-I254 HydrophobicContact CD2-CD1 3.94Å; L250-I254 HydrophobicContact CD2-CG2 4.23Å; L250-I254 HydrophobicContact CG-CD1 4.5Å; L250-I254 WeakPolarHBondContact O-CA 3.5Å; L250-I254 PolarHBondContact O-N 2.82Å; I254-L257 WeakPolarHBondContact O-CA 3.21Å; I254-L257 VanDerWaalsContact O-CB 3.31Å; I254-L257 WeakPolarHBondContact O-CB 3.44Å; I254-L257 PolarHBondContact O-N 2.86Å; I254-G258 PolarHBondContact O-N 3.25Å; I254-T262 HydrophobicContact CG2-CG2 3.81Å; I254-T262 WeakPolarHBondContact CG2-OG1 3.13Å; I254-I265 HydrophobicContact CD1-CD1 4.26Å; I254-I265 HydrophobicContact CD1-CG2 3.89Å; I254-I265 HydrophobicContact CG1-CD1 4.13Å; I254-I265 HydrophobicContact CG2-CD1 3.88Å |
| 255 | D | 72.3 | Confident | 84.9 | Confident | 44 Ų | 44 | 56.1 Ų | 56.1 | 24% | 0.235 | 30% | 0.304 | C | S | . | . | G | 310 helix | trans | -44.5 | -50.1 | 166.6 | -89 | 65.9 | 0 | 0 | 0 | 114.2 | I122 M126 L250 D251 L257 G258 | I122-D255 WeakPolarHBondContact CG2-OD1 3.36Å; M126-D255 HydrophobicContact CE-CB 4.2Å; M126-D255 WeakPolarHBondContact CE-OD1 3.48Å; L250-D255 PolarHBondContact O-N 2.85Å; D251-D255 WeakPolarHBondContact CA-OD1 3.25Å; D251-D255 PolarHBondContact N-OD1 3.47Å; D255-L257 PolarHBondContact O-N 2.86Å; D255-L257 VanDerWaalsContact O-N 3.14Å; D255-G258 PolarHBondContact O-N 2.84Å |
| 256 | P | 78.4 | Confident | 85.2 | Confident | 106 Ų | 106 | 54.2 Ų | 54.2 | 69% | 0.688 | 28% | 0.284 | S | S | * | . | G | 310 helix | trans | -68.3 | -8.2 | 176.9 | 27.3 | -36.5 | 0 | 0 | 0 | 114.8 | ||
| 257 | L | 82.3 | Confident | 85.6 | Confident | 94 Ų | 94 | 54.1 Ų | 54.1 | 49% | 0.492 | 28% | 0.284 | S | S | . | . | G | 310 helix | trans | -92.5 | -11.2 | 176.3 | -52.3 | -179.8 | 0 | 0 | 0 | 112.8 | L253 I254 D255 R261 I265 | L253-L257 WeakPolarHBondContact O-CD1 3.42Å; I254-L257 WeakPolarHBondContact O-CA 3.21Å; I254-L257 VanDerWaalsContact O-CB 3.31Å; I254-L257 WeakPolarHBondContact O-CB 3.44Å; I254-L257 PolarHBondContact O-N 2.86Å; D255-L257 PolarHBondContact O-N 2.86Å; D255-L257 VanDerWaalsContact O-N 3.14Å; L257-R261 HydrophobicContact CB-CB 3.75Å; L257-R261 HydrophobicContact CB-CG 4.2Å; L257-R261 WeakPolarHBondContact O-CB 3.47Å; L257-R261 WeakPolarHBondContact O-CG 3.47Å; L257-I265 HydrophobicContact CD1-CD1 3.98Å |
| 258 | G | 86 | Confident | 86.1 | Confident | 33 Ų | 33 | 57 Ų | 57 | 34% | 0.34 | 30% | 0.297 | S | S | . | . | trans | 82.2 | 160.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | I254 D255 S260 R261 T262 | I254-G258 PolarHBondContact O-N 3.25Å; D255-G258 PolarHBondContact O-N 2.84Å; G258-S260 PolarHBondContact O-N 3.27Å; G258-R261 PolarHBondContact O-N 3.01Å; G258-T262 PolarHBondContact O-N 3.4Å; G258-T262 PolarHBondContact O-OG1 3.4Å | ||
| 259 | L | 87 | Confident | 86.5 | Confident | 10 Ų | 10 | 54.5 Ų | 54.5 | 5% | 0.052 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -57.4 | -42.9 | -168.3 | -176 | 69.5 | 0 | 0 | 0 | 114 | L123 M126 L127 E130 R261 T262 F263 | L123-L259 HydrophobicContact CD2-CD1 4.42Å; M126-L259 HydrophobicContact CB-CD1 3.76Å; M126-L259 HydrophobicContact CG-CD1 4.46Å; M126-L259 HydrophobicContact SD-CB 4.49Å; M126-L259 HydrophobicContact SD-CD1 3.74Å; L127-L259 HydrophobicContact CD2-CD1 4.45Å; L127-L259 HydrophobicContact CD2-CD2 3.73Å; L127-L259 HydrophobicContact CG-CD1 4.32Å; L127-L259 HydrophobicContact CG-CD2 4.28Å; E130-L259 WeakPolarHBondContact OE2-CB 3.48Å; E130-L259 WeakPolarHBondContact OE2-CD2 3.39Å; L259-R261 VanDerWaalsContact C-N 3.34Å; L259-R261 PolarHBondContact O-N 2.89Å; L259-T262 WeakPolarHBondContact O-CA 3.45Å; L259-T262 WeakPolarHBondContact O-CB 3.47Å; L259-T262 PolarHBondContact O-N 3.02Å; L259-T262 VanDerWaalsContact O-N 3.15Å; L259-F263 HydrophobicContact CD1-CD2 4.02Å; L259-F263 HydrophobicContact CD1-CE2 3.42Å; L259-F263 VanDerWaalsContact CD1-CE2 3.42Å; L259-F263 HydrophobicContact CD1-CZ 3.9Å; L259-F263 HydrophobicContact CD2-CE2 3.93Å; L259-F263 HydrophobicContact CG-CD2 3.88Å; L259-F263 HydrophobicContact CG-CE2 3.53Å; L259-F263 HydrophobicContact CG-CZ 4.47Å; L259-F263 WeakPolarHBondContact O-CD2 3.3Å; L259-F263 PolarHBondContact O-N 2.65Å |
| 260 | S | 90 | Very high | 87 | Confident | 46 Ų | 46 | 51.3 Ų | 51.3 | 32% | 0.322 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -61.7 | -39.2 | 176.9 | -64 | 0 | 0 | 0 | 0 | 112.7 | S189 G258 T262 Q264 | S189-S260 VanDerWaalsContact CB-O 3.29Å; S189-S260 WeakPolarHBondContact CB-O 3.44Å; S189-S260 VanDerWaalsContact O-CB 3.26Å; S189-S260 WeakPolarHBondContact O-CB 3.45Å; S189-S260 PolarHBondContact O-OG 3.27Å; G258-S260 PolarHBondContact O-N 3.27Å; S260-T262 VanDerWaalsContact C-N 3.33Å; S260-Q264 VanDerWaalsContact O-CG 3.27Å; S260-Q264 WeakPolarHBondContact O-CG 3.5Å; S260-Q264 PolarHBondContact O-N 3.21Å; S260-Q264 VanDerWaalsContact O-N 3.08Å |
| 261 | R | 91.1 | Very high | 87.6 | Confident | 145 Ų | 145 | 54.6 Ų | 54.6 | 55% | 0.547 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -69.4 | -35.9 | 174.8 | -63 | -52.8 | -166.4 | 179.6 | 6.1 | 111.4 | L257 G258 L259 Q264 I265 | L257-R261 HydrophobicContact CB-CB 3.75Å; L257-R261 HydrophobicContact CB-CG 4.2Å; L257-R261 WeakPolarHBondContact O-CB 3.47Å; L257-R261 WeakPolarHBondContact O-CG 3.47Å; G258-R261 PolarHBondContact O-N 3.01Å; L259-R261 VanDerWaalsContact C-N 3.34Å; L259-R261 PolarHBondContact O-N 2.89Å; R261-Q264 PolarHBondContact O-N 3.31Å; R261-I265 WeakPolarHBondContact O-CG1 3.47Å; R261-I265 PolarHBondContact O-N 3.43Å |
| 262 | T | 92 | Very high | 88.4 | Confident | 0 Ų | 0 | 53.5 Ų | 53.5 | 0% | 0 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -55.4 | -56 | 173.2 | -48.1 | 0 | 0 | 0 | 0 | 111.3 | L123 M126 L250 I254 G258 L259 S260 Q264 I265 L266 | L123-T262 HydrophobicContact CD2-CG2 3.61Å; M126-T262 HydrophobicContact CE-CG2 3.94Å; M126-T262 HydrophobicContact SD-CG2 4.07Å; L250-T262 HydrophobicContact CD2-CG2 3.46Å; L250-T262 VanDerWaalsContact CD2-CG2 3.46Å; I254-T262 HydrophobicContact CG2-CG2 3.81Å; I254-T262 WeakPolarHBondContact CG2-OG1 3.13Å; G258-T262 PolarHBondContact O-N 3.4Å; G258-T262 PolarHBondContact O-OG1 3.4Å; L259-T262 WeakPolarHBondContact O-CA 3.45Å; L259-T262 WeakPolarHBondContact O-CB 3.47Å; L259-T262 PolarHBondContact O-N 3.02Å; L259-T262 VanDerWaalsContact O-N 3.15Å; S260-T262 VanDerWaalsContact C-N 3.33Å; T262-Q264 VanDerWaalsContact C-N 3.31Å; T262-Q264 PolarHBondContact O-N 3.26Å; T262-I265 PolarHBondContact O-N 2.85Å; T262-L266 HydrophobicContact CG2-CD1 4.39Å; T262-L266 WeakPolarHBondContact O-CG 3.39Å; T262-L266 PolarHBondContact O-N 2.84Å |
| 263 | F | 93.6 | Very high | 89.2 | Confident | 1 Ų | 1 | 44.9 Ų | 44.9 | 0% | 0.004 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -64.5 | -32.1 | 178 | -71.5 | -54.5 | 0 | 0 | 0 | 113.5 | L123 L127 L185 T188 Y201 L259 S267 | L123-F263 HydrophobicContact CD2-CE1 4.01Å; L123-F263 HydrophobicContact CD2-CZ 4.3Å; L127-F263 HydrophobicContact CD2-CE2 4.47Å; L127-F263 HydrophobicContact CD2-CZ 4.47Å; L185-F263 HydrophobicContact CD2-CD1 4.4Å; T188-F263 HydrophobicContact CG2-CD1 4.01Å; T188-F263 HydrophobicContact CG2-CD2 3.71Å; T188-F263 HydrophobicContact CG2-CE1 3.9Å; T188-F263 HydrophobicContact CG2-CE2 3.56Å; T188-F263 HydrophobicContact CG2-CG 3.94Å; T188-F263 HydrophobicContact CG2-CZ 3.68Å; Y201-F263 HydrophobicContact CD2-CD1 4.25Å; Y201-F263 AromaticContact CD2-CE1 3.6Å; Y201-F263 HydrophobicContact CD2-CE1 3.6Å; Y201-F263 HydrophobicContact CD2-CZ 4.35Å; Y201-F263 HydrophobicContact CE2-CD1 4.4Å; Y201-F263 AromaticContact CE2-CE1 3.72Å; Y201-F263 HydrophobicContact CE2-CE1 3.72Å; L259-F263 HydrophobicContact CD1-CD2 4.02Å; L259-F263 HydrophobicContact CD1-CE2 3.42Å; L259-F263 VanDerWaalsContact CD1-CE2 3.42Å; L259-F263 HydrophobicContact CD1-CZ 3.9Å; L259-F263 HydrophobicContact CD2-CE2 3.93Å; L259-F263 HydrophobicContact CG-CD2 3.88Å; L259-F263 HydrophobicContact CG-CE2 3.53Å; L259-F263 HydrophobicContact CG-CZ 4.47Å; L259-F263 WeakPolarHBondContact O-CD2 3.3Å; L259-F263 PolarHBondContact O-N 2.65Å; F263-S267 WeakPolarHBondContact O-CB 3.49Å; F263-S267 PolarHBondContact O-N 2.88Å |
| 264 | Q | 94.9 | Very high | 90.5 | Very high | 40 Ų | 40 | 40.1 Ų | 40.1 | 19% | 0.187 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -64.2 | -46.6 | 173.1 | -75.3 | 164 | 14 | 0 | 0 | 111.7 | L186 S189 S260 R261 T262 S267 L268 | L186-Q264 HydrophobicContact CD1-CG 4.2Å; S189-Q264 WeakPolarHBondContact OG-CG 3.32Å; S189-Q264 PolarHBondContact OG-NE2 3.46Å; S260-Q264 VanDerWaalsContact O-CG 3.27Å; S260-Q264 WeakPolarHBondContact O-CG 3.5Å; S260-Q264 PolarHBondContact O-N 3.21Å; S260-Q264 VanDerWaalsContact O-N 3.08Å; R261-Q264 PolarHBondContact O-N 3.31Å; T262-Q264 VanDerWaalsContact C-N 3.31Å; T262-Q264 PolarHBondContact O-N 3.26Å; Q264-S267 WeakPolarHBondContact O-CB 3.05Å; Q264-S267 PolarHBondContact O-N 3.4Å; Q264-S267 PolarHBondContact O-OG 2.94Å; Q264-L268 PolarHBondContact O-N 3.49Å |
| 265 | I | 93.9 | Very high | 91.7 | Very high | 48 Ų | 48 | 45.1 Ų | 45.1 | 25% | 0.246 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -63.8 | -44.6 | 177.5 | -69.6 | 159.1 | 0 | 0 | 0 | 110.7 | I254 L257 R261 T262 S267 L268 F269 | I254-I265 HydrophobicContact CD1-CD1 4.26Å; I254-I265 HydrophobicContact CD1-CG2 3.89Å; I254-I265 HydrophobicContact CG1-CD1 4.13Å; I254-I265 HydrophobicContact CG2-CD1 3.88Å; L257-I265 HydrophobicContact CD1-CD1 3.98Å; R261-I265 WeakPolarHBondContact O-CG1 3.47Å; R261-I265 PolarHBondContact O-N 3.43Å; T262-I265 PolarHBondContact O-N 2.85Å; I265-S267 VanDerWaalsContact C-N 3.27Å; I265-S267 PolarHBondContact O-N 3.46Å; I265-L268 WeakPolarHBondContact O-CB 3.31Å; I265-L268 PolarHBondContact O-N 3.18Å; I265-L268 VanDerWaalsContact O-N 3.07Å; I265-F269 HydrophobicContact CG2-CE2 4.29Å; I265-F269 WeakPolarHBondContact O-CD2 3.48Å |
| 266 | L | 94.1 | Very high | 92.9 | Very high | 0 Ų | 0 | 44.4 Ų | 44.4 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -64.3 | -31 | 176.3 | -63.1 | -176.6 | 0 | 0 | 0 | 112.5 | I116 L123 L185 L246 L250 T262 L268 F269 | I116-L266 HydrophobicContact CD1-CB 4.17Å; I116-L266 HydrophobicContact CD1-CD2 4.45Å; I116-L266 HydrophobicContact CG1-CB 4.44Å; I116-L266 HydrophobicContact CG1-CD1 4.28Å; I116-L266 HydrophobicContact CG1-CD2 3.98Å; I116-L266 HydrophobicContact CG1-CG 4.45Å; I116-L266 HydrophobicContact CG2-CD1 4.34Å; L123-L266 HydrophobicContact CD1-CD1 4.03Å; L123-L266 HydrophobicContact CD2-CD1 4.24Å; L185-L266 HydrophobicContact CD1-CB 4.17Å; L185-L266 WeakPolarHBondContact CD1-O 3.22Å; L246-L266 HydrophobicContact CD1-CD2 4.17Å; L246-L266 HydrophobicContact CD2-CD2 4.12Å; L250-L266 HydrophobicContact CD2-CD1 4.43Å; L250-L266 HydrophobicContact CD2-CD2 4.3Å; T262-L266 HydrophobicContact CG2-CD1 4.39Å; T262-L266 WeakPolarHBondContact O-CG 3.39Å; T262-L266 PolarHBondContact O-N 2.84Å; L266-L268 VanDerWaalsContact C-N 3.28Å; L266-L268 PolarHBondContact O-N 3.46Å; L266-F269 WeakPolarHBondContact O-CB 3.38Å; L266-F269 PolarHBondContact O-N 2.93Å |
| 267 | S | 96.4 | Very high | 93.6 | Very high | 3 Ų | 3 | 39.3 Ų | 39.3 | 2% | 0.021 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -60.9 | -37.6 | 172.4 | 85.2 | 0 | 0 | 0 | 0 | 111.8 | F182 F263 Q264 I265 F269 M270 L271 | F182-S267 WeakPolarHBondContact CD2-O 3.34Å; F263-S267 WeakPolarHBondContact O-CB 3.49Å; F263-S267 PolarHBondContact O-N 2.88Å; Q264-S267 WeakPolarHBondContact O-CB 3.05Å; Q264-S267 PolarHBondContact O-N 3.4Å; Q264-S267 PolarHBondContact O-OG 2.94Å; I265-S267 VanDerWaalsContact C-N 3.27Å; I265-S267 PolarHBondContact O-N 3.46Å; S267-F269 VanDerWaalsContact C-N 3.26Å; S267-F269 PolarHBondContact O-N 3.24Å; S267-M270 PolarHBondContact O-N 3.15Å; S267-L271 PolarHBondContact O-N 2.98Å |
| 268 | L | 96.2 | Very high | 94.3 | Very high | 93 Ų | 93 | 39.1 Ų | 39.1 | 49% | 0.487 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -63.2 | -30.8 | 179 | -62 | 174.2 | 0 | 0 | 0 | 112.6 | Q264 I265 L266 M270 L271 V272 | Q264-L268 PolarHBondContact O-N 3.49Å; I265-L268 WeakPolarHBondContact O-CB 3.31Å; I265-L268 PolarHBondContact O-N 3.18Å; I265-L268 VanDerWaalsContact O-N 3.07Å; L266-L268 VanDerWaalsContact C-N 3.28Å; L266-L268 PolarHBondContact O-N 3.46Å; L268-M270 VanDerWaalsContact C-N 3.27Å; L268-M270 PolarHBondContact O-N 3.47Å; L268-L271 HydrophobicContact CD2-CD2 4.16Å; L268-L271 PolarHBondContact O-N 3.07Å; L268-V272 WeakPolarHBondContact O-CG2 3.46Å; L268-V272 PolarHBondContact O-N 2.97Å |
| 269 | F | 95.5 | Very high | 94.7 | Very high | 34 Ų | 34 | 38.5 Ų | 38.5 | 15% | 0.149 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -63.7 | -35.5 | 174 | -77.5 | -126.5 | 0 | 0 | 0 | 111.5 | W108 F242 L246 L249 I265 L266 S267 Q273 | W108-F269 HydrophobicContact CH2-CD1 4.31Å; W108-F269 HydrophobicContact CH2-CE1 4.45Å; W108-F269 HydrophobicContact CZ2-CB 4.32Å; W108-F269 AromaticContact CZ2-CD1 3.9Å; W108-F269 HydrophobicContact CZ2-CD1 3.9Å; W108-F269 HydrophobicContact CZ2-CE1 4.48Å; W108-F269 HydrophobicContact CZ2-CG 4.12Å; W108-F269 PolarHBondContact NE1-O 3.35Å; F242-F269 HydrophobicContact CD1-CE1 4.44Å; F242-F269 HydrophobicContact CE1-CD1 4.16Å; F242-F269 AromaticContact CE1-CE1 3.99Å; F242-F269 HydrophobicContact CE1-CE1 3.99Å; L246-F269 HydrophobicContact CD1-CE1 4.04Å; L246-F269 HydrophobicContact CD1-CZ 3.98Å; L249-F269 HydrophobicContact CD2-CZ 4.26Å; I265-F269 HydrophobicContact CG2-CE2 4.29Å; I265-F269 WeakPolarHBondContact O-CD2 3.48Å; L266-F269 WeakPolarHBondContact O-CB 3.38Å; L266-F269 PolarHBondContact O-N 2.93Å; S267-F269 VanDerWaalsContact C-N 3.26Å; S267-F269 PolarHBondContact O-N 3.24Å; F269-Q273 WeakPolarHBondContact O-CB 3.22Å; F269-Q273 PolarHBondContact O-N 2.97Å |
| 270 | M | 97.1 | Very high | 94.9 | Very high | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -78.8 | -29.8 | 175.8 | -58.5 | -48.7 | -70.1 | 0 | 0 | 112.5 | I113 I116 A181 F182 L185 F205 S267 L268 Q273 A274 | I113-M270 HydrophobicContact CD1-CE 4.14Å; I113-M270 HydrophobicContact CG1-CE 3.74Å; I113-M270 HydrophobicContact CG1-SD 4.21Å; I116-M270 HydrophobicContact CD1-SD 4.44Å; A181-M270 HydrophobicContact CB-CB 4.24Å; A181-M270 HydrophobicContact CB-CE 3.52Å; A181-M270 HydrophobicContact CB-CG 4.1Å; F182-M270 HydrophobicContact CB-CB 4.13Å; L185-M270 HydrophobicContact CD1-CG 3.74Å; F205-M270 HydrophobicContact CE2-CE 4.5Å; F205-M270 HydrophobicContact CE2-CG 4.19Å; F205-M270 HydrophobicContact CE2-SD 4.31Å; S267-M270 PolarHBondContact O-N 3.15Å; L268-M270 VanDerWaalsContact C-N 3.27Å; L268-M270 PolarHBondContact O-N 3.47Å; M270-Q273 WeakPolarHBondContact O-CB 3.27Å; M270-Q273 PolarHBondContact O-N 3.41Å; M270-A274 PolarHBondContact O-N 2.99Å |
| 271 | L | 97.3 | Very high | 94.7 | Very high | 69 Ų | 69 | 41.7 Ų | 41.7 | 36% | 0.361 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -65.6 | -45.1 | 169.9 | -175.9 | 62.5 | 0 | 0 | 0 | 111.5 | F182 S267 L268 Q273 A274 L275 | F182-L271 HydrophobicContact CD1-CD1 4.38Å; F182-L271 HydrophobicContact CD2-CB 3.92Å; F182-L271 HydrophobicContact CE1-CD1 4.37Å; F182-L271 HydrophobicContact CE2-CB 4.18Å; F182-L271 HydrophobicContact CE2-CD2 4.33Å; F182-L271 HydrophobicContact CG-CB 4.31Å; F182-L271 HydrophobicContact CZ-CD2 4.4Å; S267-L271 PolarHBondContact O-N 2.98Å; L268-L271 HydrophobicContact CD2-CD2 4.16Å; L268-L271 PolarHBondContact O-N 3.07Å; L271-Q273 VanDerWaalsContact C-N 3.28Å; L271-Q273 PolarHBondContact O-N 3.05Å; L271-A274 WeakPolarHBondContact O-CB 3.46Å; L271-A274 PolarHBondContact O-N 3.15Å; L271-A274 VanDerWaalsContact O-N 3.14Å; L271-L275 PolarHBondContact O-N 2.9Å |
| 272 | V | 97.8 | Very high | 93.9 | Very high | 58 Ų | 58 | 37.1 Ų | 37.1 | 35% | 0.352 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -59.5 | -41.1 | 171.5 | 171.2 | 0 | 0 | 0 | 0 | 110.5 | W108 L268 A274 L275 L276 | W108-V272 HydrophobicContact CD2-CG1 4.2Å; W108-V272 HydrophobicContact CH2-CG1 4.44Å; W108-V272 HydrophobicContact CZ2-CB 4.04Å; W108-V272 HydrophobicContact CZ2-CG1 3.75Å; L268-V272 WeakPolarHBondContact O-CG2 3.46Å; L268-V272 PolarHBondContact O-N 2.97Å; V272-A274 VanDerWaalsContact C-N 3.34Å; V272-A274 PolarHBondContact O-N 3.26Å; V272-L275 PolarHBondContact O-N 3.08Å; V272-L276 HydrophobicContact CG1-CD1 3.81Å; V272-L276 HydrophobicContact CG1-CG 4.28Å; V272-L276 WeakPolarHBondContact O-CG 3.45Å; V272-L276 PolarHBondContact O-N 3.28Å |
| 273 | Q | 96.3 | Very high | 93.1 | Very high | 0 Ų | 0 | 39.6 Ų | 39.6 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -62.6 | -37.2 | 174.5 | 177.4 | 47.8 | 32.7 | 0 | 0 | 112.9 | A105 C109 A178 F269 M270 L271 L275 L276 A277 | A105-Q273 PolarHBondContact O-OE1 3.15Å; C109-Q273 VanDerWaalsContact CA-OE1 3.26Å; C109-Q273 HydrophobicContact CB-CG 4.22Å; C109-Q273 VanDerWaalsContact CB-NE2 3.32Å; C109-Q273 PolarHBondContact SG-NE2 3.18Å; C109-Q273 VanDerWaalsContact SG-NE2 3.39Å; A178-Q273 HydrophobicContact CB-CB 4.33Å; A178-Q273 HydrophobicContact CB-CG 3.95Å; F269-Q273 WeakPolarHBondContact O-CB 3.22Å; F269-Q273 PolarHBondContact O-N 2.97Å; M270-Q273 WeakPolarHBondContact O-CB 3.27Å; M270-Q273 PolarHBondContact O-N 3.41Å; L271-Q273 VanDerWaalsContact C-N 3.28Å; L271-Q273 PolarHBondContact O-N 3.05Å; Q273-L275 VanDerWaalsContact C-N 3.31Å; Q273-L275 PolarHBondContact O-N 3.01Å; Q273-L276 PolarHBondContact O-N 3.34Å; Q273-A277 VanDerWaalsContact O-CB 3.29Å; Q273-A277 WeakPolarHBondContact O-CB 3.29Å; Q273-A277 PolarHBondContact O-N 3.25Å |
| 274 | A | 96.9 | Very high | 91.8 | Very high | 12 Ų | 12 | 40.3 Ų | 40.3 | 10% | 0.099 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -64.2 | -36.5 | 176 | 0 | 0 | 0 | 0 | 0 | 112.2 | A178 M270 L271 V272 | A178-A274 HydrophobicContact CB-CB 3.69Å; M270-A274 PolarHBondContact O-N 2.99Å; L271-A274 WeakPolarHBondContact O-CB 3.46Å; L271-A274 PolarHBondContact O-N 3.15Å; L271-A274 VanDerWaalsContact O-N 3.14Å; V272-A274 VanDerWaalsContact C-N 3.34Å; V272-A274 PolarHBondContact O-N 3.26Å |
| 275 | L | 97.2 | Very high | 89.9 | Confident | 111 Ų | 111 | 43.1 Ų | 43.1 | 58% | 0.581 | 23% | 0.233 | S | C | * | . | H | α-helix | trans | -70.1 | -45.6 | 173.4 | -62.8 | 175.6 | 0 | 0 | 0 | 111.7 | L271 V272 Q273 A277 L278 | L271-L275 PolarHBondContact O-N 2.9Å; V272-L275 PolarHBondContact O-N 3.08Å; Q273-L275 VanDerWaalsContact C-N 3.31Å; Q273-L275 PolarHBondContact O-N 3.01Å; L275-A277 VanDerWaalsContact C-N 3.31Å; L275-A277 PolarHBondContact O-N 3.24Å; L275-L278 HydrophobicContact CD2-CD1 4.42Å; L275-L278 VanDerWaalsContact O-CB 3.27Å; L275-L278 WeakPolarHBondContact O-CB 3.15Å; L275-L278 WeakPolarHBondContact O-CG 3.37Å; L275-L278 PolarHBondContact O-N 3.45Å; L275-L278 VanDerWaalsContact O-N 3.14Å |
| 276 | L | 96.3 | Very high | 87.8 | Confident | 29 Ų | 29 | 44.1 Ų | 44.1 | 15% | 0.152 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -63.7 | -34.2 | 178.4 | -72.2 | 173.4 | 0 | 0 | 0 | 112.5 | F104 A105 W108 V272 Q273 L278 T279 | F104-L276 HydrophobicContact CD1-CD2 4.2Å; F104-L276 HydrophobicContact CE1-CD1 4.27Å; F104-L276 HydrophobicContact CE1-CD2 4.01Å; A105-L276 HydrophobicContact CB-CB 3.86Å; W108-L276 HydrophobicContact CB-CD1 3.59Å; W108-L276 HydrophobicContact CD2-CD1 4.05Å; W108-L276 HydrophobicContact CG-CD1 3.47Å; W108-L276 VanDerWaalsContact CG-CD1 3.47Å; V272-L276 HydrophobicContact CG1-CD1 3.81Å; V272-L276 HydrophobicContact CG1-CG 4.28Å; V272-L276 WeakPolarHBondContact O-CG 3.45Å; V272-L276 PolarHBondContact O-N 3.28Å; Q273-L276 PolarHBondContact O-N 3.34Å; L276-L278 PolarHBondContact O-N 2.88Å; L276-T279 WeakPolarHBondContact O-CB 3.32Å; L276-T279 WeakPolarHBondContact O-CG2 3.5Å; L276-T279 PolarHBondContact O-N 3.38Å; L276-T279 PolarHBondContact O-OG1 3.15Å |
| 277 | A | 94.6 | Very high | 85.6 | Confident | 0 Ų | 0 | 47.3 Ų | 47.3 | 0% | 0 | 28% | 0.275 | C | S | . | . | G | 310 helix | trans | -61.8 | -20.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | A174 V175 Q273 L275 T279 F280 | A174-A277 HydrophobicContact CB-CB 3.81Å; V175-A277 HydrophobicContact CG2-CB 3.64Å; Q273-A277 VanDerWaalsContact O-CB 3.29Å; Q273-A277 WeakPolarHBondContact O-CB 3.29Å; Q273-A277 PolarHBondContact O-N 3.25Å; L275-A277 VanDerWaalsContact C-N 3.31Å; L275-A277 PolarHBondContact O-N 3.24Å; A277-T279 PolarHBondContact O-N 3.47Å; A277-F280 HydrophobicContact CB-CD2 4.49Å; A277-F280 HydrophobicContact CB-CE2 4.42Å; A277-F280 WeakPolarHBondContact O-CB 3.4Å; A277-F280 PolarHBondContact O-N 3.42Å |
| 278 | L | 95.3 | Very high | 82.7 | Confident | 90 Ų | 90 | 49.8 Ų | 49.8 | 47% | 0.471 | 30% | 0.301 | S | S | . | . | G | 310 helix | trans | -63.9 | -26.1 | 172.3 | -62.1 | 168 | 0 | 0 | 0 | 112.3 | R171 V175 L275 L276 F280 | R171-L278 PolarHBondContact NE-O 3.44Å; R171-L278 PolarHBondContact NH2-O 3.35Å; R171-L278 VanDerWaalsContact NH2-O 3.09Å; V175-L278 HydrophobicContact CG1-CD2 4.49Å; V175-L278 HydrophobicContact CG2-CD2 3.84Å; V175-L278 HydrophobicContact CG2-CG 4.22Å; L275-L278 HydrophobicContact CD2-CD1 4.42Å; L275-L278 VanDerWaalsContact O-CB 3.27Å; L275-L278 WeakPolarHBondContact O-CB 3.15Å; L275-L278 WeakPolarHBondContact O-CG 3.37Å; L275-L278 PolarHBondContact O-N 3.45Å; L275-L278 VanDerWaalsContact O-N 3.14Å; L276-L278 PolarHBondContact O-N 2.88Å; L278-F280 PolarHBondContact O-N 2.75Å |
| 279 | T | 94.3 | Very high | 79.9 | Confident | 20 Ų | 20 | 49.3 Ų | 49.3 | 12% | 0.123 | 32% | 0.318 | C | S | . | . | G | 310 helix | trans | -67.1 | -23.3 | 179.1 | 68.1 | 0 | 0 | 0 | 0 | 113 | W98 L101 A105 L276 A277 K281 | W98-T279 PolarHBondContact NE1-O 3.49Å; L101-T279 HydrophobicContact CD2-CG2 3.96Å; L101-T279 HydrophobicContact CG-CG2 4.02Å; A105-T279 WeakPolarHBondContact CB-OG1 3.26Å; L276-T279 WeakPolarHBondContact O-CB 3.32Å; L276-T279 WeakPolarHBondContact O-CG2 3.5Å; L276-T279 PolarHBondContact O-N 3.38Å; L276-T279 PolarHBondContact O-OG1 3.15Å; A277-T279 PolarHBondContact O-N 3.47Å; T279-K281 PolarHBondContact O-N 3.1Å |
| 280 | F | 92.3 | Very high | 77.4 | Confident | 0 Ų | 0 | 53.2 Ų | 53.2 | 0% | 0 | 34% | 0.338 | C | S | . | . | trans | -64 | 94.9 | 179.3 | -62.8 | -9.2 | 0 | 0 | 0 | 109.8 | V102 A105 R171 A174 I219 A277 L278 | V102-F280 HydrophobicContact CG1-CD1 3.87Å; V102-F280 HydrophobicContact CG1-CE1 4.11Å; V102-F280 HydrophobicContact CG2-CD1 4.39Å; A105-F280 HydrophobicContact CB-CD1 4.42Å; A105-F280 HydrophobicContact CB-CE1 3.72Å; R171-F280 HydrophobicContact CB-CB 4.47Å; R171-F280 WeakPolarHBondContact CB-O 3.34Å; R171-F280 PolarHBondContact NE-O 3.18Å; R171-F280 PolarHBondContact NH2-O 3.3Å; A174-F280 HydrophobicContact CB-CD2 3.81Å; A174-F280 HydrophobicContact CB-CE2 3.72Å; I219-F280 HydrophobicContact CD1-CB 4.5Å; I219-F280 HydrophobicContact CG1-CB 4.15Å; I219-F280 HydrophobicContact CG1-CG 4.33Å; I219-F280 HydrophobicContact CG2-CD1 4.14Å; I219-F280 HydrophobicContact CG2-CD2 4.42Å; I219-F280 HydrophobicContact CG2-CE1 4.17Å; I219-F280 HydrophobicContact CG2-CE2 4.46Å; I219-F280 HydrophobicContact CG2-CG 4.27Å; I219-F280 HydrophobicContact CG2-CZ 4.34Å; A277-F280 HydrophobicContact CB-CD2 4.49Å; A277-F280 HydrophobicContact CB-CE2 4.42Å; A277-F280 WeakPolarHBondContact O-CB 3.4Å; A277-F280 PolarHBondContact O-N 3.42Å; L278-F280 PolarHBondContact O-N 2.75Å | ||
| 281 | K | 86.3 | Confident | 74.5 | Confident | 122 Ų | 122 | 55.3 Ų | 55.3 | 53% | 0.53 | 36% | 0.36 | S | S | . | . | trans | -93.9 | 112.8 | 175.1 | -179.8 | -177.1 | 178 | -178.1 | 0 | 108 | Y223 T279 L283 | Y223-K281 WeakPolarHBondContact CE2-O 3.35Å; Y223-K281 WeakPolarHBondContact OH-CB 3.36Å; Y223-K281 PolarHBondContact OH-O 2.65Å; T279-K281 PolarHBondContact O-N 3.1Å; K281-L283 HydrophobicContact CD-CD2 4.39Å; K281-L283 HydrophobicContact CG-CD2 4.31Å; K281-L283 PolarHBondContact O-N 2.89Å | ||
| 282 | P | 74 | Confident | 71.3 | Confident | 49 Ų | 49 | 56.7 Ų | 56.7 | 32% | 0.318 | 37% | 0.373 | S | S | . | . | trans | -66.3 | 125.1 | 178.8 | 27.2 | -33.1 | 0 | 0 | 0 | 109.7 | ||||
| 283 | L | 74.3 | Confident | 68.1 | Low | 52 Ų | 52 | 60.7 Ų | 60.7 | 27% | 0.272 | 40% | 0.4 | S | S | . | . | trans | -101 | -24.1 | 177.3 | -56.7 | -176.2 | 0 | 0 | 0 | 113.3 | F91 P94 Y223 K281 | F91-L283 HydrophobicContact CE2-CB 3.78Å; F91-L283 WeakPolarHBondContact CE2-O 3.07Å; F91-L283 HydrophobicContact CZ-CB 3.52Å; F91-L283 HydrophobicContact CZ-CD1 4.28Å; P94-L283 HydrophobicContact CG-CD1 3.81Å; Y223-L283 HydrophobicContact CD1-CD1 3.89Å; Y223-L283 HydrophobicContact CD2-CD1 4.3Å; Y223-L283 HydrophobicContact CE1-CD1 3.67Å; Y223-L283 HydrophobicContact CE1-CG 4.39Å; Y223-L283 HydrophobicContact CE2-CD1 4.08Å; Y223-L283 HydrophobicContact CE2-CG 4.16Å; Y223-L283 HydrophobicContact CG-CD1 4.22Å; K281-L283 HydrophobicContact CD-CD2 4.39Å; K281-L283 HydrophobicContact CG-CD2 4.31Å; K281-L283 PolarHBondContact O-N 2.89Å | ||
| 284 | L | 66.1 | Low | 65.2 | Low | 16 Ų | 16 | 64.7 Ų | 64.7 | 8% | 0.084 | 44% | 0.441 | C | S | . | . | S | Bend | trans | -87.1 | 142.3 | 174.7 | -73.1 | 172.5 | 0 | 0 | 0 | 111.3 | F91 H222 T286 P455 M456 | F91-L284 HydrophobicContact CB-CD2 4.18Å; F91-L284 HydrophobicContact CD1-CD2 3.36Å; F91-L284 HydrophobicContact CD1-CG 4.21Å; F91-L284 HydrophobicContact CD2-CD2 4.34Å; F91-L284 HydrophobicContact CE1-CD2 3.75Å; F91-L284 HydrophobicContact CE1-CG 4.09Å; F91-L284 HydrophobicContact CG-CD2 3.69Å; F91-L284 HydrophobicContact CZ-CD2 4.4Å; H222-L284 HydrophobicContact CB-CD1 4.43Å; L284-T286 PolarHBondContact O-N 2.86Å; L284-P455 HydrophobicContact CD1-CB 3.93Å; L284-M456 HydrophobicContact CB-CE 3.88Å; L284-M456 HydrophobicContact CD1-CE 4.05Å; L284-M456 HydrophobicContact CD2-CE 4.06Å; L284-M456 HydrophobicContact CG-CE 4.23Å |
| 285 | P | 55.7 | Low | 62.4 | Low | 100 Ų | 100 | 72 Ų | 72 | 65% | 0.649 | 48% | 0.476 | S | S | * | . | P | Polyproline II helix | trans | -58.9 | 123.3 | 178.7 | -25 | 34.8 | 0 | 0 | 0 | 112.6 | ||
| 286 | T | 50.2 | Low | 59.3 | Low | 68 Ų | 68 | 69.3 Ų | 69.3 | 42% | 0.417 | 47% | 0.474 | S | S | . | . | S | Bend | trans | -86.3 | 127.4 | 177.6 | -52.3 | 0 | 0 | 0 | 0 | 109.6 | D166 L284 G288 | D166-T286 WeakPolarHBondContact O-CG2 3.33Å; L284-T286 PolarHBondContact O-N 2.86Å; T286-G288 PolarHBondContact O-N 3.43Å |
