| 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 | 40.9 | Very low | 50 | Low | 242 Ų | 242 | 136.9 Ų | 136.9 | 100% | 1.192 | 82% | 0.821 | S | S | * | * | 0 | 99.4 | 0 | -65.6 | 169.6 | 75 | 0 | 0 | 107.1 | |||||
| 2 | S | 40.9 | Very low | 50.3 | Low | 126 Ų | 126 | 141 Ų | 141 | 88% | 0.881 | 83% | 0.825 | S | S | * | * | trans | -74.4 | 126.7 | 175.2 | -70.6 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 3 | T | 64 | Low | 50.3 | Low | 142 Ų | 142 | 142 Ų | 142 | 87% | 0.871 | 82% | 0.823 | S | S | * | * | trans | -103.6 | 104.4 | 157.8 | 49.2 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 4 | G | 50 | Low | 50.4 | Low | 72 Ų | 72 | 139.1 Ų | 139.1 | 74% | 0.742 | 80% | 0.802 | S | S | * | * | trans | -64.1 | 147 | 178 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 5 | S | 47 | Very low | 50.2 | Low | 126 Ų | 126 | 139.3 Ų | 139.3 | 88% | 0.881 | 80% | 0.799 | S | S | * | * | trans | -49.2 | 134.4 | 176 | -53.2 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 6 | L | 55.6 | Low | 49.6 | Very low | 172 Ų | 172 | 134.6 Ų | 134.6 | 90% | 0.901 | 79% | 0.791 | S | S | * | * | trans | -93.1 | 112.4 | 160.8 | -164.7 | 71 | 0 | 0 | 0 | 107.7 | ||||
| 7 | S | 47.6 | Very low | 49.7 | Very low | 80 Ų | 80 | 134.6 Ų | 134.6 | 56% | 0.559 | 79% | 0.785 | S | S | * | * | trans | -57.5 | 128.3 | -178.6 | 44 | 0 | 0 | 0 | 0 | 114.7 | V9 | S7-V9 PolarHBondContact O-N 3.43Å; S7-V9 VanDerWaalsContact O-N 3.08Å | ||
| 8 | D | 47.8 | Very low | 49.4 | Very low | 148 Ų | 148 | 136.1 Ų | 136.1 | 79% | 0.791 | 79% | 0.788 | S | S | * | * | 14.5 | 67.6 | 114.8 | -128.9 | -100 | 0 | 0 | 0 | 118.1 | |||||
| 9 | V | 54.1 | Low | 49.4 | Very low | 114 Ų | 114 | 139 Ų | 139 | 69% | 0.691 | 79% | 0.791 | S | S | * | * | trans | -143.7 | 55.7 | 168.2 | -65.6 | 0 | 0 | 0 | 0 | 112.8 | S7 | S7-V9 PolarHBondContact O-N 3.43Å; S7-V9 VanDerWaalsContact O-N 3.08Å | ||
| 10 | D | 49.1 | Very low | 49 | Very low | 142 Ų | 142 | 142.7 Ų | 142.7 | 76% | 0.759 | 80% | 0.798 | S | S | * | * | trans | -144.2 | 22.4 | 175.7 | -80.4 | -56.7 | 0 | 0 | 0 | 114.4 | ||||
| 11 | D | 53.4 | Low | 48.8 | Very low | 142 Ų | 142 | 139.1 Ų | 139.1 | 76% | 0.759 | 79% | 0.793 | S | S | * | * | S | Bend | trans | -93.2 | -6.8 | -176.1 | -84.3 | -65.9 | 0 | 0 | 0 | 115.9 | ||
| 12 | E | 52.7 | Low | 48.9 | Very low | 186 Ų | 186 | 133.3 Ų | 133.3 | 87% | 0.869 | 78% | 0.777 | S | S | * | * | S | Bend | trans | -98.3 | -16.3 | -179.7 | -80.1 | -151.3 | 132.7 | 0 | 0 | 115.8 | L14 | E12-L14 VanDerWaalsContact C-N 3.32Å; E12-L14 PolarHBondContact O-N 3.08Å |
| 13 | L | 51.2 | Low | 48.6 | Very low | 154 Ų | 154 | 133.4 Ų | 133.4 | 81% | 0.806 | 78% | 0.777 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.4 | -10.5 | -171.8 | -166.7 | 59.8 | 0 | 0 | 0 | 114.2 | ||
| 14 | L | 51.6 | Low | 47.3 | Very low | 101 Ų | 101 | 130.3 Ų | 130.3 | 53% | 0.529 | 77% | 0.773 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -89.3 | -5.9 | -177 | -157.9 | 58.8 | 0 | 0 | 0 | 114.1 | E12 I17 V90 | E12-L14 VanDerWaalsContact C-N 3.32Å; E12-L14 PolarHBondContact O-N 3.08Å; L14-I17 HydrophobicContact CD1-CD1 4.47Å; L14-V90 HydrophobicContact CD2-CG2 4.3Å |
| 15 | D | 47.1 | Very low | 46.7 | Very low | 142 Ų | 142 | 136 Ų | 136 | 76% | 0.759 | 78% | 0.778 | S | S | * | * | S | Bend | trans | -82.6 | -18.6 | -178.8 | -140.6 | 46.6 | 0 | 0 | 0 | 113.1 | ||
| 16 | G | 41 | Very low | 45.9 | Very low | 64 Ų | 64 | 136.7 Ų | 136.7 | 66% | 0.66 | 77% | 0.771 | S | S | * | * | G | 310 helix | trans | -77.8 | -17.1 | -177.1 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||
| 17 | I | 50.6 | Low | 45.3 | Very low | 135 Ų | 135 | 134.8 Ų | 134.8 | 69% | 0.692 | 77% | 0.773 | S | S | * | * | G | 310 helix | trans | -83 | -15.6 | -173.4 | -77.9 | 162.8 | 0 | 0 | 0 | 113.2 | L14 | L14-I17 HydrophobicContact CD1-CD1 4.47Š|
| 18 | L | 44.7 | Very low | 44.6 | Very low | 162 Ų | 162 | 138.3 Ų | 138.3 | 85% | 0.848 | 79% | 0.785 | S | S | * | * | G | 310 helix | trans | -106.5 | 4.6 | -177.2 | -66.4 | 175.2 | 0 | 0 | 0 | 114.2 | ||
| 19 | K | 48.3 | Very low | 43.9 | Very low | 191 Ų | 191 | 140.5 Ų | 140.5 | 83% | 0.83 | 79% | 0.79 | S | S | * | * | trans | -108 | 43.9 | -176.4 | -154.1 | 89.2 | 173.9 | -170.9 | 0 | 113.2 | ||||
| 20 | F | 43 | Very low | 43.1 | Very low | 212 Ų | 212 | 139.1 Ų | 139.1 | 93% | 0.93 | 79% | 0.786 | S | S | * | * | trans | -121.9 | 92.8 | 164.5 | -169.4 | -95.3 | 0 | 0 | 0 | 109.1 | ||||
| 21 | G | 43.5 | Very low | 42.7 | Very low | 68 Ų | 68 | 139 Ų | 139 | 70% | 0.701 | 79% | 0.791 | S | S | * | * | S | Bend | trans | 142.6 | 71.7 | 170.2 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||
| 22 | S | 43.3 | Very low | 42 | Very low | 121 Ų | 121 | 139.6 Ų | 139.6 | 85% | 0.846 | 79% | 0.789 | S | S | * | * | trans | 168 | 104.5 | 142.1 | -87.1 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 23 | S | 35.1 | Very low | 41.1 | Very low | 127 Ų | 127 | 138.8 Ų | 138.8 | 89% | 0.888 | 79% | 0.785 | S | S | * | * | trans | 169.8 | 107.6 | 133 | 39.7 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 24 | G | 36.9 | Very low | 40.5 | Very low | 77 Ų | 77 | 136.2 Ų | 136.2 | 79% | 0.794 | 78% | 0.78 | S | S | * | * | trans | -82.8 | 142.8 | 165 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 25 | K | 36.1 | Very low | 40.2 | Very low | 193 Ų | 193 | 136.5 Ų | 136.5 | 84% | 0.839 | 79% | 0.79 | S | S | * | * | -173.6 | 104.3 | 129.2 | -131.5 | 152.4 | 174.6 | 162.6 | 0 | 111.4 | |||||
| 26 | D | 32.1 | Very low | 40 | Very low | 139 Ų | 139 | 137.5 Ų | 137.5 | 74% | 0.743 | 80% | 0.796 | S | S | * | * | trans | 39.4 | 116.5 | 135.4 | -41.8 | -35.7 | 0 | 0 | 0 | 121 | ||||
| 27 | S | 41.2 | Very low | 39.4 | Very low | 133 Ų | 133 | 140.2 Ų | 140.2 | 93% | 0.93 | 80% | 0.803 | S | S | * | * | -167.5 | 134.7 | 120.8 | -76.5 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 28 | N | 33.8 | Very low | 39.1 | Very low | 153 Ų | 153 | 142.7 Ų | 142.7 | 82% | 0.818 | 81% | 0.812 | S | S | * | * | trans | -72.8 | 140.2 | -168.2 | -119.6 | -3 | 0 | 0 | 0 | 114.6 | ||||
| 29 | E | 32.9 | Very low | 38.5 | Very low | 194 Ų | 194 | 139.3 Ų | 139.3 | 91% | 0.907 | 82% | 0.816 | S | S | * | * | trans | -156.1 | 122.7 | 130.9 | -170.8 | 160.7 | 101.3 | 0 | 0 | 108.8 | ||||
| 30 | S | 38.2 | Very low | 38.4 | Very low | 86 Ų | 86 | 135.1 Ų | 135.1 | 60% | 0.601 | 81% | 0.811 | S | S | * | * | trans | -86 | 136.5 | -171.4 | -52.6 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 31 | T | 40.2 | Very low | 38.2 | Very low | 140 Ų | 140 | 132.7 Ų | 132.7 | 86% | 0.859 | 81% | 0.807 | S | S | * | * | trans | -147.3 | 121.5 | 144.3 | -38.2 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 32 | E | 37.9 | Very low | 38 | Very low | 154 Ų | 154 | 134.5 Ų | 134.5 | 72% | 0.72 | 80% | 0.804 | S | S | * | * | trans | -67.5 | 145.4 | 176.9 | -42.1 | -161.3 | 174.4 | 0 | 0 | 107.3 | ||||
| 33 | E | 34.1 | Very low | 37.7 | Very low | 169 Ų | 169 | 135.3 Ų | 135.3 | 79% | 0.79 | 80% | 0.804 | S | S | * | * | 178.8 | 159.8 | 88.3 | -68.5 | -78.9 | 109.2 | 0 | 0 | 107.7 | |||||
| 34 | S | 39.8 | Very low | 37.8 | Very low | 99 Ų | 99 | 137.8 Ų | 137.8 | 69% | 0.692 | 80% | 0.802 | S | S | * | * | trans | -58.6 | 150.3 | -173.3 | 33.7 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 35 | S | 44.1 | Very low | 37.7 | Very low | 107 Ų | 107 | 137.4 Ų | 137.4 | 75% | 0.748 | 80% | 0.798 | S | S | * | * | trans | 62.7 | 122.8 | 137.7 | 73.7 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 36 | N | 42.2 | Very low | 37.7 | Very low | 163 Ų | 163 | 139.2 Ų | 139.2 | 87% | 0.872 | 80% | 0.799 | S | S | * | * | trans | 60.2 | 126.1 | 151.8 | -96.5 | 12 | 0 | 0 | 0 | 119 | ||||
| 37 | C | 29.2 | Very low | 38 | Very low | 121 Ų | 121 | 143.5 Ų | 143.5 | 82% | 0.818 | 81% | 0.805 | S | S | * | * | -171.4 | 139.7 | 108.7 | 53.4 | 0 | 0 | 0 | 0 | 112 | |||||
| 38 | E | 43.9 | Very low | 38.2 | Very low | 187 Ų | 187 | 148.8 Ų | 148.8 | 87% | 0.874 | 81% | 0.805 | S | S | * | * | trans | -53.4 | 137.3 | 161.5 | -57.4 | -151.8 | 121.3 | 0 | 0 | 111.4 | S40 | E38-S40 PolarHBondContact O-N 3.43Š| ||
| 39 | G | 32.1 | Very low | 38.3 | Very low | 91 Ų | 91 | 150.5 Ų | 150.5 | 94% | 0.938 | 81% | 0.808 | S | S | * | * | trans | -86.3 | 98.7 | 167.8 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 40 | S | 46.5 | Very low | 38.9 | Very low | 104 Ų | 104 | 146 Ų | 146 | 73% | 0.727 | 80% | 0.804 | S | S | * | * | trans | -109.4 | 140.3 | 165.2 | -130.9 | 0 | 0 | 0 | 0 | 109 | E38 | E38-S40 PolarHBondContact O-N 3.43Š| ||
