| 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 | 48.8 | Very low | 53.8 | Low | 235 Ų | 235 | 168.1 Ų | 168.1 | 100% | 1.158 | 84% | 0.838 | S | S | * | * | 0 | 127.4 | 0 | -71.6 | -168.9 | 147.4 | 0 | 0 | 108.9 | |||||
| 2 | P | 62.2 | Low | 52.9 | Low | 124 Ų | 124 | 165.6 Ų | 165.6 | 81% | 0.805 | 84% | 0.838 | S | S | * | * | trans | -73.9 | 136 | 177.1 | 30.8 | -32.8 | 0 | 0 | 0 | 110.5 | V4 | P2-V4 PolarHBondContact O-N 3.35Š| ||
| 3 | K | 50.9 | Low | 52.5 | Low | 208 Ų | 208 | 166.4 Ų | 166.4 | 90% | 0.904 | 83% | 0.832 | S | S | * | * | trans | -84.3 | 109.3 | 175.8 | -68.4 | 175.6 | 179.9 | 174.4 | 0 | 108.7 | F5 | K3-F5 PolarHBondContact O-N 3.19Š| ||
| 4 | V | 60.1 | Low | 52.5 | Low | 129 Ų | 129 | 162.6 Ų | 162.6 | 78% | 0.782 | 82% | 0.822 | S | S | * | * | trans | -78.1 | 113.1 | 177.7 | -173.9 | 0 | 0 | 0 | 0 | 109.5 | P2 | P2-V4 PolarHBondContact O-N 3.35Š| ||
| 5 | F | 56.6 | Low | 51.9 | Low | 185 Ų | 185 | 162.9 Ų | 162.9 | 81% | 0.811 | 82% | 0.819 | S | S | * | * | trans | -84.7 | 125.3 | 177.7 | -168 | -95.8 | 0 | 0 | 0 | 109.8 | K3 | K3-F5 PolarHBondContact O-N 3.19Š| ||
| 6 | R | 59.6 | Low | 51.7 | Low | 229 Ų | 229 | 162.3 Ų | 162.3 | 86% | 0.864 | 82% | 0.817 | S | S | * | * | trans | -108.5 | 120.9 | 170.7 | -72.5 | -169.6 | 177.8 | -139.3 | -0.7 | 109.4 | ||||
| 7 | P | 54.8 | Low | 51.7 | Low | 104 Ų | 104 | 163.9 Ų | 163.9 | 68% | 0.675 | 82% | 0.817 | S | S | * | * | trans | -73.7 | 145.7 | 179.4 | 30.2 | -33.9 | 0 | 0 | 0 | 111.6 | ||||
| 8 | S | 52.4 | Low | 51.3 | Low | 101 Ų | 101 | 161.7 Ų | 161.7 | 71% | 0.706 | 81% | 0.814 | S | S | * | * | trans | -80.6 | 121.9 | 176.2 | -177.8 | 0 | 0 | 0 | 0 | 110.6 | K10 | S8-K10 PolarHBondContact O-N 2.98Š| ||
| 9 | I | 48.8 | Very low | 51.1 | Low | 165 Ų | 165 | 161.3 Ų | 161.3 | 85% | 0.846 | 82% | 0.815 | S | S | * | * | trans | -70.8 | 110.3 | 175.1 | -62.8 | 171.2 | 0 | 0 | 0 | 109.1 | ||||
| 10 | K | 49.7 | Very low | 50.6 | Low | 181 Ų | 181 | 162.5 Ų | 162.5 | 79% | 0.787 | 82% | 0.818 | S | S | * | * | trans | -134.9 | 119.5 | 163 | -72.9 | -172.3 | 179.2 | 178.6 | 0 | 110.2 | S8 | S8-K10 PolarHBondContact O-N 2.98Š| ||
| 11 | Q | 48.4 | Very low | 50.6 | Low | 188 Ų | 188 | 161.4 Ų | 161.4 | 88% | 0.879 | 82% | 0.819 | S | S | * | * | trans | 57.8 | 83.6 | 160.2 | -57.7 | -175.3 | -5 | 0 | 0 | 117.1 | K13 | Q11-K13 PolarHBondContact O-N 2.87Š| ||
| 12 | V | 42.7 | Very low | 50.3 | Low | 138 Ų | 138 | 159 Ų | 159 | 84% | 0.836 | 81% | 0.805 | S | S | * | * | trans | -82.7 | 105.2 | 152.6 | 179.2 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 13 | K | 47.6 | Very low | 49.1 | Very low | 176 Ų | 176 | 158.7 Ų | 158.7 | 77% | 0.765 | 80% | 0.801 | S | S | * | * | trans | -92 | 115.6 | 167.7 | -172.6 | 162.5 | -178 | 173.6 | 0 | 108.1 | Q11 H15 | Q11-K13 PolarHBondContact O-N 2.87Å; K13-H15 PolarHBondContact O-N 2.79Å | ||
| 14 | T | 52.2 | Low | 48.7 | Very low | 113 Ų | 113 | 158.4 Ų | 158.4 | 69% | 0.693 | 80% | 0.803 | S | S | * | * | trans | -69.1 | 124.4 | -177.5 | 40.1 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 15 | H | 44.3 | Very low | 47.6 | Very low | 168 Ų | 168 | 159.3 Ų | 159.3 | 78% | 0.778 | 80% | 0.799 | S | S | * | * | trans | -116.4 | 92.6 | 161.8 | -79.5 | -83.9 | 0 | 0 | 0 | 107.6 | K13 | K13-H15 PolarHBondContact O-N 2.79Š| ||
| 16 | I | 48.8 | Very low | 47 | Very low | 153 Ų | 153 | 158.8 Ų | 158.8 | 79% | 0.785 | 80% | 0.802 | S | S | * | * | trans | -82.4 | 114.9 | 168.1 | -62.2 | 176.7 | 0 | 0 | 0 | 106.4 | ||||
| 17 | K | 50.4 | Low | 46.4 | Very low | 189 Ų | 189 | 157.7 Ų | 157.7 | 82% | 0.822 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -77.1 | 122.4 | 169.7 | -74.3 | -178.3 | 174.2 | -177.1 | 0 | 108.6 | ||
| 18 | T | 45 | Very low | 45.8 | Very low | 124 Ų | 124 | 157.6 Ų | 157.6 | 76% | 0.761 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -76 | 126.5 | 162.9 | 43.5 | 0 | 0 | 0 | 0 | 108.9 | ||
| 19 | N | 47.5 | Very low | 45.4 | Very low | 155 Ų | 155 | 160.8 Ų | 160.8 | 83% | 0.829 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -86.4 | 129.6 | 163.7 | -80.4 | -11.6 | 0 | 0 | 0 | 108.5 | ||
| 20 | E | 42.2 | Very low | 45 | Very low | 185 Ų | 185 | 161.5 Ų | 161.5 | 86% | 0.864 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -82.4 | 137 | 175 | -61.1 | 171.5 | 146 | 0 | 0 | 109.5 | ||
| 21 | V | 50.1 | Low | 44.6 | Very low | 139 Ų | 139 | 159.5 Ų | 159.5 | 84% | 0.842 | 81% | 0.809 | S | S | * | * | trans | -133.8 | 97.2 | 162.7 | -178.9 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 22 | E | 41.4 | Very low | 44.4 | Very low | 184 Ų | 184 | 156.1 Ų | 156.1 | 86% | 0.86 | 81% | 0.806 | S | S | * | * | trans | 26.5 | 109.1 | 143.8 | -152.5 | 157.7 | -167.3 | 0 | 0 | 120.5 | ||||
| 23 | T | 36.8 | Very low | 44.4 | Very low | 119 Ų | 119 | 157.4 Ų | 157.4 | 73% | 0.73 | 81% | 0.808 | S | S | * | * | trans | -27.6 | 137.8 | 156.9 | -43.1 | 0 | 0 | 0 | 0 | 117.5 | E25 | T23-E25 HydrophobicContact CG2-CB 4.46Š| ||
| 24 | Q | 43.5 | Very low | 44 | Very low | 202 Ų | 202 | 154 Ų | 154 | 94% | 0.944 | 80% | 0.804 | S | S | * | * | trans | -131.6 | 144.4 | 132.9 | -71.8 | -161.4 | 8.3 | 0 | 0 | 110.9 | ||||
| 25 | E | 36.7 | Very low | 43.5 | Very low | 148 Ų | 148 | 156 Ų | 156 | 69% | 0.692 | 81% | 0.806 | S | S | * | * | trans | -112.3 | 125.9 | -160.1 | 175.8 | -175 | -168.6 | 0 | 0 | 111.4 | T23 | T23-E25 HydrophobicContact CG2-CB 4.46Š| ||
| 26 | I | 44.7 | Very low | 43.4 | Very low | 174 Ų | 174 | 153.7 Ų | 153.7 | 89% | 0.892 | 81% | 0.806 | S | S | * | * | trans | -137.5 | 108.5 | 160.8 | -54.8 | -178.8 | 0 | 0 | 0 | 110 | ||||
| 27 | R | 46.1 | Very low | 43.3 | Very low | 206 Ų | 206 | 151.1 Ų | 151.1 | 78% | 0.777 | 80% | 0.801 | S | S | * | * | trans | -93.9 | 177 | 164.3 | -86.3 | -178.3 | 168.7 | -159.3 | 1 | 109.6 | ||||
| 28 | P | 42.4 | Very low | 42.7 | Very low | 101 Ų | 101 | 151.4 Ų | 151.4 | 66% | 0.656 | 80% | 0.802 | S | S | * | * | cis | -132.8 | -177.5 | -43.2 | 38 | -22.9 | 0 | 0 | 0 | 111.1 | ||||
| 29 | N | 44.8 | Very low | 42.7 | Very low | 168 Ų | 168 | 154.3 Ų | 154.3 | 90% | 0.898 | 81% | 0.807 | S | S | * | * | trans | -159.1 | 144.6 | 134.6 | -107.6 | -29.5 | 0 | 0 | 0 | 112.4 | ||||
| 30 | Q | 40.4 | Very low | 42.5 | Very low | 181 Ų | 181 | 152 Ų | 152 | 85% | 0.846 | 80% | 0.803 | S | S | * | * | trans | -106.9 | 136.8 | -174.4 | -59.6 | 177.5 | -6.3 | 0 | 0 | 110.9 | ||||
| 31 | V | 41.2 | Very low | 42.7 | Very low | 138 Ų | 138 | 147.9 Ų | 147.9 | 84% | 0.836 | 80% | 0.795 | S | S | * | * | trans | -144.7 | 104.3 | 156.7 | -177.3 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 32 | S | 43.1 | Very low | 42.3 | Very low | 117 Ų | 117 | 146.7 Ų | 146.7 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | trans | 56.7 | 135.2 | 138.1 | -49.6 | 0 | 0 | 0 | 0 | 124 | ||||
| 33 | D | 42.7 | Very low | 42 | Very low | 166 Ų | 166 | 143.3 Ų | 143.3 | 89% | 0.888 | 79% | 0.788 | S | S | * | * | trans | -82.8 | 175.5 | -172.1 | -89 | -53.6 | 0 | 0 | 0 | 117.8 | ||||
| 34 | P | 39.4 | Very low | 42.2 | Very low | 103 Ų | 103 | 144.2 Ų | 144.2 | 67% | 0.669 | 79% | 0.787 | S | S | * | * | trans | -115.9 | 175.7 | -165.8 | 43.3 | -34.7 | 0 | 0 | 0 | 116.8 | ||||
| 35 | Q | 42.1 | Very low | 42 | Very low | 156 Ų | 156 | 141.7 Ų | 141.7 | 73% | 0.729 | 78% | 0.779 | S | S | * | * | trans | -148 | 148.6 | 162.3 | -90.4 | -55.1 | -82 | 0 | 0 | 111.4 | ||||
| 36 | P | 42.4 | Very low | 41.9 | Very low | 120 Ų | 120 | 140.1 Ų | 140.1 | 78% | 0.779 | 78% | 0.779 | S | S | * | * | -137.9 | 157.3 | 92.1 | 35.7 | -21.4 | 0 | 0 | 0 | 116.8 | |||||
| 37 | S | 45.8 | Very low | 41.9 | Very low | 98 Ų | 98 | 137.6 Ų | 137.6 | 69% | 0.685 | 78% | 0.777 | S | S | * | * | trans | -58.5 | 138.5 | 170.6 | 43.8 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 38 | K | 39.3 | Very low | 42 | Very low | 196 Ų | 196 | 137 Ų | 137 | 85% | 0.852 | 78% | 0.783 | S | S | * | * | 73.7 | 96.6 | 58.6 | -75.5 | -167.5 | 179.3 | 179.8 | 0 | 116.2 | |||||
| 39 | E | 44.2 | Very low | 42 | Very low | 184 Ų | 184 | 137.1 Ų | 137.1 | 86% | 0.86 | 78% | 0.784 | S | S | * | * | trans | -142.7 | 106.2 | 143.2 | -68.4 | -168.7 | 155.9 | 0 | 0 | 106.7 | ||||
| 40 | S | 43.1 | Very low | 41.7 | Very low | 106 Ų | 106 | 138.4 Ų | 138.4 | 74% | 0.741 | 78% | 0.781 | S | S | * | * | 45 | 120.1 | 99.7 | 56 | 0 | 0 | 0 | 0 | 114.7 | |||||
| 41 | S | 46 | Very low | 41.8 | Very low | 100 Ų | 100 | 135.4 Ų | 135.4 | 70% | 0.699 | 78% | 0.777 | S | S | * | * | -169.8 | 149.4 | 59.7 | -57.1 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 42 | S | 42.3 | Very low | 41.5 | Very low | 113 Ų | 113 | 133.9 Ų | 133.9 | 79% | 0.79 | 77% | 0.773 | S | S | * | * | trans | 53.9 | 160.5 | 146.6 | 60.2 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 43 | C | 35.1 | Very low | 41.6 | Very low | 113 Ų | 113 | 133.9 Ų | 133.9 | 76% | 0.764 | 77% | 0.773 | S | S | * | * | cis | -175.1 | 159.2 | -20.1 | -95 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 44 | I | 42 | Very low | 41.5 | Very low | 138 Ų | 138 | 132.2 Ų | 132.2 | 71% | 0.708 | 77% | 0.771 | S | S | * | * | cis | -171.7 | 156.4 | -24.7 | -156 | 176.3 | 0 | 0 | 0 | 108.3 | ||||
| 45 | I | 39.4 | Very low | 41.4 | Very low | 150 Ų | 150 | 135.3 Ų | 135.3 | 77% | 0.769 | 78% | 0.781 | S | S | * | * | trans | 67.1 | 153.5 | 166.9 | -69.4 | 169.1 | 0 | 0 | 0 | 116.8 | ||||
| 46 | T | 34.1 | Very low | 41.5 | Very low | 115 Ų | 115 | 133.5 Ų | 133.5 | 71% | 0.706 | 78% | 0.783 | S | S | * | * | cis | -178.1 | 136.5 | -33.8 | -71 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 47 | S | 45 | Very low | 41.4 | Very low | 121 Ų | 121 | 132.7 Ų | 132.7 | 85% | 0.846 | 78% | 0.78 | S | S | * | * | trans | -178.5 | 145.3 | 145.1 | 36.5 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 48 | E | 47.5 | Very low | 41.5 | Very low | 192 Ų | 192 | 136.8 Ų | 136.8 | 90% | 0.897 | 79% | 0.789 | S | S | * | * | trans | -97.9 | 176.8 | -172.5 | -94.5 | -158.6 | 147.7 | 0 | 0 | 114.1 | ||||
| 49 | P | 42.1 | Very low | 41.5 | Very low | 104 Ų | 104 | 135 Ų | 135 | 68% | 0.675 | 79% | 0.788 | S | S | * | * | trans | -113.2 | 171.1 | -154.3 | 41.8 | -35.7 | 0 | 0 | 0 | 117.4 | ||||
| 50 | K | 39 | Very low | 41.4 | Very low | 196 Ų | 196 | 131.9 Ų | 131.9 | 85% | 0.852 | 78% | 0.784 | S | S | * | * | trans | 66.7 | 171.4 | 160.2 | -99.1 | 179.4 | 160.7 | 169.4 | 0 | 115.6 | ||||
| 51 | P | 41.3 | Very low | 40.8 | Very low | 117 Ų | 117 | 132.3 Ų | 132.3 | 76% | 0.76 | 79% | 0.786 | S | S | * | * | cis | -127.7 | 178.6 | 6.6 | 38.9 | -20.9 | 0 | 0 | 0 | 116.9 | ||||
| 52 | S | 36.5 | Very low | 40.6 | Very low | 106 Ų | 106 | 136.1 Ų | 136.1 | 74% | 0.741 | 79% | 0.792 | S | S | * | * | trans | -79.8 | 147.7 | 175.1 | 49.8 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 53 | S | 43.7 | Very low | 40.7 | Very low | 118 Ų | 118 | 135.9 Ų | 135.9 | 83% | 0.825 | 79% | 0.787 | S | S | * | * | trans | -139.4 | 152.7 | 166 | -62.5 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 54 | P | 40.4 | Very low | 40.9 | Very low | 130 Ų | 130 | 136 Ų | 136 | 84% | 0.844 | 79% | 0.786 | S | S | * | * | trans | -105.2 | 174.7 | -160.6 | 39.4 | -34.2 | 0 | 0 | 0 | 116.4 | ||||
| 55 | L | 39.1 | Very low | 41.1 | Very low | 168 Ų | 168 | 138.1 Ų | 138.1 | 88% | 0.88 | 79% | 0.79 | S | S | * | * | trans | -71.8 | 156.7 | 179.2 | -81.8 | 98.6 | 0 | 0 | 0 | 114.7 | ||||
| 56 | P | 43.8 | Very low | 41 | Very low | 118 Ų | 118 | 137 Ų | 137 | 77% | 0.766 | 79% | 0.79 | S | S | * | * | trans | -88.4 | 135 | 176.7 | 34.7 | -34.1 | 0 | 0 | 0 | 115.1 | ||||
| 57 | S | 40.7 | Very low | 41.4 | Very low | 103 Ų | 103 | 135.3 Ų | 135.3 | 72% | 0.72 | 79% | 0.788 | S | S | * | * | trans | 16 | 133.6 | 133.9 | -161.1 | 0 | 0 | 0 | 0 | 121 | ||||
| 58 | Q | 46.6 | Very low | 41.2 | Very low | 185 Ų | 185 | 135.8 Ų | 135.8 | 86% | 0.864 | 79% | 0.786 | S | S | * | * | -175.6 | 126.5 | 104.5 | -95 | 169.7 | 11.9 | 0 | 0 | 114 | |||||
| 59 | N | 40.3 | Very low | 41.2 | Very low | 157 Ų | 157 | 131.4 Ų | 131.4 | 84% | 0.84 | 77% | 0.774 | S | S | * | * | trans | -88.7 | -179.4 | 160.2 | -74.1 | -33.6 | 0 | 0 | 0 | 108.8 | ||||
| 60 | P | 41.4 | Very low | 41 | Very low | 119 Ų | 119 | 137.3 Ų | 137.3 | 77% | 0.773 | 78% | 0.783 | S | S | * | * | cis | -130.3 | 166 | 25.4 | 19.9 | 8.4 | 0 | 0 | 0 | 115 | ||||
| 61 | C | 31.4 | Very low | 41.2 | Very low | 115 Ų | 115 | 135.1 Ų | 135.1 | 78% | 0.777 | 78% | 0.78 | S | S | * | * | 74.6 | 113 | 56.5 | -158.2 | 0 | 0 | 0 | 0 | 116.1 | |||||
| 62 | E | 40.8 | Very low | 41.4 | Very low | 180 Ų | 180 | 134.5 Ų | 134.5 | 84% | 0.841 | 77% | 0.774 | S | S | * | * | trans | -179.7 | 102.5 | 147.1 | -103 | 171.6 | -155.5 | 0 | 0 | 110.4 | ||||
| 63 | T | 44.4 | Very low | 41.9 | Very low | 109 Ų | 109 | 136.4 Ų | 136.4 | 67% | 0.669 | 78% | 0.776 | S | S | * | * | 76.5 | 130.3 | 99.3 | 61.2 | 0 | 0 | 0 | 0 | 119.1 | |||||
| 64 | P | 40.3 | Very low | 42 | Very low | 115 Ų | 115 | 136.4 Ų | 136.4 | 75% | 0.747 | 77% | 0.773 | S | S | * | * | trans | -109.4 | 166.2 | -175.2 | 41.4 | -36.2 | 0 | 0 | 0 | 116.6 | ||||
