| 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 | V | 39.3 | Very low | 44.1 | Very low | 203 Ų | 203 | 161.4 Ų | 161.4 | 100% | 1.23 | 85% | 0.849 | S | S | * | * | 0 | 135.8 | 0 | 171.9 | 0 | 0 | 0 | 0 | 108.5 | |||||
| 2 | R | 37.9 | Very low | 43.9 | Very low | 244 Ų | 244 | 160.3 Ų | 160.3 | 92% | 0.921 | 84% | 0.844 | S | S | * | * | trans | -27.8 | 136.3 | -165.3 | -80.4 | 170.8 | -175.5 | -142.7 | -2 | 120 | ||||
| 3 | G | 42.8 | Very low | 44.1 | Very low | 83 Ų | 83 | 162.5 Ų | 162.5 | 86% | 0.856 | 85% | 0.847 | S | S | * | * | trans | -83.6 | 152.4 | 164.9 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 4 | R | 48.3 | Very low | 43.6 | Very low | 232 Ų | 232 | 156.4 Ų | 156.4 | 88% | 0.875 | 84% | 0.843 | S | S | * | * | trans | -73.9 | 148.8 | -179.1 | 172.1 | -165.4 | -105.6 | -151.1 | -5.3 | 113.2 | ||||
| 5 | R | 47.5 | Very low | 43.8 | Very low | 228 Ų | 228 | 153.1 Ų | 153.1 | 86% | 0.86 | 84% | 0.837 | S | S | * | * | trans | 163.2 | 109.9 | 137.5 | -91.7 | 169 | -173.6 | -147.1 | 1.6 | 111.4 | ||||
| 6 | T | 44.1 | Very low | 43.9 | Very low | 126 Ų | 126 | 150 Ų | 150 | 77% | 0.773 | 84% | 0.838 | S | S | * | * | 77.6 | 110.6 | 93 | 54.4 | 0 | 0 | 0 | 0 | 115.9 | |||||
| 7 | N | 39.9 | Very low | 44.2 | Very low | 160 Ų | 160 | 151.5 Ų | 151.5 | 86% | 0.856 | 84% | 0.837 | S | S | * | * | trans | -71.3 | 173.6 | 154.5 | -89.5 | 0.5 | 0 | 0 | 0 | 110.4 | ||||
| 8 | P | 47.5 | Very low | 44.2 | Very low | 105 Ų | 105 | 151.2 Ų | 151.2 | 68% | 0.682 | 83% | 0.834 | S | S | * | * | cis | -154.3 | -169.5 | 36 | 39.2 | -13.8 | 0 | 0 | 0 | 118.8 | ||||
| 9 | E | 35.7 | Very low | 44.4 | Very low | 180 Ų | 180 | 151 Ų | 151 | 84% | 0.841 | 84% | 0.837 | S | S | * | * | trans | 71.5 | 148.6 | 153.4 | -101.1 | 160.2 | 82.9 | 0 | 0 | 121.6 | ||||
| 10 | S | 42.9 | Very low | 44.4 | Very low | 100 Ų | 100 | 148.1 Ų | 148.1 | 70% | 0.699 | 83% | 0.833 | S | S | * | * | cis | -177 | -161.9 | -22.6 | 66.7 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 11 | P | 58.9 | Low | 44.2 | Very low | 114 Ų | 114 | 146 Ų | 146 | 74% | 0.74 | 84% | 0.835 | S | S | * | * | trans | -117 | 179.2 | -132.6 | 40.2 | -19.1 | 0 | 0 | 0 | 117.3 | ||||
| 12 | D | 41.3 | Very low | 44.6 | Very low | 149 Ų | 149 | 140.5 Ų | 140.5 | 80% | 0.797 | 81% | 0.811 | S | S | * | * | trans | -178.9 | 119.5 | 151.7 | -109.9 | -26.5 | 0 | 0 | 0 | 110.1 | ||||
| 13 | E | 46.5 | Very low | 44.8 | Very low | 188 Ų | 188 | 139.6 Ų | 139.6 | 88% | 0.879 | 81% | 0.814 | S | S | * | * | 73.2 | 131 | 86.9 | -74.3 | -83.6 | 134.5 | 0 | 0 | 115.3 | |||||
| 14 | G | 38.2 | Very low | 44.7 | Very low | 77 Ų | 77 | 145 Ų | 145 | 79% | 0.794 | 81% | 0.814 | S | S | * | * | trans | 151.8 | 84 | 162 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 15 | S | 45.8 | Very low | 44.2 | Very low | 107 Ų | 107 | 137 Ų | 137 | 75% | 0.748 | 80% | 0.804 | S | S | * | * | trans | -59.3 | 140.8 | 165 | -178.6 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 16 | A | 46.3 | Very low | 43.7 | Very low | 104 Ų | 104 | 132.3 Ų | 132.3 | 86% | 0.86 | 80% | 0.801 | S | S | * | * | trans | -158.7 | 125 | 153.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 17 | E | 48.3 | Very low | 43.3 | Very low | 176 Ų | 176 | 133 Ų | 133 | 82% | 0.822 | 80% | 0.8 | S | S | * | * | trans | -94.6 | 162.4 | -168.4 | -55.9 | 177.2 | 154.9 | 0 | 0 | 112 | ||||
| 18 | D | 44.7 | Very low | 43.2 | Very low | 146 Ų | 146 | 131.1 Ų | 131.1 | 78% | 0.781 | 80% | 0.799 | S | S | * | * | trans | -42.1 | 136.9 | 170 | -171.5 | 28.4 | 0 | 0 | 0 | 115.9 | ||||
| 19 | V | 47.2 | Very low | 43.1 | Very low | 147 Ų | 147 | 133.3 Ų | 133.3 | 89% | 0.891 | 80% | 0.8 | S | S | * | * | trans | -158.4 | 93.6 | 153.7 | -106.9 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 20 | A | 44.7 | Very low | 43.9 | Very low | 92 Ų | 92 | 130.3 Ų | 130.3 | 76% | 0.76 | 80% | 0.796 | S | S | * | * | trans | -96.2 | 122.3 | 158.6 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 21 | A | 40.7 | Very low | 44 | Very low | 105 Ų | 105 | 131.6 Ų | 131.6 | 87% | 0.868 | 80% | 0.795 | S | S | * | * | trans | -156.3 | 138.1 | 161.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 22 | A | 47.8 | Very low | 43.5 | Very low | 88 Ų | 88 | 131.1 Ų | 131.1 | 73% | 0.727 | 79% | 0.792 | S | S | * | * | trans | -72.3 | 159.6 | -177.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 23 | F | 42.3 | Very low | 43.3 | Very low | 224 Ų | 224 | 131.2 Ų | 131.2 | 98% | 0.982 | 79% | 0.792 | S | S | * | * | trans | -148.4 | 149.7 | 147.6 | -108 | -80.8 | 0 | 0 | 0 | 112.6 | ||||
| 24 | K | 40.9 | Very low | 43.3 | Very low | 197 Ų | 197 | 130.5 Ų | 130.5 | 86% | 0.857 | 79% | 0.794 | S | S | * | * | trans | -119.3 | 140.4 | -154.5 | 172 | -177 | 178.7 | -171.5 | 0 | 110.8 | ||||
| 25 | G | 37.2 | Very low | 43.9 | Very low | 65 Ų | 65 | 132.5 Ų | 132.5 | 67% | 0.67 | 79% | 0.793 | S | S | * | * | trans | 87.9 | 130.4 | 146.4 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 26 | T | 36.6 | Very low | 43.5 | Very low | 129 Ų | 129 | 134.7 Ų | 134.7 | 79% | 0.791 | 80% | 0.796 | S | S | * | * | 164.8 | 137.7 | 94.9 | -47.6 | 0 | 0 | 0 | 0 | 111.5 | |||||
| 27 | D | 35.4 | Very low | 43.1 | Very low | 141 Ų | 141 | 134.9 Ų | 134.9 | 75% | 0.754 | 79% | 0.791 | S | S | * | * | trans | 6.6 | 138.1 | 162.3 | -64 | -55.5 | 0 | 0 | 0 | 123.9 | ||||
| 28 | S | 38 | Very low | 42.6 | Very low | 119 Ų | 119 | 131.6 Ų | 131.6 | 83% | 0.832 | 79% | 0.788 | S | S | * | * | 159.1 | 128.7 | 104.2 | -67.5 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 29 | H | 45.3 | Very low | 42.5 | Very low | 151 Ų | 151 | 130 Ų | 130 | 70% | 0.699 | 79% | 0.788 | S | S | * | * | trans | -78.9 | 151.5 | 164.9 | -164.7 | -115.8 | 0 | 0 | 0 | 109.6 | D31 | H29-D31 PolarHBondContact CE1-N 3.18Å; H29-D31 IonicContact CE1-OD2 3.62Å; H29-D31 PolarHBondContact ND1-N 2.86Å | ||
| 30 | P | 52.1 | Low | 42.5 | Very low | 118 Ų | 118 | 128.6 Ų | 128.6 | 77% | 0.766 | 78% | 0.782 | S | S | * | * | -145.5 | 150 | 91.5 | 32.3 | -11.8 | 0 | 0 | 0 | 117.3 | |||||
| 31 | D | 45.7 | Very low | 42.4 | Very low | 126 Ų | 126 | 129.8 Ų | 129.8 | 67% | 0.674 | 78% | 0.784 | S | S | * | * | trans | -54.5 | 153.2 | 161.2 | -116.7 | -37.8 | 0 | 0 | 0 | 113.2 | H29 | H29-D31 PolarHBondContact CE1-N 3.18Å; H29-D31 IonicContact CE1-OD2 3.62Å; H29-D31 PolarHBondContact ND1-N 2.86Å | ||
| 32 | P | 48.5 | Very low | 42.6 | Very low | 105 Ų | 105 | 130.4 Ų | 130.4 | 68% | 0.682 | 78% | 0.78 | S | S | * | * | trans | -131.9 | 113.5 | 143.2 | 32.1 | -16.4 | 0 | 0 | 0 | 113.6 | ||||
| 33 | N | 37.7 | Very low | 42.7 | Very low | 150 Ų | 150 | 131.9 Ų | 131.9 | 80% | 0.802 | 79% | 0.785 | S | S | * | * | trans | 58.7 | 96.9 | 134 | -62.9 | -63.1 | 0 | 0 | 0 | 119.2 | ||||
| 34 | L | 45.8 | Very low | 42.5 | Very low | 173 Ų | 173 | 126.6 Ų | 126.6 | 91% | 0.906 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -82 | 130.3 | 145.5 | -91.1 | 131 | 0 | 0 | 0 | 109.8 | ||
| 35 | P | 51.8 | Low | 43.3 | Very low | 120 Ų | 120 | 122.9 Ų | 122.9 | 78% | 0.779 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -90.7 | 121.8 | 156.9 | 30.7 | -26.2 | 0 | 0 | 0 | 110.7 | ||
| 36 | D | 36.4 | Very low | 43.7 | Very low | 153 Ų | 153 | 124.8 Ų | 124.8 | 82% | 0.818 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -52.2 | 143 | 156.7 | -77.4 | -44 | 0 | 0 | 0 | 111.7 | ||
| 37 | S | 37.3 | Very low | 44.3 | Very low | 107 Ų | 107 | 124.9 Ų | 124.9 | 75% | 0.748 | 78% | 0.78 | S | S | * | * | 166.4 | 105.9 | 121.9 | -77.3 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 38 | S | 38.2 | Very low | 44.6 | Very low | 108 Ų | 108 | 125.9 Ų | 125.9 | 76% | 0.755 | 79% | 0.785 | S | S | * | * | 44.7 | 127.7 | 117.2 | -44.7 | 0 | 0 | 0 | 0 | 121.6 | |||||
| 39 | S | 44 | Very low | 45.2 | Very low | 113 Ų | 113 | 125.9 Ų | 125.9 | 79% | 0.79 | 78% | 0.782 | S | S | * | * | trans | 103.6 | 162.6 | 142.2 | -53 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 40 | P | 45.7 | Very low | 45.4 | Very low | 117 Ų | 117 | 127.6 Ų | 127.6 | 76% | 0.76 | 79% | 0.79 | S | S | * | * | -116.5 | 171.9 | -86.2 | 27.2 | -7.3 | 0 | 0 | 0 | 111.6 | |||||
| 41 | S | 43.1 | Very low | 45 | Very low | 116 Ų | 116 | 127.9 Ų | 127.9 | 81% | 0.811 | 79% | 0.792 | S | S | * | * | trans | -52 | 150.8 | 174.3 | -42 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 42 | P | 44.2 | Very low | 45.1 | Very low | 119 Ų | 119 | 126.7 Ų | 126.7 | 77% | 0.773 | 80% | 0.8 | S | S | * | * | -120.8 | 126.2 | 123.4 | 33.1 | -27.8 | 0 | 0 | 0 | 110.7 | S44 | P42-S44 PolarHBondContact O-N 3.12Š| |||
| 43 | S | 49.8 | Very low | 45.9 | Very low | 119 Ų | 119 | 130 Ų | 130 | 83% | 0.832 | 81% | 0.808 | S | S | * | * | trans | -56.7 | 118.5 | 162.1 | 27.8 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 44 | S | 39 | Very low | 46.9 | Very low | 113 Ų | 113 | 128.3 Ų | 128.3 | 79% | 0.79 | 81% | 0.805 | S | S | * | * | trans | -135.5 | 91.1 | 157.9 | 65.1 | 0 | 0 | 0 | 0 | 108.7 | P42 | P42-S44 PolarHBondContact O-N 3.12Š| ||
| 45 | S | 57 | Low | 47.1 | Very low | 119 Ų | 119 | 125.8 Ų | 125.8 | 83% | 0.832 | 80% | 0.799 | S | S | * | * | trans | -69.3 | 117.7 | 166 | 38.3 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 46 | S | 45.8 | Very low | 46.9 | Very low | 105 Ų | 105 | 125.6 Ų | 125.6 | 73% | 0.734 | 80% | 0.801 | S | S | * | * | trans | -140.4 | 131.3 | 160.9 | -79.2 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 47 | P | 49.5 | Very low | 47.5 | Very low | 131 Ų | 131 | 125 Ų | 125 | 85% | 0.851 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -82.4 | 130.3 | -174.1 | 32.2 | -31.1 | 0 | 0 | 0 | 110.6 | ||
| 48 | L | 42.4 | Very low | 47.9 | Very low | 162 Ų | 162 | 124.3 Ų | 124.3 | 85% | 0.848 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -85.2 | 149.1 | 166.5 | -100.8 | 91.2 | 0 | 0 | 0 | 111.1 | ||
| 49 | P | 49.9 | Very low | 48.4 | Very low | 118 Ų | 118 | 124.1 Ų | 124.1 | 77% | 0.766 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -80.1 | 134.9 | -176.8 | 27.7 | -22.6 | 0 | 0 | 0 | 111.8 | ||
| 50 | Q | 49.8 | Very low | 48.7 | Very low | 187 Ų | 187 | 123.7 Ų | 123.7 | 87% | 0.874 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -71.7 | 139.2 | 175.2 | -68 | -177 | -30 | 0 | 0 | 111.2 | ||
| 51 | P | 44.4 | Very low | 49.1 | Very low | 124 Ų | 124 | 124 Ų | 124 | 81% | 0.805 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 128.4 | 168.4 | 9.1 | 3.9 | 0 | 0 | 0 | 110.4 | ||
| 52 | A | 47 | Very low | 49.4 | Very low | 101 Ų | 101 | 126.4 Ų | 126.4 | 84% | 0.835 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -68.8 | 126.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||
