| 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 | 34.2 | Very low | 45.2 | Very low | 191 Ų | 191 | 141.9 Ų | 141.9 | 94% | 0.941 | 78% | 0.778 | S | S | * | * | 0 | 139.5 | 0 | -80 | 177.5 | 70 | 0 | 0 | 108.8 | C54 | M1-C54 PolarHBondContact N-SG 2.93Š| |||
| 2 | S | 42.1 | Very low | 44.9 | Very low | 89 Ų | 89 | 139.8 Ų | 139.8 | 62% | 0.622 | 77% | 0.772 | S | S | * | * | trans | 66 | 99.5 | 145.4 | -55.1 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 3 | T | 46 | Very low | 43.9 | Very low | 122 Ų | 122 | 139.2 Ų | 139.2 | 75% | 0.748 | 77% | 0.767 | S | S | * | * | 72.6 | 146.4 | 75.9 | 66 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 4 | T | 50.3 | Low | 43.7 | Very low | 135 Ų | 135 | 136.7 Ų | 136.7 | 83% | 0.828 | 76% | 0.764 | S | S | * | * | trans | 79.9 | 109 | 154.3 | 6.1 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 5 | G | 48.3 | Very low | 43.7 | Very low | 66 Ų | 66 | 139.3 Ų | 139.3 | 68% | 0.68 | 78% | 0.775 | S | S | * | * | 94.2 | 131.2 | 55.9 | 0 | 0 | 0 | 0 | 0 | 108.1 | |||||
| 6 | P | 47.7 | Very low | 43.6 | Very low | 114 Ų | 114 | 141 Ų | 141 | 74% | 0.74 | 78% | 0.779 | S | S | * | * | -136.7 | 131.5 | 88 | 26.8 | -7.7 | 0 | 0 | 0 | 112 | |||||
| 7 | I | 52.5 | Low | 42.9 | Very low | 159 Ų | 159 | 142.2 Ų | 142.2 | 82% | 0.815 | 78% | 0.784 | S | S | * | * | 48.1 | 104.3 | 96.9 | -43.8 | 154.9 | 0 | 0 | 0 | 111.5 | |||||
| 8 | S | 36.8 | Very low | 42.7 | Very low | 95 Ų | 95 | 143.6 Ų | 143.6 | 66% | 0.664 | 78% | 0.784 | S | S | * | * | -178 | 146 | 117.6 | -162.8 | 0 | 0 | 0 | 0 | 110.7 | |||||
| 9 | N | 46.5 | Very low | 42.4 | Very low | 142 Ų | 142 | 143.6 Ų | 143.6 | 76% | 0.759 | 78% | 0.778 | S | S | * | * | trans | -61.4 | 124.6 | -170.5 | -56.1 | -72.8 | 0 | 0 | 0 | 112.5 | ||||
| 10 | Y | 43.8 | Very low | 41.7 | Very low | 225 Ų | 225 | 143 Ų | 143 | 88% | 0.882 | 77% | 0.774 | S | S | * | * | trans | -96.7 | 94.3 | 158.2 | -80.4 | -82.9 | 0 | 0 | 0 | 108.7 | V12 | Y10-V12 PolarHBondContact O-N 3.42Š| ||
| 11 | Y | 49.2 | Very low | 41.2 | Very low | 223 Ų | 223 | 144.4 Ų | 144.4 | 88% | 0.875 | 78% | 0.776 | S | S | * | * | trans | -69 | 114.1 | 157 | -124.4 | -93 | 0 | 0 | 0 | 106.9 | ||||
| 12 | V | 41.2 | Very low | 41.3 | Very low | 116 Ų | 116 | 141.2 Ų | 141.2 | 70% | 0.703 | 76% | 0.763 | S | S | * | * | trans | -138.9 | 101.5 | 162.1 | 179.5 | 0 | 0 | 0 | 0 | 104.6 | Y10 | Y10-V12 PolarHBondContact O-N 3.42Š| ||
| 13 | D | 32.3 | Very low | 41 | Very low | 133 Ų | 133 | 142.6 Ų | 142.6 | 71% | 0.711 | 77% | 0.767 | S | S | * | * | S | Bend | -176.7 | 135.9 | 109.6 | -135.5 | -46 | 0 | 0 | 0 | 112.8 | |||
| 14 | S | 41.4 | Very low | 40.6 | Very low | 104 Ų | 104 | 144.8 Ų | 144.8 | 73% | 0.727 | 77% | 0.773 | S | S | * | * | trans | 73.6 | 76.3 | 152.7 | -65.2 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 15 | L | 43.8 | Very low | 39.9 | Very low | 176 Ų | 176 | 143 Ų | 143 | 92% | 0.921 | 77% | 0.772 | S | S | * | * | trans | -90.4 | 105.2 | 138.6 | -78.8 | 166.3 | 0 | 0 | 0 | 108.5 | ||||
| 16 | I | 41.4 | Very low | 39.2 | Very low | 166 Ų | 166 | 144.2 Ų | 144.2 | 85% | 0.851 | 78% | 0.775 | S | S | * | * | trans | -155.9 | 98 | 150 | -96.8 | 142 | 0 | 0 | 0 | 106.6 | ||||
| 17 | N | 32.7 | Very low | 38.6 | Very low | 161 Ų | 161 | 144.3 Ų | 144.3 | 86% | 0.861 | 77% | 0.774 | S | S | * | * | trans | -155.8 | 122.8 | 131.4 | -144.1 | 47.8 | 0 | 0 | 0 | 108.3 | ||||
| 18 | H | 39.2 | Very low | 37.8 | Very low | 167 Ų | 167 | 146.6 Ų | 146.6 | 77% | 0.773 | 77% | 0.772 | S | S | * | * | trans | -43.6 | 152.9 | 165 | -120.6 | -79.9 | 0 | 0 | 0 | 110.5 | ||||
| 19 | E | 35.5 | Very low | 37.8 | Very low | 145 Ų | 145 | 151.3 Ų | 151.3 | 68% | 0.678 | 78% | 0.781 | S | S | * | * | cis | 179 | 154.7 | 43.2 | 40.9 | -172.5 | 100.1 | 0 | 0 | 110.4 | ||||
| 20 | N | 29.5 | Very low | 37.3 | Very low | 131 Ų | 131 | 150 Ų | 150 | 70% | 0.701 | 78% | 0.784 | S | S | * | * | trans | 105.7 | 131.3 | 152.3 | -58.5 | -48.8 | 0 | 0 | 0 | 121.1 | ||||
| 21 | E | 31.7 | Very low | 37.2 | Very low | 172 Ų | 172 | 144 Ų | 144 | 80% | 0.804 | 78% | 0.78 | S | S | * | * | trans | 68.6 | 130.7 | 165.2 | -70.4 | -161 | 120.1 | 0 | 0 | 117.2 | ||||
| 22 | D | 35.7 | Very low | 37.6 | Very low | 125 Ų | 125 | 139.9 Ų | 139.9 | 67% | 0.668 | 78% | 0.781 | S | S | * | * | cis | -152.3 | 128 | 21.8 | -82.9 | -61.4 | 0 | 0 | 0 | 108 | ||||
| 23 | V | 35.4 | Very low | 37.3 | Very low | 118 Ų | 118 | 138.1 Ų | 138.1 | 72% | 0.715 | 79% | 0.786 | S | S | * | * | 61.4 | 106.1 | 91.4 | -179.2 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 24 | L | 38.2 | Very low | 37.6 | Very low | 168 Ų | 168 | 136.5 Ų | 136.5 | 88% | 0.88 | 79% | 0.785 | S | S | * | * | trans | 84.3 | 96.6 | 156.2 | -56.6 | 164.3 | 0 | 0 | 0 | 120.2 | ||||
| 25 | A | 36.2 | Very low | 37.6 | Very low | 96 Ų | 96 | 140.5 Ų | 140.5 | 79% | 0.793 | 79% | 0.792 | S | S | * | * | trans | 179.4 | 85 | 130.6 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 26 | A | 33.3 | Very low | 38.3 | Very low | 92 Ų | 92 | 138.4 Ų | 138.4 | 76% | 0.76 | 79% | 0.789 | S | S | * | * | 33.1 | 110.8 | 105.4 | 0 | 0 | 0 | 0 | 0 | 115.6 | |||||
| 27 | T | 35.2 | Very low | 38.2 | Very low | 116 Ų | 116 | 135.6 Ų | 135.6 | 71% | 0.712 | 79% | 0.791 | S | S | * | * | 147.9 | 103.7 | 105.9 | -47.5 | 0 | 0 | 0 | 0 | 113 | |||||
| 28 | R | 35.6 | Very low | 38.3 | Very low | 207 Ų | 207 | 131.2 Ų | 131.2 | 78% | 0.781 | 78% | 0.784 | S | S | * | * | trans | 42.1 | 124 | 133.6 | -45.3 | 173.7 | -173.8 | -141 | -0.5 | 119.9 | ||||
| 29 | F | 36 | Very low | 38.8 | Very low | 195 Ų | 195 | 129.7 Ų | 129.7 | 86% | 0.855 | 79% | 0.788 | S | S | * | * | 173.8 | 145.9 | 93.6 | -103.2 | -80 | 0 | 0 | 0 | 112 | |||||
| 30 | S | 35.8 | Very low | 38.9 | Very low | 115 Ų | 115 | 133.7 Ų | 133.7 | 80% | 0.804 | 80% | 0.797 | S | S | * | * | trans | -91.8 | 155.9 | 179.1 | -58.5 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 31 | A | 41.8 | Very low | 39.7 | Very low | 98 Ų | 98 | 133.6 Ų | 133.6 | 81% | 0.81 | 80% | 0.804 | S | S | * | * | 122.1 | 151.8 | 127.3 | 0 | 0 | 0 | 0 | 0 | 118.3 | |||||
| 32 | P | 57.9 | Low | 40.3 | Very low | 136 Ų | 136 | 131.4 Ų | 131.4 | 88% | 0.883 | 80% | 0.802 | S | S | * | * | trans | -116.6 | 176.7 | -153.5 | 40.3 | -25.4 | 0 | 0 | 0 | 114.1 | ||||
| 33 | G | 34.1 | Very low | 40.3 | Very low | 79 Ų | 79 | 130.8 Ų | 130.8 | 81% | 0.814 | 81% | 0.808 | S | S | * | * | trans | -163.7 | 139.3 | 172.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 34 | S | 40.1 | Very low | 41 | Very low | 100 Ų | 100 | 132.8 Ų | 132.8 | 70% | 0.699 | 81% | 0.814 | S | S | * | * | trans | -128 | 136.3 | -159.1 | 53 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 35 | H | 40.3 | Very low | 41.3 | Very low | 188 Ų | 188 | 131.4 Ų | 131.4 | 87% | 0.87 | 81% | 0.812 | S | S | * | * | trans | 57.6 | 170.4 | 154.1 | -56.7 | -63 | 0 | 0 | 0 | 119.4 | ||||
| 36 | P | 58.1 | Low | 41.9 | Very low | 131 Ų | 131 | 132.1 Ų | 132.1 | 85% | 0.851 | 81% | 0.809 | S | S | * | * | cis | -137.6 | -164.7 | 5.1 | 37.1 | -13.5 | 0 | 0 | 0 | 116.4 | ||||
| 37 | A | 39.3 | Very low | 42.4 | Very low | 108 Ų | 108 | 136.4 Ų | 136.4 | 89% | 0.893 | 81% | 0.813 | S | S | * | * | trans | -82.9 | 167.6 | -160.4 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 38 | G | 35.9 | Very low | 42.6 | Very low | 69 Ų | 69 | 137.2 Ų | 137.2 | 71% | 0.711 | 82% | 0.821 | S | S | * | * | trans | 179.3 | 157.2 | 163.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 39 | P | 48.4 | Very low | 43.5 | Very low | 134 Ų | 134 | 131.2 Ų | 131.2 | 87% | 0.87 | 82% | 0.817 | S | S | * | * | trans | -106.3 | 172.3 | -135.5 | 38.9 | -34 | 0 | 0 | 0 | 118.6 | ||||
| 40 | R | 38.8 | Very low | 43.7 | Very low | 229 Ų | 229 | 129.6 Ų | 129.6 | 86% | 0.864 | 82% | 0.817 | S | S | * | * | trans | -38.7 | 159.6 | 178.3 | -76.5 | 179.3 | 168.6 | 168.6 | -4 | 117.2 | ||||
| 41 | P | 46.2 | Very low | 44.5 | Very low | 129 Ų | 129 | 135.3 Ų | 135.3 | 84% | 0.838 | 82% | 0.822 | S | S | * | * | -137.8 | 155 | 103 | 36.7 | -24.1 | 0 | 0 | 0 | 115.7 | |||||
| 42 | T | 43.7 | Very low | 45.3 | Very low | 126 Ų | 126 | 135.6 Ų | 135.6 | 77% | 0.773 | 82% | 0.816 | S | S | * | * | trans | -68.3 | 140.2 | 174.4 | -45.2 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 43 | S | 36.3 | Very low | 45.1 | Very low | 112 Ų | 112 | 134.4 Ų | 134.4 | 78% | 0.783 | 81% | 0.811 | S | S | * | * | trans | -142.1 | 141.5 | 157.5 | -168.3 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 44 | L | 49 | Very low | 46 | Very low | 161 Ų | 161 | 135.8 Ų | 135.8 | 84% | 0.843 | 81% | 0.807 | S | S | * | * | trans | -64.1 | 141.4 | -174.4 | -64.6 | 139.4 | 0 | 0 | 0 | 112.4 | ||||
| 45 | V | 45.2 | Very low | 46.8 | Very low | 138 Ų | 138 | 136.3 Ų | 136.3 | 84% | 0.836 | 81% | 0.81 | S | S | * | * | trans | -140.9 | 133.8 | 155.4 | -176.3 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 46 | P | 48.8 | Very low | 47.5 | Very low | 112 Ų | 112 | 137.3 Ų | 137.3 | 73% | 0.727 | 81% | 0.812 | S | S | * | * | trans | -76.9 | 154 | 179 | -12.8 | 29.8 | 0 | 0 | 0 | 115.8 | ||||
| 47 | E | 44.1 | Very low | 47.6 | Very low | 181 Ų | 181 | 134.8 Ų | 134.8 | 85% | 0.846 | 80% | 0.803 | S | S | * | * | trans | 34.4 | 113.7 | 139.4 | -154.1 | 165.1 | 158 | 0 | 0 | 120.2 | ||||
| 48 | C | 39.6 | Very low | 48.6 | Very low | 133 Ų | 133 | 135.2 Ų | 135.2 | 90% | 0.899 | 80% | 0.796 | S | S | * | * | trans | -154.6 | 94 | 144 | -104.1 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 49 | A | 53.3 | Low | 50 | Low | 82 Ų | 82 | 140.9 Ų | 140.9 | 68% | 0.678 | 80% | 0.802 | S | S | * | * | trans | -69.8 | 127.2 | 151.6 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 50 | D | 42 | Very low | 50.3 | Low | 160 Ų | 160 | 140.2 Ų | 140.2 | 86% | 0.856 | 80% | 0.797 | S | S | * | * | trans | 165.2 | 89.7 | 146.6 | -84.4 | -29.9 | 0 | 0 | 0 | 109.4 | ||||
| 51 | Y | 51.8 | Low | 51.5 | Low | 235 Ų | 235 | 135.1 Ų | 135.1 | 92% | 0.922 | 79% | 0.792 | S | S | * | * | trans | -84.9 | 122.1 | 161.6 | -103 | -86.7 | 0 | 0 | 0 | 108.1 | S53 | Y51-S53 PolarHBondContact O-N 2.77Š| ||
| 52 | P | 57.6 | Low | 52.2 | Low | 105 Ų | 105 | 135.2 Ų | 135.2 | 68% | 0.682 | 79% | 0.79 | S | S | * | * | trans | -76.6 | 115.4 | 177.5 | 29.4 | -30.7 | 0 | 0 | 0 | 110 | C54 | P52-C54 PolarHBondContact O-N 3.43Š| ||
| 53 | S | 55.3 | Low | 52.6 | Low | 111 Ų | 111 | 137.1 Ų | 137.1 | 78% | 0.776 | 79% | 0.788 | S | S | * | * | trans | -49.9 | 126 | 167.4 | -170.9 | 0 | 0 | 0 | 0 | 110.7 | Y51 S55 | Y51-S53 PolarHBondContact O-N 2.77Å; S53-S55 PolarHBondContact O-N 2.98Å | ||
| 54 | C | 52.1 | Low | 53.3 | Low | 108 Ų | 108 | 137.8 Ų | 137.8 | 73% | 0.73 | 79% | 0.792 | S | S | * | * | trans | -75.6 | 86.6 | -178.2 | -74 | 0 | 0 | 0 | 0 | 111.2 | M1 P52 | M1-C54 PolarHBondContact N-SG 2.93Å; P52-C54 PolarHBondContact O-N 3.43Å | ||
| 55 | S | 56.9 | Low | 53.2 | Low | 110 Ų | 110 | 134.9 Ų | 134.9 | 77% | 0.769 | 78% | 0.781 | S | S | * | * | trans | -86.3 | 124 | 165.1 | -82.8 | 0 | 0 | 0 | 0 | 111 | S53 A57 | S53-S55 PolarHBondContact O-N 2.98Å; S55-A57 PolarHBondContact O-N 3.18Å; S55-A57 VanDerWaalsContact O-N 3.16Å | ||
| 56 | F | 55.5 | Low | 53.6 | Low | 209 Ų | 209 | 133.1 Ų | 133.1 | 92% | 0.917 | 78% | 0.775 | S | S | * | * | trans | -76.3 | 93.8 | 175.9 | -158.8 | -91.8 | 0 | 0 | 0 | 109.2 | ||||