| 65 | K | 45.3 | Very low | 42.4 | Very low | 182 Ų | 182 | 137.2 Ų | 137.2 | 79% | 0.791 | 77% | 0.77 | S | S | * | * | trans | -168.9 | 163.7 | 167.2 | -85.9 | 116 | -155.7 | 173.2 | 0 | 109.8 | ||||
| 66 | T | 37.8 | Very low | 42.9 | Very low | 126 Ų | 126 | 136.6 Ų | 136.6 | 77% | 0.773 | 77% | 0.767 | S | S | * | * | cis | -170.2 | 146.3 | -22.1 | -87.4 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 67 | A | 41 | Very low | 42.8 | Very low | 81 Ų | 81 | 138.1 Ų | 138.1 | 67% | 0.669 | 77% | 0.769 | S | S | * | * | trans | 64.4 | 110.6 | 157.7 | 0 | 0 | 0 | 0 | 0 | 124.8 | ||||
| 68 | T | 42.1 | Very low | 43 | Very low | 131 Ų | 131 | 139.8 Ų | 139.8 | 80% | 0.804 | 77% | 0.774 | S | S | * | * | 15 | 170.4 | 115 | 15 | 0 | 0 | 0 | 0 | 122.8 | |||||
| 69 | P | 46.4 | Very low | 42.7 | Very low | 99 Ų | 99 | 140.9 Ų | 140.9 | 64% | 0.643 | 77% | 0.771 | S | S | * | * | cis | -144.2 | 173.4 | -8.1 | 31.7 | -8 | 0 | 0 | 0 | 119.9 | ||||
| 70 | R | 38.9 | Very low | 42.9 | Very low | 228 Ų | 228 | 139.3 Ų | 139.3 | 86% | 0.86 | 77% | 0.766 | S | S | * | * | trans | 66.5 | 128.6 | 145.1 | -75.7 | 165.3 | -159.2 | -108.5 | 5.2 | 122.7 | ||||
| 71 | L | 42.9 | Very low | 43 | Very low | 151 Ų | 151 | 139.6 Ų | 139.6 | 79% | 0.791 | 76% | 0.761 | S | S | * | * | -173.2 | 137.1 | 98.3 | -96.7 | 169.6 | 0 | 0 | 0 | 112.8 | |||||
| 72 | T | 44.8 | Very low | 44 | Very low | 104 Ų | 104 | 137.7 Ų | 137.7 | 64% | 0.638 | 75% | 0.749 | S | S | * | * | trans | 26.2 | 142.1 | 146.6 | 54.8 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 73 | D | 48.4 | Very low | 44.3 | Very low | 146 Ų | 146 | 136.5 Ų | 136.5 | 78% | 0.781 | 74% | 0.744 | S | S | * | * | cis | -160.4 | 166.2 | -2.6 | -93.1 | -30.2 | 0 | 0 | 0 | 109.7 | ||||
| 74 | P | 46.1 | Very low | 44.2 | Very low | 118 Ų | 118 | 141 Ų | 141 | 77% | 0.766 | 75% | 0.748 | S | S | * | * | trans | -108.9 | 156.3 | -167.7 | 39.2 | -31.8 | 0 | 0 | 0 | 115.7 | ||||
| 75 | D | 47.2 | Very low | 44.5 | Very low | 147 Ų | 147 | 139.5 Ų | 139.5 | 79% | 0.786 | 74% | 0.741 | S | S | * | * | trans | -158 | 152 | 144.6 | -149.7 | -0.3 | 0 | 0 | 0 | 114.5 | ||||
| 76 | L | 49.8 | Very low | 44.8 | Very low | 155 Ų | 155 | 136.4 Ų | 136.4 | 81% | 0.812 | 73% | 0.729 | S | S | * | * | trans | 68.7 | 109.8 | 167.4 | -54.9 | -176.1 | 0 | 0 | 0 | 121.5 | ||||
| 77 | D | 42.6 | Very low | 45.3 | Very low | 150 Ų | 150 | 137.3 Ų | 137.3 | 80% | 0.802 | 73% | 0.725 | S | S | * | * | trans | -73.8 | 133.1 | 174.5 | -77.8 | -62.7 | 0 | 0 | 0 | 115.6 | ||||
| 78 | V | 45.3 | Very low | 45.7 | Very low | 137 Ų | 137 | 136.9 Ų | 136.9 | 83% | 0.83 | 71% | 0.713 | S | S | * | * | -145.3 | 91.6 | 128.9 | -177.7 | 0 | 0 | 0 | 0 | 108.5 | V80 | V78-V80 HydrophobicContact CG1-CG2 4.42Å; V78-V80 PolarHBondContact O-N 2.77Å | |||
| 79 | R | 39 | Very low | 46.3 | Very low | 209 Ų | 209 | 133.6 Ų | 133.6 | 79% | 0.789 | 70% | 0.696 | S | S | * | * | trans | -91.1 | 100.1 | 179 | -162.9 | 170 | -171.4 | 137.5 | 2.2 | 111.2 | ||||
| 80 | V | 46.2 | Very low | 46.7 | Very low | 123 Ų | 123 | 135.1 Ų | 135.1 | 75% | 0.745 | 69% | 0.694 | S | S | * | * | trans | -98.9 | 127.6 | 162.9 | 175.7 | 0 | 0 | 0 | 0 | 108 | V78 S82 | V78-V80 HydrophobicContact CG1-CG2 4.42Å; V78-V80 PolarHBondContact O-N 2.77Å; V80-S82 PolarHBondContact O-N 2.74Å | ||
| 81 | D | 43.1 | Very low | 47.5 | Very low | 126 Ų | 126 | 131.1 Ų | 131.1 | 67% | 0.674 | 69% | 0.685 | S | S | * | * | trans | -64.9 | 92.2 | -171.1 | -64.1 | -53.4 | 0 | 0 | 0 | 113.5 | ||||
| 82 | S | 51.3 | Low | 48.3 | Very low | 75 Ų | 75 | 128.4 Ų | 128.4 | 52% | 0.524 | 67% | 0.671 | S | S | . | * | trans | -76.1 | -23.7 | -177.2 | -159.7 | 0 | 0 | 0 | 0 | 113.5 | V80 S85 | V80-S82 PolarHBondContact O-N 2.74Å; S82-S85 PolarHBondContact O-N 3.32Å | ||
| 83 | E | 46.8 | Very low | 48.8 | Very low | 155 Ų | 155 | 128 Ų | 128 | 72% | 0.724 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -75.7 | -29.4 | -168.8 | -60.3 | -169.4 | 163.4 | 0 | 0 | 113.8 | S85 Q86 | E83-S85 VanDerWaalsContact C-N 3.32Å; E83-S85 PolarHBondContact O-N 2.94Å; E83-Q86 PolarHBondContact O-N 2.93Å |
| 84 | R | 44 | Very low | 49.3 | Very low | 203 Ų | 203 | 126.5 Ų | 126.5 | 77% | 0.766 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -74.1 | -23.9 | 178 | -157.4 | 172.9 | -167.2 | -170.4 | 3.9 | 113.2 | V88 | R84-V88 WeakPolarHBondContact O-CG2 3.24Å |
| 85 | S | 46.4 | Very low | 49.8 | Very low | 84 Ų | 84 | 127.4 Ų | 127.4 | 59% | 0.587 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -76.5 | -27.1 | 177.8 | -63 | 0 | 0 | 0 | 0 | 112.5 | S82 E83 S89 | S82-S85 PolarHBondContact O-N 3.32Å; E83-S85 VanDerWaalsContact C-N 3.32Å; E83-S85 PolarHBondContact O-N 2.94Å; S85-S89 WeakPolarHBondContact O-CB 3.43Å; S85-S89 PolarHBondContact O-N 2.99Å; S85-S89 PolarHBondContact O-OG 3.37Å |
| 86 | Q | 50.4 | Low | 50.2 | Low | 116 Ų | 116 | 128.4 Ų | 128.4 | 54% | 0.542 | 66% | 0.655 | S | S | . | * | H | α-helix | trans | -73.7 | -49.6 | -179.9 | -66 | -177.3 | 3.6 | 0 | 0 | 111.3 | E83 V88 S89 E90 | E83-Q86 PolarHBondContact O-N 2.93Å; Q86-V88 PolarHBondContact O-N 3.16Å; Q86-S89 PolarHBondContact O-N 3.47Å; Q86-S89 VanDerWaalsContact O-N 3.08Å; Q86-S89 PolarHBondContact O-OG 2.87Å; Q86-E90 PolarHBondContact O-N 3.49Å |
| 87 | Q | 48.1 | Very low | 50.7 | Low | 146 Ų | 146 | 125.4 Ų | 125.4 | 68% | 0.682 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -58.9 | -41.5 | 177.2 | -74.7 | -173.9 | -33.7 | 0 | 0 | 113.4 | S89 E90 E91 | Q87-S89 VanDerWaalsContact C-N 3.32Å; Q87-S89 PolarHBondContact O-N 2.94Å; Q87-E90 PolarHBondContact O-N 2.7Å; Q87-E91 PolarHBondContact O-N 3.03Å |
| 88 | V | 50.5 | Low | 51.4 | Low | 71 Ų | 71 | 123.5 Ų | 123.5 | 43% | 0.43 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -69.5 | -31.4 | 177.8 | 177.8 | 0 | 0 | 0 | 0 | 111.7 | R84 Q86 I92 | R84-V88 WeakPolarHBondContact O-CG2 3.24Å; Q86-V88 PolarHBondContact O-N 3.16Å; V88-I92 HydrophobicContact CG1-CD1 3.75Å; V88-I92 HydrophobicContact CG1-CG1 4.46Å; V88-I92 WeakPolarHBondContact O-CB 3.37Å; V88-I92 VanDerWaalsContact O-CG1 3.29Å; V88-I92 WeakPolarHBondContact O-CG1 3.48Å; V88-I92 PolarHBondContact O-N 2.79Å |
| 89 | S | 55 | Low | 52.1 | Low | 63 Ų | 63 | 126.5 Ų | 126.5 | 44% | 0.441 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -69.3 | -38.1 | 175 | 74.7 | 0 | 0 | 0 | 0 | 112.5 | S85 Q86 Q87 V93 | S85-S89 WeakPolarHBondContact O-CB 3.43Å; S85-S89 PolarHBondContact O-N 2.99Å; S85-S89 PolarHBondContact O-OG 3.37Å; Q86-S89 PolarHBondContact O-N 3.47Å; Q86-S89 VanDerWaalsContact O-N 3.08Å; Q86-S89 PolarHBondContact O-OG 2.87Å; Q87-S89 VanDerWaalsContact C-N 3.32Å; Q87-S89 PolarHBondContact O-N 2.94Å; S89-V93 WeakPolarHBondContact O-CB 3.28Å; S89-V93 WeakPolarHBondContact O-CG2 3.35Å; S89-V93 PolarHBondContact O-N 2.88Å; S89-V93 VanDerWaalsContact O-N 3.11Å |
| 90 | E | 53.4 | Low | 53.1 | Low | 130 Ų | 130 | 125.6 Ų | 125.6 | 61% | 0.607 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -73.7 | -35.7 | 177.8 | -67.3 | -173.7 | 172.1 | 0 | 0 | 112.7 | Q86 Q87 N94 | Q86-E90 PolarHBondContact O-N 3.49Å; Q87-E90 PolarHBondContact O-N 2.7Å; E90-N94 PolarHBondContact O-N 2.95Å; E90-N94 PolarHBondContact O-ND2 3.23Å |
| 91 | E | 55.4 | Low | 53.3 | Low | 144 Ų | 144 | 125.3 Ų | 125.3 | 67% | 0.673 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -68.5 | -37.8 | 176.9 | -164.4 | 172.1 | -155.9 | 0 | 0 | 112.1 | Q87 | Q87-E91 PolarHBondContact O-N 3.03Å |
| 92 | I | 60 | Low | 53.7 | Low | 94 Ų | 94 | 130.2 Ų | 130.2 | 48% | 0.482 | 66% | 0.655 | S | S | . | * | H | α-helix | trans | -74 | -34.8 | 177.2 | -66 | 172.3 | 0 | 0 | 0 | 112 | V88 N94 L95 F96 | V88-I92 HydrophobicContact CG1-CD1 3.75Å; V88-I92 HydrophobicContact CG1-CG1 4.46Å; V88-I92 WeakPolarHBondContact O-CB 3.37Å; V88-I92 VanDerWaalsContact O-CG1 3.29Å; V88-I92 WeakPolarHBondContact O-CG1 3.48Å; V88-I92 PolarHBondContact O-N 2.79Å; I92-N94 VanDerWaalsContact C-N 3.34Å; I92-L95 PolarHBondContact O-N 3.38Å; I92-F96 HydrophobicContact CG2-CE2 4.5Å; I92-F96 WeakPolarHBondContact O-CD2 3.47Å |
| 93 | V | 56.7 | Low | 53.6 | Low | 97 Ų | 97 | 136.1 Ų | 136.1 | 59% | 0.588 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -68.5 | -33.5 | 176.9 | 168.5 | 0 | 0 | 0 | 0 | 111.8 | S89 L95 F96 | S89-V93 WeakPolarHBondContact O-CB 3.28Å; S89-V93 WeakPolarHBondContact O-CG2 3.35Å; S89-V93 PolarHBondContact O-N 2.88Å; S89-V93 VanDerWaalsContact O-N 3.11Å; V93-L95 VanDerWaalsContact C-N 3.27Å; V93-L95 PolarHBondContact O-N 2.98Å; V93-F96 PolarHBondContact O-N 3.36Å |
| 94 | N | 58.1 | Low | 53.7 | Low | 114 Ų | 114 | 135.1 Ų | 135.1 | 61% | 0.61 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -71.5 | -15.3 | 177.9 | -78.4 | -50.2 | 0 | 0 | 0 | 114.8 | E90 I92 F96 | E90-N94 PolarHBondContact O-N 2.95Å; E90-N94 PolarHBondContact O-ND2 3.23Å; I92-N94 VanDerWaalsContact C-N 3.34Å; N94-F96 VanDerWaalsContact C-N 3.33Å |
| 95 | L | 56.3 | Low | 54 | Low | 136 Ų | 136 | 134.9 Ų | 134.9 | 71% | 0.712 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74 | -20 | 174.2 | -87 | 154.1 | 0 | 0 | 0 | 113.8 | I92 V93 | I92-L95 PolarHBondContact O-N 3.38Å; V93-L95 VanDerWaalsContact C-N 3.27Å; V93-L95 PolarHBondContact O-N 2.98Å |
| 96 | F | 56.9 | Low | 54.3 | Low | 168 Ų | 168 | 136 Ų | 136 | 74% | 0.737 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.9 | 6.4 | -178.4 | -63.3 | -78.7 | 0 | 0 | 0 | 114.1 | I92 V93 N94 S98 | I92-F96 HydrophobicContact CG2-CE2 4.5Å; I92-F96 WeakPolarHBondContact O-CD2 3.47Å; V93-F96 PolarHBondContact O-N 3.36Å; N94-F96 VanDerWaalsContact C-N 3.33Å; F96-S98 PolarHBondContact O-N 3.5Å; F96-S98 VanDerWaalsContact O-N 3.09Å |
| 97 | V | 59.4 | Low | 54.4 | Low | 92 Ų | 92 | 139.5 Ų | 139.5 | 56% | 0.558 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -70.2 | 107.3 | 171.5 | 178.4 | 0 | 0 | 0 | 0 | 109 | K99 | V97-K99 PolarHBondContact O-N 3.02Š|
| 98 | S | 58.3 | Low | 54.6 | Low | 110 Ų | 110 | 137.1 Ų | 137.1 | 77% | 0.769 | 69% | 0.686 | S | S | * | * | trans | -51.6 | 103.3 | 173.4 | -54.4 | 0 | 0 | 0 | 0 | 110.4 | F96 K100 | F96-S98 PolarHBondContact O-N 3.5Å; F96-S98 VanDerWaalsContact O-N 3.09Å; S98-K100 PolarHBondContact O-N 3.4Å | ||
| 99 | K | 58.3 | Low | 54.9 | Low | 201 Ų | 201 | 139.4 Ų | 139.4 | 87% | 0.874 | 70% | 0.7 | S | S | * | * | trans | -57.6 | 113.2 | 174.2 | -73.3 | -177.6 | 179.3 | 173.1 | 0 | 107.7 | V97 | V97-K99 PolarHBondContact O-N 3.02Š| ||
| 100 | K | 61.1 | Low | 55 | Low | 190 Ų | 190 | 142.4 Ų | 142.4 | 83% | 0.826 | 71% | 0.707 | S | S | * | * | trans | -43.4 | 129.2 | 173.1 | -68.1 | 178.6 | 180 | 176.6 | 0 | 107.6 | S98 R102 | S98-K100 PolarHBondContact O-N 3.4Å; K100-R102 PolarHBondContact O-N 2.88Å | ||
| 101 | P | 49.9 | Very low | 55.6 | Low | 116 Ų | 116 | 142.9 Ų | 142.9 | 75% | 0.753 | 72% | 0.719 | S | S | * | * | trans | -55.3 | 118.5 | -174.6 | 21.8 | -32.8 | 0 | 0 | 0 | 108 | K103 | P101-K103 PolarHBondContact O-N 3.48Š| ||
| 102 | R | 52 | Low | 56 | Low | 230 Ų | 230 | 141.8 Ų | 141.8 | 87% | 0.868 | 72% | 0.717 | S | S | * | * | trans | -58 | 107.3 | 172.7 | -84.7 | -177.3 | 172.8 | 166.8 | -3.5 | 105.6 | K100 I104 | K100-R102 PolarHBondContact O-N 2.88Å; R102-I104 HydrophobicContact CB-CG1 4.28Å; R102-I104 PolarHBondContact O-N 3.04Å | ||
| 103 | K | 48.8 | Very low | 56.1 | Low | 198 Ų | 198 | 139.1 Ų | 139.1 | 86% | 0.861 | 71% | 0.706 | S | S | * | * | trans | -66.2 | 81 | 166.5 | -71.2 | -170.3 | 178.5 | -176 | 0 | 106.6 | P101 K105 | P101-K103 PolarHBondContact O-N 3.48Å; K103-K105 PolarHBondContact O-N 2.81Å | ||
| 104 | I | 49.5 | Very low | 56.5 | Low | 135 Ų | 135 | 138.6 Ų | 138.6 | 69% | 0.692 | 70% | 0.704 | S | S | * | * | trans | -64.6 | 94.8 | 167 | -57.8 | 177.2 | 0 | 0 | 0 | 104.5 | R102 V106 | R102-I104 HydrophobicContact CB-CG1 4.28Å; R102-I104 PolarHBondContact O-N 3.04Å; I104-V106 HydrophobicContact CG2-CG2 3.84Å; I104-V106 PolarHBondContact O-N 3.04Å | ||
| 105 | K | 50.2 | Low | 56.8 | Low | 197 Ų | 197 | 137.3 Ų | 137.3 | 86% | 0.857 | 70% | 0.7 | S | S | * | * | trans | -65.2 | 84 | 162.1 | -77.7 | -173.7 | 174.8 | -176.8 | 0 | 106.2 | K103 K107 | K103-K105 PolarHBondContact O-N 2.81Å; K105-K107 PolarHBondContact O-N 3.36Å | ||
| 106 | V | 52.5 | Low | 57.2 | Low | 107 Ų | 107 | 137 Ų | 137 | 65% | 0.648 | 70% | 0.7 | S | S | * | * | trans | -58.5 | 108.7 | 162.1 | 179.8 | 0 | 0 | 0 | 0 | 104.8 | I104 T108 | I104-V106 HydrophobicContact CG2-CG2 3.84Å; I104-V106 PolarHBondContact O-N 3.04Å; V106-T108 VanDerWaalsContact C-N 3.28Å; V106-T108 PolarHBondContact O-N 3.3Å; V106-T108 PolarHBondContact O-OG1 2.94Å | ||
| 107 | K | 52.3 | Low | 57.8 | Low | 190 Ų | 190 | 135.1 Ų | 135.1 | 83% | 0.826 | 69% | 0.693 | S | S | * | * | trans | -63.2 | 99.4 | 167.7 | -93.1 | -174.6 | 171.8 | -177.5 | 0 | 105.9 | K105 T109 | K105-K107 PolarHBondContact O-N 3.36Å; K107-T109 PolarHBondContact O-N 3.26Å | ||
| 108 | T | 51.8 | Low | 58.4 | Low | 96 Ų | 96 | 135.3 Ų | 135.3 | 59% | 0.589 | 70% | 0.696 | S | S | * | * | trans | -74.4 | 79.4 | 174.8 | -51.3 | 0 | 0 | 0 | 0 | 107.9 | V106 | V106-T108 VanDerWaalsContact C-N 3.28Å; V106-T108 PolarHBondContact O-N 3.3Å; V106-T108 PolarHBondContact O-OG1 2.94Å | ||