| 41 | L | 38.1 | Very low | 39.1 | Very low | 161 Ų | 161 | 147.7 Ų | 147.7 | 84% | 0.843 | 82% | 0.816 | S | S | * | * | trans | 179.2 | 140.5 | 146.3 | -128.5 | 65.9 | 0 | 0 | 0 | 110.4 | ||||
| 42 | V | 39.2 | Very low | 39.2 | Very low | 106 Ų | 106 | 144.2 Ų | 144.2 | 64% | 0.642 | 81% | 0.807 | S | S | * | * | cis | -170.9 | 150.5 | -13.4 | -104.8 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 43 | T | 37.7 | Very low | 39.5 | Very low | 137 Ų | 137 | 146.8 Ų | 146.8 | 84% | 0.84 | 82% | 0.816 | S | S | * | * | -167.8 | 111.6 | 112.2 | 26 | 0 | 0 | 0 | 0 | 109.5 | |||||
| 44 | E | 36.7 | Very low | 40.2 | Very low | 180 Ų | 180 | 148.7 Ų | 148.7 | 84% | 0.841 | 82% | 0.822 | S | S | * | * | trans | 8.7 | 132.4 | 145.7 | -74.9 | -81.8 | 140.8 | 0 | 0 | 117.3 | ||||
| 45 | G | 34.8 | Very low | 40.7 | Very low | 69 Ų | 69 | 155.8 Ų | 155.8 | 71% | 0.711 | 83% | 0.833 | S | S | * | * | cis | 141.7 | 147.7 | 45.9 | 0 | 0 | 0 | 0 | 0 | 104.1 | ||||
| 46 | R | 36.6 | Very low | 41.1 | Very low | 231 Ų | 231 | 160.6 Ų | 160.6 | 87% | 0.872 | 84% | 0.841 | S | S | * | * | cis | -172.7 | 146.9 | 42.7 | -101.7 | -177.7 | 175.7 | -151.1 | -0.4 | 108.8 | ||||
| 47 | R | 39.6 | Very low | 41.2 | Very low | 229 Ų | 229 | 157.5 Ų | 157.5 | 86% | 0.864 | 83% | 0.832 | S | S | * | * | trans | 50.9 | 124.9 | 137.4 | -117 | 172.3 | -175.8 | -101.4 | 2.4 | 121.7 | ||||
| 48 | R | 44.8 | Very low | 42.3 | Very low | 244 Ų | 244 | 157.1 Ų | 157.1 | 92% | 0.921 | 83% | 0.831 | S | S | * | * | trans | -61.2 | 138.8 | 159.4 | -65.5 | 173.3 | 175 | 171.4 | -1.9 | 111.3 | ||||
| 49 | E | 35.7 | Very low | 42.7 | Very low | 189 Ų | 189 | 154 Ų | 154 | 88% | 0.883 | 83% | 0.829 | S | S | * | * | trans | -144.8 | 128.5 | 153.2 | -149.4 | 176 | 164.8 | 0 | 0 | 109.4 | ||||
| 50 | A | 45.7 | Very low | 43.7 | Very low | 99 Ų | 99 | 161.2 Ų | 161.2 | 82% | 0.818 | 83% | 0.828 | S | S | * | * | trans | -89.6 | 126.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 51 | S | 41.8 | Very low | 43.8 | Very low | 122 Ų | 122 | 166 Ų | 166 | 85% | 0.853 | 84% | 0.836 | S | S | * | * | trans | -159.3 | 124.1 | 156.8 | -170.6 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 52 | G | 42.5 | Very low | 44.6 | Very low | 66 Ų | 66 | 164 Ų | 164 | 68% | 0.68 | 84% | 0.836 | S | S | * | * | trans | -71.1 | 149.7 | -178 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 53 | K | 45.2 | Very low | 45.6 | Very low | 208 Ų | 208 | 162.2 Ų | 162.2 | 90% | 0.904 | 83% | 0.831 | S | S | * | * | trans | -160.8 | 113.7 | 145.3 | -108.9 | 164.4 | -173.5 | 177.9 | 0 | 110.8 | R55 | K53-R55 PolarHBondContact O-N 3.21Š| ||
| 54 | K | 48.6 | Very low | 46.2 | Very low | 209 Ų | 209 | 160.8 Ų | 160.8 | 91% | 0.909 | 83% | 0.825 | S | S | * | * | trans | -46.2 | 124.5 | 164.5 | -132.5 | 176.8 | -175.3 | 175.7 | 0 | 110.3 | ||||
| 55 | R | 49.8 | Very low | 47 | Very low | 249 Ų | 249 | 160.3 Ų | 160.3 | 94% | 0.94 | 82% | 0.82 | S | S | * | * | trans | -144.5 | 125.4 | 145.4 | -66 | -167.4 | 79.6 | 170.6 | 0.8 | 110.4 | K53 | K53-R55 PolarHBondContact O-N 3.21Š| ||
| 56 | K | 52.8 | Low | 48 | Very low | 207 Ų | 207 | 159.1 Ų | 159.1 | 90% | 0.9 | 81% | 0.807 | S | S | * | * | trans | -97.8 | 128.1 | 179 | 168.3 | 176.5 | 178 | 176.1 | 0 | 108.3 | ||||
| 57 | S | 43.2 | Very low | 48.9 | Very low | 99 Ų | 99 | 152.4 Ų | 152.4 | 69% | 0.692 | 79% | 0.792 | S | S | * | * | trans | 176.7 | 98 | 151.5 | 52.3 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 58 | S | 53.3 | Low | 49.8 | Very low | 113 Ų | 113 | 144.7 Ų | 144.7 | 79% | 0.79 | 78% | 0.777 | S | S | * | * | 57.5 | 94.6 | 100.2 | 68.5 | 0 | 0 | 0 | 0 | 114 | |||||
| 59 | S | 51.9 | Low | 50.6 | Low | 121 Ų | 121 | 139.8 Ų | 139.8 | 85% | 0.846 | 76% | 0.764 | S | S | * | * | -170.3 | 131.9 | 124.5 | 50.9 | 0 | 0 | 0 | 0 | 110 | |||||
| 60 | R | 53.5 | Low | 51.8 | Low | 242 Ų | 242 | 137.4 Ų | 137.4 | 91% | 0.913 | 75% | 0.753 | S | S | * | * | trans | -69.8 | 126 | -179.1 | -62 | 163.9 | 174.1 | 166.4 | -4.2 | 109 | ||||
| 61 | K | 49.2 | Very low | 52.9 | Low | 206 Ų | 206 | 138.9 Ų | 138.9 | 90% | 0.896 | 74% | 0.744 | S | S | * | * | trans | -140.3 | 87.2 | 145.9 | -74.2 | -168.6 | 179.8 | 176.4 | 0 | 108.3 | A63 | K61-A63 VanDerWaalsContact C-N 3.34Å; K61-A63 PolarHBondContact O-N 3.39Å | ||
| 62 | S | 54.7 | Low | 54.5 | Low | 119 Ų | 119 | 135.1 Ų | 135.1 | 83% | 0.832 | 72% | 0.724 | S | S | * | * | trans | -63.6 | 93.9 | 165.6 | 46.7 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 63 | A | 59.7 | Low | 56.4 | Low | 67 Ų | 67 | 139.1 Ų | 139.1 | 55% | 0.554 | 72% | 0.723 | S | S | * | * | trans | -57.3 | 144.9 | 160.5 | 0 | 0 | 0 | 0 | 0 | 108.6 | K61 K65 | K61-A63 VanDerWaalsContact C-N 3.34Å; K61-A63 PolarHBondContact O-N 3.39Å; A63-K65 PolarHBondContact O-N 3.02Å | ||
| 64 | P | 50.9 | Low | 58.4 | Low | 107 Ų | 107 | 132.8 Ų | 132.8 | 70% | 0.695 | 70% | 0.696 | S | S | * | * | trans | -72.1 | 81.1 | -178.3 | 31.3 | -33.2 | 0 | 0 | 0 | 109 | G66 | P64-G66 PolarHBondContact O-N 3.44Š| ||
| 65 | K | 53.6 | Low | 60.3 | Low | 171 Ų | 171 | 127.6 Ų | 127.6 | 74% | 0.743 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -65.7 | -3.1 | 179.9 | -98.5 | 167.4 | 172 | 174.1 | 0 | 113.9 | A63 | A63-K65 PolarHBondContact O-N 3.02Å |
| 66 | G | 54.8 | Low | 62.2 | Low | 43 Ų | 43 | 122.7 Ų | 122.7 | 44% | 0.443 | 67% | 0.669 | S | S | . | * | H | α-helix | trans | -74.8 | -32.9 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | P64 Q70 | P64-G66 PolarHBondContact O-N 3.44Å; G66-Q70 WeakPolarHBondContact O-CG 3.28Å; G66-Q70 PolarHBondContact O-N 2.83Å |
| 67 | V | 54.8 | Low | 64.3 | Low | 90 Ų | 90 | 119 Ų | 119 | 55% | 0.545 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -82.7 | -47 | -171.8 | -71.1 | 0 | 0 | 0 | 0 | 113.2 | Q69 Q70 E71 | V67-Q69 PolarHBondContact O-N 3.48Å; V67-Q70 PolarHBondContact O-N 2.93Å; V67-Q70 VanDerWaalsContact O-N 3.13Å; V67-E71 PolarHBondContact O-N 3.05Å |
| 68 | A | 59.8 | Low | 66.8 | Low | 68 Ų | 68 | 118 Ų | 118 | 56% | 0.562 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -67.2 | -33.1 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | G72 | A68-G72 PolarHBondContact O-N 3.01Å |
| 69 | Q | 60.4 | Low | 68.8 | Low | 140 Ų | 140 | 114.5 Ų | 114.5 | 65% | 0.654 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -71.5 | -29.6 | 173.8 | -88.3 | -173.3 | -38.1 | 0 | 0 | 112.8 | V67 K73 | V67-Q69 PolarHBondContact O-N 3.48Å; Q69-K73 WeakPolarHBondContact O-CG 2.91Å; Q69-K73 PolarHBondContact O-N 3.06Å |
| 70 | Q | 62.5 | Low | 70.9 | Confident | 139 Ų | 139 | 111.2 Ų | 111.2 | 65% | 0.65 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -74.8 | -39.1 | 175.2 | -76.9 | -179 | 4.2 | 0 | 0 | 111.5 | G66 V67 K73 Q74 | G66-Q70 WeakPolarHBondContact O-CG 3.28Å; G66-Q70 PolarHBondContact O-N 2.83Å; V67-Q70 PolarHBondContact O-N 2.93Å; V67-Q70 VanDerWaalsContact O-N 3.13Å; Q70-K73 PolarHBondContact O-N 3.05Å; Q70-Q74 WeakPolarHBondContact O-CB 3.49Å; Q70-Q74 PolarHBondContact O-N 3.33Å |
| 71 | E | 67.7 | Low | 73.1 | Confident | 131 Ų | 131 | 102.5 Ų | 102.5 | 61% | 0.612 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -62.3 | -44.3 | 175.2 | -73 | -179.8 | 150.5 | 0 | 0 | 112.3 | V67 K73 Q74 V75 | V67-E71 PolarHBondContact O-N 3.05Å; E71-K73 VanDerWaalsContact C-N 3.33Å; E71-K73 PolarHBondContact O-N 3.19Å; E71-Q74 WeakPolarHBondContact O-CB 3.43Å; E71-Q74 PolarHBondContact O-N 3.43Å; E71-Q74 VanDerWaalsContact O-N 3.1Å; E71-V75 WeakPolarHBondContact O-CG2 3.4Å; E71-V75 PolarHBondContact O-N 3.45Å |
| 72 | G | 75.8 | Confident | 75.4 | Confident | 43 Ų | 43 | 95 Ų | 95 | 44% | 0.443 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -59.6 | -40.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | A68 Q74 V75 Q76 | A68-G72 PolarHBondContact O-N 3.01Å; G72-Q74 VanDerWaalsContact C-N 3.34Å; G72-V75 PolarHBondContact O-N 3.28Å; G72-Q76 PolarHBondContact O-N 3.37Å |