| 287 | G | 46.8 | Very low | 56.3 | Low | 68 Ų | 68 | 73.6 Ų | 73.6 | 70% | 0.701 | 50% | 0.504 | S | S | * | . | S | Bend | trans | 78.3 | 7 | 168.1 | 0 | 0 | 0 | 0 | 0 | 117.9 | G289 | G287-G289 PolarHBondContact O-N 2.96Š|
| 288 | G | 35.8 | Very low | 53.4 | Low | 55 Ų | 55 | 75.3 Ų | 75.3 | 57% | 0.567 | 52% | 0.522 | S | S | * | . | trans | -68 | 109.5 | 171.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | T286 M290 | T286-G288 PolarHBondContact O-N 3.43Å; G288-M290 VanDerWaalsContact C-N 3.33Å; G288-M290 PolarHBondContact O-N 3.23Å | ||
| 289 | G | 38.5 | Very low | 50.7 | Low | 83 Ų | 83 | 76.3 Ų | 76.3 | 86% | 0.856 | 53% | 0.534 | S | S | * | . | trans | -70.7 | 75.4 | -174.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | G287 G291 | G287-G289 PolarHBondContact O-N 2.96Å; G289-G291 PolarHBondContact O-N 3.31Å | ||
| 290 | M | 41.9 | Very low | 48.2 | Very low | 115 Ų | 115 | 78.3 Ų | 78.3 | 57% | 0.567 | 55% | 0.552 | S | S | * | * | trans | -72.1 | 90.3 | -179.4 | -77.9 | -167 | -80.5 | 0 | 0 | 113.4 | G288 R328 M456 | G288-M290 VanDerWaalsContact C-N 3.33Å; G288-M290 PolarHBondContact O-N 3.23Å; M290-R328 PolarHBondContact O-NH1 3.07Å; M290-M456 HydrophobicContact CE-CG 3.85Å; M290-M456 HydrophobicContact CE-SD 3.32Å; M290-M456 WeakPolarHBondContact CE-SD 3.34Å | ||
| 291 | G | 37.7 | Very low | 45.8 | Very low | 45 Ų | 45 | 82.9 Ų | 82.9 | 46% | 0.464 | 57% | 0.574 | S | S | . | * | S | Bend | trans | -61.8 | -174.3 | 133.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | G289 | G289-G291 PolarHBondContact O-N 3.31Š|
| 292 | P | 30.3 | Very low | 43.5 | Very low | 98 Ų | 98 | 80.2 Ų | 80.2 | 64% | 0.636 | 58% | 0.575 | S | S | * | * | S | Bend | trans | -62.7 | 153.7 | 178 | 27.4 | -34.5 | 0 | 0 | 0 | 111.9 | G294 | P292-G294 PolarHBondContact O-N 2.92Š|
| 293 | P | 30.1 | Very low | 41.8 | Very low | 141 Ų | 141 | 85 Ų | 85 | 92% | 0.916 | 59% | 0.593 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.7 | 131.5 | 179.9 | -22.6 | 33.5 | 0 | 0 | 0 | 111.9 | ||
| 294 | G | 35.3 | Very low | 40.4 | Very low | 84 Ų | 84 | 87.1 Ų | 87.1 | 87% | 0.866 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 117.3 | -20.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | P292 | P292-G294 PolarHBondContact O-N 2.92Š|
| 295 | M | 36.9 | Very low | 39.3 | Very low | 166 Ų | 166 | 93 Ų | 93 | 82% | 0.818 | 64% | 0.635 | S | S | * | * | trans | -92.5 | 109.3 | 172.2 | -77.7 | -173.9 | 169.7 | 0 | 0 | 111.8 | ||||
| 296 | G | 33.8 | Very low | 38.5 | Very low | 54 Ų | 54 | 91.8 Ų | 91.8 | 56% | 0.557 | 63% | 0.633 | S | S | * | * | trans | -67.3 | -175 | 153.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | G298 | G296-G298 PolarHBondContact O-N 3.34Š| ||
| 297 | P | 33 | Very low | 38.2 | Very low | 119 Ų | 119 | 92.9 Ų | 92.9 | 77% | 0.773 | 64% | 0.644 | S | S | * | * | S | Bend | trans | -61.8 | 102.4 | 179 | 26.2 | -34 | 0 | 0 | 0 | 110.7 | ||
| 298 | G | 33 | Very low | 38.2 | Very low | 37 Ų | 37 | 91.3 Ų | 91.3 | 38% | 0.381 | 62% | 0.624 | S | S | . | * | trans | -71.6 | 160 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | G296 A300 E301 | G296-G298 PolarHBondContact O-N 3.34Å; G298-A300 PolarHBondContact O-N 2.83Å; G298-E301 PolarHBondContact O-N 3.38Å; G298-E301 VanDerWaalsContact O-N 3.09Å | ||
| 299 | P | 39.2 | Very low | 38.8 | Very low | 111 Ų | 111 | 97 Ų | 97 | 72% | 0.721 | 64% | 0.636 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.4 | -19.5 | -175.6 | 21.2 | -32.7 | 0 | 0 | 0 | 114.6 | E301 A302 E303 | P299-E301 VanDerWaalsContact C-N 3.25Å; P299-E301 PolarHBondContact O-N 3.25Å; P299-A302 WeakPolarHBondContact O-CA 3.34Å; P299-A302 WeakPolarHBondContact O-CB 3.41Å; P299-A302 PolarHBondContact O-N 2.73Å; P299-E303 PolarHBondContact O-N 3.1Å |
| 300 | A | 42.1 | Very low | 39.4 | Very low | 61 Ų | 61 | 96.9 Ų | 96.9 | 50% | 0.504 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -57 | -29.4 | 173.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | G298 A302 T304 | G298-A300 PolarHBondContact O-N 2.83Å; A300-A302 VanDerWaalsContact C-N 3.28Å; A300-A302 PolarHBondContact O-N 2.64Å; A300-T304 WeakPolarHBondContact O-CB 3.44Å; A300-T304 PolarHBondContact O-N 3.05Å; A300-T304 VanDerWaalsContact O-N 3.08Å; A300-T304 PolarHBondContact O-OG1 3.16Å |
| 301 | E | 41.6 | Very low | 40 | Very low | 97 Ų | 97 | 94.8 Ų | 94.8 | 45% | 0.453 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -73.3 | -18.5 | 173.6 | -77.6 | -151.5 | 126.6 | 0 | 0 | 113.1 | G298 P299 Q305 K323 | G298-E301 PolarHBondContact O-N 3.38Å; G298-E301 VanDerWaalsContact O-N 3.09Å; P299-E301 VanDerWaalsContact C-N 3.25Å; P299-E301 PolarHBondContact O-N 3.25Å; E301-Q305 WeakPolarHBondContact O-CG 3.5Å; E301-Q305 PolarHBondContact O-NE2 3.16Å; E301-Q305 VanDerWaalsContact O-NE2 3.15Å; E301-K323 IonicContact OE1-NZ 3.7Å; E301-K323 PolarHBondContact OE1-NZ 3.16Å |
| 302 | A | 37.7 | Very low | 41.6 | Very low | 66 Ų | 66 | 96.1 Ų | 96.1 | 55% | 0.545 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -81.9 | -46.8 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | P299 A300 T304 Q305 | P299-A302 WeakPolarHBondContact O-CA 3.34Å; P299-A302 WeakPolarHBondContact O-CB 3.41Å; P299-A302 PolarHBondContact O-N 2.73Å; A300-A302 VanDerWaalsContact C-N 3.28Å; A300-A302 PolarHBondContact O-N 2.64Å; A302-T304 VanDerWaalsContact C-N 3.3Å; A302-T304 PolarHBondContact O-N 3.12Å; A302-Q305 PolarHBondContact O-N 3.25Å; A302-Q305 VanDerWaalsContact O-N 3.09Å |
| 303 | E | 39.2 | Very low | 43.7 | Very low | 149 Ų | 149 | 100.5 Ų | 100.5 | 70% | 0.696 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -61.6 | -38.2 | 177.8 | -65.3 | -173.8 | 137.4 | 0 | 0 | 112.2 | P299 Q305 A306 | P299-E303 PolarHBondContact O-N 3.1Å; E303-Q305 PolarHBondContact O-N 3.46Å; E303-A306 WeakPolarHBondContact O-CB 3.26Å; E303-A306 PolarHBondContact O-N 2.92Å; E303-A306 VanDerWaalsContact O-N 3.15Å |
| 304 | T | 43.2 | Very low | 45.3 | Very low | 96 Ų | 96 | 103.5 Ų | 103.5 | 59% | 0.589 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -58 | -34.9 | 175.8 | -58.5 | 0 | 0 | 0 | 0 | 111.8 | A300 A302 S307 | A300-T304 WeakPolarHBondContact O-CB 3.44Å; A300-T304 PolarHBondContact O-N 3.05Å; A300-T304 VanDerWaalsContact O-N 3.08Å; A300-T304 PolarHBondContact O-OG1 3.16Å; A302-T304 VanDerWaalsContact C-N 3.3Å; A302-T304 PolarHBondContact O-N 3.12Å; T304-S307 PolarHBondContact O-OG 3.39Å |
| 305 | Q | 42.8 | Very low | 46.6 | Very low | 139 Ų | 139 | 101.8 Ų | 101.8 | 65% | 0.65 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -72.7 | -29.6 | -179.7 | -68.8 | 177.8 | 43.1 | 0 | 0 | 113.2 | E301 A302 E303 S307 A308 | E301-Q305 WeakPolarHBondContact O-CG 3.5Å; E301-Q305 PolarHBondContact O-NE2 3.16Å; E301-Q305 VanDerWaalsContact O-NE2 3.15Å; A302-Q305 PolarHBondContact O-N 3.25Å; A302-Q305 VanDerWaalsContact O-N 3.09Å; E303-Q305 PolarHBondContact O-N 3.46Å; Q305-S307 VanDerWaalsContact C-N 3.28Å; Q305-S307 PolarHBondContact O-N 3Å; Q305-A308 WeakPolarHBondContact O-CB 3.44Å; Q305-A308 PolarHBondContact O-N 3.38Å; Q305-A308 VanDerWaalsContact O-N 3.14Å |
| 306 | A | 40.6 | Very low | 47.8 | Very low | 75 Ų | 75 | 98.2 Ų | 98.2 | 62% | 0.62 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -62 | -36.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | E303 A308 | E303-A306 WeakPolarHBondContact O-CB 3.26Å; E303-A306 PolarHBondContact O-N 2.92Å; E303-A306 VanDerWaalsContact O-N 3.15Å; A306-A308 VanDerWaalsContact C-N 3.28Å; A306-A308 PolarHBondContact O-N 2.83Å |
| 307 | S | 42.2 | Very low | 49.4 | Very low | 92 Ų | 92 | 100.1 Ų | 100.1 | 64% | 0.643 | 58% | 0.584 | S | S | * | * | G | 310 helix | trans | -72 | -16.9 | 177.5 | 70.3 | 0 | 0 | 0 | 0 | 114.5 | T304 Q305 Q309 | T304-S307 PolarHBondContact O-OG 3.39Å; Q305-S307 VanDerWaalsContact C-N 3.28Å; Q305-S307 PolarHBondContact O-N 3Å; S307-Q309 VanDerWaalsContact C-N 3.33Å; S307-Q309 PolarHBondContact O-N 3.29Å |
| 308 | A | 48.8 | Very low | 51 | Low | 34 Ų | 34 | 97.4 Ų | 97.4 | 28% | 0.281 | 57% | 0.565 | S | S | . | * | G | 310 helix | trans | -80.6 | -4.5 | -169 | 0 | 0 | 0 | 0 | 0 | 114.9 | Q305 A306 G310 K316 | Q305-A308 WeakPolarHBondContact O-CB 3.44Å; Q305-A308 PolarHBondContact O-N 3.38Å; Q305-A308 VanDerWaalsContact O-N 3.14Å; A306-A308 VanDerWaalsContact C-N 3.28Å; A306-A308 PolarHBondContact O-N 2.83Å; A308-G310 PolarHBondContact O-N 3.05Å; A308-K316 WeakPolarHBondContact O-CE 3.44Å; A308-K316 PolarHBondContact O-NZ 3.42Å |
| 309 | Q | 47.4 | Very low | 52.2 | Low | 174 Ų | 174 | 97.9 Ų | 97.9 | 81% | 0.813 | 57% | 0.566 | S | S | * | * | G | 310 helix | trans | -65.7 | -34.9 | -174.5 | -67.8 | -171.1 | -10.8 | 0 | 0 | 113.1 | S307 | S307-Q309 VanDerWaalsContact C-N 3.33Å; S307-Q309 PolarHBondContact O-N 3.29Å |
| 310 | G | 51.9 | Low | 53.2 | Low | 82 Ų | 82 | 94 Ų | 94 | 85% | 0.845 | 55% | 0.546 | S | S | * | . | G | 310 helix | trans | -82.5 | -11 | -178.6 | 0 | 0 | 0 | 0 | 0 | 117.1 | A308 | A308-G310 PolarHBondContact O-N 3.05Š|
| 311 | M | 53.8 | Low | 54.2 | Low | 71 Ų | 71 | 94.4 Ų | 94.4 | 35% | 0.35 | 54% | 0.542 | S | S | . | . | trans | -76.7 | 136.9 | -174.1 | -85.9 | 165.8 | 62.1 | 0 | 0 | 113.6 | S315 K316 A319 | M311-S315 WeakPolarHBondContact CE-O 3.36Å; M311-S315 WeakPolarHBondContact CE-OG 3.2Å; M311-K316 HydrophobicContact CB-CD 4.41Å; M311-K316 HydrophobicContact CB-CG 3.93Å; M311-K316 HydrophobicContact CE-CG 4.27Å; M311-K316 WeakPolarHBondContact O-CD 3.19Å; M311-K316 WeakPolarHBondContact O-CE 3.21Å; M311-K316 PolarHBondContact O-NZ 2.82Å; M311-A319 HydrophobicContact CE-CB 3.82Å | ||
| 312 | S | 71 | Confident | 55.2 | Low | 72 Ų | 72 | 99.5 Ų | 99.5 | 50% | 0.503 | 56% | 0.557 | S | S | . | * | trans | -61.4 | 155.9 | 173.6 | 73.9 | 0 | 0 | 0 | 0 | 112.5 | W314 S315 K316 | S312-W314 PolarHBondContact O-N 3.47Å; S312-S315 PolarHBondContact O-N 3.37Å; S312-S315 VanDerWaalsContact O-N 3.1Å; S312-S315 WeakPolarHBondContact OG-CB 3.19Å; S312-S315 PolarHBondContact OG-N 3.15Å; S312-K316 PolarHBondContact O-N 3.07Å | ||
| 313 | K | 73.9 | Confident | 56.3 | Low | 190 Ų | 190 | 103.2 Ų | 103.2 | 83% | 0.826 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -52.4 | -42.7 | 177.2 | -85 | -174.4 | 174.6 | 179.3 | 0 | 112.3 | K316 V317 | K313-K316 PolarHBondContact O-N 3.16Å; K313-V317 WeakPolarHBondContact O-CG2 3.4Å; K313-V317 PolarHBondContact O-N 3.27Å |
| 314 | W | 63.7 | Low | 57.3 | Low | 205 Ų | 205 | 101.1 Ų | 101.1 | 78% | 0.777 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -66.1 | -42.6 | 179.5 | -155.9 | 83.4 | 0 | 0 | 0 | 111.8 | S312 K316 V317 V318 | S312-W314 PolarHBondContact O-N 3.47Å; W314-K316 VanDerWaalsContact C-N 3.32Å; W314-K316 PolarHBondContact O-N 3.41Å; W314-V317 PolarHBondContact O-N 3.07Å; W314-V318 HydrophobicContact CD2-CG2 4.09Å; W314-V318 HydrophobicContact CE3-CG2 3.71Å; W314-V318 HydrophobicContact CH2-CG2 4Å; W314-V318 HydrophobicContact CZ2-CG2 4.35Å; W314-V318 HydrophobicContact CZ3-CG2 3.67Å; W314-V318 WeakPolarHBondContact O-CG2 3.32Å; W314-V318 PolarHBondContact O-N 3.12Å |
| 315 | S | 62.3 | Low | 58.4 | Low | 48 Ų | 48 | 101.1 Ų | 101.1 | 34% | 0.336 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -64.6 | -35.1 | 175.6 | -161.2 | 0 | 0 | 0 | 0 | 112.3 | M311 S312 V318 A319 | M311-S315 WeakPolarHBondContact CE-O 3.36Å; M311-S315 WeakPolarHBondContact CE-OG 3.2Å; S312-S315 PolarHBondContact O-N 3.37Å; S312-S315 VanDerWaalsContact O-N 3.1Å; S312-S315 WeakPolarHBondContact OG-CB 3.19Å; S312-S315 PolarHBondContact OG-N 3.15Å; S315-V318 PolarHBondContact O-N 3.14Å; S315-A319 VanDerWaalsContact O-CB 3.3Å; S315-A319 WeakPolarHBondContact O-CB 3.36Å; S315-A319 PolarHBondContact O-N 3.3Å |
| 316 | K | 63.5 | Low | 59.6 | Low | 91 Ų | 91 | 97.6 Ų | 97.6 | 40% | 0.396 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -66.9 | -40.1 | 172.8 | -72.9 | 173.4 | 173.3 | 160.2 | 0 | 112.7 | A308 M311 S312 K313 W314 G320 | A308-K316 WeakPolarHBondContact O-CE 3.44Å; A308-K316 PolarHBondContact O-NZ 3.42Å; M311-K316 HydrophobicContact CB-CD 4.41Å; M311-K316 HydrophobicContact CB-CG 3.93Å; M311-K316 HydrophobicContact CE-CG 4.27Å; M311-K316 WeakPolarHBondContact O-CD 3.19Å; M311-K316 WeakPolarHBondContact O-CE 3.21Å; M311-K316 PolarHBondContact O-NZ 2.82Å; S312-K316 PolarHBondContact O-N 3.07Å; K313-K316 PolarHBondContact O-N 3.16Å; W314-K316 VanDerWaalsContact C-N 3.32Å; W314-K316 PolarHBondContact O-N 3.41Å; K316-G320 PolarHBondContact O-N 3.4Å |
| 317 | V | 67.4 | Low | 61.4 | Low | 93 Ų | 93 | 98.4 Ų | 98.4 | 56% | 0.564 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -63.9 | -46.6 | 172.3 | 170.6 | 0 | 0 | 0 | 0 | 110.8 | K313 W314 A319 G320 V321 | K313-V317 WeakPolarHBondContact O-CG2 3.4Å; K313-V317 PolarHBondContact O-N 3.27Å; W314-V317 PolarHBondContact O-N 3.07Å; V317-A319 PolarHBondContact O-N 2.74Å; V317-G320 PolarHBondContact O-N 3.25Å; V317-V321 HydrophobicContact CG1-CG2 4.43Å; V317-V321 WeakPolarHBondContact O-CG2 3.47Å; V317-V321 PolarHBondContact O-N 3.46Å |
| 318 | V | 65.7 | Low | 63.2 | Low | 62 Ų | 62 | 99.8 Ų | 99.8 | 38% | 0.376 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63 | -40.5 | 177.7 | 170.1 | 0 | 0 | 0 | 0 | 111.9 | W314 S315 V321 R322 | W314-V318 HydrophobicContact CD2-CG2 4.09Å; W314-V318 HydrophobicContact CE3-CG2 3.71Å; W314-V318 HydrophobicContact CH2-CG2 4Å; W314-V318 HydrophobicContact CZ2-CG2 4.35Å; W314-V318 HydrophobicContact CZ3-CG2 3.67Å; W314-V318 WeakPolarHBondContact O-CG2 3.32Å; W314-V318 PolarHBondContact O-N 3.12Å; S315-V318 PolarHBondContact O-N 3.14Å; V318-V321 PolarHBondContact O-N 3.35Å; V318-R322 VanDerWaalsContact O-CB 3.27Å; V318-R322 WeakPolarHBondContact O-CB 3.32Å; V318-R322 PolarHBondContact O-N 3.27Å |
| 319 | A | 58.4 | Low | 65 | Low | 47 Ų | 47 | 98.2 Ų | 98.2 | 39% | 0.388 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -65 | -39.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | M311 S315 V317 R322 K323 | M311-A319 HydrophobicContact CE-CB 3.82Å; S315-A319 VanDerWaalsContact O-CB 3.3Å; S315-A319 WeakPolarHBondContact O-CB 3.36Å; S315-A319 PolarHBondContact O-N 3.3Å; V317-A319 PolarHBondContact O-N 2.74Å; A319-R322 PolarHBondContact O-N 3.42Å; A319-K323 PolarHBondContact O-N 3.33Å |
| 320 | G | 60.4 | Low | 67 | Low | 31 Ų | 31 | 91.9 Ų | 91.9 | 32% | 0.32 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -59.6 | -52.7 | 171.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | K316 V317 R322 K323 Y324 | K316-G320 PolarHBondContact O-N 3.4Å; V317-G320 PolarHBondContact O-N 3.25Å; G320-R322 VanDerWaalsContact C-N 3.26Å; G320-R322 PolarHBondContact O-N 3.4Å; G320-K323 WeakPolarHBondContact O-CB 3.35Å; G320-K323 PolarHBondContact O-N 3Å; G320-Y324 WeakPolarHBondContact O-CD2 3.26Å; G320-Y324 WeakPolarHBondContact O-CE2 3.32Å; G320-Y324 PolarHBondContact O-N 3.39Å |
| 321 | V | 62.5 | Low | 68.7 | Low | 69 Ų | 69 | 95.2 Ų | 95.2 | 42% | 0.418 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -55.7 | -40.8 | 174.7 | 169.7 | 0 | 0 | 0 | 0 | 111.2 | V317 V318 K323 Y324 F325 | V317-V321 HydrophobicContact CG1-CG2 4.43Å; V317-V321 WeakPolarHBondContact O-CG2 3.47Å; V317-V321 PolarHBondContact O-N 3.46Å; V318-V321 PolarHBondContact O-N 3.35Å; V321-K323 VanDerWaalsContact C-N 3.33Å; V321-K323 PolarHBondContact O-N 2.71Å; V321-Y324 CarbonylContact O-C 3.53Å; V321-Y324 WeakPolarHBondContact O-CA 3.21Å; V321-Y324 PolarHBondContact O-N 3.29Å; V321-F325 HydrophobicContact CG1-CD2 3.56Å; V321-F325 HydrophobicContact CG1-CE2 3.62Å; V321-F325 PolarHBondContact O-N 3.2Å |
| 322 | R | 62.9 | Low | 70.4 | Confident | 204 Ų | 204 | 94 Ų | 94 | 77% | 0.77 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -67.5 | -26.5 | 177.7 | -162.6 | 175.4 | -171.6 | -177.8 | 3.3 | 113.7 | V318 A319 G320 Y324 | V318-R322 VanDerWaalsContact O-CB 3.27Å; V318-R322 WeakPolarHBondContact O-CB 3.32Å; V318-R322 PolarHBondContact O-N 3.27Å; A319-R322 PolarHBondContact O-N 3.42Å; G320-R322 VanDerWaalsContact C-N 3.26Å; G320-R322 PolarHBondContact O-N 3.4Å; R322-Y324 PolarHBondContact O-N 3.09Å |
| 323 | K | 61.1 | Low | 71.4 | Confident | 143 Ų | 143 | 93.1 Ų | 93.1 | 62% | 0.622 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -69.5 | -22.3 | 169.7 | -168.5 | 167.8 | -175.4 | 171.6 | 0 | 112 | E301 A319 G320 V321 | E301-K323 IonicContact OE1-NZ 3.7Å; E301-K323 PolarHBondContact OE1-NZ 3.16Å; A319-K323 PolarHBondContact O-N 3.33Å; G320-K323 WeakPolarHBondContact O-CB 3.35Å; G320-K323 PolarHBondContact O-N 3Å; V321-K323 VanDerWaalsContact C-N 3.33Å; V321-K323 PolarHBondContact O-N 2.71Å |
| 324 | Y | 60.7 | Low | 72.3 | Confident | 105 Ų | 105 | 84.3 Ų | 84.3 | 41% | 0.412 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -97.6 | -22.6 | 177.5 | -56.5 | -58.7 | 0 | 0 | 0 | 114.4 | H167 G320 V321 R322 N326 | H167-Y324 AromaticContact ND1-CE1 3.75Å; H167-Y324 AromaticContact ND1-CZ 3.95Å; G320-Y324 WeakPolarHBondContact O-CD2 3.26Å; G320-Y324 WeakPolarHBondContact O-CE2 3.32Å; G320-Y324 PolarHBondContact O-N 3.39Å; V321-Y324 CarbonylContact O-C 3.53Å; V321-Y324 WeakPolarHBondContact O-CA 3.21Å; V321-Y324 PolarHBondContact O-N 3.29Å; R322-Y324 PolarHBondContact O-N 3.09Å; Y324-N326 PolarHBondContact O-N 3.29Å |
| 325 | F | 65.4 | Low | 73.8 | Confident | 97 Ų | 97 | 74.6 Ų | 74.6 | 43% | 0.425 | 37% | 0.371 | S | S | . | . | trans | -71.7 | 66.5 | 169.3 | -95.5 | -91 | 0 | 0 | 0 | 111.8 | M163 V321 L327 | M163-F325 HydrophobicContact CE-CD2 4Å; M163-F325 HydrophobicContact CE-CE1 4.49Å; M163-F325 HydrophobicContact CE-CE2 3.54Å; M163-F325 HydrophobicContact CE-CZ 3.82Å; M163-F325 HydrophobicContact SD-CD2 3.58Å; M163-F325 VanDerWaalsContact SD-CD2 3.58Å; M163-F325 HydrophobicContact SD-CE2 3.8Å; M163-F325 HydrophobicContact SD-CG 4.02Å; M163-F325 HydrophobicContact SD-CZ 4.38Å; V321-F325 HydrophobicContact CG1-CD2 3.56Å; V321-F325 HydrophobicContact CG1-CE2 3.62Å; V321-F325 PolarHBondContact O-N 3.2Å; F325-L327 PolarHBondContact O-N 2.81Å | ||
| 326 | N | 67.1 | Low | 75.3 | Confident | 65 Ų | 65 | 77.1 Ų | 77.1 | 35% | 0.348 | 37% | 0.373 | S | S | . | . | trans | -82.9 | 80.7 | -174 | -166.9 | 2.4 | 0 | 0 | 0 | 112.4 | Y324 R328 Q460 | Y324-N326 PolarHBondContact O-N 3.29Å; N326-R328 PolarHBondContact O-N 3.23Å; N326-R328 WeakPolarHBondContact OD1-CB 3.14Å; N326-R328 PolarHBondContact OD1-N 3.29Å; N326-Q460 PolarHBondContact O-OE1 3.28Å | ||
| 327 | L | 79.1 | Confident | 76.9 | Confident | 92 Ų | 92 | 74.6 Ų | 74.6 | 48% | 0.482 | 37% | 0.366 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.9 | 6.2 | 177.7 | -60.9 | 177.1 | 0 | 0 | 0 | 114.6 | F325 V329 F330 H331 | F325-L327 PolarHBondContact O-N 2.81Å; L327-V329 PolarHBondContact O-N 3.35Å; L327-V329 VanDerWaalsContact O-N 3.11Å; L327-F330 HydrophobicContact CD2-CD2 3.85Å; L327-F330 HydrophobicContact CD2-CE2 4.19Å; L327-F330 WeakPolarHBondContact O-CA 3.47Å; L327-F330 WeakPolarHBondContact O-CB 3.34Å; L327-F330 PolarHBondContact O-N 2.86Å; L327-H331 PolarHBondContact O-N 3.08Å |
| 328 | R | 80.9 | Confident | 78.3 | Confident | 121 Ų | 121 | 70.2 Ų | 70.2 | 46% | 0.457 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -48.8 | -34.3 | 171.1 | -178.8 | 177.4 | -174.1 | 179.8 | 0.5 | 112.7 | M290 N326 F330 H331 | M290-R328 PolarHBondContact O-NH1 3.07Å; N326-R328 PolarHBondContact O-N 3.23Å; N326-R328 WeakPolarHBondContact OD1-CB 3.14Å; N326-R328 PolarHBondContact OD1-N 3.29Å; R328-F330 VanDerWaalsContact C-N 3.29Å; R328-F330 PolarHBondContact O-N 3.39Å; R328-H331 WeakPolarHBondContact O-CB 3.43Å; R328-H331 PolarHBondContact O-N 2.99Å; R328-H331 VanDerWaalsContact O-N 3.08Å |
| 329 | V | 86.2 | Confident | 79.7 | Confident | 0 Ų | 0 | 67.2 Ų | 67.2 | 0% | 0 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -57.5 | -39 | 173.3 | 171.3 | 0 | 0 | 0 | 0 | 112.4 | L327 H331 I332 Y335 V453 Q457 Q460 A461 Y464 | L327-V329 PolarHBondContact O-N 3.35Å; L327-V329 VanDerWaalsContact O-N 3.11Å; V329-H331 VanDerWaalsContact C-N 3.34Å; V329-H331 PolarHBondContact O-N 3.06Å; V329-I332 WeakPolarHBondContact O-CB 3.42Å; V329-I332 PolarHBondContact O-N 2.91Å; V329-Y335 HydrophobicContact CG1-CD1 3.47Å; V329-Y335 VanDerWaalsContact CG1-CD1 3.47Å; V329-Y335 HydrophobicContact CG1-CD2 4.32Å; V329-Y335 HydrophobicContact CG1-CE1 3.36Å; V329-Y335 HydrophobicContact CG1-CE2 4.19Å; V329-Y335 HydrophobicContact CG1-CG 3.99Å; V329-Y335 WeakPolarHBondContact O-CD1 3.4Å; V329-V453 HydrophobicContact CG1-CG1 4.48Å; V329-Q457 HydrophobicContact CG2-CB 4.11Å; V329-Q460 HydrophobicContact CG2-CB 3.87Å; V329-A461 HydrophobicContact CG1-CB 4.05Å; V329-Y464 HydrophobicContact CB-CD2 4.32Å; V329-Y464 HydrophobicContact CB-CE2 4.46Å; V329-Y464 HydrophobicContact CG1-CD2 4.26Å |
| 330 | F | 89.2 | Confident | 81.5 | Confident | 41 Ų | 41 | 70 Ų | 70 | 18% | 0.18 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -79.4 | -11.2 | 176.9 | -72.1 | -79.1 | 0 | 0 | 0 | 114.4 | L327 R328 I332 Y335 R336 F340 Y464 L468 | L327-F330 HydrophobicContact CD2-CD2 3.85Å; L327-F330 HydrophobicContact CD2-CE2 4.19Å; L327-F330 WeakPolarHBondContact O-CA 3.47Å; L327-F330 WeakPolarHBondContact O-CB 3.34Å; L327-F330 PolarHBondContact O-N 2.86Å; R328-F330 VanDerWaalsContact C-N 3.29Å; R328-F330 PolarHBondContact O-N 3.39Å; F330-I332 VanDerWaalsContact C-N 3.29Å; F330-Y335 HydrophobicContact CD1-CE1 4.15Å; F330-Y335 HydrophobicContact CE1-CE1 4.01Å; F330-Y335 HydrophobicContact CZ-CE1 4.37Å; F330-R336 HydrophobicContact CD1-CG 4.29Å; F330-R336 PolarHBondContact O-NH1 3.3Å; F330-F340 HydrophobicContact CD1-CE2 4.49Å; F330-F340 HydrophobicContact CE1-CE2 4.21Å; F330-Y464 HydrophobicContact CD2-CD2 4.31Å; F330-Y464 HydrophobicContact CE2-CD1 4.17Å; F330-Y464 AromaticContact CE2-CD2 3.68Å; F330-Y464 HydrophobicContact CE2-CD2 3.68Å; F330-Y464 HydrophobicContact CE2-CE2 4.22Å; F330-Y464 AromaticContact CE2-CG 3.67Å; F330-Y464 HydrophobicContact CE2-CG 3.67Å; F330-Y464 HydrophobicContact CZ-CD2 4.48Å; F330-Y464 HydrophobicContact CZ-CG 4.17Å; F330-L468 HydrophobicContact CE1-CD1 3.97Å; F330-L468 HydrophobicContact CZ-CD1 3.98Å |
| 331 | H | 87.3 | Confident | 83.2 | Confident | 152 Ų | 152 | 68.6 Ų | 68.6 | 70% | 0.704 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -73 | -24.1 | 166.5 | -76.2 | -111.6 | 0 | 0 | 0 | 111.8 | L327 R328 V329 V333 | L327-H331 PolarHBondContact O-N 3.08Å; R328-H331 WeakPolarHBondContact O-CB 3.43Å; R328-H331 PolarHBondContact O-N 2.99Å; R328-H331 VanDerWaalsContact O-N 3.08Å; V329-H331 VanDerWaalsContact C-N 3.34Å; V329-H331 PolarHBondContact O-N 3.06Å; H331-V333 PolarHBondContact O-N 3.39Å |
| 332 | I | 89.4 | Confident | 84.8 | Confident | 45 Ų | 45 | 65.3 Ų | 65.3 | 23% | 0.231 | 29% | 0.29 | C | S | . | . | S | Bend | trans | -71.9 | 99.4 | 173.7 | -57.1 | 173.2 | 0 | 0 | 0 | 108.3 | V329 F330 T334 Y335 R336 V453 | V329-I332 WeakPolarHBondContact O-CB 3.42Å; V329-I332 PolarHBondContact O-N 2.91Å; F330-I332 VanDerWaalsContact C-N 3.29Å; I332-T334 VanDerWaalsContact C-N 3.26Å; I332-T334 PolarHBondContact O-N 3.32Å; I332-Y335 PolarHBondContact O-N 3.22Å; I332-Y335 VanDerWaalsContact O-N 3.14Å; I332-R336 PolarHBondContact O-N 3.46Å; I332-V453 HydrophobicContact CD1-CB 3.84Å; I332-V453 HydrophobicContact CD1-CG1 3.71Å |
| 333 | V | 91.7 | Very high | 86.4 | Confident | 55 Ų | 55 | 56 Ų | 56 | 33% | 0.333 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -55.4 | -40.4 | -172 | -179 | 0 | 0 | 0 | 0 | 112.2 | H331 R336 V337 I514 I518 | H331-V333 PolarHBondContact O-N 3.39Å; V333-R336 PolarHBondContact O-N 2.65Å; V333-V337 HydrophobicContact CG1-CG2 4.48Å; V333-V337 WeakPolarHBondContact O-CG2 3.25Å; V333-V337 PolarHBondContact O-N 2.8Å; V333-I514 HydrophobicContact CG1-CG2 4.17Å; V333-I518 HydrophobicContact CB-CD1 4.14Å |
| 334 | T | 93.1 | Very high | 88 | Confident | 5 Ų | 5 | 52 Ų | 52 | 3% | 0.031 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -68.1 | -41.6 | -179.7 | 48.6 | 0 | 0 | 0 | 0 | 112.4 | I332 W338 V511 I514 H515 I518 | I332-T334 VanDerWaalsContact C-N 3.26Å; I332-T334 PolarHBondContact O-N 3.32Å; T334-W338 VanDerWaalsContact O-CB 3.26Å; T334-W338 WeakPolarHBondContact O-CB 3.27Å; T334-W338 PolarHBondContact O-N 2.98Å; T334-V511 HydrophobicContact CG2-CG1 4.41Å; T334-V511 WeakPolarHBondContact O-CG1 3.32Å; T334-I514 HydrophobicContact CG2-CG2 4.03Å; T334-H515 HydrophobicContact CG2-CB 3.68Å; T334-I518 HydrophobicContact CG2-CD1 4.45Å |
| 335 | Y | 95 | Very high | 89.6 | Confident | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -61.9 | -45.2 | 170.3 | 169.6 | -89 | 0 | 0 | 0 | 111 | V329 F330 I332 V337 W338 A339 V453 A461 L465 | V329-Y335 HydrophobicContact CG1-CD1 3.47Å; V329-Y335 VanDerWaalsContact CG1-CD1 3.47Å; V329-Y335 HydrophobicContact CG1-CD2 4.32Å; V329-Y335 HydrophobicContact CG1-CE1 3.36Å; V329-Y335 HydrophobicContact CG1-CE2 4.19Å; V329-Y335 HydrophobicContact CG1-CG 3.99Å; V329-Y335 WeakPolarHBondContact O-CD1 3.4Å; F330-Y335 HydrophobicContact CD1-CE1 4.15Å; F330-Y335 HydrophobicContact CE1-CE1 4.01Å; F330-Y335 HydrophobicContact CZ-CE1 4.37Å; I332-Y335 PolarHBondContact O-N 3.22Å; I332-Y335 VanDerWaalsContact O-N 3.14Å; Y335-V337 PolarHBondContact O-N 3.28Å; Y335-W338 AromaticContact CD2-CE3 3.85Å; Y335-W338 HydrophobicContact CD2-CE3 3.85Å; Y335-W338 HydrophobicContact CD2-CZ3 4.02Å; Y335-W338 HydrophobicContact CE2-CE3 4Å; Y335-W338 AromaticContact CE2-CZ3 3.88Å; Y335-W338 HydrophobicContact CE2-CZ3 3.88Å; Y335-W338 PolarHBondContact O-N 2.94Å; Y335-A339 HydrophobicContact CD1-CB 4.47Å; Y335-A339 HydrophobicContact CE1-CB 3.87Å; Y335-A339 HydrophobicContact CE2-CB 4.09Å; Y335-A339 WeakPolarHBondContact O-CB 3.41Å; Y335-A339 PolarHBondContact O-N 3.13Å; Y335-V453 HydrophobicContact CD2-CG1 3.89Å; Y335-V453 HydrophobicContact CG-CG1 3.9Å; Y335-A461 HydrophobicContact CD2-CB 3.93Å; Y335-A461 HydrophobicContact CE2-CB 3.5Å; Y335-A461 PolarHBondContact OH-O 2.92Å; Y335-L465 PolarHBondContact OH-N 2.95Å |
| 336 | R | 95.1 | Very high | 91 | Very high | 101 Ų | 101 | 42.4 Ų | 42.4 | 38% | 0.381 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -59.9 | -48.3 | -178.7 | -174.3 | 172.3 | 70.6 | -127.2 | 7.8 | 111.9 | F330 I332 V333 F340 | F330-R336 HydrophobicContact CD1-CG 4.29Å; F330-R336 PolarHBondContact O-NH1 3.3Å; I332-R336 PolarHBondContact O-N 3.46Å; V333-R336 PolarHBondContact O-N 2.65Å; R336-F340 HydrophobicContact CG-CD2 3.93Å; R336-F340 HydrophobicContact CG-CE2 4.08Å; R336-F340 WeakPolarHBondContact O-CD2 3.28Å; R336-F340 PolarHBondContact O-N 3.32Å; R336-F340 VanDerWaalsContact O-N 3.15Å |