| 109 | T | 56.1 | Low | 59.2 | Low | 120 Ų | 120 | 131.9 Ų | 131.9 | 74% | 0.736 | 67% | 0.669 | S | S | * | * | trans | -111.6 | 44.3 | 172.4 | -45.3 | 0 | 0 | 0 | 0 | 109.1 | K107 | K107-T109 PolarHBondContact O-N 3.26Š| ||
| 110 | E | 58.1 | Low | 60.2 | Low | 126 Ų | 126 | 126.8 Ų | 126.8 | 59% | 0.589 | 65% | 0.651 | S | S | * | * | trans | -110.7 | 109.1 | 167.7 | -73.7 | -88.2 | 130 | 0 | 0 | 105.2 | L112 | E110-L112 PolarHBondContact O-N 3.14Š| ||
| 111 | V | 65.8 | Low | 61.2 | Low | 139 Ų | 139 | 129.1 Ų | 129.1 | 84% | 0.842 | 66% | 0.655 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 127.6 | 176.6 | 178.3 | 0 | 0 | 0 | 0 | 107.4 | ||
| 112 | L | 63.7 | Low | 62.8 | Low | 121 Ų | 121 | 128.2 Ų | 128.2 | 63% | 0.634 | 66% | 0.657 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 136.5 | 175.8 | -76.5 | 166.8 | 0 | 0 | 0 | 109.2 | E110 H131 | E110-L112 PolarHBondContact O-N 3.14Å; L112-H131 HydrophobicContact CD2-CB 4.03Å |
| 113 | P | 62.3 | Low | 64.2 | Low | 39 Ų | 39 | 121.1 Ų | 121.1 | 25% | 0.253 | 64% | 0.643 | S | S | . | * | P | Polyproline II helix | trans | -57.5 | 146.2 | 177.5 | -16.6 | 25.6 | 0 | 0 | 0 | 110.7 | V115 L119 S128 | P113-V115 PolarHBondContact O-N 2.93Å; P113-L119 HydrophobicContact CB-CD1 3.66Å; P113-L119 HydrophobicContact CG-CD1 3.49Å; P113-L119 VanDerWaalsContact CG-CD1 3.49Å; P113-S128 WeakPolarHBondContact CG-OG 3.23Å |
| 114 | P | 65.6 | Low | 65.8 | Low | 85 Ų | 85 | 113.8 Ų | 113.8 | 55% | 0.552 | 62% | 0.615 | S | S | * | * | P | Polyproline II helix | trans | -52.7 | 134.9 | 165.8 | -22.6 | 33.3 | 0 | 0 | 0 | 110 | D116 Q117 | P114-D116 PolarHBondContact O-N 2.97Å; P114-D116 VanDerWaalsContact O-N 3.15Å; P114-Q117 HydrophobicContact CB-CB 4.48Å; P114-Q117 PolarHBondContact O-N 3.41Å |
| 115 | V | 63.4 | Low | 67.5 | Low | 88 Ų | 88 | 110 Ų | 110 | 53% | 0.533 | 60% | 0.597 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -60.1 | -27.4 | -177.9 | 178.4 | 0 | 0 | 0 | 0 | 111.6 | P113 | P113-V115 PolarHBondContact O-N 2.93Š|
| 116 | D | 64.8 | Low | 69.2 | Low | 130 Ų | 130 | 107.1 Ų | 107.1 | 70% | 0.695 | 59% | 0.591 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.7 | -12.3 | -170.5 | -49.1 | -57.6 | 0 | 0 | 0 | 114.2 | P114 | P114-D116 PolarHBondContact O-N 2.97Å; P114-D116 VanDerWaalsContact O-N 3.15Å |
| 117 | Q | 69.8 | Low | 70.3 | Confident | 127 Ų | 127 | 109.5 Ų | 109.5 | 59% | 0.593 | 59% | 0.588 | S | S | * | * | S | Bend | trans | -94.3 | 131.8 | -176.4 | -155.8 | 73.9 | 28.2 | 0 | 0 | 110.8 | P114 L119 W132 | P114-Q117 HydrophobicContact CB-CB 4.48Å; P114-Q117 PolarHBondContact O-N 3.41Å; Q117-L119 PolarHBondContact O-N 2.92Å; Q117-W132 PolarHBondContact O-NE1 3.43Å |
| 118 | P | 72.8 | Confident | 71.7 | Confident | 96 Ų | 96 | 101.1 Ų | 101.1 | 62% | 0.623 | 55% | 0.553 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 132.3 | 168.5 | 25.8 | -33.6 | 0 | 0 | 0 | 110.1 | D120 | P118-D120 PolarHBondContact O-N 2.94Š|
| 119 | L | 74.6 | Confident | 73.2 | Confident | 38 Ų | 38 | 101.9 Ų | 101.9 | 20% | 0.199 | 55% | 0.553 | C | S | . | * | P | Polyproline II helix | trans | -68.9 | 116 | -173 | -146.1 | 70.7 | 0 | 0 | 0 | 110.9 | P113 Q117 R121 V124 S128 W132 | P113-L119 HydrophobicContact CB-CD1 3.66Å; P113-L119 HydrophobicContact CG-CD1 3.49Å; P113-L119 VanDerWaalsContact CG-CD1 3.49Å; Q117-L119 PolarHBondContact O-N 2.92Å; L119-R121 PolarHBondContact O-N 3.44Å; L119-V124 HydrophobicContact CB-CG2 4.14Å; L119-V124 HydrophobicContact CD2-CB 4.24Å; L119-V124 HydrophobicContact CD2-CG1 3.71Å; L119-V124 HydrophobicContact CD2-CG2 3.7Å; L119-V124 HydrophobicContact CG-CG2 3.75Å; L119-S128 VanDerWaalsContact CD1-OG 3.32Å; L119-S128 WeakPolarHBondContact CD1-OG 3.45Å; L119-S128 WeakPolarHBondContact CD2-OG 3.48Å; L119-W132 HydrophobicContact CB-CD2 4.41Å; L119-W132 HydrophobicContact CB-CG 4.37Å; L119-W132 HydrophobicContact CD1-CB 4.31Å; L119-W132 HydrophobicContact CD1-CG 4.03Å; L119-W132 HydrophobicContact CD2-CB 4.13Å; L119-W132 HydrophobicContact CD2-CG 4.31Å; L119-W132 HydrophobicContact CG-CG 4.48Å |
| 120 | D | 79.7 | Confident | 74.4 | Confident | 94 Ų | 94 | 102.5 Ų | 102.5 | 50% | 0.503 | 55% | 0.551 | S | S | . | * | P | Polyproline II helix | trans | -66.6 | 121.3 | -176.3 | 164.7 | 41.7 | 0 | 0 | 0 | 111.5 | P118 A122 S123 V124 | P118-D120 PolarHBondContact O-N 2.94Å; D120-A122 PolarHBondContact O-N 3.08Å; D120-A122 PolarHBondContact OD1-N 2.9Å; D120-S123 PolarHBondContact O-N 3.39Å; D120-S123 PolarHBondContact O-OG 2.68Å; D120-S123 PolarHBondContact OD2-OG 2.8Å; D120-V124 WeakPolarHBondContact O-CG2 3.31Å; D120-V124 PolarHBondContact O-N 3.01Å; D120-V124 VanDerWaalsContact O-N 3.12Å |
| 121 | R | 82.4 | Confident | 75.5 | Confident | 240 Ų | 240 | 100.8 Ų | 100.8 | 91% | 0.906 | 54% | 0.543 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.4 | -25.9 | -172.3 | -64.2 | -177.6 | -176.1 | 171.5 | 1.9 | 113.5 | L119 | L119-R121 PolarHBondContact O-N 3.44Š|
| 122 | A | 82.9 | Confident | 76.1 | Confident | 97 Ų | 97 | 98.1 Ų | 98.1 | 80% | 0.802 | 52% | 0.518 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.2 | -26.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | D120 | D120-A122 PolarHBondContact O-N 3.08Å; D120-A122 PolarHBondContact OD1-N 2.9Å |
| 123 | S | 81.4 | Confident | 76.8 | Confident | 81 Ų | 81 | 94.9 Ų | 94.9 | 57% | 0.566 | 50% | 0.503 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -110.5 | 2.2 | -175.5 | 56.7 | 0 | 0 | 0 | 0 | 114.5 | D120 T125 | D120-S123 PolarHBondContact O-N 3.39Å; D120-S123 PolarHBondContact O-OG 2.68Å; D120-S123 PolarHBondContact OD2-OG 2.8Å; S123-T125 PolarHBondContact O-N 2.78Å |
| 124 | V | 81.9 | Confident | 77.4 | Confident | 44 Ų | 44 | 95.2 Ų | 95.2 | 27% | 0.267 | 51% | 0.505 | S | S | . | . | trans | -63.8 | 107.3 | 178.1 | -179.7 | 0 | 0 | 0 | 0 | 112.2 | L119 D120 L129 | L119-V124 HydrophobicContact CB-CG2 4.14Å; L119-V124 HydrophobicContact CD2-CB 4.24Å; L119-V124 HydrophobicContact CD2-CG1 3.71Å; L119-V124 HydrophobicContact CD2-CG2 3.7Å; L119-V124 HydrophobicContact CG-CG2 3.75Å; D120-V124 WeakPolarHBondContact O-CG2 3.31Å; D120-V124 PolarHBondContact O-N 3.01Å; D120-V124 VanDerWaalsContact O-N 3.12Å; V124-L129 HydrophobicContact CG1-CB 3.91Å; V124-L129 HydrophobicContact CG1-CD1 3.54Å; V124-L129 HydrophobicContact CG1-CG 3.55Å | ||
| 125 | T | 85.4 | Confident | 77.6 | Confident | 54 Ų | 54 | 95.5 Ų | 95.5 | 33% | 0.331 | 51% | 0.506 | S | S | . | . | trans | -77.9 | 150.2 | 161 | 68.5 | 0 | 0 | 0 | 0 | 110.6 | S123 R127 S128 L129 | S123-T125 PolarHBondContact O-N 2.78Å; T125-R127 PolarHBondContact O-N 2.81Å; T125-R127 VanDerWaalsContact O-N 3.11Å; T125-S128 WeakPolarHBondContact O-CA 3.46Å; T125-S128 VanDerWaalsContact O-CB 3.26Å; T125-S128 WeakPolarHBondContact O-CB 3.38Å; T125-S128 PolarHBondContact O-N 3.33Å; T125-S128 VanDerWaalsContact OG1-CB 3.3Å; T125-S128 WeakPolarHBondContact OG1-CB 3.34Å; T125-S128 PolarHBondContact OG1-N 3.16Å; T125-S128 VanDerWaalsContact OG1-N 3.17Å; T125-L129 PolarHBondContact O-N 3.31Å | ||
| 126 | L | 85.2 | Confident | 78.1 | Confident | 138 Ų | 138 | 98.4 Ų | 98.4 | 72% | 0.723 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -54.4 | -33.7 | 175.7 | 179.2 | 64.4 | 0 | 0 | 0 | 112.1 | L129 L130 | L126-L129 WeakPolarHBondContact O-CB 3.47Å; L126-L129 PolarHBondContact O-N 3.13Å; L126-L130 WeakPolarHBondContact O-CB 3.36Å; L126-L130 PolarHBondContact O-N 2.84Å |
| 127 | R | 77 | Confident | 78.6 | Confident | 156 Ų | 156 | 100.1 Ų | 100.1 | 59% | 0.589 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -70 | -39.8 | 177.4 | -169.3 | 174.8 | -171.8 | 97.1 | 4.9 | 112.1 | T125 L130 H131 | T125-R127 PolarHBondContact O-N 2.81Å; T125-R127 VanDerWaalsContact O-N 3.11Å; R127-L130 PolarHBondContact O-N 3.17Å; R127-H131 PolarHBondContact O-CD2 3.22Å; R127-H131 PolarHBondContact O-N 3.34Å |
| 128 | S | 81 | Confident | 78.6 | Confident | 14 Ų | 14 | 98.4 Ų | 98.4 | 10% | 0.098 | 52% | 0.52 | C | S | . | . | H | α-helix | trans | -60 | -47.7 | 171.6 | -172.7 | 0 | 0 | 0 | 0 | 110.9 | P113 L119 T125 L130 H131 W132 | P113-S128 WeakPolarHBondContact CG-OG 3.23Å; L119-S128 VanDerWaalsContact CD1-OG 3.32Å; L119-S128 WeakPolarHBondContact CD1-OG 3.45Å; L119-S128 WeakPolarHBondContact CD2-OG 3.48Å; T125-S128 WeakPolarHBondContact O-CA 3.46Å; T125-S128 VanDerWaalsContact O-CB 3.26Å; T125-S128 WeakPolarHBondContact O-CB 3.38Å; T125-S128 PolarHBondContact O-N 3.33Å; T125-S128 VanDerWaalsContact OG1-CB 3.3Å; T125-S128 WeakPolarHBondContact OG1-CB 3.34Å; T125-S128 PolarHBondContact OG1-N 3.16Å; T125-S128 VanDerWaalsContact OG1-N 3.17Å; S128-L130 VanDerWaalsContact C-N 3.26Å; S128-L130 PolarHBondContact O-N 2.99Å; S128-H131 PolarHBondContact O-N 3.17Å; S128-H131 VanDerWaalsContact O-N 3.15Å; S128-W132 WeakPolarHBondContact O-CB 3.43Å; S128-W132 PolarHBondContact O-N 2.87Å |
| 129 | L | 84.2 | Confident | 78.4 | Confident | 112 Ų | 112 | 95.4 Ų | 95.4 | 59% | 0.586 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -56.8 | -34.2 | 173.7 | -124 | 167.8 | 0 | 0 | 0 | 113.6 | V124 T125 L126 | V124-L129 HydrophobicContact CG1-CB 3.91Å; V124-L129 HydrophobicContact CG1-CD1 3.54Å; V124-L129 HydrophobicContact CG1-CG 3.55Å; T125-L129 PolarHBondContact O-N 3.31Å; L126-L129 WeakPolarHBondContact O-CB 3.47Å; L126-L129 PolarHBondContact O-N 3.13Å |
| 130 | L | 81.5 | Confident | 78.1 | Confident | 133 Ų | 133 | 96.9 Ų | 96.9 | 70% | 0.696 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -81.1 | -16.8 | -178 | -146.3 | 124.7 | 0 | 0 | 0 | 113.8 | L126 R127 S128 | L126-L130 WeakPolarHBondContact O-CB 3.36Å; L126-L130 PolarHBondContact O-N 2.84Å; R127-L130 PolarHBondContact O-N 3.17Å; S128-L130 VanDerWaalsContact C-N 3.26Å; S128-L130 PolarHBondContact O-N 2.99Å |
| 131 | H | 80.8 | Confident | 77.6 | Confident | 90 Ų | 90 | 97.3 Ų | 97.3 | 42% | 0.417 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -114.5 | -16.6 | -178.1 | -68.6 | -54.4 | 0 | 0 | 0 | 114.2 | L112 R127 S128 V133 | L112-H131 HydrophobicContact CD2-CB 4.03Å; R127-H131 PolarHBondContact O-CD2 3.22Å; R127-H131 PolarHBondContact O-N 3.34Å; S128-H131 PolarHBondContact O-N 3.17Å; S128-H131 VanDerWaalsContact O-N 3.15Å; H131-V133 PolarHBondContact O-N 3.01Å |
| 132 | W | 78.3 | Confident | 77.1 | Confident | 84 Ų | 84 | 93.7 Ų | 93.7 | 32% | 0.318 | 51% | 0.505 | S | S | . | . | trans | -68 | 126.9 | 176.9 | -172.3 | 80.4 | 0 | 0 | 0 | 111.3 | Q117 L119 S128 P134 | Q117-W132 PolarHBondContact O-NE1 3.43Å; L119-W132 HydrophobicContact CB-CD2 4.41Å; L119-W132 HydrophobicContact CB-CG 4.37Å; L119-W132 HydrophobicContact CD1-CB 4.31Å; L119-W132 HydrophobicContact CD1-CG 4.03Å; L119-W132 HydrophobicContact CD2-CB 4.13Å; L119-W132 HydrophobicContact CD2-CG 4.31Å; L119-W132 HydrophobicContact CG-CG 4.48Å; S128-W132 WeakPolarHBondContact O-CB 3.43Å; S128-W132 PolarHBondContact O-N 2.87Å; W132-P134 HydrophobicContact CE3-CB 4.37Å; W132-P134 HydrophobicContact CE3-CG 4.37Å; W132-P134 HydrophobicContact CH2-CB 3.59Å; W132-P134 HydrophobicContact CH2-CG 4.38Å; W132-P134 HydrophobicContact CZ2-CB 4.43Å; W132-P134 HydrophobicContact CZ3-CB 3.56Å; W132-P134 HydrophobicContact CZ3-CG 3.82Å | ||
| 133 | V | 78.2 | Confident | 75.9 | Confident | 53 Ų | 53 | 95.9 Ų | 95.9 | 32% | 0.321 | 49% | 0.493 | S | S | . | . | trans | -112.9 | 111.5 | 178.6 | 174.7 | 0 | 0 | 0 | 0 | 108.1 | H131 T135 | H131-V133 PolarHBondContact O-N 3.01Å; V133-T135 PolarHBondContact O-N 3.22Å | ||
| 134 | P | 74.5 | Confident | 74.9 | Confident | 45 Ų | 45 | 96.4 Ų | 96.4 | 29% | 0.292 | 49% | 0.486 | S | S | . | . | trans | -62.3 | 128.9 | 172.7 | 19.8 | -26.7 | 0 | 0 | 0 | 110.4 | W132 N136 K137 | W132-P134 HydrophobicContact CE3-CB 4.37Å; W132-P134 HydrophobicContact CE3-CG 4.37Å; W132-P134 HydrophobicContact CH2-CB 3.59Å; W132-P134 HydrophobicContact CH2-CG 4.38Å; W132-P134 HydrophobicContact CZ2-CB 4.43Å; W132-P134 HydrophobicContact CZ3-CB 3.56Å; W132-P134 HydrophobicContact CZ3-CG 3.82Å; P134-N136 PolarHBondContact O-N 3.39Å; P134-N136 VanDerWaalsContact O-N 3.09Å; P134-K137 HydrophobicContact CG-CB 4.27Å; P134-K137 CarbonylContact O-C 3.56Å; P134-K137 PolarHBondContact O-N 3.01Å | ||
| 135 | T | 69.8 | Low | 73.7 | Confident | 91 Ų | 91 | 101.1 Ų | 101.1 | 56% | 0.558 | 51% | 0.506 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -49.3 | -37.5 | 178 | 52.3 | 0 | 0 | 0 | 0 | 113.3 | V133 K137 | V133-T135 PolarHBondContact O-N 3.22Å; T135-K137 VanDerWaalsContact C-N 3.28Å; T135-K137 PolarHBondContact O-N 3.49Å |
| 136 | N | 74 | Confident | 72.3 | Confident | 149 Ų | 149 | 107.8 Ų | 107.8 | 80% | 0.797 | 53% | 0.525 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.8 | -9.7 | -180 | -62.8 | -22.3 | 0 | 0 | 0 | 114.8 | P134 | P134-N136 PolarHBondContact O-N 3.39Å; P134-N136 VanDerWaalsContact O-N 3.09Å |
| 137 | K | 75 | Confident | 70.9 | Confident | 166 Ų | 166 | 106.3 Ų | 106.3 | 72% | 0.722 | 52% | 0.517 | S | S | * | . | S | Bend | trans | -144.1 | 77.3 | -179.4 | -64.2 | -172.8 | -179.4 | -177 | 0 | 110.4 | P134 T135 | P134-K137 HydrophobicContact CG-CB 4.27Å; P134-K137 CarbonylContact O-C 3.56Å; P134-K137 PolarHBondContact O-N 3.01Å; T135-K137 VanDerWaalsContact C-N 3.28Å; T135-K137 PolarHBondContact O-N 3.49Å |