| 57 | A | 60.5 | Low | 54.1 | Low | 78 Ų | 78 | 138.9 Ų | 138.9 | 65% | 0.645 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -84.3 | 130 | 169.3 | 0 | 0 | 0 | 0 | 0 | 109.7 | S55 K59 | S55-A57 PolarHBondContact O-N 3.18Å; S55-A57 VanDerWaalsContact O-N 3.16Å; A57-K59 PolarHBondContact O-N 3.07Å |
| 58 | P | 59.2 | Low | 54.2 | Low | 117 Ų | 117 | 133.8 Ų | 133.8 | 76% | 0.76 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 125.9 | 173 | 26.7 | -30.5 | 0 | 0 | 0 | 109.5 | ||
| 59 | K | 64.7 | Low | 54.9 | Low | 189 Ų | 189 | 132.9 Ų | 132.9 | 82% | 0.822 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 144.6 | 176.6 | -62.9 | 178.5 | 179.6 | 178.1 | 0 | 110.2 | A57 | A57-K59 PolarHBondContact O-N 3.07Š|
| 60 | P | 55 | Low | 54.4 | Low | 119 Ų | 119 | 132.2 Ų | 132.2 | 77% | 0.773 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -66.7 | 134.7 | 172.6 | 27.5 | -32.9 | 0 | 0 | 0 | 111 | V62 | P60-V62 PolarHBondContact O-N 3.36Š|
| 61 | T | 63.8 | Low | 54.8 | Low | 123 Ų | 123 | 133.2 Ų | 133.2 | 76% | 0.755 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 117.2 | 176.8 | -57.8 | 0 | 0 | 0 | 0 | 110.4 | F63 | T61-F63 WeakPolarHBondContact CG2-O 3.36Å; T61-F63 PolarHBondContact O-N 3.35Å |
| 62 | V | 61.3 | Low | 54.3 | Low | 131 Ų | 131 | 127.7 Ų | 127.7 | 79% | 0.794 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -83.7 | 5.9 | -180 | -152.5 | 0 | 0 | 0 | 0 | 112.9 | P60 | P60-V62 PolarHBondContact O-N 3.36Š|
| 63 | F | 53.3 | Low | 53.6 | Low | 166 Ų | 166 | 131.5 Ų | 131.5 | 73% | 0.728 | 77% | 0.768 | S | S | * | * | trans | -127.9 | 98.6 | 173.8 | -65.4 | -75.5 | 0 | 0 | 0 | 110.4 | T61 T65 | T61-F63 WeakPolarHBondContact CG2-O 3.36Å; T61-F63 PolarHBondContact O-N 3.35Å; F63-T65 PolarHBondContact O-N 3.01Å | ||
| 64 | S | 49.8 | Very low | 52.9 | Low | 126 Ų | 126 | 131.1 Ų | 131.1 | 88% | 0.881 | 77% | 0.766 | S | S | * | * | trans | -66 | 86.6 | 161.5 | -80.3 | 0 | 0 | 0 | 0 | 108.8 | S66 | S64-S66 VanDerWaalsContact C-N 3.29Å; S64-S66 PolarHBondContact O-N 2.98Å | ||
| 65 | T | 48.5 | Very low | 52.5 | Low | 100 Ų | 100 | 131 Ų | 131 | 61% | 0.613 | 77% | 0.767 | S | S | * | * | trans | -85.4 | 84.2 | 164 | -46 | 0 | 0 | 0 | 0 | 107.1 | F63 W67 | F63-T65 PolarHBondContact O-N 3.01Å; T65-W67 PolarHBondContact O-N 3.09Å; T65-W67 VanDerWaalsContact O-N 3.14Å | ||
| 66 | S | 52.9 | Low | 52.1 | Low | 101 Ų | 101 | 131.7 Ų | 131.7 | 71% | 0.706 | 77% | 0.766 | S | S | * | * | trans | -72.8 | 99.3 | 171.6 | -169.8 | 0 | 0 | 0 | 0 | 108.4 | S64 A68 | S64-S66 VanDerWaalsContact C-N 3.29Å; S64-S66 PolarHBondContact O-N 2.98Å; S66-A68 VanDerWaalsContact C-N 3.32Å | ||
| 67 | W | 58.4 | Low | 51.9 | Low | 233 Ų | 233 | 126.9 Ų | 126.9 | 88% | 0.883 | 75% | 0.753 | S | S | * | * | trans | -95.1 | 74.3 | 155.8 | -69.2 | 77.7 | 0 | 0 | 0 | 106.8 | T65 P69 | T65-W67 PolarHBondContact O-N 3.09Å; T65-W67 VanDerWaalsContact O-N 3.14Å; W67-P69 WeakPolarHBondContact O-CD 3.41Å | ||
| 68 | A | 47.3 | Very low | 50.9 | Low | 73 Ų | 73 | 133 Ų | 133 | 60% | 0.603 | 76% | 0.761 | S | S | * | * | trans | -80.7 | 125 | 163.6 | 0 | 0 | 0 | 0 | 0 | 108.1 | S66 G70 | S66-A68 VanDerWaalsContact C-N 3.32Å; A68-G70 PolarHBondContact O-N 2.67Å | ||
| 69 | P | 53.2 | Low | 50.2 | Low | 115 Ų | 115 | 135.3 Ų | 135.3 | 75% | 0.747 | 76% | 0.761 | S | S | * | * | trans | -67.2 | 103.5 | 163.6 | -16.9 | 31.7 | 0 | 0 | 0 | 108 | W67 H71 | W67-P69 WeakPolarHBondContact O-CD 3.41Å; P69-H71 PolarHBondContact O-N 2.81Å | ||
| 70 | G | 43.3 | Very low | 49.4 | Very low | 68 Ų | 68 | 130.9 Ų | 130.9 | 70% | 0.701 | 75% | 0.752 | S | S | * | * | trans | -56.8 | 110.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | A68 S72 | A68-G70 PolarHBondContact O-N 2.67Å; G70-S72 PolarHBondContact O-N 2.95Å; G70-S72 VanDerWaalsContact O-N 3.14Å | ||
| 71 | H | 49.9 | Very low | 48.7 | Very low | 180 Ų | 180 | 134.8 Ų | 134.8 | 83% | 0.833 | 75% | 0.752 | S | S | * | * | trans | -65.6 | 105.8 | 162.5 | -80.6 | 23.9 | 0 | 0 | 0 | 107.7 | P69 Q73 | P69-H71 PolarHBondContact O-N 2.81Å; H71-Q73 PolarHBondContact O-N 3.45Å | ||
| 72 | S | 42.4 | Very low | 47.5 | Very low | 120 Ų | 120 | 134.7 Ų | 134.7 | 84% | 0.839 | 76% | 0.757 | S | S | * | * | trans | -74.9 | 106.4 | 169.2 | -66.4 | 0 | 0 | 0 | 0 | 108 | G70 S74 | G70-S72 PolarHBondContact O-N 2.95Å; G70-S72 VanDerWaalsContact O-N 3.14Å; S72-S74 PolarHBondContact O-N 3.47Å | ||
| 73 | Q | 41.9 | Very low | 46.6 | Very low | 184 Ų | 184 | 135.4 Ų | 135.4 | 86% | 0.86 | 75% | 0.751 | S | S | * | * | trans | -63.6 | 118.3 | 167.9 | -71.7 | -114 | 33 | 0 | 0 | 108.6 | H71 S75 | H71-Q73 PolarHBondContact O-N 3.45Å; Q73-S75 PolarHBondContact O-N 3.37Å | ||
| 74 | S | 41 | Very low | 46 | Very low | 103 Ų | 103 | 135.7 Ų | 135.7 | 72% | 0.72 | 76% | 0.755 | S | S | * | * | trans | -71.6 | 98.1 | 171 | 164.7 | 0 | 0 | 0 | 0 | 109.4 | S72 V76 | S72-S74 PolarHBondContact O-N 3.47Å; S74-V76 PolarHBondContact O-N 3.07Å | ||
| 75 | S | 44.3 | Very low | 46 | Very low | 107 Ų | 107 | 134 Ų | 134 | 75% | 0.748 | 74% | 0.741 | S | S | * | * | trans | -81.9 | 101.7 | 160.6 | 38.9 | 0 | 0 | 0 | 0 | 109.1 | Q73 V77 | Q73-S75 PolarHBondContact O-N 3.37Å; S75-V77 PolarHBondContact O-N 3.02Å | ||
| 76 | V | 48.4 | Very low | 45.6 | Very low | 124 Ų | 124 | 138.1 Ų | 138.1 | 75% | 0.752 | 75% | 0.753 | S | S | * | * | trans | -69.8 | 104.6 | 168.8 | 179.5 | 0 | 0 | 0 | 0 | 107.7 | S74 | S74-V76 PolarHBondContact O-N 3.07Š| ||
| 77 | V | 50.3 | Low | 45.2 | Very low | 108 Ų | 108 | 142.2 Ų | 142.2 | 66% | 0.655 | 77% | 0.766 | S | S | * | * | trans | -115.4 | 114.7 | 161.9 | 178.8 | 0 | 0 | 0 | 0 | 107.3 | S75 H79 | S75-V77 PolarHBondContact O-N 3.02Å; V77-H79 PolarHBondContact O-N 3.2Å | ||
| 78 | Y | 40 | Very low | 44.4 | Very low | 205 Ų | 205 | 134.6 Ų | 134.6 | 80% | 0.804 | 76% | 0.759 | S | S | * | * | trans | -69.6 | 118.8 | 178.3 | -164.2 | -92 | 0 | 0 | 0 | 109.4 | ||||
| 79 | H | 45 | Very low | 44.4 | Very low | 166 Ų | 166 | 137.3 Ų | 137.3 | 77% | 0.769 | 77% | 0.768 | S | S | * | * | trans | -127.3 | 125.1 | 164.8 | -79.4 | -65.1 | 0 | 0 | 0 | 110.3 | V77 | V77-H79 PolarHBondContact O-N 3.2Š| ||
| 80 | P | 47.7 | Very low | 44.2 | Very low | 96 Ų | 96 | 139.7 Ų | 139.7 | 62% | 0.623 | 77% | 0.77 | S | S | * | * | trans | -87.5 | 139 | -178.1 | 34 | -31.4 | 0 | 0 | 0 | 112.1 | ||||
| 81 | Y | 40.6 | Very low | 44.5 | Very low | 201 Ų | 201 | 142 Ų | 142 | 79% | 0.788 | 78% | 0.775 | S | S | * | * | trans | 47.3 | 110.7 | 147.4 | -119 | -94.8 | 0 | 0 | 0 | 119.9 | H83 | Y81-H83 AromaticContact CE1-CD2 3.82Å; Y81-H83 AromaticContact CE1-NE2 3.56Å | ||
| 82 | S | 38.1 | Very low | 44.8 | Very low | 121 Ų | 121 | 145 Ų | 145 | 85% | 0.846 | 78% | 0.779 | S | S | * | * | trans | -171.4 | 138.9 | 130 | 25.4 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 83 | H | 41.4 | Very low | 45.5 | Very low | 146 Ų | 146 | 150.3 Ų | 150.3 | 68% | 0.676 | 78% | 0.782 | S | S | * | * | trans | -79.1 | 146 | -179.1 | -68.1 | -108.2 | 0 | 0 | 0 | 112.5 | Y81 | Y81-H83 AromaticContact CE1-CD2 3.82Å; Y81-H83 AromaticContact CE1-NE2 3.56Å | ||
| 84 | Q | 40.7 | Very low | 46.1 | Very low | 173 Ų | 173 | 149 Ų | 149 | 81% | 0.808 | 78% | 0.778 | S | S | * | * | 166 | 153.8 | 119.6 | -93.4 | -78.8 | -56.1 | 0 | 0 | 112.4 | |||||
| 85 | P | 51.1 | Low | 46.7 | Very low | 89 Ų | 89 | 155.2 Ų | 155.2 | 58% | 0.578 | 79% | 0.785 | S | S | * | * | trans | -98.6 | 144 | -165.7 | 37.1 | -26.3 | 0 | 0 | 0 | 112.5 | ||||
| 86 | H | 39 | Very low | 47.1 | Very low | 188 Ų | 188 | 154.2 Ų | 154.2 | 87% | 0.87 | 78% | 0.779 | S | S | * | * | trans | -121.4 | 121.5 | 162.5 | -70.2 | -46.7 | 0 | 0 | 0 | 110 | G88 | H86-G88 PolarHBondContact O-N 3.24Š| ||
| 87 | L | 45.9 | Very low | 47.5 | Very low | 187 Ų | 187 | 160.6 Ų | 160.6 | 98% | 0.979 | 79% | 0.789 | S | S | * | * | trans | -52 | 125.3 | 165.4 | -77.8 | 118.7 | 0 | 0 | 0 | 109.6 | ||||
| 88 | G | 39.8 | Very low | 48 | Very low | 72 Ų | 72 | 163.5 Ų | 163.5 | 74% | 0.742 | 80% | 0.8 | S | S | * | * | trans | -150.9 | 100.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 109 | H86 | H86-G88 PolarHBondContact O-N 3.24Š| ||
| 89 | T | 48.6 | Very low | 48.7 | Very low | 130 Ų | 130 | 160.7 Ų | 160.7 | 80% | 0.798 | 80% | 0.795 | S | S | * | * | trans | -54 | 152.2 | 169.5 | -36 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 90 | E | 48.6 | Very low | 48.9 | Very low | 166 Ų | 166 | 158.8 Ų | 158.8 | 78% | 0.776 | 80% | 0.797 | S | S | * | * | trans | 84.9 | 92 | 175.4 | -57.3 | -62.3 | 147.9 | 0 | 0 | 116.8 | ||||
| 91 | S | 48.9 | Very low | 49 | Very low | 115 Ų | 115 | 161.6 Ų | 161.6 | 80% | 0.804 | 81% | 0.805 | S | S | * | * | trans | -178.3 | 31.6 | 147.8 | -83.7 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 92 | R | 56.6 | Low | 49.4 | Very low | 244 Ų | 244 | 158 Ų | 158 | 92% | 0.921 | 81% | 0.809 | S | S | * | * | trans | -95.8 | 24.2 | 179.6 | -69.1 | -156.1 | -66.9 | -172.4 | -3.1 | 116.2 | ||||
| 93 | Y | 56.5 | Low | 49.6 | Very low | 231 Ų | 231 | 155 Ų | 155 | 91% | 0.906 | 80% | 0.798 | S | S | * | * | S | Bend | trans | -123 | 38.5 | 172.3 | -80.9 | -77.7 | 0 | 0 | 0 | 113.4 | ||
| 94 | M | 55.2 | Low | 49.8 | Very low | 156 Ų | 156 | 153 Ų | 153 | 77% | 0.768 | 81% | 0.806 | S | S | * | * | S | Bend | trans | -130.3 | 107.9 | 168.2 | -77.2 | -79.1 | -108.3 | 0 | 0 | 109.4 | ||
| 95 | R | 54.8 | Low | 50.2 | Low | 234 Ų | 234 | 151.3 Ų | 151.3 | 88% | 0.883 | 81% | 0.807 | S | S | * | * | trans | 86.1 | 91.9 | 163.5 | -53.5 | 168.1 | -172.1 | -107.4 | -0.1 | 116.9 | ||||
| 96 | S | 52.2 | Low | 50.1 | Low | 87 Ų | 87 | 152.7 Ų | 152.7 | 61% | 0.608 | 82% | 0.816 | S | S | * | * | trans | -147.6 | 74.3 | 150.3 | -175.6 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 97 | W | 56.6 | Low | 50.2 | Low | 257 Ų | 257 | 153.4 Ų | 153.4 | 97% | 0.973 | 82% | 0.818 | S | S | * | * | S | Bend | trans | -122.2 | 11.6 | 166.1 | -74.5 | 105.7 | 0 | 0 | 0 | 111.6 | ||
| 98 | L | 60.2 | Low | 49.9 | Very low | 169 Ų | 169 | 153.3 Ų | 153.3 | 89% | 0.885 | 81% | 0.812 | S | S | * | * | trans | -136.9 | 76.6 | 178 | -72.9 | 167 | 0 | 0 | 0 | 108.7 | ||||
| 99 | E | 54.3 | Low | 49.8 | Very low | 147 Ų | 147 | 152.9 Ų | 152.9 | 69% | 0.687 | 81% | 0.807 | S | S | * | * | trans | -148.3 | 119.3 | 162 | -110.3 | 157.3 | -172.5 | 0 | 0 | 108.4 | I101 | E99-I101 PolarHBondContact O-N 2.95Š| ||
| 100 | P | 49.8 | Very low | 49.6 | Very low | 125 Ų | 125 | 157.8 Ų | 157.8 | 81% | 0.812 | 81% | 0.813 | S | S | * | * | trans | -79.7 | 104.5 | 169.9 | 30.4 | -25.9 | 0 | 0 | 0 | 107.7 | S102 | P100-S102 PolarHBondContact O-N 3.33Š| ||
| 101 | I | 50.2 | Low | 49.7 | Very low | 155 Ų | 155 | 155.6 Ų | 155.6 | 80% | 0.795 | 81% | 0.813 | S | S | * | * | trans | -75.4 | 97.6 | 173.6 | -59.6 | 174.9 | 0 | 0 | 0 | 108.1 | E99 G103 | E99-I101 PolarHBondContact O-N 2.95Å; I101-G103 PolarHBondContact O-N 3.45Å | ||
| 102 | S | 49.4 | Very low | 49.5 | Very low | 125 Ų | 125 | 153.5 Ų | 153.5 | 87% | 0.874 | 81% | 0.809 | S | S | * | * | trans | -64.9 | 117.8 | 151.1 | -77.1 | 0 | 0 | 0 | 0 | 108.1 | P100 | P100-S102 PolarHBondContact O-N 3.33Š| ||
| 103 | G | 41.7 | Very low | 48.7 | Very low | 60 Ų | 60 | 150.4 Ų | 150.4 | 62% | 0.619 | 81% | 0.811 | S | S | * | * | trans | -157.8 | 78.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | I101 | I101-G103 PolarHBondContact O-N 3.45Š| ||
| 104 | A | 46.3 | Very low | 47.8 | Very low | 102 Ų | 102 | 142.8 Ų | 142.8 | 84% | 0.843 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -70.8 | 122.2 | 164.5 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||