| 73 | K | 82.4 | Confident | 77.4 | Confident | 150 Ų | 150 | 98.1 Ų | 98.1 | 65% | 0.652 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -65.3 | -38.7 | 174.4 | -70.9 | 176.6 | -178.7 | -174.4 | 0 | 111.9 | Q69 Q70 E71 Q76 R77 | Q69-K73 WeakPolarHBondContact O-CG 2.91Å; Q69-K73 PolarHBondContact O-N 3.06Å; Q70-K73 PolarHBondContact O-N 3.05Å; E71-K73 VanDerWaalsContact C-N 3.33Å; E71-K73 PolarHBondContact O-N 3.19Å; K73-Q76 PolarHBondContact O-N 2.59Å; K73-R77 WeakPolarHBondContact O-CB 3.33Å; K73-R77 PolarHBondContact O-N 2.79Å |
| 74 | Q | 87.1 | Confident | 79.3 | Confident | 75 Ų | 75 | 98.8 Ų | 98.8 | 35% | 0.35 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -67.2 | -40 | 178.2 | -179.4 | 54.6 | 25.9 | 0 | 0 | 112 | Q70 E71 G72 R77 N78 | Q70-Q74 WeakPolarHBondContact O-CB 3.49Å; Q70-Q74 PolarHBondContact O-N 3.33Å; E71-Q74 WeakPolarHBondContact O-CB 3.43Å; E71-Q74 PolarHBondContact O-N 3.43Å; E71-Q74 VanDerWaalsContact O-N 3.1Å; G72-Q74 VanDerWaalsContact C-N 3.34Å; Q74-R77 VanDerWaalsContact CD-NH2 3.26Å; Q74-R77 PolarHBondContact O-N 3.41Å; Q74-R77 VanDerWaalsContact OE1-CZ 3.29Å; Q74-N78 PolarHBondContact NE2-ND2 3.33Å; Q74-N78 PolarHBondContact NE2-OD1 3.1Å; Q74-N78 WeakPolarHBondContact O-CB 3.48Å; Q74-N78 PolarHBondContact O-N 3.41Å |
| 75 | V | 87.6 | Confident | 81.5 | Confident | 99 Ų | 99 | 100.7 Ų | 100.7 | 60% | 0.6 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63.3 | -44.8 | 173.4 | 174.2 | 0 | 0 | 0 | 0 | 111 | E71 G72 R77 N78 A79 | E71-V75 WeakPolarHBondContact O-CG2 3.4Å; E71-V75 PolarHBondContact O-N 3.45Å; G72-V75 PolarHBondContact O-N 3.28Å; V75-R77 PolarHBondContact O-N 2.96Å; V75-N78 PolarHBondContact O-N 3Å; V75-A79 WeakPolarHBondContact O-CB 3.32Å; V75-A79 PolarHBondContact O-N 3.31Å |
| 76 | Q | 91.5 | Very high | 83.7 | Confident | 146 Ų | 146 | 94.7 Ų | 94.7 | 68% | 0.682 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -61.6 | -43.8 | 177.2 | -171.2 | 178.2 | 30.8 | 0 | 0 | 111.9 | G72 K73 A79 A80 | G72-Q76 PolarHBondContact O-N 3.37Å; K73-Q76 PolarHBondContact O-N 2.59Å; Q76-A79 PolarHBondContact O-N 3.45Å; Q76-A80 WeakPolarHBondContact O-CB 3.28Å; Q76-A80 PolarHBondContact O-N 3.35Å |
| 77 | R | 95.8 | Very high | 85.7 | Confident | 131 Ų | 131 | 99.9 Ų | 99.9 | 49% | 0.494 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.9 | -43.6 | 175.3 | -171.2 | 179.3 | 70.5 | 91.2 | -5.6 | 111.8 | K73 Q74 V75 A80 N81 | K73-R77 WeakPolarHBondContact O-CB 3.33Å; K73-R77 PolarHBondContact O-N 2.79Å; Q74-R77 VanDerWaalsContact CD-NH2 3.26Å; Q74-R77 PolarHBondContact O-N 3.41Å; Q74-R77 VanDerWaalsContact OE1-CZ 3.29Å; V75-R77 PolarHBondContact O-N 2.96Å; R77-A80 PolarHBondContact O-N 3.07Å; R77-N81 WeakPolarHBondContact O-CB 3.5Å; R77-N81 VanDerWaalsContact O-CG 3.22Å; R77-N81 PolarHBondContact O-N 3.28Å; R77-N81 PolarHBondContact O-ND2 2.96Å |
| 78 | N | 96.1 | Very high | 87.8 | Confident | 78 Ų | 78 | 98.6 Ų | 98.6 | 42% | 0.417 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.6 | -43.1 | 176.8 | -76.3 | -6.2 | 0 | 0 | 0 | 111.8 | Q74 V75 N81 A82 | Q74-N78 PolarHBondContact NE2-ND2 3.33Å; Q74-N78 PolarHBondContact NE2-OD1 3.1Å; Q74-N78 WeakPolarHBondContact O-CB 3.48Å; Q74-N78 PolarHBondContact O-N 3.41Å; V75-N78 PolarHBondContact O-N 3Å; N78-N81 PolarHBondContact O-N 3.43Å; N78-A82 WeakPolarHBondContact O-CB 3.39Å; N78-A82 PolarHBondContact O-N 3.22Å |
| 79 | A | 95.2 | Very high | 89.7 | Confident | 38 Ų | 38 | 103.9 Ų | 103.9 | 31% | 0.314 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.4 | -41.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | V75 Q76 A82 R83 | V75-A79 WeakPolarHBondContact O-CB 3.32Å; V75-A79 PolarHBondContact O-N 3.31Å; Q76-A79 PolarHBondContact O-N 3.45Å; A79-A82 PolarHBondContact O-N 3.26Å; A79-R83 WeakPolarHBondContact O-CG 3.44Å; A79-R83 PolarHBondContact O-N 2.96Å; A79-R83 VanDerWaalsContact O-N 3.1Å |
| 80 | A | 96.5 | Very high | 91.5 | Very high | 52 Ų | 52 | 101.1 Ų | 101.1 | 43% | 0.43 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63 | -44.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q76 R77 A82 R83 E84 | Q76-A80 WeakPolarHBondContact O-CB 3.28Å; Q76-A80 PolarHBondContact O-N 3.35Å; R77-A80 PolarHBondContact O-N 3.07Å; A80-A82 VanDerWaalsContact C-N 3.31Å; A80-A82 PolarHBondContact O-N 2.9Å; A80-R83 WeakPolarHBondContact O-CB 3.42Å; A80-R83 PolarHBondContact O-N 3.25Å; A80-E84 PolarHBondContact O-N 3.16Å |
| 81 | N | 98.3 | Very high | 93.2 | Very high | 59 Ų | 59 | 98.8 Ų | 98.8 | 32% | 0.316 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.2 | -38.4 | 175.9 | -71 | -19.9 | 0 | 0 | 0 | 112.1 | R77 N78 R83 E84 R85 | R77-N81 WeakPolarHBondContact O-CB 3.5Å; R77-N81 VanDerWaalsContact O-CG 3.22Å; R77-N81 PolarHBondContact O-N 3.28Å; R77-N81 PolarHBondContact O-ND2 2.96Å; N78-N81 PolarHBondContact O-N 3.43Å; N81-R83 VanDerWaalsContact C-N 3.34Å; N81-E84 PolarHBondContact O-N 3.18Å; N81-R85 WeakPolarHBondContact O-CG 3.41Å; N81-R85 PolarHBondContact O-N 3.29Å |
| 82 | A | 97.7 | Very high | 94.6 | Very high | 49 Ų | 49 | 95.4 Ų | 95.4 | 41% | 0.405 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -61.7 | -43.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | N78 A79 A80 R85 A86 | N78-A82 WeakPolarHBondContact O-CB 3.39Å; N78-A82 PolarHBondContact O-N 3.22Å; A79-A82 PolarHBondContact O-N 3.26Å; A80-A82 VanDerWaalsContact C-N 3.31Å; A80-A82 PolarHBondContact O-N 2.9Å; A82-R85 PolarHBondContact O-N 3.37Å; A82-A86 PolarHBondContact O-N 3.08Å |
| 83 | R | 98.3 | Very high | 95.6 | Very high | 184 Ų | 184 | 99.9 Ų | 99.9 | 69% | 0.694 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -62.1 | -44.1 | 175.2 | -66 | 172.8 | -147.2 | -106.2 | 4.6 | 112.1 | A79 A80 N81 R85 A86 R87 | A79-R83 WeakPolarHBondContact O-CG 3.44Å; A79-R83 PolarHBondContact O-N 2.96Å; A79-R83 VanDerWaalsContact O-N 3.1Å; A80-R83 WeakPolarHBondContact O-CB 3.42Å; A80-R83 PolarHBondContact O-N 3.25Å; N81-R83 VanDerWaalsContact C-N 3.34Å; R83-R85 VanDerWaalsContact C-N 3.35Å; R83-R85 PolarHBondContact O-N 3.44Å; R83-A86 WeakPolarHBondContact O-CB 3.45Å; R83-A86 PolarHBondContact O-N 3.49Å; R83-R87 PolarHBondContact O-N 3.02Å |
| 84 | E | 98.3 | Very high | 96.3 | Very high | 82 Ų | 82 | 95.2 Ų | 95.2 | 38% | 0.383 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -66.5 | -37.8 | 179.1 | -175.7 | 57.8 | -164.8 | 0 | 0 | 111.8 | A80 N81 A86 R87 M88 | A80-E84 PolarHBondContact O-N 3.16Å; N81-E84 PolarHBondContact O-N 3.18Å; E84-A86 VanDerWaalsContact C-N 3.32Å; E84-A86 PolarHBondContact O-N 2.86Å; E84-R87 WeakPolarHBondContact O-CB 3.15Å; E84-R87 PolarHBondContact O-N 3.29Å; E84-R87 IonicContact OE1-CZ 3.45Å; E84-R87 IonicContact OE1-NE 3.13Å; E84-R87 PolarHBondContact OE1-NE 3.19Å; E84-R87 VanDerWaalsContact OE1-NE 3.13Å; E84-R87 IonicContact OE1-NH2 2.86Å; E84-R87 PolarHBondContact OE1-NH2 2.64Å; E84-R87 WeakPolarHBondContact OE2-CD 3.33Å; E84-R87 IonicContact OE2-CZ 3.82Å; E84-R87 IonicContact OE2-NE 2.87Å; E84-R87 PolarHBondContact OE2-NE 3.09Å; E84-R87 IonicContact OE2-NH2 3.91Å; E84-M88 HydrophobicContact CG-CG 4.45Å; E84-M88 WeakPolarHBondContact O-CB 3.28Å; E84-M88 WeakPolarHBondContact O-CG 3.34Å; E84-M88 PolarHBondContact O-N 2.91Å |
| 85 | R | 98.5 | Very high | 96.8 | Very high | 147 Ų | 147 | 93.7 Ų | 93.7 | 56% | 0.555 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -59.5 | -44.2 | 171.6 | -70.8 | -174.3 | -155.1 | 107.2 | -3.6 | 111.5 | N81 A82 R83 M88 R89 | N81-R85 WeakPolarHBondContact O-CG 3.41Å; N81-R85 PolarHBondContact O-N 3.29Å; A82-R85 PolarHBondContact O-N 3.37Å; R83-R85 VanDerWaalsContact C-N 3.35Å; R83-R85 PolarHBondContact O-N 3.44Å; R85-M88 PolarHBondContact O-N 3.17Å; R85-R89 WeakPolarHBondContact O-CG 3.46Å; R85-R89 PolarHBondContact O-N 3.38Å |
| 86 | A | 98.1 | Very high | 97.2 | Very high | 44 Ų | 44 | 92.2 Ų | 92.2 | 36% | 0.364 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -60.7 | -45.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | A82 R83 E84 M88 R89 V90 | A82-A86 PolarHBondContact O-N 3.08Å; R83-A86 WeakPolarHBondContact O-CB 3.45Å; R83-A86 PolarHBondContact O-N 3.49Å; E84-A86 VanDerWaalsContact C-N 3.32Å; E84-A86 PolarHBondContact O-N 2.86Å; A86-M88 VanDerWaalsContact C-N 3.3Å; A86-M88 PolarHBondContact O-N 2.78Å; A86-R89 WeakPolarHBondContact O-CB 3.14Å; A86-R89 PolarHBondContact O-N 3.13Å; A86-V90 PolarHBondContact O-N 3.36Å; A86-V90 VanDerWaalsContact O-N 3.13Å |