| 138 | P | 70.9 | Confident | 69.7 | Low | 92 Ų | 92 | 104.8 Ų | 104.8 | 60% | 0.597 | 52% | 0.52 | S | S | * | . | P | Polyproline II helix | trans | -55.7 | 149.3 | 171.6 | 25.2 | -34.8 | 0 | 0 | 0 | 110.6 | ||
| 139 | P | 68.9 | Low | 68.3 | Low | 33 Ų | 33 | 108.6 Ų | 108.6 | 21% | 0.214 | 55% | 0.547 | C | S | . | . | P | Polyproline II helix | trans | -61 | 137.8 | 179.3 | 26.5 | -34.9 | 0 | 0 | 0 | 109.9 | T141 R143 | P139-T141 PolarHBondContact O-N 2.9Å; P139-R143 HydrophobicContact CB-CB 4Å |
| 140 | P | 67.7 | Low | 66.8 | Low | 69 Ų | 69 | 108.7 Ų | 108.7 | 45% | 0.448 | 55% | 0.553 | S | S | . | * | P | Polyproline II helix | trans | -56.1 | 141.3 | 176.4 | 24 | -34.8 | 0 | 0 | 0 | 110.4 | Y142 R143 | P140-Y142 HydrophobicContact CB-CD1 3.94Å; P140-Y142 HydrophobicContact CB-CE1 3.83Å; P140-Y142 HydrophobicContact CG-CD1 3.99Å; P140-Y142 HydrophobicContact CG-CE1 3.43Å; P140-Y142 VanDerWaalsContact CG-CE1 3.43Å; P140-Y142 PolarHBondContact O-N 2.84Å; P140-R143 PolarHBondContact O-N 2.75Å |
| 141 | T | 68.5 | Low | 65.1 | Low | 103 Ų | 103 | 107.7 Ų | 107.7 | 63% | 0.632 | 55% | 0.552 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -49.6 | -35.1 | -161.6 | -39.5 | 0 | 0 | 0 | 0 | 114.5 | P139 R143 Q144 | P139-T141 PolarHBondContact O-N 2.9Å; T141-R143 PolarHBondContact O-N 2.99Å; T141-Q144 WeakPolarHBondContact O-CB 3.24Å; T141-Q144 PolarHBondContact O-N 2.82Å |
| 142 | Y | 71.6 | Confident | 62.7 | Low | 163 Ų | 163 | 108.8 Ų | 108.8 | 64% | 0.639 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -58.3 | -20.2 | 177 | 81.4 | -96.9 | 0 | 0 | 0 | 114.7 | P140 | P140-Y142 HydrophobicContact CB-CD1 3.94Å; P140-Y142 HydrophobicContact CB-CE1 3.83Å; P140-Y142 HydrophobicContact CG-CD1 3.99Å; P140-Y142 HydrophobicContact CG-CE1 3.43Å; P140-Y142 VanDerWaalsContact CG-CE1 3.43Å; P140-Y142 PolarHBondContact O-N 2.84Å |
| 143 | R | 59.3 | Low | 60.6 | Low | 144 Ų | 144 | 110 Ų | 110 | 54% | 0.543 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -78.8 | -28.8 | 174.1 | -102.5 | -176.3 | 177.7 | 164.3 | 0.1 | 113.1 | P139 P140 T141 R146 L147 | P139-R143 HydrophobicContact CB-CB 4Å; P140-R143 PolarHBondContact O-N 2.75Å; T141-R143 PolarHBondContact O-N 2.99Å; R143-R146 PolarHBondContact O-N 2.97Å; R143-L147 PolarHBondContact O-N 2.89Å |
| 144 | Q | 59.3 | Low | 58.6 | Low | 91 Ų | 91 | 116 Ų | 116 | 43% | 0.425 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -65.9 | -41.9 | -177.2 | -67.3 | 178.1 | -25.7 | 0 | 0 | 111.1 | T141 R146 L147 N148 | T141-Q144 WeakPolarHBondContact O-CB 3.24Å; T141-Q144 PolarHBondContact O-N 2.82Å; Q144-R146 PolarHBondContact O-N 2.96Å; Q144-L147 PolarHBondContact O-N 3.09Å; Q144-L147 VanDerWaalsContact O-N 3.13Å; Q144-N148 PolarHBondContact O-N 3.19Å; Q144-N148 VanDerWaalsContact O-N 3.11Å; Q144-N148 PolarHBondContact O-OD1 3.33Å |
| 145 | E | 56 | Low | 56.8 | Low | 143 Ų | 143 | 118.8 Ų | 118.8 | 67% | 0.668 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -55.2 | -36.4 | 175.1 | -62.1 | -175.4 | 164.5 | 0 | 0 | 112.5 | S149 | E145-S149 WeakPolarHBondContact O-CB 3.43Å; E145-S149 PolarHBondContact O-N 3.11Å; E145-S149 PolarHBondContact O-OG 2.84Å |
| 146 | R | 56.7 | Low | 55.3 | Low | 195 Ų | 195 | 120 Ų | 120 | 74% | 0.736 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -76.9 | -30 | -178.4 | -155.3 | 172.7 | -167.1 | 143.6 | 1.3 | 113.4 | R143 Q144 T150 | R143-R146 PolarHBondContact O-N 2.97Å; Q144-R146 PolarHBondContact O-N 2.96Å; R146-T150 PolarHBondContact O-OG1 3.38Å |
| 147 | L | 56.4 | Low | 53.6 | Low | 107 Ų | 107 | 120.4 Ų | 120.4 | 56% | 0.56 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -73.1 | -46.1 | 175.5 | -67.6 | 174.3 | 0 | 0 | 0 | 110.7 | R143 Q144 S149 T150 | R143-L147 PolarHBondContact O-N 2.89Å; Q144-L147 PolarHBondContact O-N 3.09Å; Q144-L147 VanDerWaalsContact O-N 3.13Å; L147-S149 PolarHBondContact O-N 2.88Å; L147-T150 PolarHBondContact O-N 3.05Å |
| 148 | N | 51.9 | Low | 52.2 | Low | 123 Ų | 123 | 119.4 Ų | 119.4 | 66% | 0.658 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -61.9 | -30.8 | 178.4 | -61.5 | 1.5 | 0 | 0 | 0 | 112.1 | Q144 T150 | Q144-N148 PolarHBondContact O-N 3.19Å; Q144-N148 VanDerWaalsContact O-N 3.11Å; Q144-N148 PolarHBondContact O-OD1 3.33Å; N148-T150 PolarHBondContact O-N 3.33Å |
| 149 | S | 51.1 | Low | 50.7 | Low | 94 Ų | 94 | 123.2 Ų | 123.2 | 66% | 0.657 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.4 | -12.8 | 176 | -60.4 | 0 | 0 | 0 | 0 | 114.7 | E145 L147 | E145-S149 WeakPolarHBondContact O-CB 3.43Å; E145-S149 PolarHBondContact O-N 3.11Å; E145-S149 PolarHBondContact O-OG 2.84Å; L147-S149 PolarHBondContact O-N 2.88Å |
| 150 | T | 53 | Low | 49.2 | Very low | 115 Ų | 115 | 125.8 Ų | 125.8 | 71% | 0.706 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.5 | -11.6 | -167.9 | -53.2 | 0 | 0 | 0 | 0 | 113.6 | R146 L147 N148 | R146-T150 PolarHBondContact O-OG1 3.38Å; L147-T150 PolarHBondContact O-N 3.05Å; N148-T150 PolarHBondContact O-N 3.33Å |
| 151 | T | 44.6 | Very low | 47.8 | Very low | 112 Ų | 112 | 128.5 Ų | 128.5 | 69% | 0.687 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -105.8 | -8 | -170.6 | 46.3 | 0 | 0 | 0 | 0 | 115.8 | ||
| 152 | C | 31.4 | Very low | 46.3 | Very low | 113 Ų | 113 | 130.4 Ų | 130.4 | 76% | 0.764 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -127.7 | 74 | -175.4 | -69.2 | 0 | 0 | 0 | 0 | 113.5 | ||
| 153 | S | 32.8 | Very low | 45.2 | Very low | 108 Ų | 108 | 131.1 Ų | 131.1 | 76% | 0.755 | 73% | 0.731 | S | S | * | * | trans | -169.8 | 69.5 | 157.5 | 15.7 | 0 | 0 | 0 | 0 | 111 | ||||
| 154 | L | 36.3 | Very low | 44.2 | Very low | 181 Ų | 181 | 129.4 Ų | 129.4 | 95% | 0.948 | 73% | 0.733 | S | S | * | * | trans | -113.1 | 53.1 | 175 | -108.9 | 168.9 | 0 | 0 | 0 | 110.8 | ||||
| 155 | S | 36.5 | Very low | 43.4 | Very low | 102 Ų | 102 | 133.3 Ų | 133.3 | 71% | 0.713 | 76% | 0.756 | S | S | * | * | trans | -170.1 | 149.3 | 173.6 | 50.4 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 156 | S | 39.1 | Very low | 42.7 | Very low | 116 Ų | 116 | 134 Ų | 134 | 81% | 0.811 | 76% | 0.756 | S | S | * | * | trans | 78.1 | 133 | 175.4 | 74.6 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 157 | D | 37.6 | Very low | 41.9 | Very low | 159 Ų | 159 | 129.7 Ų | 129.7 | 85% | 0.85 | 76% | 0.756 | S | S | * | * | trans | -97.3 | 132.9 | -172 | -44.6 | -98.2 | 0 | 0 | 0 | 111.5 | ||||
| 158 | V | 47.3 | Very low | 41.4 | Very low | 144 Ų | 144 | 131.7 Ų | 131.7 | 87% | 0.873 | 76% | 0.762 | S | S | * | * | trans | -145.7 | 135.7 | 157 | -167.9 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 159 | E | 38.4 | Very low | 40.6 | Very low | 172 Ų | 172 | 132.9 Ų | 132.9 | 80% | 0.804 | 77% | 0.769 | S | S | * | * | trans | -27.7 | 139.4 | 169.1 | -75.5 | -86.3 | 117 | 0 | 0 | 119.9 | ||||
| 160 | A | 37.8 | Very low | 40.1 | Very low | 88 Ų | 88 | 133.9 Ų | 133.9 | 73% | 0.727 | 77% | 0.767 | S | S | * | * | trans | 10.7 | 122.8 | 142.7 | 0 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 161 | S | 37.8 | Very low | 39.5 | Very low | 126 Ų | 126 | 135.5 Ų | 135.5 | 88% | 0.881 | 77% | 0.771 | S | S | * | * | -150.3 | 130 | 125.3 | 56.7 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 162 | D | 36.9 | Very low | 39.1 | Very low | 142 Ų | 142 | 136.5 Ų | 136.5 | 76% | 0.759 | 78% | 0.777 | S | S | * | * | trans | -89.5 | 143.5 | -174.2 | -175.4 | 11.8 | 0 | 0 | 0 | 111.6 | D164 | D162-D164 PolarHBondContact OD1-N 3.05Š| ||
| 163 | H | 47.9 | Very low | 39.5 | Very low | 179 Ų | 179 | 139.4 Ų | 139.4 | 83% | 0.829 | 78% | 0.78 | S | S | * | * | trans | -154.9 | 66 | 169.4 | -106.8 | -49.6 | 0 | 0 | 0 | 113.4 | L165 | H163-L165 PolarHBondContact O-N 3.08Š| ||
| 164 | D | 38.6 | Very low | 39.6 | Very low | 107 Ų | 107 | 140.3 Ų | 140.3 | 57% | 0.572 | 78% | 0.78 | S | S | * | * | trans | 22.6 | 92.3 | 137.3 | -151.5 | 14.7 | 0 | 0 | 0 | 116.9 | D162 K166 | D162-D164 PolarHBondContact OD1-N 3.05Å; D164-K166 PolarHBondContact O-N 2.72Å; D164-K166 IonicContact OD1-NZ 3.01Å; D164-K166 PolarHBondContact OD1-NZ 3.47Å; D164-K166 IonicContact OD2-NZ 3.16Å; D164-K166 PolarHBondContact OD2-NZ 3.42Å | ||
| 165 | L | 43.1 | Very low | 39.7 | Very low | 174 Ų | 174 | 137.2 Ų | 137.2 | 91% | 0.911 | 77% | 0.771 | S | S | * | * | trans | -85.1 | 85.8 | 166.4 | -76.5 | 172 | 0 | 0 | 0 | 110.2 | H163 S167 | H163-L165 PolarHBondContact O-N 3.08Å; L165-S167 PolarHBondContact O-N 3.34Å | ||
| 166 | K | 42.4 | Very low | 39.5 | Very low | 157 Ų | 157 | 137.7 Ų | 137.7 | 68% | 0.683 | 77% | 0.766 | S | S | * | * | trans | -80.2 | 104.2 | 166.8 | -81.2 | -179.1 | 173.7 | 62.9 | 0 | 110.8 | D164 H168 | D164-K166 PolarHBondContact O-N 2.72Å; D164-K166 IonicContact OD1-NZ 3.01Å; D164-K166 PolarHBondContact OD1-NZ 3.47Å; D164-K166 IonicContact OD2-NZ 3.16Å; D164-K166 PolarHBondContact OD2-NZ 3.42Å; K166-H168 PolarHBondContact O-N 3.18Å | ||
| 167 | S | 39.1 | Very low | 39.7 | Very low | 105 Ų | 105 | 140.6 Ų | 140.6 | 73% | 0.734 | 77% | 0.771 | S | S | * | * | trans | -56.8 | 126.8 | 157.8 | 47.4 | 0 | 0 | 0 | 0 | 109.2 | L165 | L165-S167 PolarHBondContact O-N 3.34Š| ||
| 168 | H | 44.8 | Very low | 40.1 | Very low | 149 Ų | 149 | 140.2 Ų | 140.2 | 69% | 0.69 | 76% | 0.762 | S | S | * | * | trans | -118.7 | 91.7 | 169.9 | -149.6 | -52 | 0 | 0 | 0 | 107.5 | K166 N170 | K166-H168 PolarHBondContact O-N 3.18Å; H168-N170 PolarHBondContact CE1-OD1 3.44Å; H168-N170 PolarHBondContact ND1-ND2 3.3Å; H168-N170 PolarHBondContact ND1-OD1 3.46Å; H168-N170 PolarHBondContact O-N 3.46Å; H168-N170 PolarHBondContact O-ND2 2.87Å | ||
| 169 | D | 35.5 | Very low | 39.6 | Very low | 148 Ų | 148 | 142.2 Ų | 142.2 | 79% | 0.791 | 76% | 0.762 | S | S | * | * | trans | -57.6 | 120.5 | 163.2 | -63.2 | -50.3 | 0 | 0 | 0 | 107 | ||||
| 170 | N | 41.4 | Very low | 39.4 | Very low | 114 Ų | 114 | 141.5 Ų | 141.5 | 61% | 0.61 | 76% | 0.764 | S | S | * | * | trans | -129.2 | 119.9 | 168.5 | -72.6 | -63 | 0 | 0 | 0 | 105.8 | H168 T172 | H168-N170 PolarHBondContact CE1-OD1 3.44Å; H168-N170 PolarHBondContact ND1-ND2 3.3Å; H168-N170 PolarHBondContact ND1-OD1 3.46Å; H168-N170 PolarHBondContact O-N 3.46Å; H168-N170 PolarHBondContact O-ND2 2.87Å; N170-T172 PolarHBondContact O-N 2.72Å; N170-T172 VanDerWaalsContact O-N 3.15Å | ||
| 171 | N | 39.6 | Very low | 39.6 | Very low | 150 Ų | 150 | 142.2 Ų | 142.2 | 80% | 0.802 | 76% | 0.763 | S | S | * | * | trans | -53.1 | 120.2 | 177.5 | -67.9 | -30.3 | 0 | 0 | 0 | 109.6 | E173 | N171-E173 VanDerWaalsContact C-N 3.28Å; N171-E173 PolarHBondContact O-N 2.97Å | ||
| 172 | T | 36.5 | Very low | 39.6 | Very low | 132 Ų | 132 | 140.3 Ų | 140.3 | 81% | 0.81 | 76% | 0.755 | S | S | * | * | trans | -76.3 | 89 | 164.1 | -58.5 | 0 | 0 | 0 | 0 | 106.9 | N170 T174 | N170-T172 PolarHBondContact O-N 2.72Å; N170-T172 VanDerWaalsContact O-N 3.15Å; T172-T174 PolarHBondContact O-N 2.75Å; T172-T174 VanDerWaalsContact O-N 3.12Å | ||
| 173 | E | 39.3 | Very low | 39.4 | Very low | 175 Ų | 175 | 143.5 Ų | 143.5 | 82% | 0.818 | 76% | 0.762 | S | S | * | * | trans | -62 | 111.7 | 166.6 | -70.6 | 177.8 | 164.2 | 0 | 0 | 108.1 | N171 | N171-E173 VanDerWaalsContact C-N 3.28Å; N171-E173 PolarHBondContact O-N 2.97Å | ||
| 174 | T | 36.5 | Very low | 38.5 | Very low | 126 Ų | 126 | 140.6 Ų | 140.6 | 77% | 0.773 | 76% | 0.761 | S | S | * | * | trans | -66.9 | 123.8 | 176.9 | 43.4 | 0 | 0 | 0 | 0 | 109.9 | T172 | T172-T174 PolarHBondContact O-N 2.75Å; T172-T174 VanDerWaalsContact O-N 3.12Å | ||
| 175 | P | 38.1 | Very low | 38.3 | Very low | 116 Ų | 116 | 140.9 Ų | 140.9 | 75% | 0.753 | 77% | 0.771 | S | S | * | * | trans | -79.1 | 134.6 | -179.8 | 31.1 | -33.7 | 0 | 0 | 0 | 112.1 | ||||
| 176 | D | 32.1 | Very low | 37.9 | Very low | 113 Ų | 113 | 138.6 Ų | 138.6 | 60% | 0.604 | 77% | 0.769 | S | S | * | * | trans | 37.7 | 88.8 | 151.1 | -69.1 | -1 | 0 | 0 | 0 | 118.6 | K178 | D176-K178 HydrophobicContact CB-CD 4.48Å; D176-K178 HydrophobicContact CB-CG 4.29Å; D176-K178 PolarHBondContact O-N 2.91Å; D176-K178 VanDerWaalsContact OD2-CE 3.31Å; D176-K178 WeakPolarHBondContact OD2-CE 3.44Å; D176-K178 IonicContact OD2-NZ 2.73Å; D176-K178 PolarHBondContact OD2-NZ 2.89Å | ||
| 177 | L | 44 | Very low | 37.7 | Very low | 176 Ų | 176 | 135.3 Ų | 135.3 | 92% | 0.921 | 77% | 0.766 | S | S | * | * | trans | -84.2 | 88 | 140.3 | -73.3 | -178.9 | 0 | 0 | 0 | 108.5 | E179 | L177-E179 PolarHBondContact O-N 3.27Š| ||
| 178 | K | 44.9 | Very low | 37.9 | Very low | 151 Ų | 151 | 137 Ų | 137 | 66% | 0.657 | 77% | 0.767 | S | S | * | * | trans | -74.3 | 103.1 | 170.2 | -83.3 | 169.6 | 171.5 | 141.1 | 0 | 109.5 | D176 N180 | D176-K178 HydrophobicContact CB-CD 4.48Å; D176-K178 HydrophobicContact CB-CG 4.29Å; D176-K178 PolarHBondContact O-N 2.91Å; D176-K178 VanDerWaalsContact OD2-CE 3.31Å; D176-K178 WeakPolarHBondContact OD2-CE 3.44Å; D176-K178 IonicContact OD2-NZ 2.73Å; D176-K178 PolarHBondContact OD2-NZ 2.89Å; K178-N180 VanDerWaalsContact C-N 3.33Å; K178-N180 PolarHBondContact O-N 3.1Å | ||