| 105 | V | 48.5 | Very low | 47.1 | Very low | 138 Ų | 138 | 145.8 Ų | 145.8 | 84% | 0.836 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -100.5 | 117.2 | 168.8 | -85.3 | 0 | 0 | 0 | 0 | 109 | ||
| 106 | P | 49.9 | Very low | 46.3 | Very low | 118 Ų | 118 | 141 Ų | 141 | 77% | 0.766 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -90.9 | 117.5 | 161.7 | 27.5 | -16.1 | 0 | 0 | 0 | 108.8 | ||
| 107 | F | 40 | Very low | 45.8 | Very low | 204 Ų | 204 | 147.2 Ų | 147.2 | 90% | 0.895 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -81.3 | 116.4 | 166.4 | -137.4 | -97 | 0 | 0 | 0 | 107.7 | ||
| 108 | H | 40.8 | Very low | 44.9 | Very low | 185 Ų | 185 | 138.3 Ų | 138.3 | 86% | 0.856 | 79% | 0.793 | S | S | * | * | trans | -132.5 | 128 | 169.4 | -107.8 | 45 | 0 | 0 | 0 | 110.1 | ||||
| 109 | G | 36.2 | Very low | 44 | Very low | 63 Ų | 63 | 138.1 Ų | 138.1 | 65% | 0.649 | 79% | 0.792 | S | S | * | * | trans | 91.3 | 98.4 | 141.2 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 110 | Y | 44.3 | Very low | 43.4 | Very low | 232 Ų | 232 | 140.6 Ų | 140.6 | 91% | 0.91 | 80% | 0.8 | S | S | * | * | -131.2 | 145.1 | 129.8 | -96.9 | -86.6 | 0 | 0 | 0 | 109.3 | |||||
| 111 | P | 51.3 | Low | 43.7 | Very low | 121 Ų | 121 | 139.5 Ų | 139.5 | 79% | 0.786 | 79% | 0.793 | S | S | * | * | trans | -88.4 | 157.6 | -159.6 | 35.5 | -31.4 | 0 | 0 | 0 | 112.5 | ||||
| 112 | G | 44 | Very low | 42.9 | Very low | 70 Ų | 70 | 139.6 Ų | 139.6 | 72% | 0.722 | 80% | 0.796 | S | S | * | * | trans | -91.3 | 173.7 | 170.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 113 | N | 41.3 | Very low | 42.4 | Very low | 179 Ų | 179 | 136.9 Ų | 136.9 | 96% | 0.957 | 78% | 0.781 | S | S | * | * | trans | 85.4 | 127.6 | 160.3 | -82.5 | 8.5 | 0 | 0 | 0 | 120.2 | ||||
| 114 | G | 36 | Very low | 42.1 | Very low | 72 Ų | 72 | 143.2 Ų | 143.2 | 74% | 0.742 | 79% | 0.792 | S | S | * | * | trans | -176.1 | 14.7 | 169.2 | 0 | 0 | 0 | 0 | 0 | 123.8 | ||||
| 115 | R | 40.6 | Very low | 41.4 | Very low | 218 Ų | 218 | 146.7 Ų | 146.7 | 82% | 0.823 | 79% | 0.79 | S | S | * | * | trans | 77.6 | 149.8 | 154.1 | -55 | -160.6 | 171.9 | -135 | 3.1 | 124.3 | ||||
| 116 | H | 39.5 | Very low | 40.7 | Very low | 133 Ų | 133 | 147.4 Ų | 147.4 | 62% | 0.616 | 78% | 0.784 | S | S | * | * | trans | 77.5 | 132.1 | 146.8 | -74.7 | -65.6 | 0 | 0 | 0 | 118.4 | ||||
| 117 | Y | 40.3 | Very low | 40.2 | Very low | 219 Ų | 219 | 149 Ų | 149 | 86% | 0.859 | 78% | 0.781 | S | S | * | * | cis | -138.6 | 167.5 | 21.3 | -76.4 | -92.7 | 0 | 0 | 0 | 108.9 | ||||
| 118 | G | 37.4 | Very low | 40 | Very low | 70 Ų | 70 | 150 Ų | 150 | 72% | 0.722 | 78% | 0.779 | S | S | * | * | cis | 138 | 130.6 | 27.9 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 119 | L | 43 | Very low | 39.7 | Very low | 165 Ų | 165 | 145.8 Ų | 145.8 | 86% | 0.864 | 78% | 0.777 | S | S | * | * | trans | -57.5 | 150.4 | -169.3 | -67 | 136.1 | 0 | 0 | 0 | 116.2 | ||||
| 120 | K | 41.5 | Very low | 39.5 | Very low | 198 Ų | 198 | 145.9 Ų | 145.9 | 86% | 0.861 | 78% | 0.777 | S | S | * | * | -167.4 | 141.7 | 106.8 | -93.5 | -142.5 | 175 | 179.4 | 0 | 114.3 | |||||
| 121 | P | 55.3 | Low | 39.1 | Very low | 103 Ų | 103 | 143.9 Ų | 143.9 | 67% | 0.669 | 78% | 0.776 | S | S | * | * | trans | -93.6 | 143.1 | 161.7 | 36.1 | -27.1 | 0 | 0 | 0 | 110.1 | ||||
| 122 | D | 33.7 | Very low | 38.3 | Very low | 157 Ų | 157 | 143.3 Ų | 143.3 | 84% | 0.84 | 77% | 0.774 | S | S | * | * | trans | -160.7 | 154.9 | 147.9 | -129.6 | -44.3 | 0 | 0 | 0 | 112.5 | ||||
| 123 | A | 39.4 | Very low | 38 | Very low | 68 Ų | 68 | 147.6 Ų | 147.6 | 56% | 0.562 | 78% | 0.779 | S | S | * | * | trans | -97.7 | -174.9 | -155.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 124 | F | 34.1 | Very low | 37.6 | Very low | 193 Ų | 193 | 144.9 Ų | 144.9 | 85% | 0.846 | 78% | 0.775 | S | S | * | * | trans | 82.2 | 133.9 | 170.8 | -53.9 | -84.3 | 0 | 0 | 0 | 114.4 | ||||
| 125 | Q | 33 | Very low | 37.8 | Very low | 174 Ų | 174 | 147.3 Ų | 147.3 | 81% | 0.813 | 78% | 0.78 | S | S | * | * | cis | -158.3 | 149.8 | 28.4 | -159 | 166.4 | -12.7 | 0 | 0 | 112.3 | ||||
| 126 | E | 32.4 | Very low | 37.9 | Very low | 153 Ų | 153 | 141.4 Ų | 141.4 | 72% | 0.715 | 78% | 0.778 | S | S | * | * | trans | -58.4 | 146.4 | 176.5 | -167.8 | -175.9 | 179.9 | 0 | 0 | 115.2 | ||||
| 127 | H | 39.7 | Very low | 37.7 | Very low | 152 Ų | 152 | 138.3 Ų | 138.3 | 70% | 0.704 | 78% | 0.782 | S | S | * | * | -174 | 114.4 | 125 | -90.9 | -55 | 0 | 0 | 0 | 112.5 | |||||
| 128 | R | 36.2 | Very low | 37.6 | Very low | 225 Ų | 225 | 139 Ų | 139 | 85% | 0.849 | 78% | 0.783 | S | S | * | * | trans | 42 | 144.1 | 134.3 | -76.4 | -176.7 | -179.1 | 171.3 | -0.6 | 119.6 | ||||
| 129 | A | 34.8 | Very low | 37.5 | Very low | 97 Ų | 97 | 141.8 Ų | 141.8 | 80% | 0.802 | 79% | 0.786 | S | S | * | * | cis | -166.3 | 148.2 | 5.8 | 0 | 0 | 0 | 0 | 0 | 103.5 | ||||
| 130 | G | 31.9 | Very low | 37.3 | Very low | 64 Ų | 64 | 143.6 Ų | 143.6 | 66% | 0.66 | 78% | 0.782 | S | S | * | * | 136.8 | 151.5 | 61.5 | 0 | 0 | 0 | 0 | 0 | 106.8 | |||||
| 131 | E | 36.3 | Very low | 37.8 | Very low | 191 Ų | 191 | 139.8 Ų | 139.8 | 89% | 0.893 | 78% | 0.778 | S | S | * | * | trans | 79.4 | 130.5 | 171 | -48 | -176.6 | 177.3 | 0 | 0 | 116.4 | ||||
| 132 | C | 34.3 | Very low | 36.7 | Very low | 108 Ų | 108 | 140.4 Ų | 140.4 | 73% | 0.73 | 78% | 0.776 | S | S | * | * | cis | -165.8 | 137.5 | -14.9 | -114.7 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 133 | L | 37 | Very low | 37.1 | Very low | 160 Ų | 160 | 144 Ų | 144 | 84% | 0.838 | 78% | 0.779 | S | S | * | * | trans | 63.6 | 101.5 | 143.2 | -56.3 | 168.6 | 0 | 0 | 0 | 120.7 | ||||
| 134 | S | 33.9 | Very low | 37.4 | Very low | 123 Ų | 123 | 147.8 Ų | 147.8 | 86% | 0.86 | 79% | 0.789 | S | S | * | * | trans | -59.9 | 139.3 | 135.1 | -80.4 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 135 | S | 39.5 | Very low | 37.5 | Very low | 123 Ų | 123 | 147.6 Ų | 147.6 | 86% | 0.86 | 78% | 0.784 | S | S | * | * | trans | -139.4 | 121.2 | 152.1 | -159.4 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 136 | A | 42.4 | Very low | 37.5 | Very low | 94 Ų | 94 | 144.6 Ų | 144.6 | 78% | 0.777 | 78% | 0.781 | S | S | * | * | trans | -80 | 145.4 | 173.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 137 | G | 35.8 | Very low | 37.7 | Very low | 67 Ų | 67 | 141.4 Ų | 141.4 | 69% | 0.691 | 78% | 0.776 | S | S | * | * | trans | 76.2 | 128.7 | 146.2 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 138 | R | 36.9 | Very low | 37.5 | Very low | 234 Ų | 234 | 139.3 Ų | 139.3 | 88% | 0.883 | 78% | 0.778 | S | S | * | * | 162 | 120.6 | 123.6 | -84 | -74.4 | -165.9 | -117.7 | -2.4 | 110.6 | |||||
| 139 | T | 35.6 | Very low | 37.4 | Very low | 128 Ų | 128 | 134.3 Ų | 134.3 | 79% | 0.785 | 77% | 0.773 | S | S | * | * | trans | 53.8 | 125 | 138.7 | 42.5 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 140 | Y | 38.9 | Very low | 37.6 | Very low | 203 Ų | 203 | 136 Ų | 136 | 80% | 0.796 | 77% | 0.768 | S | S | * | * | trans | -34 | 149.9 | 151.6 | -112.9 | -108.8 | 0 | 0 | 0 | 113.9 | ||||
| 141 | P | 52.2 | Low | 37.9 | Very low | 119 Ų | 119 | 141.9 Ų | 141.9 | 77% | 0.773 | 78% | 0.781 | S | S | * | * | -146.9 | 168 | 76.4 | 35.3 | -14.7 | 0 | 0 | 0 | 117.4 | |||||
| 142 | D | 33.4 | Very low | 38.1 | Very low | 115 Ų | 115 | 143.4 Ų | 143.4 | 62% | 0.615 | 78% | 0.778 | S | S | * | * | trans | -45.5 | 143.8 | 169.7 | -77.9 | -55.9 | 0 | 0 | 0 | 115.2 | ||||
| 143 | Y | 41 | Very low | 38.1 | Very low | 234 Ų | 234 | 143.8 Ų | 143.8 | 92% | 0.918 | 77% | 0.773 | S | S | * | * | trans | -128.8 | 106 | 147.1 | -111.4 | -85.4 | 0 | 0 | 0 | 109.7 | ||||
| 144 | L | 46.4 | Very low | 38.1 | Very low | 146 Ų | 146 | 144.7 Ų | 144.7 | 76% | 0.764 | 77% | 0.77 | S | S | * | * | trans | -75.6 | 157.6 | 163.1 | -77.6 | 160.7 | 0 | 0 | 0 | 110.6 | ||||
| 145 | Y | 36.1 | Very low | 38.2 | Very low | 190 Ų | 190 | 145 Ų | 145 | 75% | 0.745 | 77% | 0.767 | S | S | * | * | trans | 100.2 | 110.9 | 139.9 | -150.3 | -103.8 | 0 | 0 | 0 | 119.2 | ||||
| 146 | C | 31.7 | Very low | 38.8 | Very low | 111 Ų | 111 | 144.6 Ų | 144.6 | 75% | 0.75 | 76% | 0.762 | S | S | * | * | -160.6 | 130.8 | 89.4 | -158.8 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 147 | S | 36.4 | Very low | 38.3 | Very low | 86 Ų | 86 | 149.7 Ų | 149.7 | 60% | 0.601 | 77% | 0.769 | S | S | * | * | trans | -88.8 | 164.1 | 175 | -68.3 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 148 | S | 37.3 | Very low | 38 | Very low | 108 Ų | 108 | 153.2 Ų | 153.2 | 76% | 0.755 | 77% | 0.772 | S | S | * | * | -179.3 | 139.4 | 123.1 | -80.3 | 0 | 0 | 0 | 0 | 108.4 | |||||
| 149 | T | 34.1 | Very low | 37.9 | Very low | 120 Ų | 120 | 147.9 Ų | 147.9 | 74% | 0.736 | 77% | 0.766 | S | S | * | * | -154.4 | 142.3 | 57.4 | 45 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 150 | D | 38.7 | Very low | 38.2 | Very low | 132 Ų | 132 | 147.4 Ų | 147.4 | 71% | 0.706 | 77% | 0.765 | S | S | * | * | trans | 58.9 | 114.9 | 142.9 | -67 | -66.3 | 0 | 0 | 0 | 122.6 | ||||
| 151 | M | 38.3 | Very low | 37.8 | Very low | 188 Ų | 188 | 142.6 Ų | 142.6 | 93% | 0.926 | 76% | 0.761 | S | S | * | * | -161.4 | 137.3 | 116.4 | -89.1 | -53 | 120.6 | 0 | 0 | 110 | |||||
| 152 | R | 39.9 | Very low | 37.5 | Very low | 222 Ų | 222 | 142.3 Ų | 142.3 | 84% | 0.838 | 76% | 0.759 | S | S | * | * | trans | -110.6 | 140.3 | -165.6 | -170.5 | 175.3 | -162.5 | -159.9 | 10.5 | 113.7 | ||||
| 153 | D | 33.4 | Very low | 37.4 | Very low | 116 Ų | 116 | 145.4 Ų | 145.4 | 62% | 0.62 | 77% | 0.77 | S | S | * | * | trans | 45.5 | 121.3 | 154 | -77.9 | -73.7 | 0 | 0 | 0 | 126.2 | ||||
| 154 | K | 37.6 | Very low | 37.4 | Very low | 179 Ų | 179 | 140.1 Ų | 140.1 | 78% | 0.778 | 77% | 0.767 | S | S | * | * | 30.5 | 143.4 | 112.4 | -105.7 | 97.3 | 165.3 | -171 | 0 | 119.3 | |||||
| 155 | T | 37.1 | Very low | 37 | Very low | 129 Ų | 129 | 141.7 Ų | 141.7 | 79% | 0.791 | 77% | 0.771 | S | S | * | * | cis | -173.5 | -179.7 | 26.2 | -4.4 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 156 | P | 51.2 | Low | 37 | Very low | 115 Ų | 115 | 139.4 Ų | 139.4 | 75% | 0.747 | 77% | 0.77 | S | S | * | * | trans | -101.7 | 167.2 | -151.2 | 41.4 | -38.1 | 0 | 0 | 0 | 117.2 | ||||
| 157 | Q | 32.2 | Very low | 37.4 | Very low | 201 Ų | 201 | 141.4 Ų | 141.4 | 94% | 0.939 | 77% | 0.773 | S | S | * | * | trans | -154.2 | 154.8 | 159.5 | -156.4 | 166.7 | -25.1 | 0 | 0 | 114.4 | ||||
| 158 | N | 30 | Very low | 37.4 | Very low | 141 Ų | 141 | 142.2 Ų | 142.2 | 75% | 0.754 | 79% | 0.785 | S | S | * | * | trans | -90.1 | 136 | -159.9 | -169.2 | -92.7 | 0 | 0 | 0 | 114 | ||||
| 159 | V | 34.8 | Very low | 37.4 | Very low | 122 Ų | 122 | 142.6 Ų | 142.6 | 74% | 0.739 | 79% | 0.788 | S | S | * | * | trans | 25.7 | 165.2 | 156.4 | -78.7 | 0 | 0 | 0 | 0 | 124.1 | ||||
| 160 | P | 41.5 | Very low | 37.5 | Very low | 119 Ų | 119 | 140.3 Ų | 140.3 | 77% | 0.773 | 79% | 0.788 | S | S | * | * | cis | -133.1 | 176.5 | 1.7 | 29.5 | -5.5 | 0 | 0 | 0 | 117.7 | ||||
| 161 | S | 30.7 | Very low | 37.5 | Very low | 102 Ų | 102 | 143.5 Ų | 143.5 | 71% | 0.713 | 80% | 0.795 | S | S | * | * | trans | -23.1 | 158.9 | 159.8 | -141.9 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 162 | P | 45.3 | Very low | 37.3 | Very low | 112 Ų | 112 | 143.5 Ų | 143.5 | 73% | 0.727 | 79% | 0.793 | S | S | * | * | -142.7 | 138 | 76.7 | 32.5 | -11.8 | 0 | 0 | 0 | 117.4 | |||||