| 87 | R | 98.6 | Very high | 97.4 | Very high | 152 Ų | 152 | 94 Ų | 94 | 57% | 0.574 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -57.1 | -44.4 | 174.8 | -163.1 | -176.3 | 80.4 | 95 | 4.1 | 111.8 | R83 E84 V90 L91 | R83-R87 PolarHBondContact O-N 3.02Å; E84-R87 WeakPolarHBondContact O-CB 3.15Å; E84-R87 PolarHBondContact O-N 3.29Å; E84-R87 IonicContact OE1-CZ 3.45Å; E84-R87 IonicContact OE1-NE 3.13Å; E84-R87 PolarHBondContact OE1-NE 3.19Å; E84-R87 VanDerWaalsContact OE1-NE 3.13Å; E84-R87 IonicContact OE1-NH2 2.86Å; E84-R87 PolarHBondContact OE1-NH2 2.64Å; E84-R87 WeakPolarHBondContact OE2-CD 3.33Å; E84-R87 IonicContact OE2-CZ 3.82Å; E84-R87 IonicContact OE2-NE 2.87Å; E84-R87 PolarHBondContact OE2-NE 3.09Å; E84-R87 IonicContact OE2-NH2 3.91Å; R87-V90 PolarHBondContact O-N 2.97Å; R87-L91 PolarHBondContact O-N 3.4Å |
| 88 | M | 98.6 | Very high | 97.4 | Very high | 64 Ų | 64 | 90.2 Ų | 90.2 | 32% | 0.315 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -68.9 | -33 | 178.8 | -71.3 | -57.3 | -60.1 | 0 | 0 | 113.1 | E84 R85 A86 L91 S92 | E84-M88 HydrophobicContact CG-CG 4.45Å; E84-M88 WeakPolarHBondContact O-CB 3.28Å; E84-M88 WeakPolarHBondContact O-CG 3.34Å; E84-M88 PolarHBondContact O-N 2.91Å; R85-M88 PolarHBondContact O-N 3.17Å; A86-M88 VanDerWaalsContact C-N 3.3Å; A86-M88 PolarHBondContact O-N 2.78Å; M88-L91 HydrophobicContact CE-CD2 4.04Å; M88-L91 PolarHBondContact O-N 3.28Å; M88-L91 HydrophobicContact SD-CD2 4.05Å; M88-S92 WeakPolarHBondContact O-CB 3.47Å; M88-S92 PolarHBondContact O-N 3.45Å; M88-S92 PolarHBondContact O-OG 2.94Å |
| 89 | R | 98 | Very high | 97.3 | Very high | 179 Ų | 179 | 88.9 Ų | 88.9 | 68% | 0.675 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -62 | -46.8 | 172.5 | -73.7 | 173.4 | -177.7 | 160.5 | -3.9 | 111.2 | R85 A86 L91 S92 K93 | R85-R89 WeakPolarHBondContact O-CG 3.46Å; R85-R89 PolarHBondContact O-N 3.38Å; A86-R89 WeakPolarHBondContact O-CB 3.14Å; A86-R89 PolarHBondContact O-N 3.13Å; R89-L91 PolarHBondContact O-N 3.21Å; R89-S92 PolarHBondContact O-N 3.47Å; R89-K93 PolarHBondContact O-N 2.89Å |
| 90 | V | 98.3 | Very high | 97.3 | Very high | 82 Ų | 82 | 91.7 Ų | 91.7 | 50% | 0.497 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -59.3 | -47.4 | 176.1 | 176.4 | 0 | 0 | 0 | 0 | 110.9 | L14 A86 R87 S92 K93 A94 | L14-V90 HydrophobicContact CD2-CG2 4.3Å; A86-V90 PolarHBondContact O-N 3.36Å; A86-V90 VanDerWaalsContact O-N 3.13Å; R87-V90 PolarHBondContact O-N 2.97Å; V90-S92 VanDerWaalsContact C-N 3.31Å; V90-S92 PolarHBondContact O-N 2.9Å; V90-K93 PolarHBondContact O-N 3.4Å; V90-A94 PolarHBondContact O-N 3.04Å |
| 91 | L | 98.2 | Very high | 97.1 | Very high | 89 Ų | 89 | 92.2 Ų | 92.2 | 47% | 0.466 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -59.2 | -43.3 | 176.7 | 178.5 | 59.7 | 0 | 0 | 0 | 111.8 | R87 M88 R89 A94 F95 | R87-L91 PolarHBondContact O-N 3.4Å; M88-L91 HydrophobicContact CE-CD2 4.04Å; M88-L91 PolarHBondContact O-N 3.28Å; M88-L91 HydrophobicContact SD-CD2 4.05Å; R89-L91 PolarHBondContact O-N 3.21Å; L91-A94 PolarHBondContact O-N 3.44Å; L91-F95 WeakPolarHBondContact O-CB 3.1Å; L91-F95 PolarHBondContact O-N 3.27Å |
| 92 | S | 97.7 | Very high | 96.8 | Very high | 61 Ų | 61 | 89.9 Ų | 89.9 | 43% | 0.427 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -66.1 | -40.3 | -179.9 | -56.3 | 0 | 0 | 0 | 0 | 111.4 | M88 R89 V90 F95 S96 | M88-S92 WeakPolarHBondContact O-CB 3.47Å; M88-S92 PolarHBondContact O-N 3.45Å; M88-S92 PolarHBondContact O-OG 2.94Å; R89-S92 PolarHBondContact O-N 3.47Å; V90-S92 VanDerWaalsContact C-N 3.31Å; V90-S92 PolarHBondContact O-N 2.9Å; S92-F95 PolarHBondContact O-N 3.33Å; S92-S96 PolarHBondContact O-N 3.03Å; S92-S96 PolarHBondContact O-OG 2.81Å |
| 93 | K | 97.4 | Very high | 96.3 | Very high | 137 Ų | 137 | 89.3 Ų | 89.3 | 60% | 0.596 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -61.9 | -45.6 | 174 | -173.5 | 173 | -177.4 | 173.3 | 0 | 111.5 | R89 V90 F95 S96 R97 | R89-K93 PolarHBondContact O-N 2.89Å; V90-K93 PolarHBondContact O-N 3.4Å; K93-F95 VanDerWaalsContact C-N 3.31Å; K93-F95 PolarHBondContact O-N 3.08Å; K93-S96 PolarHBondContact O-N 3.32Å; K93-R97 WeakPolarHBondContact O-CG 3.26Å; K93-R97 PolarHBondContact O-N 2.79Å; K93-R97 VanDerWaalsContact O-N 3.07Å |
| 94 | A | 97.7 | Very high | 95.6 | Very high | 52 Ų | 52 | 89 Ų | 89 | 43% | 0.43 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -61.6 | -40.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | V90 L91 R97 L98 | V90-A94 PolarHBondContact O-N 3.04Å; L91-A94 PolarHBondContact O-N 3.44Å; A94-R97 WeakPolarHBondContact O-CB 3.39Å; A94-R97 PolarHBondContact O-N 3.22Å; A94-L98 PolarHBondContact O-N 2.97Å |
| 95 | F | 97.3 | Very high | 95 | Very high | 42 Ų | 42 | 86.1 Ų | 86.1 | 18% | 0.184 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -65.8 | -40.6 | 177.5 | -166.5 | -92.5 | 0 | 0 | 0 | 112.6 | L91 S92 K93 R97 L98 K99 K113 T116 L117 | L91-F95 WeakPolarHBondContact O-CB 3.1Å; L91-F95 PolarHBondContact O-N 3.27Å; S92-F95 PolarHBondContact O-N 3.33Å; K93-F95 VanDerWaalsContact C-N 3.31Å; K93-F95 PolarHBondContact O-N 3.08Å; F95-R97 VanDerWaalsContact C-N 3.34Å; F95-R97 PolarHBondContact O-N 2.93Å; F95-L98 WeakPolarHBondContact O-CB 3.44Å; F95-L98 PolarHBondContact O-N 3.32Å; F95-K99 HydrophobicContact CD1-CD 4.46Å; F95-K99 HydrophobicContact CD1-CG 4.47Å; F95-K99 HydrophobicContact CE1-CD 4.18Å; F95-K99 HydrophobicContact CE1-CG 4.15Å; F95-K99 PolarHBondContact O-N 3.04Å; F95-K99 VanDerWaalsContact O-N 3.08Å; F95-K113 HydrophobicContact CE1-CG 4.18Å; F95-K113 HydrophobicContact CE2-CB 4.39Å; F95-K113 HydrophobicContact CE2-CG 4.29Å; F95-K113 VanDerWaalsContact CZ-CA 3.47Å; F95-K113 HydrophobicContact CZ-CB 4.09Å; F95-K113 HydrophobicContact CZ-CG 3.96Å; F95-T116 HydrophobicContact CE1-CG2 4.22Å; F95-T116 HydrophobicContact CE2-CG2 4.21Å; F95-T116 VanDerWaalsContact CZ-CB 3.41Å; F95-T116 HydrophobicContact CZ-CG2 3.71Å; F95-T116 WeakPolarHBondContact CZ-OG1 3.28Å; F95-L117 HydrophobicContact CE2-CG 4.48Å |
| 96 | S | 95.3 | Very high | 94.4 | Very high | 69 Ų | 69 | 82 Ų | 82 | 48% | 0.483 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -62.4 | -40.5 | 173.6 | -64.3 | 0 | 0 | 0 | 0 | 112.2 | S92 K93 L98 K99 T100 | S92-S96 PolarHBondContact O-N 3.03Å; S92-S96 PolarHBondContact O-OG 2.81Å; K93-S96 PolarHBondContact O-N 3.32Å; S96-L98 VanDerWaalsContact C-N 3.3Å; S96-L98 PolarHBondContact O-N 2.82Å; S96-K99 WeakPolarHBondContact O-CB 3.36Å; S96-K99 PolarHBondContact O-N 3.19Å; S96-T100 PolarHBondContact O-N 2.91Å; S96-T100 VanDerWaalsContact O-N 3.16Å |
| 97 | R | 95.8 | Very high | 93.7 | Very high | 183 Ų | 183 | 85 Ų | 85 | 69% | 0.691 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -62.2 | -37.5 | 174.3 | -69.8 | 172.8 | 64.5 | -160.7 | 0.3 | 112.3 | K93 A94 F95 T100 S101 | K93-R97 WeakPolarHBondContact O-CG 3.26Å; K93-R97 PolarHBondContact O-N 2.79Å; K93-R97 VanDerWaalsContact O-N 3.07Å; A94-R97 WeakPolarHBondContact O-CB 3.39Å; A94-R97 PolarHBondContact O-N 3.22Å; F95-R97 VanDerWaalsContact C-N 3.34Å; F95-R97 PolarHBondContact O-N 2.93Å; R97-T100 PolarHBondContact O-N 3.44Å; R97-T100 PolarHBondContact O-OG1 3.38Å; R97-S101 PolarHBondContact O-N 2.83Å |
| 98 | L | 96.3 | Very high | 93 | Very high | 52 Ų | 52 | 84 Ų | 84 | 27% | 0.272 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -62.1 | -45.2 | 174.2 | -179.7 | 63.8 | 0 | 0 | 0 | 110.6 | A94 F95 S96 T100 S101 T116 L117 A120 | A94-L98 PolarHBondContact O-N 2.97Å; F95-L98 WeakPolarHBondContact O-CB 3.44Å; F95-L98 PolarHBondContact O-N 3.32Å; S96-L98 VanDerWaalsContact C-N 3.3Å; S96-L98 PolarHBondContact O-N 2.82Å; L98-T100 VanDerWaalsContact C-N 3.33Å; L98-T100 PolarHBondContact O-N 2.6Å; L98-S101 PolarHBondContact O-N 2.76Å; L98-S101 VanDerWaalsContact O-N 3.09Å; L98-S101 PolarHBondContact O-OG 2.91Å; L98-T116 HydrophobicContact CD2-CG2 3.93Å; L98-T116 HydrophobicContact CG-CG2 3.97Å; L98-L117 HydrophobicContact CD2-CD2 4.19Å; L98-A120 HydrophobicContact CD1-CB 3.9Å; L98-A120 HydrophobicContact CD2-CB 4.36Å; L98-A120 HydrophobicContact CG-CB 4.39Å |
| 99 | K | 94.3 | Very high | 92.5 | Very high | 49 Ų | 49 | 81.3 Ų | 81.3 | 21% | 0.213 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -57 | -44.9 | 177.4 | -71.1 | -178.1 | 62.4 | -172.8 | 0 | 112.7 | F95 S96 S101 L102 T109 T116 | F95-K99 HydrophobicContact CD1-CD 4.46Å; F95-K99 HydrophobicContact CD1-CG 4.47Å; F95-K99 HydrophobicContact CE1-CD 4.18Å; F95-K99 HydrophobicContact CE1-CG 4.15Å; F95-K99 PolarHBondContact O-N 3.04Å; F95-K99 VanDerWaalsContact O-N 3.08Å; S96-K99 WeakPolarHBondContact O-CB 3.36Å; S96-K99 PolarHBondContact O-N 3.19Å; K99-S101 PolarHBondContact O-N 3.26Å; K99-L102 WeakPolarHBondContact O-CB 3.44Å; K99-L102 PolarHBondContact O-N 3.02Å; K99-T109 WeakPolarHBondContact CE-O 3.42Å; K99-T109 PolarHBondContact NZ-O 2.88Å; K99-T116 HydrophobicContact CG-CG2 3.69Å |