| 179 | E | 36.3 | Very low | 38.2 | Very low | 187 Ų | 187 | 135.7 Ų | 135.7 | 87% | 0.874 | 77% | 0.769 | S | S | * | * | trans | -62.4 | 89.2 | 171.3 | -66.3 | -175.8 | 148.4 | 0 | 0 | 111.1 | L177 S181 | L177-E179 PolarHBondContact O-N 3.27Å; E179-S181 PolarHBondContact O-N 3.34Å | ||
| 180 | N | 36 | Very low | 39.2 | Very low | 157 Ų | 157 | 140.3 Ų | 140.3 | 84% | 0.84 | 78% | 0.777 | S | S | * | * | trans | -91.3 | 62.3 | 160.9 | -72.8 | -53.3 | 0 | 0 | 0 | 109.1 | K178 | K178-N180 VanDerWaalsContact C-N 3.33Å; K178-N180 PolarHBondContact O-N 3.1Å | ||
| 181 | S | 39.9 | Very low | 40.4 | Very low | 103 Ų | 103 | 137.9 Ų | 137.9 | 72% | 0.72 | 77% | 0.77 | S | S | * | * | trans | -79.3 | 119.4 | 166.9 | -173.9 | 0 | 0 | 0 | 0 | 109.1 | E179 K183 | E179-S181 PolarHBondContact O-N 3.34Å; S181-K183 PolarHBondContact O-N 3.25Å; S181-K183 VanDerWaalsContact O-N 3.13Å | ||
| 182 | A | 39.4 | Very low | 42.3 | Very low | 85 Ų | 85 | 135.3 Ų | 135.3 | 70% | 0.702 | 76% | 0.756 | S | S | * | * | trans | -74.2 | 104.6 | -178.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | C184 | A182-C184 PolarHBondContact O-N 3.23Å; A182-C184 VanDerWaalsContact O-N 3.09Å | ||
| 183 | K | 31.5 | Very low | 44.2 | Very low | 209 Ų | 209 | 133.1 Ų | 133.1 | 91% | 0.909 | 74% | 0.744 | S | S | * | * | trans | 43.5 | 57.5 | 142.5 | -163.2 | 79.2 | 177.4 | -178 | 0 | 115.3 | S181 | S181-K183 PolarHBondContact O-N 3.25Å; S181-K183 VanDerWaalsContact O-N 3.13Å | ||
| 184 | C | 29.2 | Very low | 46.2 | Very low | 118 Ų | 118 | 130.4 Ų | 130.4 | 80% | 0.797 | 73% | 0.734 | S | S | * | * | trans | -80.4 | 137.9 | 166.1 | -74.1 | 0 | 0 | 0 | 0 | 111 | A182 | A182-C184 PolarHBondContact O-N 3.23Å; A182-C184 VanDerWaalsContact O-N 3.09Å | ||
| 185 | S | 34.1 | Very low | 48.7 | Very low | 114 Ų | 114 | 126.2 Ų | 126.2 | 80% | 0.797 | 71% | 0.713 | S | S | * | * | trans | -66.1 | 144.6 | 179.3 | 42.6 | 0 | 0 | 0 | 0 | 112.2 | S187 | S185-S187 PolarHBondContact O-N 3.11Å; S185-S187 VanDerWaalsContact O-N 3.11Å | ||
| 186 | S | 35.9 | Very low | 51.2 | Low | 125 Ų | 125 | 124.9 Ų | 124.9 | 87% | 0.874 | 70% | 0.704 | S | S | * | * | S | Bend | trans | -77.7 | 88.3 | -178.1 | 53.9 | 0 | 0 | 0 | 0 | 113.2 | ||
| 187 | S | 37.4 | Very low | 54 | Low | 88 Ų | 88 | 122.4 Ų | 122.4 | 62% | 0.615 | 69% | 0.688 | S | S | * | * | trans | -165.8 | 154.7 | 141.5 | 68.3 | 0 | 0 | 0 | 0 | 110.9 | S185 | S185-S187 PolarHBondContact O-N 3.11Å; S185-S187 VanDerWaalsContact O-N 3.11Å | ||
| 188 | D | 43 | Very low | 56.4 | Low | 141 Ų | 141 | 119.8 Ų | 119.8 | 75% | 0.754 | 68% | 0.675 | S | S | * | * | S | Bend | trans | 72.3 | 107.4 | 158.4 | -46.8 | -46.8 | 0 | 0 | 0 | 120.2 | ||
| 189 | V | 51.3 | Low | 58.6 | Low | 121 Ų | 121 | 119 Ų | 119 | 73% | 0.733 | 67% | 0.668 | S | S | * | * | trans | 54.6 | 102.9 | 152.7 | -162.3 | 0 | 0 | 0 | 0 | 118.3 | S191 | V189-S191 PolarHBondContact O-N 2.73Š| ||
| 190 | Y | 57 | Low | 61.4 | Low | 245 Ų | 245 | 115.9 Ų | 115.9 | 96% | 0.961 | 66% | 0.656 | S | S | * | * | trans | -65.4 | 89.7 | 161.1 | -83.9 | -96.1 | 0 | 0 | 0 | 111 | ||||
| 191 | S | 66.3 | Low | 64 | Low | 64 Ų | 64 | 110.7 Ų | 110.7 | 45% | 0.448 | 63% | 0.628 | S | S | . | * | trans | -90.6 | 116.1 | 168.8 | -62.6 | 0 | 0 | 0 | 0 | 110.2 | V189 P193 | V189-S191 PolarHBondContact O-N 2.73Å; S191-P193 WeakPolarHBondContact O-CD 3.37Å | ||
| 192 | D | 78.9 | Confident | 66.5 | Low | 95 Ų | 95 | 111 Ų | 111 | 51% | 0.508 | 64% | 0.637 | S | S | . | * | trans | -66.1 | 120.4 | 173.3 | -177.5 | -6.6 | 0 | 0 | 0 | 109.5 | L194 A195 Q197 | D192-L194 PolarHBondContact O-N 2.84Å; D192-L194 VanDerWaalsContact OD1-CB 3.31Å; D192-L194 WeakPolarHBondContact OD1-CB 3.45Å; D192-L194 PolarHBondContact OD1-N 3.14Å; D192-A195 HydrophobicContact CB-CB 4.05Å; D192-A195 PolarHBondContact O-N 2.87Å; D192-Q197 PolarHBondContact O-NE2 2.86Å | ||
| 193 | P | 76.8 | Confident | 69 | Low | 86 Ų | 86 | 113.4 Ų | 113.4 | 56% | 0.558 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.2 | -4.2 | 178.6 | 32.3 | -37.7 | 0 | 0 | 0 | 113.7 | S191 | S191-P193 WeakPolarHBondContact O-CD 3.37Š|
| 194 | L | 82.7 | Confident | 71.9 | Confident | 119 Ų | 119 | 106.1 Ų | 106.1 | 62% | 0.623 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.1 | -10.7 | 174.7 | -142.9 | 77.1 | 0 | 0 | 0 | 113 | D192 V215 | D192-L194 PolarHBondContact O-N 2.84Å; D192-L194 VanDerWaalsContact OD1-CB 3.31Å; D192-L194 WeakPolarHBondContact OD1-CB 3.45Å; D192-L194 PolarHBondContact OD1-N 3.14Å; L194-V215 HydrophobicContact CD1-CG1 3.52Å; L194-V215 HydrophobicContact CG-CG1 4.3Å |
| 195 | A | 87.6 | Confident | 74.9 | Confident | 38 Ų | 38 | 104.9 Ų | 104.9 | 31% | 0.314 | 61% | 0.608 | S | S | . | * | S | Bend | trans | -102.5 | 151.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | D192 Q197 S212 | D192-A195 HydrophobicContact CB-CB 4.05Å; D192-A195 PolarHBondContact O-N 2.87Å; A195-Q197 PolarHBondContact O-N 3.02Å; A195-S212 PolarHBondContact O-OG 3.4Å; A195-S212 VanDerWaalsContact O-OG 3.05Å |
| 196 | P | 91 | Very high | 77.7 | Confident | 87 Ų | 87 | 105.6 Ų | 105.6 | 57% | 0.565 | 60% | 0.601 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 127.9 | 173 | -22 | 33.7 | 0 | 0 | 0 | 112.1 | L208 L213 | P196-L208 HydrophobicContact CB-CD1 4.2Å; P196-L213 HydrophobicContact CB-CD2 4.39Å |
| 197 | Q | 91.9 | Very high | 80.5 | Confident | 61 Ų | 61 | 103 Ų | 103 | 29% | 0.285 | 58% | 0.58 | S | S | . | * | P | Polyproline II helix | trans | -102.4 | 151.5 | -177.6 | -63.1 | 178.4 | 10.5 | 0 | 0 | 112.1 | D192 A195 D209 S212 | D192-Q197 PolarHBondContact O-NE2 2.86Å; A195-Q197 PolarHBondContact O-N 3.02Å; Q197-D209 PolarHBondContact O-N 3.48Å; Q197-S212 WeakPolarHBondContact CB-OG 3.42Å; Q197-S212 WeakPolarHBondContact CG-OG 3.49Å; Q197-S212 PolarHBondContact N-OG 3.45Å |
| 198 | L | 92.9 | Very high | 83.1 | Confident | 121 Ų | 121 | 102.3 Ų | 102.3 | 63% | 0.634 | 57% | 0.569 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -107 | 144.4 | 175.2 | -58.2 | 178.7 | 0 | 0 | 0 | 109.9 | I206 V207 L208 | L198-I206 HydrophobicContact CB-CG2 4.04Å; L198-I206 HydrophobicContact CD1-CG2 3.88Å; L198-I206 HydrophobicContact CG-CG2 4.42Å; L198-V207 WeakPolarHBondContact CA-O 3.21Å; L198-L208 HydrophobicContact CD2-CB 4.34Å; L198-L208 HydrophobicContact CD2-CD1 3.82Å |
| 199 | R | 91.6 | Very high | 85.4 | Confident | 136 Ų | 136 | 96.5 Ų | 96.5 | 51% | 0.513 | 54% | 0.538 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -128 | 151.7 | 178.1 | -178.4 | 169.1 | 66.1 | -150.3 | 2.6 | 109.6 | V207 D209 | R199-V207 PolarHBondContact N-O 3.07Å; R199-V207 PolarHBondContact O-N 2.88Å; R199-D209 HydrophobicContact CB-CB 4.39Å; R199-D209 IonicContact CZ-OD1 3.76Å; R199-D209 IonicContact CZ-OD2 3.52Å; R199-D209 IonicContact NE-OD2 3.95Å; R199-D209 IonicContact NH1-OD1 3.19Å; R199-D209 PolarHBondContact NH1-OD1 2.93Å; R199-D209 IonicContact NH1-OD2 2.79Å; R199-D209 PolarHBondContact NH1-OD2 3.46Å; R199-D209 IonicContact NH2-OD1 3.93Å |
| 200 | I | 94.5 | Very high | 87.2 | Confident | 120 Ų | 120 | 98.2 Ų | 98.2 | 62% | 0.615 | 54% | 0.538 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -90.4 | 130.3 | 174 | -54.6 | 176.8 | 0 | 0 | 0 | 108.4 | N205 | I200-N205 CarbonylContact C-O 3.57Å; I200-N205 WeakPolarHBondContact CA-O 3.5Å |
| 201 | D | 91.9 | Very high | 88.6 | Confident | 48 Ų | 48 | 91.3 Ų | 91.3 | 26% | 0.257 | 52% | 0.521 | S | S | . | . | trans | -75.2 | 171.9 | 175.5 | 82.1 | -3.5 | 0 | 0 | 0 | 112 | N203 G204 N205 V207 | D201-N203 PolarHBondContact O-N 3.25Å; D201-N203 VanDerWaalsContact O-N 3.09Å; D201-N203 VanDerWaalsContact OD1-C 3.27Å; D201-N203 VanDerWaalsContact OD1-CA 3.27Å; D201-N203 WeakPolarHBondContact OD1-CA 3.29Å; D201-N203 WeakPolarHBondContact OD1-CB 3.35Å; D201-N203 PolarHBondContact OD1-N 2.96Å; D201-N203 PolarHBondContact OD2-ND2 3.17Å; D201-G204 PolarHBondContact O-N 2.74Å; D201-G204 VanDerWaalsContact O-N 3.12Å; D201-G204 PolarHBondContact OD1-N 3.04Å; D201-N205 PolarHBondContact N-O 3.12Å; D201-N205 PolarHBondContact OD1-N 3.43Å; D201-N205 PolarHBondContact OD1-ND2 3.1Å; D201-N205 PolarHBondContact OD2-ND2 3.1Å; D201-V207 HydrophobicContact CB-CG2 3.95Å | ||
| 202 | A | 92 | Very high | 89.7 | Confident | 111 Ų | 111 | 89 Ų | 89 | 92% | 0.917 | 51% | 0.505 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.3 | -10.6 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||
| 203 | N | 91.5 | Very high | 90 | Very high | 134 Ų | 134 | 89.2 Ų | 89.2 | 72% | 0.717 | 51% | 0.506 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99 | -3.5 | 178.6 | -47.5 | -57.2 | 0 | 0 | 0 | 112.3 | D201 | D201-N203 PolarHBondContact O-N 3.25Å; D201-N203 VanDerWaalsContact O-N 3.09Å; D201-N203 VanDerWaalsContact OD1-C 3.27Å; D201-N203 VanDerWaalsContact OD1-CA 3.27Å; D201-N203 WeakPolarHBondContact OD1-CA 3.29Å; D201-N203 WeakPolarHBondContact OD1-CB 3.35Å; D201-N203 PolarHBondContact OD1-N 2.96Å; D201-N203 PolarHBondContact OD2-ND2 3.17Å |
| 204 | G | 92.8 | Very high | 90.5 | Very high | 56 Ų | 56 | 91.7 Ų | 91.7 | 58% | 0.577 | 51% | 0.513 | S | S | * | . | S | Bend | trans | 89.5 | 6.4 | -177.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | D201 | D201-G204 PolarHBondContact O-N 2.74Å; D201-G204 VanDerWaalsContact O-N 3.12Å; D201-G204 PolarHBondContact OD1-N 3.04Å |
| 205 | N | 92.9 | Very high | 90.5 | Very high | 92 Ų | 92 | 89.5 Ų | 89.5 | 49% | 0.492 | 51% | 0.505 | S | S | . | . | trans | -81.7 | 147.9 | 176.8 | -52.3 | -60.4 | 0 | 0 | 0 | 111.4 | I200 D201 V207 | I200-N205 CarbonylContact C-O 3.57Å; I200-N205 WeakPolarHBondContact CA-O 3.5Å; D201-N205 PolarHBondContact N-O 3.12Å; D201-N205 PolarHBondContact OD1-N 3.43Å; D201-N205 PolarHBondContact OD1-ND2 3.1Å; D201-N205 PolarHBondContact OD2-ND2 3.1Å; N205-V207 HydrophobicContact CB-CG2 4.38Å | ||
| 206 | I | 92.7 | Very high | 90.1 | Very high | 130 Ų | 130 | 95.9 Ų | 95.9 | 67% | 0.667 | 53% | 0.528 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -83.1 | 119.4 | 172.4 | -55.9 | 173.1 | 0 | 0 | 0 | 108.7 | L198 | L198-I206 HydrophobicContact CB-CG2 4.04Å; L198-I206 HydrophobicContact CD1-CG2 3.88Å; L198-I206 HydrophobicContact CG-CG2 4.42Å |
| 207 | V | 93.9 | Very high | 89.4 | Confident | 69 Ų | 69 | 100.5 Ų | 100.5 | 42% | 0.418 | 54% | 0.539 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.3 | 149.7 | -176.7 | -177.1 | 0 | 0 | 0 | 0 | 109.6 | L198 R199 D201 N205 | L198-V207 WeakPolarHBondContact CA-O 3.21Å; R199-V207 PolarHBondContact N-O 3.07Å; R199-V207 PolarHBondContact O-N 2.88Å; D201-V207 HydrophobicContact CB-CG2 3.95Å; N205-V207 HydrophobicContact CB-CG2 4.38Å |
| 208 | L | 91.9 | Very high | 88.4 | Confident | 75 Ų | 75 | 105.6 Ų | 105.6 | 39% | 0.393 | 56% | 0.556 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -71.3 | 135 | 175.9 | -175 | 63.3 | 0 | 0 | 0 | 110.6 | P196 L198 E210 L213 | P196-L208 HydrophobicContact CB-CD1 4.2Å; L198-L208 HydrophobicContact CD2-CB 4.34Å; L198-L208 HydrophobicContact CD2-CD1 3.82Å; L208-E210 PolarHBondContact O-N 3.44Å; L208-L213 HydrophobicContact CD2-CD1 3.91Å; L208-L213 HydrophobicContact CD2-CD2 4.23Å; L208-L213 HydrophobicContact CD2-CG 4.31Å; L208-L213 HydrophobicContact CG-CD1 4.45Å |
| 209 | D | 90.8 | Very high | 87.2 | Confident | 19 Ų | 19 | 106.2 Ų | 106.2 | 10% | 0.102 | 56% | 0.56 | C | S | . | * | trans | -80.3 | 105.5 | 173.8 | -161.5 | -29.4 | 0 | 0 | 0 | 110.2 | Q197 R199 T211 S212 | Q197-D209 PolarHBondContact O-N 3.48Å; R199-D209 HydrophobicContact CB-CB 4.39Å; R199-D209 IonicContact CZ-OD1 3.76Å; R199-D209 IonicContact CZ-OD2 3.52Å; R199-D209 IonicContact NE-OD2 3.95Å; R199-D209 IonicContact NH1-OD1 3.19Å; R199-D209 PolarHBondContact NH1-OD1 2.93Å; R199-D209 IonicContact NH1-OD2 2.79Å; R199-D209 PolarHBondContact NH1-OD2 3.46Å; R199-D209 IonicContact NH2-OD1 3.93Å; D209-T211 VanDerWaalsContact CG-OG1 3.3Å; D209-T211 PolarHBondContact O-N 3.04Å; D209-T211 VanDerWaalsContact O-N 3.16Å; D209-T211 WeakPolarHBondContact OD1-CB 3.44Å; D209-T211 PolarHBondContact OD1-N 2.93Å; D209-T211 PolarHBondContact OD1-OG1 3.41Å; D209-S212 WeakPolarHBondContact O-CB 3.38Å; D209-S212 PolarHBondContact O-N 3.46Å | ||
| 210 | E | 90 | Very high | 85.6 | Confident | 156 Ų | 156 | 106.3 Ų | 106.3 | 73% | 0.729 | 57% | 0.571 | S | S | * | * | G | 310 helix | trans | -56.4 | -29.5 | 178.6 | -61.1 | -178.7 | 166.2 | 0 | 0 | 112.9 | L208 S212 L213 | L208-E210 PolarHBondContact O-N 3.44Å; E210-S212 VanDerWaalsContact C-N 3.3Å; E210-S212 PolarHBondContact O-N 2.9Å; E210-L213 PolarHBondContact O-N 3.39Å |
| 211 | T | 86.9 | Confident | 84 | Confident | 100 Ų | 100 | 108.2 Ų | 108.2 | 61% | 0.613 | 58% | 0.575 | S | S | * | * | G | 310 helix | trans | -70.6 | -29.7 | 177.6 | 66.5 | 0 | 0 | 0 | 0 | 112 | D209 L213 L214 | D209-T211 VanDerWaalsContact CG-OG1 3.3Å; D209-T211 PolarHBondContact O-N 3.04Å; D209-T211 VanDerWaalsContact O-N 3.16Å; D209-T211 WeakPolarHBondContact OD1-CB 3.44Å; D209-T211 PolarHBondContact OD1-N 2.93Å; D209-T211 PolarHBondContact OD1-OG1 3.41Å; T211-L213 VanDerWaalsContact C-N 3.33Å; T211-L213 PolarHBondContact O-N 3.32Å; T211-L214 PolarHBondContact O-N 2.65Å |