| 53 | M | 64.3 | Low | 49.8 | Very low | 175 Ų | 175 | 129.2 Ų | 129.2 | 86% | 0.862 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -78.9 | 144.1 | 169.2 | -70.6 | -86.7 | -83.7 | 0 | 0 | 110.2 | ||
| 54 | P | 60.2 | Low | 49.8 | Very low | 114 Ų | 114 | 127.9 Ų | 127.9 | 74% | 0.74 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -74.1 | 148.5 | 174.7 | 30.4 | -33.5 | 0 | 0 | 0 | 111.7 | S56 | P54-S56 PolarHBondContact O-N 3.37Š|
| 55 | P | 50.2 | Low | 50.2 | Low | 120 Ų | 120 | 130.8 Ų | 130.8 | 78% | 0.779 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -70.9 | 122.7 | 177.7 | 28.2 | -32.5 | 0 | 0 | 0 | 111 | V57 | P55-V57 PolarHBondContact O-N 3.45Š|
| 56 | S | 47.2 | Very low | 49.6 | Very low | 116 Ų | 116 | 129.9 Ų | 129.9 | 81% | 0.811 | 81% | 0.812 | S | S | * | * | trans | -67.8 | 111.5 | 171 | -173 | 0 | 0 | 0 | 0 | 109.5 | P54 S58 | P54-S56 PolarHBondContact O-N 3.37Å; S56-S58 PolarHBondContact O-N 3.25Å | ||
| 57 | V | 48.6 | Very low | 49.2 | Very low | 140 Ų | 140 | 130.6 Ų | 130.6 | 85% | 0.848 | 82% | 0.817 | S | S | * | * | trans | -77.6 | 114.1 | 178.5 | -147.6 | 0 | 0 | 0 | 0 | 108.2 | P55 A59 | P55-V57 PolarHBondContact O-N 3.45Å; V57-A59 PolarHBondContact O-N 3.35Å | ||
| 58 | S | 45.9 | Very low | 49.2 | Very low | 94 Ų | 94 | 130.1 Ų | 130.1 | 66% | 0.657 | 81% | 0.814 | S | S | * | * | trans | -57.9 | 126.9 | -174.2 | -57.6 | 0 | 0 | 0 | 0 | 113.3 | S56 S60 | S56-S58 PolarHBondContact O-N 3.25Å; S58-S60 PolarHBondContact O-N 3Å | ||
| 59 | A | 47.6 | Very low | 49.1 | Very low | 104 Ų | 104 | 127.1 Ų | 127.1 | 86% | 0.86 | 81% | 0.812 | S | S | * | * | trans | -77.3 | 56.1 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | V57 | V57-A59 PolarHBondContact O-N 3.35Š| ||
| 60 | S | 52.2 | Low | 49.2 | Very low | 103 Ų | 103 | 127.1 Ų | 127.1 | 72% | 0.72 | 81% | 0.81 | S | S | * | * | trans | -96.8 | 7 | -175.6 | -59.5 | 0 | 0 | 0 | 0 | 114.7 | S58 | S58-S60 PolarHBondContact O-N 3Š| ||
| 61 | T | 52.2 | Low | 49.3 | Very low | 124 Ų | 124 | 129.3 Ų | 129.3 | 76% | 0.761 | 81% | 0.81 | S | S | * | * | S | Bend | trans | -102.3 | 3.5 | -168.5 | 39.3 | 0 | 0 | 0 | 0 | 116.6 | ||
| 62 | L | 50.3 | Low | 50.2 | Low | 166 Ų | 166 | 133.3 Ų | 133.3 | 87% | 0.869 | 81% | 0.81 | S | S | * | * | S | Bend | trans | -110.1 | 17.2 | -175.9 | -65.9 | -177.3 | 0 | 0 | 0 | 116.7 | ||
| 63 | L | 52.1 | Low | 51.1 | Low | 179 Ų | 179 | 133.1 Ų | 133.1 | 94% | 0.937 | 80% | 0.802 | S | S | * | * | trans | -118.6 | 41.5 | 174.9 | -76.7 | 168.9 | 0 | 0 | 0 | 112.8 | ||||
| 64 | A | 49.6 | Very low | 51.3 | Low | 91 Ų | 91 | 130.8 Ų | 130.8 | 75% | 0.752 | 79% | 0.792 | S | S | * | * | trans | -97.3 | 26.3 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 65 | L | 48.8 | Very low | 52 | Low | 173 Ų | 173 | 128.7 Ų | 128.7 | 91% | 0.906 | 78% | 0.78 | S | S | * | * | trans | -143.5 | 69.8 | -179.8 | -145.2 | 83 | 0 | 0 | 0 | 113.8 | ||||
| 66 | A | 43.3 | Very low | 53 | Low | 100 Ų | 100 | 130.4 Ų | 130.4 | 83% | 0.826 | 78% | 0.779 | S | S | * | * | trans | -170.6 | 107.5 | 153.6 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 67 | S | 36.8 | Very low | 54.3 | Low | 120 Ų | 120 | 126.3 Ų | 126.3 | 84% | 0.839 | 76% | 0.755 | S | S | * | * | trans | -73.3 | 174.9 | 163.9 | -79 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 68 | P | 50.5 | Low | 55.5 | Low | 122 Ų | 122 | 122.5 Ų | 122.5 | 79% | 0.792 | 73% | 0.73 | S | S | * | * | cis | -129 | 136.5 | -39.9 | 33.4 | -16.8 | 0 | 0 | 0 | 111.3 | ||||
| 69 | A | 39.8 | Very low | 56.3 | Low | 98 Ų | 98 | 123.9 Ų | 123.9 | 81% | 0.81 | 73% | 0.725 | S | S | * | * | trans | -160.5 | 123.8 | 156 | 0 | 0 | 0 | 0 | 0 | 109.7 | R71 | A69-R71 PolarHBondContact O-N 3.48Š| ||
| 70 | T | 52.8 | Low | 57.3 | Low | 119 Ų | 119 | 128.5 Ų | 128.5 | 73% | 0.73 | 72% | 0.72 | S | S | * | * | trans | -50.6 | 86.6 | 179.3 | -57.3 | 0 | 0 | 0 | 0 | 112.8 | R72 | T70-R72 VanDerWaalsContact C-N 3.35Å; T70-R72 HydrophobicContact CG2-CG 3.84Å; T70-R72 PolarHBondContact O-N 2.99Å | ||
| 71 | R | 50.8 | Low | 58 | Low | 232 Ų | 232 | 132.4 Ų | 132.4 | 88% | 0.875 | 72% | 0.719 | S | S | * | * | trans | -85 | 79.8 | 166.8 | -163.5 | -179.1 | -166.9 | -88.5 | 1.8 | 108.6 | A69 S73 | A69-R71 PolarHBondContact O-N 3.48Å; R71-S73 PolarHBondContact O-N 3.37Å | ||
| 72 | R | 63.7 | Low | 58.4 | Low | 209 Ų | 209 | 130.9 Ų | 130.9 | 79% | 0.789 | 71% | 0.709 | S | S | * | * | trans | -67.2 | 114.7 | 167.3 | -81 | 177.8 | 164 | 128.5 | -0.7 | 108.1 | T70 I74 | T70-R72 VanDerWaalsContact C-N 3.35Å; T70-R72 HydrophobicContact CG2-CG 3.84Å; T70-R72 PolarHBondContact O-N 2.99Å; R72-I74 PolarHBondContact O-N 3.26Å; R72-I74 VanDerWaalsContact O-N 3.12Å | ||
| 73 | S | 66.3 | Low | 59 | Low | 97 Ų | 97 | 126.8 Ų | 126.8 | 68% | 0.678 | 69% | 0.691 | S | S | * | * | trans | -63.9 | 108 | 168.9 | 55.2 | 0 | 0 | 0 | 0 | 108.2 | R71 S75 | R71-S73 PolarHBondContact O-N 3.37Å; S73-S75 PolarHBondContact O-N 3.27Å | ||
| 74 | I | 68.2 | Low | 59.3 | Low | 125 Ų | 125 | 120.1 Ų | 120.1 | 64% | 0.641 | 67% | 0.665 | S | S | * | * | trans | -70.9 | 120.3 | 174.4 | 50.5 | 171.6 | 0 | 0 | 0 | 109 | R72 F79 | R72-I74 PolarHBondContact O-N 3.26Å; R72-I74 VanDerWaalsContact O-N 3.12Å; I74-F79 HydrophobicContact CD1-CE2 4.28Å; I74-F79 HydrophobicContact CD1-CZ 3.99Å | ||
| 75 | S | 75.6 | Confident | 59.8 | Low | 71 Ų | 71 | 119.1 Ų | 119.1 | 50% | 0.497 | 66% | 0.657 | S | S | . | * | trans | -89.3 | 154.6 | 176.1 | 177.4 | 0 | 0 | 0 | 0 | 109.8 | S73 G77 D78 | S73-S75 PolarHBondContact O-N 3.27Å; S75-G77 PolarHBondContact O-N 3.11Å; S75-D78 PolarHBondContact N-OD2 2.79Å; S75-D78 WeakPolarHBondContact O-CB 3.28Å; S75-D78 PolarHBondContact O-N 2.9Å | ||
| 76 | M | 70.1 | Confident | 60.2 | Low | 156 Ų | 156 | 117.2 Ų | 117.2 | 77% | 0.768 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -52 | -25.3 | 174.4 | -168.4 | 66.4 | 68.9 | 0 | 0 | 112.7 | ||
| 77 | G | 75.3 | Confident | 60.9 | Low | 29 Ų | 29 | 119 Ų | 119 | 30% | 0.299 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -74.3 | -17.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | S75 | S75-G77 PolarHBondContact O-N 3.11Å |
| 78 | D | 73.7 | Confident | 61.7 | Low | 60 Ų | 60 | 117.6 Ų | 117.6 | 32% | 0.321 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -77.2 | -33.4 | -177.4 | -65.9 | -29.3 | 0 | 0 | 0 | 112.1 | S75 R80 R81 V82 | S75-D78 PolarHBondContact N-OD2 2.79Å; S75-D78 WeakPolarHBondContact O-CB 3.28Å; S75-D78 PolarHBondContact O-N 2.9Å; D78-R80 VanDerWaalsContact C-N 3.32Å; D78-R80 PolarHBondContact O-N 2.94Å; D78-R81 PolarHBondContact O-N 3.17Å; D78-R81 IonicContact OD1-NH2 3.96Å; D78-V82 PolarHBondContact O-N 3.06Å |
| 79 | F | 63.4 | Low | 61.6 | Low | 124 Ų | 124 | 114.9 Ų | 114.9 | 54% | 0.544 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -61.1 | -41.4 | 173.8 | -69 | -79.7 | 0 | 0 | 0 | 111.9 | I74 R81 V82 T83 | I74-F79 HydrophobicContact CD1-CE2 4.28Å; I74-F79 HydrophobicContact CD1-CZ 3.99Å; F79-R81 VanDerWaalsContact C-N 3.29Å; F79-R81 PolarHBondContact O-N 3.2Å; F79-V82 PolarHBondContact O-N 3.41Å; F79-T83 PolarHBondContact O-N 3.33Å; F79-T83 PolarHBondContact O-OG1 3.28Å |
| 80 | R | 68.4 | Low | 62.1 | Low | 200 Ų | 200 | 114.3 Ų | 114.3 | 76% | 0.755 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -64.3 | -33.9 | -179.5 | -65 | -172.7 | 178.9 | -90.4 | 0.4 | 112.4 | D78 G84 | D78-R80 VanDerWaalsContact C-N 3.32Å; D78-R80 PolarHBondContact O-N 2.94Å; R80-G84 PolarHBondContact O-N 3.48Å |
| 81 | R | 65.3 | Low | 61.7 | Low | 186 Ų | 186 | 116.4 Ų | 116.4 | 70% | 0.702 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -72.1 | -38.7 | 177.2 | -80.2 | -172.2 | -100.1 | -121.3 | 1.6 | 112.9 | D78 F79 G84 A85 | D78-R81 PolarHBondContact O-N 3.17Å; D78-R81 IonicContact OD1-NH2 3.96Å; F79-R81 VanDerWaalsContact C-N 3.29Å; F79-R81 PolarHBondContact O-N 3.2Å; R81-G84 PolarHBondContact O-N 3.28Å; R81-A85 PolarHBondContact O-N 2.86Å |
| 82 | V | 62.3 | Low | 62 | Low | 91 Ų | 91 | 110.5 Ų | 110.5 | 55% | 0.552 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -65.4 | -41.6 | 174.8 | 172.2 | 0 | 0 | 0 | 0 | 110.9 | D78 F79 G84 A85 L86 | D78-V82 PolarHBondContact O-N 3.06Å; F79-V82 PolarHBondContact O-N 3.41Å; V82-G84 VanDerWaalsContact C-N 3.35Å; V82-G84 PolarHBondContact O-N 3.33Å; V82-A85 PolarHBondContact O-N 2.97Å; V82-L86 HydrophobicContact CG1-CD1 4.38Å; V82-L86 WeakPolarHBondContact O-CG 3.29Å; V82-L86 PolarHBondContact O-N 2.97Å; V82-L86 VanDerWaalsContact O-N 3.15Å |
| 83 | T | 62 | Low | 61.4 | Low | 81 Ų | 81 | 106.2 Ų | 106.2 | 50% | 0.497 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -66 | -35.9 | 175.7 | -49.4 | 0 | 0 | 0 | 0 | 112.4 | F79 L86 L87 | F79-T83 PolarHBondContact O-N 3.33Å; F79-T83 PolarHBondContact O-OG1 3.28Å; T83-L86 PolarHBondContact O-N 3.12Å; T83-L87 HydrophobicContact CG2-CD1 4.28Å; T83-L87 PolarHBondContact O-N 2.8Å |
| 84 | G | 59 | Low | 60.7 | Low | 39 Ų | 39 | 107.7 Ų | 107.7 | 40% | 0.402 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -66.7 | -36.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | R80 R81 V82 L87 A88 | R80-G84 PolarHBondContact O-N 3.48Å; R81-G84 PolarHBondContact O-N 3.28Å; V82-G84 VanDerWaalsContact C-N 3.35Å; V82-G84 PolarHBondContact O-N 3.33Å; G84-L87 PolarHBondContact O-N 3.01Å; G84-A88 WeakPolarHBondContact O-CB 3.42Å; G84-A88 PolarHBondContact O-N 3.12Å |
| 85 | A | 59.5 | Low | 59.5 | Low | 69 Ų | 69 | 108 Ų | 108 | 57% | 0.57 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -71.4 | -30.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113 | R81 V82 | R81-A85 PolarHBondContact O-N 2.86Å; V82-A85 PolarHBondContact O-N 2.97Å |
| 86 | L | 57.2 | Low | 57.9 | Low | 134 Ų | 134 | 109.5 Ų | 109.5 | 70% | 0.702 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -74.3 | -26.9 | 174.8 | -71.4 | 171.9 | 0 | 0 | 0 | 113.1 | V82 T83 | V82-L86 HydrophobicContact CG1-CD1 4.38Å; V82-L86 WeakPolarHBondContact O-CG 3.29Å; V82-L86 PolarHBondContact O-N 2.97Å; V82-L86 VanDerWaalsContact O-N 3.15Å; T83-L86 PolarHBondContact O-N 3.12Å |
| 87 | L | 58.3 | Low | 57.4 | Low | 137 Ų | 137 | 107 Ų | 107 | 72% | 0.717 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -87.3 | -21 | 178 | -81.7 | 158.6 | 0 | 0 | 0 | 113.9 | T83 G84 | T83-L87 HydrophobicContact CG2-CD1 4.28Å; T83-L87 PolarHBondContact O-N 2.8Å; G84-L87 PolarHBondContact O-N 3.01Å |
| 88 | A | 53.6 | Low | 56.1 | Low | 91 Ų | 91 | 111.5 Ų | 111.5 | 75% | 0.752 | 67% | 0.674 | S | S | * | * | S | Bend | trans | -98.4 | 5.1 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | G84 | G84-A88 WeakPolarHBondContact O-CB 3.42Å; G84-A88 PolarHBondContact O-N 3.12Å |