| 163 | E | 32.1 | Very low | 37.3 | Very low | 180 Ų | 180 | 142 Ų | 142 | 84% | 0.841 | 79% | 0.793 | S | S | * | * | 56.2 | 114.5 | 128.1 | -54.6 | -179.8 | -156.5 | 0 | 0 | 122 | |||||
| 164 | S | 39.9 | Very low | 37.7 | Very low | 124 Ų | 124 | 145.8 Ų | 145.8 | 87% | 0.867 | 81% | 0.806 | S | S | * | * | trans | -153.4 | 97.3 | 134.6 | 62.2 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 165 | E | 38.8 | Very low | 37.9 | Very low | 179 Ų | 179 | 145.8 Ų | 145.8 | 84% | 0.836 | 81% | 0.809 | S | S | * | * | trans | -77.5 | 136.8 | 160.8 | -65.8 | -159.4 | 149.8 | 0 | 0 | 109.8 | ||||
| 166 | L | 35.6 | Very low | 38.4 | Very low | 141 Ų | 141 | 148.5 Ų | 148.5 | 74% | 0.738 | 81% | 0.81 | S | S | * | * | 174.3 | 119 | 109.4 | -111 | 113.2 | 0 | 0 | 0 | 112.2 | |||||
| 167 | L | 39.5 | Very low | 38.3 | Very low | 154 Ų | 154 | 147.5 Ų | 147.5 | 81% | 0.806 | 80% | 0.804 | S | S | * | * | trans | 48.1 | 120.4 | 135.8 | -49.3 | -176.2 | 0 | 0 | 0 | 120.6 | ||||
| 168 | A | 37.8 | Very low | 39.5 | Very low | 103 Ų | 103 | 147.1 Ų | 147.1 | 85% | 0.851 | 80% | 0.802 | S | S | * | * | -178.1 | 135.1 | 99.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 169 | S | 37.8 | Very low | 40.7 | Very low | 116 Ų | 116 | 145 Ų | 145 | 81% | 0.811 | 79% | 0.79 | S | S | * | * | trans | -61.8 | 133 | 178.5 | -169.2 | 0 | 0 | 0 | 0 | 113 | ||||
| 170 | G | 35.5 | Very low | 42 | Very low | 72 Ų | 72 | 143.7 Ų | 143.7 | 74% | 0.742 | 78% | 0.779 | S | S | * | * | trans | -134.3 | 85.5 | 168.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | H172 | G170-H172 PolarHBondContact O-N 3.47Š| ||
| 171 | K | 37.9 | Very low | 43.2 | Very low | 198 Ų | 198 | 144.1 Ų | 144.1 | 86% | 0.861 | 78% | 0.781 | S | S | * | * | trans | -61 | 98.5 | 166.5 | -77.3 | 179.4 | 173.4 | 176.7 | 0 | 109 | K173 | K171-K173 PolarHBondContact O-N 3.43Š| ||
| 172 | H | 35.5 | Very low | 44.8 | Very low | 189 Ų | 189 | 145.8 Ų | 145.8 | 88% | 0.875 | 78% | 0.782 | S | S | * | * | trans | -89.8 | 103.1 | 161.6 | -126 | -99.6 | 0 | 0 | 0 | 108.2 | G170 E174 | G170-H172 PolarHBondContact O-N 3.47Å; H172-E174 PolarHBondContact O-N 3.19Å | ||
| 173 | K | 38.9 | Very low | 46.1 | Very low | 191 Ų | 191 | 144 Ų | 144 | 83% | 0.83 | 77% | 0.767 | S | S | * | * | trans | -58.4 | 115.1 | 170.5 | -148.4 | 177.2 | -179.5 | -170.9 | 0 | 107 | K171 E175 | K171-K173 PolarHBondContact O-N 3.43Å; K173-E175 VanDerWaalsContact C-N 3.33Å; K173-E175 PolarHBondContact O-N 3.02Å | ||
| 174 | E | 42.1 | Very low | 47.7 | Very low | 194 Ų | 194 | 139.7 Ų | 139.7 | 91% | 0.907 | 75% | 0.754 | S | S | * | * | trans | -62.6 | 98.4 | 163.6 | -89.7 | -172.4 | 139.2 | 0 | 0 | 107.5 | H172 K176 | H172-E174 PolarHBondContact O-N 3.19Å; E174-K176 PolarHBondContact O-N 3.13Å | ||
| 175 | E | 41.7 | Very low | 48.6 | Very low | 179 Ų | 179 | 138 Ų | 138 | 84% | 0.836 | 74% | 0.738 | S | S | * | * | trans | -90 | 94.5 | 162.2 | -146.8 | -176.1 | -177.9 | 0 | 0 | 107 | K173 P177 | K173-E175 VanDerWaalsContact C-N 3.33Å; K173-E175 PolarHBondContact O-N 3.02Å; E175-P177 VanDerWaalsContact O-CD 3.23Å; E175-P177 WeakPolarHBondContact O-CD 3.42Å | ||
| 176 | K | 48.2 | Very low | 49.8 | Very low | 186 Ų | 186 | 130 Ų | 130 | 81% | 0.809 | 70% | 0.704 | S | S | * | * | trans | -65.6 | 110.6 | 165.7 | -176.9 | -179.6 | -179.4 | -177.6 | 0 | 106.3 | E174 E178 | E174-K176 PolarHBondContact O-N 3.13Å; K176-E178 PolarHBondContact O-N 3.32Å | ||
| 177 | P | 49.3 | Very low | 51.1 | Low | 95 Ų | 95 | 129.1 Ų | 129.1 | 62% | 0.617 | 70% | 0.699 | S | S | * | * | trans | -67 | 115 | 172.5 | 1.2 | 13.2 | 0 | 0 | 0 | 106.3 | E175 L179 | E175-P177 VanDerWaalsContact O-CD 3.23Å; E175-P177 WeakPolarHBondContact O-CD 3.42Å; P177-L179 VanDerWaalsContact C-N 3.26Å; P177-L179 HydrophobicContact CB-CD2 4.14Å; P177-L179 HydrophobicContact CB-CG 4.38Å; P177-L179 PolarHBondContact O-N 3.28Å | ||
| 178 | E | 55.5 | Low | 52.2 | Low | 193 Ų | 193 | 130.8 Ų | 130.8 | 90% | 0.902 | 70% | 0.695 | S | S | * | * | trans | -65.1 | 92.5 | 167.9 | -170.7 | 175.8 | -176.4 | 0 | 0 | 107 | K176 D180 | K176-E178 PolarHBondContact O-N 3.32Å; E178-D180 PolarHBondContact O-N 3.34Å | ||
| 179 | L | 56.4 | Low | 53.7 | Low | 96 Ų | 96 | 131.2 Ų | 131.2 | 50% | 0.503 | 68% | 0.682 | S | S | . | * | trans | -78.9 | 114.1 | 179.3 | -64.4 | 176.7 | 0 | 0 | 0 | 108.4 | P177 H190 | P177-L179 VanDerWaalsContact C-N 3.26Å; P177-L179 HydrophobicContact CB-CD2 4.14Å; P177-L179 HydrophobicContact CB-CG 4.38Å; P177-L179 PolarHBondContact O-N 3.28Å; L179-H190 VanDerWaalsContact CD1-CE1 3.43Å; L179-H190 WeakPolarHBondContact CD1-CE1 3.42Å | ||
| 180 | D | 61.4 | Low | 55 | Low | 94 Ų | 94 | 129.8 Ų | 129.8 | 50% | 0.503 | 66% | 0.662 | S | S | . | * | trans | -46.2 | 119.4 | 172.1 | 178.2 | 1.7 | 0 | 0 | 0 | 110.8 | E178 N182 N183 | E178-D180 PolarHBondContact O-N 3.34Å; D180-N182 PolarHBondContact O-N 3.43Å; D180-N182 PolarHBondContact OD1-N 3.42Å; D180-N182 PolarHBondContact OD1-ND2 3.46Å; D180-N183 PolarHBondContact O-N 3.01Å; D180-N183 VanDerWaalsContact O-N 3.13Å | ||
| 181 | P | 66.3 | Low | 56.4 | Low | 128 Ų | 128 | 128.1 Ų | 128.1 | 83% | 0.831 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.4 | -16.4 | 178.3 | -25.5 | 33.8 | 0 | 0 | 0 | 114.8 | ||
| 182 | N | 65.7 | Low | 57.7 | Low | 138 Ų | 138 | 128.3 Ų | 128.3 | 74% | 0.738 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.2 | -0.3 | -178.6 | -67.6 | -71.2 | 0 | 0 | 0 | 114.8 | D180 P184 | D180-N182 PolarHBondContact O-N 3.43Å; D180-N182 PolarHBondContact OD1-N 3.42Å; D180-N182 PolarHBondContact OD1-ND2 3.46Å; N182-P184 VanDerWaalsContact O-CD 3.23Å; N182-P184 WeakPolarHBondContact O-CD 3.4Å |
| 183 | N | 71.6 | Confident | 59.3 | Low | 74 Ų | 74 | 124.2 Ų | 124.2 | 40% | 0.396 | 63% | 0.63 | S | S | . | * | trans | -79.9 | 112.1 | 178.8 | -173.5 | -17.2 | 0 | 0 | 0 | 111.4 | D180 V185 A186 | D180-N183 PolarHBondContact O-N 3.01Å; D180-N183 VanDerWaalsContact O-N 3.13Å; N183-V185 PolarHBondContact O-N 3.17Å; N183-V185 WeakPolarHBondContact OD1-CB 3.45Å; N183-V185 PolarHBondContact OD1-N 3.33Å; N183-A186 HydrophobicContact CB-CB 4.14Å; N183-A186 WeakPolarHBondContact O-CB 3.32Å; N183-A186 PolarHBondContact O-N 2.96Å | ||
| 184 | P | 65.3 | Low | 61 | Low | 89 Ų | 89 | 120.9 Ų | 120.9 | 58% | 0.578 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -61.5 | -34 | -179 | 25.8 | -34.1 | 0 | 0 | 0 | 111.7 | N182 A186 N187 W188 | N182-P184 VanDerWaalsContact O-CD 3.23Å; N182-P184 WeakPolarHBondContact O-CD 3.4Å; P184-A186 VanDerWaalsContact C-N 3.35Å; P184-A186 PolarHBondContact O-N 3Å; P184-N187 VanDerWaalsContact O-CB 3.28Å; P184-N187 WeakPolarHBondContact O-CB 3.31Å; P184-N187 PolarHBondContact O-N 3.07Å; P184-N187 VanDerWaalsContact O-N 3.07Å; P184-W188 PolarHBondContact O-N 2.96Å |
| 185 | V | 60.2 | Low | 62.8 | Low | 88 Ų | 88 | 119.3 Ų | 119.3 | 53% | 0.533 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -67 | -36.6 | -178.1 | -178.2 | 0 | 0 | 0 | 0 | 111.7 | N183 N187 W188 I189 | N183-V185 PolarHBondContact O-N 3.17Å; N183-V185 WeakPolarHBondContact OD1-CB 3.45Å; N183-V185 PolarHBondContact OD1-N 3.33Å; V185-N187 PolarHBondContact O-N 3.38Å; V185-W188 PolarHBondContact O-N 2.95Å; V185-W188 VanDerWaalsContact O-N 3.09Å; V185-I189 HydrophobicContact CG1-CD1 4.12Å; V185-I189 PolarHBondContact O-N 2.88Å |
| 186 | A | 63.1 | Low | 64.8 | Low | 13 Ų | 13 | 119.9 Ų | 119.9 | 11% | 0.107 | 61% | 0.611 | C | S | . | * | H | α-helix | trans | -56.6 | -41.7 | 173.1 | 0 | 0 | 0 | 0 | 0 | 109.5 | N183 P184 W188 I189 H190 | N183-A186 HydrophobicContact CB-CB 4.14Å; N183-A186 WeakPolarHBondContact O-CB 3.32Å; N183-A186 PolarHBondContact O-N 2.96Å; P184-A186 VanDerWaalsContact C-N 3.35Å; P184-A186 PolarHBondContact O-N 3Å; A186-W188 VanDerWaalsContact C-N 3.3Å; A186-W188 PolarHBondContact O-N 3.37Å; A186-I189 PolarHBondContact O-N 2.87Å; A186-H190 VanDerWaalsContact C-ND1 3.3Å; A186-H190 WeakPolarHBondContact O-CB 3.37Å; A186-H190 PolarHBondContact O-N 3.29Å; A186-H190 PolarHBondContact O-ND1 3.07Å |
| 187 | N | 62.5 | Low | 66.6 | Low | 121 Ų | 121 | 119.9 Ų | 119.9 | 65% | 0.647 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -63.3 | -31.5 | 179.4 | -125.9 | 5.1 | 0 | 0 | 0 | 113.3 | P184 V185 A191 | P184-N187 VanDerWaalsContact O-CB 3.28Å; P184-N187 WeakPolarHBondContact O-CB 3.31Å; P184-N187 PolarHBondContact O-N 3.07Å; P184-N187 VanDerWaalsContact O-N 3.07Å; V185-N187 PolarHBondContact O-N 3.38Å; N187-A191 WeakPolarHBondContact O-CB 3.3Å; N187-A191 PolarHBondContact O-N 3.05Å |
| 188 | W | 64.4 | Low | 68.7 | Low | 190 Ų | 190 | 125.3 Ų | 125.3 | 72% | 0.72 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -74.5 | -35.7 | 176.1 | -72.2 | 72.5 | 0 | 0 | 0 | 113 | P184 V185 A186 R192 | P184-W188 PolarHBondContact O-N 2.96Å; V185-W188 PolarHBondContact O-N 2.95Å; V185-W188 VanDerWaalsContact O-N 3.09Å; A186-W188 VanDerWaalsContact C-N 3.3Å; A186-W188 PolarHBondContact O-N 3.37Å; W188-R192 WeakPolarHBondContact O-CB 3.33Å; W188-R192 PolarHBondContact O-N 3.28Å |
| 189 | I | 67.3 | Low | 70.5 | Confident | 112 Ų | 112 | 121 Ų | 121 | 57% | 0.574 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -71.1 | -44.8 | 176.8 | -61.4 | 172.6 | 0 | 0 | 0 | 109.3 | V185 A186 R192 S193 | V185-I189 HydrophobicContact CG1-CD1 4.12Å; V185-I189 PolarHBondContact O-N 2.88Å; A186-I189 PolarHBondContact O-N 2.87Å; I189-R192 PolarHBondContact O-N 2.97Å; I189-S193 PolarHBondContact O-N 3.4Å; I189-S193 VanDerWaalsContact O-N 3.11Å |
| 190 | H | 66.1 | Low | 72.4 | Confident | 85 Ų | 85 | 122.3 Ų | 122.3 | 39% | 0.394 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -67.8 | -35.7 | 175.2 | -64.5 | 105.6 | 0 | 0 | 0 | 113.1 | L179 A186 R192 S193 T194 | L179-H190 VanDerWaalsContact CD1-CE1 3.43Å; L179-H190 WeakPolarHBondContact CD1-CE1 3.42Å; A186-H190 VanDerWaalsContact C-ND1 3.3Å; A186-H190 WeakPolarHBondContact O-CB 3.37Å; A186-H190 PolarHBondContact O-N 3.29Å; A186-H190 PolarHBondContact O-ND1 3.07Å; H190-R192 PolarHBondContact O-N 3.41Å; H190-S193 PolarHBondContact O-N 2.87Å; H190-T194 PolarHBondContact O-N 3.16Å; H190-T194 PolarHBondContact O-OG1 3.48Å |
| 191 | A | 64.6 | Low | 74.1 | Confident | 38 Ų | 38 | 121.2 Ų | 121.2 | 31% | 0.314 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -69.8 | -17.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | N187 R195 | N187-A191 WeakPolarHBondContact O-CB 3.3Å; N187-A191 PolarHBondContact O-N 3.05Å; A191-R195 VanDerWaalsContact O-CB 3.31Å; A191-R195 WeakPolarHBondContact O-CB 3.15Å; A191-R195 PolarHBondContact O-NE 3.08Å |
| 192 | R | 65.9 | Low | 75.7 | Confident | 202 Ų | 202 | 118.8 Ų | 118.8 | 76% | 0.762 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -89 | -35.6 | 174.2 | -153.9 | -179.8 | -64.7 | -168.3 | 1 | 111.3 | W188 I189 H190 | W188-R192 WeakPolarHBondContact O-CB 3.33Å; W188-R192 PolarHBondContact O-N 3.28Å; I189-R192 PolarHBondContact O-N 2.97Å; H190-R192 PolarHBondContact O-N 3.41Å |
| 193 | S | 68.8 | Low | 77.2 | Confident | 103 Ų | 103 | 121 Ų | 121 | 72% | 0.72 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -74.8 | -39.8 | 179.9 | -171.1 | 0 | 0 | 0 | 0 | 113.4 | I189 H190 | I189-S193 PolarHBondContact O-N 3.4Å; I189-S193 VanDerWaalsContact O-N 3.11Å; H190-S193 PolarHBondContact O-N 2.87Å |
| 194 | T | 75.1 | Confident | 78.5 | Confident | 121 Ų | 121 | 123.6 Ų | 123.6 | 74% | 0.742 | 60% | 0.604 | S | S | * | * | S | Bend | trans | -86.7 | -7.2 | -177.3 | 56.3 | 0 | 0 | 0 | 0 | 114.5 | H190 | H190-T194 PolarHBondContact O-N 3.16Å; H190-T194 PolarHBondContact O-OG1 3.48Å |