| 212 | S | 87.8 | Confident | 82.6 | Confident | 16 Ų | 16 | 110.1 Ų | 110.1 | 11% | 0.112 | 59% | 0.585 | C | S | . | * | G | 310 helix | trans | -77.8 | -15.7 | 179.2 | -177.2 | 0 | 0 | 0 | 0 | 113.6 | A195 Q197 D209 E210 L214 | A195-S212 PolarHBondContact O-OG 3.4Å; A195-S212 VanDerWaalsContact O-OG 3.05Å; Q197-S212 WeakPolarHBondContact CB-OG 3.42Å; Q197-S212 WeakPolarHBondContact CG-OG 3.49Å; Q197-S212 PolarHBondContact N-OG 3.45Å; D209-S212 WeakPolarHBondContact O-CB 3.38Å; D209-S212 PolarHBondContact O-N 3.46Å; E210-S212 VanDerWaalsContact C-N 3.3Å; E210-S212 PolarHBondContact O-N 2.9Å; S212-L214 PolarHBondContact O-N 3Å |
| 213 | L | 86.6 | Confident | 81.3 | Confident | 99 Ų | 99 | 108.4 Ų | 108.4 | 52% | 0.518 | 57% | 0.571 | S | S | . | * | G | 310 helix | trans | -70.9 | -19.9 | 171.4 | -71.9 | 170.5 | 0 | 0 | 0 | 112.4 | P196 L208 E210 T211 | P196-L213 HydrophobicContact CB-CD2 4.39Å; L208-L213 HydrophobicContact CD2-CD1 3.91Å; L208-L213 HydrophobicContact CD2-CD2 4.23Å; L208-L213 HydrophobicContact CD2-CG 4.31Å; L208-L213 HydrophobicContact CG-CD1 4.45Å; E210-L213 PolarHBondContact O-N 3.39Å; T211-L213 VanDerWaalsContact C-N 3.33Å; T211-L213 PolarHBondContact O-N 3.32Å |
| 214 | L | 86.1 | Confident | 80.2 | Confident | 138 Ų | 138 | 111.2 Ų | 111.2 | 72% | 0.723 | 58% | 0.577 | S | S | * | * | trans | -100.2 | 83.5 | -179 | -61.4 | -179.2 | 0 | 0 | 0 | 110.5 | T211 S212 E216 | T211-L214 PolarHBondContact O-N 2.65Å; S212-L214 PolarHBondContact O-N 3Å; L214-E216 PolarHBondContact O-N 2.88Å | ||
| 215 | V | 83.8 | Confident | 79.5 | Confident | 74 Ų | 74 | 113.5 Ų | 113.5 | 45% | 0.448 | 58% | 0.58 | S | S | . | * | trans | -70.3 | 99.7 | 170 | 177.8 | 0 | 0 | 0 | 0 | 109.1 | L194 K217 | L194-V215 HydrophobicContact CD1-CG1 3.52Å; L194-V215 HydrophobicContact CG-CG1 4.3Å; V215-K217 PolarHBondContact O-N 3.05Å; V215-K217 VanDerWaalsContact O-N 3.11Å | ||
| 216 | E | 79.1 | Confident | 78.9 | Confident | 171 Ų | 171 | 114.1 Ų | 114.1 | 80% | 0.799 | 58% | 0.583 | S | S | * | * | trans | -57.3 | 117.7 | 165.8 | -71.5 | -169.5 | 164.6 | 0 | 0 | 109.1 | L214 R218 | L214-E216 PolarHBondContact O-N 2.88Å; E216-R218 VanDerWaalsContact C-N 3.26Å; E216-R218 PolarHBondContact O-N 3.39Å | ||
| 217 | K | 76.8 | Confident | 78.4 | Confident | 184 Ų | 184 | 117.9 Ų | 117.9 | 80% | 0.8 | 59% | 0.588 | S | S | * | * | trans | -65.3 | 92.3 | 168.9 | -177.4 | -166.2 | 175.1 | -165.5 | 0 | 107.5 | V215 D219 | V215-K217 PolarHBondContact O-N 3.05Å; V215-K217 VanDerWaalsContact O-N 3.11Å; K217-D219 PolarHBondContact O-N 2.87Å | ||
| 218 | R | 70.2 | Confident | 77.8 | Confident | 168 Ų | 168 | 123.1 Ų | 123.1 | 63% | 0.634 | 61% | 0.608 | S | S | * | * | trans | -49.5 | 127.7 | 168.8 | -74.3 | -176.6 | 168.4 | 81.8 | 0 | 108.2 | E216 N220 | E216-R218 VanDerWaalsContact C-N 3.26Å; E216-R218 PolarHBondContact O-N 3.39Å; R218-N220 VanDerWaalsContact CB-OD1 3.26Å; R218-N220 WeakPolarHBondContact CB-OD1 3.47Å; R218-N220 PolarHBondContact O-N 3.2Å | ||
| 219 | D | 66.5 | Low | 77.2 | Confident | 134 Ų | 134 | 123.5 Ų | 123.5 | 72% | 0.717 | 61% | 0.609 | S | S | * | * | trans | -70.5 | 64.8 | 164.6 | -74.3 | -37 | 0 | 0 | 0 | 109.1 | K217 F221 D222 | K217-D219 PolarHBondContact O-N 2.87Å; D219-F221 CarbonylContact O-C 3.23Å; D219-F221 VanDerWaalsContact O-C 3.23Å; D219-F221 PolarHBondContact O-N 3.07Å; D219-D222 PolarHBondContact O-N 3.29Å | ||
| 220 | N | 59.4 | Low | 76.8 | Confident | 139 Ų | 139 | 125 Ų | 125 | 74% | 0.743 | 62% | 0.622 | S | S | * | * | trans | -64 | -4.3 | 174.5 | -76.6 | -17.5 | 0 | 0 | 0 | 112.1 | R218 | R218-N220 VanDerWaalsContact CB-OD1 3.26Å; R218-N220 WeakPolarHBondContact CB-OD1 3.47Å; R218-N220 PolarHBondContact O-N 3.2Å | ||
| 221 | F | 60.8 | Low | 76.3 | Confident | 160 Ų | 160 | 125.1 Ų | 125.1 | 70% | 0.702 | 62% | 0.622 | S | S | * | * | S | Bend | trans | -96.7 | 94 | 154.1 | -110.1 | -95.2 | 0 | 0 | 0 | 108.7 | D219 A223 L226 | D219-F221 CarbonylContact O-C 3.23Å; D219-F221 VanDerWaalsContact O-C 3.23Å; D219-F221 PolarHBondContact O-N 3.07Å; F221-A223 PolarHBondContact O-N 2.89Å; F221-L226 HydrophobicContact CD1-CD1 3.9Å; F221-L226 HydrophobicContact CD1-CG 4.38Å; F221-L226 HydrophobicContact CE1-CD1 4.07Å; F221-L226 HydrophobicContact CE1-CD2 4.18Å; F221-L226 HydrophobicContact CE1-CG 4.42Å |
| 222 | D | 62.2 | Low | 75.9 | Confident | 87 Ų | 87 | 129.1 Ų | 129.1 | 47% | 0.465 | 63% | 0.634 | S | S | . | * | trans | -66 | 88.8 | 171.5 | -155.4 | -4.3 | 0 | 0 | 0 | 107.7 | D219 K224 T225 | D219-D222 PolarHBondContact O-N 3.29Å; D222-K224 PolarHBondContact O-N 2.71Å; D222-T225 HydrophobicContact CB-CG2 4Å; D222-T225 WeakPolarHBondContact O-CB 3.47Å; D222-T225 PolarHBondContact O-N 2.89Å; D222-T225 PolarHBondContact O-OG1 3.48Å | ||
| 223 | A | 64.6 | Low | 75.2 | Confident | 75 Ų | 75 | 132.4 Ų | 132.4 | 62% | 0.62 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.4 | -19.2 | -175.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | F221 T225 L226 | F221-A223 PolarHBondContact O-N 2.89Å; A223-T225 VanDerWaalsContact C-N 3.28Å; A223-T225 PolarHBondContact O-N 2.98Å; A223-L226 PolarHBondContact O-N 3.27Å |
| 224 | K | 69.3 | Low | 74.6 | Confident | 194 Ų | 194 | 130.1 Ų | 130.1 | 84% | 0.843 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.1 | -24.6 | 171 | -62.4 | 170.8 | -176.7 | 167.2 | 0 | 113.7 | D222 | D222-K224 PolarHBondContact O-N 2.71Š|
| 225 | T | 77.2 | Confident | 73.9 | Confident | 104 Ų | 104 | 129.3 Ų | 129.3 | 64% | 0.638 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.9 | -19.1 | 176 | 65.7 | 0 | 0 | 0 | 0 | 113 | D222 A223 R227 | D222-T225 HydrophobicContact CB-CG2 4Å; D222-T225 WeakPolarHBondContact O-CB 3.47Å; D222-T225 PolarHBondContact O-N 2.89Å; D222-T225 PolarHBondContact O-OG1 3.48Å; A223-T225 VanDerWaalsContact C-N 3.28Å; A223-T225 PolarHBondContact O-N 2.98Å; T225-R227 PolarHBondContact O-N 2.84Å |
| 226 | L | 80.2 | Confident | 73.6 | Confident | 105 Ų | 105 | 131.1 Ų | 131.1 | 55% | 0.55 | 66% | 0.655 | S | S | . | * | S | Bend | trans | -78.9 | 114.2 | 175.6 | -68 | -178.3 | 0 | 0 | 0 | 110.2 | F221 A223 | F221-L226 HydrophobicContact CD1-CD1 3.9Å; F221-L226 HydrophobicContact CD1-CG 4.38Å; F221-L226 HydrophobicContact CE1-CD1 4.07Å; F221-L226 HydrophobicContact CE1-CD2 4.18Å; F221-L226 HydrophobicContact CE1-CG 4.42Å; A223-L226 PolarHBondContact O-N 3.27Å |
| 227 | R | 81.6 | Confident | 73.6 | Confident | 209 Ų | 209 | 127.8 Ų | 127.8 | 79% | 0.789 | 65% | 0.651 | S | S | * | * | trans | -69.9 | 131.8 | 169.6 | 69.3 | -177.6 | -174.4 | -125.9 | -4.5 | 110.1 | T225 I229 | T225-R227 PolarHBondContact O-N 2.84Å; R227-I229 HydrophobicContact CG-CD1 4.25Å; R227-I229 HydrophobicContact CG-CG1 3.98Å | ||
| 228 | H | 81.3 | Confident | 74 | Confident | 179 Ų | 179 | 123.5 Ų | 123.5 | 83% | 0.829 | 64% | 0.64 | S | S | * | * | trans | -67.3 | 134.1 | 166.5 | -177.5 | 81.5 | 0 | 0 | 0 | 109.7 | ||||
| 229 | I | 80.5 | Confident | 74.8 | Confident | 82 Ų | 82 | 121 Ų | 121 | 42% | 0.421 | 64% | 0.639 | S | S | . | * | trans | -126.9 | 120.1 | 177.3 | -53.6 | 178 | 0 | 0 | 0 | 107 | R227 E231 | R227-I229 HydrophobicContact CG-CD1 4.25Å; R227-I229 HydrophobicContact CG-CG1 3.98Å; I229-E231 PolarHBondContact O-N 2.84Å | ||
| 230 | S | 81.1 | Confident | 75.9 | Confident | 52 Ų | 52 | 123.8 Ų | 123.8 | 36% | 0.364 | 64% | 0.641 | S | S | . | * | trans | -78.4 | 115.2 | 173.7 | 172.9 | 0 | 0 | 0 | 0 | 110.3 | E232 T233 | S230-E232 VanDerWaalsContact C-N 3.29Å; S230-E232 PolarHBondContact O-N 2.98Å; S230-T233 PolarHBondContact O-OG1 2.93Å | ||
| 231 | E | 80.7 | Confident | 77.1 | Confident | 158 Ų | 158 | 126.6 Ų | 126.6 | 74% | 0.738 | 64% | 0.641 | S | S | * | * | G | 310 helix | trans | -68.6 | -26.5 | -179.1 | -60.5 | -175.7 | 176.6 | 0 | 0 | 112.9 | I229 T233 G234 L236 | I229-E231 PolarHBondContact O-N 2.84Å; E231-T233 PolarHBondContact O-N 2.86Å; E231-T233 VanDerWaalsContact O-N 3.15Å; E231-G234 PolarHBondContact O-N 3.49Å; E231-L236 HydrophobicContact CG-CD1 4.47Å |
| 232 | E | 78.7 | Confident | 78.2 | Confident | 184 Ų | 184 | 121.8 Ų | 121.8 | 86% | 0.86 | 63% | 0.628 | S | S | * | * | G | 310 helix | trans | -60.8 | -25 | -179 | -171.6 | 178 | -170.9 | 0 | 0 | 113.1 | S230 G234 | S230-E232 VanDerWaalsContact C-N 3.29Å; S230-E232 PolarHBondContact O-N 2.98Å; E232-G234 PolarHBondContact O-N 2.7Å |
| 233 | T | 72.7 | Confident | 79.3 | Confident | 85 Ų | 85 | 125.9 Ų | 125.9 | 52% | 0.521 | 64% | 0.641 | S | S | . | * | G | 310 helix | trans | -66.7 | -2.1 | -178.5 | 58.8 | 0 | 0 | 0 | 0 | 115 | S230 E231 I235 | S230-T233 PolarHBondContact O-OG1 2.93Å; E231-T233 PolarHBondContact O-N 2.86Å; E231-T233 VanDerWaalsContact O-N 3.15Å; T233-I235 PolarHBondContact O-N 3.13Å; T233-I235 VanDerWaalsContact O-N 3.15Å; T233-I235 WeakPolarHBondContact OG1-CD1 3.39Å; T233-I235 VanDerWaalsContact OG1-CG1 3.24Å; T233-I235 WeakPolarHBondContact OG1-CG1 3.36Å |
| 234 | G | 74.2 | Confident | 80.3 | Confident | 51 Ų | 51 | 129.2 Ų | 129.2 | 53% | 0.526 | 64% | 0.638 | S | S | . | * | S | Bend | trans | 69.2 | 8.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | E231 E232 L236 | E231-G234 PolarHBondContact O-N 3.49Å; E232-G234 PolarHBondContact O-N 2.7Å; G234-L236 PolarHBondContact O-N 3.26Å |
| 235 | I | 71.9 | Confident | 80.7 | Confident | 120 Ų | 120 | 125.1 Ų | 125.1 | 62% | 0.615 | 63% | 0.631 | S | S | * | * | trans | -59.6 | -30.3 | 179.5 | -66.1 | 171.1 | 0 | 0 | 0 | 111.3 | T233 S237 | T233-I235 PolarHBondContact O-N 3.13Å; T233-I235 VanDerWaalsContact O-N 3.15Å; T233-I235 WeakPolarHBondContact OG1-CD1 3.39Å; T233-I235 VanDerWaalsContact OG1-CG1 3.24Å; T233-I235 WeakPolarHBondContact OG1-CG1 3.36Å; I235-S237 PolarHBondContact O-N 3.29Å | ||
| 236 | L | 75.9 | Confident | 80.4 | Confident | 113 Ų | 113 | 125.7 Ų | 125.7 | 59% | 0.592 | 64% | 0.637 | S | S | * | * | trans | -93.9 | 60 | -179.4 | -60.2 | 175.9 | 0 | 0 | 0 | 111.7 | E231 G234 V238 | E231-L236 HydrophobicContact CG-CD1 4.47Å; G234-L236 PolarHBondContact O-N 3.26Å; L236-V238 PolarHBondContact O-N 3.18Å | ||
| 237 | S | 80.3 | Confident | 79.9 | Confident | 100 Ų | 100 | 129.7 Ų | 129.7 | 70% | 0.699 | 65% | 0.645 | S | S | * | * | trans | -71.1 | 112.8 | 172.9 | 54.2 | 0 | 0 | 0 | 0 | 111.3 | I235 | I235-S237 PolarHBondContact O-N 3.29Š| ||
| 238 | V | 84.8 | Confident | 79 | Confident | 94 Ų | 94 | 125.4 Ų | 125.4 | 57% | 0.57 | 64% | 0.638 | S | S | * | * | trans | -98.1 | 97.7 | -175.2 | 176.8 | 0 | 0 | 0 | 0 | 111.1 | L236 F243 | L236-V238 PolarHBondContact O-N 3.18Å; V238-F243 HydrophobicContact CG1-CD2 4.28Å; V238-F243 HydrophobicContact CG1-CE1 4.45Å; V238-F243 HydrophobicContact CG1-CE2 3.27Å; V238-F243 HydrophobicContact CG1-CZ 3.37Å; V238-F243 HydrophobicContact CG2-CZ 4.39Å | ||
| 239 | D | 87.9 | Confident | 78 | Confident | 117 Ų | 117 | 118.2 Ų | 118.2 | 63% | 0.626 | 61% | 0.611 | S | S | * | * | trans | -81.4 | 160.1 | 168.6 | -86.3 | -4.9 | 0 | 0 | 0 | 112.2 | R241 S242 | D239-R241 PolarHBondContact O-N 3.24Å; D239-S242 PolarHBondContact O-N 2.89Å; D239-S242 PolarHBondContact O-OG 3.38Å | ||
| 240 | Y | 87.7 | Confident | 76.9 | Confident | 191 Ų | 191 | 121.7 Ų | 121.7 | 75% | 0.749 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -50.9 | -15 | 167.7 | 175 | -95.8 | 0 | 0 | 0 | 114.7 | R244 | Y240-R244 PolarHBondContact OH-NH2 2.81Š|
| 241 | R | 84.5 | Confident | 75.9 | Confident | 198 Ų | 198 | 122.5 Ų | 122.5 | 75% | 0.747 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.6 | -10.1 | -179.4 | -65.6 | -179.6 | 176.2 | 173.7 | 1 | 114.7 | D239 R244 | D239-R241 PolarHBondContact O-N 3.24Å; R241-R244 PolarHBondContact O-N 3.41Å |
| 242 | S | 85.3 | Confident | 76 | Confident | 60 Ų | 60 | 121.5 Ų | 121.5 | 42% | 0.42 | 63% | 0.631 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -65.3 | -41.7 | -172.8 | 61.4 | 0 | 0 | 0 | 0 | 112.9 | D239 R244 | D239-S242 PolarHBondContact O-N 2.89Å; D239-S242 PolarHBondContact O-OG 3.38Å; S242-R244 PolarHBondContact O-N 3.29Å |
| 243 | F | 85.3 | Confident | 76.5 | Confident | 172 Ų | 172 | 121 Ų | 121 | 75% | 0.754 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78 | 2.9 | -178 | -55.7 | -65.7 | 0 | 0 | 0 | 114.8 | V238 | V238-F243 HydrophobicContact CG1-CD2 4.28Å; V238-F243 HydrophobicContact CG1-CE1 4.45Å; V238-F243 HydrophobicContact CG1-CE2 3.27Å; V238-F243 HydrophobicContact CG1-CZ 3.37Å; V238-F243 HydrophobicContact CG2-CZ 4.39Å |
| 244 | R | 85.6 | Confident | 77.4 | Confident | 145 Ų | 145 | 118.6 Ų | 118.6 | 55% | 0.547 | 61% | 0.608 | S | S | . | * | S | Bend | trans | -86.2 | 136 | 174.8 | -66.5 | -178.5 | 177.8 | -94.6 | 4.1 | 108.2 | Y240 R241 S242 | Y240-R244 PolarHBondContact OH-NH2 2.81Å; R241-R244 PolarHBondContact O-N 3.41Å; S242-R244 PolarHBondContact O-N 3.29Å |
| 245 | P | 77 | Confident | 78.2 | Confident | 108 Ų | 108 | 119.1 Ų | 119.1 | 70% | 0.701 | 60% | 0.601 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 138.4 | 177.5 | 23.2 | -33.6 | 0 | 0 | 0 | 109.4 | R247 | P245-R247 PolarHBondContact O-N 3.38Å; P245-R247 VanDerWaalsContact O-N 3.08Å |