| 89 | G | 48.8 | Very low | 54.7 | Low | 64 Ų | 64 | 112.4 Ų | 112.4 | 66% | 0.66 | 69% | 0.69 | S | S | * | * | trans | -112.8 | 10.4 | -175.5 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 90 | S | 49.4 | Very low | 54.2 | Low | 86 Ų | 86 | 113.2 Ų | 113.2 | 60% | 0.601 | 71% | 0.708 | S | S | * | * | trans | -102.9 | 83.2 | -177.1 | 62.8 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 91 | D | 45.3 | Very low | 53.1 | Low | 164 Ų | 164 | 108 Ų | 108 | 88% | 0.877 | 70% | 0.701 | S | S | * | * | trans | -140.7 | 102.8 | 155.6 | -90.9 | -35.3 | 0 | 0 | 0 | 109.8 | ||||
| 92 | P | 56 | Low | 52.8 | Low | 108 Ų | 108 | 104.8 Ų | 104.8 | 70% | 0.701 | 71% | 0.708 | S | S | * | * | trans | -105.4 | 143 | 149.7 | 33.4 | -26.5 | 0 | 0 | 0 | 110.1 | S94 | P92-S94 PolarHBondContact O-N 3.37Š| ||
| 93 | P | 51.1 | Low | 52.3 | Low | 119 Ų | 119 | 109.6 Ų | 109.6 | 77% | 0.773 | 72% | 0.721 | S | S | * | * | trans | -60.3 | 132.3 | 178 | 24.6 | -32.5 | 0 | 0 | 0 | 110.8 | T95 | P93-T95 PolarHBondContact O-N 2.61Å; P93-T95 VanDerWaalsContact O-N 3.13Å | ||
| 94 | S | 52 | Low | 51.9 | Low | 128 Ų | 128 | 112.9 Ų | 112.9 | 90% | 0.895 | 74% | 0.735 | S | S | * | * | trans | -46.9 | 114.6 | 169.5 | -71.4 | 0 | 0 | 0 | 0 | 110.6 | P92 | P92-S94 PolarHBondContact O-N 3.37Š| ||
| 95 | T | 44.1 | Very low | 51.9 | Low | 131 Ų | 131 | 116.1 Ų | 116.1 | 80% | 0.804 | 75% | 0.747 | S | S | * | * | trans | -122.9 | 136 | 158.7 | 52.6 | 0 | 0 | 0 | 0 | 108.3 | P93 | P93-T95 PolarHBondContact O-N 2.61Å; P93-T95 VanDerWaalsContact O-N 3.13Å | ||
| 96 | S | 41.9 | Very low | 52 | Low | 102 Ų | 102 | 116.4 Ų | 116.4 | 71% | 0.713 | 74% | 0.742 | S | S | * | * | trans | -54.8 | 148.2 | -163.7 | 58 | 0 | 0 | 0 | 0 | 114.9 | T98 | S96-T98 PolarHBondContact O-N 3.17Å; S96-T98 VanDerWaalsContact O-N 3.13Å | ||
| 97 | A | 58.9 | Low | 52.3 | Low | 105 Ų | 105 | 115.4 Ų | 115.4 | 87% | 0.868 | 74% | 0.743 | S | S | * | * | trans | -42.6 | 116.2 | 158.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 98 | T | 47.1 | Very low | 52.5 | Low | 123 Ų | 123 | 112.7 Ų | 112.7 | 76% | 0.755 | 74% | 0.735 | S | S | * | * | trans | -137.2 | 131.8 | 160.2 | -66.2 | 0 | 0 | 0 | 0 | 106.3 | S96 | S96-T98 PolarHBondContact O-N 3.17Å; S96-T98 VanDerWaalsContact O-N 3.13Å | ||
| 99 | A | 44.6 | Very low | 53.1 | Low | 78 Ų | 78 | 109.9 Ų | 109.9 | 65% | 0.645 | 71% | 0.71 | S | S | * | * | trans | -43.4 | 154.2 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | S101 | A99-S101 PolarHBondContact O-N 3.19Š| ||
| 100 | P | 53.8 | Low | 54 | Low | 142 Ų | 142 | 110 Ų | 110 | 92% | 0.922 | 70% | 0.701 | S | S | * | * | trans | -69.7 | 75.5 | 173.9 | 31.3 | -34 | 0 | 0 | 0 | 109.6 | S102 | P100-S102 PolarHBondContact O-N 2.86Š| ||
| 101 | S | 45.9 | Very low | 55.3 | Low | 89 Ų | 89 | 112.3 Ų | 112.3 | 62% | 0.622 | 70% | 0.704 | S | S | * | * | trans | -75.1 | 112.2 | 171.1 | 177.9 | 0 | 0 | 0 | 0 | 107.4 | A99 K103 | A99-S101 PolarHBondContact O-N 3.19Å; S101-K103 PolarHBondContact O-N 2.93Å | ||
| 102 | S | 57.2 | Low | 57 | Low | 119 Ų | 119 | 110.6 Ų | 110.6 | 83% | 0.832 | 69% | 0.691 | S | S | * | * | trans | 0.2 | 86 | 152.9 | 177.9 | 0 | 0 | 0 | 0 | 113.3 | P100 | P100-S102 PolarHBondContact O-N 2.86Š| ||
| 103 | K | 52.8 | Low | 58.3 | Low | 193 Ų | 193 | 112.2 Ų | 112.2 | 84% | 0.839 | 69% | 0.687 | S | S | * | * | trans | -87 | 112.4 | 166.9 | -74.4 | -178.9 | -177.4 | 174.8 | 0 | 106.3 | S101 V105 | S101-K103 PolarHBondContact O-N 2.93Å; K103-V105 PolarHBondContact O-N 3.34Å; K103-V105 VanDerWaalsContact O-N 3.12Å | ||
| 104 | L | 54.4 | Low | 59.9 | Low | 149 Ų | 149 | 111.4 Ų | 111.4 | 78% | 0.78 | 67% | 0.673 | S | S | * | * | trans | -22 | 114.7 | 153.5 | -154.2 | 83 | 0 | 0 | 0 | 109.5 | T106 | L104-T106 PolarHBondContact O-N 3.37Š| ||
| 105 | V | 58.6 | Low | 61.7 | Low | 108 Ų | 108 | 107 Ų | 107 | 66% | 0.655 | 64% | 0.644 | S | S | * | * | trans | -61 | 92.6 | 170.9 | 171.2 | 0 | 0 | 0 | 0 | 106.2 | K103 | K103-V105 PolarHBondContact O-N 3.34Å; K103-V105 VanDerWaalsContact O-N 3.12Å | ||
| 106 | T | 60.8 | Low | 63.8 | Low | 75 Ų | 75 | 103.2 Ų | 103.2 | 46% | 0.46 | 63% | 0.626 | S | S | . | * | trans | -69.6 | 138.1 | 170.6 | 37.4 | 0 | 0 | 0 | 0 | 107.1 | L104 S108 S109 | L104-T106 PolarHBondContact O-N 3.37Å; T106-S108 PolarHBondContact O-N 2.96Å; T106-S109 PolarHBondContact O-N 3.2Å | ||
| 107 | P | 63.6 | Low | 66.1 | Low | 112 Ų | 112 | 107.1 Ų | 107.1 | 73% | 0.727 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -55.3 | -20.6 | -173.3 | 15.3 | -28 | 0 | 0 | 0 | 114.3 | ||
| 108 | S | 62.1 | Low | 67.8 | Low | 80 Ų | 80 | 109.5 Ų | 109.5 | 56% | 0.559 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -68.1 | -39.8 | 172.6 | -162.1 | 0 | 0 | 0 | 0 | 113.9 | T106 S110 M111 | T106-S108 PolarHBondContact O-N 2.96Å; S108-S110 VanDerWaalsContact C-N 3.32Å; S108-S110 PolarHBondContact O-N 3.39Å; S108-M111 PolarHBondContact O-N 2.92Å |
| 109 | S | 65.7 | Low | 70.1 | Confident | 33 Ų | 33 | 112 Ų | 112 | 23% | 0.231 | 61% | 0.607 | C | S | . | * | H | α-helix | trans | -69.3 | -31.6 | 179.1 | 171.7 | 0 | 0 | 0 | 0 | 111.9 | T106 M111 E112 F113 | T106-S109 PolarHBondContact O-N 3.2Å; S109-M111 VanDerWaalsContact C-N 3.31Å; S109-M111 PolarHBondContact O-N 3.39Å; S109-E112 WeakPolarHBondContact O-CB 3.33Å; S109-E112 PolarHBondContact O-N 3.13Å; S109-E112 VanDerWaalsContact O-N 3.14Å; S109-F113 WeakPolarHBondContact O-CD2 3.46Å; S109-F113 PolarHBondContact O-N 3.24Å; S109-F113 VanDerWaalsContact O-N 3.15Å; S109-F113 VanDerWaalsContact OG-CE2 3.3Å; S109-F113 WeakPolarHBondContact OG-CE2 3.24Å |
| 110 | S | 69.6 | Low | 72.5 | Confident | 65 Ų | 65 | 113 Ų | 113 | 46% | 0.455 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -59 | -40.3 | 176.4 | -168.8 | 0 | 0 | 0 | 0 | 112.6 | S108 E112 F113 E114 | S108-S110 VanDerWaalsContact C-N 3.32Å; S108-S110 PolarHBondContact O-N 3.39Å; S110-E112 VanDerWaalsContact C-N 3.34Å; S110-E112 PolarHBondContact O-N 3.22Å; S110-F113 PolarHBondContact O-N 3.3Å; S110-E114 PolarHBondContact O-N 3.35Å |
| 111 | M | 75.6 | Confident | 74.5 | Confident | 136 Ų | 136 | 110.2 Ų | 110.2 | 67% | 0.67 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -69.2 | -31.4 | 176.6 | -75.1 | -172.6 | 55.8 | 0 | 0 | 113 | S108 S109 E114 A115 | S108-M111 PolarHBondContact O-N 2.92Å; S109-M111 VanDerWaalsContact C-N 3.31Å; S109-M111 PolarHBondContact O-N 3.39Å; M111-E114 PolarHBondContact O-N 3.02Å; M111-A115 WeakPolarHBondContact O-CB 3.39Å; M111-A115 PolarHBondContact O-N 3.19Å |
| 112 | E | 80.2 | Confident | 76.8 | Confident | 128 Ų | 128 | 110 Ų | 110 | 60% | 0.598 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -70.3 | -36.9 | 177 | -66.4 | 174.3 | -175.7 | 0 | 0 | 111.7 | S109 S110 A115 A116 | S109-E112 WeakPolarHBondContact O-CB 3.33Å; S109-E112 PolarHBondContact O-N 3.13Å; S109-E112 VanDerWaalsContact O-N 3.14Å; S110-E112 VanDerWaalsContact C-N 3.34Å; S110-E112 PolarHBondContact O-N 3.22Å; E112-A115 PolarHBondContact O-N 3.22Å; E112-A116 WeakPolarHBondContact O-CB 3.43Å; E112-A116 PolarHBondContact O-N 2.96Å |
| 113 | F | 83.6 | Confident | 78.7 | Confident | 142 Ų | 142 | 108.2 Ų | 108.2 | 62% | 0.623 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -65.5 | -38.7 | 172.1 | -77 | -70.4 | 0 | 0 | 0 | 112.2 | S109 S110 A116 R117 | S109-F113 WeakPolarHBondContact O-CD2 3.46Å; S109-F113 PolarHBondContact O-N 3.24Å; S109-F113 VanDerWaalsContact O-N 3.15Å; S109-F113 VanDerWaalsContact OG-CE2 3.3Å; S109-F113 WeakPolarHBondContact OG-CE2 3.24Å; S110-F113 PolarHBondContact O-N 3.3Å; F113-A116 PolarHBondContact O-N 3.44Å; F113-R117 WeakPolarHBondContact O-CB 3.37Å; F113-R117 PolarHBondContact O-N 3.27Å |
| 114 | E | 86 | Confident | 80.7 | Confident | 101 Ų | 101 | 102.7 Ų | 102.7 | 47% | 0.472 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65.6 | -41.1 | 174.4 | -162.7 | -175.5 | 169.6 | 0 | 0 | 111.5 | S110 M111 R117 R118 | S110-E114 PolarHBondContact O-N 3.35Å; M111-E114 PolarHBondContact O-N 3.02Å; E114-R117 PolarHBondContact O-N 2.78Å; E114-R118 WeakPolarHBondContact O-CG 3.39Å; E114-R118 PolarHBondContact O-N 3.46Å; E114-R118 IonicContact OE1-CZ 3.54Å; E114-R118 IonicContact OE1-NE 3.75Å; E114-R118 IonicContact OE1-NH2 2.67Å; E114-R118 PolarHBondContact OE1-NH2 3.29Å; E114-R118 IonicContact OE2-NH2 3.73Å |
| 115 | A | 88.3 | Confident | 82.7 | Confident | 35 Ų | 35 | 101.7 Ų | 101.7 | 29% | 0.289 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.1 | -41.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | M111 E112 R117 R118 R119 | M111-A115 WeakPolarHBondContact O-CB 3.39Å; M111-A115 PolarHBondContact O-N 3.19Å; E112-A115 PolarHBondContact O-N 3.22Å; A115-R117 VanDerWaalsContact C-N 3.34Å; A115-R118 PolarHBondContact O-N 3Å; A115-R119 WeakPolarHBondContact O-CG 3.47Å; A115-R119 PolarHBondContact O-N 3.49Å; A115-R119 VanDerWaalsContact O-N 3.09Å |
| 116 | A | 88.4 | Confident | 84.5 | Confident | 53 Ų | 53 | 103.1 Ų | 103.1 | 44% | 0.438 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63 | -40.6 | 175 | 0 | 0 | 0 | 0 | 0 | 111.7 | E112 F113 R119 L120 | E112-A116 WeakPolarHBondContact O-CB 3.43Å; E112-A116 PolarHBondContact O-N 2.96Å; F113-A116 PolarHBondContact O-N 3.44Å; A116-R119 PolarHBondContact O-N 3.32Å; A116-L120 PolarHBondContact O-N 3.48Å |
| 117 | R | 92.1 | Very high | 86.2 | Confident | 184 Ų | 184 | 103.8 Ų | 103.8 | 69% | 0.694 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.8 | -43.7 | 175.4 | -175.4 | -179.8 | 179 | -173.7 | 0.3 | 112.4 | F113 E114 A115 R119 L120 L121 | F113-R117 WeakPolarHBondContact O-CB 3.37Å; F113-R117 PolarHBondContact O-N 3.27Å; E114-R117 PolarHBondContact O-N 2.78Å; A115-R117 VanDerWaalsContact C-N 3.34Å; R117-R119 VanDerWaalsContact C-N 3.33Å; R117-R119 PolarHBondContact O-N 3.11Å; R117-L120 PolarHBondContact O-N 3.36Å; R117-L121 PolarHBondContact O-N 2.89Å |
| 118 | R | 94.3 | Very high | 87.8 | Confident | 155 Ų | 155 | 107 Ų | 107 | 59% | 0.585 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -61.1 | -42.5 | 176 | -69.4 | 175.9 | -167.7 | 162.1 | 2.5 | 111.6 | E114 A115 L121 E122 | E114-R118 WeakPolarHBondContact O-CG 3.39Å; E114-R118 PolarHBondContact O-N 3.46Å; E114-R118 IonicContact OE1-CZ 3.54Å; E114-R118 IonicContact OE1-NE 3.75Å; E114-R118 IonicContact OE1-NH2 2.67Å; E114-R118 PolarHBondContact OE1-NH2 3.29Å; E114-R118 IonicContact OE2-NH2 3.73Å; A115-R118 PolarHBondContact O-N 3Å; R118-L121 PolarHBondContact O-N 2.97Å; R118-E122 PolarHBondContact O-N 3.4Å |
| 119 | R | 93.9 | Very high | 89.5 | Confident | 175 Ų | 175 | 107.5 Ų | 107.5 | 66% | 0.66 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -65.5 | -37.3 | 176.4 | -70.3 | 173.7 | -177.2 | 171.3 | 2.3 | 112.7 | A115 A116 R117 E122 V123 | A115-R119 WeakPolarHBondContact O-CG 3.47Å; A115-R119 PolarHBondContact O-N 3.49Å; A115-R119 VanDerWaalsContact O-N 3.09Å; A116-R119 PolarHBondContact O-N 3.32Å; R117-R119 VanDerWaalsContact C-N 3.33Å; R117-R119 PolarHBondContact O-N 3.11Å; R119-E122 PolarHBondContact O-N 2.83Å; R119-V123 WeakPolarHBondContact O-CG2 3.42Å; R119-V123 PolarHBondContact O-N 3.43Å; R119-V123 VanDerWaalsContact O-N 3.08Å |