| 195 | R | 79.8 | Confident | 80.1 | Confident | 160 Ų | 160 | 120.7 Ų | 120.7 | 60% | 0.604 | 58% | 0.583 | S | S | * | * | S | Bend | trans | -86.2 | 127.7 | -176.6 | -169.6 | -174.7 | -57.5 | -151.7 | 1.7 | 110.2 | A191 K197 | A191-R195 VanDerWaalsContact O-CB 3.31Å; A191-R195 WeakPolarHBondContact O-CB 3.15Å; A191-R195 PolarHBondContact O-NE 3.08Å; R195-K197 PolarHBondContact O-N 2.99Å |
| 196 | K | 82.8 | Confident | 81.9 | Confident | 191 Ų | 191 | 118.7 Ų | 118.7 | 83% | 0.83 | 57% | 0.571 | S | S | * | * | P | Polyproline II helix | trans | -46 | 127 | 173.6 | -175.1 | 149.6 | 169.3 | 166 | 0 | 110.9 | R198 | K196-R198 PolarHBondContact O-N 3Š|
| 197 | K | 87.6 | Confident | 83.6 | Confident | 186 Ų | 186 | 123.3 Ų | 123.3 | 81% | 0.809 | 59% | 0.593 | S | S | * | * | P | Polyproline II helix | trans | -49.8 | 134 | 177.9 | -175.6 | 178.2 | 179.6 | -179.2 | 0 | 109.4 | R195 C199 | R195-K197 PolarHBondContact O-N 2.99Å; K197-C199 PolarHBondContact O-N 2.94Å |
| 198 | R | 91.9 | Very high | 85.4 | Confident | 209 Ų | 209 | 119.6 Ų | 119.6 | 79% | 0.789 | 57% | 0.571 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 131 | 176.6 | -69.9 | -174.9 | 174 | -173.8 | -0.8 | 109.5 | K196 | K196-R198 PolarHBondContact O-N 3Š|
| 199 | C | 93.4 | Very high | 87 | Confident | 102 Ų | 102 | 110.5 Ų | 110.5 | 69% | 0.689 | 54% | 0.537 | S | S | * | . | P | Polyproline II helix | trans | -103.2 | 120.6 | 168.5 | -59.6 | 0 | 0 | 0 | 0 | 107.6 | K197 | K197-C199 PolarHBondContact O-N 2.94Š|
| 200 | P | 96.6 | Very high | 88.5 | Confident | 125 Ų | 125 | 108.9 Ų | 108.9 | 81% | 0.812 | 53% | 0.527 | S | S | * | . | P | Polyproline II helix | trans | -65.9 | 148.9 | 173.5 | 29 | -33.3 | 0 | 0 | 0 | 110.1 | ||
| 201 | Y | 98.4 | Very high | 90 | Very high | 71 Ų | 71 | 110.2 Ų | 110.2 | 28% | 0.278 | 53% | 0.532 | S | S | . | . | P | Polyproline II helix | trans | -75.4 | 148.9 | 172.5 | -58.9 | -38.7 | 0 | 0 | 0 | 110.4 | L209 L233 Q237 W241 | Y201-L209 HydrophobicContact CD2-CD1 4.39Å; Y201-L233 HydrophobicContact CD1-CD1 4.4Å; Y201-L233 HydrophobicContact CD1-CD2 3.97Å; Y201-L233 HydrophobicContact CE1-CD1 4.28Å; Y201-L233 HydrophobicContact CE1-CD2 3.78Å; Y201-Q237 WeakPolarHBondContact OH-CB 3.49Å; Y201-W241 AromaticContact CD2-CD1 3.81Å; Y201-W241 HydrophobicContact CE2-CB 4.4Å; Y201-W241 AromaticContact CE2-CD1 3.62Å; Y201-W241 HydrophobicContact CE2-CG 4.34Å |
| 202 | T | 98.7 | Very high | 91.7 | Very high | 76 Ų | 76 | 109.2 Ų | 109.2 | 47% | 0.466 | 52% | 0.52 | S | S | . | . | P | Polyproline II helix | trans | -68.2 | 164.5 | 175 | 70.8 | 0 | 0 | 0 | 0 | 110.6 | Y204 Q205 T206 | T202-Y204 VanDerWaalsContact C-N 3.32Å; T202-Y204 PolarHBondContact O-N 2.91Å; T202-Q205 PolarHBondContact O-N 3.2Å; T202-Q205 VanDerWaalsContact OG1-CG 3.3Å; T202-Q205 WeakPolarHBondContact OG1-CG 3.16Å; T202-Q205 PolarHBondContact OG1-N 2.83Å; T202-T206 PolarHBondContact O-N 3.47Å; T202-T206 PolarHBondContact O-OG1 2.86Å |
| 203 | K | 98.4 | Very high | 93.2 | Very high | 185 Ų | 185 | 99.8 Ų | 99.8 | 80% | 0.804 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -57.8 | -46.8 | 174.8 | -67.3 | -174.9 | 179.4 | -178.9 | 0 | 111.1 | Q205 T206 L207 | K203-Q205 PolarHBondContact O-N 3.42Å; K203-T206 PolarHBondContact O-N 3.1Å; K203-L207 WeakPolarHBondContact O-CG 3.32Å; K203-L207 PolarHBondContact O-N 3.47Å |
| 204 | Y | 98.5 | Very high | 94.6 | Very high | 129 Ų | 129 | 101.6 Ų | 101.6 | 51% | 0.506 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -57.6 | -48.4 | 176.7 | 174.4 | -104.1 | 0 | 0 | 0 | 112.5 | T202 T206 L207 E208 L231 | T202-Y204 VanDerWaalsContact C-N 3.32Å; T202-Y204 PolarHBondContact O-N 2.91Å; Y204-T206 VanDerWaalsContact C-N 3.28Å; Y204-T206 PolarHBondContact O-N 3.08Å; Y204-L207 PolarHBondContact O-N 3.27Å; Y204-E208 HydrophobicContact CD2-CG 4.31Å; Y204-E208 HydrophobicContact CE1-CG 4.29Å; Y204-E208 HydrophobicContact CE2-CG 3.75Å; Y204-E208 PolarHBondContact O-N 2.99Å; Y204-L231 HydrophobicContact CD1-CD2 4.31Å; Y204-L231 HydrophobicContact CE1-CD2 3.76Å |
| 205 | Q | 98.7 | Very high | 95.7 | Very high | 28 Ų | 28 | 103.7 Ų | 103.7 | 13% | 0.131 | 49% | 0.485 | C | S | . | . | H | α-helix | trans | -58.4 | -42.1 | 177.2 | -74.5 | 173.6 | -28.3 | 0 | 0 | 111.9 | T202 K203 L209 L231 | T202-Q205 PolarHBondContact O-N 3.2Å; T202-Q205 VanDerWaalsContact OG1-CG 3.3Å; T202-Q205 WeakPolarHBondContact OG1-CG 3.16Å; T202-Q205 PolarHBondContact OG1-N 2.83Å; K203-Q205 PolarHBondContact O-N 3.42Å; Q205-L209 WeakPolarHBondContact O-CB 3.37Å; Q205-L209 WeakPolarHBondContact O-CD1 3.42Å; Q205-L209 WeakPolarHBondContact O-CG 3.36Å; Q205-L209 PolarHBondContact O-N 3.27Å; Q205-L209 VanDerWaalsContact O-N 3.07Å; Q205-L231 HydrophobicContact CG-CB 4.34Å; Q205-L231 PolarHBondContact NE2-O 3Å |
| 206 | T | 98.6 | Very high | 96.6 | Very high | 46 Ų | 46 | 99.5 Ų | 99.5 | 28% | 0.282 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -65.2 | -44.8 | 179.2 | -54.9 | 0 | 0 | 0 | 0 | 111.4 | T202 K203 Y204 L209 E210 | T202-T206 PolarHBondContact O-N 3.47Å; T202-T206 PolarHBondContact O-OG1 2.86Å; K203-T206 PolarHBondContact O-N 3.1Å; Y204-T206 VanDerWaalsContact C-N 3.28Å; Y204-T206 PolarHBondContact O-N 3.08Å; T206-L209 PolarHBondContact O-N 3.08Å; T206-E210 WeakPolarHBondContact O-CG 3.36Å; T206-E210 PolarHBondContact O-N 2.99Å |
| 207 | L | 98.6 | Very high | 97.3 | Very high | 110 Ų | 110 | 93.3 Ų | 93.3 | 58% | 0.576 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -62.9 | -46.7 | 179.8 | -72 | 173.4 | 0 | 0 | 0 | 112.4 | K203 Y204 L209 E210 K211 | K203-L207 WeakPolarHBondContact O-CG 3.32Å; K203-L207 PolarHBondContact O-N 3.47Å; Y204-L207 PolarHBondContact O-N 3.27Å; L207-L209 VanDerWaalsContact C-N 3.34Å; L207-L209 PolarHBondContact O-N 3.49Å; L207-E210 PolarHBondContact O-N 3.05Å; L207-K211 WeakPolarHBondContact O-CB 3.32Å; L207-K211 PolarHBondContact O-N 2.78Å |
| 208 | E | 98.6 | Very high | 97.8 | Very high | 42 Ų | 42 | 91 Ų | 91 | 20% | 0.196 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -66.1 | -37.6 | 178.1 | -73.5 | -59.7 | 124.9 | 0 | 0 | 111.8 | Y204 E210 K211 E212 L231 | Y204-E208 HydrophobicContact CD2-CG 4.31Å; Y204-E208 HydrophobicContact CE1-CG 4.29Å; Y204-E208 HydrophobicContact CE2-CG 3.75Å; Y204-E208 PolarHBondContact O-N 2.99Å; E208-E210 VanDerWaalsContact C-N 3.32Å; E208-E210 PolarHBondContact O-N 3.4Å; E208-K211 PolarHBondContact O-N 3.22Å; E208-K211 IonicContact OE1-NZ 3.42Å; E208-K211 PolarHBondContact OE1-NZ 3.37Å; E208-K211 IonicContact OE2-NZ 2.93Å; E208-K211 PolarHBondContact OE2-NZ 2.86Å; E208-E212 WeakPolarHBondContact O-CG 3.35Å; E208-E212 PolarHBondContact O-N 3.41Å; E208-L231 HydrophobicContact CB-CD1 4.07Å; E208-L231 HydrophobicContact CB-CD2 3.56Å; E208-L231 HydrophobicContact CB-CG 4.38Å; E208-L231 HydrophobicContact CG-CD2 3.91Å |
| 209 | L | 98.8 | Very high | 98.1 | Very high | 0 Ų | 0 | 82.4 Ų | 82.4 | 0% | 0 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -62.7 | -39 | 173 | -73.1 | 166.3 | 0 | 0 | 0 | 112.2 | Y201 Q205 T206 L207 F213 V227 L231 L233 V238 W241 F242 | Y201-L209 HydrophobicContact CD2-CD1 4.39Å; Q205-L209 WeakPolarHBondContact O-CB 3.37Å; Q205-L209 WeakPolarHBondContact O-CD1 3.42Å; Q205-L209 WeakPolarHBondContact O-CG 3.36Å; Q205-L209 PolarHBondContact O-N 3.27Å; Q205-L209 VanDerWaalsContact O-N 3.07Å; T206-L209 PolarHBondContact O-N 3.08Å; L207-L209 VanDerWaalsContact C-N 3.34Å; L207-L209 PolarHBondContact O-N 3.49Å; L209-F213 WeakPolarHBondContact O-CB 3.39Å; L209-F213 PolarHBondContact O-N 3.25Å; L209-V227 HydrophobicContact CD2-CG1 4.11Å; L209-L231 HydrophobicContact CD1-CD1 4.43Å; L209-L231 HydrophobicContact CD2-CD1 3.87Å; L209-L231 HydrophobicContact CG-CD1 3.66Å; L209-L233 HydrophobicContact CD1-CD1 4.21Å; L209-V238 HydrophobicContact CD2-CG1 4.21Å; L209-W241 VanDerWaalsContact C-CH2 3.42Å; L209-W241 HydrophobicContact CB-CD2 3.84Å; L209-W241 HydrophobicContact CB-CE3 3.84Å; L209-W241 HydrophobicContact CB-CH2 3.65Å; L209-W241 HydrophobicContact CB-CZ2 3.62Å; L209-W241 HydrophobicContact CB-CZ3 3.75Å; L209-W241 HydrophobicContact CD1-CB 4.42Å; L209-W241 HydrophobicContact CD1-CD2 3.83Å; L209-W241 HydrophobicContact CD1-CE3 4.48Å; L209-W241 HydrophobicContact CD1-CG 3.77Å; L209-W241 HydrophobicContact CD2-CD2 4.3Å; L209-W241 HydrophobicContact CD2-CE3 4.18Å; L209-W241 HydrophobicContact CG-CD2 4.2Å; L209-W241 HydrophobicContact CG-CE3 4.38Å; L209-W241 WeakPolarHBondContact O-CH2 3.36Å; L209-W241 VanDerWaalsContact O-CZ3 3.32Å; L209-W241 WeakPolarHBondContact O-CZ3 3.42Å; L209-F242 HydrophobicContact CD2-CE2 4.03Å |
| 210 | E | 98.7 | Very high | 98.4 | Very high | 77 Ų | 77 | 81.7 Ų | 81.7 | 36% | 0.36 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -67.6 | -44 | 175.9 | -75 | -171.3 | 173.8 | 0 | 0 | 112.4 | T206 L207 E208 E212 F213 L214 W241 | T206-E210 WeakPolarHBondContact O-CG 3.36Å; T206-E210 PolarHBondContact O-N 2.99Å; L207-E210 PolarHBondContact O-N 3.05Å; E208-E210 VanDerWaalsContact C-N 3.32Å; E208-E210 PolarHBondContact O-N 3.4Å; E210-E212 PolarHBondContact O-N 3.48Å; E210-F213 WeakPolarHBondContact O-CB 3.46Å; E210-F213 PolarHBondContact O-N 3.47Å; E210-F213 VanDerWaalsContact O-N 3.16Å; E210-L214 WeakPolarHBondContact O-CG 3.34Å; E210-L214 PolarHBondContact O-N 3.45Å; E210-W241 HydrophobicContact CG-CH2 3.88Å; E210-W241 HydrophobicContact CG-CZ2 3.86Å |
| 211 | K | 98.6 | Very high | 98.4 | Very high | 114 Ų | 114 | 85 Ų | 85 | 50% | 0.496 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -57 | -48.6 | 174.1 | 174.2 | -177.9 | 157.5 | -155.6 | 0 | 111.6 | L207 E208 F213 L214 F215 | L207-K211 WeakPolarHBondContact O-CB 3.32Å; L207-K211 PolarHBondContact O-N 2.78Å; E208-K211 PolarHBondContact O-N 3.22Å; E208-K211 IonicContact OE1-NZ 3.42Å; E208-K211 PolarHBondContact OE1-NZ 3.37Å; E208-K211 IonicContact OE2-NZ 2.93Å; E208-K211 PolarHBondContact OE2-NZ 2.86Å; K211-F213 VanDerWaalsContact C-N 3.3Å; K211-F213 PolarHBondContact O-N 3.23Å; K211-L214 PolarHBondContact O-N 3.37Å; K211-F215 PolarHBondContact O-N 3.39Å |
| 212 | E | 98.6 | Very high | 98.4 | Very high | 16 Ų | 16 | 87 Ų | 87 | 8% | 0.075 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -62.3 | -37.5 | 176 | -71.4 | -62.7 | 137.7 | 0 | 0 | 112.4 | E208 E210 L214 F215 N216 R223 V227 F242 | E208-E212 WeakPolarHBondContact O-CG 3.35Å; E208-E212 PolarHBondContact O-N 3.41Å; E210-E212 PolarHBondContact O-N 3.48Å; E212-L214 VanDerWaalsContact C-N 3.35Å; E212-F215 PolarHBondContact O-N 3.23Å; E212-N216 PolarHBondContact O-N 3.38Å; E212-N216 VanDerWaalsContact O-O 3.13Å; E212-R223 IonicContact OE1-CZ 3.63Å; E212-R223 IonicContact OE1-NE 3.9Å; E212-R223 IonicContact OE1-NH2 2.67Å; E212-R223 PolarHBondContact OE1-NH2 3.02Å; E212-R223 IonicContact OE2-CZ 3.3Å; E212-R223 VanDerWaalsContact OE2-CZ 3.3Å; E212-R223 IonicContact OE2-NE 2.81Å; E212-R223 PolarHBondContact OE2-NE 3.37Å; E212-R223 IonicContact OE2-NH2 2.98Å; E212-R223 PolarHBondContact OE2-NH2 3.11Å; E212-V227 HydrophobicContact CG-CG1 4.45Å; E212-V227 HydrophobicContact CG-CG2 3.76Å; E212-F242 HydrophobicContact CB-CZ 3.96Å |