| 337 | V | 95.9 | Very high | 92.2 | Very high | 39 Ų | 39 | 42.1 Ų | 42.1 | 24% | 0.236 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -64.4 | -41.9 | 178.2 | 176.5 | 0 | 0 | 0 | 0 | 111.1 | V333 Y335 G341 V507 V511 I514 | V333-V337 HydrophobicContact CG1-CG2 4.48Å; V333-V337 WeakPolarHBondContact O-CG2 3.25Å; V333-V337 PolarHBondContact O-N 2.8Å; Y335-V337 PolarHBondContact O-N 3.28Å; V337-G341 PolarHBondContact O-N 3.41Å; V337-V507 HydrophobicContact CG1-CG1 3.73Å; V337-V511 HydrophobicContact CB-CG2 4.1Å; V337-V511 HydrophobicContact CG1-CG2 3.72Å; V337-I514 HydrophobicContact CG1-CD1 4.29Å; V337-I514 HydrophobicContact CG2-CD1 4.29Å |
| 338 | W | 96.8 | Very high | 92.8 | Very high | 0 Ų | 0 | 37.9 Ų | 37.9 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -61.2 | -51.8 | 175.7 | 176.6 | 73 | 0 | 0 | 0 | 112.4 | T334 Y335 F340 G341 V342 M445 I448 A449 L452 L465 V511 | T334-W338 VanDerWaalsContact O-CB 3.26Å; T334-W338 WeakPolarHBondContact O-CB 3.27Å; T334-W338 PolarHBondContact O-N 2.98Å; Y335-W338 AromaticContact CD2-CE3 3.85Å; Y335-W338 HydrophobicContact CD2-CE3 3.85Å; Y335-W338 HydrophobicContact CD2-CZ3 4.02Å; Y335-W338 HydrophobicContact CE2-CE3 4Å; Y335-W338 AromaticContact CE2-CZ3 3.88Å; Y335-W338 HydrophobicContact CE2-CZ3 3.88Å; Y335-W338 PolarHBondContact O-N 2.94Å; W338-F340 PolarHBondContact O-N 3.35Å; W338-G341 PolarHBondContact O-N 2.99Å; W338-V342 WeakPolarHBondContact O-CG2 3.41Å; W338-V342 PolarHBondContact O-N 2.92Å; W338-M445 HydrophobicContact CH2-CG 4.38Å; W338-M445 VanDerWaalsContact CH2-O 3.27Å; W338-M445 WeakPolarHBondContact CH2-O 3.48Å; W338-M445 HydrophobicContact CZ2-CG 4.48Å; W338-I448 HydrophobicContact CD2-CG2 4.01Å; W338-I448 VanDerWaalsContact CE2-CG2 3.4Å; W338-I448 HydrophobicContact CG-CG2 4.43Å; W338-I448 HydrophobicContact CH2-CB 4.39Å; W338-I448 HydrophobicContact CH2-CG2 4.2Å; W338-I448 HydrophobicContact CZ2-CB 3.78Å; W338-I448 HydrophobicContact CZ2-CG2 3.53Å; W338-A449 HydrophobicContact CH2-CB 3.89Å; W338-A449 HydrophobicContact CZ3-CB 3.98Å; W338-L452 HydrophobicContact CB-CD1 3.85Å; W338-L452 HydrophobicContact CD2-CD1 3.54Å; W338-L452 HydrophobicContact CE3-CD1 3.56Å; W338-L452 HydrophobicContact CG-CD1 3.67Å; W338-L452 HydrophobicContact CZ3-CD1 4.25Å; W338-L465 HydrophobicContact CE3-CD2 4.38Å; W338-L465 HydrophobicContact CH2-CD2 3.3Å; W338-L465 HydrophobicContact CZ2-CD2 3.99Å; W338-L465 HydrophobicContact CZ3-CD2 3.54Å; W338-V511 HydrophobicContact CB-CG1 4.31Å; W338-V511 HydrophobicContact CB-CG2 4.07Å |
| 339 | A | 96 | Very high | 93.2 | Very high | 0 Ų | 0 | 32.8 Ų | 32.8 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -64.9 | -41.1 | -175.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | Y335 A343 L465 L468 | Y335-A339 HydrophobicContact CD1-CB 4.47Å; Y335-A339 HydrophobicContact CE1-CB 3.87Å; Y335-A339 HydrophobicContact CE2-CB 4.09Å; Y335-A339 WeakPolarHBondContact O-CB 3.41Å; Y335-A339 PolarHBondContact O-N 3.13Å; A339-A343 WeakPolarHBondContact O-CB 3.48Å; A339-A343 PolarHBondContact O-N 2.63Å; A339-L465 HydrophobicContact CB-CD1 4.14Å; A339-L468 HydrophobicContact CB-CD1 4.23Å |
| 340 | F | 95.9 | Very high | 93.2 | Very high | 106 Ų | 106 | 34.6 Ų | 34.6 | 47% | 0.465 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -68.7 | -38 | 173 | -82.2 | -74.9 | 0 | 0 | 0 | 112.2 | F330 R336 W338 V342 A343 T344 L468 | F330-F340 HydrophobicContact CD1-CE2 4.49Å; F330-F340 HydrophobicContact CE1-CE2 4.21Å; R336-F340 HydrophobicContact CG-CD2 3.93Å; R336-F340 HydrophobicContact CG-CE2 4.08Å; R336-F340 WeakPolarHBondContact O-CD2 3.28Å; R336-F340 PolarHBondContact O-N 3.32Å; R336-F340 VanDerWaalsContact O-N 3.15Å; W338-F340 PolarHBondContact O-N 3.35Å; F340-V342 PolarHBondContact O-N 3.18Å; F340-A343 PolarHBondContact O-N 3.07Å; F340-T344 PolarHBondContact O-N 3.36Å; F340-T344 PolarHBondContact O-OG1 3.31Å; F340-L468 HydrophobicContact CE1-CD2 4.14Å; F340-L468 HydrophobicContact CZ-CD2 4.34Å |
| 341 | G | 96.6 | Very high | 93.2 | Very high | 1 Ų | 1 | 32.9 Ų | 32.9 | 1% | 0.01 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -63 | -38 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | V337 W338 A345 G504 | V337-G341 PolarHBondContact O-N 3.41Å; W338-G341 PolarHBondContact O-N 2.99Å; G341-A345 PolarHBondContact O-N 3.42Å; G341-G504 VanDerWaalsContact O-CA 3.26Å; G341-G504 WeakPolarHBondContact O-CA 3.05Å |
| 342 | V | 96.3 | Very high | 93.2 | Very high | 0 Ų | 0 | 25.7 Ų | 25.7 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -66.7 | -43.8 | 171.8 | 174.8 | 0 | 0 | 0 | 0 | 111.2 | W338 F340 T344 A345 V346 Q404 F408 F441 L465 M469 L508 | W338-V342 WeakPolarHBondContact O-CG2 3.41Å; W338-V342 PolarHBondContact O-N 2.92Å; F340-V342 PolarHBondContact O-N 3.18Å; V342-T344 VanDerWaalsContact C-N 3.31Å; V342-T344 PolarHBondContact O-N 3.19Å; V342-A345 WeakPolarHBondContact O-CB 3.44Å; V342-A345 PolarHBondContact O-N 2.85Å; V342-A345 VanDerWaalsContact O-N 3.1Å; V342-V346 HydrophobicContact CG1-CG1 4.43Å; V342-V346 PolarHBondContact O-N 2.94Å; V342-Q404 VanDerWaalsContact CG2-NE2 3.33Å; V342-F408 HydrophobicContact CG1-CZ 4.33Å; V342-F408 HydrophobicContact CG2-CE2 4.15Å; V342-F408 HydrophobicContact CG2-CZ 4.34Å; V342-F441 HydrophobicContact CG1-CE2 3.84Å; V342-F441 HydrophobicContact CG1-CZ 4.07Å; V342-L465 HydrophobicContact CB-CD1 3.94Å; V342-L465 HydrophobicContact CG1-CD1 3.85Å; V342-M469 HydrophobicContact CG1-CG 4.08Å; V342-M469 HydrophobicContact CG1-SD 3.82Å; V342-L508 HydrophobicContact CG2-CD1 4.17Å; V342-L508 HydrophobicContact CG2-CD2 4.14Å |
| 343 | A | 95.3 | Very high | 92.9 | Very high | 9 Ų | 9 | 25.8 Ų | 25.8 | 7% | 0.074 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -60.2 | -39.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | A339 F340 L468 P472 | A339-A343 WeakPolarHBondContact O-CB 3.48Å; A339-A343 PolarHBondContact O-N 2.63Å; F340-A343 PolarHBondContact O-N 3.07Å; A343-L468 HydrophobicContact CB-CB 4.17Å; A343-P472 WeakPolarHBondContact O-CB 3.32Å; A343-P472 WeakPolarHBondContact O-CG 3.4Å |
| 344 | T | 94.8 | Very high | 92.6 | Very high | 58 Ų | 58 | 27.6 Ų | 27.6 | 36% | 0.356 | 13% | 0.134 | S | C | . | . | H | α-helix | trans | -63.3 | -45.1 | 170.8 | -59.1 | 0 | 0 | 0 | 0 | 111.7 | F340 V342 V346 L347 P500 I503 | F340-T344 PolarHBondContact O-N 3.36Å; F340-T344 PolarHBondContact O-OG1 3.31Å; V342-T344 VanDerWaalsContact C-N 3.31Å; V342-T344 PolarHBondContact O-N 3.19Å; T344-V346 VanDerWaalsContact C-N 3.34Å; T344-V346 PolarHBondContact O-N 3.47Å; T344-L347 WeakPolarHBondContact O-CB 3.37Å; T344-L347 PolarHBondContact O-N 3.4Å; T344-P500 WeakPolarHBondContact O-CB 3.48Å; T344-I503 HydrophobicContact CG2-CB 4.29Å; T344-I503 HydrophobicContact CG2-CG2 3.91Å |
| 345 | A | 95.1 | Very high | 92.4 | Very high | 1 Ų | 1 | 28.2 Ų | 28.2 | 1% | 0.008 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -58.1 | -43.4 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113 | G341 V342 L347 F408 P500 | G341-A345 PolarHBondContact O-N 3.42Å; V342-A345 WeakPolarHBondContact O-CB 3.44Å; V342-A345 PolarHBondContact O-N 2.85Å; V342-A345 VanDerWaalsContact O-N 3.1Å; A345-L347 PolarHBondContact O-N 3.45Å; A345-F408 HydrophobicContact CB-CD1 3.96Å; A345-F408 HydrophobicContact CB-CD2 3.83Å; A345-F408 HydrophobicContact CB-CE1 3.71Å; A345-F408 HydrophobicContact CB-CE2 3.56Å; A345-F408 HydrophobicContact CB-CG 4.03Å; A345-F408 HydrophobicContact CB-CZ 3.49Å; A345-F408 VanDerWaalsContact CB-CZ 3.49Å; A345-P500 WeakPolarHBondContact CA-O 3.35Å |
| 346 | V | 93.9 | Very high | 92.1 | Very high | 0 Ų | 0 | 28.2 Ų | 28.2 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -76.2 | -5.8 | -172.9 | -59.5 | 0 | 0 | 0 | 0 | 115.1 | V342 T344 G348 Y349 F441 M469 P472 M473 | V342-V346 HydrophobicContact CG1-CG1 4.43Å; V342-V346 PolarHBondContact O-N 2.94Å; T344-V346 VanDerWaalsContact C-N 3.34Å; T344-V346 PolarHBondContact O-N 3.47Å; V346-G348 VanDerWaalsContact C-N 3.31Å; V346-G348 PolarHBondContact O-N 3.43Å; V346-Y349 PolarHBondContact O-N 2.88Å; V346-F441 HydrophobicContact CG1-CE1 3.84Å; V346-F441 HydrophobicContact CG1-CZ 3.62Å; V346-M469 HydrophobicContact CG1-CE 4.34Å; V346-M469 HydrophobicContact CG2-CB 4.03Å; V346-M469 HydrophobicContact CG2-CG 3.94Å; V346-P472 HydrophobicContact CG2-CB 4.28Å; V346-M473 HydrophobicContact CB-CG 3.85Å; V346-M473 HydrophobicContact CB-SD 4.44Å; V346-M473 HydrophobicContact CG2-CG 3.76Å; V346-M473 HydrophobicContact CG2-SD 4.35Å |
| 347 | L | 93.1 | Very high | 91.7 | Very high | 59 Ų | 59 | 25.5 Ų | 25.5 | 31% | 0.309 | 13% | 0.129 | S | C | . | . | H | α-helix | trans | -59.6 | -40.8 | 172.6 | -178.1 | 61.4 | 0 | 0 | 0 | 112.2 | T344 A345 P472 A475 G476 I479 P500 | T344-L347 WeakPolarHBondContact O-CB 3.37Å; T344-L347 PolarHBondContact O-N 3.4Å; A345-L347 PolarHBondContact O-N 3.45Å; L347-P472 HydrophobicContact CB-CB 3.89Å; L347-P472 HydrophobicContact CD1-CB 4.02Å; L347-A475 HydrophobicContact CD1-CB 4.16Å; L347-G476 VanDerWaalsContact O-CA 3.22Å; L347-G476 WeakPolarHBondContact O-CA 3.11Å; L347-I479 HydrophobicContact CD1-CD1 4.5Å; L347-P500 HydrophobicContact CB-CB 3.93Å; L347-P500 HydrophobicContact CB-CG 4.17Å; L347-P500 HydrophobicContact CD2-CB 4.43Å; L347-P500 HydrophobicContact CD2-CG 4.1Å; L347-P500 HydrophobicContact CG-CG 4.26Å |
| 348 | G | 90.8 | Very high | 91.2 | Very high | 2 Ų | 2 | 26.8 Ų | 26.8 | 2% | 0.021 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -89.1 | -26.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 114 | V346 F350 V351 A497 | V346-G348 VanDerWaalsContact C-N 3.31Å; V346-G348 PolarHBondContact O-N 3.43Å; G348-F350 VanDerWaalsContact C-N 3.33Å; G348-F350 PolarHBondContact O-N 2.87Å; G348-V351 PolarHBondContact O-N 3.43Å; G348-V351 VanDerWaalsContact O-N 3.11Å; G348-A497 VanDerWaalsContact CA-O 3.3Å; G348-A497 WeakPolarHBondContact CA-O 3.47Å |
| 349 | Y | 89.8 | Confident | 90.9 | Very high | 14 Ų | 14 | 27.2 Ų | 27.2 | 6% | 0.055 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -51.5 | -42.7 | -171.6 | 164.6 | -80.2 | 0 | 0 | 0 | 114 | V346 V351 Y353 L411 D438 F441 | V346-Y349 PolarHBondContact O-N 2.88Å; Y349-V351 PolarHBondContact O-N 3.35Å; Y349-Y353 HydrophobicContact CE1-CD2 4.31Å; Y349-Y353 HydrophobicContact CE1-CE2 4.05Å; Y349-Y353 HydrophobicContact CE2-CE2 4.03Å; Y349-Y353 AromaticContact CZ-CE2 3.72Å; Y349-Y353 AromaticContact CZ-CZ 3.88Å; Y349-Y353 VanDerWaalsContact O-CD2 3.24Å; Y349-Y353 WeakPolarHBondContact O-CD2 3.48Å; Y349-Y353 PolarHBondContact OH-OH 2.82Å; Y349-L411 HydrophobicContact CD2-CD1 4.46Å; Y349-L411 HydrophobicContact CD2-CD2 3.71Å; Y349-L411 HydrophobicContact CG-CD2 4.37Å; Y349-D438 HydrophobicContact CE2-CB 4.06Å; Y349-D438 WeakPolarHBondContact CE2-OD1 3.49Å; Y349-D438 VanDerWaalsContact OH-CG 3.32Å; Y349-D438 PolarHBondContact OH-OD1 3.17Å; Y349-F441 HydrophobicContact CD2-CD1 4.27Å; Y349-F441 HydrophobicContact CD2-CE1 4.36Å; Y349-F441 HydrophobicContact CE2-CD1 4.14Å; Y349-F441 HydrophobicContact CE2-CE1 4.39Å |
| 350 | F | 85.4 | Confident | 90.6 | Very high | 38 Ų | 38 | 27.3 Ų | 27.3 | 17% | 0.167 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -79.9 | -13.5 | -175.4 | -97.4 | -78.8 | 0 | 0 | 0 | 114.5 | M151 G348 Y353 I354 M473 P477 | M151-F350 HydrophobicContact CE-CE1 4.39Å; M151-F350 HydrophobicContact CE-CZ 3.94Å; G348-F350 VanDerWaalsContact C-N 3.33Å; G348-F350 PolarHBondContact O-N 2.87Å; F350-Y353 PolarHBondContact O-N 3.49Å; F350-I354 PolarHBondContact O-N 2.94Å; F350-M473 HydrophobicContact CD2-CB 3.87Å; F350-M473 HydrophobicContact CD2-CE 4.35Å; F350-M473 HydrophobicContact CD2-CG 3.74Å; F350-M473 HydrophobicContact CD2-SD 4.36Å; F350-M473 HydrophobicContact CE2-CB 4.16Å; F350-M473 HydrophobicContact CE2-CE 3.59Å; F350-M473 HydrophobicContact CE2-CG 3.87Å; F350-M473 HydrophobicContact CE2-SD 3.87Å; F350-M473 HydrophobicContact CZ-CE 4.31Å; F350-P477 HydrophobicContact CB-CG 4Å |
| 351 | V | 89.4 | Confident | 90.2 | Very high | 5 Ų | 5 | 27.3 Ų | 27.3 | 3% | 0.03 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -63.7 | -47.2 | -174 | 173.2 | 0 | 0 | 0 | 0 | 112.5 | G348 Y349 Y353 I354 H355 G476 A480 F494 A497 | G348-V351 PolarHBondContact O-N 3.43Å; G348-V351 VanDerWaalsContact O-N 3.11Å; Y349-V351 PolarHBondContact O-N 3.35Å; V351-Y353 VanDerWaalsContact C-N 3.33Å; V351-Y353 PolarHBondContact O-N 3.42Å; V351-I354 PolarHBondContact O-N 3.48Å; V351-H355 PolarHBondContact O-N 3.01Å; V351-G476 WeakPolarHBondContact CG2-O 3.42Å; V351-A480 HydrophobicContact CB-CB 4.18Å; V351-A480 HydrophobicContact CG1-CB 3.36Å; V351-A480 HydrophobicContact CG2-CB 3.74Å; V351-F494 HydrophobicContact CG1-CD1 3.98Å; V351-F494 HydrophobicContact CG1-CE1 4.06Å; V351-A497 HydrophobicContact CB-CB 3.66Å; V351-A497 HydrophobicContact CG1-CB 3.79Å; V351-A497 HydrophobicContact CG2-CB 4.03Å |
| 352 | P | 88.4 | Confident | 89.8 | Confident | 2 Ų | 2 | 31 Ų | 31 | 1% | 0.013 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -52.8 | -46.3 | 169.8 | -29 | 36.7 | 0 | 0 | 0 | 113.4 | I354 L356 I418 L434 | P352-I354 VanDerWaalsContact C-N 3.26Å; P352-I354 PolarHBondContact O-N 2.65Å; P352-L356 WeakPolarHBondContact O-CB 3.38Å; P352-L356 PolarHBondContact O-N 3.23Å; P352-L356 VanDerWaalsContact O-N 3.13Å; P352-I418 HydrophobicContact CB-CD1 3.86Å; P352-I418 HydrophobicContact CG-CD1 3.91Å; P352-L434 HydrophobicContact CB-CD1 4.39Å |
| 353 | Y | 83.7 | Confident | 89.4 | Confident | 46 Ų | 46 | 35.2 Ų | 35.2 | 18% | 0.18 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -63.3 | -29.3 | -175 | -69.2 | -100.8 | 0 | 0 | 0 | 113.7 | Y349 F350 V351 I377 D438 | Y349-Y353 HydrophobicContact CE1-CD2 4.31Å; Y349-Y353 HydrophobicContact CE1-CE2 4.05Å; Y349-Y353 HydrophobicContact CE2-CE2 4.03Å; Y349-Y353 AromaticContact CZ-CE2 3.72Å; Y349-Y353 AromaticContact CZ-CZ 3.88Å; Y349-Y353 VanDerWaalsContact O-CD2 3.24Å; Y349-Y353 WeakPolarHBondContact O-CD2 3.48Å; Y349-Y353 PolarHBondContact OH-OH 2.82Å; F350-Y353 PolarHBondContact O-N 3.49Å; V351-Y353 VanDerWaalsContact C-N 3.33Å; V351-Y353 PolarHBondContact O-N 3.42Å; Y353-I377 HydrophobicContact CD1-CG2 4.26Å; Y353-I377 HydrophobicContact CE1-CG2 3.41Å; Y353-I377 VanDerWaalsContact CE1-CG2 3.41Å; Y353-D438 WeakPolarHBondContact OH-CB 3.49Å |
| 354 | I | 84.9 | Confident | 89 | Confident | 93 Ų | 93 | 36 Ų | 36 | 48% | 0.477 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -94.8 | -44.2 | -178.7 | -58.3 | -57.4 | 0 | 0 | 0 | 112.2 | F350 V351 P352 P477 | F350-I354 PolarHBondContact O-N 2.94Å; V351-I354 PolarHBondContact O-N 3.48Å; P352-I354 VanDerWaalsContact C-N 3.26Å; P352-I354 PolarHBondContact O-N 2.65Å; I354-P477 HydrophobicContact CB-CB 4.13Å; I354-P477 HydrophobicContact CB-CG 4.36Å; I354-P477 HydrophobicContact CG1-CB 4.03Å; I354-P477 HydrophobicContact CG1-CG 3.8Å; I354-P477 HydrophobicContact CG2-CB 4.13Å |
| 355 | H | 88.3 | Confident | 88.3 | Confident | 18 Ų | 18 | 41.5 Ų | 41.5 | 8% | 0.083 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -98 | -11.3 | -168.2 | -66 | -87.1 | 0 | 0 | 0 | 115 | V351 I357 N358 F359 P477 Y490 F494 | V351-H355 PolarHBondContact O-N 3.01Å; H355-I357 VanDerWaalsContact C-N 3.31Å; H355-I357 PolarHBondContact O-N 3.14Å; H355-N358 PolarHBondContact O-N 2.87Å; H355-N358 VanDerWaalsContact O-N 3.15Å; H355-F359 PolarHBondContact O-N 3.03Å; H355-P477 PolarHBondContact NE2-O 3.34Å; H355-P477 VanDerWaalsContact NE2-O 3.13Å; H355-Y490 HydrophobicContact CB-CD1 4.02Å; H355-Y490 HydrophobicContact CB-CE1 3.63Å; H355-Y490 AromaticContact CG-CE1 3.7Å; H355-Y490 AromaticContact ND1-CE1 3.31Å; H355-Y490 VanDerWaalsContact ND1-CE1 3.31Å; H355-Y490 WeakPolarHBondContact ND1-CE1 3.47Å; H355-Y490 AromaticContact ND1-CZ 3.77Å; H355-Y490 PolarHBondContact ND1-OH 3.18Å; H355-F494 HydrophobicContact CB-CE1 4.1Å; H355-F494 HydrophobicContact CB-CZ 3.99Å |
| 356 | L | 88.7 | Confident | 87.3 | Confident | 0 Ų | 0 | 50.5 Ų | 50.5 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -56.7 | -40.5 | -177.8 | 176.4 | 67.2 | 0 | 0 | 0 | 113.2 | P352 F359 V360 L373 I377 I418 L427 C431 | P352-L356 WeakPolarHBondContact O-CB 3.38Å; P352-L356 PolarHBondContact O-N 3.23Å; P352-L356 VanDerWaalsContact O-N 3.13Å; L356-F359 HydrophobicContact CD1-CD1 4.33Å; L356-F359 PolarHBondContact O-N 3.17Å; L356-V360 HydrophobicContact CD1-CG2 4.44Å; L356-V360 VanDerWaalsContact O-CG2 3.27Å; L356-V360 WeakPolarHBondContact O-CG2 3.46Å; L356-V360 PolarHBondContact O-N 2.96Å; L356-L373 HydrophobicContact CD1-CD1 4.39Å; L356-L373 HydrophobicContact CD2-CB 3.94Å; L356-L373 HydrophobicContact CD2-CD1 4.27Å; L356-L373 HydrophobicContact CG-CD1 4.21Å; L356-I377 HydrophobicContact CD2-CD1 3.84Å; L356-I418 HydrophobicContact CD1-CG2 4.22Å; L356-L427 HydrophobicContact CD1-CD1 3.92Å; L356-L427 HydrophobicContact CD1-CD2 3.93Å; L356-L427 HydrophobicContact CD1-CG 4.17Å; L356-C431 VanDerWaalsContact CD2-SG 3.59Å |
| 357 | I | 86.1 | Confident | 86.3 | Confident | 45 Ų | 45 | 53.4 Ų | 53.4 | 23% | 0.231 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -62.5 | -45.5 | 177.6 | -73.7 | 178.9 | 0 | 0 | 0 | 111.1 | H355 F359 V360 K361 E370 L374 | H355-I357 VanDerWaalsContact C-N 3.31Å; H355-I357 PolarHBondContact O-N 3.14Å; I357-F359 PolarHBondContact O-N 3.19Å; I357-V360 PolarHBondContact O-N 2.82Å; I357-K361 HydrophobicContact CG2-CD 4.35Å; I357-K361 PolarHBondContact O-N 3.03Å; I357-E370 WeakPolarHBondContact CG2-OE2 3.26Å; I357-L374 HydrophobicContact CD1-CD1 3.59Å; I357-L374 HydrophobicContact CD1-CG 4.1Å; I357-L374 HydrophobicContact CG1-CD1 4.43Å; I357-L374 HydrophobicContact CG1-CG 4.48Å |
| 358 | N | 87.1 | Confident | 85.2 | Confident | 65 Ų | 65 | 59.1 Ų | 59.1 | 35% | 0.348 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -65.4 | -41.1 | -179.8 | -64.2 | -6.8 | 0 | 0 | 0 | 111.4 | H355 V360 K361 E362 Y490 | H355-N358 PolarHBondContact O-N 2.87Å; H355-N358 VanDerWaalsContact O-N 3.15Å; N358-V360 VanDerWaalsContact C-N 3.3Å; N358-V360 PolarHBondContact O-N 2.97Å; N358-K361 WeakPolarHBondContact O-CB 3.26Å; N358-K361 PolarHBondContact O-N 2.83Å; N358-E362 WeakPolarHBondContact O-CG 3.3Å; N358-E362 PolarHBondContact O-N 3.43Å; N358-Y490 HydrophobicContact CB-CE2 3.74Å; N358-Y490 WeakPolarHBondContact CB-OH 3.32Å; N358-Y490 PolarHBondContact ND2-OH 3.41Å |
| 359 | F | 89.9 | Confident | 84.5 | Confident | 10 Ų | 10 | 64.7 Ų | 64.7 | 4% | 0.044 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -59.4 | -38.5 | 172.7 | 166.8 | -107.3 | 0 | 0 | 0 | 113 | H355 L356 I357 E362 K363 F364 I418 L427 Y490 F494 | H355-F359 PolarHBondContact O-N 3.03Å; L356-F359 HydrophobicContact CD1-CD1 4.33Å; L356-F359 PolarHBondContact O-N 3.17Å; I357-F359 PolarHBondContact O-N 3.19Å; F359-E362 PolarHBondContact O-N 3.49Å; F359-K363 HydrophobicContact CE1-CD 4.37Å; F359-K363 HydrophobicContact CE2-CB 4.27Å; F359-K363 HydrophobicContact CE2-CD 3.62Å; F359-K363 HydrophobicContact CZ-CD 3.47Å; F359-K363 VanDerWaalsContact CZ-CD 3.47Å; F359-K363 VanDerWaalsContact O-CB 3.26Å; F359-K363 WeakPolarHBondContact O-CB 3.34Å; F359-K363 PolarHBondContact O-N 3.41Å; F359-F364 HydrophobicContact CE1-CE2 4.39Å; F359-I418 HydrophobicContact CD1-CG2 3.8Å; F359-I418 HydrophobicContact CE1-CG2 3.54Å; F359-I418 HydrophobicContact CZ-CG2 4.1Å; F359-I418 WeakPolarHBondContact CZ-O 3.44Å; F359-L427 HydrophobicContact CD1-CD2 4.35Å; F359-L427 HydrophobicContact CE1-CD1 4.43Å; F359-L427 HydrophobicContact CE1-CD2 4.03Å; F359-Y490 HydrophobicContact CB-CD2 3.82Å; F359-Y490 HydrophobicContact CB-CG 4.19Å; F359-F494 HydrophobicContact CB-CE2 3.62Å; F359-F494 HydrophobicContact CB-CZ 4.02Å; F359-F494 HydrophobicContact CD1-CE2 4.05Å; F359-F494 AromaticContact CD2-CE2 3.95Å; F359-F494 HydrophobicContact CD2-CE2 3.95Å; F359-F494 AromaticContact CG-CE2 3.61Å; F359-F494 HydrophobicContact CG-CE2 3.61Å; F359-F494 HydrophobicContact CG-CZ 4.41Å |
| 360 | V | 89.4 | Confident | 84 | Confident | 1 Ų | 1 | 66 Ų | 66 | 1% | 0.006 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -69.5 | -41.1 | 176.4 | 176.6 | 0 | 0 | 0 | 0 | 111 | L356 I357 N358 E362 K363 F364 E370 L373 F424 L427 | L356-V360 HydrophobicContact CD1-CG2 4.44Å; L356-V360 VanDerWaalsContact O-CG2 3.27Å; L356-V360 WeakPolarHBondContact O-CG2 3.46Å; L356-V360 PolarHBondContact O-N 2.96Å; I357-V360 PolarHBondContact O-N 2.82Å; N358-V360 VanDerWaalsContact C-N 3.3Å; N358-V360 PolarHBondContact O-N 2.97Å; V360-E362 VanDerWaalsContact C-N 3.28Å; V360-E362 PolarHBondContact O-N 3.3Å; V360-K363 PolarHBondContact O-N 3.29Å; V360-F364 HydrophobicContact CG1-CB 4.08Å; V360-F364 HydrophobicContact CG1-CD2 4.28Å; V360-F364 HydrophobicContact CG2-CD2 4.39Å; V360-F364 CarbonylContact O-C 3.27Å; V360-F364 WeakPolarHBondContact O-CA 3.47Å; V360-F364 WeakPolarHBondContact O-CB 3.38Å; V360-F364 PolarHBondContact O-N 3.35Å; V360-E370 HydrophobicContact CB-CG 4.44Å; V360-E370 HydrophobicContact CG1-CB 4.42Å; V360-E370 HydrophobicContact CG1-CG 3.85Å; V360-L373 HydrophobicContact CG2-CD1 3.59Å; V360-F424 HydrophobicContact CG1-CD2 4.4Å; V360-F424 HydrophobicContact CG1-CE2 4.09Å; V360-L427 HydrophobicContact CG2-CD2 3.56Å |
| 361 | K | 87.1 | Confident | 83.8 | Confident | 106 Ų | 106 | 71.8 Ų | 71.8 | 46% | 0.461 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -56.8 | -40.8 | 171.7 | -73.7 | 175.8 | -174.7 | -172.9 | 0 | 112.8 | I357 N358 K365 E370 | I357-K361 HydrophobicContact CG2-CD 4.35Å; I357-K361 PolarHBondContact O-N 3.03Å; N358-K361 WeakPolarHBondContact O-CB 3.26Å; N358-K361 PolarHBondContact O-N 2.83Å; K361-K365 WeakPolarHBondContact O-CG 3.42Å; K361-E370 WeakPolarHBondContact CE-OE1 3.49Å; K361-E370 WeakPolarHBondContact CE-OE2 3.49Å; K361-E370 WeakPolarHBondContact CG-OE1 3.28Å; K361-E370 IonicContact NZ-OE2 3.2Å |
| 362 | E | 88.8 | Confident | 83.6 | Confident | 78 Ų | 78 | 73.2 Ų | 73.2 | 36% | 0.364 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -77.2 | -40.8 | -177.8 | -73.5 | 167.1 | -157.8 | 0 | 0 | 112.7 | N358 F359 V360 K365 H484 Y490 | N358-E362 WeakPolarHBondContact O-CG 3.3Å; N358-E362 PolarHBondContact O-N 3.43Å; F359-E362 PolarHBondContact O-N 3.49Å; V360-E362 VanDerWaalsContact C-N 3.28Å; V360-E362 PolarHBondContact O-N 3.3Å; E362-K365 WeakPolarHBondContact O-CE 3.4Å; E362-H484 VanDerWaalsContact CD-NE2 3.26Å; E362-H484 IonicContact OE1-CE1 2.82Å; E362-H484 PolarHBondContact OE1-CE1 3.45Å; E362-H484 IonicContact OE1-NE2 3.7Å; E362-H484 PolarHBondContact OE1-NE2 3.48Å; E362-H484 IonicContact OE2-CD2 3.59Å; E362-H484 IonicContact OE2-CE1 3.21Å; E362-H484 IonicContact OE2-NE2 3Å; E362-H484 PolarHBondContact OE2-NE2 3.12Å; E362-Y490 WeakPolarHBondContact OE1-CE2 3.25Å; E362-Y490 WeakPolarHBondContact OE2-CD2 3.43Å; E362-Y490 WeakPolarHBondContact OE2-CE2 3.19Å |
| 363 | K | 88.5 | Confident | 83.6 | Confident | 89 Ų | 89 | 73.1 Ų | 73.1 | 39% | 0.387 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -93.6 | -33.8 | -173.3 | -167.5 | 175.6 | -173.7 | -173.4 | 0 | 114.4 | F359 V360 P419 C421 | F359-K363 HydrophobicContact CE1-CD 4.37Å; F359-K363 HydrophobicContact CE2-CB 4.27Å; F359-K363 HydrophobicContact CE2-CD 3.62Å; F359-K363 HydrophobicContact CZ-CD 3.47Å; F359-K363 VanDerWaalsContact CZ-CD 3.47Å; F359-K363 VanDerWaalsContact O-CB 3.26Å; F359-K363 WeakPolarHBondContact O-CB 3.34Å; F359-K363 PolarHBondContact O-N 3.41Å; V360-K363 PolarHBondContact O-N 3.29Å; K363-P419 PolarHBondContact NZ-O 3.44Å; K363-C421 PolarHBondContact NZ-O 3.03Å |
| 364 | F | 86.1 | Confident | 83.5 | Confident | 25 Ų | 25 | 74.1 Ų | 74.1 | 11% | 0.11 | 34% | 0.344 | C | S | . | . | trans | -122.9 | 51.6 | -171.5 | -61.6 | -75.1 | 0 | 0 | 0 | 111.4 | F359 V360 E366 N367 C421 L427 | F359-F364 HydrophobicContact CE1-CE2 4.39Å; V360-F364 HydrophobicContact CG1-CB 4.08Å; V360-F364 HydrophobicContact CG1-CD2 4.28Å; V360-F364 HydrophobicContact CG2-CD2 4.39Å; V360-F364 CarbonylContact O-C 3.27Å; V360-F364 WeakPolarHBondContact O-CA 3.47Å; V360-F364 WeakPolarHBondContact O-CB 3.38Å; V360-F364 PolarHBondContact O-N 3.35Å; F364-E366 PolarHBondContact O-N 3.23Å; F364-N367 PolarHBondContact O-N 3.28Å; F364-C421 WeakPolarHBondContact CZ-O 3.44Å; F364-L427 HydrophobicContact CE2-CD2 4.06Å | ||
| 365 | K | 79.9 | Confident | 83.6 | Confident | 175 Ų | 175 | 72.4 Ų | 72.4 | 76% | 0.761 | 34% | 0.338 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.6 | -9.8 | -171.2 | -67.2 | 176.4 | -176.5 | -174.8 | 0 | 117.5 | K361 E362 | K361-K365 WeakPolarHBondContact O-CG 3.42Å; E362-K365 WeakPolarHBondContact O-CE 3.4Å |
| 366 | E | 74.1 | Confident | 83.7 | Confident | 189 Ų | 189 | 72.8 Ų | 72.8 | 88% | 0.883 | 34% | 0.343 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -102 | -7.8 | -178.6 | -60.2 | 178.9 | 158.8 | 0 | 0 | 113.2 | F364 | F364-E366 PolarHBondContact O-N 3.23Š|
| 367 | N | 73.8 | Confident | 83.8 | Confident | 61 Ų | 61 | 73 Ų | 73 | 33% | 0.326 | 34% | 0.344 | S | S | . | . | trans | -98.4 | 99.4 | -173.5 | -77.6 | -41.7 | 0 | 0 | 0 | 113.4 | F364 Q369 F424 | F364-N367 PolarHBondContact O-N 3.28Å; N367-Q369 PolarHBondContact O-N 3.48Å; N367-Q369 VanDerWaalsContact O-N 3.09Å; N367-F424 HydrophobicContact CB-CD2 4.48Å | ||
| 368 | E | 68.6 | Low | 83.9 | Confident | 180 Ų | 180 | 71.9 Ų | 71.9 | 84% | 0.841 | 34% | 0.343 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.1 | -5.1 | 173 | -58.9 | -173.3 | 153.6 | 0 | 0 | 114.4 | E370 | E368-E370 PolarHBondContact O-N 2.78Š|
| 369 | Q | 76.8 | Confident | 84.1 | Confident | 119 Ų | 119 | 70.6 Ų | 70.6 | 56% | 0.556 | 34% | 0.342 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.3 | 19.9 | -172 | -60.8 | -167.4 | 7.1 | 0 | 0 | 114.7 | N367 W371 V372 F424 | N367-Q369 PolarHBondContact O-N 3.48Å; N367-Q369 VanDerWaalsContact O-N 3.09Å; Q369-W371 PolarHBondContact O-N 3.31Å; Q369-V372 HydrophobicContact CB-CG2 4.02Å; Q369-V372 VanDerWaalsContact O-CB 3.28Å; Q369-V372 WeakPolarHBondContact O-CB 3.45Å; Q369-V372 WeakPolarHBondContact O-CG2 3.46Å; Q369-V372 PolarHBondContact O-N 2.84Å; Q369-F424 HydrophobicContact CB-CZ 4.49Å |