| 246 | P | 71.1 | Confident | 79 | Confident | 117 Ų | 117 | 115.9 Ų | 115.9 | 76% | 0.76 | 58% | 0.583 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 122.1 | 173 | -26.3 | 34.7 | 0 | 0 | 0 | 108.8 | D248 | P246-D248 VanDerWaalsContact C-N 3.31Å; P246-D248 PolarHBondContact O-N 3.02Å |
| 247 | R | 69.2 | Low | 79.6 | Confident | 189 Ų | 189 | 116.5 Ų | 116.5 | 71% | 0.713 | 58% | 0.578 | S | S | * | * | trans | -72.1 | 95 | 173.3 | -79.2 | -168.7 | -71.7 | -126.8 | -1.9 | 108 | P245 G249 H250 | P245-R247 PolarHBondContact O-N 3.38Å; P245-R247 VanDerWaalsContact O-N 3.08Å; R247-G249 PolarHBondContact O-N 2.79Å; R247-G249 VanDerWaalsContact O-N 3.12Å; R247-H250 HydrophobicContact CB-CB 3.81Å; R247-H250 WeakPolarHBondContact O-CB 3.34Å; R247-H250 PolarHBondContact O-N 3.38Å | ||
| 248 | D | 62.4 | Low | 80.1 | Confident | 119 Ų | 119 | 112.9 Ų | 112.9 | 64% | 0.636 | 55% | 0.55 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -40.5 | 118.5 | 168.7 | -68.6 | -19.4 | 0 | 0 | 0 | 109.8 | P246 K284 | P246-D248 VanDerWaalsContact C-N 3.31Å; P246-D248 PolarHBondContact O-N 3.02Å; D248-K284 IonicContact OD2-NZ 2.76Å; D248-K284 PolarHBondContact OD2-NZ 2.72Å |
| 249 | G | 61.1 | Low | 80.5 | Confident | 27 Ų | 27 | 108.6 Ų | 108.6 | 28% | 0.278 | 52% | 0.524 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 92.3 | -10.6 | -179.4 | 0 | 0 | 0 | 0 | 0 | 116.4 | R247 G251 R252 | R247-G249 PolarHBondContact O-N 2.79Å; R247-G249 VanDerWaalsContact O-N 3.12Å; G249-G251 PolarHBondContact O-N 3.43Å; G249-R252 PolarHBondContact O-N 2.73Å |
| 250 | H | 56.4 | Low | 80.7 | Confident | 155 Ų | 155 | 103.7 Ų | 103.7 | 72% | 0.718 | 50% | 0.498 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.7 | 75.3 | 176.3 | -163.4 | 73.3 | 0 | 0 | 0 | 112.5 | R247 | R247-H250 HydrophobicContact CB-CB 3.81Å; R247-H250 WeakPolarHBondContact O-CB 3.34Å; R247-H250 PolarHBondContact O-N 3.38Å |
| 251 | G | 62.1 | Low | 80.8 | Confident | 69 Ų | 69 | 96.7 Ų | 96.7 | 71% | 0.711 | 47% | 0.47 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 153 | -18.8 | -179 | 0 | 0 | 0 | 0 | 0 | 113.9 | G249 K253 | G249-G251 PolarHBondContact O-N 3.43Å; G251-K253 PolarHBondContact O-N 3.13Å |
| 252 | R | 82.1 | Confident | 81.2 | Confident | 137 Ų | 137 | 87.3 Ų | 87.3 | 52% | 0.517 | 44% | 0.435 | S | S | . | . | trans | -73.3 | 94 | 176.1 | -69.9 | -168.6 | -174.1 | -82.5 | -0 | 110.1 | G249 R283 | G249-R252 PolarHBondContact O-N 2.73Å; R252-R283 PolarHBondContact O-NH1 3.35Å; R252-R283 PolarHBondContact O-NH2 3.2Å | ||
| 253 | K | 89.2 | Confident | 81.6 | Confident | 173 Ų | 173 | 84.5 Ų | 84.5 | 75% | 0.752 | 42% | 0.415 | S | S | * | . | P | Polyproline II helix | trans | -52.4 | 146.4 | 167 | -63.2 | -177.4 | -179.5 | -177.3 | 0 | 109.1 | G251 R283 | G251-K253 PolarHBondContact O-N 3.13Å; K253-R283 PolarHBondContact O-NH2 2.91Å |
| 254 | W | 90.8 | Very high | 81.9 | Confident | 36 Ų | 36 | 81.2 Ų | 81.2 | 14% | 0.136 | 40% | 0.398 | C | S | . | . | P | Polyproline II helix | trans | -77.6 | 126.9 | 171.7 | -75.5 | 70.2 | 0 | 0 | 0 | 107.7 | E258 F262 R283 E287 L288 K291 R294 | W254-E258 WeakPolarHBondContact CA-OE2 3.39Å; W254-E258 HydrophobicContact CE3-CG 3.73Å; W254-E258 HydrophobicContact CZ3-CG 3.75Å; W254-F262 HydrophobicContact CZ3-CB 4.35Å; W254-R283 HydrophobicContact CH2-CG 4.14Å; W254-R283 HydrophobicContact CZ2-CG 4.4Å; W254-E287 HydrophobicContact CZ2-CB 4.41Å; W254-L288 HydrophobicContact CH2-CD2 3.9Å; W254-K291 HydrophobicContact CD2-CB 4.47Å; W254-K291 HydrophobicContact CD2-CD 3.59Å; W254-K291 HydrophobicContact CD2-CG 4.06Å; W254-K291 HydrophobicContact CE3-CD 3.75Å; W254-K291 HydrophobicContact CE3-CG 3.97Å; W254-K291 HydrophobicContact CG-CD 4.07Å; W254-K291 HydrophobicContact CH2-CB 3.84Å; W254-K291 HydrophobicContact CH2-CD 4.42Å; W254-K291 HydrophobicContact CH2-CG 3.8Å; W254-K291 HydrophobicContact CZ2-CB 3.53Å; W254-K291 HydrophobicContact CZ2-CD 4.26Å; W254-K291 HydrophobicContact CZ2-CG 3.86Å; W254-K291 HydrophobicContact CZ3-CB 4.39Å; W254-K291 HydrophobicContact CZ3-CD 4.16Å; W254-K291 HydrophobicContact CZ3-CG 3.84Å; W254-R294 VanDerWaalsContact CD1-NH1 3.3Å |
| 255 | T | 90.7 | Very high | 82.2 | Confident | 62 Ų | 62 | 74.3 Ų | 74.3 | 38% | 0.38 | 37% | 0.372 | S | S | . | . | P | Polyproline II helix | trans | -78.9 | 164.2 | 171.8 | 65.5 | 0 | 0 | 0 | 0 | 110 | E258 T259 | T255-E258 PolarHBondContact N-OE2 3.07Å; T255-E258 WeakPolarHBondContact OG1-CB 3.44Å; T255-E258 PolarHBondContact OG1-N 3.05Å; T255-E258 VanDerWaalsContact OG1-N 3.16Å; T255-T259 WeakPolarHBondContact O-CB 3.43Å; T255-T259 PolarHBondContact O-N 2.84Å; T255-T259 PolarHBondContact O-OG1 2.73Å |
| 256 | E | 88.9 | Confident | 83 | Confident | 51 Ų | 51 | 69.2 Ų | 69.2 | 24% | 0.238 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -58.5 | -56.3 | 171.7 | 168.3 | 143.2 | -126.7 | 0 | 0 | 111 | E258 T259 T260 F379 H382 L383 | E256-E258 VanDerWaalsContact C-N 3.27Å; E256-E258 PolarHBondContact O-N 3.41Å; E256-T259 CarbonylContact O-C 3.45Å; E256-T259 WeakPolarHBondContact O-CA 3.48Å; E256-T259 WeakPolarHBondContact O-CB 3.36Å; E256-T259 PolarHBondContact O-N 3.28Å; E256-T260 PolarHBondContact O-N 2.74Å; E256-T260 PolarHBondContact O-OG1 3.07Å; E256-F379 HydrophobicContact CB-CE2 3.9Å; E256-F379 HydrophobicContact CB-CZ 3.94Å; E256-H382 IonicContact OE1-CD2 3.99Å; E256-H382 PolarHBondContact OE1-CD2 2.65Å; E256-L383 HydrophobicContact CB-CD1 4.35Å; E256-L383 HydrophobicContact CG-CD1 3.91Å; E256-L383 WeakPolarHBondContact OE1-CA 3.36Å |
| 257 | R | 89 | Confident | 83.9 | Confident | 126 Ų | 126 | 63.7 Ų | 63.7 | 48% | 0.475 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -51.2 | -44.3 | 176.6 | -61.3 | 176.4 | 67.4 | 175.3 | 5.9 | 112.6 | T260 R261 D323 E326 | R257-T260 PolarHBondContact O-N 3.24Å; R257-R261 PolarHBondContact O-N 2.87Å; R257-D323 IonicContact CZ-OD1 2.82Å; R257-D323 VanDerWaalsContact CZ-OD1 3.31Å; R257-D323 IonicContact NE-OD1 3.35Å; R257-D323 IonicContact NH2-OD1 3.84Å; R257-D323 PolarHBondContact NH2-OD1 3.17Å; R257-E326 IonicContact NH1-OE2 2.74Å; R257-E326 PolarHBondContact NH1-OE2 3.12Å |
| 258 | E | 91.7 | Very high | 84.9 | Confident | 25 Ų | 25 | 55.2 Ų | 55.2 | 12% | 0.117 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -68 | -35.5 | 176.7 | -174.3 | -177.3 | -139.1 | 0 | 0 | 112.6 | W254 T255 E256 F262 F280 R283 | W254-E258 WeakPolarHBondContact CA-OE2 3.39Å; W254-E258 HydrophobicContact CE3-CG 3.73Å; W254-E258 HydrophobicContact CZ3-CG 3.75Å; T255-E258 PolarHBondContact N-OE2 3.07Å; T255-E258 WeakPolarHBondContact OG1-CB 3.44Å; T255-E258 PolarHBondContact OG1-N 3.05Å; T255-E258 VanDerWaalsContact OG1-N 3.16Å; E256-E258 VanDerWaalsContact C-N 3.27Å; E256-E258 PolarHBondContact O-N 3.41Å; E258-F262 PolarHBondContact O-N 3.49Å; E258-F280 HydrophobicContact CG-CD1 4.1Å; E258-F280 HydrophobicContact CG-CE1 3.87Å; E258-R283 VanDerWaalsContact OE1-CG 3.28Å; E258-R283 WeakPolarHBondContact OE1-CG 2.97Å; E258-R283 IonicContact OE1-CZ 3.05Å; E258-R283 IonicContact OE1-NE 2.89Å; E258-R283 PolarHBondContact OE1-NE 2.9Å; E258-R283 IonicContact OE1-NH2 3.61Å; E258-R283 PolarHBondContact OE1-NH2 2.82Å; E258-R283 IonicContact OE2-CZ 2.65Å; E258-R283 IonicContact OE2-NE 2.71Å; E258-R283 IonicContact OE2-NH2 3.71Å; E258-R283 PolarHBondContact OE2-NH2 3.26Å |
| 259 | T | 92.8 | Very high | 86.3 | Confident | 3 Ų | 3 | 50.9 Ų | 50.9 | 2% | 0.018 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -71 | -40.1 | 174.9 | -59.2 | 0 | 0 | 0 | 0 | 111.6 | T255 E256 F262 Y263 K291 L383 I387 | T255-T259 WeakPolarHBondContact O-CB 3.43Å; T255-T259 PolarHBondContact O-N 2.84Å; T255-T259 PolarHBondContact O-OG1 2.73Å; E256-T259 CarbonylContact O-C 3.45Å; E256-T259 WeakPolarHBondContact O-CA 3.48Å; E256-T259 WeakPolarHBondContact O-CB 3.36Å; E256-T259 PolarHBondContact O-N 3.28Å; T259-F262 WeakPolarHBondContact O-CA 3.2Å; T259-F262 WeakPolarHBondContact O-CB 3.3Å; T259-F262 PolarHBondContact O-N 2.8Å; T259-Y263 HydrophobicContact CG2-CD2 3.9Å; T259-Y263 HydrophobicContact CG2-CE2 3.69Å; T259-Y263 VanDerWaalsContact O-CD2 3.31Å; T259-Y263 WeakPolarHBondContact O-CD2 3.3Å; T259-Y263 PolarHBondContact O-N 3.14Å; T259-K291 PolarHBondContact OG1-NZ 3.12Å; T259-L383 HydrophobicContact CG2-CD1 4.13Å; T259-L383 HydrophobicContact CG2-CD2 3.97Å; T259-L383 HydrophobicContact CG2-CG 4.39Å; T259-I387 HydrophobicContact CG2-CD1 4.27Å |
| 260 | T | 91.2 | Very high | 87.8 | Confident | 15 Ų | 15 | 50.4 Ų | 50.4 | 9% | 0.092 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -63.4 | -40.6 | 173 | -55.6 | 0 | 0 | 0 | 0 | 111.1 | E256 R257 F262 Y263 R264 V390 | E256-T260 PolarHBondContact O-N 2.74Å; E256-T260 PolarHBondContact O-OG1 3.07Å; R257-T260 PolarHBondContact O-N 3.24Å; T260-F262 VanDerWaalsContact C-N 3.29Å; T260-F262 PolarHBondContact O-N 3.37Å; T260-Y263 PolarHBondContact O-N 3.47Å; T260-R264 WeakPolarHBondContact O-CG 3.47Å; T260-R264 PolarHBondContact O-N 2.97Å; T260-V390 HydrophobicContact CG2-CG2 4.3Å |
| 261 | R | 90.5 | Very high | 89.6 | Confident | 44 Ų | 44 | 46.7 Ų | 46.7 | 17% | 0.166 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -59.6 | -39.4 | 169.5 | -176 | 179.5 | -78.4 | 109 | 10.7 | 111.5 | R257 R264 A265 F280 L318 D323 | R257-R261 PolarHBondContact O-N 2.87Å; R261-R264 PolarHBondContact O-N 3.39Å; R261-A265 WeakPolarHBondContact O-CB 3.41Å; R261-A265 PolarHBondContact O-N 2.68Å; R261-F280 HydrophobicContact CB-CE1 4.03Å; R261-F280 HydrophobicContact CB-CZ 4.03Å; R261-F280 HydrophobicContact CG-CE1 3.86Å; R261-F280 HydrophobicContact CG-CE2 4.41Å; R261-F280 HydrophobicContact CG-CZ 3.63Å; R261-L318 WeakPolarHBondContact CD-O 3.32Å; R261-L318 PolarHBondContact NE-O 3.47Å; R261-D323 IonicContact CZ-OD2 2.72Å; R261-D323 IonicContact NH1-OD2 3.42Å; R261-D323 PolarHBondContact NH1-OD2 3.05Å; R261-D323 IonicContact NH2-OD2 3.59Å; R261-D323 PolarHBondContact NH2-OD2 3.16Å |
| 262 | F | 93.5 | Very high | 91.1 | Very high | 0 Ų | 0 | 46.7 Ų | 46.7 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -62.3 | -45.6 | 178.5 | 172.6 | -93.9 | 0 | 0 | 0 | 112.3 | W254 E258 T259 T260 A265 L266 M276 F280 L288 K291 F292 E295 | W254-F262 HydrophobicContact CZ3-CB 4.35Å; E258-F262 PolarHBondContact O-N 3.49Å; T259-F262 WeakPolarHBondContact O-CA 3.2Å; T259-F262 WeakPolarHBondContact O-CB 3.3Å; T259-F262 PolarHBondContact O-N 2.8Å; T260-F262 VanDerWaalsContact C-N 3.29Å; T260-F262 PolarHBondContact O-N 3.37Å; F262-A265 PolarHBondContact O-N 2.92Å; F262-L266 HydrophobicContact CE1-CD2 4.39Å; F262-L266 VanDerWaalsContact O-CB 3.31Å; F262-L266 WeakPolarHBondContact O-CB 3.49Å; F262-L266 PolarHBondContact O-N 2.93Å; F262-M276 HydrophobicContact CD2-SD 3.85Å; F262-M276 HydrophobicContact CE2-SD 3.82Å; F262-F280 HydrophobicContact CB-CZ 4.03Å; F262-L288 HydrophobicContact CD2-CD2 3.95Å; F262-L288 HydrophobicContact CE2-CD2 4.31Å; F262-K291 HydrophobicContact CD1-CG 4.02Å; F262-K291 HydrophobicContact CD2-CG 3.89Å; F262-K291 HydrophobicContact CE1-CG 3.99Å; F262-K291 HydrophobicContact CE2-CB 4.28Å; F262-K291 HydrophobicContact CE2-CG 3.86Å; F262-K291 HydrophobicContact CG-CG 3.98Å; F262-K291 HydrophobicContact CZ-CB 4.48Å; F262-K291 HydrophobicContact CZ-CG 3.92Å; F262-F292 HydrophobicContact CZ-CB 3.95Å; F262-F292 HydrophobicContact CZ-CD2 4.27Å; F262-E295 HydrophobicContact CE1-CG 4.13Å |
| 263 | Y | 93.2 | Very high | 91.8 | Very high | 2 Ų | 2 | 41.4 Ų | 41.4 | 1% | 0.008 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -68.7 | -35.3 | 176 | -76.3 | -80.8 | 0 | 0 | 0 | 113.2 | T259 T260 L266 S267 E295 L302 V303 A306 I387 | T259-Y263 HydrophobicContact CG2-CD2 3.9Å; T259-Y263 HydrophobicContact CG2-CE2 3.69Å; T259-Y263 VanDerWaalsContact O-CD2 3.31Å; T259-Y263 WeakPolarHBondContact O-CD2 3.3Å; T259-Y263 PolarHBondContact O-N 3.14Å; T260-Y263 PolarHBondContact O-N 3.47Å; Y263-L266 HydrophobicContact CD1-CD2 4.44Å; Y263-L266 PolarHBondContact O-N 2.9Å; Y263-S267 WeakPolarHBondContact O-CB 3.16Å; Y263-S267 PolarHBondContact O-N 3.22Å; Y263-E295 HydrophobicContact CE2-CG 4.31Å; Y263-E295 WeakPolarHBondContact OH-CB 3.36Å; Y263-E295 PolarHBondContact OH-OE2 3.45Å; Y263-E295 VanDerWaalsContact OH-OE2 3.1Å; Y263-L302 HydrophobicContact CD1-CB 4.16Å; Y263-L302 HydrophobicContact CE1-CB 3.45Å; Y263-L302 VanDerWaalsContact CE1-CB 3.45Å; Y263-L302 HydrophobicContact CE1-CD1 4.49Å; Y263-L302 HydrophobicContact CE2-CD1 4.48Å; Y263-V303 HydrophobicContact CE1-CG2 3.95Å; Y263-A306 HydrophobicContact CD1-CB 4.21Å; Y263-I387 HydrophobicContact CD1-CG2 4.1Å; Y263-I387 HydrophobicContact CD2-CD1 3.36Å; Y263-I387 HydrophobicContact CD2-CG1 3.83Å; Y263-I387 HydrophobicContact CD2-CG2 4.01Å; Y263-I387 HydrophobicContact CE2-CD1 3.39Å; Y263-I387 HydrophobicContact CE2-CG1 4.35Å; Y263-I387 HydrophobicContact CG-CD1 4.22Å; Y263-I387 HydrophobicContact CG-CG1 4.34Å; Y263-I387 HydrophobicContact CG-CG2 3.72Å |