| 100 | T | 93.8 | Very high | 92.1 | Very high | 98 Ų | 98 | 82.1 Ų | 82.1 | 60% | 0.601 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -71 | -15.1 | -179.2 | 55.7 | 0 | 0 | 0 | 0 | 113.4 | S96 R97 L98 | S96-T100 PolarHBondContact O-N 2.91Å; S96-T100 VanDerWaalsContact O-N 3.16Å; R97-T100 PolarHBondContact O-N 3.44Å; R97-T100 PolarHBondContact O-OG1 3.38Å; L98-T100 VanDerWaalsContact C-N 3.33Å; L98-T100 PolarHBondContact O-N 2.6Å |
| 101 | S | 93.5 | Very high | 91.6 | Very high | 63 Ų | 63 | 79.2 Ų | 79.2 | 44% | 0.441 | 41% | 0.414 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.4 | -10.3 | 174.5 | 73.5 | 0 | 0 | 0 | 0 | 113.6 | R97 L98 K99 | R97-S101 PolarHBondContact O-N 2.83Å; L98-S101 PolarHBondContact O-N 2.76Å; L98-S101 VanDerWaalsContact O-N 3.09Å; L98-S101 PolarHBondContact O-OG 2.91Å; K99-S101 PolarHBondContact O-N 3.26Å |
| 102 | L | 91.8 | Very high | 91.4 | Very high | 9 Ų | 9 | 77.5 Ų | 77.5 | 5% | 0.047 | 41% | 0.409 | C | S | . | . | S | Bend | trans | -75.9 | 126.7 | 179.1 | -65.1 | 178.5 | 0 | 0 | 0 | 110.1 | K99 V105 L111 T116 L119 A120 | K99-L102 WeakPolarHBondContact O-CB 3.44Å; K99-L102 PolarHBondContact O-N 3.02Å; L102-V105 HydrophobicContact CB-CB 4.28Å; L102-V105 HydrophobicContact CB-CG2 4.11Å; L102-L111 HydrophobicContact CD1-CD1 3.72Å; L102-T116 HydrophobicContact CD1-CG2 3.98Å; L102-L119 HydrophobicContact CD1-CB 3.75Å; L102-L119 HydrophobicContact CD1-CD1 3.87Å; L102-L119 HydrophobicContact CD1-CG 4.48Å; L102-L119 HydrophobicContact CD2-CB 3.98Å; L102-L119 HydrophobicContact CG-CB 4.49Å; L102-A120 HydrophobicContact CD2-CB 4Å |
| 103 | P | 86.9 | Confident | 91.3 | Very high | 37 Ų | 37 | 81.3 Ų | 81.3 | 24% | 0.24 | 42% | 0.418 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -73.1 | 154.5 | 176.1 | 35 | -38.8 | 0 | 0 | 0 | 110.1 | V105 Y123 | P103-V105 PolarHBondContact O-N 3.44Å; P103-Y123 HydrophobicContact CB-CE2 4.48Å; P103-Y123 HydrophobicContact CG-CD1 4.29Å; P103-Y123 HydrophobicContact CG-CD2 3.65Å; P103-Y123 HydrophobicContact CG-CE1 4.23Å; P103-Y123 HydrophobicContact CG-CE2 3.6Å; P103-Y123 HydrophobicContact CG-CG 4.01Å |
| 104 | W | 83.4 | Confident | 91.1 | Very high | 179 Ų | 179 | 79.2 Ų | 79.2 | 68% | 0.678 | 41% | 0.413 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 63.2 | 9.1 | 174.5 | -37.5 | 107.4 | 0 | 0 | 0 | 115.5 | H142 | W104-H142 AromaticContact CD1-NE2 3.29Å; W104-H142 VanDerWaalsContact CD1-NE2 3.29Å; W104-H142 AromaticContact CG-NE2 3.68Å; W104-H142 AromaticContact NE1-NE2 3.78Å |
| 105 | V | 86.4 | Confident | 90.8 | Very high | 21 Ų | 21 | 79.6 Ų | 79.6 | 13% | 0.127 | 41% | 0.408 | C | S | . | . | S | Bend | trans | -110.5 | 115.3 | 174.1 | -179.8 | 0 | 0 | 0 | 0 | 108 | L102 P103 T109 L111 L119 | L102-V105 HydrophobicContact CB-CB 4.28Å; L102-V105 HydrophobicContact CB-CG2 4.11Å; P103-V105 PolarHBondContact O-N 3.44Å; V105-T109 HydrophobicContact CG1-CG2 4.05Å; V105-L111 HydrophobicContact CG1-CD1 3.7Å; V105-L111 HydrophobicContact CG1-CG 4.16Å; V105-L111 HydrophobicContact CG2-CD1 4.43Å; V105-L119 HydrophobicContact CG2-CD1 4.25Å |
| 106 | P | 85.9 | Confident | 90.6 | Very high | 61 Ų | 61 | 77.6 Ų | 77.6 | 40% | 0.396 | 40% | 0.399 | S | S | . | . | trans | -55.5 | 139.8 | 171.9 | -25.3 | 33.4 | 0 | 0 | 0 | 111.4 | D108 T109 | P106-D108 WeakPolarHBondContact CB-OD1 3.43Å; P106-D108 PolarHBondContact O-N 2.9Å; P106-T109 WeakPolarHBondContact CB-OG1 3.36Å; P106-T109 WeakPolarHBondContact CD-OG1 3.47Å; P106-T109 WeakPolarHBondContact O-CB 3.41Å; P106-T109 PolarHBondContact O-N 3.18Å; P106-T109 PolarHBondContact O-OG1 3.26Å | ||
| 107 | P | 81.9 | Confident | 90.6 | Very high | 105 Ų | 105 | 78.6 Ų | 78.6 | 68% | 0.682 | 40% | 0.398 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.1 | -24.9 | -172.6 | 25.5 | -34.5 | 0 | 0 | 0 | 113.8 | T109 | P107-T109 VanDerWaalsContact C-N 3.28Š|
| 108 | D | 84.4 | Confident | 90.3 | Very high | 133 Ų | 133 | 76.8 Ų | 76.8 | 71% | 0.711 | 39% | 0.392 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.1 | -5 | 176 | 61.8 | -38.2 | 0 | 0 | 0 | 113.5 | P106 K110 | P106-D108 WeakPolarHBondContact CB-OD1 3.43Å; P106-D108 PolarHBondContact O-N 2.9Å; D108-K110 PolarHBondContact O-N 3.37Å |
| 109 | T | 88.1 | Confident | 90.1 | Very high | 7 Ų | 7 | 75.1 Ų | 75.1 | 4% | 0.043 | 38% | 0.383 | C | S | . | . | trans | -63.7 | 129.6 | 179.6 | -57.9 | 0 | 0 | 0 | 0 | 111.9 | K99 V105 P106 P107 L111 W148 | K99-T109 WeakPolarHBondContact CE-O 3.42Å; K99-T109 PolarHBondContact NZ-O 2.88Å; V105-T109 HydrophobicContact CG1-CG2 4.05Å; P106-T109 WeakPolarHBondContact CB-OG1 3.36Å; P106-T109 WeakPolarHBondContact CD-OG1 3.47Å; P106-T109 WeakPolarHBondContact O-CB 3.41Å; P106-T109 PolarHBondContact O-N 3.18Å; P106-T109 PolarHBondContact O-OG1 3.26Å; P107-T109 VanDerWaalsContact C-N 3.28Å; T109-L111 HydrophobicContact CG2-CD2 3.96Å; T109-L111 HydrophobicContact CG2-CG 4.03Å; T109-L111 PolarHBondContact O-N 2.89Å; T109-W148 HydrophobicContact CG2-CD2 3.78Å; T109-W148 HydrophobicContact CG2-CE3 4.43Å; T109-W148 HydrophobicContact CG2-CG 4.19Å; T109-W148 HydrophobicContact CG2-CH2 4.17Å; T109-W148 HydrophobicContact CG2-CZ2 3.48Å; T109-W148 VanDerWaalsContact CG2-CZ2 3.48Å; T109-W148 VanDerWaalsContact CG2-NE1 3.33Å | ||
| 110 | K | 88.9 | Confident | 90.1 | Very high | 196 Ų | 196 | 73.4 Ų | 73.4 | 85% | 0.852 | 38% | 0.378 | S | S | * | . | trans | -80.1 | 83.1 | 174 | -64 | -176.8 | -177.1 | 176 | 0 | 110.5 | D108 | D108-K110 PolarHBondContact O-N 3.37Š| ||
| 111 | L | 89.1 | Confident | 90 | Very high | 21 Ų | 21 | 72.5 Ų | 72.5 | 11% | 0.11 | 38% | 0.375 | C | S | . | . | trans | -86.3 | 140 | 169.6 | -64.4 | 179.6 | 0 | 0 | 0 | 111.8 | L102 V105 T109 T116 L119 | L102-L111 HydrophobicContact CD1-CD1 3.72Å; V105-L111 HydrophobicContact CG1-CD1 3.7Å; V105-L111 HydrophobicContact CG1-CG 4.16Å; V105-L111 HydrophobicContact CG2-CD1 4.43Å; T109-L111 HydrophobicContact CG2-CD2 3.96Å; T109-L111 HydrophobicContact CG2-CG 4.03Å; T109-L111 PolarHBondContact O-N 2.89Å; L111-T116 WeakPolarHBondContact CB-OG1 3.22Å; L111-L119 HydrophobicContact CD1-CD1 3.69Å; L111-L119 HydrophobicContact CD2-CD1 4Å | ||
| 112 | S | 93.6 | Very high | 89.7 | Confident | 53 Ų | 53 | 71 Ų | 71 | 37% | 0.371 | 37% | 0.365 | S | S | . | . | trans | -71.3 | 165.6 | 170.7 | 82.9 | 0 | 0 | 0 | 0 | 111.5 | L114 D115 T116 | S112-L114 VanDerWaalsContact C-N 3.29Å; S112-L114 PolarHBondContact O-N 3.44Å; S112-L114 PolarHBondContact OG-N 2.72Å; S112-D115 WeakPolarHBondContact CB-OD2 3.35Å; S112-D115 PolarHBondContact O-N 3.46Å; S112-D115 PolarHBondContact OG-N 3.42Å; S112-D115 PolarHBondContact OG-OD2 3.07Å; S112-T116 PolarHBondContact O-N 3.3Å; S112-T116 VanDerWaalsContact O-N 3.1Å; S112-T116 PolarHBondContact O-OG1 2.93Å | ||
| 113 | K | 94.8 | Very high | 89.7 | Confident | 140 Ų | 140 | 73.8 Ų | 73.8 | 61% | 0.609 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -57.8 | -44.9 | 175.4 | -75.5 | -174.8 | -178.2 | 177.6 | 0 | 111.9 | F95 L117 | F95-K113 HydrophobicContact CE1-CG 4.18Å; F95-K113 HydrophobicContact CE2-CB 4.39Å; F95-K113 HydrophobicContact CE2-CG 4.29Å; F95-K113 VanDerWaalsContact CZ-CA 3.47Å; F95-K113 HydrophobicContact CZ-CB 4.09Å; F95-K113 HydrophobicContact CZ-CG 3.96Å; K113-L117 VanDerWaalsContact O-CG 3.28Å; K113-L117 WeakPolarHBondContact O-CG 3.34Å; K113-L117 PolarHBondContact O-N 2.89Å |
| 114 | L | 94.4 | Very high | 90 | Very high | 93 Ų | 93 | 75.9 Ų | 75.9 | 49% | 0.487 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -67.3 | -45.8 | -178.8 | 179.5 | 60.8 | 0 | 0 | 0 | 111.7 | S112 T116 L117 R118 | S112-L114 VanDerWaalsContact C-N 3.29Å; S112-L114 PolarHBondContact O-N 3.44Å; S112-L114 PolarHBondContact OG-N 2.72Å; L114-T116 PolarHBondContact O-N 3.17Å; L114-L117 PolarHBondContact O-N 3.31Å; L114-L117 VanDerWaalsContact O-N 3.16Å; L114-R118 HydrophobicContact CD1-CG 4.39Å; L114-R118 WeakPolarHBondContact O-CG 3.46Å; L114-R118 PolarHBondContact O-N 3.46Å |