| 370 | E | 79.6 | Confident | 84.4 | Confident | 42 Ų | 42 | 70.7 Ų | 70.7 | 20% | 0.196 | 34% | 0.344 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -44.6 | -42 | 179 | -54.4 | 164.9 | -176.1 | 0 | 0 | 113.9 | I357 V360 K361 E368 V372 L373 | I357-E370 WeakPolarHBondContact CG2-OE2 3.26Å; V360-E370 HydrophobicContact CB-CG 4.44Å; V360-E370 HydrophobicContact CG1-CB 4.42Å; V360-E370 HydrophobicContact CG1-CG 3.85Å; K361-E370 WeakPolarHBondContact CE-OE1 3.49Å; K361-E370 WeakPolarHBondContact CE-OE2 3.49Å; K361-E370 WeakPolarHBondContact CG-OE1 3.28Å; K361-E370 IonicContact NZ-OE2 3.2Å; E368-E370 PolarHBondContact O-N 2.78Å; E370-V372 PolarHBondContact O-N 3.16Å; E370-L373 WeakPolarHBondContact O-CB 3.42Å; E370-L373 PolarHBondContact O-N 2.88Å |
| 371 | W | 80 | Confident | 84.6 | Confident | 159 Ų | 159 | 70.7 Ų | 70.7 | 60% | 0.602 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -61.9 | -25.9 | -177 | 63.9 | -92 | 0 | 0 | 0 | 113.4 | Q369 L373 L374 V375 | Q369-W371 PolarHBondContact O-N 3.31Å; W371-L373 PolarHBondContact O-N 2.93Å; W371-L374 PolarHBondContact O-N 3.29Å; W371-V375 HydrophobicContact CE3-CG2 3.87Å; W371-V375 HydrophobicContact CZ3-CG2 4.06Å; W371-V375 PolarHBondContact O-N 3.25Å |
| 372 | V | 86.3 | Confident | 84.9 | Confident | 34 Ų | 34 | 66.2 Ų | 66.2 | 21% | 0.206 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -60 | -33.3 | 178.3 | 178 | 0 | 0 | 0 | 0 | 110.6 | Q369 E370 V375 C376 | Q369-V372 HydrophobicContact CB-CG2 4.02Å; Q369-V372 VanDerWaalsContact O-CB 3.28Å; Q369-V372 WeakPolarHBondContact O-CB 3.45Å; Q369-V372 WeakPolarHBondContact O-CG2 3.46Å; Q369-V372 PolarHBondContact O-N 2.84Å; E370-V372 PolarHBondContact O-N 3.16Å; V372-V375 WeakPolarHBondContact O-CB 3.41Å; V372-V375 PolarHBondContact O-N 2.84Å; V372-C376 WeakPolarHBondContact O-CB 3.36Å; V372-C376 PolarHBondContact O-N 2.85Å; V372-C376 PolarHBondContact O-SG 3.48Å |
| 373 | L | 87.5 | Confident | 85.2 | Confident | 1 Ų | 1 | 66.8 Ų | 66.8 | 1% | 0.005 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -64.4 | -43.5 | -179.8 | -61.4 | 170.9 | 0 | 0 | 0 | 112.4 | L356 V360 E370 W371 V375 C376 I377 F424 L427 V428 C431 | L356-L373 HydrophobicContact CD1-CD1 4.39Å; L356-L373 HydrophobicContact CD2-CB 3.94Å; L356-L373 HydrophobicContact CD2-CD1 4.27Å; L356-L373 HydrophobicContact CG-CD1 4.21Å; V360-L373 HydrophobicContact CG2-CD1 3.59Å; E370-L373 WeakPolarHBondContact O-CB 3.42Å; E370-L373 PolarHBondContact O-N 2.88Å; W371-L373 PolarHBondContact O-N 2.93Å; L373-V375 VanDerWaalsContact C-N 3.32Å; L373-V375 PolarHBondContact O-N 2.82Å; L373-C376 PolarHBondContact O-N 3.43Å; L373-I377 WeakPolarHBondContact O-CG1 3.4Å; L373-I377 PolarHBondContact O-N 3.22Å; L373-F424 HydrophobicContact CD1-CE2 3.84Å; L373-F424 HydrophobicContact CD1-CZ 4.28Å; L373-F424 HydrophobicContact CD2-CE2 4.29Å; L373-F424 HydrophobicContact CD2-CZ 4.14Å; L373-F424 HydrophobicContact CG-CE2 4.08Å; L373-F424 HydrophobicContact CG-CZ 4.01Å; L373-L427 HydrophobicContact CD1-CD2 3.86Å; L373-L427 HydrophobicContact CD1-CG 4.26Å; L373-L427 HydrophobicContact CD2-CG 4.31Å; L373-V428 HydrophobicContact CD2-CB 4.22Å; L373-V428 HydrophobicContact CD2-CG2 3.6Å; L373-C431 HydrophobicContact CD2-CB 4.38Å |
| 374 | L | 82.4 | Confident | 85.6 | Confident | 66 Ų | 66 | 62.5 Ų | 62.5 | 35% | 0.346 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -66 | -36.7 | 175.2 | -67.2 | -170 | 0 | 0 | 0 | 111.7 | I357 W371 I377 G378 | I357-L374 HydrophobicContact CD1-CD1 3.59Å; I357-L374 HydrophobicContact CD1-CG 4.1Å; I357-L374 HydrophobicContact CG1-CD1 4.43Å; I357-L374 HydrophobicContact CG1-CG 4.48Å; W371-L374 PolarHBondContact O-N 3.29Å; L374-I377 HydrophobicContact CD2-CD1 4.36Å; L374-I377 PolarHBondContact O-N 3.08Å; L374-G378 PolarHBondContact O-N 2.91Å |
| 375 | V | 86.9 | Confident | 86 | Confident | 57 Ų | 57 | 62.5 Ų | 62.5 | 35% | 0.345 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -64.3 | -42.8 | 173.9 | 172.4 | 0 | 0 | 0 | 0 | 111 | M244 W371 V372 L373 G378 A379 | M244-V375 HydrophobicContact CE-CG1 4.12Å; W371-V375 HydrophobicContact CE3-CG2 3.87Å; W371-V375 HydrophobicContact CZ3-CG2 4.06Å; W371-V375 PolarHBondContact O-N 3.25Å; V372-V375 WeakPolarHBondContact O-CB 3.41Å; V372-V375 PolarHBondContact O-N 2.84Å; L373-V375 VanDerWaalsContact C-N 3.32Å; L373-V375 PolarHBondContact O-N 2.82Å; V375-G378 PolarHBondContact O-N 2.83Å; V375-A379 VanDerWaalsContact O-CB 3.22Å; V375-A379 WeakPolarHBondContact O-CB 3.47Å; V375-A379 PolarHBondContact O-N 2.9Å |
| 376 | C | 90.2 | Very high | 86.8 | Confident | 27 Ų | 27 | 57.9 Ų | 57.9 | 18% | 0.182 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -60.6 | -45.9 | 174.5 | -73.2 | 0 | 0 | 0 | 0 | 112.1 | V372 L373 S380 V432 | V372-C376 WeakPolarHBondContact O-CB 3.36Å; V372-C376 PolarHBondContact O-N 2.85Å; V372-C376 PolarHBondContact O-SG 3.48Å; L373-C376 PolarHBondContact O-N 3.43Å; C376-S380 VanDerWaalsContact O-CB 3.23Å; C376-S380 WeakPolarHBondContact O-CB 3.28Å; C376-S380 PolarHBondContact O-N 3.49Å; C376-S380 PolarHBondContact O-OG 2.84Å; C376-S380 VanDerWaalsContact O-OG 3.04Å; C376-V432 HydrophobicContact CB-CG2 4.13Å |
| 377 | I | 90.1 | Very high | 87.8 | Confident | 4 Ų | 4 | 51 Ų | 51 | 2% | 0.021 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -62.3 | -47.2 | 176.2 | -64.4 | 163.4 | 0 | 0 | 0 | 110.7 | Y353 L356 L373 L374 S380 S381 C431 | Y353-I377 HydrophobicContact CD1-CG2 4.26Å; Y353-I377 HydrophobicContact CE1-CG2 3.41Å; Y353-I377 VanDerWaalsContact CE1-CG2 3.41Å; L356-I377 HydrophobicContact CD2-CD1 3.84Å; L373-I377 WeakPolarHBondContact O-CG1 3.4Å; L373-I377 PolarHBondContact O-N 3.22Å; L374-I377 HydrophobicContact CD2-CD1 4.36Å; L374-I377 PolarHBondContact O-N 3.08Å; I377-S380 PolarHBondContact O-OG 3.03Å; I377-S381 WeakPolarHBondContact O-CB 3.32Å; I377-S381 PolarHBondContact O-N 3.4Å; I377-C431 HydrophobicContact CD1-CB 4.18Å; I377-C431 HydrophobicContact CG1-CB 3.74Å; I377-C431 WeakPolarHBondContact CG1-O 3.37Å |
| 378 | G | 89.3 | Confident | 88.9 | Confident | 21 Ų | 21 | 51 Ų | 51 | 22% | 0.216 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -63.6 | -45.5 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | S240 L374 V375 G382 | S240-G378 WeakPolarHBondContact CB-O 3.19Å; S240-G378 PolarHBondContact OG-O 2.65Å; L374-G378 PolarHBondContact O-N 2.91Å; V375-G378 PolarHBondContact O-N 2.83Å; G378-G382 PolarHBondContact O-N 2.97Å |
| 379 | A | 91.5 | Very high | 90.1 | Very high | 39 Ų | 39 | 42.4 Ų | 42.4 | 32% | 0.322 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -68.8 | -46.7 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | M244 V375 S381 G382 V383 | M244-A379 HydrophobicContact CE-CB 4.25Å; M244-A379 HydrophobicContact SD-CB 4.07Å; V375-A379 VanDerWaalsContact O-CB 3.22Å; V375-A379 WeakPolarHBondContact O-CB 3.47Å; V375-A379 PolarHBondContact O-N 2.9Å; A379-S381 VanDerWaalsContact C-N 3.29Å; A379-S381 PolarHBondContact O-N 3.48Å; A379-G382 PolarHBondContact O-N 3.34Å; A379-G382 VanDerWaalsContact O-N 3.14Å; A379-V383 PolarHBondContact O-N 3.03Å |
| 380 | S | 94.7 | Very high | 90.9 | Very high | 12 Ų | 12 | 43.1 Ų | 43.1 | 8% | 0.084 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -67.7 | -31.8 | 179.2 | 78 | 0 | 0 | 0 | 0 | 111.9 | C376 I377 V383 G384 V432 G435 L436 | C376-S380 VanDerWaalsContact O-CB 3.23Å; C376-S380 WeakPolarHBondContact O-CB 3.28Å; C376-S380 PolarHBondContact O-N 3.49Å; C376-S380 PolarHBondContact O-OG 2.84Å; C376-S380 VanDerWaalsContact O-OG 3.04Å; I377-S380 PolarHBondContact O-OG 3.03Å; S380-V383 PolarHBondContact O-N 3.02Å; S380-G384 PolarHBondContact O-N 2.93Å; S380-V432 WeakPolarHBondContact CB-O 3.42Å; S380-V432 PolarHBondContact OG-O 3.47Å; S380-G435 VanDerWaalsContact OG-CA 3.26Å; S380-G435 WeakPolarHBondContact OG-CA 3.33Å; S380-L436 WeakPolarHBondContact O-CD2 3.18Å; S380-L436 PolarHBondContact OG-N 3.22Å |
| 381 | S | 93.9 | Very high | 91.7 | Very high | 1 Ų | 1 | 44.6 Ų | 44.6 | 1% | 0.007 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -65.6 | -43.6 | 168.1 | -178.5 | 0 | 0 | 0 | 0 | 112.6 | I377 A379 V383 G384 R385 G435 D438 | I377-S381 WeakPolarHBondContact O-CB 3.32Å; I377-S381 PolarHBondContact O-N 3.4Å; A379-S381 VanDerWaalsContact C-N 3.29Å; A379-S381 PolarHBondContact O-N 3.48Å; S381-V383 VanDerWaalsContact C-N 3.31Å; S381-V383 PolarHBondContact O-N 3.08Å; S381-G384 PolarHBondContact O-N 3.24Å; S381-G384 VanDerWaalsContact O-N 3.14Å; S381-R385 WeakPolarHBondContact O-CG 3.46Å; S381-R385 PolarHBondContact O-N 3.26Å; S381-R385 VanDerWaalsContact OG-CZ 3.31Å; S381-R385 PolarHBondContact OG-NE 3.37Å; S381-R385 PolarHBondContact OG-NH2 3.17Å; S381-R385 VanDerWaalsContact OG-NH2 3.08Å; S381-G435 WeakPolarHBondContact CA-O 3.47Å; S381-G435 VanDerWaalsContact CB-O 3.28Å; S381-G435 WeakPolarHBondContact CB-O 3.26Å; S381-D438 WeakPolarHBondContact CB-OD2 3.33Å; S381-D438 PolarHBondContact OG-OD2 3.03Å |
| 382 | G | 93.7 | Very high | 92.3 | Very high | 11 Ų | 11 | 37.1 Ų | 37.1 | 11% | 0.113 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -55.1 | -45.1 | 173 | 0 | 0 | 0 | 0 | 0 | 112.7 | G378 A379 L386 | G378-G382 PolarHBondContact O-N 2.97Å; A379-G382 PolarHBondContact O-N 3.34Å; A379-G382 VanDerWaalsContact O-N 3.14Å; G382-L386 PolarHBondContact O-N 3Å |
| 383 | V | 95.7 | Very high | 92.6 | Very high | 90 Ų | 90 | 37.1 Ų | 37.1 | 55% | 0.545 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -64.8 | -45.5 | 174.1 | 174.3 | 0 | 0 | 0 | 0 | 111.5 | A379 S380 S381 R385 L386 A387 | A379-V383 PolarHBondContact O-N 3.03Å; S380-V383 PolarHBondContact O-N 3.02Å; S381-V383 VanDerWaalsContact C-N 3.31Å; S381-V383 PolarHBondContact O-N 3.08Å; V383-R385 VanDerWaalsContact C-N 3.32Å; V383-R385 PolarHBondContact O-N 3.16Å; V383-L386 PolarHBondContact O-N 3.46Å; V383-A387 WeakPolarHBondContact O-CB 3.2Å; V383-A387 PolarHBondContact O-N 3.03Å |
| 384 | G | 95.8 | Very high | 92.8 | Very high | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -57.8 | -41.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | S380 S381 L386 A387 F388 | S380-G384 PolarHBondContact O-N 2.93Å; S381-G384 PolarHBondContact O-N 3.24Å; S381-G384 VanDerWaalsContact O-N 3.14Å; G384-L386 PolarHBondContact O-N 3.45Å; G384-A387 PolarHBondContact O-N 3.28Å; G384-F388 VanDerWaalsContact O-CB 3.32Å; G384-F388 WeakPolarHBondContact O-CB 3.28Å; G384-F388 VanDerWaalsContact O-CD2 3.26Å; G384-F388 WeakPolarHBondContact O-CD2 3.45Å; G384-F388 PolarHBondContact O-N 3.41Å |
| 385 | R | 95.9 | Very high | 93.2 | Very high | 25 Ų | 25 | 42.8 Ų | 42.8 | 9% | 0.094 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -61.5 | -44.7 | 178.8 | -67.3 | 164.3 | -165.5 | -154.7 | -0.6 | 111.8 | G233 T236 A237 S381 V383 G389 D438 G439 T443 | G233-R385 VanDerWaalsContact CA-O 3.32Å; G233-R385 WeakPolarHBondContact CA-O 3.46Å; T236-R385 VanDerWaalsContact C-CD 3.5Å; T236-R385 WeakPolarHBondContact O-CD 3.48Å; T236-R385 PolarHBondContact O-NH1 3.04Å; A237-R385 HydrophobicContact CB-CB 4.12Å; S381-R385 WeakPolarHBondContact O-CG 3.46Å; S381-R385 PolarHBondContact O-N 3.26Å; S381-R385 VanDerWaalsContact OG-CZ 3.31Å; S381-R385 PolarHBondContact OG-NE 3.37Å; S381-R385 PolarHBondContact OG-NH2 3.17Å; S381-R385 VanDerWaalsContact OG-NH2 3.08Å; V383-R385 VanDerWaalsContact C-N 3.32Å; V383-R385 PolarHBondContact O-N 3.16Å; R385-G389 WeakPolarHBondContact O-CA 3.31Å; R385-G389 PolarHBondContact O-N 2.98Å; R385-D438 IonicContact CZ-OD2 3.98Å; R385-D438 IonicContact NE-OD2 2.69Å; R385-D438 IonicContact NH2-OD1 3.82Å; R385-D438 IonicContact NH2-OD2 3.95Å; R385-D438 PolarHBondContact NH2-OD2 3.1Å; R385-G439 VanDerWaalsContact CG-CA 3.5Å; R385-T443 WeakPolarHBondContact CA-OG1 3.26Å; R385-T443 WeakPolarHBondContact CB-OG1 3.49Å; R385-T443 WeakPolarHBondContact CG-OG1 3.3Å |
| 386 | L | 95.9 | Very high | 93.1 | Very high | 78 Ų | 78 | 44.4 Ų | 44.4 | 41% | 0.408 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -68.8 | -45 | 176.4 | -62 | 175.8 | 0 | 0 | 0 | 112.4 | V234 A237 G382 V383 G384 K390 | V234-L386 HydrophobicContact CB-CD2 4.4Å; V234-L386 HydrophobicContact CG2-CD2 3.77Å; A237-L386 HydrophobicContact CB-CD1 4.46Å; A237-L386 HydrophobicContact CB-CD2 3.87Å; A237-L386 HydrophobicContact CB-CG 3.89Å; G382-L386 PolarHBondContact O-N 3Å; V383-L386 PolarHBondContact O-N 3.46Å; G384-L386 PolarHBondContact O-N 3.45Å; L386-K390 PolarHBondContact O-N 3.31Å |
| 387 | A | 95.9 | Very high | 92.9 | Very high | 43 Ų | 43 | 44.2 Ų | 44.2 | 36% | 0.355 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -69.2 | -55.1 | -176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | V383 G384 G389 K390 I391 | V383-A387 WeakPolarHBondContact O-CB 3.2Å; V383-A387 PolarHBondContact O-N 3.03Å; G384-A387 PolarHBondContact O-N 3.28Å; A387-G389 VanDerWaalsContact C-N 3.32Å; A387-G389 PolarHBondContact O-N 3.25Å; A387-K390 PolarHBondContact O-N 2.89Å; A387-I391 VanDerWaalsContact O-CG1 3.32Å; A387-I391 WeakPolarHBondContact O-CG1 3.39Å; A387-I391 PolarHBondContact O-N 3.26Å |
| 388 | F | 95.6 | Very high | 92.7 | Very high | 62 Ų | 62 | 45.1 Ų | 45.1 | 27% | 0.272 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -71.4 | -26.4 | -179.7 | -66.1 | -64.5 | 0 | 0 | 0 | 112.6 | G384 I391 G392 M403 L436 C440 M444 | G384-F388 VanDerWaalsContact O-CB 3.32Å; G384-F388 WeakPolarHBondContact O-CB 3.28Å; G384-F388 VanDerWaalsContact O-CD2 3.26Å; G384-F388 WeakPolarHBondContact O-CD2 3.45Å; G384-F388 PolarHBondContact O-N 3.41Å; F388-I391 HydrophobicContact CD1-CD1 3.96Å; F388-I391 HydrophobicContact CE1-CD1 4.27Å; F388-I391 PolarHBondContact O-N 3.23Å; F388-G392 PolarHBondContact O-N 2.99Å; F388-M403 HydrophobicContact CB-CE 4.06Å; F388-M403 HydrophobicContact CD1-CE 3.92Å; F388-M403 HydrophobicContact CG-CE 4.45Å; F388-L436 WeakPolarHBondContact CE2-O 3.35Å; F388-C440 HydrophobicContact CB-CB 4.01Å; F388-C440 HydrophobicContact CD1-CB 4.34Å; F388-C440 HydrophobicContact CD2-CB 3.49Å; F388-C440 VanDerWaalsContact CD2-CB 3.49Å; F388-C440 HydrophobicContact CE2-CB 4Å; F388-C440 HydrophobicContact CG-CB 3.69Å; F388-M444 VanDerWaalsContact O-CE 3.26Å; F388-M444 WeakPolarHBondContact O-CE 3.11Å |
| 389 | G | 94.1 | Very high | 92.7 | Very high | 0 Ų | 0 | 52.2 Ų | 52.2 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -55.5 | -53 | 166.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | G229 L230 R385 A387 G392 D393 T443 | G229-G389 VanDerWaalsContact C-C 3.49Å; G229-G389 VanDerWaalsContact C-CA 3.41Å; G229-G389 CarbonylContact C-O 3.59Å; G229-G389 VanDerWaalsContact C-O 3.27Å; G229-G389 WeakPolarHBondContact O-CA 3.19Å; L230-G389 PolarHBondContact N-O 3.42Å; R385-G389 WeakPolarHBondContact O-CA 3.31Å; R385-G389 PolarHBondContact O-N 2.98Å; A387-G389 VanDerWaalsContact C-N 3.32Å; A387-G389 PolarHBondContact O-N 3.25Å; G389-G392 PolarHBondContact O-N 3.31Å; G389-D393 PolarHBondContact O-N 2.96Å; G389-T443 VanDerWaalsContact CA-CG2 3.47Å |
| 390 | K | 94.4 | Very high | 92.7 | Very high | 134 Ų | 134 | 51 Ų | 51 | 58% | 0.583 | 27% | 0.269 | S | S | * | . | H | α-helix | trans | -64.4 | -39.8 | 177.2 | -169.5 | 178.2 | 178.6 | -177.8 | 0 | 112.9 | L230 L386 A387 G392 D393 | L230-K390 HydrophobicContact CD1-CB 4.32Å; L386-K390 PolarHBondContact O-N 3.31Å; A387-K390 PolarHBondContact O-N 2.89Å; K390-G392 VanDerWaalsContact C-N 3.34Å; K390-D393 PolarHBondContact O-N 3.42Å |
| 391 | I | 95.3 | Very high | 92.7 | Very high | 73 Ų | 73 | 50.4 Ų | 50.4 | 37% | 0.374 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -66.4 | -38.5 | 178 | -65.9 | 162.4 | 0 | 0 | 0 | 110.8 | A387 F388 D393 L394 I395 M403 | A387-I391 VanDerWaalsContact O-CG1 3.32Å; A387-I391 WeakPolarHBondContact O-CG1 3.39Å; A387-I391 PolarHBondContact O-N 3.26Å; F388-I391 HydrophobicContact CD1-CD1 3.96Å; F388-I391 HydrophobicContact CE1-CD1 4.27Å; F388-I391 PolarHBondContact O-N 3.23Å; I391-D393 VanDerWaalsContact C-N 3.31Å; I391-D393 PolarHBondContact O-N 3.37Å; I391-L394 WeakPolarHBondContact O-CB 3.4Å; I391-L394 PolarHBondContact O-N 2.63Å; I391-L394 VanDerWaalsContact O-N 3.12Å; I391-I395 HydrophobicContact CG2-CD1 3.95Å; I391-I395 PolarHBondContact O-N 3.03Å; I391-M403 HydrophobicContact CB-CE 4.08Å; I391-M403 HydrophobicContact CG2-CE 3.78Å; I391-M403 HydrophobicContact CG2-SD 4.4Å |
| 392 | G | 92.1 | Very high | 92.8 | Very high | 1 Ų | 1 | 54.5 Ų | 54.5 | 1% | 0.01 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -63.6 | -33.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | F388 G389 K390 L394 I395 K400 | F388-G392 PolarHBondContact O-N 2.99Å; G389-G392 PolarHBondContact O-N 3.31Å; K390-G392 VanDerWaalsContact C-N 3.34Å; G392-L394 VanDerWaalsContact C-N 3.31Å; G392-L394 PolarHBondContact O-N 3.28Å; G392-I395 PolarHBondContact O-N 3.42Å; G392-K400 WeakPolarHBondContact O-CE 3.38Å |
| 393 | D | 92.8 | Very high | 92.8 | Very high | 35 Ų | 35 | 55.1 Ų | 55.1 | 19% | 0.187 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -68.9 | -27.3 | 173.8 | -72.4 | -30.9 | 0 | 0 | 0 | 113.2 | Q226 R227 L228 G229 L230 G389 K390 I391 I395 | Q226-D393 WeakPolarHBondContact O-CB 3.21Å; R227-D393 VanDerWaalsContact CA-OD2 3.26Å; R227-D393 WeakPolarHBondContact CA-OD2 3.29Å; L228-D393 PolarHBondContact N-OD1 3.47Å; G229-D393 WeakPolarHBondContact CA-OD1 3.49Å; G229-D393 PolarHBondContact N-OD1 3.02Å; G229-D393 PolarHBondContact N-OD2 2.91Å; L230-D393 VanDerWaalsContact CB-OD2 3.23Å; L230-D393 WeakPolarHBondContact CB-OD2 3.45Å; L230-D393 PolarHBondContact N-OD2 2.88Å; G389-D393 PolarHBondContact O-N 2.96Å; K390-D393 PolarHBondContact O-N 3.42Å; I391-D393 VanDerWaalsContact C-N 3.31Å; I391-D393 PolarHBondContact O-N 3.37Å; D393-I395 VanDerWaalsContact C-N 3.29Å; D393-I395 PolarHBondContact O-N 3.37Å |
| 394 | L | 92.3 | Very high | 92.8 | Very high | 137 Ų | 137 | 50.8 Ų | 50.8 | 72% | 0.717 | 26% | 0.255 | S | S | * | . | H | α-helix | trans | -76.6 | -14.9 | 175.5 | -60.4 | 175.3 | 0 | 0 | 0 | 113.2 | I391 G392 P396 | I391-L394 WeakPolarHBondContact O-CB 3.4Å; I391-L394 PolarHBondContact O-N 2.63Å; I391-L394 VanDerWaalsContact O-N 3.12Å; G392-L394 VanDerWaalsContact C-N 3.31Å; G392-L394 PolarHBondContact O-N 3.28Å; L394-P396 WeakPolarHBondContact O-CD 3.18Å |
| 395 | I | 91.5 | Very high | 92.8 | Very high | 48 Ų | 48 | 51.6 Ų | 51.6 | 25% | 0.246 | 26% | 0.26 | C | S | . | . | S | Bend | trans | -104 | 107.7 | -174.8 | -69.2 | 167.9 | 0 | 0 | 0 | 109 | I391 G392 D393 R399 K400 M403 | I391-I395 HydrophobicContact CG2-CD1 3.95Å; I391-I395 PolarHBondContact O-N 3.03Å; G392-I395 PolarHBondContact O-N 3.42Å; D393-I395 VanDerWaalsContact C-N 3.29Å; D393-I395 PolarHBondContact O-N 3.37Å; I395-R399 HydrophobicContact CG2-CB 3.51Å; I395-K400 HydrophobicContact CB-CG 4.4Å; I395-K400 HydrophobicContact CG2-CG 4.17Å; I395-K400 WeakPolarHBondContact O-CE 3.42Å; I395-K400 WeakPolarHBondContact O-CG 3.4Å; I395-M403 HydrophobicContact CD1-CG 4.09Å; I395-M403 HydrophobicContact CD1-SD 3.63Å |
| 396 | P | 84.4 | Confident | 92.9 | Very high | 91 Ų | 91 | 53.3 Ų | 53.3 | 59% | 0.591 | 28% | 0.279 | S | S | * | . | trans | -73.7 | 137.9 | -172.6 | 27.5 | -34.7 | 0 | 0 | 0 | 113.4 | L394 | L394-P396 WeakPolarHBondContact O-CD 3.18Š| ||
| 397 | G | 85.4 | Confident | 92.9 | Very high | 23 Ų | 23 | 49.9 Ų | 49.9 | 24% | 0.237 | 26% | 0.262 | C | S | . | . | G | 310 helix | trans | 63.4 | -152.4 | 171.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | R399 K400 | G397-R399 PolarHBondContact O-N 2.81Å; G397-K400 VanDerWaalsContact O-CG 3.29Å; G397-K400 WeakPolarHBondContact O-CG 3.49Å; G397-K400 PolarHBondContact O-N 3Å |
| 398 | L | 86.1 | Confident | 93 | Very high | 24 Ų | 24 | 47.8 Ų | 47.8 | 13% | 0.126 | 25% | 0.245 | C | C | . | . | G | 310 helix | trans | -64.9 | -2.4 | -175.3 | -58.7 | -176.7 | 0 | 0 | 0 | 115.4 | K400 I401 E451 L452 H515 | L398-K400 PolarHBondContact O-N 2.97Å; L398-I401 HydrophobicContact CB-CD1 4.25Å; L398-I401 HydrophobicContact CD2-CD1 4.23Å; L398-I401 WeakPolarHBondContact O-CB 3.42Å; L398-I401 WeakPolarHBondContact O-CG1 3.46Å; L398-I401 PolarHBondContact O-N 3.21Å; L398-I401 VanDerWaalsContact O-N 3.12Å; L398-E451 HydrophobicContact CD2-CB 3.82Å; L398-L452 HydrophobicContact CD1-CD2 4.05Å; L398-L452 HydrophobicContact CD2-CD2 3.61Å; L398-L452 HydrophobicContact CD2-CG 3.82Å; L398-H515 HydrophobicContact CD1-CB 3.74Å |
| 399 | R | 89.8 | Confident | 93.1 | Very high | 170 Ų | 170 | 47.9 Ų | 47.9 | 64% | 0.642 | 25% | 0.247 | S | C | * | . | G | 310 helix | trans | -61 | -24.7 | 170.2 | -65.7 | -178.7 | -176.5 | 179.8 | 3 | 112 | I395 G397 I401 Y402 | I395-R399 HydrophobicContact CG2-CB 3.51Å; G397-R399 PolarHBondContact O-N 2.81Å; R399-I401 PolarHBondContact O-N 3.39Å; R399-I401 VanDerWaalsContact O-N 3.16Å; R399-Y402 WeakPolarHBondContact O-CD2 2.85Å; R399-Y402 PolarHBondContact O-N 3.39Å |
| 400 | K | 91.3 | Very high | 93.2 | Very high | 12 Ų | 12 | 49.4 Ų | 49.4 | 5% | 0.052 | 26% | 0.259 | C | S | . | . | G | 310 helix | trans | -52.2 | -31.3 | 171.5 | -64.2 | 169.8 | -169.6 | -176.6 | 0 | 112.9 | G392 I395 G397 L398 Y402 M403 I448 E451 | G392-K400 WeakPolarHBondContact O-CE 3.38Å; I395-K400 HydrophobicContact CB-CG 4.4Å; I395-K400 HydrophobicContact CG2-CG 4.17Å; I395-K400 WeakPolarHBondContact O-CE 3.42Å; I395-K400 WeakPolarHBondContact O-CG 3.4Å; G397-K400 VanDerWaalsContact O-CG 3.29Å; G397-K400 WeakPolarHBondContact O-CG 3.49Å; G397-K400 PolarHBondContact O-N 3Å; L398-K400 PolarHBondContact O-N 2.97Å; K400-Y402 PolarHBondContact O-N 3.02Å; K400-M403 WeakPolarHBondContact O-CB 3.33Å; K400-M403 PolarHBondContact O-N 3.14Å; K400-M403 VanDerWaalsContact O-N 3.07Å; K400-I448 HydrophobicContact CB-CD1 4.4Å; K400-I448 HydrophobicContact CB-CG1 4Å; K400-E451 HydrophobicContact CD-CG 4.38Å; K400-E451 WeakPolarHBondContact CE-OE1 3.35Å; K400-E451 IonicContact NZ-OE1 2.67Å; K400-E451 PolarHBondContact NZ-OE1 2.98Å |
| 401 | I | 94.8 | Very high | 93.3 | Very high | 0 Ų | 0 | 43.1 Ų | 43.1 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -59.7 | -33.4 | 178.6 | -61.6 | 178.8 | 0 | 0 | 0 | 111.6 | L398 R399 M403 Q404 V405 I448 L452 L508 V511 P512 | L398-I401 HydrophobicContact CB-CD1 4.25Å; L398-I401 HydrophobicContact CD2-CD1 4.23Å; L398-I401 WeakPolarHBondContact O-CB 3.42Å; L398-I401 WeakPolarHBondContact O-CG1 3.46Å; L398-I401 PolarHBondContact O-N 3.21Å; L398-I401 VanDerWaalsContact O-N 3.12Å; R399-I401 PolarHBondContact O-N 3.39Å; R399-I401 VanDerWaalsContact O-N 3.16Å; I401-M403 PolarHBondContact O-N 2.98Å; I401-Q404 WeakPolarHBondContact O-CA 3.2Å; I401-Q404 WeakPolarHBondContact O-CB 3.41Å; I401-Q404 PolarHBondContact O-N 2.98Å; I401-V405 HydrophobicContact CG2-CG2 4.31Å; I401-V405 WeakPolarHBondContact O-CG2 3.39Å; I401-V405 PolarHBondContact O-N 3.4Å; I401-I448 HydrophobicContact CD1-CG2 4.11Å; I401-I448 HydrophobicContact CG1-CD1 4.06Å; I401-I448 HydrophobicContact CG1-CG1 4.23Å; I401-I448 HydrophobicContact CG1-CG2 3.77Å; I401-L452 HydrophobicContact CD1-CD2 4.4Å; I401-L508 HydrophobicContact CG2-CB 4.16Å; I401-L508 HydrophobicContact CG2-CD2 4.42Å; I401-L508 HydrophobicContact CG2-CG 4.42Å; I401-L508 WeakPolarHBondContact CG2-O 3.48Å; I401-V511 HydrophobicContact CD1-CB 4.1Å; I401-V511 HydrophobicContact CD1-CG1 3.66Å; I401-P512 HydrophobicContact CB-CG 4.08Å; I401-P512 HydrophobicContact CD1-CG 4.28Å; I401-P512 HydrophobicContact CG2-CG 4.3Å |
| 402 | Y | 95.3 | Very high | 93.3 | Very high | 87 Ų | 87 | 39.7 Ų | 39.7 | 34% | 0.341 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -65.9 | -24.9 | 178.5 | -63.9 | -61.4 | 0 | 0 | 0 | 113.4 | R399 K400 V405 A406 F509 P512 | R399-Y402 WeakPolarHBondContact O-CD2 2.85Å; R399-Y402 PolarHBondContact O-N 3.39Å; K400-Y402 PolarHBondContact O-N 3.02Å; Y402-V405 PolarHBondContact O-N 2.83Å; Y402-A406 WeakPolarHBondContact O-CB 3.45Å; Y402-A406 PolarHBondContact O-N 3.5Å; Y402-F509 HydrophobicContact CD1-CD2 4.09Å; Y402-F509 HydrophobicContact CD1-CE2 4.4Å; Y402-F509 AromaticContact CE1-CD2 3.77Å; Y402-F509 HydrophobicContact CE1-CD2 3.77Å; Y402-F509 AromaticContact CE1-CE2 3.89Å; Y402-F509 HydrophobicContact CE1-CE2 3.89Å; Y402-P512 HydrophobicContact CE1-CG 4.27Å; Y402-P512 HydrophobicContact CE2-CB 4.28Å; Y402-P512 HydrophobicContact CE2-CG 4.13Å |
| 403 | M | 95 | Very high | 93.6 | Very high | 24 Ų | 24 | 43.8 Ų | 43.8 | 12% | 0.118 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -66.2 | -43.3 | 170.3 | -57.6 | 172.9 | 64.8 | 0 | 0 | 110.8 | F388 I391 I395 K400 I401 A406 S407 M444 | F388-M403 HydrophobicContact CB-CE 4.06Å; F388-M403 HydrophobicContact CD1-CE 3.92Å; F388-M403 HydrophobicContact CG-CE 4.45Å; I391-M403 HydrophobicContact CB-CE 4.08Å; I391-M403 HydrophobicContact CG2-CE 3.78Å; I391-M403 HydrophobicContact CG2-SD 4.4Å; I395-M403 HydrophobicContact CD1-CG 4.09Å; I395-M403 HydrophobicContact CD1-SD 3.63Å; K400-M403 WeakPolarHBondContact O-CB 3.33Å; K400-M403 PolarHBondContact O-N 3.14Å; K400-M403 VanDerWaalsContact O-N 3.07Å; I401-M403 PolarHBondContact O-N 2.98Å; M403-A406 PolarHBondContact O-N 2.85Å; M403-S407 VanDerWaalsContact O-CB 3.25Å; M403-S407 WeakPolarHBondContact O-CB 3.17Å; M403-S407 PolarHBondContact O-N 2.78Å; M403-M444 HydrophobicContact CB-CG 4.48Å; M403-M444 HydrophobicContact CE-CG 4.38Å; M403-M444 HydrophobicContact CE-SD 4.03Å; M403-M444 HydrophobicContact SD-SD 3.88Å |
| 404 | Q | 95.1 | Very high | 93.7 | Very high | 0 Ų | 0 | 43.7 Ų | 43.7 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -67.7 | -35.3 | 177.2 | -165 | 179.1 | 8.9 | 0 | 0 | 111.9 | V342 I401 S407 F408 F441 I448 L508 | V342-Q404 VanDerWaalsContact CG2-NE2 3.33Å; I401-Q404 WeakPolarHBondContact O-CA 3.2Å; I401-Q404 WeakPolarHBondContact O-CB 3.41Å; I401-Q404 PolarHBondContact O-N 2.98Å; Q404-S407 WeakPolarHBondContact O-CB 3.38Å; Q404-F408 HydrophobicContact CG-CD2 4.17Å; Q404-F408 HydrophobicContact CG-CE2 3.85Å; Q404-F408 HydrophobicContact CG-CZ 4.21Å; Q404-F408 WeakPolarHBondContact O-CB 3.29Å; Q404-F408 WeakPolarHBondContact O-CG 3.41Å; Q404-F408 PolarHBondContact O-N 3.32Å; Q404-F441 HydrophobicContact CG-CD2 4.28Å; Q404-I448 HydrophobicContact CB-CD1 4.22Å; Q404-I448 VanDerWaalsContact OE1-CD1 3.3Å; Q404-L508 HydrophobicContact CB-CD2 4.14Å; Q404-L508 VanDerWaalsContact CD-CD2 3.41Å; Q404-L508 HydrophobicContact CG-CD2 3.72Å |