| 213 | F | 98.7 | Very high | 98.4 | Very high | 5 Ų | 5 | 87.5 Ų | 87.5 | 2% | 0.022 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -65.5 | -37.6 | 177.5 | -175.8 | -99.2 | 0 | 0 | 0 | 113.1 | L209 E210 K211 F215 N216 M217 W241 F242 R245 R246 M249 | L209-F213 WeakPolarHBondContact O-CB 3.39Å; L209-F213 PolarHBondContact O-N 3.25Å; E210-F213 WeakPolarHBondContact O-CB 3.46Å; E210-F213 PolarHBondContact O-N 3.47Å; E210-F213 VanDerWaalsContact O-N 3.16Å; K211-F213 VanDerWaalsContact C-N 3.3Å; K211-F213 PolarHBondContact O-N 3.23Å; F213-F215 VanDerWaalsContact C-N 3.34Å; F213-N216 CarbonylContact O-C 3.47Å; F213-N216 VanDerWaalsContact O-C 3.28Å; F213-M217 HydrophobicContact CD2-CB 4.45Å; F213-M217 HydrophobicContact CE1-CE 4.18Å; F213-M217 HydrophobicContact CE1-CG 4.07Å; F213-M217 HydrophobicContact CE2-CB 3.95Å; F213-M217 HydrophobicContact CE2-CE 4.2Å; F213-M217 HydrophobicContact CE2-CG 4.02Å; F213-M217 HydrophobicContact CZ-CB 4.2Å; F213-M217 HydrophobicContact CZ-CE 3.49Å; F213-M217 VanDerWaalsContact CZ-CE 3.49Å; F213-M217 HydrophobicContact CZ-CG 3.81Å; F213-M217 HydrophobicContact CZ-SD 4.4Å; F213-M217 PolarHBondContact O-N 2.93Å; F213-W241 HydrophobicContact CB-CH2 4.25Å; F213-W241 HydrophobicContact CB-CZ3 4.01Å; F213-W241 HydrophobicContact CD2-CZ3 4.46Å; F213-W241 HydrophobicContact CG-CZ3 4.44Å; F213-F242 HydrophobicContact CB-CE1 4.22Å; F213-F242 HydrophobicContact CB-CZ 4.35Å; F213-F242 AromaticContact CD2-CD1 3.91Å; F213-F242 HydrophobicContact CD2-CD1 3.91Å; F213-F242 AromaticContact CD2-CE1 3.91Å; F213-F242 HydrophobicContact CD2-CE1 3.91Å; F213-R245 HydrophobicContact CB-CG 4.48Å; F213-R245 HydrophobicContact CD1-CG 3.76Å; F213-R245 HydrophobicContact CD2-CB 4.23Å; F213-R245 HydrophobicContact CD2-CG 3.62Å; F213-R245 HydrophobicContact CE1-CG 3.78Å; F213-R245 HydrophobicContact CE2-CB 4.16Å; F213-R245 HydrophobicContact CE2-CG 3.66Å; F213-R245 HydrophobicContact CG-CG 3.67Å; F213-R245 HydrophobicContact CZ-CG 3.71Å; F213-R246 HydrophobicContact CE2-CG 3.65Å; F213-R246 HydrophobicContact CZ-CG 4Å; F213-M249 HydrophobicContact CE1-SD 4.32Å; F213-M249 HydrophobicContact CZ-SD 4.39Å |
| 214 | L | 98.2 | Very high | 98.5 | Very high | 141 Ų | 141 | 81.6 Ų | 81.6 | 74% | 0.738 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -69.5 | -35.2 | 175.3 | -67.6 | 173.9 | 0 | 0 | 0 | 111.6 | E210 K211 E212 | E210-L214 WeakPolarHBondContact O-CG 3.34Å; E210-L214 PolarHBondContact O-N 3.45Å; K211-L214 PolarHBondContact O-N 3.37Å; E212-L214 VanDerWaalsContact C-N 3.35Å |
| 215 | F | 98.2 | Very high | 98.5 | Very high | 164 Ų | 164 | 81.8 Ų | 81.8 | 72% | 0.719 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -66.7 | -50 | 173.4 | 178.7 | -102.3 | 0 | 0 | 0 | 111.7 | K211 E212 F213 | K211-F215 PolarHBondContact O-N 3.39Å; E212-F215 PolarHBondContact O-N 3.23Å; F213-F215 VanDerWaalsContact C-N 3.34Å |
| 216 | N | 97.5 | Very high | 98.5 | Very high | 72 Ų | 72 | 84.7 Ų | 84.7 | 39% | 0.385 | 39% | 0.391 | S | S | . | . | trans | -150.2 | 120.2 | 174.3 | -172.3 | -8.9 | 0 | 0 | 0 | 110.8 | E212 F213 Y218 F242 | E212-N216 PolarHBondContact O-N 3.38Å; E212-N216 VanDerWaalsContact O-O 3.13Å; F213-N216 CarbonylContact O-C 3.47Å; F213-N216 VanDerWaalsContact O-C 3.28Å; N216-Y218 PolarHBondContact ND2-O 3.26Å; N216-Y218 PolarHBondContact O-N 3.06Å; N216-Y218 VanDerWaalsContact O-N 3.08Å; N216-Y218 PolarHBondContact OD1-N 3.3Å; N216-Y218 PolarHBondContact OD1-O 3.5Å; N216-Y218 VanDerWaalsContact OD1-O 3.05Å; N216-F242 WeakPolarHBondContact O-CE1 3.46Å | ||
| 217 | M | 97.9 | Very high | 98.5 | Very high | 61 Ų | 61 | 82.9 Ų | 82.9 | 30% | 0.3 | 38% | 0.379 | S | S | . | . | S | Bend | trans | -65.6 | -13.4 | 179.8 | -68.9 | -177.9 | 68.2 | 0 | 0 | 114.3 | F213 R246 M249 | F213-M217 HydrophobicContact CD2-CB 4.45Å; F213-M217 HydrophobicContact CE1-CE 4.18Å; F213-M217 HydrophobicContact CE1-CG 4.07Å; F213-M217 HydrophobicContact CE2-CB 3.95Å; F213-M217 HydrophobicContact CE2-CE 4.2Å; F213-M217 HydrophobicContact CE2-CG 4.02Å; F213-M217 HydrophobicContact CZ-CB 4.2Å; F213-M217 HydrophobicContact CZ-CE 3.49Å; F213-M217 VanDerWaalsContact CZ-CE 3.49Å; F213-M217 HydrophobicContact CZ-CG 3.81Å; F213-M217 HydrophobicContact CZ-SD 4.4Å; F213-M217 PolarHBondContact O-N 2.93Å; M217-R246 HydrophobicContact CE-CG 4.31Å; M217-M249 HydrophobicContact CE-CE 3.12Å; M217-M249 HydrophobicContact CE-SD 3.49Å; M217-M249 WeakPolarHBondContact CE-SD 3.37Å; M217-M249 HydrophobicContact SD-CE 4.27Å; M217-M249 HydrophobicContact SD-SD 4.36Å |
| 218 | Y | 98.5 | Very high | 98.5 | Very high | 139 Ų | 139 | 78 Ų | 78 | 55% | 0.545 | 36% | 0.355 | S | S | . | . | S | Bend | trans | -132 | 120.6 | -177.7 | -66.2 | -101.8 | 0 | 0 | 0 | 110.6 | N216 R246 | N216-Y218 PolarHBondContact ND2-O 3.26Å; N216-Y218 PolarHBondContact O-N 3.06Å; N216-Y218 VanDerWaalsContact O-N 3.08Å; N216-Y218 PolarHBondContact OD1-N 3.3Å; N216-Y218 PolarHBondContact OD1-O 3.5Å; N216-Y218 VanDerWaalsContact OD1-O 3.05Å; Y218-R246 PolarHBondContact OH-NH1 3.32Å |
| 219 | L | 98.3 | Very high | 98.5 | Very high | 27 Ų | 27 | 84.5 Ų | 84.5 | 14% | 0.141 | 38% | 0.378 | C | S | . | . | trans | -87.2 | 136 | 178.7 | -59.8 | -176.4 | 0 | 0 | 0 | 112.6 | R223 R224 V238 F242 | L219-R223 HydrophobicContact CD2-CG 3.92Å; L219-R224 HydrophobicContact CB-CB 4.23Å; L219-R224 HydrophobicContact CD1-CB 4.18Å; L219-R224 HydrophobicContact CD1-CG 4.46Å; L219-V238 HydrophobicContact CD1-CG1 3.57Å; L219-F242 HydrophobicContact CD1-CD1 4.29Å; L219-F242 HydrophobicContact CD1-CD2 3.8Å; L219-F242 HydrophobicContact CD1-CE1 4Å; L219-F242 HydrophobicContact CD1-CE2 3.51Å; L219-F242 HydrophobicContact CD1-CG 4.2Å; L219-F242 HydrophobicContact CD1-CZ 3.61Å; L219-F242 HydrophobicContact CD2-CD1 4.46Å; L219-F242 HydrophobicContact CD2-CE1 3.68Å; L219-F242 HydrophobicContact CD2-CE2 4.44Å; L219-F242 HydrophobicContact CD2-CZ 3.68Å; L219-F242 HydrophobicContact CG-CD1 3.84Å; L219-F242 HydrophobicContact CG-CD2 4.27Å; L219-F242 HydrophobicContact CG-CE1 3.52Å; L219-F242 HydrophobicContact CG-CE2 4.01Å; L219-F242 HydrophobicContact CG-CG 4.21Å; L219-F242 HydrophobicContact CG-CZ 3.63Å | ||
| 220 | T | 98.6 | Very high | 98.4 | Very high | 87 Ų | 87 | 88.2 Ų | 88.2 | 53% | 0.534 | 40% | 0.4 | S | S | . | . | trans | -68.3 | 170.8 | 160.1 | 61 | 0 | 0 | 0 | 0 | 110.6 | R223 R224 | T220-R223 WeakPolarHBondContact OG1-CB 3.41Å; T220-R223 PolarHBondContact OG1-N 2.86Å; T220-R224 WeakPolarHBondContact O-CB 3.46Å; T220-R224 PolarHBondContact O-N 3.33Å; T220-R224 VanDerWaalsContact O-N 3.13Å | ||
| 221 | R | 98.4 | Very high | 98.4 | Very high | 195 Ų | 195 | 84.8 Ų | 84.8 | 74% | 0.736 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -61.3 | -49.6 | 178.5 | -177 | 180 | 179.2 | -178 | -3.2 | 111.2 | R224 Y225 | R221-R224 WeakPolarHBondContact O-CB 3.37Å; R221-R224 PolarHBondContact O-N 3.25Å; R221-Y225 PolarHBondContact O-N 3.12Å; R221-Y225 VanDerWaalsContact O-N 3.07Å |
| 222 | D | 98.4 | Very high | 98.4 | Very high | 113 Ų | 113 | 86.4 Ų | 86.4 | 60% | 0.604 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -68 | -43.5 | -174.2 | -52.4 | -31.7 | 0 | 0 | 0 | 111.2 | R224 Y225 E226 | D222-R224 VanDerWaalsContact C-N 3.29Å; D222-R224 PolarHBondContact O-N 3Å; D222-Y225 WeakPolarHBondContact O-CB 3.49Å; D222-Y225 PolarHBondContact O-N 3Å; D222-E226 PolarHBondContact O-N 3.43Å |
| 223 | R | 98.5 | Very high | 98.4 | Very high | 86 Ų | 86 | 86.7 Ų | 86.7 | 33% | 0.325 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -62.6 | -38 | 176.4 | -171.9 | 56.6 | 174.8 | -173.1 | -4 | 112.2 | E212 L219 T220 Y225 E226 V227 | E212-R223 IonicContact OE1-CZ 3.63Å; E212-R223 IonicContact OE1-NE 3.9Å; E212-R223 IonicContact OE1-NH2 2.67Å; E212-R223 PolarHBondContact OE1-NH2 3.02Å; E212-R223 IonicContact OE2-CZ 3.3Å; E212-R223 VanDerWaalsContact OE2-CZ 3.3Å; E212-R223 IonicContact OE2-NE 2.81Å; E212-R223 PolarHBondContact OE2-NE 3.37Å; E212-R223 IonicContact OE2-NH2 2.98Å; E212-R223 PolarHBondContact OE2-NH2 3.11Å; L219-R223 HydrophobicContact CD2-CG 3.92Å; T220-R223 WeakPolarHBondContact OG1-CB 3.41Å; T220-R223 PolarHBondContact OG1-N 2.86Å; R223-Y225 VanDerWaalsContact C-N 3.31Å; R223-Y225 PolarHBondContact O-N 3.38Å; R223-E226 WeakPolarHBondContact CD-OE2 3.3Å; R223-E226 IonicContact CZ-OE2 3.74Å; R223-E226 IonicContact NE-OE2 3.97Å; R223-E226 IonicContact NH1-OE2 2.77Å; R223-E226 PolarHBondContact NH1-OE2 2.8Å; R223-E226 PolarHBondContact O-N 2.9Å; R223-V227 HydrophobicContact CG-CG2 4.41Å; R223-V227 VanDerWaalsContact O-CG2 3.31Å; R223-V227 WeakPolarHBondContact O-CG2 3.27Å; R223-V227 PolarHBondContact O-N 3.19Å |
| 224 | R | 98.8 | Very high | 98.4 | Very high | 62 Ų | 62 | 90.1 Ų | 90.1 | 23% | 0.234 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -61.3 | -41.5 | 174.4 | -176.3 | -167.7 | -56.3 | 164 | 8 | 111.6 | L219 T220 R221 D222 A228 E235 V238 | L219-R224 HydrophobicContact CB-CB 4.23Å; L219-R224 HydrophobicContact CD1-CB 4.18Å; L219-R224 HydrophobicContact CD1-CG 4.46Å; T220-R224 WeakPolarHBondContact O-CB 3.46Å; T220-R224 PolarHBondContact O-N 3.33Å; T220-R224 VanDerWaalsContact O-N 3.13Å; R221-R224 WeakPolarHBondContact O-CB 3.37Å; R221-R224 PolarHBondContact O-N 3.25Å; D222-R224 VanDerWaalsContact C-N 3.29Å; D222-R224 PolarHBondContact O-N 3Å; R224-A228 WeakPolarHBondContact O-CB 3.49Å; R224-A228 PolarHBondContact O-N 3.39Å; R224-E235 WeakPolarHBondContact CD-O 3.3Å; R224-E235 HydrophobicContact CG-CB 4.18Å; R224-E235 HydrophobicContact CG-CG 4.33Å; R224-V238 HydrophobicContact CG-CB 4.22Å; R224-V238 HydrophobicContact CG-CG1 4.13Å |
| 225 | Y | 98.8 | Very high | 98.4 | Very high | 133 Ų | 133 | 87 Ų | 87 | 52% | 0.522 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -62.1 | -45.9 | 176.8 | 175.5 | -92.9 | 0 | 0 | 0 | 111.4 | R221 D222 R223 A228 R229 | R221-Y225 PolarHBondContact O-N 3.12Å; R221-Y225 VanDerWaalsContact O-N 3.07Å; D222-Y225 WeakPolarHBondContact O-CB 3.49Å; D222-Y225 PolarHBondContact O-N 3Å; R223-Y225 VanDerWaalsContact C-N 3.31Å; R223-Y225 PolarHBondContact O-N 3.38Å; Y225-A228 PolarHBondContact O-N 2.79Å; Y225-R229 PolarHBondContact O-N 2.98Å |
| 226 | E | 98.6 | Very high | 98.4 | Very high | 88 Ų | 88 | 87.5 Ų | 87.5 | 41% | 0.411 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -59.3 | -51 | 177.2 | -69.4 | 173.1 | -176.6 | 0 | 0 | 112.4 | D222 R223 A228 R229 V230 | D222-E226 PolarHBondContact O-N 3.43Å; R223-E226 WeakPolarHBondContact CD-OE2 3.3Å; R223-E226 IonicContact CZ-OE2 3.74Å; R223-E226 IonicContact NE-OE2 3.97Å; R223-E226 IonicContact NH1-OE2 2.77Å; R223-E226 PolarHBondContact NH1-OE2 2.8Å; R223-E226 PolarHBondContact O-N 2.9Å; E226-A228 VanDerWaalsContact C-N 3.32Å; E226-A228 PolarHBondContact O-N 3.27Å; E226-R229 PolarHBondContact O-N 2.94Å; E226-V230 WeakPolarHBondContact O-CG2 3.25Å; E226-V230 PolarHBondContact O-N 3.38Å |
| 227 | V | 98.6 | Very high | 98.5 | Very high | 8 Ų | 8 | 87 Ų | 87 | 5% | 0.048 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -62.5 | -41.8 | -179.8 | 174 | 0 | 0 | 0 | 0 | 110.9 | L209 E212 R223 R229 V230 L231 V238 | L209-V227 HydrophobicContact CD2-CG1 4.11Å; E212-V227 HydrophobicContact CG-CG1 4.45Å; E212-V227 HydrophobicContact CG-CG2 3.76Å; R223-V227 HydrophobicContact CG-CG2 4.41Å; R223-V227 VanDerWaalsContact O-CG2 3.31Å; R223-V227 WeakPolarHBondContact O-CG2 3.27Å; R223-V227 PolarHBondContact O-N 3.19Å; V227-R229 VanDerWaalsContact C-N 3.31Å; V227-R229 PolarHBondContact O-N 2.91Å; V227-V230 PolarHBondContact O-N 3.08Å; V227-L231 HydrophobicContact CG1-CD1 3.82Å; V227-L231 HydrophobicContact CG1-CG 4.39Å; V227-L231 WeakPolarHBondContact O-CB 3.46Å; V227-L231 WeakPolarHBondContact O-CG 3.33Å; V227-L231 PolarHBondContact O-N 3.09Å; V227-V238 HydrophobicContact CG1-CG1 4.09Å; V227-V238 HydrophobicContact CG1-CG2 4.38Å |