| 120 | L | 95.1 | Very high | 91 | Very high | 100 Ų | 100 | 110.4 Ų | 110.4 | 52% | 0.524 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.9 | -45.8 | 176.5 | -179.2 | 62.2 | 0 | 0 | 0 | 111.4 | A116 R117 E122 V123 E124 | A116-L120 PolarHBondContact O-N 3.48Å; R117-L120 PolarHBondContact O-N 3.36Å; L120-E122 VanDerWaalsContact C-N 3.31Å; L120-E122 PolarHBondContact O-N 3.39Å; L120-V123 PolarHBondContact O-N 3.1Å; L120-V123 VanDerWaalsContact O-N 3.14Å; L120-E124 WeakPolarHBondContact O-CG 3.44Å; L120-E124 PolarHBondContact O-N 2.95Å |
| 121 | L | 95.6 | Very high | 92.4 | Very high | 83 Ų | 83 | 113 Ų | 113 | 44% | 0.435 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -60.9 | -40.6 | 177.2 | -68.2 | 173.7 | 0 | 0 | 0 | 112 | R117 R118 V123 E124 E125 | R117-L121 PolarHBondContact O-N 2.89Å; R118-L121 PolarHBondContact O-N 2.97Å; L121-V123 VanDerWaalsContact C-N 3.32Å; L121-V123 PolarHBondContact O-N 2.9Å; L121-E124 WeakPolarHBondContact O-CB 3.17Å; L121-E124 PolarHBondContact O-N 3.44Å; L121-E125 WeakPolarHBondContact O-CG 3.36Å; L121-E125 PolarHBondContact O-N 2.92Å |
| 122 | E | 95.3 | Very high | 93.5 | Very high | 83 Ų | 83 | 109.3 Ų | 109.3 | 39% | 0.388 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62 | -38.4 | 175.5 | -172.2 | -171.9 | 161.9 | 0 | 0 | 112.3 | R118 R119 L120 R126 | R118-E122 PolarHBondContact O-N 3.4Å; R119-E122 PolarHBondContact O-N 2.83Å; L120-E122 VanDerWaalsContact C-N 3.31Å; L120-E122 PolarHBondContact O-N 3.39Å; E122-R126 VanDerWaalsContact CD-NH1 3.34Å; E122-R126 WeakPolarHBondContact O-CG 3.5Å; E122-R126 PolarHBondContact O-N 3.48Å; E122-R126 VanDerWaalsContact O-N 3.14Å; E122-R126 IonicContact OE1-CZ 3.04Å; E122-R126 IonicContact OE1-NH1 3.17Å; E122-R126 PolarHBondContact OE1-NH1 3.45Å; E122-R126 IonicContact OE1-NH2 2.62Å; E122-R126 PolarHBondContact OE1-NH2 2.81Å |
| 123 | V | 96.7 | Very high | 94.3 | Very high | 82 Ų | 82 | 107.1 Ų | 107.1 | 50% | 0.497 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -69.7 | -39.1 | 174.6 | 172.8 | 0 | 0 | 0 | 0 | 111.3 | R119 L120 L121 R126 Q127 | R119-V123 WeakPolarHBondContact O-CG2 3.42Å; R119-V123 PolarHBondContact O-N 3.43Å; R119-V123 VanDerWaalsContact O-N 3.08Å; L120-V123 PolarHBondContact O-N 3.1Å; L120-V123 VanDerWaalsContact O-N 3.14Å; L121-V123 VanDerWaalsContact C-N 3.32Å; L121-V123 PolarHBondContact O-N 2.9Å; V123-R126 PolarHBondContact O-N 2.81Å; V123-Q127 WeakPolarHBondContact O-CB 2.98Å; V123-Q127 PolarHBondContact O-N 3.24Å |
| 124 | E | 95.6 | Very high | 95 | Very high | 78 Ų | 78 | 105.1 Ų | 105.1 | 36% | 0.364 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.5 | -41.8 | 175.5 | -73 | 178.5 | -176.3 | 0 | 0 | 112.1 | L120 L121 Q127 R128 | L120-E124 WeakPolarHBondContact O-CG 3.44Å; L120-E124 PolarHBondContact O-N 2.95Å; L121-E124 WeakPolarHBondContact O-CB 3.17Å; L121-E124 PolarHBondContact O-N 3.44Å; E124-Q127 WeakPolarHBondContact O-CB 3.06Å; E124-Q127 PolarHBondContact O-N 3.36Å; E124-R128 PolarHBondContact O-N 3.25Å |
| 125 | E | 95.2 | Very high | 95.6 | Very high | 127 Ų | 127 | 105.7 Ų | 105.7 | 59% | 0.593 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -61.1 | -46 | 174.5 | -73.9 | 174.5 | -178.6 | 0 | 0 | 111.4 | L121 Q127 R128 V129 | L121-E125 WeakPolarHBondContact O-CG 3.36Å; L121-E125 PolarHBondContact O-N 2.92Å; E125-Q127 VanDerWaalsContact C-N 3.29Å; E125-Q127 PolarHBondContact O-N 2.87Å; E125-R128 WeakPolarHBondContact O-CB 3.35Å; E125-R128 PolarHBondContact O-N 2.88Å; E125-V129 PolarHBondContact O-N 2.7Å |
| 126 | R | 96.5 | Very high | 96.1 | Very high | 138 Ų | 138 | 110.3 Ų | 110.3 | 52% | 0.521 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.2 | -39.8 | 173.9 | -73.6 | 174.5 | 173 | 131.1 | 6.7 | 112 | E122 V123 R128 V129 I130 | E122-R126 VanDerWaalsContact CD-NH1 3.34Å; E122-R126 WeakPolarHBondContact O-CG 3.5Å; E122-R126 PolarHBondContact O-N 3.48Å; E122-R126 VanDerWaalsContact O-N 3.14Å; E122-R126 IonicContact OE1-CZ 3.04Å; E122-R126 IonicContact OE1-NH1 3.17Å; E122-R126 PolarHBondContact OE1-NH1 3.45Å; E122-R126 IonicContact OE1-NH2 2.62Å; E122-R126 PolarHBondContact OE1-NH2 2.81Å; V123-R126 PolarHBondContact O-N 2.81Å; R126-R128 VanDerWaalsContact C-N 3.31Å; R126-R128 PolarHBondContact O-N 3.31Å; R126-V129 WeakPolarHBondContact O-CB 3.16Å; R126-V129 PolarHBondContact O-N 2.99Å; R126-I130 WeakPolarHBondContact O-CG1 3.38Å; R126-I130 PolarHBondContact O-N 3.19Å |
| 127 | Q | 97.4 | Very high | 96.5 | Very high | 90 Ų | 90 | 113.1 Ų | 113.1 | 42% | 0.421 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.3 | -35.2 | 178.9 | -161.3 | -170.9 | 19.1 | 0 | 0 | 112 | V123 E124 E125 V129 I130 R131 | V123-Q127 WeakPolarHBondContact O-CB 2.98Å; V123-Q127 PolarHBondContact O-N 3.24Å; E124-Q127 WeakPolarHBondContact O-CB 3.06Å; E124-Q127 PolarHBondContact O-N 3.36Å; E125-Q127 VanDerWaalsContact C-N 3.29Å; E125-Q127 PolarHBondContact O-N 2.87Å; Q127-V129 VanDerWaalsContact C-N 3.31Å; Q127-V129 PolarHBondContact O-N 3.41Å; Q127-I130 PolarHBondContact O-N 3.04Å; Q127-R131 VanDerWaalsContact CD-CZ 3.4Å; Q127-R131 WeakPolarHBondContact O-CG 3.39Å; Q127-R131 PolarHBondContact O-N 2.94Å |
| 128 | R | 97.5 | Very high | 96.8 | Very high | 179 Ų | 179 | 110.4 Ų | 110.4 | 68% | 0.675 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -61.1 | -42 | 172.9 | -69.6 | -179.5 | -172 | -174.1 | 3.6 | 111.5 | E124 E125 R126 R131 E132 | E124-R128 PolarHBondContact O-N 3.25Å; E125-R128 WeakPolarHBondContact O-CB 3.35Å; E125-R128 PolarHBondContact O-N 2.88Å; R126-R128 VanDerWaalsContact C-N 3.31Å; R126-R128 PolarHBondContact O-N 3.31Å; R128-R131 PolarHBondContact O-N 3.37Å; R128-E132 PolarHBondContact O-N 2.89Å; R128-E132 VanDerWaalsContact O-N 3.16Å |
| 129 | V | 97.8 | Very high | 97 | Very high | 91 Ų | 91 | 107.2 Ų | 107.2 | 55% | 0.552 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -63.8 | -43.1 | 176.2 | 179.7 | 0 | 0 | 0 | 0 | 111.2 | E125 R126 Q127 R131 E132 M133 | E125-V129 PolarHBondContact O-N 2.7Å; R126-V129 WeakPolarHBondContact O-CB 3.16Å; R126-V129 PolarHBondContact O-N 2.99Å; Q127-V129 VanDerWaalsContact C-N 3.31Å; Q127-V129 PolarHBondContact O-N 3.41Å; V129-R131 PolarHBondContact O-N 3.28Å; V129-E132 PolarHBondContact O-N 3.45Å; V129-M133 HydrophobicContact CG1-CG 4.49Å; V129-M133 WeakPolarHBondContact O-CG 3.28Å; V129-M133 PolarHBondContact O-N 2.83Å |
| 130 | I | 97.5 | Very high | 97.2 | Very high | 94 Ų | 94 | 102.4 Ų | 102.4 | 48% | 0.482 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -61 | -46.5 | 179.3 | -67.8 | 166.1 | 0 | 0 | 0 | 111 | R126 Q127 E132 M133 E134 | R126-I130 WeakPolarHBondContact O-CG1 3.38Å; R126-I130 PolarHBondContact O-N 3.19Å; Q127-I130 PolarHBondContact O-N 3.04Å; I130-E132 VanDerWaalsContact C-N 3.28Å; I130-E132 PolarHBondContact O-N 3.04Å; I130-M133 WeakPolarHBondContact O-CA 3.37Å; I130-M133 WeakPolarHBondContact O-CB 3.32Å; I130-M133 PolarHBondContact O-N 3.25Å; I130-E134 HydrophobicContact CG2-CG 4.46Å; I130-E134 WeakPolarHBondContact O-CG 3.39Å; I130-E134 PolarHBondContact O-N 3.38Å |
| 131 | R | 98 | Very high | 97.4 | Very high | 120 Ų | 120 | 106.7 Ų | 106.7 | 45% | 0.453 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -60.8 | -37.5 | 177.3 | -68.5 | -174.6 | -163.3 | 99.7 | -11.7 | 112.8 | Q127 R128 V129 M133 E134 R135 | Q127-R131 VanDerWaalsContact CD-CZ 3.4Å; Q127-R131 WeakPolarHBondContact O-CG 3.39Å; Q127-R131 PolarHBondContact O-N 2.94Å; R128-R131 PolarHBondContact O-N 3.37Å; V129-R131 PolarHBondContact O-N 3.28Å; R131-M133 VanDerWaalsContact C-N 3.34Å; R131-E134 PolarHBondContact O-N 3.31Å; R131-R135 PolarHBondContact O-N 3.19Å |
| 132 | E | 98.2 | Very high | 97.5 | Very high | 58 Ų | 58 | 107.5 Ų | 107.5 | 27% | 0.271 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -67.9 | -35.3 | 175.2 | 176 | 58.3 | -163.4 | 0 | 0 | 111.9 | R128 V129 I130 R135 R136 | R128-E132 PolarHBondContact O-N 2.89Å; R128-E132 VanDerWaalsContact O-N 3.16Å; V129-E132 PolarHBondContact O-N 3.45Å; I130-E132 VanDerWaalsContact C-N 3.28Å; I130-E132 PolarHBondContact O-N 3.04Å; E132-R135 IonicContact OE1-CZ 3.64Å; E132-R135 IonicContact OE1-NE 2.61Å; E132-R135 IonicContact OE1-NH2 3.1Å; E132-R135 PolarHBondContact OE1-NH2 3.47Å; E132-R135 IonicContact OE2-CZ 2.76Å; E132-R135 IonicContact OE2-NE 3.35Å; E132-R135 PolarHBondContact OE2-NE 3.36Å; E132-R135 IonicContact OE2-NH2 3.6Å; E132-R135 PolarHBondContact OE2-NH2 3.03Å; E132-R136 WeakPolarHBondContact O-CG 3.41Å; E132-R136 PolarHBondContact O-N 3.26Å; E132-R136 VanDerWaalsContact O-N 3.15Å; E132-R136 IonicContact OE1-CZ 2.97Å; E132-R136 IonicContact OE1-NE 2.82Å; E132-R136 PolarHBondContact OE1-NE 2.91Å; E132-R136 IonicContact OE1-NH2 2.84Å; E132-R136 PolarHBondContact OE1-NH2 2.95Å |
| 133 | M | 98.4 | Very high | 97.7 | Very high | 81 Ų | 81 | 108.9 Ų | 108.9 | 40% | 0.399 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -67 | -40.7 | 172.5 | -67.5 | -63.9 | 95 | 0 | 0 | 112.1 | V129 I130 R131 R136 L137 | V129-M133 HydrophobicContact CG1-CG 4.49Å; V129-M133 WeakPolarHBondContact O-CG 3.28Å; V129-M133 PolarHBondContact O-N 2.83Å; I130-M133 WeakPolarHBondContact O-CA 3.37Å; I130-M133 WeakPolarHBondContact O-CB 3.32Å; I130-M133 PolarHBondContact O-N 3.25Å; R131-M133 VanDerWaalsContact C-N 3.34Å; M133-R136 PolarHBondContact O-N 3.2Å; M133-L137 WeakPolarHBondContact O-CG 3.49Å; M133-L137 PolarHBondContact O-N 3.5Å |
| 134 | E | 97.6 | Very high | 97.7 | Very high | 101 Ų | 101 | 111.4 Ų | 111.4 | 47% | 0.472 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -59.6 | -46.7 | 175 | -71 | 168.6 | 169.5 | 0 | 0 | 111 | I130 R131 R136 L137 E138 | I130-E134 HydrophobicContact CG2-CG 4.46Å; I130-E134 WeakPolarHBondContact O-CG 3.39Å; I130-E134 PolarHBondContact O-N 3.38Å; R131-E134 PolarHBondContact O-N 3.31Å; E134-R136 VanDerWaalsContact C-N 3.34Å; E134-R136 PolarHBondContact O-N 2.83Å; E134-L137 WeakPolarHBondContact O-CB 3.5Å; E134-L137 PolarHBondContact O-N 3.36Å; E134-L137 VanDerWaalsContact O-N 3.12Å; E134-E138 WeakPolarHBondContact O-CG 3.48Å; E134-E138 PolarHBondContact O-N 2.8Å |
| 135 | R | 98.4 | Very high | 97.9 | Very high | 113 Ų | 113 | 111.5 Ų | 111.5 | 43% | 0.426 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -55.1 | -46.5 | 174.7 | -171.6 | -177.1 | 75.8 | 81.4 | 10.2 | 112.4 | R131 E132 L137 E138 E139 | R131-R135 PolarHBondContact O-N 3.19Å; E132-R135 IonicContact OE1-CZ 3.64Å; E132-R135 IonicContact OE1-NE 2.61Å; E132-R135 IonicContact OE1-NH2 3.1Å; E132-R135 PolarHBondContact OE1-NH2 3.47Å; E132-R135 IonicContact OE2-CZ 2.76Å; E132-R135 IonicContact OE2-NE 3.35Å; E132-R135 PolarHBondContact OE2-NE 3.36Å; E132-R135 IonicContact OE2-NH2 3.6Å; E132-R135 PolarHBondContact OE2-NH2 3.03Å; R135-L137 VanDerWaalsContact C-N 3.34Å; R135-L137 PolarHBondContact O-N 3.01Å; R135-E138 PolarHBondContact O-N 3.27Å; R135-E139 IonicContact CZ-OE1 2.85Å; R135-E139 IonicContact NH1-OE1 3.9Å; R135-E139 PolarHBondContact NH1-OE1 3.38Å; R135-E139 IonicContact NH2-OE1 3.59Å; R135-E139 WeakPolarHBondContact O-CG 3.39Å; R135-E139 PolarHBondContact O-N 3.49Å |