| 405 | V | 96.9 | Very high | 93.8 | Very high | 16 Ų | 16 | 37.1 Ų | 37.1 | 10% | 0.097 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -61.1 | -53.3 | 170.7 | 174.6 | 0 | 0 | 0 | 0 | 110.7 | I401 Y402 S407 F408 M409 L508 F509 | I401-V405 HydrophobicContact CG2-CG2 4.31Å; I401-V405 WeakPolarHBondContact O-CG2 3.39Å; I401-V405 PolarHBondContact O-N 3.4Å; Y402-V405 PolarHBondContact O-N 2.83Å; V405-S407 VanDerWaalsContact C-N 3.3Å; V405-S407 PolarHBondContact O-N 3.34Å; V405-F408 PolarHBondContact O-N 2.98Å; V405-M409 HydrophobicContact CG1-CG 4.35Å; V405-M409 WeakPolarHBondContact O-CG 3.12Å; V405-M409 PolarHBondContact O-N 3.43Å; V405-L508 HydrophobicContact CG2-CB 3.65Å; V405-F509 HydrophobicContact CG1-CB 4.25Å; V405-F509 HydrophobicContact CG2-CB 4.23Å |
| 406 | A | 96.9 | Very high | 94 | Very high | 61 Ų | 61 | 37.2 Ų | 37.2 | 50% | 0.504 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -58.6 | -43.8 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | Y402 M403 M409 A410 | Y402-A406 WeakPolarHBondContact O-CB 3.45Å; Y402-A406 PolarHBondContact O-N 3.5Å; M403-A406 PolarHBondContact O-N 2.85Å; A406-M409 PolarHBondContact O-N 3.01Å; A406-A410 VanDerWaalsContact O-CB 3.29Å; A406-A410 WeakPolarHBondContact O-CB 3.44Å; A406-A410 PolarHBondContact O-N 3.33Å |
| 407 | S | 96.6 | Very high | 94.5 | Very high | 6 Ų | 6 | 36.3 Ų | 36.3 | 4% | 0.042 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -55.5 | -49.9 | 173.2 | 175.7 | 0 | 0 | 0 | 0 | 112.8 | M403 Q404 V405 A410 L411 C437 | M403-S407 VanDerWaalsContact O-CB 3.25Å; M403-S407 WeakPolarHBondContact O-CB 3.17Å; M403-S407 PolarHBondContact O-N 2.78Å; Q404-S407 WeakPolarHBondContact O-CB 3.38Å; V405-S407 VanDerWaalsContact C-N 3.3Å; V405-S407 PolarHBondContact O-N 3.34Å; S407-A410 PolarHBondContact O-N 3.12Å; S407-L411 VanDerWaalsContact O-CB 3.25Å; S407-L411 WeakPolarHBondContact O-CB 3.19Å; S407-L411 PolarHBondContact O-N 3Å; S407-C437 PolarHBondContact OG-O 3.01Å |
| 408 | F | 97.1 | Very high | 95 | Very high | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -70.9 | -36.6 | -178.7 | -75.5 | -30.5 | 0 | 0 | 0 | 113.2 | V342 A345 Q404 V405 G412 F441 P501 L508 | V342-F408 HydrophobicContact CG1-CZ 4.33Å; V342-F408 HydrophobicContact CG2-CE2 4.15Å; V342-F408 HydrophobicContact CG2-CZ 4.34Å; A345-F408 HydrophobicContact CB-CD1 3.96Å; A345-F408 HydrophobicContact CB-CD2 3.83Å; A345-F408 HydrophobicContact CB-CE1 3.71Å; A345-F408 HydrophobicContact CB-CE2 3.56Å; A345-F408 HydrophobicContact CB-CG 4.03Å; A345-F408 HydrophobicContact CB-CZ 3.49Å; A345-F408 VanDerWaalsContact CB-CZ 3.49Å; Q404-F408 HydrophobicContact CG-CD2 4.17Å; Q404-F408 HydrophobicContact CG-CE2 3.85Å; Q404-F408 HydrophobicContact CG-CZ 4.21Å; Q404-F408 WeakPolarHBondContact O-CB 3.29Å; Q404-F408 WeakPolarHBondContact O-CG 3.41Å; Q404-F408 PolarHBondContact O-N 3.32Å; V405-F408 PolarHBondContact O-N 2.98Å; F408-G412 PolarHBondContact O-N 3.41Å; F408-F441 HydrophobicContact CE1-CB 4.22Å; F408-F441 HydrophobicContact CE1-CD1 4.01Å; F408-F441 AromaticContact CE1-CD2 3.51Å; F408-F441 HydrophobicContact CE1-CD2 3.51Å; F408-F441 HydrophobicContact CE1-CE1 4.26Å; F408-F441 AromaticContact CE1-CE2 3.83Å; F408-F441 HydrophobicContact CE1-CE2 3.83Å; F408-F441 AromaticContact CE1-CG 3.62Å; F408-F441 HydrophobicContact CE1-CG 3.62Å; F408-F441 HydrophobicContact CE1-CZ 4.18Å; F408-F441 AromaticContact CZ-CD2 3.46Å; F408-F441 HydrophobicContact CZ-CD2 3.46Å; F408-F441 VanDerWaalsContact CZ-CD2 3.46Å; F408-F441 AromaticContact CZ-CE2 3.5Å; F408-F441 HydrophobicContact CZ-CE2 3.5Å; F408-F441 VanDerWaalsContact CZ-CE2 3.5Å; F408-F441 HydrophobicContact CZ-CG 4.09Å; F408-F441 HydrophobicContact CZ-CZ 4.11Å; F408-P501 WeakPolarHBondContact CB-O 3.43Å; F408-P501 WeakPolarHBondContact O-CB 3.16Å; F408-L508 HydrophobicContact CD2-CD2 4.09Å; F408-L508 HydrophobicContact CE2-CD1 4.47Å; F408-L508 HydrophobicContact CE2-CD2 3.79Å |
| 409 | M | 97.7 | Very high | 95.3 | Very high | 64 Ų | 64 | 34.7 Ų | 34.7 | 32% | 0.315 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -64.1 | -43.3 | 173.9 | -67.1 | -58.8 | -63 | 0 | 0 | 111.4 | V405 A406 L413 M502 V506 | V405-M409 HydrophobicContact CG1-CG 4.35Å; V405-M409 WeakPolarHBondContact O-CG 3.12Å; V405-M409 PolarHBondContact O-N 3.43Å; A406-M409 PolarHBondContact O-N 3.01Å; M409-L413 WeakPolarHBondContact O-CB 3.31Å; M409-L413 PolarHBondContact O-N 3.25Å; M409-M502 HydrophobicContact CE-CB 4.35Å; M409-M502 HydrophobicContact CE-CE 3.74Å; M409-M502 HydrophobicContact CE-CG 4.31Å; M409-M502 HydrophobicContact SD-CB 4.08Å; M409-M502 HydrophobicContact SD-CG 4.32Å; M409-V506 HydrophobicContact SD-CG2 4.28Å |
| 410 | A | 96.5 | Very high | 95.5 | Very high | 31 Ų | 31 | 33.2 Ų | 33.2 | 26% | 0.256 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -68.4 | -42.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | A406 S407 G412 L413 M414 C437 | A406-A410 VanDerWaalsContact O-CB 3.29Å; A406-A410 WeakPolarHBondContact O-CB 3.44Å; A406-A410 PolarHBondContact O-N 3.33Å; S407-A410 PolarHBondContact O-N 3.12Å; A410-G412 VanDerWaalsContact C-N 3.34Å; A410-G412 PolarHBondContact O-N 3.19Å; A410-L413 PolarHBondContact O-N 3.18Å; A410-M414 VanDerWaalsContact O-CB 3.31Å; A410-M414 WeakPolarHBondContact O-CB 3.49Å; A410-M414 WeakPolarHBondContact O-CG 3.4Å; A410-M414 PolarHBondContact O-N 2.84Å; A410-C437 VanDerWaalsContact CB-SG 3.53Å |
| 411 | L | 95.9 | Very high | 95.6 | Very high | 3 Ų | 3 | 33.3 Ų | 33.3 | 2% | 0.016 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -58.7 | -45.2 | 175.4 | -170.8 | 90.5 | 0 | 0 | 0 | 111.6 | Y349 S407 S415 L434 C437 P501 | Y349-L411 HydrophobicContact CD2-CD1 4.46Å; Y349-L411 HydrophobicContact CD2-CD2 3.71Å; Y349-L411 HydrophobicContact CG-CD2 4.37Å; S407-L411 VanDerWaalsContact O-CB 3.25Å; S407-L411 WeakPolarHBondContact O-CB 3.19Å; S407-L411 PolarHBondContact O-N 3Å; L411-S415 WeakPolarHBondContact O-CB 3.29Å; L411-S415 PolarHBondContact O-N 3.43Å; L411-S415 PolarHBondContact O-OG 3.34Å; L411-L434 HydrophobicContact CD1-CD2 3.77Å; L411-L434 HydrophobicContact CG-CD2 4.17Å; L411-C437 HydrophobicContact CB-CB 4.28Å; L411-C437 HydrophobicContact CD1-CB 4.2Å; L411-P501 HydrophobicContact CD2-CB 4.22Å; L411-P501 HydrophobicContact CD2-CG 4.11Å |
| 412 | G | 96.8 | Very high | 95.3 | Very high | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -62.8 | -48.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | F408 A410 S415 M416 G498 | F408-G412 PolarHBondContact O-N 3.41Å; A410-G412 VanDerWaalsContact C-N 3.34Å; A410-G412 PolarHBondContact O-N 3.19Å; G412-S415 WeakPolarHBondContact O-CB 3.46Å; G412-S415 PolarHBondContact O-N 2.87Å; G412-M416 PolarHBondContact O-N 3.38Å; G412-M416 VanDerWaalsContact O-N 3.15Å; G412-G498 VanDerWaalsContact CA-O 3.24Å; G412-G498 WeakPolarHBondContact CA-O 3.1Å; G412-G498 WeakPolarHBondContact O-CA 3.42Å |
| 413 | L | 96.9 | Very high | 95.1 | Very high | 88 Ų | 88 | 37.8 Ų | 37.8 | 46% | 0.461 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -58 | -50.4 | 175 | 176.1 | 61.7 | 0 | 0 | 0 | 111.9 | M409 A410 S415 M416 M417 | M409-L413 WeakPolarHBondContact O-CB 3.31Å; M409-L413 PolarHBondContact O-N 3.25Å; A410-L413 PolarHBondContact O-N 3.18Å; L413-S415 VanDerWaalsContact C-N 3.25Å; L413-S415 PolarHBondContact O-N 3.31Å; L413-M416 WeakPolarHBondContact O-CB 3.26Å; L413-M416 PolarHBondContact O-N 3Å; L413-M417 HydrophobicContact CD1-CG 4.49Å; L413-M417 WeakPolarHBondContact O-CG 3.24Å; L413-M417 PolarHBondContact O-N 3.4Å |
| 414 | M | 96 | Very high | 94.8 | Very high | 32 Ų | 32 | 37.5 Ų | 37.5 | 16% | 0.158 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -62.2 | -34 | -179.5 | -70.6 | -66.4 | 162.1 | 0 | 0 | 111.9 | A410 M417 I418 V430 F433 L434 | A410-M414 VanDerWaalsContact O-CB 3.31Å; A410-M414 WeakPolarHBondContact O-CB 3.49Å; A410-M414 WeakPolarHBondContact O-CG 3.4Å; A410-M414 PolarHBondContact O-N 2.84Å; M414-M417 PolarHBondContact O-N 3.47Å; M414-M417 VanDerWaalsContact O-N 3.13Å; M414-I418 PolarHBondContact O-N 3.5Å; M414-V430 HydrophobicContact CB-CG1 4.18Å; M414-V430 WeakPolarHBondContact O-CG1 3.49Å; M414-V430 HydrophobicContact SD-CG1 4.38Å; M414-V430 HydrophobicContact SD-CG2 4.24Å; M414-F433 HydrophobicContact CE-CB 3.97Å; M414-F433 HydrophobicContact CE-CD2 4.12Å; M414-F433 HydrophobicContact CE-CG 3.97Å; M414-F433 HydrophobicContact CG-CB 4Å; M414-F433 HydrophobicContact SD-CB 3.84Å; M414-F433 HydrophobicContact SD-CD2 4.46Å; M414-F433 HydrophobicContact SD-CG 4.37Å; M414-L434 HydrophobicContact CB-CD2 3.59Å; M414-L434 HydrophobicContact CB-CG 3.83Å |
| 415 | S | 94.6 | Very high | 94.6 | Very high | 0 Ų | 0 | 43.7 Ų | 43.7 | 0% | 0 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -63.8 | -41.2 | 173.6 | -56.2 | 0 | 0 | 0 | 0 | 111.6 | L411 G412 L413 M417 I418 | L411-S415 WeakPolarHBondContact O-CB 3.29Å; L411-S415 PolarHBondContact O-N 3.43Å; L411-S415 PolarHBondContact O-OG 3.34Å; G412-S415 WeakPolarHBondContact O-CB 3.46Å; G412-S415 PolarHBondContact O-N 2.87Å; L413-S415 VanDerWaalsContact C-N 3.25Å; L413-S415 PolarHBondContact O-N 3.31Å; S415-M417 VanDerWaalsContact C-N 3.26Å; S415-M417 PolarHBondContact O-N 3.26Å; S415-I418 PolarHBondContact O-N 3.08Å |
| 416 | M | 95.8 | Very high | 94.4 | Very high | 50 Ų | 50 | 44.2 Ų | 44.2 | 25% | 0.246 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -67.4 | -23.7 | 172.9 | -62.3 | 178.3 | 178.5 | 0 | 0 | 113.3 | G412 L413 P419 V499 M502 | G412-M416 PolarHBondContact O-N 3.38Å; G412-M416 VanDerWaalsContact O-N 3.15Å; L413-M416 WeakPolarHBondContact O-CB 3.26Å; L413-M416 PolarHBondContact O-N 3Å; M416-P419 WeakPolarHBondContact O-CD 3.36Å; M416-V499 HydrophobicContact CE-CB 4.48Å; M416-V499 HydrophobicContact CE-CG2 3.54Å; M416-M502 HydrophobicContact CE-SD 3.8Å; M416-M502 HydrophobicContact SD-SD 4.27Å |
| 417 | M | 95.3 | Very high | 94.2 | Very high | 72 Ų | 72 | 41.3 Ų | 41.3 | 36% | 0.355 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -80.7 | -20.2 | 177.6 | -64.1 | -154.3 | 77.4 | 0 | 0 | 114.1 | L413 M414 S415 Q420 C421 V430 | L413-M417 HydrophobicContact CD1-CG 4.49Å; L413-M417 WeakPolarHBondContact O-CG 3.24Å; L413-M417 PolarHBondContact O-N 3.4Å; M414-M417 PolarHBondContact O-N 3.47Å; M414-M417 VanDerWaalsContact O-N 3.13Å; S415-M417 VanDerWaalsContact C-N 3.26Å; S415-M417 PolarHBondContact O-N 3.26Å; M417-Q420 WeakPolarHBondContact O-CB 3.36Å; M417-Q420 PolarHBondContact O-N 3.36Å; M417-C421 PolarHBondContact O-N 2.8Å; M417-C421 VanDerWaalsContact O-N 3.17Å; M417-C421 PolarHBondContact O-SG 3.06Å; M417-V430 HydrophobicContact CB-CG2 4.16Å |
| 418 | I | 94.4 | Very high | 94.1 | Very high | 0 Ų | 0 | 42.2 Ų | 42.2 | 0% | 0 | 24% | 0.24 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -47.8 | -57.3 | 175.7 | -67.2 | 170.2 | 0 | 0 | 0 | 112.2 | P352 L356 F359 M414 S415 Q420 C421 L427 V430 L434 F494 | P352-I418 HydrophobicContact CB-CD1 3.86Å; P352-I418 HydrophobicContact CG-CD1 3.91Å; L356-I418 HydrophobicContact CD1-CG2 4.22Å; F359-I418 HydrophobicContact CD1-CG2 3.8Å; F359-I418 HydrophobicContact CE1-CG2 3.54Å; F359-I418 HydrophobicContact CZ-CG2 4.1Å; F359-I418 WeakPolarHBondContact CZ-O 3.44Å; M414-I418 PolarHBondContact O-N 3.5Å; S415-I418 PolarHBondContact O-N 3.08Å; I418-Q420 PolarHBondContact O-N 2.84Å; I418-C421 WeakPolarHBondContact O-CB 3.27Å; I418-C421 PolarHBondContact O-N 2.96Å; I418-L427 HydrophobicContact CB-CD1 4.31Å; I418-L427 HydrophobicContact CG1-CD1 4.24Å; I418-L427 HydrophobicContact CG2-CD1 3.96Å; I418-V430 HydrophobicContact CG1-CG1 3.96Å; I418-L434 HydrophobicContact CD1-CD1 4.05Å; I418-L434 HydrophobicContact CG1-CD1 4.43Å; I418-F494 HydrophobicContact CB-CB 4.48Å; I418-F494 HydrophobicContact CB-CD2 4.19Å; I418-F494 HydrophobicContact CB-CG 4.26Å; I418-F494 HydrophobicContact CD1-CD1 4.08Å; I418-F494 HydrophobicContact CD1-CE1 4.36Å; I418-F494 HydrophobicContact CD1-CG 4.36Å; I418-F494 HydrophobicContact CG2-CD2 3.52Å; I418-F494 HydrophobicContact CG2-CE2 3.6Å; I418-F494 HydrophobicContact CG2-CG 4.01Å; I418-F494 HydrophobicContact CG2-CZ 4.18Å |
| 419 | P | 93.8 | Very high | 94 | Very high | 13 Ų | 13 | 46.1 Ų | 46.1 | 8% | 0.084 | 26% | 0.263 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.9 | -24.2 | -179.3 | 26.1 | -35.3 | 0 | 0 | 0 | 113.6 | K363 M416 C421 T491 F494 | K363-P419 PolarHBondContact NZ-O 3.44Å; M416-P419 WeakPolarHBondContact O-CD 3.36Å; P419-C421 VanDerWaalsContact C-N 3.35Å; P419-T491 HydrophobicContact CB-CG2 4.03Å; P419-T491 HydrophobicContact CG-CG2 4.45Å; P419-F494 HydrophobicContact CG-CB 4.3Å |
| 420 | Q | 93.4 | Very high | 93.9 | Very high | 138 Ų | 138 | 43.6 Ų | 43.6 | 65% | 0.645 | 25% | 0.251 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.8 | -18.9 | 179 | -59.2 | -174.5 | -6.4 | 0 | 0 | 113.2 | M417 I418 A422 | M417-Q420 WeakPolarHBondContact O-CB 3.36Å; M417-Q420 PolarHBondContact O-N 3.36Å; I418-Q420 PolarHBondContact O-N 2.84Å; Q420-A422 PolarHBondContact O-N 3.16Å; Q420-A422 VanDerWaalsContact O-N 3.09Å |
| 421 | C | 92.4 | Very high | 93.8 | Very high | 15 Ų | 15 | 42.1 Ų | 42.1 | 10% | 0.101 | 24% | 0.239 | C | C | . | . | trans | -63.5 | 111.6 | 178.1 | -66.7 | 0 | 0 | 0 | 0 | 110.9 | K363 F364 M417 I418 P419 L427 | K363-C421 PolarHBondContact NZ-O 3.03Å; F364-C421 WeakPolarHBondContact CZ-O 3.44Å; M417-C421 PolarHBondContact O-N 2.8Å; M417-C421 VanDerWaalsContact O-N 3.17Å; M417-C421 PolarHBondContact O-SG 3.06Å; I418-C421 WeakPolarHBondContact O-CB 3.27Å; I418-C421 PolarHBondContact O-N 2.96Å; P419-C421 VanDerWaalsContact C-N 3.35Å; C421-L427 HydrophobicContact CB-CB 4.06Å; C421-L427 HydrophobicContact CB-CD1 4.38Å | ||
| 422 | A | 89.1 | Confident | 93.8 | Very high | 85 Ų | 85 | 44.4 Ų | 44.4 | 70% | 0.702 | 25% | 0.253 | S | S | * | . | trans | -87.1 | -14.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | Q420 | Q420-A422 PolarHBondContact O-N 3.16Å; Q420-A422 VanDerWaalsContact O-N 3.09Å | ||
| 423 | V | 91.2 | Very high | 93.8 | Very high | 95 Ų | 95 | 49.1 Ų | 49.1 | 58% | 0.576 | 27% | 0.274 | S | S | * | . | S | Bend | trans | -132.1 | 147.7 | 179.6 | -67.2 | 0 | 0 | 0 | 0 | 110.3 | E425 G426 L427 | V423-E425 PolarHBondContact O-N 2.76Å; V423-G426 PolarHBondContact O-N 2.95Å; V423-G426 VanDerWaalsContact O-N 3.16Å; V423-L427 PolarHBondContact O-N 2.9Å |
| 424 | F | 89.6 | Confident | 93.7 | Very high | 18 Ų | 18 | 45 Ų | 45 | 8% | 0.079 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -59.8 | -43.8 | -176.3 | -174.5 | -101.4 | 0 | 0 | 0 | 112.5 | V360 N367 Q369 L373 G426 L427 V428 | V360-F424 HydrophobicContact CG1-CD2 4.4Å; V360-F424 HydrophobicContact CG1-CE2 4.09Å; N367-F424 HydrophobicContact CB-CD2 4.48Å; Q369-F424 HydrophobicContact CB-CZ 4.49Å; L373-F424 HydrophobicContact CD1-CE2 3.84Å; L373-F424 HydrophobicContact CD1-CZ 4.28Å; L373-F424 HydrophobicContact CD2-CE2 4.29Å; L373-F424 HydrophobicContact CD2-CZ 4.14Å; L373-F424 HydrophobicContact CG-CE2 4.08Å; L373-F424 HydrophobicContact CG-CZ 4.01Å; F424-G426 PolarHBondContact O-N 2.69Å; F424-L427 CarbonylContact O-C 3.4Å; F424-L427 WeakPolarHBondContact O-CA 3.36Å; F424-L427 VanDerWaalsContact O-CB 3.31Å; F424-L427 WeakPolarHBondContact O-CB 3.38Å; F424-L427 PolarHBondContact O-N 2.97Å; F424-V428 HydrophobicContact CD1-CG2 3.95Å; F424-V428 HydrophobicContact CE1-CG2 3.77Å; F424-V428 HydrophobicContact CZ-CG2 4.39Å; F424-V428 PolarHBondContact O-N 2.86Å |
| 425 | E | 90.3 | Very high | 93.6 | Very high | 131 Ų | 131 | 43.5 Ų | 43.5 | 61% | 0.612 | 25% | 0.245 | S | C | * | . | H | α-helix | trans | -56.1 | -36.4 | 176.2 | -55.6 | -48.3 | 124.6 | 0 | 0 | 113.4 | V423 L427 V428 V429 | V423-E425 PolarHBondContact O-N 2.76Å; E425-L427 VanDerWaalsContact C-N 3.31Å; E425-L427 PolarHBondContact O-N 3.18Å; E425-V428 WeakPolarHBondContact O-CB 3.43Å; E425-V428 PolarHBondContact O-N 3.46Å; E425-V429 WeakPolarHBondContact O-CG2 3.49Å; E425-V429 PolarHBondContact O-N 2.96Å |
| 426 | G | 92.4 | Very high | 93.7 | Very high | 26 Ų | 26 | 45.8 Ų | 45.8 | 27% | 0.268 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -65.7 | -36.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | V423 F424 V429 V430 | V423-G426 PolarHBondContact O-N 2.95Å; V423-G426 VanDerWaalsContact O-N 3.16Å; F424-G426 PolarHBondContact O-N 2.69Å; G426-V429 PolarHBondContact O-N 2.81Å; G426-V430 WeakPolarHBondContact O-CG2 3.39Å; G426-V430 PolarHBondContact O-N 3.24Å; G426-V430 VanDerWaalsContact O-N 3.08Å |
| 427 | L | 92.8 | Very high | 93.7 | Very high | 0 Ų | 0 | 44.2 Ų | 44.2 | 0% | 0 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -70.9 | -36.9 | 175 | -172 | 61.3 | 0 | 0 | 0 | 111.8 | L356 F359 V360 F364 L373 I418 C421 V423 F424 E425 V429 V430 C431 | L356-L427 HydrophobicContact CD1-CD1 3.92Å; L356-L427 HydrophobicContact CD1-CD2 3.93Å; L356-L427 HydrophobicContact CD1-CG 4.17Å; F359-L427 HydrophobicContact CD1-CD2 4.35Å; F359-L427 HydrophobicContact CE1-CD1 4.43Å; F359-L427 HydrophobicContact CE1-CD2 4.03Å; V360-L427 HydrophobicContact CG2-CD2 3.56Å; F364-L427 HydrophobicContact CE2-CD2 4.06Å; L373-L427 HydrophobicContact CD1-CD2 3.86Å; L373-L427 HydrophobicContact CD1-CG 4.26Å; L373-L427 HydrophobicContact CD2-CG 4.31Å; I418-L427 HydrophobicContact CB-CD1 4.31Å; I418-L427 HydrophobicContact CG1-CD1 4.24Å; I418-L427 HydrophobicContact CG2-CD1 3.96Å; C421-L427 HydrophobicContact CB-CB 4.06Å; C421-L427 HydrophobicContact CB-CD1 4.38Å; V423-L427 PolarHBondContact O-N 2.9Å; F424-L427 CarbonylContact O-C 3.4Å; F424-L427 WeakPolarHBondContact O-CA 3.36Å; F424-L427 VanDerWaalsContact O-CB 3.31Å; F424-L427 WeakPolarHBondContact O-CB 3.38Å; F424-L427 PolarHBondContact O-N 2.97Å; E425-L427 VanDerWaalsContact C-N 3.31Å; E425-L427 PolarHBondContact O-N 3.18Å; L427-V429 VanDerWaalsContact C-N 3.33Å; L427-V429 PolarHBondContact O-N 3.41Å; L427-V430 PolarHBondContact O-N 3.33Å; L427-C431 WeakPolarHBondContact O-CB 3.25Å; L427-C431 PolarHBondContact O-N 2.96Å; L427-C431 PolarHBondContact O-SG 3.33Å |
| 428 | V | 93.7 | Very high | 93.6 | Very high | 26 Ų | 26 | 40.9 Ų | 40.9 | 16% | 0.158 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -57.9 | -45.4 | 171.2 | 178.1 | 0 | 0 | 0 | 0 | 110.6 | L373 F424 E425 C431 V432 | L373-V428 HydrophobicContact CD2-CB 4.22Å; L373-V428 HydrophobicContact CD2-CG2 3.6Å; F424-V428 HydrophobicContact CD1-CG2 3.95Å; F424-V428 HydrophobicContact CE1-CG2 3.77Å; F424-V428 HydrophobicContact CZ-CG2 4.39Å; F424-V428 PolarHBondContact O-N 2.86Å; E425-V428 WeakPolarHBondContact O-CB 3.43Å; E425-V428 PolarHBondContact O-N 3.46Å; V428-C431 WeakPolarHBondContact O-CB 3.48Å; V428-C431 PolarHBondContact O-N 3.33Å; V428-V432 WeakPolarHBondContact O-CG2 3.34Å; V428-V432 PolarHBondContact O-N 3.36Å |
| 429 | V | 95.6 | Very high | 93.6 | Very high | 81 Ų | 81 | 40.9 Ų | 40.9 | 49% | 0.491 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -61.7 | -46.8 | 176.7 | 172.5 | 0 | 0 | 0 | 0 | 111.7 | E425 G426 L427 C431 V432 F433 | E425-V429 WeakPolarHBondContact O-CG2 3.49Å; E425-V429 PolarHBondContact O-N 2.96Å; G426-V429 PolarHBondContact O-N 2.81Å; L427-V429 VanDerWaalsContact C-N 3.33Å; L427-V429 PolarHBondContact O-N 3.41Å; V429-C431 VanDerWaalsContact C-N 3.28Å; V429-C431 PolarHBondContact O-N 3.44Å; V429-V432 PolarHBondContact O-N 3.45Å; V429-F433 HydrophobicContact CG1-CD2 3.9Å; V429-F433 HydrophobicContact CG1-CE2 3.77Å; V429-F433 VanDerWaalsContact O-CD2 3.31Å; V429-F433 WeakPolarHBondContact O-CD2 3.3Å; V429-F433 PolarHBondContact O-N 3.2Å; V429-F433 VanDerWaalsContact O-N 3.11Å |
| 430 | V | 95.7 | Very high | 93.7 | Very high | 11 Ų | 11 | 40.5 Ų | 40.5 | 7% | 0.067 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -58 | -41.6 | 174.6 | 168.4 | 0 | 0 | 0 | 0 | 111.3 | M414 M417 I418 G426 L427 F433 L434 | M414-V430 HydrophobicContact CB-CG1 4.18Å; M414-V430 WeakPolarHBondContact O-CG1 3.49Å; M414-V430 HydrophobicContact SD-CG1 4.38Å; M414-V430 HydrophobicContact SD-CG2 4.24Å; M417-V430 HydrophobicContact CB-CG2 4.16Å; I418-V430 HydrophobicContact CG1-CG1 3.96Å; G426-V430 WeakPolarHBondContact O-CG2 3.39Å; G426-V430 PolarHBondContact O-N 3.24Å; G426-V430 VanDerWaalsContact O-N 3.08Å; L427-V430 PolarHBondContact O-N 3.33Å; V430-F433 PolarHBondContact O-N 2.87Å; V430-L434 HydrophobicContact CG1-CD1 4Å; V430-L434 HydrophobicContact CG1-CG 4.38Å; V430-L434 WeakPolarHBondContact O-CG 3.49Å; V430-L434 PolarHBondContact O-N 3.24Å |
| 431 | C | 93.9 | Very high | 93.7 | Very high | 0 Ų | 0 | 34.1 Ų | 34.1 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -63.7 | -39.8 | 177.2 | -72.1 | 0 | 0 | 0 | 0 | 113.1 | L356 L373 I377 L427 V428 V429 L434 G435 | L356-C431 VanDerWaalsContact CD2-SG 3.59Å; L373-C431 HydrophobicContact CD2-CB 4.38Å; I377-C431 HydrophobicContact CD1-CB 4.18Å; I377-C431 HydrophobicContact CG1-CB 3.74Å; I377-C431 WeakPolarHBondContact CG1-O 3.37Å; L427-C431 WeakPolarHBondContact O-CB 3.25Å; L427-C431 PolarHBondContact O-N 2.96Å; L427-C431 PolarHBondContact O-SG 3.33Å; V428-C431 WeakPolarHBondContact O-CB 3.48Å; V428-C431 PolarHBondContact O-N 3.33Å; V429-C431 VanDerWaalsContact C-N 3.28Å; V429-C431 PolarHBondContact O-N 3.44Å; C431-L434 PolarHBondContact O-N 3.32Å; C431-G435 PolarHBondContact O-N 3.42Å |
| 432 | V | 96.1 | Very high | 93.7 | Very high | 52 Ų | 52 | 35.4 Ų | 35.4 | 32% | 0.315 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -63 | -42.5 | 174 | 170.5 | 0 | 0 | 0 | 0 | 111.1 | C376 S380 V428 V429 L436 | C376-V432 HydrophobicContact CB-CG2 4.13Å; S380-V432 WeakPolarHBondContact CB-O 3.42Å; S380-V432 PolarHBondContact OG-O 3.47Å; V428-V432 WeakPolarHBondContact O-CG2 3.34Å; V428-V432 PolarHBondContact O-N 3.36Å; V429-V432 PolarHBondContact O-N 3.45Å; V432-L436 HydrophobicContact CG1-CD1 4.21Å; V432-L436 WeakPolarHBondContact O-CG 3.33Å; V432-L436 PolarHBondContact O-N 3.43Å |
| 433 | F | 96.3 | Very high | 94 | Very high | 99 Ų | 99 | 31.3 Ų | 31.3 | 43% | 0.434 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -67.4 | -40.3 | 175.7 | -79.9 | -69 | 0 | 0 | 0 | 113.2 | M414 V429 V430 L436 C437 | M414-F433 HydrophobicContact CE-CB 3.97Å; M414-F433 HydrophobicContact CE-CD2 4.12Å; M414-F433 HydrophobicContact CE-CG 3.97Å; M414-F433 HydrophobicContact CG-CB 4Å; M414-F433 HydrophobicContact SD-CB 3.84Å; M414-F433 HydrophobicContact SD-CD2 4.46Å; M414-F433 HydrophobicContact SD-CG 4.37Å; V429-F433 HydrophobicContact CG1-CD2 3.9Å; V429-F433 HydrophobicContact CG1-CE2 3.77Å; V429-F433 VanDerWaalsContact O-CD2 3.31Å; V429-F433 WeakPolarHBondContact O-CD2 3.3Å; V429-F433 PolarHBondContact O-N 3.2Å; V429-F433 VanDerWaalsContact O-N 3.11Å; V430-F433 PolarHBondContact O-N 2.87Å; F433-L436 PolarHBondContact O-N 3.49Å; F433-C437 PolarHBondContact O-N 3.14Å; F433-C437 PolarHBondContact O-SG 3.5Å |
| 434 | L | 94.8 | Very high | 94 | Very high | 1 Ų | 1 | 26.8 Ų | 26.8 | 1% | 0.005 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -57.3 | -49.4 | 174.1 | -76 | 168.5 | 0 | 0 | 0 | 111.4 | P352 L411 M414 I418 V430 C431 C437 D438 | P352-L434 HydrophobicContact CB-CD1 4.39Å; L411-L434 HydrophobicContact CD1-CD2 3.77Å; L411-L434 HydrophobicContact CG-CD2 4.17Å; M414-L434 HydrophobicContact CB-CD2 3.59Å; M414-L434 HydrophobicContact CB-CG 3.83Å; I418-L434 HydrophobicContact CD1-CD1 4.05Å; I418-L434 HydrophobicContact CG1-CD1 4.43Å; V430-L434 HydrophobicContact CG1-CD1 4Å; V430-L434 HydrophobicContact CG1-CG 4.38Å; V430-L434 WeakPolarHBondContact O-CG 3.49Å; V430-L434 PolarHBondContact O-N 3.24Å; C431-L434 PolarHBondContact O-N 3.32Å; L434-C437 PolarHBondContact O-N 3.19Å; L434-D438 PolarHBondContact O-N 3.19Å |
| 435 | G | 94.7 | Very high | 94.1 | Very high | 0 Ų | 0 | 26.4 Ų | 26.4 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -64 | -42.5 | 178 | 0 | 0 | 0 | 0 | 0 | 113.1 | S380 S381 C431 C437 D438 G439 | S380-G435 VanDerWaalsContact OG-CA 3.26Å; S380-G435 WeakPolarHBondContact OG-CA 3.33Å; S381-G435 WeakPolarHBondContact CA-O 3.47Å; S381-G435 VanDerWaalsContact CB-O 3.28Å; S381-G435 WeakPolarHBondContact CB-O 3.26Å; C431-G435 PolarHBondContact O-N 3.42Å; G435-C437 VanDerWaalsContact C-N 3.27Å; G435-C437 PolarHBondContact O-N 3.38Å; G435-D438 PolarHBondContact O-N 3.43Å; G435-G439 PolarHBondContact O-N 2.9Å |
| 436 | L | 96.3 | Very high | 94.1 | Very high | 49 Ų | 49 | 20.3 Ų | 20.3 | 26% | 0.257 | 12% | 0.117 | S | C | . | . | H | α-helix | trans | -58 | -39.2 | 174.2 | -78.1 | 169.9 | 0 | 0 | 0 | 112.3 | S380 F388 V432 F433 C440 | S380-L436 WeakPolarHBondContact O-CD2 3.18Å; S380-L436 PolarHBondContact OG-N 3.22Å; F388-L436 WeakPolarHBondContact CE2-O 3.35Å; V432-L436 HydrophobicContact CG1-CD1 4.21Å; V432-L436 WeakPolarHBondContact O-CG 3.33Å; V432-L436 PolarHBondContact O-N 3.43Å; F433-L436 PolarHBondContact O-N 3.49Å; L436-C440 PolarHBondContact O-N 3.35Å |
| 437 | C | 95.7 | Very high | 94.1 | Very high | 16 Ų | 16 | 19.2 Ų | 19.2 | 11% | 0.108 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -68 | -49.4 | 176.1 | -63.9 | 0 | 0 | 0 | 0 | 111.4 | S407 A410 L411 F433 L434 G435 G439 C440 F441 | S407-C437 PolarHBondContact OG-O 3.01Å; A410-C437 VanDerWaalsContact CB-SG 3.53Å; L411-C437 HydrophobicContact CB-CB 4.28Å; L411-C437 HydrophobicContact CD1-CB 4.2Å; F433-C437 PolarHBondContact O-N 3.14Å; F433-C437 PolarHBondContact O-SG 3.5Å; L434-C437 PolarHBondContact O-N 3.19Å; G435-C437 VanDerWaalsContact C-N 3.27Å; G435-C437 PolarHBondContact O-N 3.38Å; C437-G439 VanDerWaalsContact C-N 3.25Å; C437-G439 PolarHBondContact O-N 3.25Å; C437-C440 WeakPolarHBondContact O-CA 3.37Å; C437-C440 WeakPolarHBondContact O-CB 3.43Å; C437-C440 PolarHBondContact O-N 3.4Å; C437-F441 PolarHBondContact O-N 3.07Å |