| 228 | A | 98.8 | Very high | 98.5 | Very high | 7 Ų | 7 | 84.1 Ų | 84.1 | 6% | 0.058 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -57.7 | -45.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | R224 Y225 E226 N232 L233 E235 V238 | R224-A228 WeakPolarHBondContact O-CB 3.49Å; R224-A228 PolarHBondContact O-N 3.39Å; Y225-A228 PolarHBondContact O-N 2.79Å; E226-A228 VanDerWaalsContact C-N 3.32Å; E226-A228 PolarHBondContact O-N 3.27Å; A228-N232 PolarHBondContact O-N 3.26Å; A228-N232 VanDerWaalsContact O-N 3.09Å; A228-L233 CarbonylContact C-O 3.28Å; A228-L233 VanDerWaalsContact CB-O 3.32Å; A228-L233 WeakPolarHBondContact CB-O 3.48Å; A228-L233 PolarHBondContact O-N 3.26Å; A228-L233 VanDerWaalsContact O-O 3.08Å; A228-E235 HydrophobicContact CB-CG 4.09Å; A228-V238 HydrophobicContact CB-CG2 3.98Å |
| 229 | R | 98.6 | Very high | 98.5 | Very high | 179 Ų | 179 | 81.8 Ų | 81.8 | 68% | 0.675 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -64.8 | -48.3 | 178.9 | -166.8 | 174.7 | 75.7 | 114.8 | -1.5 | 112.3 | Y225 E226 V227 L231 N232 | Y225-R229 PolarHBondContact O-N 2.98Å; E226-R229 PolarHBondContact O-N 2.94Å; V227-R229 VanDerWaalsContact C-N 3.31Å; V227-R229 PolarHBondContact O-N 2.91Å; R229-L231 VanDerWaalsContact C-N 3.28Å; R229-L231 PolarHBondContact O-N 3.34Å; R229-N232 PolarHBondContact O-N 3.07Å |
| 230 | V | 98.3 | Very high | 98.5 | Very high | 79 Ų | 79 | 82.8 Ų | 82.8 | 48% | 0.479 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -62.4 | -36.8 | -178.8 | 172.9 | 0 | 0 | 0 | 0 | 111.7 | E226 V227 | E226-V230 WeakPolarHBondContact O-CG2 3.25Å; E226-V230 PolarHBondContact O-N 3.38Å; V227-V230 PolarHBondContact O-N 3.08Å |
| 231 | L | 98.4 | Very high | 98.5 | Very high | 5 Ų | 5 | 80 Ų | 80 | 3% | 0.026 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -93.8 | 0.2 | -175.9 | -58.6 | -175.1 | 0 | 0 | 0 | 114.3 | Y204 Q205 E208 L209 V227 R229 L233 | Y204-L231 HydrophobicContact CD1-CD2 4.31Å; Y204-L231 HydrophobicContact CE1-CD2 3.76Å; Q205-L231 HydrophobicContact CG-CB 4.34Å; Q205-L231 PolarHBondContact NE2-O 3Å; E208-L231 HydrophobicContact CB-CD1 4.07Å; E208-L231 HydrophobicContact CB-CD2 3.56Å; E208-L231 HydrophobicContact CB-CG 4.38Å; E208-L231 HydrophobicContact CG-CD2 3.91Å; L209-L231 HydrophobicContact CD1-CD1 4.43Å; L209-L231 HydrophobicContact CD2-CD1 3.87Å; L209-L231 HydrophobicContact CG-CD1 3.66Å; V227-L231 HydrophobicContact CG1-CD1 3.82Å; V227-L231 HydrophobicContact CG1-CG 4.39Å; V227-L231 WeakPolarHBondContact O-CB 3.46Å; V227-L231 WeakPolarHBondContact O-CG 3.33Å; V227-L231 PolarHBondContact O-N 3.09Å; R229-L231 VanDerWaalsContact C-N 3.28Å; R229-L231 PolarHBondContact O-N 3.34Å; L231-L233 HydrophobicContact CB-CD1 4.14Å; L231-L233 HydrophobicContact CB-CG 4.12Å; L231-L233 PolarHBondContact O-N 3.26Å |
| 232 | N | 98.4 | Very high | 98.5 | Very high | 148 Ų | 148 | 71.1 Ų | 71.1 | 79% | 0.791 | 33% | 0.326 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.6 | 44.7 | -172.5 | -63.4 | -72.8 | 0 | 0 | 0 | 112.2 | A228 R229 | A228-N232 PolarHBondContact O-N 3.26Å; A228-N232 VanDerWaalsContact O-N 3.09Å; R229-N232 PolarHBondContact O-N 3.07Å |
| 233 | L | 98.2 | Very high | 98.5 | Very high | 21 Ų | 21 | 69.7 Ų | 69.7 | 11% | 0.11 | 32% | 0.315 | C | S | . | . | trans | -116.1 | 159 | 175.4 | -65.8 | 178.4 | 0 | 0 | 0 | 109.6 | Y201 L209 A228 L231 Q237 V238 | Y201-L233 HydrophobicContact CD1-CD1 4.4Å; Y201-L233 HydrophobicContact CD1-CD2 3.97Å; Y201-L233 HydrophobicContact CE1-CD1 4.28Å; Y201-L233 HydrophobicContact CE1-CD2 3.78Å; L209-L233 HydrophobicContact CD1-CD1 4.21Å; A228-L233 CarbonylContact C-O 3.28Å; A228-L233 VanDerWaalsContact CB-O 3.32Å; A228-L233 WeakPolarHBondContact CB-O 3.48Å; A228-L233 PolarHBondContact O-N 3.26Å; A228-L233 VanDerWaalsContact O-O 3.08Å; L231-L233 HydrophobicContact CB-CD1 4.14Å; L231-L233 HydrophobicContact CB-CG 4.12Å; L231-L233 PolarHBondContact O-N 3.26Å; L233-Q237 HydrophobicContact CB-CB 4.36Å; L233-V238 HydrophobicContact CB-CG2 4.17Å | ||
| 234 | T | 98.6 | Very high | 98.5 | Very high | 77 Ų | 77 | 70.3 Ų | 70.3 | 47% | 0.472 | 33% | 0.325 | S | S | . | . | trans | -75 | 148.2 | 169.4 | 61.4 | 0 | 0 | 0 | 0 | 110.4 | R236 Q237 V238 | T234-R236 PolarHBondContact O-N 3.32Å; T234-R236 VanDerWaalsContact O-N 3.08Å; T234-Q237 WeakPolarHBondContact O-CB 3.49Å; T234-Q237 PolarHBondContact O-N 2.85Å; T234-Q237 WeakPolarHBondContact OG1-CB 3.35Å; T234-Q237 VanDerWaalsContact OG1-CG 3.25Å; T234-Q237 WeakPolarHBondContact OG1-CG 3.48Å; T234-Q237 PolarHBondContact OG1-N 3.49Å; T234-Q237 PolarHBondContact OG1-OE1 2.88Å; T234-V238 PolarHBondContact O-N 3.16Å; T234-V238 VanDerWaalsContact O-N 3.1Å | ||
| 235 | E | 98.6 | Very high | 98.5 | Very high | 75 Ų | 75 | 69.9 Ų | 69.9 | 35% | 0.35 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -51.2 | -36 | 172.1 | -72.5 | -176.2 | -115.8 | 0 | 0 | 112.2 | R224 A228 V238 K239 | R224-E235 WeakPolarHBondContact CD-O 3.3Å; R224-E235 HydrophobicContact CG-CB 4.18Å; R224-E235 HydrophobicContact CG-CG 4.33Å; A228-E235 HydrophobicContact CB-CG 4.09Å; E235-V238 PolarHBondContact O-N 3.45Å; E235-K239 WeakPolarHBondContact O-CB 3.41Å; E235-K239 PolarHBondContact O-N 2.97Å |
| 236 | R | 98.2 | Very high | 98.5 | Very high | 175 Ų | 175 | 67 Ų | 67 | 66% | 0.66 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -63.1 | -43.3 | 176.3 | -174.1 | 177.6 | -175.6 | -82.5 | -1 | 112 | T234 K239 I240 | T234-R236 PolarHBondContact O-N 3.32Å; T234-R236 VanDerWaalsContact O-N 3.08Å; R236-K239 PolarHBondContact O-N 3.36Å; R236-I240 HydrophobicContact CG-CD1 3.93Å; R236-I240 WeakPolarHBondContact O-CB 3.31Å; R236-I240 VanDerWaalsContact O-CG1 3.27Å; R236-I240 WeakPolarHBondContact O-CG1 3.24Å; R236-I240 PolarHBondContact O-N 3.42Å |
| 237 | Q | 98.4 | Very high | 98.5 | Very high | 62 Ų | 62 | 68.2 Ų | 68.2 | 29% | 0.29 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -63.2 | -45.4 | 176.6 | -78.6 | 164.7 | -52.3 | 0 | 0 | 111.1 | Y201 L233 T234 K239 I240 W241 | Y201-Q237 WeakPolarHBondContact OH-CB 3.49Å; L233-Q237 HydrophobicContact CB-CB 4.36Å; T234-Q237 WeakPolarHBondContact O-CB 3.49Å; T234-Q237 PolarHBondContact O-N 2.85Å; T234-Q237 WeakPolarHBondContact OG1-CB 3.35Å; T234-Q237 VanDerWaalsContact OG1-CG 3.25Å; T234-Q237 WeakPolarHBondContact OG1-CG 3.48Å; T234-Q237 PolarHBondContact OG1-N 3.49Å; T234-Q237 PolarHBondContact OG1-OE1 2.88Å; Q237-K239 VanDerWaalsContact C-N 3.34Å; Q237-K239 PolarHBondContact O-N 3.07Å; Q237-I240 PolarHBondContact O-N 3.07Å; Q237-W241 WeakPolarHBondContact O-CB 3Å; Q237-W241 PolarHBondContact O-N 3.44Å |
| 238 | V | 98.7 | Very high | 98.4 | Very high | 0 Ų | 0 | 73.8 Ų | 73.8 | 0% | 0 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -59.3 | -46.6 | 175.1 | -179.1 | 0 | 0 | 0 | 0 | 110.2 | L209 L219 R224 V227 A228 L233 T234 E235 I240 W241 F242 | L209-V238 HydrophobicContact CD2-CG1 4.21Å; L219-V238 HydrophobicContact CD1-CG1 3.57Å; R224-V238 HydrophobicContact CG-CB 4.22Å; R224-V238 HydrophobicContact CG-CG1 4.13Å; V227-V238 HydrophobicContact CG1-CG1 4.09Å; V227-V238 HydrophobicContact CG1-CG2 4.38Å; A228-V238 HydrophobicContact CB-CG2 3.98Å; L233-V238 HydrophobicContact CB-CG2 4.17Å; T234-V238 PolarHBondContact O-N 3.16Å; T234-V238 VanDerWaalsContact O-N 3.1Å; E235-V238 PolarHBondContact O-N 3.45Å; V238-I240 PolarHBondContact O-N 3.34Å; V238-W241 PolarHBondContact O-N 2.78Å; V238-F242 HydrophobicContact CG1-CD2 3.96Å; V238-F242 HydrophobicContact CG1-CE2 4.03Å; V238-F242 WeakPolarHBondContact O-CD2 3.48Å; V238-F242 PolarHBondContact O-N 3.07Å |
| 239 | K | 98.5 | Very high | 98.3 | Very high | 91 Ų | 91 | 76.4 Ų | 76.4 | 40% | 0.396 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -56.6 | -47.1 | 176.5 | -169.1 | -178.5 | 87.3 | 172.8 | 0 | 112.1 | E235 R236 Q237 F242 Q243 | E235-K239 WeakPolarHBondContact O-CB 3.41Å; E235-K239 PolarHBondContact O-N 2.97Å; R236-K239 PolarHBondContact O-N 3.36Å; Q237-K239 VanDerWaalsContact C-N 3.34Å; Q237-K239 PolarHBondContact O-N 3.07Å; K239-F242 PolarHBondContact O-N 3.3Å; K239-Q243 WeakPolarHBondContact O-CG 3.48Å; K239-Q243 PolarHBondContact O-N 2.67Å; K239-Q243 VanDerWaalsContact O-N 3.08Å |
| 240 | I | 98.5 | Very high | 98.2 | Very high | 47 Ų | 47 | 74.2 Ų | 74.2 | 24% | 0.241 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -65.9 | -42 | 179.9 | -71.6 | 168.3 | 0 | 0 | 0 | 110.8 | R236 Q237 V238 F242 Q243 N244 | R236-I240 HydrophobicContact CG-CD1 3.93Å; R236-I240 WeakPolarHBondContact O-CB 3.31Å; R236-I240 VanDerWaalsContact O-CG1 3.27Å; R236-I240 WeakPolarHBondContact O-CG1 3.24Å; R236-I240 PolarHBondContact O-N 3.42Å; Q237-I240 PolarHBondContact O-N 3.07Å; V238-I240 PolarHBondContact O-N 3.34Å; I240-F242 PolarHBondContact O-N 3.21Å; I240-Q243 PolarHBondContact O-N 3.46Å; I240-N244 WeakPolarHBondContact O-CB 3.43Å; I240-N244 VanDerWaalsContact O-CG 3.25Å; I240-N244 PolarHBondContact O-N 2.9Å; I240-N244 PolarHBondContact O-ND2 2.9Å |
| 241 | W | 98.6 | Very high | 98.1 | Very high | 29 Ų | 29 | 77.3 Ų | 77.3 | 11% | 0.11 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -61.5 | -45.1 | 178.1 | -172.7 | 97 | 0 | 0 | 0 | 111.2 | Y201 L209 E210 F213 Q237 V238 Q243 N244 R245 | Y201-W241 AromaticContact CD2-CD1 3.81Å; Y201-W241 HydrophobicContact CE2-CB 4.4Å; Y201-W241 AromaticContact CE2-CD1 3.62Å; Y201-W241 HydrophobicContact CE2-CG 4.34Å; L209-W241 VanDerWaalsContact C-CH2 3.42Å; L209-W241 HydrophobicContact CB-CD2 3.84Å; L209-W241 HydrophobicContact CB-CE3 3.84Å; L209-W241 HydrophobicContact CB-CH2 3.65Å; L209-W241 HydrophobicContact CB-CZ2 3.62Å; L209-W241 HydrophobicContact CB-CZ3 3.75Å; L209-W241 HydrophobicContact CD1-CB 4.42Å; L209-W241 HydrophobicContact CD1-CD2 3.83Å; L209-W241 HydrophobicContact CD1-CE3 4.48Å; L209-W241 HydrophobicContact CD1-CG 3.77Å; L209-W241 HydrophobicContact CD2-CD2 4.3Å; L209-W241 HydrophobicContact CD2-CE3 4.18Å; L209-W241 HydrophobicContact CG-CD2 4.2Å; L209-W241 HydrophobicContact CG-CE3 4.38Å; L209-W241 WeakPolarHBondContact O-CH2 3.36Å; L209-W241 VanDerWaalsContact O-CZ3 3.32Å; L209-W241 WeakPolarHBondContact O-CZ3 3.42Å; E210-W241 HydrophobicContact CG-CH2 3.88Å; E210-W241 HydrophobicContact CG-CZ2 3.86Å; F213-W241 HydrophobicContact CB-CH2 4.25Å; F213-W241 HydrophobicContact CB-CZ3 4.01Å; F213-W241 HydrophobicContact CD2-CZ3 4.46Å; F213-W241 HydrophobicContact CG-CZ3 4.44Å; Q237-W241 WeakPolarHBondContact O-CB 3Å; Q237-W241 PolarHBondContact O-N 3.44Å; V238-W241 PolarHBondContact O-N 2.78Å; W241-Q243 VanDerWaalsContact C-N 3.33Å; W241-Q243 PolarHBondContact O-N 3.22Å; W241-N244 PolarHBondContact O-N 3.28Å; W241-R245 HydrophobicContact CD2-CB 4.47Å; W241-R245 HydrophobicContact CE3-CB 3.99Å; W241-R245 HydrophobicContact CH2-CB 4.01Å; W241-R245 HydrophobicContact CH2-CG 3.71Å; W241-R245 HydrophobicContact CZ2-CB 4.5Å; W241-R245 HydrophobicContact CZ2-CG 4.41Å; W241-R245 HydrophobicContact CZ3-CB 3.74Å; W241-R245 HydrophobicContact CZ3-CG 3.77Å; W241-R245 VanDerWaalsContact O-CB 3.3Å; W241-R245 WeakPolarHBondContact O-CB 3.23Å; W241-R245 PolarHBondContact O-N 3.09Å |