| 115 | D | 90.7 | Very high | 90.2 | Very high | 60 Ų | 60 | 69.9 Ų | 69.9 | 32% | 0.321 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -64.9 | -42.6 | -176.9 | -60 | -37.1 | 0 | 0 | 0 | 111 | S112 L117 R118 L119 | S112-D115 WeakPolarHBondContact CB-OD2 3.35Å; S112-D115 PolarHBondContact O-N 3.46Å; S112-D115 PolarHBondContact OG-N 3.42Å; S112-D115 PolarHBondContact OG-OD2 3.07Å; D115-L117 VanDerWaalsContact C-N 3.27Å; D115-L117 PolarHBondContact O-N 3.16Å; D115-R118 PolarHBondContact O-N 3.1Å; D115-R118 VanDerWaalsContact O-N 3.17Å; D115-L119 WeakPolarHBondContact O-CB 3.34Å; D115-L119 VanDerWaalsContact O-CG 3.22Å; D115-L119 WeakPolarHBondContact O-CG 3.36Å; D115-L119 PolarHBondContact O-N 3.06Å |
| 116 | T | 93.3 | Very high | 90.1 | Very high | 0 Ų | 0 | 71.5 Ų | 71.5 | 0% | 0 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -57.5 | -42.2 | 175.1 | -50.2 | 0 | 0 | 0 | 0 | 111.3 | F95 L98 K99 L102 L111 S112 L114 A120 | F95-T116 HydrophobicContact CE1-CG2 4.22Å; F95-T116 HydrophobicContact CE2-CG2 4.21Å; F95-T116 VanDerWaalsContact CZ-CB 3.41Å; F95-T116 HydrophobicContact CZ-CG2 3.71Å; F95-T116 WeakPolarHBondContact CZ-OG1 3.28Å; L98-T116 HydrophobicContact CD2-CG2 3.93Å; L98-T116 HydrophobicContact CG-CG2 3.97Å; K99-T116 HydrophobicContact CG-CG2 3.69Å; L102-T116 HydrophobicContact CD1-CG2 3.98Å; L111-T116 WeakPolarHBondContact CB-OG1 3.22Å; S112-T116 PolarHBondContact O-N 3.3Å; S112-T116 VanDerWaalsContact O-N 3.1Å; S112-T116 PolarHBondContact O-OG1 2.93Å; L114-T116 PolarHBondContact O-N 3.17Å; T116-A120 VanDerWaalsContact O-CB 3.26Å; T116-A120 WeakPolarHBondContact O-CB 3.44Å; T116-A120 PolarHBondContact O-N 3.44Å |
| 117 | L | 95.2 | Very high | 90.3 | Very high | 91 Ų | 91 | 71.8 Ų | 71.8 | 48% | 0.476 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -67.5 | -39.7 | 178.3 | -67.9 | 173.7 | 0 | 0 | 0 | 112.2 | F95 L98 K113 L114 D115 S121 | F95-L117 HydrophobicContact CE2-CG 4.48Å; L98-L117 HydrophobicContact CD2-CD2 4.19Å; K113-L117 VanDerWaalsContact O-CG 3.28Å; K113-L117 WeakPolarHBondContact O-CG 3.34Å; K113-L117 PolarHBondContact O-N 2.89Å; L114-L117 PolarHBondContact O-N 3.31Å; L114-L117 VanDerWaalsContact O-N 3.16Å; D115-L117 VanDerWaalsContact C-N 3.27Å; D115-L117 PolarHBondContact O-N 3.16Å; L117-S121 WeakPolarHBondContact O-CB 3.46Å; L117-S121 PolarHBondContact O-N 3.1Å; L117-S121 PolarHBondContact O-OG 3.47Å |
| 118 | R | 90.4 | Very high | 90.6 | Very high | 145 Ų | 145 | 75.2 Ų | 75.2 | 55% | 0.547 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -63.2 | -50.7 | 175.1 | -74 | 177.2 | 170.4 | 174.2 | -4 | 111.1 | L114 D115 A120 S121 S122 | L114-R118 HydrophobicContact CD1-CG 4.39Å; L114-R118 WeakPolarHBondContact O-CG 3.46Å; L114-R118 PolarHBondContact O-N 3.46Å; D115-R118 PolarHBondContact O-N 3.1Å; D115-R118 VanDerWaalsContact O-N 3.17Å; R118-A120 VanDerWaalsContact C-N 3.35Å; R118-A120 PolarHBondContact O-N 2.6Å; R118-S121 PolarHBondContact O-N 3.01Å; R118-S122 PolarHBondContact O-N 3.18Å; R118-S122 PolarHBondContact O-OG 2.87Å |
| 119 | L | 91.2 | Very high | 90.6 | Very high | 17 Ų | 17 | 74.6 Ų | 74.6 | 9% | 0.089 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -59.5 | -44.9 | 178.8 | -66.7 | 173.1 | 0 | 0 | 0 | 111.2 | L102 V105 L111 D115 S121 S122 Y123 N145 L146 | L102-L119 HydrophobicContact CD1-CB 3.75Å; L102-L119 HydrophobicContact CD1-CD1 3.87Å; L102-L119 HydrophobicContact CD1-CG 4.48Å; L102-L119 HydrophobicContact CD2-CB 3.98Å; L102-L119 HydrophobicContact CG-CB 4.49Å; V105-L119 HydrophobicContact CG2-CD1 4.25Å; L111-L119 HydrophobicContact CD1-CD1 3.69Å; L111-L119 HydrophobicContact CD2-CD1 4Å; D115-L119 WeakPolarHBondContact O-CB 3.34Å; D115-L119 VanDerWaalsContact O-CG 3.22Å; D115-L119 WeakPolarHBondContact O-CG 3.36Å; D115-L119 PolarHBondContact O-N 3.06Å; L119-S121 VanDerWaalsContact C-N 3.35Å; L119-S121 PolarHBondContact O-N 3.38Å; L119-S122 PolarHBondContact O-N 3.19Å; L119-Y123 WeakPolarHBondContact O-CB 3.47Å; L119-Y123 PolarHBondContact O-N 2.86Å; L119-N145 WeakPolarHBondContact CD2-O 3.47Å; L119-L146 HydrophobicContact CB-CD2 3.99Å; L119-L146 HydrophobicContact CD2-CB 4.4Å; L119-L146 HydrophobicContact CD2-CD2 3.46Å; L119-L146 VanDerWaalsContact CD2-CD2 3.46Å; L119-L146 HydrophobicContact CD2-CG 4.4Å; L119-L146 HydrophobicContact CG-CD2 4.32Å; L119-L146 WeakPolarHBondContact O-CD2 3.21Å |
| 120 | A | 94 | Very high | 90.5 | Very high | 12 Ų | 12 | 75.9 Ų | 75.9 | 10% | 0.099 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -60.7 | -43.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | L98 L102 T116 R118 Y123 I124 | L98-A120 HydrophobicContact CD1-CB 3.9Å; L98-A120 HydrophobicContact CD2-CB 4.36Å; L98-A120 HydrophobicContact CG-CB 4.39Å; L102-A120 HydrophobicContact CD2-CB 4Å; T116-A120 VanDerWaalsContact O-CB 3.26Å; T116-A120 WeakPolarHBondContact O-CB 3.44Å; T116-A120 PolarHBondContact O-N 3.44Å; R118-A120 VanDerWaalsContact C-N 3.35Å; R118-A120 PolarHBondContact O-N 2.6Å; A120-Y123 PolarHBondContact O-N 3.41Å; A120-I124 WeakPolarHBondContact O-CG1 3.49Å; A120-I124 PolarHBondContact O-N 3.36Å |
| 121 | S | 91.6 | Very high | 90.4 | Very high | 79 Ų | 79 | 73.6 Ų | 73.6 | 55% | 0.552 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -63.2 | -44.3 | 178.4 | -57.5 | 0 | 0 | 0 | 0 | 111.6 | L117 R118 L119 Y123 I124 A125 | L117-S121 WeakPolarHBondContact O-CB 3.46Å; L117-S121 PolarHBondContact O-N 3.1Å; L117-S121 PolarHBondContact O-OG 3.47Å; R118-S121 PolarHBondContact O-N 3.01Å; L119-S121 VanDerWaalsContact C-N 3.35Å; L119-S121 PolarHBondContact O-N 3.38Å; S121-Y123 VanDerWaalsContact C-N 3.35Å; S121-I124 PolarHBondContact O-N 3.37Å; S121-A125 PolarHBondContact O-N 3Å; S121-A125 VanDerWaalsContact O-N 3.1Å |
| 122 | S | 88.1 | Confident | 90.2 | Very high | 31 Ų | 31 | 76.2 Ų | 76.2 | 22% | 0.217 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -63.4 | -39.4 | 175 | -66.1 | 0 | 0 | 0 | 0 | 112.3 | R118 L119 A125 H126 | R118-S122 PolarHBondContact O-N 3.18Å; R118-S122 PolarHBondContact O-OG 2.87Å; L119-S122 PolarHBondContact O-N 3.19Å; S122-A125 PolarHBondContact O-N 2.89Å; S122-H126 WeakPolarHBondContact O-CB 3.44Å; S122-H126 PolarHBondContact O-N 3.41Å |
| 123 | Y | 92.5 | Very high | 89.3 | Confident | 68 Ų | 68 | 78 Ų | 78 | 27% | 0.267 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -66 | -43.3 | 177.8 | -178.2 | -137.3 | 0 | 0 | 0 | 112.1 | P103 L119 A120 S121 A125 H126 L127 | P103-Y123 HydrophobicContact CB-CE2 4.48Å; P103-Y123 HydrophobicContact CG-CD1 4.29Å; P103-Y123 HydrophobicContact CG-CD2 3.65Å; P103-Y123 HydrophobicContact CG-CE1 4.23Å; P103-Y123 HydrophobicContact CG-CE2 3.6Å; P103-Y123 HydrophobicContact CG-CG 4.01Å; L119-Y123 WeakPolarHBondContact O-CB 3.47Å; L119-Y123 PolarHBondContact O-N 2.86Å; A120-Y123 PolarHBondContact O-N 3.41Å; S121-Y123 VanDerWaalsContact C-N 3.35Å; Y123-A125 VanDerWaalsContact C-N 3.32Å; Y123-A125 PolarHBondContact O-N 2.85Å; Y123-H126 PolarHBondContact O-N 3.13Å; Y123-L127 HydrophobicContact CD1-CD1 4.33Å; Y123-L127 HydrophobicContact CD2-CD1 4.32Å; Y123-L127 HydrophobicContact CD2-CD2 4.45Å; Y123-L127 HydrophobicContact CD2-CG 4.02Å; Y123-L127 HydrophobicContact CE1-CD1 3.88Å; Y123-L127 HydrophobicContact CE2-CD1 3.85Å; Y123-L127 HydrophobicContact CE2-CD2 3.66Å; Y123-L127 HydrophobicContact CE2-CG 3.64Å; Y123-L127 WeakPolarHBondContact O-CG 3.46Å; Y123-L127 PolarHBondContact O-N 3.24Å |
| 124 | I | 92.4 | Very high | 87.7 | Confident | 81 Ų | 81 | 79.3 Ų | 79.3 | 42% | 0.415 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -58.5 | -44.8 | 173.9 | -67.4 | 165.3 | 0 | 0 | 0 | 110.8 | A120 S121 L127 R128 | A120-I124 WeakPolarHBondContact O-CG1 3.49Å; A120-I124 PolarHBondContact O-N 3.36Å; S121-I124 PolarHBondContact O-N 3.37Å; I124-L127 PolarHBondContact O-N 3.42Å; I124-R128 VanDerWaalsContact CG2-CZ 3.49Å; I124-R128 WeakPolarHBondContact O-CG 3.46Å; I124-R128 PolarHBondContact O-N 3.26Å |
| 125 | A | 86.8 | Confident | 85.8 | Confident | 54 Ų | 54 | 83.9 Ų | 83.9 | 45% | 0.446 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -62.6 | -42.6 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | S121 S122 Y123 R128 Q129 | S121-A125 PolarHBondContact O-N 3Å; S121-A125 VanDerWaalsContact O-N 3.1Å; S122-A125 PolarHBondContact O-N 2.89Å; Y123-A125 VanDerWaalsContact C-N 3.32Å; Y123-A125 PolarHBondContact O-N 2.85Å; A125-R128 WeakPolarHBondContact O-CB 3.38Å; A125-R128 PolarHBondContact O-N 3.46Å; A125-Q129 PolarHBondContact O-N 2.91Å |