| 438 | D | 93.9 | Very high | 94.1 | Very high | 3 Ų | 3 | 19.3 Ų | 19.3 | 2% | 0.016 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -49.9 | -47.4 | 172.5 | 166.4 | 48.8 | 0 | 0 | 0 | 112.2 | Y349 Y353 S381 R385 L434 G435 C440 F441 L442 | Y349-D438 HydrophobicContact CE2-CB 4.06Å; Y349-D438 WeakPolarHBondContact CE2-OD1 3.49Å; Y349-D438 VanDerWaalsContact OH-CG 3.32Å; Y349-D438 PolarHBondContact OH-OD1 3.17Å; Y353-D438 WeakPolarHBondContact OH-CB 3.49Å; S381-D438 WeakPolarHBondContact CB-OD2 3.33Å; S381-D438 PolarHBondContact OG-OD2 3.03Å; R385-D438 IonicContact CZ-OD2 3.98Å; R385-D438 IonicContact NE-OD2 2.69Å; R385-D438 IonicContact NH2-OD1 3.82Å; R385-D438 IonicContact NH2-OD2 3.95Å; R385-D438 PolarHBondContact NH2-OD2 3.1Å; L434-D438 PolarHBondContact O-N 3.19Å; G435-D438 PolarHBondContact O-N 3.43Å; D438-C440 VanDerWaalsContact C-N 3.26Å; D438-C440 PolarHBondContact O-N 3.12Å; D438-F441 PolarHBondContact O-N 2.98Å; D438-L442 PolarHBondContact O-N 3.16Å; D438-L442 WeakPolarHBondContact OD1-CD1 3.31Å; D438-L442 VanDerWaalsContact OD1-CG 3.32Å; D438-L442 WeakPolarHBondContact OD1-CG 3.13Å |
| 439 | G | 93.9 | Very high | 94.1 | Very high | 0 Ų | 0 | 18 Ų | 18 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -61.2 | -33.4 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | R385 G435 C437 T443 | R385-G439 VanDerWaalsContact CG-CA 3.5Å; G435-G439 PolarHBondContact O-N 2.9Å; C437-G439 VanDerWaalsContact C-N 3.25Å; C437-G439 PolarHBondContact O-N 3.25Å; G439-T443 VanDerWaalsContact O-CB 3.25Å; G439-T443 WeakPolarHBondContact O-CB 3.25Å; G439-T443 PolarHBondContact O-N 3.19Å; G439-T443 PolarHBondContact O-OG1 2.88Å |
| 440 | C | 95.6 | Very high | 93.9 | Very high | 5 Ų | 5 | 15 Ų | 15 | 3% | 0.034 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -67.9 | -47.9 | 170 | -171.1 | 0 | 0 | 0 | 0 | 112 | F388 L436 C437 D438 M444 | F388-C440 HydrophobicContact CB-CB 4.01Å; F388-C440 HydrophobicContact CD1-CB 4.34Å; F388-C440 HydrophobicContact CD2-CB 3.49Å; F388-C440 VanDerWaalsContact CD2-CB 3.49Å; F388-C440 HydrophobicContact CE2-CB 4Å; F388-C440 HydrophobicContact CG-CB 3.69Å; L436-C440 PolarHBondContact O-N 3.35Å; C437-C440 WeakPolarHBondContact O-CA 3.37Å; C437-C440 WeakPolarHBondContact O-CB 3.43Å; C437-C440 PolarHBondContact O-N 3.4Å; D438-C440 VanDerWaalsContact C-N 3.26Å; D438-C440 PolarHBondContact O-N 3.12Å; C440-M444 WeakPolarHBondContact O-CB 3.39Å; C440-M444 VanDerWaalsContact O-CG 3.27Å; C440-M444 WeakPolarHBondContact O-CG 3.49Å; C440-M444 PolarHBondContact O-N 3.47Å; C440-M444 VanDerWaalsContact O-N 3.14Å |
| 441 | F | 94.1 | Very high | 93.6 | Very high | 3 Ų | 3 | 18.4 Ų | 18.4 | 1% | 0.013 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -58.5 | -59.5 | -178.1 | 160 | -132.1 | 0 | 0 | 0 | 112.1 | V342 V346 Y349 Q404 F408 C437 D438 T443 M444 M445 M469 | V342-F441 HydrophobicContact CG1-CE2 3.84Å; V342-F441 HydrophobicContact CG1-CZ 4.07Å; V346-F441 HydrophobicContact CG1-CE1 3.84Å; V346-F441 HydrophobicContact CG1-CZ 3.62Å; Y349-F441 HydrophobicContact CD2-CD1 4.27Å; Y349-F441 HydrophobicContact CD2-CE1 4.36Å; Y349-F441 HydrophobicContact CE2-CD1 4.14Å; Y349-F441 HydrophobicContact CE2-CE1 4.39Å; Q404-F441 HydrophobicContact CG-CD2 4.28Å; F408-F441 HydrophobicContact CE1-CB 4.22Å; F408-F441 HydrophobicContact CE1-CD1 4.01Å; F408-F441 AromaticContact CE1-CD2 3.51Å; F408-F441 HydrophobicContact CE1-CD2 3.51Å; F408-F441 HydrophobicContact CE1-CE1 4.26Å; F408-F441 AromaticContact CE1-CE2 3.83Å; F408-F441 HydrophobicContact CE1-CE2 3.83Å; F408-F441 AromaticContact CE1-CG 3.62Å; F408-F441 HydrophobicContact CE1-CG 3.62Å; F408-F441 HydrophobicContact CE1-CZ 4.18Å; F408-F441 AromaticContact CZ-CD2 3.46Å; F408-F441 HydrophobicContact CZ-CD2 3.46Å; F408-F441 VanDerWaalsContact CZ-CD2 3.46Å; F408-F441 AromaticContact CZ-CE2 3.5Å; F408-F441 HydrophobicContact CZ-CE2 3.5Å; F408-F441 VanDerWaalsContact CZ-CE2 3.5Å; F408-F441 HydrophobicContact CZ-CG 4.09Å; F408-F441 HydrophobicContact CZ-CZ 4.11Å; C437-F441 PolarHBondContact O-N 3.07Å; D438-F441 PolarHBondContact O-N 2.98Å; F441-T443 VanDerWaalsContact C-N 3.3Å; F441-T443 PolarHBondContact O-N 2.91Å; F441-M444 PolarHBondContact O-N 3.17Å; F441-M445 PolarHBondContact O-N 3.1Å; F441-M469 HydrophobicContact CZ-CE 4.03Å |
| 442 | L | 92.3 | Very high | 93.5 | Very high | 42 Ų | 42 | 19 Ų | 19 | 22% | 0.22 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -66.1 | -33.8 | -173.7 | -68.6 | 178.5 | 0 | 0 | 0 | 112.3 | D438 | D438-L442 PolarHBondContact O-N 3.16Å; D438-L442 WeakPolarHBondContact OD1-CD1 3.31Å; D438-L442 VanDerWaalsContact OD1-CG 3.32Å; D438-L442 WeakPolarHBondContact OD1-CG 3.13Å |
| 443 | T | 94.1 | Very high | 93.2 | Very high | 0 Ų | 0 | 17.4 Ų | 17.4 | 0% | 0 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -71.8 | -35.7 | 178.8 | -55.1 | 0 | 0 | 0 | 0 | 112.7 | G229 N232 G233 T236 R385 G389 G439 F441 P447 | G229-T443 VanDerWaalsContact O-CG2 3.28Å; G229-T443 WeakPolarHBondContact O-CG2 3.45Å; N232-T443 PolarHBondContact ND2-O 3.14Å; G233-T443 VanDerWaalsContact CA-CG2 3.43Å; T236-T443 PolarHBondContact OG1-OG1 3.45Å; R385-T443 WeakPolarHBondContact CA-OG1 3.26Å; R385-T443 WeakPolarHBondContact CB-OG1 3.49Å; R385-T443 WeakPolarHBondContact CG-OG1 3.3Å; G389-T443 VanDerWaalsContact CA-CG2 3.47Å; G439-T443 VanDerWaalsContact O-CB 3.25Å; G439-T443 WeakPolarHBondContact O-CB 3.25Å; G439-T443 PolarHBondContact O-N 3.19Å; G439-T443 PolarHBondContact O-OG1 2.88Å; F441-T443 VanDerWaalsContact C-N 3.3Å; F441-T443 PolarHBondContact O-N 2.91Å; T443-P447 WeakPolarHBondContact O-CD 3.2Å; T443-P447 WeakPolarHBondContact O-CG 3.38Å |
| 444 | M | 92.2 | Very high | 92.7 | Very high | 0 Ų | 0 | 13.8 Ų | 13.8 | 0% | 0 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -79 | -18.8 | 179.3 | -67.9 | -61.8 | 98 | 0 | 0 | 113.5 | F388 M403 C440 F441 A446 P447 I448 | F388-M444 VanDerWaalsContact O-CE 3.26Å; F388-M444 WeakPolarHBondContact O-CE 3.11Å; M403-M444 HydrophobicContact CB-CG 4.48Å; M403-M444 HydrophobicContact CE-CG 4.38Å; M403-M444 HydrophobicContact CE-SD 4.03Å; M403-M444 HydrophobicContact SD-SD 3.88Å; C440-M444 WeakPolarHBondContact O-CB 3.39Å; C440-M444 VanDerWaalsContact O-CG 3.27Å; C440-M444 WeakPolarHBondContact O-CG 3.49Å; C440-M444 PolarHBondContact O-N 3.47Å; C440-M444 VanDerWaalsContact O-N 3.14Å; F441-M444 PolarHBondContact O-N 3.17Å; M444-A446 PolarHBondContact O-N 3.09Å; M444-P447 WeakPolarHBondContact O-CD 3.24Å; M444-I448 HydrophobicContact CB-CD1 3.82Å; M444-I448 HydrophobicContact CB-CG1 4.49Å; M444-I448 WeakPolarHBondContact O-CB 3.5Å; M444-I448 VanDerWaalsContact O-CG1 3.26Å; M444-I448 WeakPolarHBondContact O-CG1 3.46Å; M444-I448 PolarHBondContact O-N 3.42Å |
| 445 | M | 91.4 | Very high | 92.1 | Very high | 9 Ų | 9 | 16.7 Ų | 16.7 | 4% | 0.044 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -53.7 | -56 | -176.8 | -170.3 | -162.7 | 128.3 | 0 | 0 | 113.4 | W338 F441 A449 I462 L465 L466 M469 | W338-M445 HydrophobicContact CH2-CG 4.38Å; W338-M445 VanDerWaalsContact CH2-O 3.27Å; W338-M445 WeakPolarHBondContact CH2-O 3.48Å; W338-M445 HydrophobicContact CZ2-CG 4.48Å; F441-M445 PolarHBondContact O-N 3.1Å; M445-A449 PolarHBondContact O-N 3.17Å; M445-A449 VanDerWaalsContact O-N 3.16Å; M445-I462 HydrophobicContact CE-CG2 4.28Å; M445-L465 HydrophobicContact CE-CB 4.44Å; M445-L465 HydrophobicContact CE-CD2 3.67Å; M445-L465 HydrophobicContact CE-CG 4Å; M445-L465 HydrophobicContact CG-CD2 3.57Å; M445-L465 HydrophobicContact SD-CD2 4.01Å; M445-L466 HydrophobicContact CE-CD2 3.64Å; M445-L466 HydrophobicContact CE-CG 3.79Å; M445-L466 HydrophobicContact SD-CD2 4.32Å; M445-M469 HydrophobicContact SD-CE 4.36Å; M445-M469 HydrophobicContact SD-SD 4.06Å |
| 446 | A | 90.8 | Very high | 91.4 | Very high | 4 Ų | 4 | 20.7 Ų | 20.7 | 3% | 0.033 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -68.2 | -48.9 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | M444 I448 A449 F450 I462 | M444-A446 PolarHBondContact O-N 3.09Å; A446-I448 VanDerWaalsContact C-N 3.29Å; A446-I448 PolarHBondContact O-N 2.93Å; A446-A449 WeakPolarHBondContact O-CB 3.44Å; A446-A449 PolarHBondContact O-N 2.57Å; A446-A449 VanDerWaalsContact O-N 3.08Å; A446-F450 WeakPolarHBondContact O-CD2 3.43Å; A446-F450 PolarHBondContact O-N 2.69Å; A446-I462 HydrophobicContact CB-CD1 4.11Å |
| 447 | P | 92 | Very high | 90.8 | Very high | 3 Ų | 3 | 19.9 Ų | 19.9 | 2% | 0.019 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -51.7 | -42.4 | 173.8 | -28.3 | 34.1 | 0 | 0 | 0 | 114.1 | L228 T443 M444 F450 E451 | L228-P447 HydrophobicContact CG-CG 4.4Å; T443-P447 WeakPolarHBondContact O-CD 3.2Å; T443-P447 WeakPolarHBondContact O-CG 3.38Å; M444-P447 WeakPolarHBondContact O-CD 3.24Å; P447-F450 PolarHBondContact O-N 3.01Å; P447-E451 VanDerWaalsContact O-CG 3.24Å; P447-E451 WeakPolarHBondContact O-CG 3.35Å; P447-E451 PolarHBondContact O-N 3.48Å |
| 448 | I | 93.9 | Very high | 90.4 | Very high | 1 Ų | 1 | 19.1 Ų | 19.1 | 1% | 0.005 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -68.2 | -37.6 | 178.5 | -68.6 | 167.3 | 0 | 0 | 0 | 111.4 | W338 K400 I401 Q404 M444 A446 E451 L452 | W338-I448 HydrophobicContact CD2-CG2 4.01Å; W338-I448 VanDerWaalsContact CE2-CG2 3.4Å; W338-I448 HydrophobicContact CG-CG2 4.43Å; W338-I448 HydrophobicContact CH2-CB 4.39Å; W338-I448 HydrophobicContact CH2-CG2 4.2Å; W338-I448 HydrophobicContact CZ2-CB 3.78Å; W338-I448 HydrophobicContact CZ2-CG2 3.53Å; K400-I448 HydrophobicContact CB-CD1 4.4Å; K400-I448 HydrophobicContact CB-CG1 4Å; I401-I448 HydrophobicContact CD1-CG2 4.11Å; I401-I448 HydrophobicContact CG1-CD1 4.06Å; I401-I448 HydrophobicContact CG1-CG1 4.23Å; I401-I448 HydrophobicContact CG1-CG2 3.77Å; Q404-I448 HydrophobicContact CB-CD1 4.22Å; Q404-I448 VanDerWaalsContact OE1-CD1 3.3Å; M444-I448 HydrophobicContact CB-CD1 3.82Å; M444-I448 HydrophobicContact CB-CG1 4.49Å; M444-I448 WeakPolarHBondContact O-CB 3.5Å; M444-I448 VanDerWaalsContact O-CG1 3.26Å; M444-I448 WeakPolarHBondContact O-CG1 3.46Å; M444-I448 PolarHBondContact O-N 3.42Å; A446-I448 VanDerWaalsContact C-N 3.29Å; A446-I448 PolarHBondContact O-N 2.93Å; I448-E451 PolarHBondContact O-N 3.41Å; I448-L452 HydrophobicContact CG2-CD1 3.55Å; I448-L452 HydrophobicContact CG2-CG 4.11Å; I448-L452 WeakPolarHBondContact O-CB 3.23Å; I448-L452 VanDerWaalsContact O-CG 3.3Å; I448-L452 WeakPolarHBondContact O-CG 3.26Å; I448-L452 PolarHBondContact O-N 3.49Å |
| 449 | A | 92.6 | Very high | 90.2 | Very high | 0 Ų | 0 | 19.2 Ų | 19.2 | 0% | 0 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -60.4 | -45.5 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | W338 M445 A446 E451 L452 V453 A461 I462 | W338-A449 HydrophobicContact CH2-CB 3.89Å; W338-A449 HydrophobicContact CZ3-CB 3.98Å; M445-A449 PolarHBondContact O-N 3.17Å; M445-A449 VanDerWaalsContact O-N 3.16Å; A446-A449 WeakPolarHBondContact O-CB 3.44Å; A446-A449 PolarHBondContact O-N 2.57Å; A446-A449 VanDerWaalsContact O-N 3.08Å; A449-E451 VanDerWaalsContact C-N 3.33Å; A449-E451 PolarHBondContact O-N 2.89Å; A449-L452 PolarHBondContact O-N 2.98Å; A449-V453 WeakPolarHBondContact O-CG2 3.39Å; A449-V453 PolarHBondContact O-N 3.42Å; A449-V453 VanDerWaalsContact O-N 3.1Å; A449-A461 HydrophobicContact CB-CB 4.33Å; A449-I462 HydrophobicContact CB-CG1 3.93Å |
| 450 | F | 90.9 | Very high | 90.1 | Very high | 18 Ų | 18 | 20 Ų | 20 | 8% | 0.079 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -60.9 | -38.1 | 176.5 | -86.8 | -84.9 | 0 | 0 | 0 | 112.9 | L228 A446 P447 G454 P455 A458 I462 | L228-F450 HydrophobicContact CD2-CB 3.99Å; L228-F450 HydrophobicContact CD2-CD1 4.47Å; L228-F450 HydrophobicContact CD2-CD2 3.79Å; L228-F450 HydrophobicContact CD2-CE2 4.42Å; L228-F450 HydrophobicContact CD2-CG 3.84Å; A446-F450 WeakPolarHBondContact O-CD2 3.43Å; A446-F450 PolarHBondContact O-N 2.69Å; P447-F450 PolarHBondContact O-N 3.01Å; F450-G454 WeakPolarHBondContact O-CA 3.45Å; F450-G454 PolarHBondContact O-N 3.11Å; F450-P455 HydrophobicContact CD1-CB 4.02Å; F450-P455 HydrophobicContact CE1-CB 4.01Å; F450-A458 HydrophobicContact CD1-CB 3.45Å; F450-A458 VanDerWaalsContact CD1-CB 3.45Å; F450-A458 HydrophobicContact CD2-CB 3.91Å; F450-A458 HydrophobicContact CE1-CB 3.34Å; F450-A458 HydrophobicContact CE2-CB 3.82Å; F450-A458 HydrophobicContact CG-CB 3.72Å; F450-A458 HydrophobicContact CZ-CB 3.53Å; F450-I462 HydrophobicContact CD2-CD1 4.38Å; F450-I462 HydrophobicContact CE2-CD1 3.89Å |
| 451 | E | 90.9 | Very high | 89.9 | Confident | 82 Ų | 82 | 19.8 Ų | 19.8 | 38% | 0.383 | 11% | 0.109 | S | C | . | . | H | α-helix | trans | -73 | -32.8 | 175.8 | -64.8 | -88.5 | -162.5 | 0 | 0 | 112.9 | L398 K400 P447 I448 A449 | L398-E451 HydrophobicContact CD2-CB 3.82Å; K400-E451 HydrophobicContact CD-CG 4.38Å; K400-E451 WeakPolarHBondContact CE-OE1 3.35Å; K400-E451 IonicContact NZ-OE1 2.67Å; K400-E451 PolarHBondContact NZ-OE1 2.98Å; P447-E451 VanDerWaalsContact O-CG 3.24Å; P447-E451 WeakPolarHBondContact O-CG 3.35Å; P447-E451 PolarHBondContact O-N 3.48Å; I448-E451 PolarHBondContact O-N 3.41Å; A449-E451 VanDerWaalsContact C-N 3.33Å; A449-E451 PolarHBondContact O-N 2.89Å |
| 452 | L | 91 | Very high | 89.9 | Confident | 12 Ų | 12 | 19.6 Ų | 19.6 | 6% | 0.063 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -80.3 | -33.1 | -176.6 | -79.1 | 170.8 | 0 | 0 | 0 | 114.5 | W338 L398 I401 I448 A449 V511 | W338-L452 HydrophobicContact CB-CD1 3.85Å; W338-L452 HydrophobicContact CD2-CD1 3.54Å; W338-L452 HydrophobicContact CE3-CD1 3.56Å; W338-L452 HydrophobicContact CG-CD1 3.67Å; W338-L452 HydrophobicContact CZ3-CD1 4.25Å; L398-L452 HydrophobicContact CD1-CD2 4.05Å; L398-L452 HydrophobicContact CD2-CD2 3.61Å; L398-L452 HydrophobicContact CD2-CG 3.82Å; I401-L452 HydrophobicContact CD1-CD2 4.4Å; I448-L452 HydrophobicContact CG2-CD1 3.55Å; I448-L452 HydrophobicContact CG2-CG 4.11Å; I448-L452 WeakPolarHBondContact O-CB 3.23Å; I448-L452 VanDerWaalsContact O-CG 3.3Å; I448-L452 WeakPolarHBondContact O-CG 3.26Å; I448-L452 PolarHBondContact O-N 3.49Å; A449-L452 PolarHBondContact O-N 2.98Å; L452-V511 HydrophobicContact CD2-CG1 4.18Å |
| 453 | V | 89.5 | Confident | 89.9 | Confident | 18 Ų | 18 | 17.6 Ų | 17.6 | 11% | 0.109 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -125.1 | -5.5 | -175.4 | -48.7 | 0 | 0 | 0 | 0 | 114.7 | V329 I332 Y335 A449 Q457 A461 | V329-V453 HydrophobicContact CG1-CG1 4.48Å; I332-V453 HydrophobicContact CD1-CB 3.84Å; I332-V453 HydrophobicContact CD1-CG1 3.71Å; Y335-V453 HydrophobicContact CD2-CG1 3.89Å; Y335-V453 HydrophobicContact CG-CG1 3.9Å; A449-V453 WeakPolarHBondContact O-CG2 3.39Å; A449-V453 PolarHBondContact O-N 3.42Å; A449-V453 VanDerWaalsContact O-N 3.1Å; V453-Q457 HydrophobicContact CB-CB 3.97Å; V453-Q457 VanDerWaalsContact CG2-C 3.46Å; V453-Q457 HydrophobicContact CG2-CB 3.67Å; V453-A461 HydrophobicContact CB-CB 4.5Å; V453-A461 HydrophobicContact CG1-CB 4.13Å; V453-A461 HydrophobicContact CG2-CB 3.56Å |
| 454 | G | 85.9 | Confident | 89.9 | Confident | 23 Ų | 23 | 18.3 Ų | 18.3 | 24% | 0.237 | 10% | 0.1 | C | C | . | . | trans | 76.1 | 162.4 | -175.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | F450 M456 Q457 A458 | F450-G454 WeakPolarHBondContact O-CA 3.45Å; F450-G454 PolarHBondContact O-N 3.11Å; G454-M456 PolarHBondContact O-N 2.71Å; G454-M456 VanDerWaalsContact O-N 3.1Å; G454-Q457 PolarHBondContact O-N 3.23Å; G454-Q457 VanDerWaalsContact O-N 3.13Å; G454-A458 PolarHBondContact O-N 2.88Å; G454-A458 VanDerWaalsContact O-N 3.09Å | ||
| 455 | P | 81.4 | Confident | 90.1 | Very high | 63 Ų | 63 | 18.3 Ų | 18.3 | 41% | 0.409 | 10% | 0.1 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -64.1 | -21.8 | -172.2 | 25.7 | -35.3 | 0 | 0 | 0 | 114.2 | L284 F450 Q457 | L284-P455 HydrophobicContact CD1-CB 3.93Å; F450-P455 HydrophobicContact CD1-CB 4.02Å; F450-P455 HydrophobicContact CE1-CB 4.01Å; P455-Q457 VanDerWaalsContact C-N 3.35Å |
| 456 | M | 80.1 | Confident | 90.2 | Very high | 84 Ų | 84 | 18 Ų | 18 | 41% | 0.414 | 10% | 0.099 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -76.2 | -18 | 178.9 | -61.4 | -83.4 | 77.2 | 0 | 0 | 114.1 | L284 M290 G454 | L284-M456 HydrophobicContact CB-CE 3.88Å; L284-M456 HydrophobicContact CD1-CE 4.05Å; L284-M456 HydrophobicContact CD2-CE 4.06Å; L284-M456 HydrophobicContact CG-CE 4.23Å; M290-M456 HydrophobicContact CE-CG 3.85Å; M290-M456 HydrophobicContact CE-SD 3.32Å; M290-M456 WeakPolarHBondContact CE-SD 3.34Å; G454-M456 PolarHBondContact O-N 2.71Å; G454-M456 VanDerWaalsContact O-N 3.1Å |
| 457 | Q | 84.6 | Confident | 90.3 | Very high | 32 Ų | 32 | 18.3 Ų | 18.3 | 15% | 0.15 | 10% | 0.103 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -121.1 | -6.2 | 179.6 | -65.7 | -178.7 | 26.2 | 0 | 0 | 112.8 | V329 V453 G454 P455 S459 Q460 A461 | V329-Q457 HydrophobicContact CG2-CB 4.11Å; V453-Q457 HydrophobicContact CB-CB 3.97Å; V453-Q457 VanDerWaalsContact CG2-C 3.46Å; V453-Q457 HydrophobicContact CG2-CB 3.67Å; G454-Q457 PolarHBondContact O-N 3.23Å; G454-Q457 VanDerWaalsContact O-N 3.13Å; P455-Q457 VanDerWaalsContact C-N 3.35Å; Q457-S459 PolarHBondContact O-N 3.1Å; Q457-Q460 PolarHBondContact O-N 2.81Å; Q457-Q460 VanDerWaalsContact O-N 3.1Å; Q457-A461 PolarHBondContact O-N 3.44Å |
| 458 | A | 87.2 | Confident | 90.4 | Very high | 0 Ų | 0 | 20.5 Ų | 20.5 | 0% | 0 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -55.6 | -34.5 | -178 | 0 | 0 | 0 | 0 | 0 | 113.4 | F450 G454 A461 I462 | F450-A458 HydrophobicContact CD1-CB 3.45Å; F450-A458 VanDerWaalsContact CD1-CB 3.45Å; F450-A458 HydrophobicContact CD2-CB 3.91Å; F450-A458 HydrophobicContact CE1-CB 3.34Å; F450-A458 HydrophobicContact CE2-CB 3.82Å; F450-A458 HydrophobicContact CG-CB 3.72Å; F450-A458 HydrophobicContact CZ-CB 3.53Å; G454-A458 PolarHBondContact O-N 2.88Å; G454-A458 VanDerWaalsContact O-N 3.09Å; A458-A461 PolarHBondContact O-N 3.11Å; A458-I462 WeakPolarHBondContact O-CB 3.33Å; A458-I462 WeakPolarHBondContact O-CD1 3.48Å; A458-I462 VanDerWaalsContact O-CG1 3.26Å; A458-I462 WeakPolarHBondContact O-CG1 3.46Å; A458-I462 PolarHBondContact O-N 3.31Å |
| 459 | S | 90 | Very high | 90.3 | Very high | 5 Ų | 5 | 20.6 Ų | 20.6 | 4% | 0.035 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -55.9 | -53.4 | 173.7 | 173.9 | 0 | 0 | 0 | 0 | 112.7 | D166 Q214 Q457 I462 G463 | D166-S459 WeakPolarHBondContact OD1-CB 3.32Å; D166-S459 PolarHBondContact OD1-OG 3.33Å; Q214-S459 PolarHBondContact NE2-O 3.36Å; Q457-S459 PolarHBondContact O-N 3.1Å; S459-I462 PolarHBondContact O-N 2.95Å; S459-G463 PolarHBondContact O-N 3.38Å |
| 460 | Q | 90.6 | Very high | 90.3 | Very high | 16 Ų | 16 | 20.9 Ų | 20.9 | 8% | 0.075 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -67.7 | -39.8 | 177.6 | -61.8 | -175.1 | 6.4 | 0 | 0 | 111.9 | D166 N326 V329 Q457 G463 Y464 | D166-Q460 WeakPolarHBondContact OD2-CG 3.48Å; D166-Q460 PolarHBondContact OD2-NE2 3.28Å; N326-Q460 PolarHBondContact O-OE1 3.28Å; V329-Q460 HydrophobicContact CG2-CB 3.87Å; Q457-Q460 PolarHBondContact O-N 2.81Å; Q457-Q460 VanDerWaalsContact O-N 3.1Å; Q460-G463 PolarHBondContact O-N 3.01Å; Q460-Y464 HydrophobicContact CB-CD2 4.16Å; Q460-Y464 HydrophobicContact CB-CE2 3.95Å; Q460-Y464 VanDerWaalsContact O-CB 3.31Å; Q460-Y464 WeakPolarHBondContact O-CB 3.33Å; Q460-Y464 WeakPolarHBondContact O-CD2 3.32Å; Q460-Y464 VanDerWaalsContact O-CG 3.31Å; Q460-Y464 PolarHBondContact O-N 2.83Å |
| 461 | A | 92.6 | Very high | 90.2 | Very high | 0 Ų | 0 | 25.8 Ų | 25.8 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -62.7 | -42.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | V329 Y335 A449 V453 Q457 A458 L465 | V329-A461 HydrophobicContact CG1-CB 4.05Å; Y335-A461 HydrophobicContact CD2-CB 3.93Å; Y335-A461 HydrophobicContact CE2-CB 3.5Å; Y335-A461 PolarHBondContact OH-O 2.92Å; A449-A461 HydrophobicContact CB-CB 4.33Å; V453-A461 HydrophobicContact CB-CB 4.5Å; V453-A461 HydrophobicContact CG1-CB 4.13Å; V453-A461 HydrophobicContact CG2-CB 3.56Å; Q457-A461 PolarHBondContact O-N 3.44Å; A458-A461 PolarHBondContact O-N 3.11Å; A461-L465 WeakPolarHBondContact O-CB 3.19Å; A461-L465 PolarHBondContact O-N 3.48Å |
| 462 | I | 92.9 | Very high | 90.3 | Very high | 0 Ų | 0 | 23.1 Ų | 23.1 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -66.4 | -46 | 174.3 | -70.8 | 162.8 | 0 | 0 | 0 | 110.1 | Q214 L217 V218 M445 A446 A449 F450 A458 S459 L465 L466 | Q214-I462 HydrophobicContact CG-CG2 4.29Å; L217-I462 HydrophobicContact CD1-CG2 4.28Å; V218-I462 HydrophobicContact CG2-CD1 4.32Å; M445-I462 HydrophobicContact CE-CG2 4.28Å; A446-I462 HydrophobicContact CB-CD1 4.11Å; A449-I462 HydrophobicContact CB-CG1 3.93Å; F450-I462 HydrophobicContact CD2-CD1 4.38Å; F450-I462 HydrophobicContact CE2-CD1 3.89Å; A458-I462 WeakPolarHBondContact O-CB 3.33Å; A458-I462 WeakPolarHBondContact O-CD1 3.48Å; A458-I462 VanDerWaalsContact O-CG1 3.26Å; A458-I462 WeakPolarHBondContact O-CG1 3.46Å; A458-I462 PolarHBondContact O-N 3.31Å; S459-I462 PolarHBondContact O-N 2.95Å; I462-L465 PolarHBondContact O-N 3.3Å; I462-L466 HydrophobicContact CG2-CD1 3.71Å; I462-L466 HydrophobicContact CG2-CG 4.29Å; I462-L466 WeakPolarHBondContact O-CB 3.43Å; I462-L466 VanDerWaalsContact O-CG 3.26Å; I462-L466 WeakPolarHBondContact O-CG 3.4Å; I462-L466 PolarHBondContact O-N 2.82Å |
| 463 | G | 93.6 | Very high | 90.1 | Very high | 0 Ų | 0 | 23.4 Ų | 23.4 | 0% | 0 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -64.1 | -45.6 | -178.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | S158 P159 S459 Q460 G467 | S158-G463 CarbonylContact C-O 3.6Å; S158-G463 WeakPolarHBondContact CB-O 3.34Å; P159-G463 VanDerWaalsContact CD-O 3.28Å; P159-G463 WeakPolarHBondContact CD-O 3.39Å; P159-G463 WeakPolarHBondContact CG-O 3.41Å; S459-G463 PolarHBondContact O-N 3.38Å; Q460-G463 PolarHBondContact O-N 3.01Å; G463-G467 PolarHBondContact O-N 3.01Å |
| 464 | Y | 94.3 | Very high | 89.9 | Confident | 14 Ų | 14 | 26.3 Ų | 26.3 | 6% | 0.055 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -65.3 | -36.8 | 174.9 | -69.2 | -42.6 | 0 | 0 | 0 | 112.2 | P159 V329 F330 Q460 L468 | P159-Y464 HydrophobicContact CB-CD1 3.9Å; P159-Y464 HydrophobicContact CB-CE1 4.14Å; P159-Y464 HydrophobicContact CG-CD1 4.4Å; V329-Y464 HydrophobicContact CB-CD2 4.32Å; V329-Y464 HydrophobicContact CB-CE2 4.46Å; V329-Y464 HydrophobicContact CG1-CD2 4.26Å; F330-Y464 HydrophobicContact CD2-CD2 4.31Å; F330-Y464 HydrophobicContact CE2-CD1 4.17Å; F330-Y464 AromaticContact CE2-CD2 3.68Å; F330-Y464 HydrophobicContact CE2-CD2 3.68Å; F330-Y464 HydrophobicContact CE2-CE2 4.22Å; F330-Y464 AromaticContact CE2-CG 3.67Å; F330-Y464 HydrophobicContact CE2-CG 3.67Å; F330-Y464 HydrophobicContact CZ-CD2 4.48Å; F330-Y464 HydrophobicContact CZ-CG 4.17Å; Q460-Y464 HydrophobicContact CB-CD2 4.16Å; Q460-Y464 HydrophobicContact CB-CE2 3.95Å; Q460-Y464 VanDerWaalsContact O-CB 3.31Å; Q460-Y464 WeakPolarHBondContact O-CB 3.33Å; Q460-Y464 WeakPolarHBondContact O-CD2 3.32Å; Q460-Y464 VanDerWaalsContact O-CG 3.31Å; Q460-Y464 PolarHBondContact O-N 2.83Å; Y464-L468 WeakPolarHBondContact O-CB 3.29Å; Y464-L468 VanDerWaalsContact O-CG 3.29Å; Y464-L468 WeakPolarHBondContact O-CG 3.5Å; Y464-L468 PolarHBondContact O-N 3.42Å |
| 465 | L | 95 | Very high | 90 | Very high | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -65.9 | -49.9 | 175.2 | 175.9 | 56.9 | 0 | 0 | 0 | 112.1 | Y335 W338 A339 V342 M445 A461 I462 G467 L468 M469 | Y335-L465 PolarHBondContact OH-N 2.95Å; W338-L465 HydrophobicContact CE3-CD2 4.38Å; W338-L465 HydrophobicContact CH2-CD2 3.3Å; W338-L465 HydrophobicContact CZ2-CD2 3.99Å; W338-L465 HydrophobicContact CZ3-CD2 3.54Å; A339-L465 HydrophobicContact CB-CD1 4.14Å; V342-L465 HydrophobicContact CB-CD1 3.94Å; V342-L465 HydrophobicContact CG1-CD1 3.85Å; M445-L465 HydrophobicContact CE-CB 4.44Å; M445-L465 HydrophobicContact CE-CD2 3.67Å; M445-L465 HydrophobicContact CE-CG 4Å; M445-L465 HydrophobicContact CG-CD2 3.57Å; M445-L465 HydrophobicContact SD-CD2 4.01Å; A461-L465 WeakPolarHBondContact O-CB 3.19Å; A461-L465 PolarHBondContact O-N 3.48Å; I462-L465 PolarHBondContact O-N 3.3Å; L465-G467 VanDerWaalsContact C-N 3.27Å; L465-G467 PolarHBondContact O-N 3.41Å; L465-L468 PolarHBondContact O-N 3.32Å; L465-L468 VanDerWaalsContact O-N 3.13Å; L465-M469 HydrophobicContact CD1-CG 4.02Å; L465-M469 HydrophobicContact CD1-SD 3.86Å; L465-M469 HydrophobicContact CD2-SD 4.44Å; L465-M469 HydrophobicContact CG-CG 4.45Å; L465-M469 HydrophobicContact CG-SD 3.76Å; L465-M469 WeakPolarHBondContact O-CB 3.34Å; L465-M469 VanDerWaalsContact O-CG 3.32Å; L465-M469 WeakPolarHBondContact O-CG 3.36Å; L465-M469 PolarHBondContact O-N 2.85Å |
| 466 | L | 93.5 | Very high | 90.4 | Very high | 4 Ų | 4 | 24.1 Ų | 24.1 | 2% | 0.021 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -57.6 | -41.5 | 176.6 | -69.7 | 170.3 | 0 | 0 | 0 | 111.2 | F155 S158 F213 M445 I462 M469 S470 | F155-L466 HydrophobicContact CD1-CB 4.22Å; F155-L466 HydrophobicContact CD1-CD2 3.66Å; F155-L466 HydrophobicContact CE1-CD2 3.68Å; S158-L466 WeakPolarHBondContact OG-CB 3.43Å; F213-L466 HydrophobicContact CE1-CD1 3.93Å; F213-L466 HydrophobicContact CE1-CD2 4.15Å; M445-L466 HydrophobicContact CE-CD2 3.64Å; M445-L466 HydrophobicContact CE-CG 3.79Å; M445-L466 HydrophobicContact SD-CD2 4.32Å; I462-L466 HydrophobicContact CG2-CD1 3.71Å; I462-L466 HydrophobicContact CG2-CG 4.29Å; I462-L466 WeakPolarHBondContact O-CB 3.43Å; I462-L466 VanDerWaalsContact O-CG 3.26Å; I462-L466 WeakPolarHBondContact O-CG 3.4Å; I462-L466 PolarHBondContact O-N 2.82Å; L466-M469 PolarHBondContact O-N 3.47Å; L466-S470 PolarHBondContact O-N 3.24Å; L466-S470 VanDerWaalsContact O-N 3.15Å |
| 467 | G | 93.9 | Very high | 90.8 | Very high | 10 Ų | 10 | 21 Ų | 21 | 10% | 0.103 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -61.3 | -46 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | F155 G463 L465 M469 S470 | F155-G467 WeakPolarHBondContact O-CA 3.24Å; G463-G467 PolarHBondContact O-N 3.01Å; L465-G467 VanDerWaalsContact C-N 3.27Å; L465-G467 PolarHBondContact O-N 3.41Å; G467-M469 VanDerWaalsContact C-N 3.31Å; G467-M469 PolarHBondContact O-N 2.87Å; G467-S470 WeakPolarHBondContact O-CB 3.45Å; G467-S470 PolarHBondContact O-N 3.1Å; G467-S470 PolarHBondContact O-OG 2.87Å |