| 242 | F | 98.8 | Very high | 97.9 | Very high | 8 Ų | 8 | 81 Ų | 81 | 4% | 0.035 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -63.1 | -36.9 | 176.5 | -90.3 | -105.5 | 0 | 0 | 0 | 112.9 | L209 E212 F213 N216 L219 V238 K239 I240 R246 | L209-F242 HydrophobicContact CD2-CE2 4.03Å; E212-F242 HydrophobicContact CB-CZ 3.96Å; F213-F242 HydrophobicContact CB-CE1 4.22Å; F213-F242 HydrophobicContact CB-CZ 4.35Å; F213-F242 AromaticContact CD2-CD1 3.91Å; F213-F242 HydrophobicContact CD2-CD1 3.91Å; F213-F242 AromaticContact CD2-CE1 3.91Å; F213-F242 HydrophobicContact CD2-CE1 3.91Å; N216-F242 WeakPolarHBondContact O-CE1 3.46Å; L219-F242 HydrophobicContact CD1-CD1 4.29Å; L219-F242 HydrophobicContact CD1-CD2 3.8Å; L219-F242 HydrophobicContact CD1-CE1 4Å; L219-F242 HydrophobicContact CD1-CE2 3.51Å; L219-F242 HydrophobicContact CD1-CG 4.2Å; L219-F242 HydrophobicContact CD1-CZ 3.61Å; L219-F242 HydrophobicContact CD2-CD1 4.46Å; L219-F242 HydrophobicContact CD2-CE1 3.68Å; L219-F242 HydrophobicContact CD2-CE2 4.44Å; L219-F242 HydrophobicContact CD2-CZ 3.68Å; L219-F242 HydrophobicContact CG-CD1 3.84Å; L219-F242 HydrophobicContact CG-CD2 4.27Å; L219-F242 HydrophobicContact CG-CE1 3.52Å; L219-F242 HydrophobicContact CG-CE2 4.01Å; L219-F242 HydrophobicContact CG-CG 4.21Å; L219-F242 HydrophobicContact CG-CZ 3.63Å; V238-F242 HydrophobicContact CG1-CD2 3.96Å; V238-F242 HydrophobicContact CG1-CE2 4.03Å; V238-F242 WeakPolarHBondContact O-CD2 3.48Å; V238-F242 PolarHBondContact O-N 3.07Å; K239-F242 PolarHBondContact O-N 3.3Å; I240-F242 PolarHBondContact O-N 3.21Å; F242-R246 WeakPolarHBondContact O-CG 3.23Å; F242-R246 PolarHBondContact O-N 2.94Å; F242-R246 VanDerWaalsContact O-N 3.12Å; F242-R246 PolarHBondContact O-NE 3.18Å |
| 243 | Q | 98.7 | Very high | 97.5 | Very high | 83 Ų | 83 | 78.6 Ų | 78.6 | 39% | 0.388 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -63.5 | -50.2 | 172.8 | -72.5 | 174 | 4.1 | 0 | 0 | 111 | K239 I240 W241 R245 R246 M247 | K239-Q243 WeakPolarHBondContact O-CG 3.48Å; K239-Q243 PolarHBondContact O-N 2.67Å; K239-Q243 VanDerWaalsContact O-N 3.08Å; I240-Q243 PolarHBondContact O-N 3.46Å; W241-Q243 VanDerWaalsContact C-N 3.33Å; W241-Q243 PolarHBondContact O-N 3.22Å; Q243-R245 VanDerWaalsContact C-N 3.3Å; Q243-R245 PolarHBondContact O-N 3.04Å; Q243-R246 PolarHBondContact O-N 3.46Å; Q243-M247 WeakPolarHBondContact O-CG 3.28Å; Q243-M247 PolarHBondContact O-N 2.99Å |
| 244 | N | 98.4 | Very high | 97.1 | Very high | 99 Ų | 99 | 84 Ų | 84 | 53% | 0.529 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -60.8 | -40.1 | 178 | -68.8 | -19.2 | 0 | 0 | 0 | 111.8 | I240 W241 M247 K248 | I240-N244 WeakPolarHBondContact O-CB 3.43Å; I240-N244 VanDerWaalsContact O-CG 3.25Å; I240-N244 PolarHBondContact O-N 2.9Å; I240-N244 PolarHBondContact O-ND2 2.9Å; W241-N244 PolarHBondContact O-N 3.28Å; N244-M247 PolarHBondContact O-N 2.97Å; N244-K248 WeakPolarHBondContact O-CB 3.43Å; N244-K248 PolarHBondContact O-N 3.45Å |
| 245 | R | 98.6 | Very high | 96.3 | Very high | 53 Ų | 53 | 83.8 Ų | 83.8 | 20% | 0.2 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -64.8 | -40.9 | -179.7 | -177.8 | 62.5 | -170.8 | 82.4 | -0.7 | 112.1 | F213 W241 Q243 K248 M249 | F213-R245 HydrophobicContact CB-CG 4.48Å; F213-R245 HydrophobicContact CD1-CG 3.76Å; F213-R245 HydrophobicContact CD2-CB 4.23Å; F213-R245 HydrophobicContact CD2-CG 3.62Å; F213-R245 HydrophobicContact CE1-CG 3.78Å; F213-R245 HydrophobicContact CE2-CB 4.16Å; F213-R245 HydrophobicContact CE2-CG 3.66Å; F213-R245 HydrophobicContact CG-CG 3.67Å; F213-R245 HydrophobicContact CZ-CG 3.71Å; W241-R245 HydrophobicContact CD2-CB 4.47Å; W241-R245 HydrophobicContact CE3-CB 3.99Å; W241-R245 HydrophobicContact CH2-CB 4.01Å; W241-R245 HydrophobicContact CH2-CG 3.71Å; W241-R245 HydrophobicContact CZ2-CB 4.5Å; W241-R245 HydrophobicContact CZ2-CG 4.41Å; W241-R245 HydrophobicContact CZ3-CB 3.74Å; W241-R245 HydrophobicContact CZ3-CG 3.77Å; W241-R245 VanDerWaalsContact O-CB 3.3Å; W241-R245 WeakPolarHBondContact O-CB 3.23Å; W241-R245 PolarHBondContact O-N 3.09Å; Q243-R245 VanDerWaalsContact C-N 3.3Å; Q243-R245 PolarHBondContact O-N 3.04Å; R245-K248 PolarHBondContact O-N 3.3Å; R245-M249 PolarHBondContact O-N 3.23Å |
| 246 | R | 98.4 | Very high | 95.5 | Very high | 73 Ų | 73 | 86.7 Ų | 86.7 | 28% | 0.275 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -65.1 | -41.8 | 172.9 | -72.2 | -174.1 | -74 | 148.3 | -8 | 112 | F213 M217 Y218 F242 Q243 K248 M249 K250 | F213-R246 HydrophobicContact CE2-CG 3.65Å; F213-R246 HydrophobicContact CZ-CG 4Å; M217-R246 HydrophobicContact CE-CG 4.31Å; Y218-R246 PolarHBondContact OH-NH1 3.32Å; F242-R246 WeakPolarHBondContact O-CG 3.23Å; F242-R246 PolarHBondContact O-N 2.94Å; F242-R246 VanDerWaalsContact O-N 3.12Å; F242-R246 PolarHBondContact O-NE 3.18Å; Q243-R246 PolarHBondContact O-N 3.46Å; R246-K248 PolarHBondContact O-N 3.03Å; R246-M249 PolarHBondContact O-N 3.13Å; R246-K250 PolarHBondContact O-N 3.38Å |
| 247 | M | 98.3 | Very high | 94.3 | Very high | 113 Ų | 113 | 81.3 Ų | 81.3 | 56% | 0.557 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -62.4 | -42.7 | 175.4 | -66 | -58.8 | -74.8 | 0 | 0 | 112 | Q243 N244 K250 K251 | Q243-M247 WeakPolarHBondContact O-CG 3.28Å; Q243-M247 PolarHBondContact O-N 2.99Å; N244-M247 PolarHBondContact O-N 2.97Å; M247-K250 PolarHBondContact O-N 3.22Å; M247-K251 PolarHBondContact O-N 3.16Å |
| 248 | K | 97.3 | Very high | 92.9 | Very high | 126 Ų | 126 | 82.5 Ų | 82.5 | 55% | 0.548 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -60.3 | -45 | 174.8 | -174.4 | -179.7 | 178.8 | -175 | 0 | 111.4 | N244 R245 R246 K251 M252 | N244-K248 WeakPolarHBondContact O-CB 3.43Å; N244-K248 PolarHBondContact O-N 3.45Å; R245-K248 PolarHBondContact O-N 3.3Å; R246-K248 PolarHBondContact O-N 3.03Å; K248-K251 PolarHBondContact O-N 3.36Å; K248-M252 HydrophobicContact CD-SD 4.48Å; K248-M252 HydrophobicContact CG-SD 3.95Å; K248-M252 VanDerWaalsContact O-CG 3.3Å; K248-M252 WeakPolarHBondContact O-CG 3.37Å; K248-M252 PolarHBondContact O-N 3.14Å |
| 249 | M | 96.6 | Very high | 91.4 | Very high | 61 Ų | 61 | 88.1 Ų | 88.1 | 30% | 0.3 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -59.3 | -52.9 | 176.1 | -164.5 | -176.7 | 75.1 | 0 | 0 | 111.1 | F213 M217 R245 R246 K251 M252 N253 | F213-M249 HydrophobicContact CE1-SD 4.32Å; F213-M249 HydrophobicContact CZ-SD 4.39Å; M217-M249 HydrophobicContact CE-CE 3.12Å; M217-M249 HydrophobicContact CE-SD 3.49Å; M217-M249 WeakPolarHBondContact CE-SD 3.37Å; M217-M249 HydrophobicContact SD-CE 4.27Å; M217-M249 HydrophobicContact SD-SD 4.36Å; R245-M249 PolarHBondContact O-N 3.23Å; R246-M249 PolarHBondContact O-N 3.13Å; M249-K251 PolarHBondContact O-N 3.35Å; M249-M252 PolarHBondContact O-N 3.48Å; M249-M252 VanDerWaalsContact O-N 3.08Å; M249-N253 WeakPolarHBondContact CG-OD1 3.38Å; M249-N253 PolarHBondContact O-N 2.97Å; M249-N253 PolarHBondContact O-OD1 3.06Å |
| 250 | K | 96.8 | Very high | 89.7 | Confident | 134 Ų | 134 | 92.8 Ų | 92.8 | 58% | 0.583 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -54.2 | -41.2 | 179.1 | -172.7 | 177.8 | 68.6 | 170.5 | 0 | 112 | R246 M247 K254 | R246-K250 PolarHBondContact O-N 3.38Å; M247-K250 PolarHBondContact O-N 3.22Å; K250-K254 PolarHBondContact O-N 3.37Å |
| 251 | K | 95.8 | Very high | 87.7 | Confident | 143 Ų | 143 | 99.1 Ų | 99.1 | 62% | 0.622 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -63.5 | -51.5 | 176.2 | -175.6 | 170.2 | -179.6 | 173.8 | 0 | 111.7 | M247 K248 M249 N253 K254 D255 | M247-K251 PolarHBondContact O-N 3.16Å; K248-K251 PolarHBondContact O-N 3.36Å; M249-K251 PolarHBondContact O-N 3.35Å; K251-N253 PolarHBondContact O-N 3.41Å; K251-K254 PolarHBondContact O-N 3.37Å; K251-K254 VanDerWaalsContact O-N 3.09Å; K251-D255 VanDerWaalsContact O-CG 3.31Å; K251-D255 PolarHBondContact O-N 3.19Å |
| 252 | M | 93.4 | Very high | 85.2 | Confident | 82 Ų | 82 | 108.2 Ų | 108.2 | 40% | 0.404 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.2 | -31.7 | 179.3 | -68.6 | 171.4 | 62.6 | 0 | 0 | 113.3 | K248 M249 K256 | K248-M252 HydrophobicContact CD-SD 4.48Å; K248-M252 HydrophobicContact CG-SD 3.95Å; K248-M252 VanDerWaalsContact O-CG 3.3Å; K248-M252 WeakPolarHBondContact O-CG 3.37Å; K248-M252 PolarHBondContact O-N 3.14Å; M249-M252 PolarHBondContact O-N 3.48Å; M249-M252 VanDerWaalsContact O-N 3.08Å; M252-K256 VanDerWaalsContact O-CG 3.24Å; M252-K256 WeakPolarHBondContact O-CG 3.46Å; M252-K256 PolarHBondContact O-N 2.89Å |
| 253 | N | 91.1 | Very high | 84.6 | Confident | 98 Ų | 98 | 113.3 Ų | 113.3 | 52% | 0.524 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -71.7 | -33.9 | 176.8 | -75.8 | 64.3 | 0 | 0 | 0 | 112.3 | M249 K251 S257 | M249-N253 WeakPolarHBondContact CG-OD1 3.38Å; M249-N253 PolarHBondContact O-N 2.97Å; M249-N253 PolarHBondContact O-OD1 3.06Å; K251-N253 PolarHBondContact O-N 3.41Å; N253-S257 PolarHBondContact O-N 2.99Å |
| 254 | K | 88 | Confident | 83.8 | Confident | 135 Ų | 135 | 114.8 Ų | 114.8 | 59% | 0.587 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -71.9 | -45 | 175.8 | -175.8 | 170.4 | 178.2 | 176.4 | 0 | 111.7 | K250 K251 K256 S257 D258 | K250-K254 PolarHBondContact O-N 3.37Å; K251-K254 PolarHBondContact O-N 3.37Å; K251-K254 VanDerWaalsContact O-N 3.09Å; K254-K256 PolarHBondContact O-N 3.14Å; K254-S257 PolarHBondContact O-N 3.24Å; K254-S257 VanDerWaalsContact O-N 3.07Å; K254-S257 PolarHBondContact O-OG 3.2Å; K254-D258 PolarHBondContact O-N 3.39Å |
| 255 | D | 83.3 | Confident | 83 | Confident | 73 Ų | 73 | 115.7 Ų | 115.7 | 39% | 0.39 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -63 | -21.7 | 179.1 | -55.7 | -21 | 0 | 0 | 0 | 112.3 | K251 N259 | K251-D255 VanDerWaalsContact O-CG 3.31Å; K251-D255 PolarHBondContact O-N 3.19Å; D255-N259 PolarHBondContact O-ND2 3.47Å |
| 256 | K | 80.8 | Confident | 82.1 | Confident | 135 Ų | 135 | 119.4 Ų | 119.4 | 59% | 0.587 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -84.1 | -26.1 | 176.1 | -75.9 | 176.6 | 179.9 | -173.1 | 0 | 114.3 | M252 K254 | M252-K256 VanDerWaalsContact O-CG 3.24Å; M252-K256 WeakPolarHBondContact O-CG 3.46Å; M252-K256 PolarHBondContact O-N 2.89Å; K254-K256 PolarHBondContact O-N 3.14Å |
| 257 | S | 74.4 | Confident | 81.1 | Confident | 63 Ų | 63 | 122.3 Ų | 122.3 | 44% | 0.441 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -71.5 | -42 | 173.3 | 51.2 | 0 | 0 | 0 | 0 | 110.5 | N253 K254 N259 K260 | N253-S257 PolarHBondContact O-N 2.99Å; K254-S257 PolarHBondContact O-N 3.24Å; K254-S257 VanDerWaalsContact O-N 3.07Å; K254-S257 PolarHBondContact O-OG 3.2Å; S257-N259 VanDerWaalsContact C-N 3.31Å; S257-N259 PolarHBondContact O-N 3.28Å; S257-K260 PolarHBondContact O-N 3.18Å; S257-K260 VanDerWaalsContact O-N 3.16Å |
| 258 | D | 68.5 | Low | 79.9 | Confident | 86 Ų | 86 | 122.9 Ų | 122.9 | 46% | 0.46 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -69.4 | -29.2 | -173.9 | -57.2 | -5.2 | 0 | 0 | 0 | 112 | K254 | K254-D258 PolarHBondContact O-N 3.39Å |
| 259 | N | 67.1 | Low | 78.7 | Confident | 118 Ų | 118 | 122.7 Ų | 122.7 | 63% | 0.631 | 59% | 0.587 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.7 | -8.3 | 176.1 | -84 | -62.7 | 0 | 0 | 0 | 114.8 | D255 S257 | D255-N259 PolarHBondContact O-ND2 3.47Å; S257-N259 VanDerWaalsContact C-N 3.31Å; S257-N259 PolarHBondContact O-N 3.28Å |
| 260 | K | 62.2 | Low | 77.3 | Confident | 189 Ų | 189 | 127.5 Ų | 127.5 | 82% | 0.822 | 61% | 0.61 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.1 | -12.1 | 176.9 | -83.3 | -173.1 | 175.7 | -173.4 | 0 | 113.3 | S257 | S257-K260 PolarHBondContact O-N 3.18Å; S257-K260 VanDerWaalsContact O-N 3.16Å |
| 261 | E | 56.2 | Low | 75.7 | Confident | 180 Ų | 180 | 126.9 Ų | 126.9 | 84% | 0.841 | 61% | 0.612 | S | S | * | * | trans | -97.1 | 11.3 | 177.4 | -72.6 | -175.1 | 155.4 | 0 | 0 | 112.9 | ||||
| 262 | Q | 47.3 | Very low | 73.8 | Confident | 221 Ų | 221 | 125.5 Ų | 125.5 | 100% | 1.033 | 61% | 0.611 | S | S | * | * | trans | -124.8 | 0 | -178.8 | -150.7 | 166.3 | 21.1 | 0 | 0 | 110.3 |
Retrieved 262 of 262 residues in 180.7 ms
(Link to these results)