| 126 | H | 85.3 | Confident | 84.1 | Confident | 55 Ų | 55 | 88.5 Ų | 88.5 | 26% | 0.255 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -61.2 | -47.5 | 176.7 | 176.4 | -115.9 | 0 | 0 | 0 | 112.1 | S122 Y123 R128 Q129 I130 | S122-H126 WeakPolarHBondContact O-CB 3.44Å; S122-H126 PolarHBondContact O-N 3.41Å; Y123-H126 PolarHBondContact O-N 3.13Å; H126-R128 VanDerWaalsContact C-N 3.29Å; H126-R128 PolarHBondContact O-N 3.31Å; H126-Q129 PolarHBondContact O-N 3.35Å; H126-I130 WeakPolarHBondContact CE1-CD1 3.46Å; H126-I130 PolarHBondContact O-N 2.9Å |
| 127 | L | 89.3 | Confident | 82.2 | Confident | 67 Ų | 67 | 96.7 Ų | 96.7 | 35% | 0.351 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -60.6 | -38.6 | 176.1 | -67.9 | 179.2 | 0 | 0 | 0 | 112.2 | Y123 I124 I130 L131 | Y123-L127 HydrophobicContact CD1-CD1 4.33Å; Y123-L127 HydrophobicContact CD2-CD1 4.32Å; Y123-L127 HydrophobicContact CD2-CD2 4.45Å; Y123-L127 HydrophobicContact CD2-CG 4.02Å; Y123-L127 HydrophobicContact CE1-CD1 3.88Å; Y123-L127 HydrophobicContact CE2-CD1 3.85Å; Y123-L127 HydrophobicContact CE2-CD2 3.66Å; Y123-L127 HydrophobicContact CE2-CG 3.64Å; Y123-L127 WeakPolarHBondContact O-CG 3.46Å; Y123-L127 PolarHBondContact O-N 3.24Å; I124-L127 PolarHBondContact O-N 3.42Å; L127-I130 WeakPolarHBondContact O-CB 3.4Å; L127-I130 PolarHBondContact O-N 2.87Å; L127-L131 VanDerWaalsContact O-CG 3.28Å; L127-L131 WeakPolarHBondContact O-CG 3.47Å; L127-L131 PolarHBondContact O-N 3.39Å |
| 128 | R | 88.9 | Confident | 80.1 | Confident | 177 Ų | 177 | 99.3 Ų | 99.3 | 67% | 0.668 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -62.9 | -41.4 | 175.5 | -74.1 | 172.3 | 177.4 | 159.2 | -0.1 | 112.4 | I124 A125 H126 L131 A132 | I124-R128 VanDerWaalsContact CG2-CZ 3.49Å; I124-R128 WeakPolarHBondContact O-CG 3.46Å; I124-R128 PolarHBondContact O-N 3.26Å; A125-R128 WeakPolarHBondContact O-CB 3.38Å; A125-R128 PolarHBondContact O-N 3.46Å; H126-R128 VanDerWaalsContact C-N 3.29Å; H126-R128 PolarHBondContact O-N 3.31Å; R128-L131 PolarHBondContact O-N 2.89Å; R128-A132 WeakPolarHBondContact O-CB 3.33Å; R128-A132 PolarHBondContact O-N 3.43Å; R128-A132 VanDerWaalsContact O-N 3.08Å |
| 129 | Q | 84.1 | Confident | 77.9 | Confident | 119 Ų | 119 | 94.2 Ų | 94.2 | 56% | 0.556 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -65.6 | -43.7 | 177.8 | -178.6 | 177 | -4.2 | 0 | 0 | 111.6 | A125 H126 L131 A132 N133 | A125-Q129 PolarHBondContact O-N 2.91Å; H126-Q129 PolarHBondContact O-N 3.35Å; Q129-L131 VanDerWaalsContact C-N 3.32Å; Q129-L131 PolarHBondContact O-N 2.96Å; Q129-A132 PolarHBondContact O-N 3.34Å; Q129-N133 PolarHBondContact O-N 2.97Å |
| 130 | I | 85.9 | Confident | 75.9 | Confident | 35 Ų | 35 | 103.2 Ų | 103.2 | 18% | 0.179 | 52% | 0.524 | C | S | . | . | H | α-helix | trans | -54.7 | -47.4 | 173.4 | -84.5 | 171.3 | 0 | 0 | 0 | 111.5 | H126 L127 A132 N133 Y136 | H126-I130 WeakPolarHBondContact CE1-CD1 3.46Å; H126-I130 PolarHBondContact O-N 2.9Å; L127-I130 WeakPolarHBondContact O-CB 3.4Å; L127-I130 PolarHBondContact O-N 2.87Å; I130-A132 VanDerWaalsContact C-N 3.28Å; I130-A132 PolarHBondContact O-N 3.48Å; I130-N133 PolarHBondContact O-N 3.18Å; I130-Y136 HydrophobicContact CD1-CE1 3.93Å; I130-Y136 HydrophobicContact CG1-CE1 3.84Å; I130-Y136 HydrophobicContact CG2-CE1 4.36Å; I130-Y136 HydrophobicContact CG2-CE2 3.88Å; I130-Y136 VanDerWaalsContact CG2-CZ 3.47Å; I130-Y136 WeakPolarHBondContact CG2-OH 3.37Å |
| 131 | L | 87.8 | Confident | 73.7 | Confident | 147 Ų | 147 | 107.7 Ų | 107.7 | 77% | 0.77 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -71.4 | -24.7 | -178 | -69.1 | 173.1 | 0 | 0 | 0 | 112.7 | L127 R128 Q129 | L127-L131 VanDerWaalsContact O-CG 3.28Å; L127-L131 WeakPolarHBondContact O-CG 3.47Å; L127-L131 PolarHBondContact O-N 3.39Å; R128-L131 PolarHBondContact O-N 2.89Å; Q129-L131 VanDerWaalsContact C-N 3.32Å; Q129-L131 PolarHBondContact O-N 2.96Å |
| 132 | A | 84.3 | Confident | 71.8 | Confident | 77 Ų | 77 | 106.4 Ų | 106.4 | 64% | 0.636 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -83.2 | -29.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113 | R128 Q129 I130 | R128-A132 WeakPolarHBondContact O-CB 3.33Å; R128-A132 PolarHBondContact O-N 3.43Å; R128-A132 VanDerWaalsContact O-N 3.08Å; Q129-A132 PolarHBondContact O-N 3.34Å; I130-A132 VanDerWaalsContact C-N 3.28Å; I130-A132 PolarHBondContact O-N 3.48Å |
| 133 | N | 73.9 | Confident | 70.2 | Confident | 90 Ų | 90 | 107 Ų | 107 | 48% | 0.481 | 54% | 0.539 | S | S | . | . | trans | -111.1 | 94.1 | -175.9 | -63.8 | -7.5 | 0 | 0 | 0 | 109.9 | Q129 I130 K135 | Q129-N133 PolarHBondContact O-N 2.97Å; I130-N133 PolarHBondContact O-N 3.18Å; N133-K135 PolarHBondContact O-N 3.45Å | ||
| 134 | D | 62.5 | Low | 68.4 | Low | 167 Ų | 167 | 108.2 Ų | 108.2 | 89% | 0.893 | 55% | 0.553 | S | S | * | * | S | Bend | trans | -59.6 | 1.6 | 176 | -111.7 | -12.6 | 0 | 0 | 0 | 114.9 | ||
| 135 | K | 53.3 | Low | 66.6 | Low | 189 Ų | 189 | 108.4 Ų | 108.4 | 82% | 0.822 | 56% | 0.555 | S | S | * | * | trans | -120.3 | 89.5 | 179 | -68.7 | 180 | -105 | -101.1 | 0 | 108.5 | N133 E137 | N133-K135 PolarHBondContact O-N 3.45Å; K135-E137 PolarHBondContact O-N 3.06Å | ||
| 136 | Y | 55.4 | Low | 65.3 | Low | 157 Ų | 157 | 106.6 Ų | 106.6 | 62% | 0.616 | 54% | 0.538 | S | S | * | . | trans | -63.2 | 98.9 | 166.1 | -86.2 | -101.8 | 0 | 0 | 0 | 109 | I130 N138 | I130-Y136 HydrophobicContact CD1-CE1 3.93Å; I130-Y136 HydrophobicContact CG1-CE1 3.84Å; I130-Y136 HydrophobicContact CG2-CE1 4.36Å; I130-Y136 HydrophobicContact CG2-CE2 3.88Å; I130-Y136 VanDerWaalsContact CG2-CZ 3.47Å; I130-Y136 WeakPolarHBondContact CG2-OH 3.37Å; Y136-N138 PolarHBondContact O-N 2.91Å | ||
| 137 | E | 52.8 | Low | 64.1 | Low | 173 Ų | 173 | 107 Ų | 107 | 81% | 0.808 | 54% | 0.544 | S | S | * | . | trans | -74 | 120.2 | 158.1 | -124.2 | -63.7 | 149.5 | 0 | 0 | 107.2 | K135 G139 | K135-E137 PolarHBondContact O-N 3.06Å; E137-G139 PolarHBondContact O-N 3.1Å | ||
| 138 | N | 50.8 | Low | 62.4 | Low | 146 Ų | 146 | 110.3 Ų | 110.3 | 78% | 0.781 | 55% | 0.552 | S | S | * | * | S | Bend | trans | -85.9 | 60.4 | -155.6 | -152.3 | 60.1 | 0 | 0 | 0 | 110.4 | Y136 | Y136-N138 PolarHBondContact O-N 2.91Š|
| 139 | G | 45.3 | Very low | 61.1 | Low | 38 Ų | 38 | 105.7 Ų | 105.7 | 39% | 0.392 | 55% | 0.545 | S | S | . | . | S | Bend | trans | -121.7 | 130.3 | 166 | 0 | 0 | 0 | 0 | 0 | 107.4 | E137 T141 | E137-G139 PolarHBondContact O-N 3.1Å; G139-T141 PolarHBondContact O-N 3.37Å; G139-T141 PolarHBondContact O-OG1 3.36Å |
| 140 | Y | 48.6 | Very low | 59.9 | Low | 205 Ų | 205 | 106.9 Ų | 106.9 | 80% | 0.804 | 55% | 0.549 | S | S | * | . | trans | -55.6 | 72.4 | 164.1 | -61.3 | -93.9 | 0 | 0 | 0 | 109.5 | H142 | Y140-H142 PolarHBondContact O-N 3.03Š| ||
| 141 | T | 48.5 | Very low | 58.5 | Low | 106 Ų | 106 | 112.6 Ų | 112.6 | 65% | 0.65 | 58% | 0.576 | S | S | * | * | trans | -78.5 | 66 | 169.8 | 41.2 | 0 | 0 | 0 | 0 | 105.2 | G139 P143 | G139-T141 PolarHBondContact O-N 3.37Å; G139-T141 PolarHBondContact O-OG1 3.36Å; T141-P143 WeakPolarHBondContact O-CD 3.46Å | ||
| 142 | H | 51.7 | Low | 56.5 | Low | 52 Ų | 52 | 112.4 Ų | 112.4 | 24% | 0.241 | 58% | 0.581 | C | S | . | * | trans | -47.6 | 113.4 | 155.4 | -123.8 | -101.7 | 0 | 0 | 0 | 104.3 | W104 Y140 V144 L146 | W104-H142 AromaticContact CD1-NE2 3.29Å; W104-H142 VanDerWaalsContact CD1-NE2 3.29Å; W104-H142 AromaticContact CG-NE2 3.68Å; W104-H142 AromaticContact NE1-NE2 3.78Å; Y140-H142 PolarHBondContact O-N 3.03Å; H142-V144 PolarHBondContact O-N 3.13Å; H142-L146 VanDerWaalsContact CE1-C 3.47Å; H142-L146 WeakPolarHBondContact CE1-CB 3.39Å; H142-L146 PolarHBondContact CE1-O 3.01Å; H142-L146 VanDerWaalsContact CE1-O 3.29Å; H142-L146 VanDerWaalsContact ND1-CB 3.28Å; H142-L146 WeakPolarHBondContact ND1-CB 3.42Å | ||
| 143 | P | 54.6 | Low | 54.6 | Low | 44 Ų | 44 | 111.4 Ų | 111.4 | 29% | 0.286 | 57% | 0.572 | S | S | . | * | trans | -53.1 | 120 | 161.6 | 24.4 | -32.4 | 0 | 0 | 0 | 103.2 | T141 N145 L146 | T141-P143 WeakPolarHBondContact O-CD 3.46Å; P143-N145 PolarHBondContact O-N 3.38Å; P143-L146 HydrophobicContact CG-CD1 3.48Å; P143-L146 VanDerWaalsContact CG-CD1 3.48Å; P143-L146 HydrophobicContact CG-CG 3.87Å; P143-L146 PolarHBondContact O-N 3.46Å | ||
| 144 | V | 54.1 | Low | 52.9 | Low | 94 Ų | 94 | 110.5 Ų | 110.5 | 57% | 0.57 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.1 | 5.4 | -173.1 | -70.3 | 0 | 0 | 0 | 0 | 114.9 | H142 A153 | H142-V144 PolarHBondContact O-N 3.13Å; V144-A153 HydrophobicContact CB-CB 4.12Å; V144-A153 HydrophobicContact CG1-CB 4.33Å |