| 136 | R | 98.3 | Very high | 98 | Very high | 131 Ų | 131 | 112.7 Ų | 112.7 | 49% | 0.494 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -68.6 | -32.7 | 178.7 | -68.7 | 179.2 | -165 | -169.5 | -0.4 | 112.9 | E132 M133 E134 E138 L140 | E132-R136 WeakPolarHBondContact O-CG 3.41Å; E132-R136 PolarHBondContact O-N 3.26Å; E132-R136 VanDerWaalsContact O-N 3.15Å; E132-R136 IonicContact OE1-CZ 2.97Å; E132-R136 IonicContact OE1-NE 2.82Å; E132-R136 PolarHBondContact OE1-NE 2.91Å; E132-R136 IonicContact OE1-NH2 2.84Å; E132-R136 PolarHBondContact OE1-NH2 2.95Å; M133-R136 PolarHBondContact O-N 3.2Å; E134-R136 VanDerWaalsContact C-N 3.34Å; E134-R136 PolarHBondContact O-N 2.83Å; R136-E138 VanDerWaalsContact C-N 3.35Å; R136-L140 WeakPolarHBondContact O-CB 3.22Å; R136-L140 PolarHBondContact O-N 2.93Å |
| 137 | L | 98.3 | Very high | 98.1 | Very high | 113 Ų | 113 | 108.6 Ų | 108.6 | 59% | 0.592 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -68.7 | -36.4 | 174.7 | -76.1 | 169.7 | 0 | 0 | 0 | 111.5 | M133 E134 R135 L140 R141 | M133-L137 WeakPolarHBondContact O-CG 3.49Å; M133-L137 PolarHBondContact O-N 3.5Å; E134-L137 WeakPolarHBondContact O-CB 3.5Å; E134-L137 PolarHBondContact O-N 3.36Å; E134-L137 VanDerWaalsContact O-N 3.12Å; R135-L137 VanDerWaalsContact C-N 3.34Å; R135-L137 PolarHBondContact O-N 3.01Å; L137-L140 PolarHBondContact O-N 3.48Å; L137-R141 WeakPolarHBondContact O-CB 3.41Å; L137-R141 PolarHBondContact O-N 3.35Å |
| 138 | E | 98.3 | Very high | 98 | Very high | 126 Ų | 126 | 110.5 Ų | 110.5 | 59% | 0.589 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -64.6 | -47 | 173 | -70.8 | 173.3 | 176 | 0 | 0 | 111.3 | E134 R135 R136 L140 R141 E142 | E134-E138 WeakPolarHBondContact O-CG 3.48Å; E134-E138 PolarHBondContact O-N 2.8Å; R135-E138 PolarHBondContact O-N 3.27Å; R136-E138 VanDerWaalsContact C-N 3.35Å; E138-L140 VanDerWaalsContact C-N 3.3Å; E138-L140 PolarHBondContact O-N 3.47Å; E138-R141 WeakPolarHBondContact O-CB 3.3Å; E138-R141 PolarHBondContact O-N 3.49Å; E138-R141 VanDerWaalsContact O-N 3.15Å; E138-E142 PolarHBondContact O-N 3.41Å |
| 139 | E | 98.2 | Very high | 98 | Very high | 88 Ų | 88 | 108.5 Ų | 108.5 | 41% | 0.411 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -56.1 | -45.4 | 173.5 | -70.9 | 171.3 | 179.4 | 0 | 0 | 111.6 | R135 R141 E142 M143 | R135-E139 IonicContact CZ-OE1 2.85Å; R135-E139 IonicContact NH1-OE1 3.9Å; R135-E139 PolarHBondContact NH1-OE1 3.38Å; R135-E139 IonicContact NH2-OE1 3.59Å; R135-E139 WeakPolarHBondContact O-CG 3.39Å; R135-E139 PolarHBondContact O-N 3.49Å; E139-R141 PolarHBondContact O-N 3.12Å; E139-E142 PolarHBondContact O-N 3.36Å; E139-M143 WeakPolarHBondContact O-CG 3.42Å; E139-M143 PolarHBondContact O-N 3.16Å |
| 140 | L | 98.4 | Very high | 98 | Very high | 74 Ų | 74 | 109.8 Ų | 109.8 | 39% | 0.387 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.8 | -41.9 | 178 | -174.7 | 60.9 | 0 | 0 | 0 | 111.6 | R136 L137 E138 E142 M143 F144 | R136-L140 WeakPolarHBondContact O-CB 3.22Å; R136-L140 PolarHBondContact O-N 2.93Å; L137-L140 PolarHBondContact O-N 3.48Å; E138-L140 VanDerWaalsContact C-N 3.3Å; E138-L140 PolarHBondContact O-N 3.47Å; L140-E142 VanDerWaalsContact C-N 3.33Å; L140-E142 PolarHBondContact O-N 3.44Å; L140-M143 HydrophobicContact CD1-CE 3.7Å; L140-M143 PolarHBondContact O-N 2.98Å; L140-F144 HydrophobicContact CD1-CD2 4.05Å; L140-F144 HydrophobicContact CD1-CE2 3.68Å; L140-F144 HydrophobicContact CD2-CE2 4.16Å; L140-F144 HydrophobicContact CG-CD2 3.89Å; L140-F144 HydrophobicContact CG-CE2 3.68Å; L140-F144 VanDerWaalsContact O-CD2 3.25Å; L140-F144 WeakPolarHBondContact O-CD2 3.5Å; L140-F144 PolarHBondContact O-N 3.3Å |
| 141 | R | 98.3 | Very high | 98 | Very high | 190 Ų | 190 | 110.2 Ų | 110.2 | 72% | 0.717 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -58.6 | -45.4 | 175.4 | 178 | -174.9 | 175.8 | -171.7 | -1.4 | 111 | L137 E138 E139 M143 F144 V145 | L137-R141 WeakPolarHBondContact O-CB 3.41Å; L137-R141 PolarHBondContact O-N 3.35Å; E138-R141 WeakPolarHBondContact O-CB 3.3Å; E138-R141 PolarHBondContact O-N 3.49Å; E138-R141 VanDerWaalsContact O-N 3.15Å; E139-R141 PolarHBondContact O-N 3.12Å; R141-M143 VanDerWaalsContact C-N 3.32Å; R141-M143 PolarHBondContact O-N 3.47Å; R141-F144 PolarHBondContact O-N 3.05Å; R141-V145 WeakPolarHBondContact O-CG2 3.43Å; R141-V145 PolarHBondContact O-N 3.28Å |
| 142 | E | 98.1 | Very high | 97.9 | Very high | 101 Ų | 101 | 108.7 Ų | 108.7 | 47% | 0.472 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.3 | -41.5 | 176.8 | -71.1 | -173.1 | -171.5 | 0 | 0 | 112.1 | E138 E139 L140 F144 V145 R146 | E138-E142 PolarHBondContact O-N 3.41Å; E139-E142 PolarHBondContact O-N 3.36Å; L140-E142 VanDerWaalsContact C-N 3.33Å; L140-E142 PolarHBondContact O-N 3.44Å; E142-F144 VanDerWaalsContact C-N 3.32Å; E142-F144 PolarHBondContact O-N 3.13Å; E142-V145 PolarHBondContact O-N 3.34Å; E142-R146 WeakPolarHBondContact O-CG 3.49Å; E142-R146 PolarHBondContact O-N 2.9Å; E142-R146 IonicContact OE2-CZ 2.65Å; E142-R146 IonicContact OE2-NH1 3.47Å; E142-R146 IonicContact OE2-NH2 3.57Å; E142-R146 PolarHBondContact OE2-NH2 2.9Å |
| 143 | M | 98.4 | Very high | 97.8 | Very high | 111 Ų | 111 | 110.2 Ų | 110.2 | 55% | 0.547 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.1 | -39.3 | 175.9 | -68.7 | -161.8 | -61.2 | 0 | 0 | 112.3 | E139 L140 R141 S147 | E139-M143 WeakPolarHBondContact O-CG 3.42Å; E139-M143 PolarHBondContact O-N 3.16Å; L140-M143 HydrophobicContact CD1-CE 3.7Å; L140-M143 PolarHBondContact O-N 2.98Å; R141-M143 VanDerWaalsContact C-N 3.32Å; R141-M143 PolarHBondContact O-N 3.47Å; M143-S147 WeakPolarHBondContact O-CB 3.43Å; M143-S147 PolarHBondContact O-N 3.33Å; M143-S147 PolarHBondContact O-OG 2.97Å |
| 144 | F | 98.4 | Very high | 97.8 | Very high | 135 Ų | 135 | 110.8 Ų | 110.8 | 59% | 0.592 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -65.5 | -42 | 175.3 | -85.9 | -71.7 | 0 | 0 | 0 | 112.8 | L140 R141 E142 S147 E148 | L140-F144 HydrophobicContact CD1-CD2 4.05Å; L140-F144 HydrophobicContact CD1-CE2 3.68Å; L140-F144 HydrophobicContact CD2-CE2 4.16Å; L140-F144 HydrophobicContact CG-CD2 3.89Å; L140-F144 HydrophobicContact CG-CE2 3.68Å; L140-F144 VanDerWaalsContact O-CD2 3.25Å; L140-F144 WeakPolarHBondContact O-CD2 3.5Å; L140-F144 PolarHBondContact O-N 3.3Å; R141-F144 PolarHBondContact O-N 3.05Å; E142-F144 VanDerWaalsContact C-N 3.32Å; E142-F144 PolarHBondContact O-N 3.13Å; F144-S147 WeakPolarHBondContact CA-OG 3.21Å; F144-S147 PolarHBondContact O-N 3.45Å; F144-S147 PolarHBondContact O-OG 3.01Å; F144-E148 WeakPolarHBondContact O-CB 3.49Å; F144-E148 PolarHBondContact O-N 3.23Å |
| 145 | V | 98.2 | Very high | 97.8 | Very high | 80 Ų | 80 | 107.8 Ų | 107.8 | 49% | 0.485 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64.9 | -42.8 | 177.4 | 173.3 | 0 | 0 | 0 | 0 | 110.8 | R141 E142 S147 E148 Q149 | R141-V145 WeakPolarHBondContact O-CG2 3.43Å; R141-V145 PolarHBondContact O-N 3.28Å; E142-V145 PolarHBondContact O-N 3.34Å; V145-S147 VanDerWaalsContact C-N 3.34Å; V145-S147 PolarHBondContact O-N 2.97Å; V145-E148 PolarHBondContact O-N 3.25Å; V145-Q149 PolarHBondContact O-N 3.39Å; V145-Q149 VanDerWaalsContact O-N 3.12Å |
| 146 | R | 97.9 | Very high | 97.7 | Very high | 153 Ų | 153 | 107.9 Ų | 107.9 | 58% | 0.577 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -62.7 | -41.6 | 175.4 | -70.9 | -179.5 | -170.2 | 121.2 | 11 | 111.7 | E142 Q149 Q150 | E142-R146 WeakPolarHBondContact O-CG 3.49Å; E142-R146 PolarHBondContact O-N 2.9Å; E142-R146 IonicContact OE2-CZ 2.65Å; E142-R146 IonicContact OE2-NH1 3.47Å; E142-R146 IonicContact OE2-NH2 3.57Å; E142-R146 PolarHBondContact OE2-NH2 2.9Å; R146-Q149 PolarHBondContact O-N 2.93Å; R146-Q150 WeakPolarHBondContact O-CB 3.46Å; R146-Q150 PolarHBondContact O-N 3.32Å |
| 147 | S | 97.8 | Very high | 97.7 | Very high | 52 Ų | 52 | 106.1 Ų | 106.1 | 36% | 0.364 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -69.7 | -38 | -179.6 | 70.5 | 0 | 0 | 0 | 0 | 112.3 | M143 F144 V145 Q150 V151 | M143-S147 WeakPolarHBondContact O-CB 3.43Å; M143-S147 PolarHBondContact O-N 3.33Å; M143-S147 PolarHBondContact O-OG 2.97Å; F144-S147 WeakPolarHBondContact CA-OG 3.21Å; F144-S147 PolarHBondContact O-N 3.45Å; F144-S147 PolarHBondContact O-OG 3.01Å; V145-S147 VanDerWaalsContact C-N 3.34Å; V145-S147 PolarHBondContact O-N 2.97Å; S147-Q150 PolarHBondContact O-N 2.92Å; S147-V151 VanDerWaalsContact O-CG2 3.28Å; S147-V151 WeakPolarHBondContact O-CG2 3.45Å; S147-V151 PolarHBondContact O-N 3.28Å |
| 148 | E | 96.9 | Very high | 97.7 | Very high | 130 Ų | 130 | 104.8 Ų | 104.8 | 61% | 0.607 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -57.8 | -50.2 | 172.4 | -179.6 | 178.8 | -169.5 | 0 | 0 | 111 | F144 V145 Q150 V151 V152 | F144-E148 WeakPolarHBondContact O-CB 3.49Å; F144-E148 PolarHBondContact O-N 3.23Å; V145-E148 PolarHBondContact O-N 3.25Å; E148-Q150 VanDerWaalsContact C-N 3.29Å; E148-Q150 PolarHBondContact O-N 2.99Å; E148-V151 PolarHBondContact O-N 3.45Å; E148-V151 VanDerWaalsContact O-N 3.13Å; E148-V152 WeakPolarHBondContact O-CG2 3.27Å; E148-V152 PolarHBondContact O-N 3.44Å |
| 149 | Q | 96.9 | Very high | 97.6 | Very high | 136 Ų | 136 | 102.6 Ų | 102.6 | 64% | 0.636 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -59.6 | -42 | 178.8 | -172 | 171.2 | 17 | 0 | 0 | 111.8 | V145 R146 V152 V153 | V145-Q149 PolarHBondContact O-N 3.39Å; V145-Q149 VanDerWaalsContact O-N 3.12Å; R146-Q149 PolarHBondContact O-N 2.93Å; Q149-V152 PolarHBondContact O-N 3.28Å; Q149-V153 WeakPolarHBondContact O-CG2 3.31Å; Q149-V153 PolarHBondContact O-N 3.05Å |
| 150 | Q | 96.9 | Very high | 97.6 | Very high | 118 Ų | 118 | 107 Ų | 107 | 55% | 0.551 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -64 | -40.4 | 176.7 | 178.3 | 168.5 | 12.5 | 0 | 0 | 112.2 | R146 S147 E148 V152 V153 H154 | R146-Q150 WeakPolarHBondContact O-CB 3.46Å; R146-Q150 PolarHBondContact O-N 3.32Å; S147-Q150 PolarHBondContact O-N 2.92Å; E148-Q150 VanDerWaalsContact C-N 3.29Å; E148-Q150 PolarHBondContact O-N 2.99Å; Q150-V152 VanDerWaalsContact C-N 3.34Å; Q150-V152 PolarHBondContact O-N 3.02Å; Q150-V153 PolarHBondContact O-N 3.42Å; Q150-H154 WeakPolarHBondContact CG-CD2 3.33Å; Q150-H154 PolarHBondContact NE2-NE2 3.34Å; Q150-H154 PolarHBondContact O-CD2 3.43Å; Q150-H154 PolarHBondContact O-N 3.2Å |