| 468 | L | 94.1 | Very high | 91 | Very high | 48 Ų | 48 | 23.1 Ų | 23.1 | 25% | 0.251 | 14% | 0.139 | S | C | . | . | H | α-helix | trans | -64.8 | -33 | 176.4 | -75.8 | 170.1 | 0 | 0 | 0 | 112.9 | F330 A339 F340 A343 Y464 L465 S470 P472 | F330-L468 HydrophobicContact CE1-CD1 3.97Å; F330-L468 HydrophobicContact CZ-CD1 3.98Å; A339-L468 HydrophobicContact CB-CD1 4.23Å; F340-L468 HydrophobicContact CE1-CD2 4.14Å; F340-L468 HydrophobicContact CZ-CD2 4.34Å; A343-L468 HydrophobicContact CB-CB 4.17Å; Y464-L468 WeakPolarHBondContact O-CB 3.29Å; Y464-L468 VanDerWaalsContact O-CG 3.29Å; Y464-L468 WeakPolarHBondContact O-CG 3.5Å; Y464-L468 PolarHBondContact O-N 3.42Å; L465-L468 PolarHBondContact O-N 3.32Å; L465-L468 VanDerWaalsContact O-N 3.13Å; L468-S470 VanDerWaalsContact C-N 3.34Å; L468-P472 WeakPolarHBondContact O-CD 3.42Å |
| 469 | M | 92.6 | Very high | 91.1 | Very high | 4 Ų | 4 | 27.3 Ų | 27.3 | 2% | 0.02 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -70.8 | -26.3 | 175.8 | -73.4 | 168.5 | 49.5 | 0 | 0 | 113 | V342 V346 F441 M445 L465 L466 G467 L471 P472 M473 | V342-M469 HydrophobicContact CG1-CG 4.08Å; V342-M469 HydrophobicContact CG1-SD 3.82Å; V346-M469 HydrophobicContact CG1-CE 4.34Å; V346-M469 HydrophobicContact CG2-CB 4.03Å; V346-M469 HydrophobicContact CG2-CG 3.94Å; F441-M469 HydrophobicContact CZ-CE 4.03Å; M445-M469 HydrophobicContact SD-CE 4.36Å; M445-M469 HydrophobicContact SD-SD 4.06Å; L465-M469 HydrophobicContact CD1-CG 4.02Å; L465-M469 HydrophobicContact CD1-SD 3.86Å; L465-M469 HydrophobicContact CD2-SD 4.44Å; L465-M469 HydrophobicContact CG-CG 4.45Å; L465-M469 HydrophobicContact CG-SD 3.76Å; L465-M469 WeakPolarHBondContact O-CB 3.34Å; L465-M469 VanDerWaalsContact O-CG 3.32Å; L465-M469 WeakPolarHBondContact O-CG 3.36Å; L465-M469 PolarHBondContact O-N 2.85Å; L466-M469 PolarHBondContact O-N 3.47Å; G467-M469 VanDerWaalsContact C-N 3.31Å; G467-M469 PolarHBondContact O-N 2.87Å; M469-L471 PolarHBondContact O-N 3.45Å; M469-P472 WeakPolarHBondContact O-CD 3.33Å; M469-M473 HydrophobicContact CB-SD 3.9Å; M469-M473 HydrophobicContact CE-SD 3.94Å; M469-M473 VanDerWaalsContact O-CB 3.29Å; M469-M473 WeakPolarHBondContact O-CB 2.99Å; M469-M473 WeakPolarHBondContact O-CG 3.42Å; M469-M473 PolarHBondContact O-N 3.42Å; M469-M473 VanDerWaalsContact O-N 3.15Å |
| 470 | S | 91.3 | Very high | 91.1 | Very high | 5 Ų | 5 | 27.1 Ų | 27.1 | 4% | 0.035 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -58.4 | -49.1 | -175.6 | 69.3 | 0 | 0 | 0 | 0 | 113.5 | L466 G467 L468 M473 T474 | L466-S470 PolarHBondContact O-N 3.24Å; L466-S470 VanDerWaalsContact O-N 3.15Å; G467-S470 WeakPolarHBondContact O-CB 3.45Å; G467-S470 PolarHBondContact O-N 3.1Å; G467-S470 PolarHBondContact O-OG 2.87Å; L468-S470 VanDerWaalsContact C-N 3.34Å; S470-M473 PolarHBondContact O-N 3.24Å; S470-T474 PolarHBondContact O-N 2.8Å; S470-T474 PolarHBondContact O-OG1 2.91Å |
| 471 | L | 89.8 | Confident | 91 | Very high | 121 Ų | 121 | 27.1 Ų | 27.1 | 63% | 0.634 | 16% | 0.164 | S | C | * | . | H | α-helix | trans | -66.7 | -47.8 | -174.7 | -56.8 | 174 | 0 | 0 | 0 | 112.9 | M469 T474 A475 | M469-L471 PolarHBondContact O-N 3.45Å; L471-T474 PolarHBondContact O-N 2.74Å; L471-A475 WeakPolarHBondContact O-CB 3.33Å; L471-A475 PolarHBondContact O-N 3.35Å |
| 472 | P | 91.6 | Very high | 90.8 | Very high | 26 Ų | 26 | 32.8 Ų | 32.8 | 17% | 0.169 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -66.6 | -37 | 177.3 | -20.4 | 34.2 | 0 | 0 | 0 | 112.9 | A343 V346 L347 L468 M469 T474 A475 G476 | A343-P472 WeakPolarHBondContact O-CB 3.32Å; A343-P472 WeakPolarHBondContact O-CG 3.4Å; V346-P472 HydrophobicContact CG2-CB 4.28Å; L347-P472 HydrophobicContact CB-CB 3.89Å; L347-P472 HydrophobicContact CD1-CB 4.02Å; L468-P472 WeakPolarHBondContact O-CD 3.42Å; M469-P472 WeakPolarHBondContact O-CD 3.33Å; P472-T474 VanDerWaalsContact C-N 3.32Å; P472-T474 PolarHBondContact O-N 3.28Å; P472-A475 PolarHBondContact O-N 2.83Å; P472-G476 PolarHBondContact O-N 3.13Å |
| 473 | M | 87 | Confident | 90.8 | Very high | 19 Ų | 19 | 34.4 Ų | 34.4 | 9% | 0.094 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -62.4 | -37.5 | 175.3 | -72 | 174.5 | 20.4 | 0 | 0 | 112.3 | F155 V346 F350 M469 S470 P477 | F155-M473 HydrophobicContact CD1-CE 4.28Å; F155-M473 HydrophobicContact CD2-CE 3.67Å; F155-M473 HydrophobicContact CE1-CE 4.23Å; F155-M473 HydrophobicContact CE2-CE 3.62Å; F155-M473 HydrophobicContact CG-CE 4.03Å; F155-M473 HydrophobicContact CZ-CE 3.92Å; V346-M473 HydrophobicContact CB-CG 3.85Å; V346-M473 HydrophobicContact CB-SD 4.44Å; V346-M473 HydrophobicContact CG2-CG 3.76Å; V346-M473 HydrophobicContact CG2-SD 4.35Å; F350-M473 HydrophobicContact CD2-CB 3.87Å; F350-M473 HydrophobicContact CD2-CE 4.35Å; F350-M473 HydrophobicContact CD2-CG 3.74Å; F350-M473 HydrophobicContact CD2-SD 4.36Å; F350-M473 HydrophobicContact CE2-CB 4.16Å; F350-M473 HydrophobicContact CE2-CE 3.59Å; F350-M473 HydrophobicContact CE2-CG 3.87Å; F350-M473 HydrophobicContact CE2-SD 3.87Å; F350-M473 HydrophobicContact CZ-CE 4.31Å; M469-M473 HydrophobicContact CB-SD 3.9Å; M469-M473 HydrophobicContact CE-SD 3.94Å; M469-M473 VanDerWaalsContact O-CB 3.29Å; M469-M473 WeakPolarHBondContact O-CB 2.99Å; M469-M473 WeakPolarHBondContact O-CG 3.42Å; M469-M473 PolarHBondContact O-N 3.42Å; M469-M473 VanDerWaalsContact O-N 3.15Å; S470-M473 PolarHBondContact O-N 3.24Å; M473-P477 WeakPolarHBondContact O-CD 3.49Å |
| 474 | T | 85.9 | Confident | 90.7 | Very high | 78 Ų | 78 | 36 Ų | 36 | 48% | 0.479 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -74.5 | -33.5 | 174.8 | -56.1 | 0 | 0 | 0 | 0 | 112.7 | S470 L471 P472 P478 | S470-T474 PolarHBondContact O-N 2.8Å; S470-T474 PolarHBondContact O-OG1 2.91Å; L471-T474 PolarHBondContact O-N 2.74Å; P472-T474 VanDerWaalsContact C-N 3.32Å; P472-T474 PolarHBondContact O-N 3.28Å; T474-P478 WeakPolarHBondContact O-CD 3.09Å; T474-P478 WeakPolarHBondContact O-CG 3.39Å |
| 475 | A | 89 | Confident | 90.6 | Very high | 37 Ų | 37 | 41.3 Ų | 41.3 | 31% | 0.306 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -78.4 | -30.3 | -177.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | L347 L471 P472 P478 I479 | L347-A475 HydrophobicContact CD1-CB 4.16Å; L471-A475 WeakPolarHBondContact O-CB 3.33Å; L471-A475 PolarHBondContact O-N 3.35Å; P472-A475 PolarHBondContact O-N 2.83Å; A475-P478 WeakPolarHBondContact O-CD 3.15Å; A475-I479 HydrophobicContact CB-CD1 4.21Å; A475-I479 WeakPolarHBondContact O-CD1 3.29Å; A475-I479 VanDerWaalsContact O-CG1 3.25Å; A475-I479 WeakPolarHBondContact O-CG1 3.3Å; A475-I479 PolarHBondContact O-N 3.17Å |
| 476 | G | 88.9 | Confident | 90.5 | Very high | 4 Ų | 4 | 50.2 Ų | 50.2 | 4% | 0.041 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -54.8 | -60.5 | -174.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | L347 V351 P472 I479 A480 | L347-G476 VanDerWaalsContact O-CA 3.22Å; L347-G476 WeakPolarHBondContact O-CA 3.11Å; V351-G476 WeakPolarHBondContact CG2-O 3.42Å; P472-G476 PolarHBondContact O-N 3.13Å; G476-I479 PolarHBondContact O-N 3.45Å; G476-A480 PolarHBondContact O-N 3.22Å |
| 477 | P | 88.3 | Confident | 90.5 | Very high | 18 Ų | 18 | 55.1 Ų | 55.1 | 12% | 0.117 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -62.1 | -43.8 | -177.5 | -20.9 | 32.4 | 0 | 0 | 0 | 114.3 | F350 I354 H355 M473 I479 A480 G481 | F350-P477 HydrophobicContact CB-CG 4Å; I354-P477 HydrophobicContact CB-CB 4.13Å; I354-P477 HydrophobicContact CB-CG 4.36Å; I354-P477 HydrophobicContact CG1-CB 4.03Å; I354-P477 HydrophobicContact CG1-CG 3.8Å; I354-P477 HydrophobicContact CG2-CB 4.13Å; H355-P477 PolarHBondContact NE2-O 3.34Å; H355-P477 VanDerWaalsContact NE2-O 3.13Å; M473-P477 WeakPolarHBondContact O-CD 3.49Å; P477-I479 VanDerWaalsContact C-N 3.3Å; P477-I479 PolarHBondContact O-N 3.12Å; P477-A480 WeakPolarHBondContact O-CB 3.42Å; P477-A480 PolarHBondContact O-N 3.07Å; P477-A480 VanDerWaalsContact O-N 3.08Å; P477-G481 PolarHBondContact O-N 3.15Å |
| 478 | P | 88.4 | Confident | 90.4 | Very high | 76 Ų | 76 | 57.6 Ų | 57.6 | 49% | 0.494 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -57.3 | -38 | 172.5 | -27.8 | 36.4 | 0 | 0 | 0 | 114.2 | T474 A475 G481 L482 | T474-P478 WeakPolarHBondContact O-CD 3.09Å; T474-P478 WeakPolarHBondContact O-CG 3.39Å; A475-P478 WeakPolarHBondContact O-CD 3.15Å; P478-G481 PolarHBondContact O-N 3.33Å; P478-L482 WeakPolarHBondContact O-CG 3.36Å; P478-L482 PolarHBondContact O-N 3.3Å |
| 479 | I | 91.1 | Very high | 90.2 | Very high | 88 Ų | 88 | 58.3 Ų | 58.3 | 45% | 0.451 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -66.4 | -39.5 | 175 | -68 | 166.6 | 0 | 0 | 0 | 110.7 | L347 A475 G476 P477 L482 L483 | L347-I479 HydrophobicContact CD1-CD1 4.5Å; A475-I479 HydrophobicContact CB-CD1 4.21Å; A475-I479 WeakPolarHBondContact O-CD1 3.29Å; A475-I479 VanDerWaalsContact O-CG1 3.25Å; A475-I479 WeakPolarHBondContact O-CG1 3.3Å; A475-I479 PolarHBondContact O-N 3.17Å; G476-I479 PolarHBondContact O-N 3.45Å; P477-I479 VanDerWaalsContact C-N 3.3Å; P477-I479 PolarHBondContact O-N 3.12Å; I479-L482 PolarHBondContact O-N 3.25Å; I479-L483 HydrophobicContact CG2-CD1 4.22Å; I479-L483 VanDerWaalsContact O-CG 3.31Å; I479-L483 WeakPolarHBondContact O-CG 3.31Å; I479-L483 PolarHBondContact O-N 3.03Å |
| 480 | A | 89.2 | Confident | 90.2 | Very high | 2 Ų | 2 | 58.6 Ų | 58.6 | 2% | 0.017 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -66.9 | -37 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | V351 G476 P477 L483 H484 A493 | V351-A480 HydrophobicContact CB-CB 4.18Å; V351-A480 HydrophobicContact CG1-CB 3.36Å; V351-A480 HydrophobicContact CG2-CB 3.74Å; G476-A480 PolarHBondContact O-N 3.22Å; P477-A480 WeakPolarHBondContact O-CB 3.42Å; P477-A480 PolarHBondContact O-N 3.07Å; P477-A480 VanDerWaalsContact O-N 3.08Å; A480-L483 PolarHBondContact O-N 3.22Å; A480-H484 PolarHBondContact O-N 3.42Å; A480-A493 HydrophobicContact CB-CB 4.21Å |
| 481 | G | 87.6 | Confident | 90.3 | Very high | 15 Ų | 15 | 61.1 Ų | 61.1 | 16% | 0.155 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -60.8 | -50.3 | 170.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | P477 P478 L483 H484 D485 | P477-G481 PolarHBondContact O-N 3.15Å; P478-G481 PolarHBondContact O-N 3.33Å; G481-L483 PolarHBondContact O-N 2.67Å; G481-H484 CarbonylContact O-C 3.57Å; G481-H484 WeakPolarHBondContact O-CA 3.5Å; G481-H484 WeakPolarHBondContact O-CB 3.27Å; G481-H484 PolarHBondContact O-N 3.32Å; G481-D485 PolarHBondContact O-N 3.18Å |
| 482 | L | 89.9 | Confident | 90.5 | Very high | 119 Ų | 119 | 57.3 Ų | 57.3 | 62% | 0.623 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -62.5 | -27.7 | 177.6 | -70 | 168.2 | 0 | 0 | 0 | 113.5 | P478 I479 Y486 | P478-L482 WeakPolarHBondContact O-CG 3.36Å; P478-L482 PolarHBondContact O-N 3.3Å; I479-L482 PolarHBondContact O-N 3.25Å; L482-Y486 WeakPolarHBondContact O-CB 3.35Å; L482-Y486 PolarHBondContact O-N 3.36Å |
| 483 | L | 92.6 | Very high | 90.5 | Very high | 35 Ų | 35 | 56.2 Ų | 56.2 | 18% | 0.183 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -72.4 | -39.9 | 171.3 | -72.7 | 166.1 | 0 | 0 | 0 | 111.6 | I479 A480 G481 Y486 F487 V492 A493 L496 | I479-L483 HydrophobicContact CG2-CD1 4.22Å; I479-L483 VanDerWaalsContact O-CG 3.31Å; I479-L483 WeakPolarHBondContact O-CG 3.31Å; I479-L483 PolarHBondContact O-N 3.03Å; A480-L483 PolarHBondContact O-N 3.22Å; G481-L483 PolarHBondContact O-N 2.67Å; L483-Y486 PolarHBondContact O-N 3.02Å; L483-F487 HydrophobicContact CD2-CD2 4.29Å; L483-F487 HydrophobicContact CD2-CE2 3.92Å; L483-F487 WeakPolarHBondContact O-CB 3.39Å; L483-F487 WeakPolarHBondContact O-CD2 3.42Å; L483-F487 PolarHBondContact O-N 3.39Å; L483-V492 HydrophobicContact CD2-CG1 4.33Å; L483-A493 HydrophobicContact CB-CB 4.14Å; L483-L496 HydrophobicContact CD1-CB 4.49Å; L483-L496 HydrophobicContact CD1-CD1 3.89Å; L483-L496 HydrophobicContact CD2-CD1 4.16Å |
| 484 | H | 91.4 | Very high | 90.9 | Very high | 32 Ų | 32 | 55.3 Ų | 55.3 | 15% | 0.148 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -62.8 | -47.9 | 173.1 | 179.6 | -104.4 | 0 | 0 | 0 | 111.6 | E362 A480 G481 Y486 F487 G488 D489 Y490 | E362-H484 VanDerWaalsContact CD-NE2 3.26Å; E362-H484 IonicContact OE1-CE1 2.82Å; E362-H484 PolarHBondContact OE1-CE1 3.45Å; E362-H484 IonicContact OE1-NE2 3.7Å; E362-H484 PolarHBondContact OE1-NE2 3.48Å; E362-H484 IonicContact OE2-CD2 3.59Å; E362-H484 IonicContact OE2-CE1 3.21Å; E362-H484 IonicContact OE2-NE2 3Å; E362-H484 PolarHBondContact OE2-NE2 3.12Å; A480-H484 PolarHBondContact O-N 3.42Å; G481-H484 CarbonylContact O-C 3.57Å; G481-H484 WeakPolarHBondContact O-CA 3.5Å; G481-H484 WeakPolarHBondContact O-CB 3.27Å; G481-H484 PolarHBondContact O-N 3.32Å; H484-Y486 PolarHBondContact O-N 3.14Å; H484-F487 PolarHBondContact O-N 3.5Å; H484-G488 WeakPolarHBondContact O-CA 3.46Å; H484-G488 PolarHBondContact O-N 3.13Å; H484-D489 VanDerWaalsContact CD2-C 3.48Å; H484-Y490 HydrophobicContact CB-CD1 4.05Å; H484-Y490 HydrophobicContact CB-CE1 3.72Å; H484-Y490 AromaticContact CD2-CD1 3.82Å; H484-Y490 AromaticContact CD2-CD2 3.36Å; H484-Y490 WeakPolarHBondContact CD2-CD2 3.37Å; H484-Y490 AromaticContact CD2-CE1 3.71Å; H484-Y490 AromaticContact CD2-CE2 3.26Å; H484-Y490 WeakPolarHBondContact CD2-CE2 3.43Å; H484-Y490 AromaticContact CD2-CG 3.65Å; H484-Y490 AromaticContact CD2-CZ 3.43Å; H484-Y490 VanDerWaalsContact CD2-CZ 3.43Å; H484-Y490 AromaticContact CE1-CE2 3.88Å; H484-Y490 AromaticContact CE1-CZ 3.98Å; H484-Y490 AromaticContact CG-CE1 3.74Å; H484-Y490 AromaticContact CG-CE2 3.92Å; H484-Y490 AromaticContact CG-CZ 3.61Å; H484-Y490 AromaticContact ND1-CZ 3.94Å; H484-Y490 AromaticContact NE2-CD2 3.61Å; H484-Y490 AromaticContact NE2-CE2 3.23Å; H484-Y490 WeakPolarHBondContact NE2-CE2 3.48Å; H484-Y490 AromaticContact NE2-CZ 3.69Å |
| 485 | D | 92.3 | Very high | 91.3 | Very high | 126 Ų | 126 | 53.6 Ų | 53.6 | 67% | 0.674 | 30% | 0.303 | S | S | * | . | H | α-helix | trans | -56.4 | -33.1 | 176.2 | -67 | -38.6 | 0 | 0 | 0 | 112.8 | G481 | G481-D485 PolarHBondContact O-N 3.18Å |
| 486 | Y | 93.2 | Very high | 91.6 | Very high | 188 Ų | 188 | 56.1 Ų | 56.1 | 74% | 0.737 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -87.2 | -39.6 | -177.7 | -175.4 | -94.6 | 0 | 0 | 0 | 114 | L482 L483 H484 | L482-Y486 WeakPolarHBondContact O-CB 3.35Å; L482-Y486 PolarHBondContact O-N 3.36Å; L483-Y486 PolarHBondContact O-N 3.02Å; H484-Y486 PolarHBondContact O-N 3.14Å |
| 487 | F | 93.5 | Very high | 91.9 | Very high | 106 Ų | 106 | 56.2 Ų | 56.2 | 47% | 0.465 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -95.2 | -17.1 | -176.9 | -72.6 | -72 | 0 | 0 | 0 | 114.1 | L483 H484 D489 V492 | L483-F487 HydrophobicContact CD2-CD2 4.29Å; L483-F487 HydrophobicContact CD2-CE2 3.92Å; L483-F487 WeakPolarHBondContact O-CB 3.39Å; L483-F487 WeakPolarHBondContact O-CD2 3.42Å; L483-F487 PolarHBondContact O-N 3.39Å; H484-F487 PolarHBondContact O-N 3.5Å; F487-D489 PolarHBondContact O-N 3.1Å; F487-V492 HydrophobicContact CB-CG2 4.37Å; F487-V492 HydrophobicContact CD1-CG2 4.06Å; F487-V492 HydrophobicContact CD2-CB 3.76Å; F487-V492 HydrophobicContact CD2-CG1 3.9Å; F487-V492 HydrophobicContact CD2-CG2 3.81Å; F487-V492 HydrophobicContact CE1-CG2 4.31Å; F487-V492 HydrophobicContact CE2-CB 4.04Å; F487-V492 HydrophobicContact CE2-CG1 3.65Å; F487-V492 HydrophobicContact CE2-CG2 4.09Å; F487-V492 HydrophobicContact CG-CB 4.23Å; F487-V492 HydrophobicContact CG-CG2 3.81Å; F487-V492 HydrophobicContact CZ-CG1 4.27Å; F487-V492 HydrophobicContact CZ-CG2 4.33Å |
| 488 | G | 89.9 | Confident | 92.3 | Very high | 63 Ų | 63 | 55.3 Ų | 55.3 | 65% | 0.649 | 31% | 0.305 | S | S | * | . | S | Bend | trans | 74.9 | 6.8 | -175 | 0 | 0 | 0 | 0 | 0 | 114.5 | H484 | H484-G488 WeakPolarHBondContact O-CA 3.46Å; H484-G488 PolarHBondContact O-N 3.13Å |
| 489 | D | 91.8 | Very high | 92.7 | Very high | 62 Ų | 62 | 54.4 Ų | 54.4 | 33% | 0.332 | 30% | 0.298 | S | S | . | . | S | Bend | trans | -148.5 | 166.9 | 174.5 | 92.7 | -3.3 | 0 | 0 | 0 | 112.7 | H484 F487 T491 | H484-D489 VanDerWaalsContact CD2-C 3.48Å; F487-D489 PolarHBondContact O-N 3.1Å; D489-T491 VanDerWaalsContact CG-OG1 3.27Å; D489-T491 WeakPolarHBondContact OD1-CA 3.46Å; D489-T491 WeakPolarHBondContact OD1-CB 3.37Å; D489-T491 PolarHBondContact OD1-N 3.02Å; D489-T491 PolarHBondContact OD1-OG1 3.42Å; D489-T491 WeakPolarHBondContact OD2-CB 3.47Å; D489-T491 PolarHBondContact OD2-OG1 3.13Å |
| 490 | Y | 91.1 | Very high | 93 | Very high | 11 Ų | 11 | 51.1 Ų | 51.1 | 4% | 0.043 | 28% | 0.282 | C | S | . | . | S | Bend | trans | -89.2 | 2.8 | 176.3 | -74.4 | -73 | 0 | 0 | 0 | 114.2 | H355 N358 F359 E362 H484 V492 A493 F494 | H355-Y490 HydrophobicContact CB-CD1 4.02Å; H355-Y490 HydrophobicContact CB-CE1 3.63Å; H355-Y490 AromaticContact CG-CE1 3.7Å; H355-Y490 AromaticContact ND1-CE1 3.31Å; H355-Y490 VanDerWaalsContact ND1-CE1 3.31Å; H355-Y490 WeakPolarHBondContact ND1-CE1 3.47Å; H355-Y490 AromaticContact ND1-CZ 3.77Å; H355-Y490 PolarHBondContact ND1-OH 3.18Å; N358-Y490 HydrophobicContact CB-CE2 3.74Å; N358-Y490 WeakPolarHBondContact CB-OH 3.32Å; N358-Y490 PolarHBondContact ND2-OH 3.41Å; F359-Y490 HydrophobicContact CB-CD2 3.82Å; F359-Y490 HydrophobicContact CB-CG 4.19Å; E362-Y490 WeakPolarHBondContact OE1-CE2 3.25Å; E362-Y490 WeakPolarHBondContact OE2-CD2 3.43Å; E362-Y490 WeakPolarHBondContact OE2-CE2 3.19Å; H484-Y490 HydrophobicContact CB-CD1 4.05Å; H484-Y490 HydrophobicContact CB-CE1 3.72Å; H484-Y490 AromaticContact CD2-CD1 3.82Å; H484-Y490 AromaticContact CD2-CD2 3.36Å; H484-Y490 WeakPolarHBondContact CD2-CD2 3.37Å; H484-Y490 AromaticContact CD2-CE1 3.71Å; H484-Y490 AromaticContact CD2-CE2 3.26Å; H484-Y490 WeakPolarHBondContact CD2-CE2 3.43Å; H484-Y490 AromaticContact CD2-CG 3.65Å; H484-Y490 AromaticContact CD2-CZ 3.43Å; H484-Y490 VanDerWaalsContact CD2-CZ 3.43Å; H484-Y490 AromaticContact CE1-CE2 3.88Å; H484-Y490 AromaticContact CE1-CZ 3.98Å; H484-Y490 AromaticContact CG-CE1 3.74Å; H484-Y490 AromaticContact CG-CE2 3.92Å; H484-Y490 AromaticContact CG-CZ 3.61Å; H484-Y490 AromaticContact ND1-CZ 3.94Å; H484-Y490 AromaticContact NE2-CD2 3.61Å; H484-Y490 AromaticContact NE2-CE2 3.23Å; H484-Y490 WeakPolarHBondContact NE2-CE2 3.48Å; H484-Y490 AromaticContact NE2-CZ 3.69Å; Y490-V492 PolarHBondContact O-N 3.09Å; Y490-A493 HydrophobicContact CD1-CB 4.08Å; Y490-A493 PolarHBondContact O-N 3.2Å; Y490-F494 HydrophobicContact CD1-CE2 4.49Å; Y490-F494 HydrophobicContact CG-CE2 4.12Å; Y490-F494 HydrophobicContact CG-CZ 4.49Å; Y490-F494 VanDerWaalsContact O-CD2 3.32Å; Y490-F494 WeakPolarHBondContact O-CD2 3.35Å; Y490-F494 PolarHBondContact O-N 3.01Å |
| 491 | T | 93 | Very high | 93.3 | Very high | 58 Ų | 58 | 51 Ų | 51 | 36% | 0.356 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -63.3 | -47.2 | -175.7 | -59.3 | 0 | 0 | 0 | 0 | 110.8 | P419 D489 S495 | P419-T491 HydrophobicContact CB-CG2 4.03Å; P419-T491 HydrophobicContact CG-CG2 4.45Å; D489-T491 VanDerWaalsContact CG-OG1 3.27Å; D489-T491 WeakPolarHBondContact OD1-CA 3.46Å; D489-T491 WeakPolarHBondContact OD1-CB 3.37Å; D489-T491 PolarHBondContact OD1-N 3.02Å; D489-T491 PolarHBondContact OD1-OG1 3.42Å; D489-T491 WeakPolarHBondContact OD2-CB 3.47Å; D489-T491 PolarHBondContact OD2-OG1 3.13Å; T491-S495 VanDerWaalsContact O-CB 3.24Å; T491-S495 WeakPolarHBondContact O-CB 3.32Å; T491-S495 PolarHBondContact O-N 3.01Å; T491-S495 VanDerWaalsContact O-N 3.15Å; T491-S495 PolarHBondContact O-OG 2.86Å |
| 492 | V | 93.9 | Very high | 93.8 | Very high | 41 Ų | 41 | 53 Ų | 53 | 25% | 0.248 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -69.1 | -40.2 | 176.1 | -175.5 | 0 | 0 | 0 | 0 | 110.8 | L483 F487 Y490 S495 L496 | L483-V492 HydrophobicContact CD2-CG1 4.33Å; F487-V492 HydrophobicContact CB-CG2 4.37Å; F487-V492 HydrophobicContact CD1-CG2 4.06Å; F487-V492 HydrophobicContact CD2-CB 3.76Å; F487-V492 HydrophobicContact CD2-CG1 3.9Å; F487-V492 HydrophobicContact CD2-CG2 3.81Å; F487-V492 HydrophobicContact CE1-CG2 4.31Å; F487-V492 HydrophobicContact CE2-CB 4.04Å; F487-V492 HydrophobicContact CE2-CG1 3.65Å; F487-V492 HydrophobicContact CE2-CG2 4.09Å; F487-V492 HydrophobicContact CG-CB 4.23Å; F487-V492 HydrophobicContact CG-CG2 3.81Å; F487-V492 HydrophobicContact CZ-CG1 4.27Å; F487-V492 HydrophobicContact CZ-CG2 4.33Å; Y490-V492 PolarHBondContact O-N 3.09Å; V492-S495 PolarHBondContact O-N 3.32Å; V492-L496 HydrophobicContact CG1-CD1 3.76Å; V492-L496 HydrophobicContact CG1-CG 4.14Å; V492-L496 WeakPolarHBondContact O-CB 3.49Å; V492-L496 WeakPolarHBondContact O-CG 3.34Å; V492-L496 PolarHBondContact O-N 2.88Å |
| 493 | A | 93.5 | Very high | 94.2 | Very high | 2 Ų | 2 | 51.5 Ų | 51.5 | 2% | 0.017 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -59.2 | -50.3 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | A480 L483 Y490 A497 | A480-A493 HydrophobicContact CB-CB 4.21Å; L483-A493 HydrophobicContact CB-CB 4.14Å; Y490-A493 HydrophobicContact CD1-CB 4.08Å; Y490-A493 PolarHBondContact O-N 3.2Å; A493-A497 VanDerWaalsContact O-CB 3.31Å; A493-A497 WeakPolarHBondContact O-CB 3.27Å; A493-A497 PolarHBondContact O-N 3.44Å |
| 494 | F | 94.8 | Very high | 94.4 | Very high | 0 Ų | 0 | 49.9 Ų | 49.9 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -72.7 | -35.4 | 177.5 | -66.8 | -51.9 | 0 | 0 | 0 | 113.2 | V351 H355 F359 I418 P419 Y490 L496 A497 G498 | V351-F494 HydrophobicContact CG1-CD1 3.98Å; V351-F494 HydrophobicContact CG1-CE1 4.06Å; H355-F494 HydrophobicContact CB-CE1 4.1Å; H355-F494 HydrophobicContact CB-CZ 3.99Å; F359-F494 HydrophobicContact CB-CE2 3.62Å; F359-F494 HydrophobicContact CB-CZ 4.02Å; F359-F494 HydrophobicContact CD1-CE2 4.05Å; F359-F494 AromaticContact CD2-CE2 3.95Å; F359-F494 HydrophobicContact CD2-CE2 3.95Å; F359-F494 AromaticContact CG-CE2 3.61Å; F359-F494 HydrophobicContact CG-CE2 3.61Å; F359-F494 HydrophobicContact CG-CZ 4.41Å; I418-F494 HydrophobicContact CB-CB 4.48Å; I418-F494 HydrophobicContact CB-CD2 4.19Å; I418-F494 HydrophobicContact CB-CG 4.26Å; I418-F494 HydrophobicContact CD1-CD1 4.08Å; I418-F494 HydrophobicContact CD1-CE1 4.36Å; I418-F494 HydrophobicContact CD1-CG 4.36Å; I418-F494 HydrophobicContact CG2-CD2 3.52Å; I418-F494 HydrophobicContact CG2-CE2 3.6Å; I418-F494 HydrophobicContact CG2-CG 4.01Å; I418-F494 HydrophobicContact CG2-CZ 4.18Å; P419-F494 HydrophobicContact CG-CB 4.3Å; Y490-F494 HydrophobicContact CD1-CE2 4.49Å; Y490-F494 HydrophobicContact CG-CE2 4.12Å; Y490-F494 HydrophobicContact CG-CZ 4.49Å; Y490-F494 VanDerWaalsContact O-CD2 3.32Å; Y490-F494 WeakPolarHBondContact O-CD2 3.35Å; Y490-F494 PolarHBondContact O-N 3.01Å; F494-L496 VanDerWaalsContact C-N 3.34Å; F494-L496 PolarHBondContact O-N 3.38Å; F494-A497 PolarHBondContact O-N 3.48Å; F494-G498 PolarHBondContact O-N 3.26Å; F494-G498 VanDerWaalsContact O-N 3.08Å |
| 495 | S | 94.6 | Very high | 94.6 | Very high | 43 Ų | 43 | 48.3 Ų | 48.3 | 30% | 0.301 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -61.2 | -44.1 | 176.6 | -61.2 | 0 | 0 | 0 | 0 | 111.3 | T491 V492 G498 | T491-S495 VanDerWaalsContact O-CB 3.24Å; T491-S495 WeakPolarHBondContact O-CB 3.32Å; T491-S495 PolarHBondContact O-N 3.01Å; T491-S495 VanDerWaalsContact O-N 3.15Å; T491-S495 PolarHBondContact O-OG 2.86Å; V492-S495 PolarHBondContact O-N 3.32Å; S495-G498 PolarHBondContact O-N 3.14Å |
| 496 | L | 95.2 | Very high | 94.9 | Very high | 89 Ų | 89 | 46 Ų | 46 | 47% | 0.466 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -73 | -33.8 | 175.3 | -67.1 | -179.1 | 0 | 0 | 0 | 112.5 | L483 V492 F494 G498 V499 P500 | L483-L496 HydrophobicContact CD1-CB 4.49Å; L483-L496 HydrophobicContact CD1-CD1 3.89Å; L483-L496 HydrophobicContact CD2-CD1 4.16Å; V492-L496 HydrophobicContact CG1-CD1 3.76Å; V492-L496 HydrophobicContact CG1-CG 4.14Å; V492-L496 WeakPolarHBondContact O-CB 3.49Å; V492-L496 WeakPolarHBondContact O-CG 3.34Å; V492-L496 PolarHBondContact O-N 2.88Å; F494-L496 VanDerWaalsContact C-N 3.34Å; F494-L496 PolarHBondContact O-N 3.38Å; L496-G498 PolarHBondContact O-N 3.44Å; L496-V499 PolarHBondContact O-N 3.05Å; L496-V499 VanDerWaalsContact O-N 3.09Å; L496-P500 WeakPolarHBondContact O-CD 3.33Å |
| 497 | A | 94.5 | Very high | 95 | Very high | 6 Ų | 6 | 39.4 Ų | 39.4 | 5% | 0.05 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -62 | -26.5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | G348 V351 A493 F494 V499 P501 | G348-A497 VanDerWaalsContact CA-O 3.3Å; G348-A497 WeakPolarHBondContact CA-O 3.47Å; V351-A497 HydrophobicContact CB-CB 3.66Å; V351-A497 HydrophobicContact CG1-CB 3.79Å; V351-A497 HydrophobicContact CG2-CB 4.03Å; A493-A497 VanDerWaalsContact O-CB 3.31Å; A493-A497 WeakPolarHBondContact O-CB 3.27Å; A493-A497 PolarHBondContact O-N 3.44Å; F494-A497 PolarHBondContact O-N 3.48Å; A497-V499 VanDerWaalsContact C-N 3.3Å; A497-V499 PolarHBondContact O-N 3.04Å; A497-P501 WeakPolarHBondContact O-CD 3.37Å |
| 498 | G | 96.4 | Very high | 95.1 | Very high | 0 Ų | 0 | 34.3 Ų | 34.3 | 0% | 0 | 21% | 0.21 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -70.2 | -22.4 | 173.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | G412 F494 S495 L496 P501 M502 | G412-G498 VanDerWaalsContact CA-O 3.24Å; G412-G498 WeakPolarHBondContact CA-O 3.1Å; G412-G498 WeakPolarHBondContact O-CA 3.42Å; F494-G498 PolarHBondContact O-N 3.26Å; F494-G498 VanDerWaalsContact O-N 3.08Å; S495-G498 PolarHBondContact O-N 3.14Å; L496-G498 PolarHBondContact O-N 3.44Å; G498-P501 WeakPolarHBondContact O-CD 3.23Å; G498-M502 WeakPolarHBondContact O-CG 3.46Å |
| 499 | V | 97.1 | Very high | 95.4 | Very high | 56 Ų | 56 | 35.6 Ų | 35.6 | 34% | 0.339 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -72.6 | -49 | -172 | 178.5 | 0 | 0 | 0 | 0 | 113.4 | M416 L496 A497 M502 I503 | M416-V499 HydrophobicContact CE-CB 4.48Å; M416-V499 HydrophobicContact CE-CG2 3.54Å; L496-V499 PolarHBondContact O-N 3.05Å; L496-V499 VanDerWaalsContact O-N 3.09Å; A497-V499 VanDerWaalsContact C-N 3.3Å; A497-V499 PolarHBondContact O-N 3.04Å; V499-M502 PolarHBondContact O-N 2.97Å; V499-M502 VanDerWaalsContact O-N 3.14Å; V499-I503 HydrophobicContact CG1-CD1 3.68Å; V499-I503 HydrophobicContact CG1-CG1 4.17Å; V499-I503 WeakPolarHBondContact O-CG1 3.44Å; V499-I503 PolarHBondContact O-N 2.93Å |