| 145 | N | 54 | Low | 51.9 | Low | 85 Ų | 85 | 111.6 Ų | 111.6 | 46% | 0.455 | 58% | 0.581 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -97.9 | -5.5 | 174.2 | -54.7 | -49.1 | 0 | 0 | 0 | 114.5 | L119 P143 | L119-N145 WeakPolarHBondContact CD2-O 3.47Å; P143-N145 PolarHBondContact O-N 3.38Å |
| 146 | L | 59.6 | Low | 51.2 | Low | 16 Ų | 16 | 107.9 Ų | 107.9 | 8% | 0.084 | 58% | 0.576 | C | S | . | * | S | Bend | trans | -102.9 | -2.9 | -179.2 | -71 | 175.2 | 0 | 0 | 0 | 113.9 | L119 H142 P143 W148 | L119-L146 HydrophobicContact CB-CD2 3.99Å; L119-L146 HydrophobicContact CD2-CB 4.4Å; L119-L146 HydrophobicContact CD2-CD2 3.46Å; L119-L146 VanDerWaalsContact CD2-CD2 3.46Å; L119-L146 HydrophobicContact CD2-CG 4.4Å; L119-L146 HydrophobicContact CG-CD2 4.32Å; L119-L146 WeakPolarHBondContact O-CD2 3.21Å; H142-L146 VanDerWaalsContact CE1-C 3.47Å; H142-L146 WeakPolarHBondContact CE1-CB 3.39Å; H142-L146 PolarHBondContact CE1-O 3.01Å; H142-L146 VanDerWaalsContact CE1-O 3.29Å; H142-L146 VanDerWaalsContact ND1-CB 3.28Å; H142-L146 WeakPolarHBondContact ND1-CB 3.42Å; P143-L146 HydrophobicContact CG-CD1 3.48Å; P143-L146 VanDerWaalsContact CG-CD1 3.48Å; P143-L146 HydrophobicContact CG-CG 3.87Å; P143-L146 PolarHBondContact O-N 3.46Å; L146-W148 PolarHBondContact O-N 3.13Å |
| 147 | T | 61.4 | Low | 50.7 | Low | 62 Ų | 62 | 110 Ų | 110 | 38% | 0.38 | 59% | 0.592 | S | S | . | * | S | Bend | trans | -81.8 | 113.6 | 178.2 | 70.5 | 0 | 0 | 0 | 0 | 109.7 | P149 | T147-P149 CarbonylContact O-C 3.28Å; T147-P149 VanDerWaalsContact O-C 3.28Å |
| 148 | W | 53.1 | Low | 50.7 | Low | 138 Ų | 138 | 106.9 Ų | 106.9 | 52% | 0.523 | 59% | 0.585 | S | S | . | * | S | Bend | trans | -85.6 | 134 | 171 | -172.1 | 85.7 | 0 | 0 | 0 | 109.5 | T109 L146 | T109-W148 HydrophobicContact CG2-CD2 3.78Å; T109-W148 HydrophobicContact CG2-CE3 4.43Å; T109-W148 HydrophobicContact CG2-CG 4.19Å; T109-W148 HydrophobicContact CG2-CH2 4.17Å; T109-W148 HydrophobicContact CG2-CZ2 3.48Å; T109-W148 VanDerWaalsContact CG2-CZ2 3.48Å; T109-W148 VanDerWaalsContact CG2-NE1 3.33Å; L146-W148 PolarHBondContact O-N 3.13Å |
| 149 | P | 62.6 | Low | 50.7 | Low | 79 Ų | 79 | 105.4 Ų | 105.4 | 51% | 0.513 | 58% | 0.577 | S | S | . | * | S | Bend | cis | -77.5 | 151.1 | -4.9 | 32.6 | -33.2 | 0 | 0 | 0 | 112.3 | T147 M151 | T147-P149 CarbonylContact O-C 3.28Å; T147-P149 VanDerWaalsContact O-C 3.28Å; P149-M151 PolarHBondContact O-N 3.49Å |
| 150 | F | 58.3 | Low | 50.9 | Low | 145 Ų | 145 | 111.8 Ų | 111.8 | 64% | 0.636 | 60% | 0.601 | S | S | * | * | trans | -70.4 | 36.2 | -178.3 | -171.8 | -101.6 | 0 | 0 | 0 | 113.9 | ||||
| 151 | M | 55.3 | Low | 50.9 | Low | 155 Ų | 155 | 110.1 Ų | 110.1 | 76% | 0.764 | 60% | 0.598 | S | S | * | * | trans | -113.1 | 119.2 | 171.5 | -59.1 | -160.1 | -34.3 | 0 | 0 | 109.3 | P149 | P149-M151 PolarHBondContact O-N 3.49Š| ||
| 152 | V | 46.7 | Very low | 51.2 | Low | 142 Ų | 142 | 112.6 Ų | 112.6 | 86% | 0.861 | 60% | 0.602 | S | S | * | * | trans | 77.3 | 71.5 | 165 | -164.9 | 0 | 0 | 0 | 0 | 115 | ||||
| 153 | A | 43.6 | Very low | 51.1 | Low | 56 Ų | 56 | 118.2 Ų | 118.2 | 46% | 0.463 | 63% | 0.631 | S | S | . | * | S | Bend | trans | -118 | 119.7 | 133 | 0 | 0 | 0 | 0 | 0 | 106.3 | V144 K155 | V144-A153 HydrophobicContact CB-CB 4.12Å; V144-A153 HydrophobicContact CG1-CB 4.33Å; A153-K155 PolarHBondContact O-N 3.48Å |
| 154 | G | 39.9 | Very low | 51.2 | Low | 71 Ų | 71 | 123.5 Ų | 123.5 | 73% | 0.732 | 66% | 0.656 | S | S | * | * | P | Polyproline II helix | trans | -49 | 126.2 | -159.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||
| 155 | K | 39.9 | Very low | 51.1 | Low | 191 Ų | 191 | 125.2 Ų | 125.2 | 83% | 0.83 | 66% | 0.662 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 130 | 142.1 | -75.9 | -166.6 | 161.6 | 177.3 | 0 | 106.8 | A153 E157 | A153-K155 PolarHBondContact O-N 3.48Å; K155-E157 PolarHBondContact O-N 2.73Å |
| 156 | P | 39 | Very low | 51.2 | Low | 110 Ų | 110 | 124 Ų | 124 | 71% | 0.714 | 67% | 0.67 | S | S | * | * | P | Polyproline II helix | trans | -56.6 | 128.3 | 167.4 | 24 | -31.3 | 0 | 0 | 0 | 108.4 | T158 | P156-T158 PolarHBondContact O-N 3.04Š|
| 157 | E | 45.2 | Very low | 50.9 | Low | 201 Ų | 201 | 129.8 Ų | 129.8 | 94% | 0.939 | 71% | 0.706 | S | S | * | * | S | Bend | trans | -68.7 | 39.5 | -174.2 | -70.9 | -157.9 | 124.8 | 0 | 0 | 114.6 | K155 | K155-E157 PolarHBondContact O-N 2.73Š|
| 158 | T | 53.4 | Low | 50.7 | Low | 109 Ų | 109 | 137.8 Ų | 137.8 | 67% | 0.669 | 73% | 0.729 | S | S | * | * | S | Bend | trans | -106.2 | -2.7 | -170.6 | 55.2 | 0 | 0 | 0 | 0 | 116.8 | P156 | P156-T158 PolarHBondContact O-N 3.04Š|
| 159 | D | 49 | Very low | 50.8 | Low | 115 Ų | 115 | 139.6 Ų | 139.6 | 62% | 0.615 | 75% | 0.748 | S | S | * | * | S | Bend | trans | -135.6 | 19.2 | -175.6 | -80.7 | -58.5 | 0 | 0 | 0 | 116.3 | ||
| 160 | L | 51.2 | Low | 50.5 | Low | 172 Ų | 172 | 141.7 Ų | 141.7 | 90% | 0.901 | 76% | 0.763 | S | S | * | * | S | Bend | trans | -96 | 7.1 | 169.1 | -70.1 | -179.6 | 0 | 0 | 0 | 113.7 | ||
| 161 | K | 48.4 | Very low | 50.1 | Low | 169 Ų | 169 | 138.1 Ų | 138.1 | 74% | 0.735 | 77% | 0.767 | S | S | * | * | S | Bend | trans | -109.2 | -1.2 | 178.8 | -147.4 | 178.6 | 179.7 | -175.9 | 0 | 114.8 | N165 | K161-N165 PolarHBondContact O-ND2 3.45Å; K161-N165 VanDerWaalsContact O-ND2 3.13Å |
| 162 | E | 54.3 | Low | 50.1 | Low | 159 Ų | 159 | 137.5 Ų | 137.5 | 74% | 0.743 | 77% | 0.773 | S | S | * | * | S | Bend | trans | -104.2 | -16.2 | 176.3 | -86.1 | -139.1 | 125.7 | 0 | 0 | 115.1 | ||
| 163 | M | 49.6 | Very low | 51 | Low | 170 Ų | 170 | 137.3 Ų | 137.3 | 84% | 0.837 | 77% | 0.772 | S | S | * | * | S | Bend | trans | -89.7 | -11.4 | 178.6 | -68.9 | -165.8 | 72.2 | 0 | 0 | 114.6 | ||
| 164 | L | 55.9 | Low | 51.2 | Low | 155 Ų | 155 | 139.3 Ų | 139.3 | 81% | 0.812 | 79% | 0.789 | S | S | * | * | S | Bend | trans | -104.7 | 7.2 | 178.1 | -153 | 73.8 | 0 | 0 | 0 | 113.6 | ||
| 165 | N | 53.4 | Low | 52 | Low | 129 Ų | 129 | 145.1 Ų | 145.1 | 69% | 0.69 | 82% | 0.818 | S | S | * | * | S | Bend | trans | -114.2 | 6.2 | 178.7 | -64.2 | -7.6 | 0 | 0 | 0 | 112.8 | K161 | K161-N165 PolarHBondContact O-ND2 3.45Å; K161-N165 VanDerWaalsContact O-ND2 3.13Å |
| 166 | G | 55.6 | Low | 52.6 | Low | 61 Ų | 61 | 142.9 Ų | 142.9 | 63% | 0.629 | 82% | 0.817 | S | S | * | * | trans | -107.3 | 0.4 | -171.3 | 0 | 0 | 0 | 0 | 0 | 116.7 | R168 | G166-R168 PolarHBondContact O-N 3Š| ||
| 167 | T | 53.2 | Low | 53.4 | Low | 137 Ų | 137 | 144.6 Ų | 144.6 | 84% | 0.84 | 82% | 0.823 | S | S | * | * | trans | -102.6 | 85.7 | 178.1 | -32.6 | 0 | 0 | 0 | 0 | 109.7 | L169 | T167-L169 PolarHBondContact O-N 3.34Š| ||
| 168 | R | 56.7 | Low | 53.8 | Low | 229 Ų | 229 | 141.4 Ų | 141.4 | 86% | 0.864 | 82% | 0.816 | S | S | * | * | trans | -50.2 | 127.4 | 170.6 | -74.5 | 175 | 170.8 | -95.2 | -1 | 110.4 | G166 C170 | G166-R168 PolarHBondContact O-N 3Å; R168-C170 PolarHBondContact O-N 3.4Å | ||
| 169 | L | 56.1 | Low | 53.8 | Low | 177 Ų | 177 | 143.4 Ų | 143.4 | 93% | 0.927 | 83% | 0.825 | S | S | * | * | trans | -24.2 | 119.6 | 149.8 | -67.8 | 112.3 | 0 | 0 | 0 | 113.6 | T167 | T167-L169 PolarHBondContact O-N 3.34Š| ||
| 170 | C | 55.3 | Low | 54.1 | Low | 123 Ų | 123 | 145.1 Ų | 145.1 | 83% | 0.831 | 84% | 0.838 | S | S | * | * | trans | -134.9 | 110.5 | 138.1 | 64.2 | 0 | 0 | 0 | 0 | 108.1 | R168 | R168-C170 PolarHBondContact O-N 3.4Š| ||
| 171 | G | 51.2 | Low | 54.3 | Low | 70 Ų | 70 | 143.3 Ų | 143.3 | 72% | 0.722 | 83% | 0.834 | S | S | * | * | trans | -76.1 | 152.6 | 166.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 172 | T | 55.7 | Low | 54.8 | Low | 142 Ų | 142 | 141.5 Ų | 141.5 | 87% | 0.871 | 84% | 0.841 | S | S | * | * | trans | -153 | 116.5 | 148.1 | 11.5 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 173 | T | 64.5 | Low | 54.8 | Low | 137 Ų | 137 | 140.2 Ų | 140.2 | 84% | 0.84 | 85% | 0.849 | S | S | * | * | trans | -63.9 | 144.1 | 165.5 | 170.1 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 174 | A | 47.4 | Very low | 55.2 | Low | 99 Ų | 99 | 137.7 Ų | 137.7 | 82% | 0.818 | 85% | 0.849 | S | S | * | * | trans | -140.1 | 120.8 | 162.3 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 175 | S | 57.7 | Low | 55.2 | Low | 193 Ų | 193 | 136.1 Ų | 136.1 | 100% | 1.35 | 85% | 0.853 | S | S | * | * | trans | -66.5 | 0 | 173.7 | -97.5 | 0 | 0 | 0 | 0 | 112.9 |
Retrieved 175 of 175 residues in 195 ms
(Link to these results)