| 151 | V | 97.9 | Very high | 97.6 | Very high | 104 Ų | 104 | 108.1 Ų | 108.1 | 63% | 0.63 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -63.9 | -39.5 | 177 | 169 | 0 | 0 | 0 | 0 | 111.4 | S147 E148 H154 G155 | S147-V151 VanDerWaalsContact O-CG2 3.28Å; S147-V151 WeakPolarHBondContact O-CG2 3.45Å; S147-V151 PolarHBondContact O-N 3.28Å; E148-V151 PolarHBondContact O-N 3.45Å; E148-V151 VanDerWaalsContact O-N 3.13Å; V151-H154 PolarHBondContact O-N 3.33Å; V151-G155 PolarHBondContact O-N 3.05Å |
| 152 | V | 97.1 | Very high | 97.6 | Very high | 87 Ų | 87 | 102.1 Ų | 102.1 | 53% | 0.527 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -60.7 | -49.1 | 176.1 | 173.5 | 0 | 0 | 0 | 0 | 110.8 | E148 Q149 Q150 H154 G155 E156 | E148-V152 WeakPolarHBondContact O-CG2 3.27Å; E148-V152 PolarHBondContact O-N 3.44Å; Q149-V152 PolarHBondContact O-N 3.28Å; Q150-V152 VanDerWaalsContact C-N 3.34Å; Q150-V152 PolarHBondContact O-N 3.02Å; V152-H154 PolarHBondContact O-N 3.48Å; V152-G155 PolarHBondContact O-N 3.35Å; V152-E156 PolarHBondContact O-N 3.03Å |
| 153 | V | 95.9 | Very high | 97.6 | Very high | 91 Ų | 91 | 99 Ų | 99 | 55% | 0.552 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -61.9 | -45.5 | 179.6 | 174.5 | 0 | 0 | 0 | 0 | 111.7 | Q149 Q150 G155 | Q149-V153 WeakPolarHBondContact O-CG2 3.31Å; Q149-V153 PolarHBondContact O-N 3.05Å; Q150-V153 PolarHBondContact O-N 3.42Å; V153-G155 VanDerWaalsContact C-N 3.32Å; V153-G155 PolarHBondContact O-N 3.25Å |
| 154 | H | 98.1 | Very high | 97.6 | Very high | 93 Ų | 93 | 96.6 Ų | 96.6 | 43% | 0.431 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -70.5 | -29.4 | 177.6 | -73.3 | -63.6 | 0 | 0 | 0 | 112.8 | Q150 V151 V152 E156 L157 V158 | Q150-H154 WeakPolarHBondContact CG-CD2 3.33Å; Q150-H154 PolarHBondContact NE2-NE2 3.34Å; Q150-H154 PolarHBondContact O-CD2 3.43Å; Q150-H154 PolarHBondContact O-N 3.2Å; V151-H154 PolarHBondContact O-N 3.33Å; V152-H154 PolarHBondContact O-N 3.48Å; H154-E156 VanDerWaalsContact C-N 3.34Å; H154-E156 PolarHBondContact O-N 2.87Å; H154-L157 PolarHBondContact O-N 3.01Å; H154-V158 WeakPolarHBondContact O-CG2 3.45Å; H154-V158 PolarHBondContact O-N 3.3Å |
| 155 | G | 97.6 | Very high | 97.6 | Very high | 38 Ų | 38 | 93.1 Ų | 93.1 | 39% | 0.392 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -60.5 | -42.2 | 176 | 0 | 0 | 0 | 0 | 0 | 112.4 | V151 V152 V153 V158 S159 | V151-G155 PolarHBondContact O-N 3.05Å; V152-G155 PolarHBondContact O-N 3.35Å; V153-G155 VanDerWaalsContact C-N 3.32Å; V153-G155 PolarHBondContact O-N 3.25Å; G155-V158 PolarHBondContact O-N 3.3Å; G155-S159 WeakPolarHBondContact O-CB 3.46Å; G155-S159 PolarHBondContact O-N 3.35Å |
| 156 | E | 96.1 | Very high | 97.6 | Very high | 115 Ų | 115 | 94.8 Ų | 94.8 | 54% | 0.537 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.6 | -44.2 | 174.8 | -67 | -173.7 | -175.7 | 0 | 0 | 112.2 | V152 H154 S159 R160 | V152-E156 PolarHBondContact O-N 3.03Å; H154-E156 VanDerWaalsContact C-N 3.34Å; H154-E156 PolarHBondContact O-N 2.87Å; E156-S159 WeakPolarHBondContact O-CB 3.41Å; E156-S159 PolarHBondContact O-N 3.42Å; E156-R160 WeakPolarHBondContact O-CG 3.28Å; E156-R160 PolarHBondContact O-N 2.87Å |
| 157 | L | 96.9 | Very high | 97.6 | Very high | 93 Ų | 93 | 94.3 Ų | 94.3 | 49% | 0.487 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.1 | -46.4 | 177.4 | 176.9 | 61.5 | 0 | 0 | 0 | 111.2 | H154 S159 R160 I161 | H154-L157 PolarHBondContact O-N 3.01Å; L157-S159 VanDerWaalsContact C-N 3.31Å; L157-S159 PolarHBondContact O-N 2.97Å; L157-R160 PolarHBondContact O-N 3.5Å; L157-I161 HydrophobicContact CD1-CD1 4.15Å; L157-I161 HydrophobicContact CD1-CG1 4.43Å; L157-I161 HydrophobicContact CG-CD1 3.96Å; L157-I161 WeakPolarHBondContact O-CG1 3.34Å; L157-I161 PolarHBondContact O-N 3.32Å |
| 158 | V | 98.4 | Very high | 97.6 | Very high | 85 Ų | 85 | 93.4 Ų | 93.4 | 52% | 0.515 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.1 | -42.5 | 177 | 172.1 | 0 | 0 | 0 | 0 | 110.5 | H154 G155 R160 I161 T162 | H154-V158 WeakPolarHBondContact O-CG2 3.45Å; H154-V158 PolarHBondContact O-N 3.3Å; G155-V158 PolarHBondContact O-N 3.3Å; V158-R160 VanDerWaalsContact C-N 3.33Å; V158-R160 PolarHBondContact O-N 3.05Å; V158-I161 PolarHBondContact O-N 2.95Å; V158-T162 WeakPolarHBondContact O-CB 3.4Å; V158-T162 PolarHBondContact O-N 3.42Å; V158-T162 PolarHBondContact O-OG1 3.2Å |
| 159 | S | 97.9 | Very high | 97.6 | Very high | 81 Ų | 81 | 94 Ų | 94 | 57% | 0.566 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -58 | -43.7 | 176.4 | -174.1 | 0 | 0 | 0 | 0 | 112.3 | G155 E156 L157 T162 G163 | G155-S159 WeakPolarHBondContact O-CB 3.46Å; G155-S159 PolarHBondContact O-N 3.35Å; E156-S159 WeakPolarHBondContact O-CB 3.41Å; E156-S159 PolarHBondContact O-N 3.42Å; L157-S159 VanDerWaalsContact C-N 3.31Å; L157-S159 PolarHBondContact O-N 2.97Å; S159-T162 PolarHBondContact O-N 2.82Å; S159-G163 PolarHBondContact O-N 3.15Å |
| 160 | R | 97.8 | Very high | 97.6 | Very high | 179 Ų | 179 | 93.6 Ų | 93.6 | 68% | 0.675 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -63.9 | -43.7 | 175.5 | -66.6 | 177.6 | -167 | -162.3 | 5.7 | 112.2 | E156 L157 V158 T162 G163 A164 | E156-R160 WeakPolarHBondContact O-CG 3.28Å; E156-R160 PolarHBondContact O-N 2.87Å; L157-R160 PolarHBondContact O-N 3.5Å; V158-R160 VanDerWaalsContact C-N 3.33Å; V158-R160 PolarHBondContact O-N 3.05Å; R160-T162 VanDerWaalsContact C-N 3.34Å; R160-G163 PolarHBondContact O-N 2.96Å; R160-A164 WeakPolarHBondContact O-CB 3.41Å; R160-A164 PolarHBondContact O-N 3.36Å |
| 161 | I | 98.3 | Very high | 97.6 | Very high | 99 Ų | 99 | 94.9 Ų | 94.9 | 51% | 0.508 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -61.5 | -44.9 | 176.9 | -67.9 | 166.8 | 0 | 0 | 0 | 110.2 | L157 V158 A164 A165 | L157-I161 HydrophobicContact CD1-CD1 4.15Å; L157-I161 HydrophobicContact CD1-CG1 4.43Å; L157-I161 HydrophobicContact CG-CD1 3.96Å; L157-I161 WeakPolarHBondContact O-CG1 3.34Å; L157-I161 PolarHBondContact O-N 3.32Å; V158-I161 PolarHBondContact O-N 2.95Å; I161-A164 PolarHBondContact O-N 3.46Å; I161-A165 VanDerWaalsContact O-CB 3.27Å; I161-A165 WeakPolarHBondContact O-CB 3.38Å; I161-A165 PolarHBondContact O-N 3.31Å |
| 162 | T | 98.4 | Very high | 97.6 | Very high | 64 Ų | 64 | 94.1 Ų | 94.1 | 39% | 0.393 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.1 | -44.7 | 177.6 | -59.5 | 0 | 0 | 0 | 0 | 111.5 | V158 S159 R160 A165 Q166 | V158-T162 WeakPolarHBondContact O-CB 3.4Å; V158-T162 PolarHBondContact O-N 3.42Å; V158-T162 PolarHBondContact O-OG1 3.2Å; S159-T162 PolarHBondContact O-N 2.82Å; R160-T162 VanDerWaalsContact C-N 3.34Å; T162-A165 PolarHBondContact O-N 2.96Å; T162-Q166 HydrophobicContact CG2-CG 4.49Å; T162-Q166 WeakPolarHBondContact O-CB 3.45Å; T162-Q166 VanDerWaalsContact O-CG 3.31Å; T162-Q166 WeakPolarHBondContact O-CG 3.43Å; T162-Q166 PolarHBondContact O-N 3.15Å |
| 163 | G | 98.2 | Very high | 97.6 | Very high | 34 Ų | 34 | 92.9 Ų | 92.9 | 35% | 0.351 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.2 | -46.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | S159 R160 A165 Q166 Q167 | S159-G163 PolarHBondContact O-N 3.15Å; R160-G163 PolarHBondContact O-N 2.96Å; G163-A165 PolarHBondContact O-N 3.06Å; G163-Q166 PolarHBondContact O-N 3.12Å; G163-Q167 WeakPolarHBondContact O-CB 3.36Å; G163-Q167 PolarHBondContact O-N 3.33Å |
| 164 | A | 98.1 | Very high | 97.6 | Very high | 62 Ų | 62 | 92.8 Ų | 92.8 | 51% | 0.512 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.1 | -39.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | R160 I161 Q167 G168 | R160-A164 WeakPolarHBondContact O-CB 3.41Å; R160-A164 PolarHBondContact O-N 3.36Å; I161-A164 PolarHBondContact O-N 3.46Å; A164-Q167 PolarHBondContact O-N 3.05Å; A164-G168 PolarHBondContact O-N 3.02Å |
| 165 | A | 98.3 | Very high | 97.4 | Very high | 62 Ų | 62 | 90.3 Ų | 90.3 | 51% | 0.512 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.8 | -44.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | I161 T162 G163 G168 E169 | I161-A165 VanDerWaalsContact O-CB 3.27Å; I161-A165 WeakPolarHBondContact O-CB 3.38Å; I161-A165 PolarHBondContact O-N 3.31Å; T162-A165 PolarHBondContact O-N 2.96Å; G163-A165 PolarHBondContact O-N 3.06Å; A165-G168 PolarHBondContact O-N 3.12Å; A165-E169 PolarHBondContact O-N 3.33Å |
| 166 | Q | 98.2 | Very high | 97.3 | Very high | 114 Ų | 114 | 92.5 Ų | 92.5 | 53% | 0.533 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.6 | -43.4 | 176 | -73.6 | 175.1 | -0.8 | 0 | 0 | 111.8 | T162 G163 G168 E169 L170 | T162-Q166 HydrophobicContact CG2-CG 4.49Å; T162-Q166 WeakPolarHBondContact O-CB 3.45Å; T162-Q166 VanDerWaalsContact O-CG 3.31Å; T162-Q166 WeakPolarHBondContact O-CG 3.43Å; T162-Q166 PolarHBondContact O-N 3.15Å; G163-Q166 PolarHBondContact O-N 3.12Å; Q166-G168 VanDerWaalsContact C-N 3.3Å; Q166-G168 PolarHBondContact O-N 3.35Å; Q166-E169 WeakPolarHBondContact O-CB 3.36Å; Q166-E169 PolarHBondContact O-N 3.24Å; Q166-L170 WeakPolarHBondContact O-CG 3.49Å; Q166-L170 PolarHBondContact O-N 3.13Å |
| 167 | Q | 98 | Very high | 97.2 | Very high | 144 Ų | 144 | 92.2 Ų | 92.2 | 67% | 0.673 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61.8 | -41.2 | 174.5 | -176.2 | 178.9 | -10.8 | 0 | 0 | 111.5 | G163 A164 L170 Y171 | G163-Q167 WeakPolarHBondContact O-CB 3.36Å; G163-Q167 PolarHBondContact O-N 3.33Å; A164-Q167 PolarHBondContact O-N 3.05Å; Q167-L170 PolarHBondContact O-N 2.89Å; Q167-Y171 WeakPolarHBondContact O-CB 3.48Å; Q167-Y171 PolarHBondContact O-N 2.93Å |
| 168 | G | 98.1 | Very high | 96.9 | Very high | 32 Ų | 32 | 94.5 Ų | 94.5 | 33% | 0.33 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.8 | -42.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | A164 A165 Q166 Y171 V172 | A164-G168 PolarHBondContact O-N 3.02Å; A165-G168 PolarHBondContact O-N 3.12Å; Q166-G168 VanDerWaalsContact C-N 3.3Å; Q166-G168 PolarHBondContact O-N 3.35Å; G168-Y171 PolarHBondContact O-N 3.15Å; G168-V172 WeakPolarHBondContact O-CB 3.46Å; G168-V172 VanDerWaalsContact O-CG2 3.3Å; G168-V172 WeakPolarHBondContact O-CG2 3.44Å; G168-V172 PolarHBondContact O-N 3.38Å |
| 169 | E | 96.6 | Very high | 96.6 | Very high | 143 Ų | 143 | 95.3 Ų | 95.3 | 67% | 0.668 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -61 | -47.6 | 176.6 | -172.5 | 179.7 | 174.8 | 0 | 0 | 111.6 | A165 Q166 Y171 V172 A173 | A165-E169 PolarHBondContact O-N 3.33Å; Q166-E169 WeakPolarHBondContact O-CB 3.36Å; Q166-E169 PolarHBondContact O-N 3.24Å; E169-Y171 VanDerWaalsContact C-N 3.34Å; E169-Y171 PolarHBondContact O-N 3.28Å; E169-V172 PolarHBondContact O-N 3.49Å; E169-A173 WeakPolarHBondContact O-CB 3.47Å; E169-A173 PolarHBondContact O-N 2.79Å |
| 170 | L | 97.3 | Very high | 96.2 | Very high | 127 Ų | 127 | 98 Ų | 98 | 67% | 0.665 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -60.2 | -44.1 | 176.1 | -67.8 | 175 | 0 | 0 | 0 | 111.7 | Q166 Q167 A173 E174 | Q166-L170 WeakPolarHBondContact O-CG 3.49Å; Q166-L170 PolarHBondContact O-N 3.13Å; Q167-L170 PolarHBondContact O-N 2.89Å; L170-A173 PolarHBondContact O-N 2.65Å; L170-E174 PolarHBondContact O-N 3.49Å |