| 500 | P | 96.8 | Very high | 95.6 | Very high | 19 Ų | 19 | 37.7 Ų | 37.7 | 12% | 0.123 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -59.4 | -41.7 | -179.7 | -19.4 | 28.8 | 0 | 0 | 0 | 114.5 | T344 A345 L347 L496 M502 I503 G504 | T344-P500 WeakPolarHBondContact O-CB 3.48Å; A345-P500 WeakPolarHBondContact CA-O 3.35Å; L347-P500 HydrophobicContact CB-CB 3.93Å; L347-P500 HydrophobicContact CB-CG 4.17Å; L347-P500 HydrophobicContact CD2-CB 4.43Å; L347-P500 HydrophobicContact CD2-CG 4.1Å; L347-P500 HydrophobicContact CG-CG 4.26Å; L496-P500 WeakPolarHBondContact O-CD 3.33Å; P500-M502 PolarHBondContact O-N 3.23Å; P500-I503 PolarHBondContact O-N 3.03Å; P500-G504 PolarHBondContact O-N 2.96Å |
| 501 | P | 96.8 | Very high | 95.7 | Very high | 0 Ų | 0 | 37.1 Ų | 37.1 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -53 | -47.3 | 170.1 | -28.3 | 35 | 0 | 0 | 0 | 113.3 | F408 L411 A497 G498 G504 G505 | F408-P501 WeakPolarHBondContact CB-O 3.43Å; F408-P501 WeakPolarHBondContact O-CB 3.16Å; L411-P501 HydrophobicContact CD2-CB 4.22Å; L411-P501 HydrophobicContact CD2-CG 4.11Å; A497-P501 WeakPolarHBondContact O-CD 3.37Å; G498-P501 WeakPolarHBondContact O-CD 3.23Å; P501-G504 PolarHBondContact O-N 2.98Å; P501-G505 PolarHBondContact O-N 3.03Å |
| 502 | M | 97.6 | Very high | 95.7 | Very high | 58 Ų | 58 | 35.2 Ų | 35.2 | 29% | 0.286 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -64.6 | -42.7 | 179.3 | -64.8 | 176.7 | 73.8 | 0 | 0 | 111.9 | M409 M416 G498 V499 P500 G504 G505 V506 | M409-M502 HydrophobicContact CE-CB 4.35Å; M409-M502 HydrophobicContact CE-CE 3.74Å; M409-M502 HydrophobicContact CE-CG 4.31Å; M409-M502 HydrophobicContact SD-CB 4.08Å; M409-M502 HydrophobicContact SD-CG 4.32Å; M416-M502 HydrophobicContact CE-SD 3.8Å; M416-M502 HydrophobicContact SD-SD 4.27Å; G498-M502 WeakPolarHBondContact O-CG 3.46Å; V499-M502 PolarHBondContact O-N 2.97Å; V499-M502 VanDerWaalsContact O-N 3.14Å; P500-M502 PolarHBondContact O-N 3.23Å; M502-G504 PolarHBondContact O-N 3.33Å; M502-G505 PolarHBondContact O-N 2.94Å; M502-V506 WeakPolarHBondContact O-CG2 3.48Å; M502-V506 PolarHBondContact O-N 3.29Å |
| 503 | I | 97.6 | Very high | 95.5 | Very high | 87 Ų | 87 | 36.4 Ų | 36.4 | 45% | 0.446 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -60.7 | -46.6 | 175.5 | -65.9 | 174.1 | 0 | 0 | 0 | 110.5 | T344 V499 P500 G505 V506 V507 | T344-I503 HydrophobicContact CG2-CB 4.29Å; T344-I503 HydrophobicContact CG2-CG2 3.91Å; V499-I503 HydrophobicContact CG1-CD1 3.68Å; V499-I503 HydrophobicContact CG1-CG1 4.17Å; V499-I503 WeakPolarHBondContact O-CG1 3.44Å; V499-I503 PolarHBondContact O-N 2.93Å; P500-I503 PolarHBondContact O-N 3.03Å; I503-G505 PolarHBondContact O-N 3.28Å; I503-V506 PolarHBondContact O-N 3.16Å; I503-V507 WeakPolarHBondContact O-CG2 3.32Å; I503-V507 PolarHBondContact O-N 2.88Å |
| 504 | G | 96.8 | Very high | 95.4 | Very high | 0 Ų | 0 | 38.5 Ų | 38.5 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -60.9 | -42.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | G341 P500 P501 M502 V506 V507 L508 | G341-G504 VanDerWaalsContact O-CA 3.26Å; G341-G504 WeakPolarHBondContact O-CA 3.05Å; P500-G504 PolarHBondContact O-N 2.96Å; P501-G504 PolarHBondContact O-N 2.98Å; M502-G504 PolarHBondContact O-N 3.33Å; G504-V506 PolarHBondContact O-N 2.87Å; G504-V507 PolarHBondContact O-N 3.09Å; G504-L508 WeakPolarHBondContact O-CB 3.49Å; G504-L508 WeakPolarHBondContact O-CD1 3.3Å; G504-L508 PolarHBondContact O-N 3.03Å |
| 505 | G | 96.8 | Very high | 95.2 | Very high | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -57.6 | -45.5 | 173 | 0 | 0 | 0 | 0 | 0 | 112.9 | P501 M502 I503 L508 F509 | P501-G505 PolarHBondContact O-N 3.03Å; M502-G505 PolarHBondContact O-N 2.94Å; I503-G505 PolarHBondContact O-N 3.28Å; G505-L508 PolarHBondContact O-N 2.94Å; G505-F509 PolarHBondContact O-N 3.3Å |
| 506 | V | 97.3 | Very high | 94.9 | Very high | 76 Ų | 76 | 46.7 Ų | 46.7 | 46% | 0.461 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -63.6 | -40.8 | 175.4 | 171.7 | 0 | 0 | 0 | 0 | 111.7 | M409 M502 I503 G504 F509 F510 | M409-V506 HydrophobicContact SD-CG2 4.28Å; M502-V506 WeakPolarHBondContact O-CG2 3.48Å; M502-V506 PolarHBondContact O-N 3.29Å; I503-V506 PolarHBondContact O-N 3.16Å; G504-V506 PolarHBondContact O-N 2.87Å; V506-F509 WeakPolarHBondContact O-CB 3.47Å; V506-F509 PolarHBondContact O-N 3.32Å; V506-F510 HydrophobicContact CG1-CE2 4.08Å; V506-F510 WeakPolarHBondContact O-CD2 3.48Å |
| 507 | V | 96.8 | Very high | 94.7 | Very high | 50 Ų | 50 | 50.9 Ų | 50.9 | 30% | 0.303 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -62.6 | -43.6 | 174.2 | 171.6 | 0 | 0 | 0 | 0 | 111.3 | V337 I503 G504 F509 F510 | V337-V507 HydrophobicContact CG1-CG1 3.73Å; I503-V507 WeakPolarHBondContact O-CG2 3.32Å; I503-V507 PolarHBondContact O-N 2.88Å; G504-V507 PolarHBondContact O-N 3.09Å; V507-F509 VanDerWaalsContact C-N 3.33Å; V507-F509 PolarHBondContact O-N 2.79Å; V507-F510 PolarHBondContact O-N 3.09Å |
| 508 | L | 95.9 | Very high | 94.3 | Very high | 0 Ų | 0 | 53.5 Ų | 53.5 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -65 | -33.8 | 179.3 | -94.8 | 71.4 | 0 | 0 | 0 | 112.9 | V342 I401 Q404 V405 F408 G504 G505 F510 V511 P512 | V342-L508 HydrophobicContact CG2-CD1 4.17Å; V342-L508 HydrophobicContact CG2-CD2 4.14Å; I401-L508 HydrophobicContact CG2-CB 4.16Å; I401-L508 HydrophobicContact CG2-CD2 4.42Å; I401-L508 HydrophobicContact CG2-CG 4.42Å; I401-L508 WeakPolarHBondContact CG2-O 3.48Å; Q404-L508 HydrophobicContact CB-CD2 4.14Å; Q404-L508 VanDerWaalsContact CD-CD2 3.41Å; Q404-L508 HydrophobicContact CG-CD2 3.72Å; V405-L508 HydrophobicContact CG2-CB 3.65Å; F408-L508 HydrophobicContact CD2-CD2 4.09Å; F408-L508 HydrophobicContact CE2-CD1 4.47Å; F408-L508 HydrophobicContact CE2-CD2 3.79Å; G504-L508 WeakPolarHBondContact O-CB 3.49Å; G504-L508 WeakPolarHBondContact O-CD1 3.3Å; G504-L508 PolarHBondContact O-N 3.03Å; G505-L508 PolarHBondContact O-N 2.94Å; L508-F510 PolarHBondContact O-N 3.2Å; L508-V511 WeakPolarHBondContact O-CB 3.46Å; L508-V511 PolarHBondContact O-N 3.28Å; L508-P512 WeakPolarHBondContact O-CD 3.36Å |
| 509 | F | 96.1 | Very high | 93.7 | Very high | 90 Ų | 90 | 58.6 Ų | 58.6 | 40% | 0.395 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -56.6 | -33 | 177 | 179.1 | -95.7 | 0 | 0 | 0 | 112.9 | Y402 V405 G505 V506 V507 L513 | Y402-F509 HydrophobicContact CD1-CD2 4.09Å; Y402-F509 HydrophobicContact CD1-CE2 4.4Å; Y402-F509 AromaticContact CE1-CD2 3.77Å; Y402-F509 HydrophobicContact CE1-CD2 3.77Å; Y402-F509 AromaticContact CE1-CE2 3.89Å; Y402-F509 HydrophobicContact CE1-CE2 3.89Å; V405-F509 HydrophobicContact CG1-CB 4.25Å; V405-F509 HydrophobicContact CG2-CB 4.23Å; G505-F509 PolarHBondContact O-N 3.3Å; V506-F509 WeakPolarHBondContact O-CB 3.47Å; V506-F509 PolarHBondContact O-N 3.32Å; V507-F509 VanDerWaalsContact C-N 3.33Å; V507-F509 PolarHBondContact O-N 2.79Å; F509-L513 HydrophobicContact CD1-CD1 4.37Å; F509-L513 HydrophobicContact CE1-CD1 3.98Å |
| 510 | F | 94.4 | Very high | 93.2 | Very high | 105 Ų | 105 | 60.6 Ų | 60.6 | 46% | 0.461 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -79.3 | -15.1 | 177.9 | -66.8 | -73.4 | 0 | 0 | 0 | 114.1 | V506 V507 L508 L513 I514 | V506-F510 HydrophobicContact CG1-CE2 4.08Å; V506-F510 WeakPolarHBondContact O-CD2 3.48Å; V507-F510 PolarHBondContact O-N 3.09Å; L508-F510 PolarHBondContact O-N 3.2Å; F510-L513 HydrophobicContact CD1-CD1 4.03Å; F510-L513 WeakPolarHBondContact O-CB 3.35Å; F510-L513 PolarHBondContact O-N 3.07Å; F510-L513 VanDerWaalsContact O-N 3.16Å; F510-I514 HydrophobicContact CB-CD1 4.16Å; F510-I514 VanDerWaalsContact O-CG1 3.28Å; F510-I514 WeakPolarHBondContact O-CG1 3.44Å; F510-I514 PolarHBondContact O-N 3.04Å |
| 511 | V | 94.4 | Very high | 92.5 | Very high | 0 Ų | 0 | 65.6 Ų | 65.6 | 0% | 0 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -61.8 | -47.1 | -175 | 178.2 | 0 | 0 | 0 | 0 | 112.9 | T334 V337 W338 I401 L452 L508 L513 I514 H515 | T334-V511 HydrophobicContact CG2-CG1 4.41Å; T334-V511 WeakPolarHBondContact O-CG1 3.32Å; V337-V511 HydrophobicContact CB-CG2 4.1Å; V337-V511 HydrophobicContact CG1-CG2 3.72Å; W338-V511 HydrophobicContact CB-CG1 4.31Å; W338-V511 HydrophobicContact CB-CG2 4.07Å; I401-V511 HydrophobicContact CD1-CB 4.1Å; I401-V511 HydrophobicContact CD1-CG1 3.66Å; L452-V511 HydrophobicContact CD2-CG1 4.18Å; L508-V511 WeakPolarHBondContact O-CB 3.46Å; L508-V511 PolarHBondContact O-N 3.28Å; V511-L513 VanDerWaalsContact C-N 3.29Å; V511-L513 PolarHBondContact O-N 2.77Å; V511-I514 PolarHBondContact O-N 3.38Å; V511-H515 PolarHBondContact O-N 3.39Å |
| 512 | P | 92.3 | Very high | 91.5 | Very high | 18 Ų | 18 | 72 Ų | 72 | 12% | 0.117 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -64.7 | -32.1 | 175 | -21.9 | 34.8 | 0 | 0 | 0 | 113.2 | I401 Y402 L508 H515 R516 | I401-P512 HydrophobicContact CB-CG 4.08Å; I401-P512 HydrophobicContact CD1-CG 4.28Å; I401-P512 HydrophobicContact CG2-CG 4.3Å; Y402-P512 HydrophobicContact CE1-CG 4.27Å; Y402-P512 HydrophobicContact CE2-CB 4.28Å; Y402-P512 HydrophobicContact CE2-CG 4.13Å; L508-P512 WeakPolarHBondContact O-CD 3.36Å; P512-H515 PolarHBondContact O-N 3.48Å; P512-R516 PolarHBondContact O-N 3.23Å |
| 513 | L | 90.6 | Very high | 90.3 | Very high | 66 Ų | 66 | 72 Ų | 72 | 35% | 0.346 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -70.4 | -41 | 178.1 | -58.5 | 177.8 | 0 | 0 | 0 | 111.5 | F509 F510 V511 R517 | F509-L513 HydrophobicContact CD1-CD1 4.37Å; F509-L513 HydrophobicContact CE1-CD1 3.98Å; F510-L513 HydrophobicContact CD1-CD1 4.03Å; F510-L513 WeakPolarHBondContact O-CB 3.35Å; F510-L513 PolarHBondContact O-N 3.07Å; F510-L513 VanDerWaalsContact O-N 3.16Å; V511-L513 VanDerWaalsContact C-N 3.29Å; V511-L513 PolarHBondContact O-N 2.77Å; L513-R517 WeakPolarHBondContact O-CG 2.89Å; L513-R517 PolarHBondContact O-N 3.24Å; L513-R517 VanDerWaalsContact O-N 3.08Å |
| 514 | I | 91 | Very high | 88.3 | Confident | 46 Ų | 46 | 71.2 Ų | 71.2 | 24% | 0.236 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -62.8 | -45.1 | 172.7 | -69.1 | 164 | 0 | 0 | 0 | 110.1 | V333 T334 V337 F510 V511 R516 R517 I518 | V333-I514 HydrophobicContact CG1-CG2 4.17Å; T334-I514 HydrophobicContact CG2-CG2 4.03Å; V337-I514 HydrophobicContact CG1-CD1 4.29Å; V337-I514 HydrophobicContact CG2-CD1 4.29Å; F510-I514 HydrophobicContact CB-CD1 4.16Å; F510-I514 VanDerWaalsContact O-CG1 3.28Å; F510-I514 WeakPolarHBondContact O-CG1 3.44Å; F510-I514 PolarHBondContact O-N 3.04Å; V511-I514 PolarHBondContact O-N 3.38Å; I514-R516 PolarHBondContact O-N 2.92Å; I514-R517 PolarHBondContact O-N 3.4Å; I514-I518 HydrophobicContact CG2-CD1 3.77Å; I514-I518 HydrophobicContact CG2-CG1 4.49Å; I514-I518 WeakPolarHBondContact O-CG1 3.38Å; I514-I518 PolarHBondContact O-N 3.4Å |
| 515 | H | 89.9 | Confident | 86.2 | Confident | 53 Ų | 53 | 74.8 Ų | 74.8 | 25% | 0.245 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -58.3 | -49.1 | 177.5 | -167.4 | 83.5 | 0 | 0 | 0 | 112 | T334 L398 V511 P512 R517 I518 Q519 | T334-H515 HydrophobicContact CG2-CB 3.68Å; L398-H515 HydrophobicContact CD1-CB 3.74Å; V511-H515 PolarHBondContact O-N 3.39Å; P512-H515 PolarHBondContact O-N 3.48Å; H515-R517 PolarHBondContact O-N 2.67Å; H515-I518 PolarHBondContact O-N 2.85Å; H515-Q519 PolarHBondContact CD2-OE1 3.28Å; H515-Q519 PolarHBondContact NE2-NE2 3.01Å; H515-Q519 VanDerWaalsContact NE2-NE2 3.2Å; H515-Q519 PolarHBondContact O-N 3.33Å |
| 516 | R | 88.6 | Confident | 83.8 | Confident | 162 Ų | 162 | 81.9 Ų | 81.9 | 61% | 0.611 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -59.5 | -43.5 | 178.2 | -174.2 | -178.5 | 175.4 | 176.2 | 1.6 | 112 | P512 I514 Q519 Q520 | P512-R516 PolarHBondContact O-N 3.23Å; I514-R516 PolarHBondContact O-N 2.92Å; R516-Q519 PolarHBondContact O-N 2.84Å; R516-Q520 WeakPolarHBondContact O-CG 3.46Å; R516-Q520 PolarHBondContact O-N 3.19Å |
| 517 | R | 90.3 | Very high | 81.3 | Confident | 177 Ų | 177 | 85.2 Ų | 85.2 | 67% | 0.668 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -62.8 | -41 | 176.8 | -75.2 | 177.6 | 177.8 | -178.2 | -0.1 | 112.5 | L513 I514 H515 Q520 N521 | L513-R517 WeakPolarHBondContact O-CG 2.89Å; L513-R517 PolarHBondContact O-N 3.24Å; L513-R517 VanDerWaalsContact O-N 3.08Å; I514-R517 PolarHBondContact O-N 3.4Å; H515-R517 PolarHBondContact O-N 2.67Å; R517-Q520 PolarHBondContact O-N 2.71Å; R517-N521 WeakPolarHBondContact O-CB 3.13Å; R517-N521 PolarHBondContact O-N 2.88Å; R517-N521 PolarHBondContact O-OD1 3.32Å |
| 518 | I | 87.4 | Confident | 78.8 | Confident | 61 Ų | 61 | 88 Ų | 88 | 31% | 0.313 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -63 | -45.8 | 176.8 | -68.6 | 167.2 | 0 | 0 | 0 | 110.4 | V333 T334 I514 H515 Q520 N521 Q522 | V333-I518 HydrophobicContact CB-CD1 4.14Å; T334-I518 HydrophobicContact CG2-CD1 4.45Å; I514-I518 HydrophobicContact CG2-CD1 3.77Å; I514-I518 HydrophobicContact CG2-CG1 4.49Å; I514-I518 WeakPolarHBondContact O-CG1 3.38Å; I514-I518 PolarHBondContact O-N 3.4Å; H515-I518 PolarHBondContact O-N 2.85Å; I518-Q520 PolarHBondContact O-N 3.26Å; I518-N521 PolarHBondContact O-N 3.23Å; I518-Q522 WeakPolarHBondContact O-CG 3.5Å; I518-Q522 PolarHBondContact O-N 3.08Å; I518-Q522 VanDerWaalsContact O-N 3.09Å |
| 519 | Q | 84.1 | Confident | 76.2 | Confident | 107 Ų | 107 | 91.8 Ų | 91.8 | 50% | 0.5 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -61.5 | -43.7 | 176.5 | -71.6 | 179.4 | -41.6 | 0 | 0 | 112.6 | H515 R516 Q522 A523 | H515-Q519 PolarHBondContact CD2-OE1 3.28Å; H515-Q519 PolarHBondContact NE2-NE2 3.01Å; H515-Q519 VanDerWaalsContact NE2-NE2 3.2Å; H515-Q519 PolarHBondContact O-N 3.33Å; R516-Q519 PolarHBondContact O-N 2.84Å; Q519-Q522 PolarHBondContact O-N 3.37Å; Q519-Q522 VanDerWaalsContact O-N 3.16Å; Q519-A523 PolarHBondContact O-N 2.85Å |
| 520 | Q | 84.9 | Confident | 73.8 | Confident | 98 Ų | 98 | 91.2 Ų | 91.2 | 46% | 0.458 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -62.5 | -45.3 | 177.4 | -71.3 | 178.2 | -74.3 | 0 | 0 | 111.7 | R516 R517 I518 Q522 A523 S524 | R516-Q520 WeakPolarHBondContact O-CG 3.46Å; R516-Q520 PolarHBondContact O-N 3.19Å; R517-Q520 PolarHBondContact O-N 2.71Å; I518-Q520 PolarHBondContact O-N 3.26Å; Q520-Q522 PolarHBondContact O-N 3.37Å; Q520-A523 PolarHBondContact O-N 3.09Å; Q520-A523 VanDerWaalsContact O-N 3.14Å; Q520-S524 PolarHBondContact O-N 2.94Å; Q520-S524 PolarHBondContact O-OG 3.19Å |
| 521 | N | 83.3 | Confident | 71.4 | Confident | 123 Ų | 123 | 91.2 Ų | 91.2 | 66% | 0.658 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -66.7 | -15 | 176.4 | -72.1 | 16.9 | 0 | 0 | 0 | 113.8 | R517 I518 P525 | R517-N521 WeakPolarHBondContact O-CB 3.13Å; R517-N521 PolarHBondContact O-N 2.88Å; R517-N521 PolarHBondContact O-OD1 3.32Å; I518-N521 PolarHBondContact O-N 3.23Å; N521-P525 WeakPolarHBondContact O-CD 3.36Å; N521-P525 WeakPolarHBondContact O-CG 3.3Å |
| 522 | Q | 76.4 | Confident | 69 | Low | 134 Ų | 134 | 94.8 Ų | 94.8 | 63% | 0.626 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -92.3 | -17.4 | 174.5 | -75.7 | 176.8 | -33.7 | 0 | 0 | 113.4 | I518 Q519 Q520 | I518-Q522 WeakPolarHBondContact O-CG 3.5Å; I518-Q522 PolarHBondContact O-N 3.08Å; I518-Q522 VanDerWaalsContact O-N 3.09Å; Q519-Q522 PolarHBondContact O-N 3.37Å; Q519-Q522 VanDerWaalsContact O-N 3.16Å; Q520-Q522 PolarHBondContact O-N 3.37Å |
| 523 | A | 70.7 | Confident | 66.8 | Low | 58 Ų | 58 | 102 Ų | 102 | 48% | 0.479 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -86.3 | -43.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q519 Q520 E526 | Q519-A523 PolarHBondContact O-N 2.85Å; Q520-A523 PolarHBondContact O-N 3.09Å; Q520-A523 VanDerWaalsContact O-N 3.14Å; A523-E526 PolarHBondContact O-N 3.47Å |
| 524 | S | 55.4 | Low | 64.4 | Low | 72 Ų | 72 | 106.2 Ų | 106.2 | 50% | 0.503 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -60.2 | -24.6 | -178.2 | -56.4 | 0 | 0 | 0 | 0 | 117.6 | Q520 T528 | Q520-S524 PolarHBondContact O-N 2.94Å; Q520-S524 PolarHBondContact O-OG 3.19Å; S524-T528 PolarHBondContact O-OG1 3.15Å |
| 525 | P | 52.6 | Low | 62 | Low | 75 Ų | 75 | 110.8 Ų | 110.8 | 49% | 0.487 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -66.3 | -35.7 | 178.7 | -24.8 | 36 | 0 | 0 | 0 | 115 | N521 | N521-P525 WeakPolarHBondContact O-CD 3.36Å; N521-P525 WeakPolarHBondContact O-CG 3.3Å |
| 526 | E | 47.3 | Very low | 59.5 | Low | 149 Ų | 149 | 113.7 Ų | 113.7 | 70% | 0.696 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -79.1 | -38.4 | -170.8 | -68.1 | -170.7 | 125.2 | 0 | 0 | 113.1 | A523 T528 S529 T530 | A523-E526 PolarHBondContact O-N 3.47Å; E526-T528 VanDerWaalsContact C-N 3.32Å; E526-T528 PolarHBondContact O-N 2.93Å; E526-S529 PolarHBondContact O-N 3.15Å; E526-T530 WeakPolarHBondContact O-CB 3.42Å; E526-T530 PolarHBondContact O-N 3.09Å; E526-T530 PolarHBondContact O-OG1 3.14Å |
| 527 | E | 44.6 | Very low | 57.1 | Low | 146 Ų | 146 | 112.6 Ų | 112.6 | 68% | 0.682 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -60.3 | -43.4 | 176.9 | -65.4 | -174.3 | 142.8 | 0 | 0 | 111.2 | S529 T530 T531 | E527-S529 VanDerWaalsContact C-N 3.34Å; E527-S529 PolarHBondContact O-N 3.23Å; E527-T530 PolarHBondContact O-N 3.37Å; E527-T531 PolarHBondContact O-N 3.36Å; E527-T531 VanDerWaalsContact O-N 3.07Å; E527-T531 PolarHBondContact O-OG1 3.42Å; E527-T531 VanDerWaalsContact O-OG1 3.09Å |
| 528 | T | 43.7 | Very low | 54.4 | Low | 108 Ų | 108 | 110.2 Ų | 110.2 | 66% | 0.663 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -63.7 | -37.7 | -179 | -50.6 | 0 | 0 | 0 | 0 | 112.4 | S524 E526 | S524-T528 PolarHBondContact O-OG1 3.15Å; E526-T528 VanDerWaalsContact C-N 3.32Å; E526-T528 PolarHBondContact O-N 2.93Å |
| 529 | S | 43 | Very low | 52 | Low | 80 Ų | 80 | 112.8 Ų | 112.8 | 56% | 0.559 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -72.3 | -37.2 | 177.1 | -165 | 0 | 0 | 0 | 0 | 112.2 | E526 E527 | E526-S529 PolarHBondContact O-N 3.15Å; E527-S529 VanDerWaalsContact C-N 3.34Å; E527-S529 PolarHBondContact O-N 3.23Å |
| 530 | T | 44.5 | Very low | 49.7 | Very low | 78 Ų | 78 | 114 Ų | 114 | 48% | 0.479 | 66% | 0.658 | S | S | . | * | H | α-helix | trans | -73.9 | -42.7 | -174.8 | -51.7 | 0 | 0 | 0 | 0 | 111.9 | E526 E527 A532 H533 M534 | E526-T530 WeakPolarHBondContact O-CB 3.42Å; E526-T530 PolarHBondContact O-N 3.09Å; E526-T530 PolarHBondContact O-OG1 3.14Å; E527-T530 PolarHBondContact O-N 3.37Å; T530-A532 VanDerWaalsContact C-N 3.29Å; T530-A532 PolarHBondContact O-N 3.33Å; T530-H533 PolarHBondContact O-N 3.17Å; T530-M534 HydrophobicContact CG2-CE 4.46Å |
| 531 | T | 45.5 | Very low | 47.3 | Very low | 105 Ų | 105 | 114.4 Ų | 114.4 | 64% | 0.644 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -65.4 | -32.7 | 178.3 | -48.3 | 0 | 0 | 0 | 0 | 112.4 | E527 H533 M534 | E527-T531 PolarHBondContact O-N 3.36Å; E527-T531 VanDerWaalsContact O-N 3.07Å; E527-T531 PolarHBondContact O-OG1 3.42Å; E527-T531 VanDerWaalsContact O-OG1 3.09Å; T531-H533 PolarHBondContact O-N 3.24Å; T531-M534 PolarHBondContact O-N 3.01Å |
| 532 | A | 44.1 | Very low | 44.8 | Very low | 75 Ų | 75 | 112.4 Ų | 112.4 | 62% | 0.62 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -63.9 | -22.1 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | T530 | T530-A532 VanDerWaalsContact C-N 3.29Å; T530-A532 PolarHBondContact O-N 3.33Å |
| 533 | H | 44.8 | Very low | 42.7 | Very low | 170 Ų | 170 | 113.8 Ų | 113.8 | 79% | 0.787 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.7 | -1.8 | -174.4 | -115 | -66.2 | 0 | 0 | 0 | 115.2 | T530 T531 | T530-H533 PolarHBondContact O-N 3.17Å; T531-H533 PolarHBondContact O-N 3.24Å |
| 534 | M | 41.3 | Very low | 41.1 | Very low | 153 Ų | 153 | 116.2 Ų | 116.2 | 75% | 0.754 | 70% | 0.704 | S | S | * | * | trans | -101.9 | 7 | -177.1 | -69.3 | -163.6 | 176.9 | 0 | 0 | 115.2 | T530 T531 P536 | T530-M534 HydrophobicContact CG2-CE 4.46Å; T531-M534 PolarHBondContact O-N 3.01Å; M534-P536 VanDerWaalsContact O-CD 3.3Å; M534-P536 WeakPolarHBondContact O-CD 3.48Å | ||
| 535 | L | 39.5 | Very low | 39.9 | Very low | 143 Ų | 143 | 121.6 Ų | 121.6 | 75% | 0.749 | 72% | 0.718 | S | S | * | * | trans | -90.9 | 109.8 | 173 | -78.6 | 167.1 | 0 | 0 | 0 | 110.8 | T537 | L535-T537 PolarHBondContact O-N 3.17Š| ||
| 536 | P | 37.4 | Very low | 38.6 | Very low | 113 Ų | 113 | 123.9 Ų | 123.9 | 73% | 0.734 | 74% | 0.736 | S | S | * | * | trans | -74.5 | 114 | 177.4 | 29.8 | -33.7 | 0 | 0 | 0 | 110.9 | M534 T538 | M534-P536 VanDerWaalsContact O-CD 3.3Å; M534-P536 WeakPolarHBondContact O-CD 3.48Å; P536-T538 PolarHBondContact O-N 2.88Å; P536-T538 VanDerWaalsContact O-N 3.17Å | ||
| 537 | T | 37.8 | Very low | 37.6 | Very low | 140 Ų | 140 | 122.7 Ų | 122.7 | 86% | 0.859 | 74% | 0.743 | S | S | * | * | trans | -73.7 | 101.6 | 173.4 | 51.2 | 0 | 0 | 0 | 0 | 111.2 | L535 | L535-T537 PolarHBondContact O-N 3.17Š| ||
| 538 | T | 33.3 | Very low | 36.8 | Very low | 126 Ų | 126 | 120.9 Ų | 120.9 | 77% | 0.773 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -92 | 125.1 | 166.5 | 38.3 | 0 | 0 | 0 | 0 | 110.8 | P536 | P536-T538 PolarHBondContact O-N 2.88Å; P536-T538 VanDerWaalsContact O-N 3.17Å |
| 539 | P | 37.4 | Very low | 36.1 | Very low | 116 Ų | 116 | 123 Ų | 123 | 75% | 0.753 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -83.6 | 133.9 | 177.1 | 31.9 | -32.6 | 0 | 0 | 0 | 111.3 | ||
| 540 | P | 36 | Very low | 35.5 | Very low | 133 Ų | 133 | 122.4 Ų | 122.4 | 86% | 0.864 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -79.1 | 131.6 | 168.7 | 31.6 | -32 | 0 | 0 | 0 | 110.6 | ||
| 541 | A | 34.9 | Very low | 34.8 | Very low | 106 Ų | 106 | 126.2 Ų | 126.2 | 88% | 0.876 | 78% | 0.777 | S | S | * | * | trans | -139.8 | 119.4 | 171.1 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 542 | G | 30.9 | Very low | 34.1 | Very low | 81 Ų | 81 | 128.8 Ų | 128.8 | 84% | 0.835 | 79% | 0.786 | S | S | * | * | trans | 145.2 | 66.9 | -178 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 543 | E | 31.9 | Very low | 33.3 | Very low | 162 Ų | 162 | 132.7 Ų | 132.7 | 76% | 0.757 | 80% | 0.795 | S | S | * | * | trans | -76.5 | 152.8 | 159.6 | -137.8 | -157.4 | -104.9 | 0 | 0 | 109 | K545 | E543-K545 PolarHBondContact OE2-N 2.98Å; E543-K545 VanDerWaalsContact OE2-N 3.17Å | ||
| 544 | P | 38.1 | Very low | 33.2 | Very low | 109 Ų | 109 | 130.7 Ų | 130.7 | 71% | 0.708 | 80% | 0.797 | S | S | * | * | -148.1 | 143.7 | 83.3 | 36.6 | -18.7 | 0 | 0 | 0 | 117.1 | |||||
| 545 | K | 28.8 | Very low | 32.6 | Very low | 185 Ų | 185 | 127.3 Ų | 127.3 | 80% | 0.804 | 80% | 0.801 | S | S | * | * | trans | 44.2 | 115.5 | 139.2 | -56.5 | 176.8 | -177.1 | 177.7 | 0 | 120.7 | E543 | E543-K545 PolarHBondContact OE2-N 2.98Å; E543-K545 VanDerWaalsContact OE2-N 3.17Å | ||
| 546 | S | 25.5 | Very low | 32.1 | Very low | 124 Ų | 124 | 130.6 Ų | 130.6 | 87% | 0.867 | 81% | 0.805 | S | S | * | * | -153.4 | 156.2 | 113.7 | -162.8 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 547 | C | 27.6 | Very low | 31.9 | Very low | 124 Ų | 124 | 131.1 Ų | 131.1 | 84% | 0.838 | 81% | 0.807 | S | S | * | * | trans | -98.5 | 147.4 | -174.8 | -52.2 | 0 | 0 | 0 | 0 | 112 | ||||
| 548 | S | 27.3 | Very low | 31.5 | Very low | 107 Ų | 107 | 131 Ų | 131 | 75% | 0.748 | 80% | 0.801 | S | S | * | * | 176.6 | 155.7 | 118.4 | -163.9 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 549 | N | 29.1 | Very low | 31.5 | Very low | 153 Ų | 153 | 130 Ų | 130 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | trans | -37.7 | 158.2 | 164.6 | -41.1 | -21.9 | 0 | 0 | 0 | 114 | ||||
| 550 | G | 29.8 | Very low | 31.2 | Very low | 67 Ų | 67 | 132.5 Ų | 132.5 | 69% | 0.691 | 80% | 0.796 | S | S | * | * | cis | 133.2 | 161.1 | 9.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 551 | D | 29 | Very low | 31.1 | Very low | 158 Ų | 158 | 131.3 Ų | 131.3 | 85% | 0.845 | 79% | 0.786 | S | S | * | * | trans | 71.5 | 137.4 | 164.9 | -73.1 | -26.7 | 0 | 0 | 0 | 122.9 | ||||
| 552 | I | 30.8 | Very low | 31 | Very low | 160 Ų | 160 | 134.4 Ų | 134.4 | 82% | 0.821 | 78% | 0.782 | S | S | * | * | trans | 85.3 | 133.7 | 141.5 | -71.6 | 164.6 | 0 | 0 | 0 | 121.6 | ||||
| 553 | L | 28.8 | Very low | 31.3 | Very low | 157 Ų | 157 | 142 Ų | 142 | 82% | 0.822 | 80% | 0.801 | S | S | * | * | trans | -94.8 | 178.9 | 170.3 | -70.1 | 163.6 | 0 | 0 | 0 | 110.7 | ||||
| 554 | P | 42.9 | Very low | 31.3 | Very low | 128 Ų | 128 | 141 Ų | 141 | 83% | 0.831 | 80% | 0.803 | S | S | * | * | cis | -121.6 | -178.6 | -30.7 | 35.8 | -20.4 | 0 | 0 | 0 | 111.5 | ||||
| 555 | G | 28.5 | Very low | 30.9 | Very low | 81 Ų | 81 | 142.6 Ų | 142.6 | 84% | 0.835 | 81% | 0.808 | S | S | * | * | trans | -153.3 | 152.8 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 556 | Y | 27.9 | Very low | 31 | Very low | 213 Ų | 213 | 140.3 Ų | 140.3 | 84% | 0.835 | 81% | 0.808 | S | S | * | * | trans | -115 | 175.6 | 179.1 | -158.3 | -104.7 | 0 | 0 | 0 | 109.8 | ||||
| 557 | T | 33.5 | Very low | 31.4 | Very low | 124 Ų | 124 | 141.2 Ų | 141.2 | 76% | 0.761 | 81% | 0.805 | S | S | * | * | trans | 65.6 | 155.8 | 178.9 | 65.1 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 558 | D | 29.3 | Very low | 31.6 | Very low | 138 Ų | 138 | 142.3 Ų | 142.3 | 74% | 0.738 | 80% | 0.803 | S | S | * | * | cis | -170.2 | 177.9 | -42.1 | -145.5 | -35.6 | 0 | 0 | 0 | 107.4 | ||||
| 559 | V | 33.3 | Very low | 31.9 | Very low | 105 Ų | 105 | 144.7 Ų | 144.7 | 64% | 0.636 | 81% | 0.807 | S | S | * | * | trans | 69.3 | 125.1 | 158.3 | 171.2 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 560 | E | 31.7 | Very low | 32.1 | Very low | 168 Ų | 168 | 144.1 Ų | 144.1 | 79% | 0.785 | 81% | 0.806 | S | S | * | * | trans | 22.9 | 144.5 | 137.3 | -42.8 | 178.6 | 120 | 0 | 0 | 119.9 | ||||
| 561 | T | 33.4 | Very low | 32.2 | Very low | 108 Ų | 108 | 150 Ų | 150 | 66% | 0.663 | 82% | 0.815 | S | S | * | * | -163.5 | 150.3 | 50.3 | 47.2 | 0 | 0 | 0 | 0 | 115.3 | |||||
| 562 | H | 33.3 | Very low | 32.5 | Very low | 170 Ų | 170 | 149.3 Ų | 149.3 | 79% | 0.787 | 81% | 0.812 | S | S | * | * | trans | 67.9 | 118 | 141.2 | -72.7 | -49.3 | 0 | 0 | 0 | 123.7 | ||||
| 563 | I | 36.7 | Very low | 32.7 | Very low | 240 Ų | 240 | 148.4 Ų | 148.4 | 100% | 1.231 | 81% | 0.811 | S | S | * | * | trans | 79.9 | 0 | 148.6 | -54.9 | 165.7 | 0 | 0 | 0 | 115.9 |
Retrieved 563 of 563 residues in 450.2 ms
(Link to these results)