| 171 | Y | 97.4 | Very high | 95.9 | Very high | 146 Ų | 146 | 95.5 Ų | 95.5 | 57% | 0.573 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62.5 | -44.9 | 178 | -177.4 | -100.8 | 0 | 0 | 0 | 111.7 | Q167 G168 E169 E174 N175 | Q167-Y171 WeakPolarHBondContact O-CB 3.48Å; Q167-Y171 PolarHBondContact O-N 2.93Å; G168-Y171 PolarHBondContact O-N 3.15Å; E169-Y171 VanDerWaalsContact C-N 3.34Å; E169-Y171 PolarHBondContact O-N 3.28Å; Y171-E174 PolarHBondContact O-N 3.16Å; Y171-N175 WeakPolarHBondContact CD2-ND2 3.25Å; Y171-N175 VanDerWaalsContact CE1-ND2 3.32Å; Y171-N175 WeakPolarHBondContact CE1-ND2 3.38Å; Y171-N175 WeakPolarHBondContact CE2-ND2 3.44Å; Y171-N175 WeakPolarHBondContact O-CB 3.48Å; Y171-N175 PolarHBondContact O-N 3.13Å; Y171-N175 PolarHBondContact O-ND2 3.25Å |
| 172 | V | 97.7 | Very high | 95.3 | Very high | 87 Ų | 87 | 92.7 Ų | 92.7 | 53% | 0.527 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65.2 | -41.8 | 177.7 | 171.2 | 0 | 0 | 0 | 0 | 111 | G168 E169 E174 N175 T176 | G168-V172 WeakPolarHBondContact O-CB 3.46Å; G168-V172 VanDerWaalsContact O-CG2 3.3Å; G168-V172 WeakPolarHBondContact O-CG2 3.44Å; G168-V172 PolarHBondContact O-N 3.38Å; E169-V172 PolarHBondContact O-N 3.49Å; V172-E174 PolarHBondContact O-N 3.2Å; V172-N175 PolarHBondContact O-N 3.49Å; V172-T176 WeakPolarHBondContact O-CB 3.35Å; V172-T176 PolarHBondContact O-N 2.76Å; V172-T176 PolarHBondContact O-OG1 3.19Å |
| 173 | A | 96.2 | Very high | 94.5 | Very high | 61 Ų | 61 | 94.4 Ų | 94.4 | 50% | 0.504 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60.5 | -46.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | E169 L170 T176 Q177 | E169-A173 WeakPolarHBondContact O-CB 3.47Å; E169-A173 PolarHBondContact O-N 2.79Å; L170-A173 PolarHBondContact O-N 2.65Å; A173-T176 PolarHBondContact O-N 3.48Å; A173-Q177 PolarHBondContact O-N 3.03Å; A173-Q177 VanDerWaalsContact O-N 3.11Å |
| 174 | E | 95.3 | Very high | 93.4 | Very high | 90 Ų | 90 | 99.3 Ų | 99.3 | 42% | 0.421 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64 | -49 | 177.6 | -173.5 | -177.4 | -166.4 | 0 | 0 | 111.7 | L170 Y171 V172 T176 Q177 R178 | L170-E174 PolarHBondContact O-N 3.49Å; Y171-E174 PolarHBondContact O-N 3.16Å; V172-E174 PolarHBondContact O-N 3.2Å; E174-T176 VanDerWaalsContact C-N 3.3Å; E174-T176 PolarHBondContact O-N 2.97Å; E174-Q177 WeakPolarHBondContact O-CB 3.43Å; E174-Q177 PolarHBondContact O-N 3.43Å; E174-Q177 VanDerWaalsContact O-N 3.1Å; E174-R178 VanDerWaalsContact CD-NH2 3.33Å; E174-R178 WeakPolarHBondContact O-CG 3.38Å; E174-R178 PolarHBondContact O-N 3.32Å; E174-R178 IonicContact OE1-CZ 2.82Å; E174-R178 IonicContact OE1-NE 3.47Å; E174-R178 PolarHBondContact OE1-NE 3.03Å; E174-R178 VanDerWaalsContact OE1-NE 3.17Å; E174-R178 IonicContact OE1-NH2 3.54Å; E174-R178 PolarHBondContact OE1-NH2 3.32Å; E174-R178 IonicContact OE2-CZ 3.93Å; E174-R178 IonicContact OE2-NH2 3.56Å |
| 175 | N | 95.5 | Very high | 92.2 | Very high | 41 Ų | 41 | 101.7 Ų | 101.7 | 22% | 0.219 | 52% | 0.522 | C | S | . | . | H | α-helix | trans | -64.3 | -37.3 | -179.3 | -80 | -78.1 | 0 | 0 | 0 | 111.7 | Y171 V172 Q177 R178 V179 | Y171-N175 WeakPolarHBondContact CD2-ND2 3.25Å; Y171-N175 VanDerWaalsContact CE1-ND2 3.32Å; Y171-N175 WeakPolarHBondContact CE1-ND2 3.38Å; Y171-N175 WeakPolarHBondContact CE2-ND2 3.44Å; Y171-N175 WeakPolarHBondContact O-CB 3.48Å; Y171-N175 PolarHBondContact O-N 3.13Å; Y171-N175 PolarHBondContact O-ND2 3.25Å; V172-N175 PolarHBondContact O-N 3.49Å; N175-Q177 VanDerWaalsContact C-N 3.29Å; N175-Q177 PolarHBondContact O-N 3.47Å; N175-R178 PolarHBondContact O-N 3Å; N175-V179 WeakPolarHBondContact O-CB 3.41Å; N175-V179 VanDerWaalsContact O-CG2 3.28Å; N175-V179 WeakPolarHBondContact O-CG2 3.49Å; N175-V179 PolarHBondContact O-N 2.85Å |
| 176 | T | 94.9 | Very high | 90.8 | Very high | 83 Ų | 83 | 106.3 Ų | 106.3 | 51% | 0.509 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -59.1 | -42.5 | 173.2 | -62.1 | 0 | 0 | 0 | 0 | 110.9 | V172 A173 E174 K180 | V172-T176 WeakPolarHBondContact O-CB 3.35Å; V172-T176 PolarHBondContact O-N 2.76Å; V172-T176 PolarHBondContact O-OG1 3.19Å; A173-T176 PolarHBondContact O-N 3.48Å; E174-T176 VanDerWaalsContact C-N 3.3Å; E174-T176 PolarHBondContact O-N 2.97Å; T176-K180 WeakPolarHBondContact O-CB 3.35Å; T176-K180 PolarHBondContact O-N 2.84Å |
| 177 | Q | 92.8 | Very high | 89.5 | Confident | 109 Ų | 109 | 108 Ų | 108 | 51% | 0.509 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -63.8 | -46.6 | 174.7 | -173.2 | -174.4 | -95.1 | 0 | 0 | 111.9 | A173 E174 N175 K180 K181 | A173-Q177 PolarHBondContact O-N 3.03Å; A173-Q177 VanDerWaalsContact O-N 3.11Å; E174-Q177 WeakPolarHBondContact O-CB 3.43Å; E174-Q177 PolarHBondContact O-N 3.43Å; E174-Q177 VanDerWaalsContact O-N 3.1Å; N175-Q177 VanDerWaalsContact C-N 3.29Å; N175-Q177 PolarHBondContact O-N 3.47Å; Q177-K180 PolarHBondContact O-N 2.89Å; Q177-K181 HydrophobicContact CG-CD 4.18Å; Q177-K181 WeakPolarHBondContact O-CB 3.44Å; Q177-K181 WeakPolarHBondContact O-CG 3.39Å; Q177-K181 PolarHBondContact O-N 3.39Å |
| 178 | R | 90.9 | Very high | 88 | Confident | 141 Ų | 141 | 106.2 Ų | 106.2 | 53% | 0.532 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -60.2 | -46.8 | 179 | -70.5 | 177 | 179.9 | -179.4 | -4 | 111.2 | E174 N175 K181 G182 | E174-R178 VanDerWaalsContact CD-NH2 3.33Å; E174-R178 WeakPolarHBondContact O-CG 3.38Å; E174-R178 PolarHBondContact O-N 3.32Å; E174-R178 IonicContact OE1-CZ 2.82Å; E174-R178 IonicContact OE1-NE 3.47Å; E174-R178 PolarHBondContact OE1-NE 3.03Å; E174-R178 VanDerWaalsContact OE1-NE 3.17Å; E174-R178 IonicContact OE1-NH2 3.54Å; E174-R178 PolarHBondContact OE1-NH2 3.32Å; E174-R178 IonicContact OE2-CZ 3.93Å; E174-R178 IonicContact OE2-NH2 3.56Å; N175-R178 PolarHBondContact O-N 3Å; R178-K181 PolarHBondContact O-N 3.18Å; R178-G182 PolarHBondContact O-N 3.29Å |
| 179 | V | 92 | Very high | 86.6 | Confident | 102 Ų | 102 | 110.9 Ų | 110.9 | 62% | 0.618 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -63.4 | -44.9 | 176.8 | 171.7 | 0 | 0 | 0 | 0 | 111.2 | N175 K181 G182 L183 | N175-V179 WeakPolarHBondContact O-CB 3.41Å; N175-V179 VanDerWaalsContact O-CG2 3.28Å; N175-V179 WeakPolarHBondContact O-CG2 3.49Å; N175-V179 PolarHBondContact O-N 2.85Å; V179-K181 VanDerWaalsContact C-N 3.32Å; V179-K181 PolarHBondContact O-N 2.69Å; V179-G182 PolarHBondContact O-N 3.29Å; V179-L183 WeakPolarHBondContact O-CB 3.46Å; V179-L183 PolarHBondContact O-N 2.96Å |
| 180 | K | 91.2 | Very high | 85.4 | Confident | 138 Ų | 138 | 107 Ų | 107 | 60% | 0.6 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -60.3 | -41.3 | 177.3 | -175.3 | 175.4 | 178.5 | 176 | 0 | 111.9 | T176 Q177 K184 | T176-K180 WeakPolarHBondContact O-CB 3.35Å; T176-K180 PolarHBondContact O-N 2.84Å; Q177-K180 PolarHBondContact O-N 2.89Å; K180-K184 WeakPolarHBondContact O-CG 3.46Å; K180-K184 PolarHBondContact O-N 3.34Å |
| 181 | K | 90.1 | Very high | 84.1 | Confident | 127 Ų | 127 | 104.6 Ų | 104.6 | 55% | 0.552 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -65.7 | -46.3 | 173.9 | -72.7 | 173.5 | 175.9 | 174.9 | 0 | 111.3 | Q177 R178 V179 L183 K184 F185 | Q177-K181 HydrophobicContact CG-CD 4.18Å; Q177-K181 WeakPolarHBondContact O-CB 3.44Å; Q177-K181 WeakPolarHBondContact O-CG 3.39Å; Q177-K181 PolarHBondContact O-N 3.39Å; R178-K181 PolarHBondContact O-N 3.18Å; V179-K181 VanDerWaalsContact C-N 3.32Å; V179-K181 PolarHBondContact O-N 2.69Å; K181-L183 VanDerWaalsContact C-N 3.32Å; K181-L183 PolarHBondContact O-N 2.89Å; K181-K184 PolarHBondContact O-N 3.22Å; K181-F185 PolarHBondContact O-N 2.95Å; K181-F185 VanDerWaalsContact O-N 3.13Å |
| 182 | G | 85.1 | Confident | 82.9 | Confident | 39 Ų | 39 | 101.4 Ų | 101.4 | 40% | 0.402 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -59.6 | -39.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | R178 V179 F185 K186 | R178-G182 PolarHBondContact O-N 3.29Å; V179-G182 PolarHBondContact O-N 3.29Å; G182-F185 PolarHBondContact O-N 3.33Å; G182-K186 PolarHBondContact O-N 3.14Å |
| 183 | L | 82.6 | Confident | 81.9 | Confident | 100 Ų | 100 | 100.8 Ų | 100.8 | 52% | 0.524 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65.3 | -43.1 | 176.5 | -176.6 | 63.8 | 0 | 0 | 0 | 112 | V179 K181 F185 K186 K187 | V179-L183 WeakPolarHBondContact O-CB 3.46Å; V179-L183 PolarHBondContact O-N 2.96Å; K181-L183 VanDerWaalsContact C-N 3.32Å; K181-L183 PolarHBondContact O-N 2.89Å; L183-F185 PolarHBondContact O-N 2.91Å; L183-K186 PolarHBondContact O-N 3.08Å; L183-K187 WeakPolarHBondContact O-CG 3.41Å; L183-K187 PolarHBondContact O-N 3.41Å |
| 184 | K | 75.4 | Confident | 80.9 | Confident | 137 Ų | 137 | 104.2 Ų | 104.2 | 60% | 0.596 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -59.1 | -37.8 | 175 | -73 | -178.3 | 178.2 | -172.1 | 0 | 111.7 | K180 K181 | K180-K184 WeakPolarHBondContact O-CG 3.46Å; K180-K184 PolarHBondContact O-N 3.34Å; K181-K184 PolarHBondContact O-N 3.22Å |
| 185 | F | 71.8 | Confident | 79.9 | Confident | 113 Ų | 113 | 101 Ų | 101 | 50% | 0.496 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -73.1 | -39.1 | 178.7 | -168.6 | -129 | 0 | 0 | 0 | 113 | K181 G182 L183 K187 H188 R189 | K181-F185 PolarHBondContact O-N 2.95Å; K181-F185 VanDerWaalsContact O-N 3.13Å; G182-F185 PolarHBondContact O-N 3.33Å; L183-F185 PolarHBondContact O-N 2.91Å; F185-K187 PolarHBondContact O-N 3.4Å; F185-H188 PolarHBondContact O-N 3.2Å; F185-R189 HydrophobicContact CD1-CG 3.95Å; F185-R189 HydrophobicContact CD2-CG 4.37Å; F185-R189 HydrophobicContact CE1-CG 4.13Å; F185-R189 HydrophobicContact CE2-CG 4.44Å; F185-R189 HydrophobicContact CG-CG 4.15Å; F185-R189 HydrophobicContact CZ-CG 4.38Å; F185-R189 WeakPolarHBondContact O-CB 3.48Å; F185-R189 WeakPolarHBondContact O-CG 3.44Å; F185-R189 PolarHBondContact O-N 3.19Å |
| 186 | K | 70.6 | Confident | 78.9 | Confident | 159 Ų | 159 | 103.4 Ų | 103.4 | 69% | 0.691 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -64.5 | -23.2 | 175.3 | -168.6 | 169.4 | 173.3 | 179.6 | 0 | 113.1 | G182 L183 P190 | G182-K186 PolarHBondContact O-N 3.14Å; L183-K186 PolarHBondContact O-N 3.08Å; K186-P190 WeakPolarHBondContact O-CD 3.44Å |
| 187 | K | 69.7 | Low | 78.2 | Confident | 149 Ų | 149 | 106.6 Ų | 106.6 | 65% | 0.648 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -69.4 | -37.6 | 173.3 | -71.2 | -179.7 | 179.7 | -170.7 | 0 | 113.3 | L183 F185 | L183-K187 WeakPolarHBondContact O-CG 3.41Å; L183-K187 PolarHBondContact O-N 3.41Å; F185-K187 PolarHBondContact O-N 3.4Å |
| 188 | H | 66.9 | Low | 77.5 | Confident | 106 Ų | 106 | 107.5 Ų | 107.5 | 49% | 0.491 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -91.8 | -25.3 | -178 | -90.6 | -72.4 | 0 | 0 | 0 | 114 | F185 T191 I192 | F185-H188 PolarHBondContact O-N 3.2Å; H188-T191 PolarHBondContact O-N 3.37Å; H188-I192 HydrophobicContact CB-CD1 4.31Å; H188-I192 WeakPolarHBondContact O-CG1 3.35Å; H188-I192 PolarHBondContact O-N 3.17Å; H188-I192 VanDerWaalsContact O-N 3.12Å |
| 189 | R | 67.8 | Low | 76.9 | Confident | 131 Ų | 131 | 103.3 Ų | 103.3 | 49% | 0.494 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -55.3 | -45.9 | -179 | -82.8 | -85.4 | -170.6 | 165.9 | 3 | 114.1 | F185 T191 I192 V193 | F185-R189 HydrophobicContact CD1-CG 3.95Å; F185-R189 HydrophobicContact CD2-CG 4.37Å; F185-R189 HydrophobicContact CE1-CG 4.13Å; F185-R189 HydrophobicContact CE2-CG 4.44Å; F185-R189 HydrophobicContact CG-CG 4.15Å; F185-R189 HydrophobicContact CZ-CG 4.38Å; F185-R189 WeakPolarHBondContact O-CB 3.48Å; F185-R189 WeakPolarHBondContact O-CG 3.44Å; F185-R189 PolarHBondContact O-N 3.19Å; R189-T191 PolarHBondContact O-N 3.42Å; R189-I192 PolarHBondContact O-N 3.14Å; R189-V193 VanDerWaalsContact O-CG2 3.29Å; R189-V193 WeakPolarHBondContact O-CG2 3.37Å; R189-V193 PolarHBondContact O-N 2.62Å |
| 190 | P | 72.3 | Confident | 76.2 | Confident | 60 Ų | 60 | 102.3 Ų | 102.3 | 39% | 0.39 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -58.3 | -49.7 | 177.1 | -23.6 | 32.4 | 0 | 0 | 0 | 111.1 | K186 I192 V193 F194 | K186-P190 WeakPolarHBondContact O-CD 3.44Å; P190-I192 VanDerWaalsContact C-N 3.29Å; P190-I192 PolarHBondContact O-N 2.92Å; P190-V193 PolarHBondContact O-N 3.12Å; P190-F194 HydrophobicContact CB-CD2 4.14Å; P190-F194 HydrophobicContact CB-CE2 4.2Å; P190-F194 WeakPolarHBondContact O-CB 3.49Å; P190-F194 WeakPolarHBondContact O-CD2 3.47Å; P190-F194 PolarHBondContact O-N 2.76Å |
| 191 | T | 69.2 | Low | 75 | Confident | 77 Ų | 77 | 107.5 Ų | 107.5 | 47% | 0.472 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -58.6 | -39.9 | -179.4 | -49.6 | 0 | 0 | 0 | 0 | 112.5 | H188 R189 S195 | H188-T191 PolarHBondContact O-N 3.37Å; R189-T191 PolarHBondContact O-N 3.42Å; T191-S195 WeakPolarHBondContact O-CB 3.36Å; T191-S195 PolarHBondContact O-N 3.38Å; T191-S195 PolarHBondContact O-OG 2.84Å; T191-S195 VanDerWaalsContact O-OG 3.11Å |
| 192 | I | 73 | Confident | 73.6 | Confident | 80 Ų | 80 | 107.3 Ų | 107.3 | 41% | 0.41 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -71.2 | -40.8 | 178 | -63.3 | 165.1 | 0 | 0 | 0 | 111.7 | H188 R189 P190 S195 S196 P205 | H188-I192 HydrophobicContact CB-CD1 4.31Å; H188-I192 WeakPolarHBondContact O-CG1 3.35Å; H188-I192 PolarHBondContact O-N 3.17Å; H188-I192 VanDerWaalsContact O-N 3.12Å; R189-I192 PolarHBondContact O-N 3.14Å; P190-I192 VanDerWaalsContact C-N 3.29Å; P190-I192 PolarHBondContact O-N 2.92Å; I192-S195 PolarHBondContact O-OG 2.82Å; I192-S195 VanDerWaalsContact O-OG 3.06Å; I192-S196 VanDerWaalsContact O-CB 3.28Å; I192-S196 WeakPolarHBondContact O-CB 3.39Å; I192-S196 PolarHBondContact O-N 3.35Å; I192-P205 HydrophobicContact CG1-CG 4.34Å |
| 193 | V | 76.9 | Confident | 72.4 | Confident | 73 Ų | 73 | 108.8 Ų | 108.8 | 44% | 0.442 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -68.8 | -42.9 | 178 | 174.2 | 0 | 0 | 0 | 0 | 110.4 | R189 P190 S196 M197 | R189-V193 VanDerWaalsContact O-CG2 3.29Å; R189-V193 WeakPolarHBondContact O-CG2 3.37Å; R189-V193 PolarHBondContact O-N 2.62Å; P190-V193 PolarHBondContact O-N 3.12Å; V193-S196 PolarHBondContact O-N 2.94Å; V193-M197 HydrophobicContact CG1-CG 4.39Å; V193-M197 HydrophobicContact CG1-SD 4.08Å; V193-M197 WeakPolarHBondContact O-CB 3.39Å; V193-M197 WeakPolarHBondContact O-CG 3.45Å; V193-M197 PolarHBondContact O-N 2.92Å |
| 194 | F | 74.6 | Confident | 71.4 | Confident | 133 Ų | 133 | 109.8 Ų | 109.8 | 58% | 0.583 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -62.7 | -45.7 | 175.9 | -81.3 | -67.7 | 0 | 0 | 0 | 111.9 | P190 S196 M197 L198 | P190-F194 HydrophobicContact CB-CD2 4.14Å; P190-F194 HydrophobicContact CB-CE2 4.2Å; P190-F194 WeakPolarHBondContact O-CB 3.49Å; P190-F194 WeakPolarHBondContact O-CD2 3.47Å; P190-F194 PolarHBondContact O-N 2.76Å; F194-S196 VanDerWaalsContact C-N 3.33Å; F194-S196 PolarHBondContact O-N 3.4Å; F194-M197 PolarHBondContact O-N 3.43Å; F194-L198 WeakPolarHBondContact O-CB 3.3Å; F194-L198 WeakPolarHBondContact O-CD1 3.49Å; F194-L198 VanDerWaalsContact O-CG 3.24Å; F194-L198 WeakPolarHBondContact O-CG 3.15Å; F194-L198 PolarHBondContact O-N 2.89Å |
| 195 | S | 74.6 | Confident | 70.9 | Confident | 23 Ų | 23 | 106.4 Ų | 106.4 | 16% | 0.161 | 55% | 0.549 | C | S | . | . | H | α-helix | trans | -64.9 | -37.1 | 176.9 | 64.2 | 0 | 0 | 0 | 0 | 112.4 | T191 I192 L198 G199 L200 | T191-S195 WeakPolarHBondContact O-CB 3.36Å; T191-S195 PolarHBondContact O-N 3.38Å; T191-S195 PolarHBondContact O-OG 2.84Å; T191-S195 VanDerWaalsContact O-OG 3.11Å; I192-S195 PolarHBondContact O-OG 2.82Å; I192-S195 VanDerWaalsContact O-OG 3.06Å; S195-L198 PolarHBondContact O-N 3.14Å; S195-G199 PolarHBondContact O-N 3.15Å; S195-L200 WeakPolarHBondContact O-CB 3.41Å; S195-L200 PolarHBondContact O-N 3.39Å |
| 196 | S | 74.3 | Confident | 70.2 | Confident | 92 Ų | 92 | 109.9 Ų | 109.9 | 64% | 0.643 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -67.6 | -39.9 | 174.9 | -169.4 | 0 | 0 | 0 | 0 | 112.8 | I192 V193 F194 G199 | I192-S196 VanDerWaalsContact O-CB 3.28Å; I192-S196 WeakPolarHBondContact O-CB 3.39Å; I192-S196 PolarHBondContact O-N 3.35Å; V193-S196 PolarHBondContact O-N 2.94Å; F194-S196 VanDerWaalsContact C-N 3.33Å; F194-S196 PolarHBondContact O-N 3.4Å; S196-G199 PolarHBondContact O-N 3.19Å |
| 197 | M | 79.9 | Confident | 69.8 | Low | 150 Ų | 150 | 107.9 Ų | 107.9 | 74% | 0.739 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -67.8 | -35.2 | 176.1 | -76.5 | -178.4 | 65 | 0 | 0 | 112.2 | V193 F194 G199 | V193-M197 HydrophobicContact CG1-CG 4.39Å; V193-M197 HydrophobicContact CG1-SD 4.08Å; V193-M197 WeakPolarHBondContact O-CB 3.39Å; V193-M197 WeakPolarHBondContact O-CG 3.45Å; V193-M197 PolarHBondContact O-N 2.92Å; F194-M197 PolarHBondContact O-N 3.43Å; M197-G199 PolarHBondContact O-N 3.48Å |
| 198 | L | 79.6 | Confident | 68.8 | Low | 127 Ų | 127 | 106.2 Ų | 106.2 | 67% | 0.665 | 56% | 0.564 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.5 | 3.3 | 175.4 | -68 | 166.5 | 0 | 0 | 0 | 113.1 | F194 S195 L200 | F194-L198 WeakPolarHBondContact O-CB 3.3Å; F194-L198 WeakPolarHBondContact O-CD1 3.49Å; F194-L198 VanDerWaalsContact O-CG 3.24Å; F194-L198 WeakPolarHBondContact O-CG 3.15Å; F194-L198 PolarHBondContact O-N 2.89Å; S195-L198 PolarHBondContact O-N 3.14Å; L198-L200 HydrophobicContact CB-CD1 4Å; L198-L200 HydrophobicContact CB-CG 3.98Å; L198-L200 HydrophobicContact CD1-CD1 4.34Å; L198-L200 PolarHBondContact O-N 3.02Å |
| 199 | G | 78.4 | Confident | 68.3 | Low | 54 Ų | 54 | 111 Ų | 111 | 56% | 0.557 | 58% | 0.583 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 70.2 | 13.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | S195 S196 M197 R201 | S195-G199 PolarHBondContact O-N 3.15Å; S196-G199 PolarHBondContact O-N 3.19Å; M197-G199 PolarHBondContact O-N 3.48Å; G199-R201 PolarHBondContact O-N 3.09Å |
| 200 | L | 77.3 | Confident | 67.5 | Low | 81 Ų | 81 | 112.5 Ų | 112.5 | 42% | 0.424 | 60% | 0.6 | S | S | . | * | trans | -78.3 | 68.8 | -177.6 | -60.9 | 171.6 | 0 | 0 | 0 | 110.3 | S195 L198 T202 C203 | S195-L200 WeakPolarHBondContact O-CB 3.41Å; S195-L200 PolarHBondContact O-N 3.39Å; L198-L200 HydrophobicContact CB-CD1 4Å; L198-L200 HydrophobicContact CB-CG 3.98Å; L198-L200 HydrophobicContact CD1-CD1 4.34Å; L198-L200 PolarHBondContact O-N 3.02Å; L200-T202 PolarHBondContact O-N 3.38Å; L200-C203 HydrophobicContact CB-CB 4.12Å | ||
| 201 | R | 64.3 | Low | 66.1 | Low | 247 Ų | 247 | 122.8 Ų | 122.8 | 93% | 0.932 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.3 | -8.1 | -178.6 | -85.7 | -171.8 | 156.1 | 147.7 | -3 | 114.7 | G199 | G199-R201 PolarHBondContact O-N 3.09Š|
| 202 | T | 62 | Low | 65.9 | Low | 122 Ų | 122 | 125.1 Ų | 125.1 | 75% | 0.748 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -122.9 | -5.1 | -175.9 | 57.6 | 0 | 0 | 0 | 0 | 114.6 | L200 L204 | L200-T202 PolarHBondContact O-N 3.38Å; T202-L204 PolarHBondContact O-N 3.33Å; T202-L204 VanDerWaalsContact O-N 3.12Å |
| 203 | C | 60.2 | Low | 65.5 | Low | 70 Ų | 70 | 127.5 Ų | 127.5 | 47% | 0.473 | 66% | 0.66 | S | S | . | * | trans | -90.4 | 76.2 | 179 | -48.4 | 0 | 0 | 0 | 0 | 109.4 | L200 | L200-C203 HydrophobicContact CB-CB 4.12Š| ||
| 204 | L | 59.9 | Low | 64.9 | Low | 121 Ų | 121 | 130.5 Ų | 130.5 | 63% | 0.634 | 67% | 0.672 | S | S | * | * | trans | -64.7 | 127.6 | -178.1 | -70.7 | 150.2 | 0 | 0 | 0 | 110.1 | T202 W206 | T202-L204 PolarHBondContact O-N 3.33Å; T202-L204 VanDerWaalsContact O-N 3.12Å; L204-W206 HydrophobicContact CB-CG 4.28Å; L204-W206 PolarHBondContact O-N 2.89Å | ||
| 205 | P | 65.6 | Low | 64.3 | Low | 66 Ų | 66 | 130.4 Ų | 130.4 | 43% | 0.429 | 68% | 0.677 | S | S | . | * | trans | -75.4 | 67.2 | 170.8 | 31.9 | -32.1 | 0 | 0 | 0 | 108.8 | I192 | I192-P205 HydrophobicContact CG1-CG 4.34Š| ||
| 206 | W | 57.8 | Low | 63.7 | Low | 186 Ų | 186 | 137.1 Ų | 137.1 | 71% | 0.705 | 71% | 0.709 | S | S | * | * | trans | -80.9 | 127 | 165.8 | -72.1 | 104.3 | 0 | 0 | 0 | 108.1 | L204 V208 | L204-W206 HydrophobicContact CB-CG 4.28Å; L204-W206 PolarHBondContact O-N 2.89Å; W206-V208 VanDerWaalsContact C-N 3.27Å; W206-V208 PolarHBondContact O-N 3.44Å | ||
| 207 | P | 61.2 | Low | 63 | Low | 117 Ų | 117 | 140.1 Ų | 140.1 | 76% | 0.76 | 71% | 0.714 | S | S | * | * | trans | -71 | 90.1 | 167.8 | 29 | -30.4 | 0 | 0 | 0 | 107.8 | K209 | P207-K209 PolarHBondContact O-N 3.48Š| ||
| 208 | V | 49.1 | Very low | 61.8 | Low | 114 Ų | 114 | 139.4 Ų | 139.4 | 69% | 0.691 | 71% | 0.712 | S | S | * | * | trans | -71.7 | 110.2 | 168.6 | -72.8 | 0 | 0 | 0 | 0 | 108 | W206 L210 | W206-V208 VanDerWaalsContact C-N 3.27Å; W206-V208 PolarHBondContact O-N 3.44Å; V208-L210 VanDerWaalsContact C-N 3.32Å; V208-L210 PolarHBondContact O-N 3.49Å | ||
| 209 | K | 55.5 | Low | 60.4 | Low | 207 Ų | 207 | 140.3 Ų | 140.3 | 90% | 0.9 | 72% | 0.716 | S | S | * | * | trans | -74.3 | 90.1 | 173.4 | -154.3 | 175.8 | -173.3 | 179.2 | 0 | 106.9 | P207 K211 | P207-K209 PolarHBondContact O-N 3.48Å; K209-K211 PolarHBondContact O-N 2.67Å | ||
| 210 | L | 51 | Low | 58.9 | Low | 162 Ų | 162 | 147.5 Ų | 147.5 | 85% | 0.848 | 73% | 0.729 | S | S | * | * | trans | -63.7 | 127.7 | 170 | -75.7 | 158 | 0 | 0 | 0 | 107.9 | V208 | V208-L210 VanDerWaalsContact C-N 3.32Å; V208-L210 PolarHBondContact O-N 3.49Å | ||
| 211 | K | 43 | Very low | 57.2 | Low | 277 Ų | 277 | 153.5 Ų | 153.5 | 100% | 1.204 | 76% | 0.757 | S | S | * | * | trans | -90 | 0 | -176.2 | -160.1 | 176.6 | -177.5 | 173 | 0 | 109.9 | K209 | K209-K211 PolarHBondContact O-N 2.67Š|
Retrieved 211 of 211 residues in 43.2 ms
(Link to these results)