| 264 | R | 90.3 | Very high | 92 | Very high | 102 Ų | 102 | 39.9 Ų | 39.9 | 39% | 0.385 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -61.4 | -47.1 | 170.5 | -71.8 | -178.6 | -178.9 | -154.5 | -1.4 | 111.7 | T260 R261 L266 S267 T268 L318 V390 | T260-R264 WeakPolarHBondContact O-CG 3.47Å; T260-R264 PolarHBondContact O-N 2.97Å; R261-R264 PolarHBondContact O-N 3.39Å; R264-L266 PolarHBondContact O-N 3.05Å; R264-S267 PolarHBondContact O-N 3.43Å; R264-T268 PolarHBondContact O-N 3.38Å; R264-T268 PolarHBondContact O-OG1 2.86Å; R264-L318 HydrophobicContact CB-CD2 3.88Å; R264-V390 HydrophobicContact CG-CG1 3.76Å; R264-V390 VanDerWaalsContact NE-CG1 3.34Å |
| 265 | A | 92.3 | Very high | 92.1 | Very high | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -64.7 | -39.1 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112 | R261 F262 S267 T268 I269 M276 F280 L318 | R261-A265 WeakPolarHBondContact O-CB 3.41Å; R261-A265 PolarHBondContact O-N 2.68Å; F262-A265 PolarHBondContact O-N 2.92Å; A265-S267 VanDerWaalsContact C-N 3.3Å; A265-S267 PolarHBondContact O-N 3.3Å; A265-T268 PolarHBondContact O-N 3.05Å; A265-T268 VanDerWaalsContact O-N 3.16Å; A265-I269 HydrophobicContact CB-CD1 4.45Å; A265-I269 WeakPolarHBondContact O-CB 3.29Å; A265-I269 PolarHBondContact O-N 3.35Å; A265-M276 HydrophobicContact CB-CE 4.21Å; A265-M276 HydrophobicContact CB-CG 3.96Å; A265-M276 HydrophobicContact CB-SD 4.32Å; A265-F280 HydrophobicContact CB-CE2 4.26Å; A265-L318 HydrophobicContact CB-CD2 4.13Å |
| 266 | L | 93.6 | Very high | 92.2 | Very high | 1 Ų | 1 | 37.7 Ų | 37.7 | 1% | 0.005 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -62.1 | -36.3 | 174.4 | -171.4 | 65.8 | 0 | 0 | 0 | 112.2 | F262 Y263 R264 G270 M276 F292 V303 A306 L307 | F262-L266 HydrophobicContact CE1-CD2 4.39Å; F262-L266 VanDerWaalsContact O-CB 3.31Å; F262-L266 WeakPolarHBondContact O-CB 3.49Å; F262-L266 PolarHBondContact O-N 2.93Å; Y263-L266 HydrophobicContact CD1-CD2 4.44Å; Y263-L266 PolarHBondContact O-N 2.9Å; R264-L266 PolarHBondContact O-N 3.05Å; L266-G270 WeakPolarHBondContact O-CA 2.95Å; L266-G270 PolarHBondContact O-N 3.48Å; L266-M276 HydrophobicContact CB-CE 4.31Å; L266-M276 HydrophobicContact CD1-CE 4.25Å; L266-F292 HydrophobicContact CD1-CD2 4.01Å; L266-F292 HydrophobicContact CD1-CE2 3.97Å; L266-F292 HydrophobicContact CD2-CD2 4.36Å; L266-F292 HydrophobicContact CD2-CE2 4.28Å; L266-V303 HydrophobicContact CD2-CG1 4.29Å; L266-A306 HydrophobicContact CB-CB 4.37Å; L266-A306 HydrophobicContact CD2-CB 3.99Å; L266-A306 HydrophobicContact CG-CB 4.21Å; L266-L307 HydrophobicContact CD1-CD2 3.83Å; L266-L307 HydrophobicContact CD1-CG 4.48Å; L266-L307 HydrophobicContact CG-CD2 4.01Å; L266-L307 HydrophobicContact CG-CG 4.32Å |
| 267 | S | 91.5 | Very high | 92.4 | Very high | 1 Ų | 1 | 37.8 Ų | 37.8 | 1% | 0.007 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -73.8 | -26.1 | 174 | 167.9 | 0 | 0 | 0 | 0 | 113.6 | Y263 R264 A265 A306 N309 R310 R311 | Y263-S267 WeakPolarHBondContact O-CB 3.16Å; Y263-S267 PolarHBondContact O-N 3.22Å; R264-S267 PolarHBondContact O-N 3.43Å; A265-S267 VanDerWaalsContact C-N 3.3Å; A265-S267 PolarHBondContact O-N 3.3Å; S267-A306 VanDerWaalsContact CA-O 3.3Å; S267-A306 WeakPolarHBondContact CA-O 3.32Å; S267-N309 PolarHBondContact OG-O 3.35Å; S267-R310 CarbonylContact O-C 3.33Å; S267-R310 WeakPolarHBondContact O-CA 3.36Å; S267-R311 PolarHBondContact O-N 3.47Å; S267-R311 WeakPolarHBondContact OG-CD 3.43Å; S267-R311 PolarHBondContact OG-NH1 3.22Å |
| 268 | T | 89.8 | Confident | 92.4 | Very high | 11 Ų | 11 | 38.2 Ų | 38.2 | 7% | 0.067 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -85 | -56.1 | 177.8 | -39.5 | 0 | 0 | 0 | 0 | 112 | R264 A265 Y313 L315 L318 | R264-T268 PolarHBondContact O-N 3.38Å; R264-T268 PolarHBondContact O-OG1 2.86Å; A265-T268 PolarHBondContact O-N 3.05Å; A265-T268 VanDerWaalsContact O-N 3.16Å; T268-Y313 HydrophobicContact CG2-CD2 4.31Å; T268-Y313 VanDerWaalsContact OG1-CD2 3.31Å; T268-Y313 WeakPolarHBondContact OG1-CD2 3.29Å; T268-L315 HydrophobicContact CG2-CD2 3.82Å; T268-L318 WeakPolarHBondContact OG1-CD2 3.45Å |
| 269 | I | 91.4 | Very high | 92.3 | Very high | 29 Ų | 29 | 37.2 Ų | 37.2 | 15% | 0.149 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -91.9 | -30.5 | -167.6 | -62.9 | 160.9 | 0 | 0 | 0 | 110.8 | A265 D272 V275 M276 M279 L315 | A265-I269 HydrophobicContact CB-CD1 4.45Å; A265-I269 WeakPolarHBondContact O-CB 3.29Å; A265-I269 PolarHBondContact O-N 3.35Å; I269-D272 HydrophobicContact CG2-CB 4.05Å; I269-V275 HydrophobicContact CD1-CG1 3.99Å; I269-V275 HydrophobicContact CG1-CG1 4.08Å; I269-V275 HydrophobicContact CG2-CB 3.89Å; I269-V275 HydrophobicContact CG2-CG1 3.94Å; I269-M276 HydrophobicContact CD1-CB 4.2Å; I269-M279 HydrophobicContact CD1-CG 3.94Å; I269-L315 HydrophobicContact CD1-CD2 4.31Å; I269-L315 HydrophobicContact CG1-CD2 4.01Å |
| 270 | G | 92.7 | Very high | 92.2 | Very high | 16 Ų | 16 | 37.4 Ų | 37.4 | 17% | 0.165 | 18% | 0.179 | C | C | . | . | trans | 79 | -145.9 | -165.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | L266 D272 M276 | L266-G270 WeakPolarHBondContact O-CA 2.95Å; L266-G270 PolarHBondContact O-N 3.48Å; G270-D272 VanDerWaalsContact C-N 3.33Å; G270-D272 PolarHBondContact O-N 2.92Å; G270-M276 WeakPolarHBondContact O-CE 3.09Å | ||
| 271 | T | 94.2 | Very high | 92 | Very high | 78 Ų | 78 | 41.3 Ų | 41.3 | 48% | 0.479 | 21% | 0.205 | S | C | . | . | S | Bend | trans | -84.9 | 7.8 | -171.9 | 51.6 | 0 | 0 | 0 | 0 | 115 | F273 F292 L307 | T271-F273 WeakPolarHBondContact O-CD2 3.5Å; T271-F273 VanDerWaalsContact O-CE2 3.23Å; T271-F273 WeakPolarHBondContact O-CE2 3.33Å; T271-F273 PolarHBondContact O-N 3.05Å; T271-F292 HydrophobicContact CG2-CE2 4.28Å; T271-F292 HydrophobicContact CG2-CZ 4.31Å; T271-L307 HydrophobicContact CG2-CD2 4.02Å |
| 272 | D | 94.6 | Very high | 91.9 | Very high | 68 Ų | 68 | 45.4 Ų | 45.4 | 36% | 0.364 | 22% | 0.22 | S | C | . | . | trans | -78.9 | 93.3 | 173.6 | -169.5 | -3.6 | 0 | 0 | 0 | 112.2 | I269 G270 Y274 V275 M276 R285 | I269-D272 HydrophobicContact CG2-CB 4.05Å; G270-D272 VanDerWaalsContact C-N 3.33Å; G270-D272 PolarHBondContact O-N 2.92Å; D272-Y274 PolarHBondContact O-N 3.42Å; D272-Y274 WeakPolarHBondContact OD1-CB 3.22Å; D272-Y274 PolarHBondContact OD1-N 3.4Å; D272-V275 PolarHBondContact O-N 2.87Å; D272-V275 WeakPolarHBondContact OD2-CG2 3.24Å; D272-M276 WeakPolarHBondContact O-CB 3.15Å; D272-M276 PolarHBondContact O-N 2.94Å; D272-R285 IonicContact OD1-NH1 2.84Å; D272-R285 PolarHBondContact OD1-NH1 3.18Å | ||
| 273 | F | 95.3 | Very high | 91.8 | Very high | 26 Ų | 26 | 46 Ų | 46 | 11% | 0.114 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -66.6 | -13.4 | 178.5 | -52 | -65.7 | 0 | 0 | 0 | 114.9 | T271 M276 E277 R285 L288 V289 F292 | T271-F273 WeakPolarHBondContact O-CD2 3.5Å; T271-F273 VanDerWaalsContact O-CE2 3.23Å; T271-F273 WeakPolarHBondContact O-CE2 3.33Å; T271-F273 PolarHBondContact O-N 3.05Å; F273-M276 HydrophobicContact CD1-SD 4.33Å; F273-E277 WeakPolarHBondContact O-CB 3.46Å; F273-E277 PolarHBondContact O-N 2.96Å; F273-E277 VanDerWaalsContact O-N 3.11Å; F273-R285 HydrophobicContact CB-CG 3.92Å; F273-L288 HydrophobicContact CB-CB 4.39Å; F273-L288 HydrophobicContact CD1-CB 4.14Å; F273-V289 HydrophobicContact CB-CG2 4.11Å; F273-V289 HydrophobicContact CD1-CG2 4.49Å; F273-V289 HydrophobicContact CD2-CG2 3.42Å; F273-V289 VanDerWaalsContact CD2-CG2 3.42Å; F273-V289 HydrophobicContact CE2-CG2 3.93Å; F273-V289 HydrophobicContact CG-CG2 3.74Å; F273-F292 HydrophobicContact CE1-CB 3.69Å; F273-F292 HydrophobicContact CE1-CD2 4.16Å; F273-F292 AromaticContact CE1-CG 3.96Å; F273-F292 HydrophobicContact CE1-CG 3.96Å; F273-F292 HydrophobicContact CZ-CB 3.74Å; F273-F292 HydrophobicContact CZ-CD1 4.05Å; F273-F292 HydrophobicContact CZ-CD2 4.09Å; F273-F292 AromaticContact CZ-CG 3.67Å; F273-F292 HydrophobicContact CZ-CG 3.67Å |
| 274 | Y | 94.2 | Very high | 91.7 | Very high | 142 Ų | 142 | 50.9 Ų | 50.9 | 56% | 0.557 | 24% | 0.243 | S | C | * | . | H | α-helix | trans | -84.1 | -43.2 | 178.1 | 179.3 | -112.7 | 0 | 0 | 0 | 110.9 | D272 M276 E277 R285 | D272-Y274 PolarHBondContact O-N 3.42Å; D272-Y274 WeakPolarHBondContact OD1-CB 3.22Å; D272-Y274 PolarHBondContact OD1-N 3.4Å; Y274-M276 VanDerWaalsContact C-N 3.29Å; Y274-E277 WeakPolarHBondContact O-CB 3.3Å; Y274-E277 PolarHBondContact O-N 2.81Å; Y274-R285 VanDerWaalsContact CB-NH1 3.29Å |
| 275 | V | 92.2 | Very high | 91.9 | Very high | 51 Ų | 51 | 51.1 Ų | 51.1 | 31% | 0.309 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -64.7 | -39.4 | 169.1 | 178 | 0 | 0 | 0 | 0 | 110 | I269 D272 E277 K278 | I269-V275 HydrophobicContact CD1-CG1 3.99Å; I269-V275 HydrophobicContact CG1-CG1 4.08Å; I269-V275 HydrophobicContact CG2-CB 3.89Å; I269-V275 HydrophobicContact CG2-CG1 3.94Å; D272-V275 PolarHBondContact O-N 2.87Å; D272-V275 WeakPolarHBondContact OD2-CG2 3.24Å; V275-E277 VanDerWaalsContact C-N 3.33Å; V275-E277 PolarHBondContact O-N 2.75Å; V275-K278 PolarHBondContact O-N 3.22Å |
| 276 | M | 92.5 | Very high | 91.9 | Very high | 0 Ų | 0 | 54.9 Ų | 54.9 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -62.6 | -34.6 | 176 | -168.4 | 178.1 | -64.7 | 0 | 0 | 113.4 | F262 A265 L266 I269 G270 D272 F273 Y274 K278 M279 F280 L288 | F262-M276 HydrophobicContact CD2-SD 3.85Å; F262-M276 HydrophobicContact CE2-SD 3.82Å; A265-M276 HydrophobicContact CB-CE 4.21Å; A265-M276 HydrophobicContact CB-CG 3.96Å; A265-M276 HydrophobicContact CB-SD 4.32Å; L266-M276 HydrophobicContact CB-CE 4.31Å; L266-M276 HydrophobicContact CD1-CE 4.25Å; I269-M276 HydrophobicContact CD1-CB 4.2Å; G270-M276 WeakPolarHBondContact O-CE 3.09Å; D272-M276 WeakPolarHBondContact O-CB 3.15Å; D272-M276 PolarHBondContact O-N 2.94Å; F273-M276 HydrophobicContact CD1-SD 4.33Å; Y274-M276 VanDerWaalsContact C-N 3.29Å; M276-K278 PolarHBondContact O-N 2.95Å; M276-M279 VanDerWaalsContact O-CB 3.31Å; M276-M279 WeakPolarHBondContact O-CB 3.46Å; M276-M279 WeakPolarHBondContact O-CG 3.18Å; M276-M279 PolarHBondContact O-N 2.97Å; M276-F280 HydrophobicContact CG-CD2 4.16Å; M276-F280 HydrophobicContact CG-CE2 3.83Å; M276-F280 WeakPolarHBondContact O-CD2 3.46Å; M276-F280 HydrophobicContact SD-CE2 4.43Å; M276-L288 HydrophobicContact CB-CD1 4.2Å; M276-L288 HydrophobicContact CG-CD1 4.04Å; M276-L288 HydrophobicContact CG-CD2 4.25Å; M276-L288 HydrophobicContact SD-CD1 4.46Å; M276-L288 HydrophobicContact SD-CD2 3.96Å |
| 277 | E | 92.9 | Very high | 91.8 | Very high | 54 Ų | 54 | 56.3 Ų | 56.3 | 25% | 0.252 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -56 | -36.4 | 178.8 | -175.5 | 166 | -142.4 | 0 | 0 | 112.7 | F273 Y274 V275 M279 F280 K284 R285 L288 | F273-E277 WeakPolarHBondContact O-CB 3.46Å; F273-E277 PolarHBondContact O-N 2.96Å; F273-E277 VanDerWaalsContact O-N 3.11Å; Y274-E277 WeakPolarHBondContact O-CB 3.3Å; Y274-E277 PolarHBondContact O-N 2.81Å; V275-E277 VanDerWaalsContact C-N 3.33Å; V275-E277 PolarHBondContact O-N 2.75Å; E277-M279 PolarHBondContact O-N 2.96Å; E277-M279 VanDerWaalsContact O-N 3.13Å; E277-F280 CarbonylContact O-C 3.44Å; E277-F280 PolarHBondContact O-N 3.39Å; E277-K284 VanDerWaalsContact OE1-CA 3.24Å; E277-K284 WeakPolarHBondContact OE1-CA 3.39Å; E277-R285 VanDerWaalsContact CD-N 3.29Å; E277-R285 PolarHBondContact OE1-N 3.04Å; E277-R285 WeakPolarHBondContact OE2-CB 3.31Å; E277-L288 HydrophobicContact CB-CD1 4.14Å |
| 278 | K | 90.6 | Very high | 92 | Very high | 135 Ų | 135 | 56.3 Ų | 56.3 | 59% | 0.587 | 28% | 0.277 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.7 | -26.1 | 175.9 | -60.2 | -173.7 | 177.1 | -173.6 | 0 | 113.3 | V275 M276 F280 F319 | V275-K278 PolarHBondContact O-N 3.22Å; M276-K278 PolarHBondContact O-N 2.95Å; K278-F280 VanDerWaalsContact C-N 3.31Å; K278-F319 VanDerWaalsContact O-CE1 3.26Å; K278-F319 WeakPolarHBondContact O-CE1 3.29Å |
| 279 | M | 88.5 | Confident | 92.2 | Very high | 3 Ų | 3 | 57.6 Ų | 57.6 | 2% | 0.015 | 29% | 0.285 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -82 | -11.4 | 179.2 | -39.6 | -48.4 | -70.7 | 0 | 0 | 112.6 | I269 M276 E277 L315 L318 F319 | I269-M279 HydrophobicContact CD1-CG 3.94Å; M276-M279 VanDerWaalsContact O-CB 3.31Å; M276-M279 WeakPolarHBondContact O-CB 3.46Å; M276-M279 WeakPolarHBondContact O-CG 3.18Å; M276-M279 PolarHBondContact O-N 2.97Å; E277-M279 PolarHBondContact O-N 2.96Å; E277-M279 VanDerWaalsContact O-N 3.13Å; M279-L315 HydrophobicContact CE-CB 4.13Å; M279-L315 WeakPolarHBondContact CE-O 3.42Å; M279-L318 HydrophobicContact CE-CB 3.47Å; M279-L318 VanDerWaalsContact CE-CB 3.47Å; M279-F319 HydrophobicContact CE-CD1 4.49Å; M279-F319 HydrophobicContact CE-CD2 3.71Å; M279-F319 HydrophobicContact CE-CE1 4.45Å; M279-F319 HydrophobicContact CE-CE2 3.68Å; M279-F319 HydrophobicContact CE-CG 4.14Å; M279-F319 HydrophobicContact CE-CZ 4.06Å; M279-F319 HydrophobicContact SD-CE1 4.16Å; M279-F319 HydrophobicContact SD-CE2 4.05Å; M279-F319 HydrophobicContact SD-CZ 3.83Å |
| 280 | F | 90.8 | Very high | 92.3 | Very high | 7 Ų | 7 | 59.3 Ų | 59.3 | 3% | 0.031 | 30% | 0.299 | C | S | . | . | trans | -127.6 | 80.3 | -176.9 | -65.1 | -88.4 | 0 | 0 | 0 | 111 | E258 R261 F262 A265 M276 E277 K278 R282 R283 L288 | E258-F280 HydrophobicContact CG-CD1 4.1Å; E258-F280 HydrophobicContact CG-CE1 3.87Å; R261-F280 HydrophobicContact CB-CE1 4.03Å; R261-F280 HydrophobicContact CB-CZ 4.03Å; R261-F280 HydrophobicContact CG-CE1 3.86Å; R261-F280 HydrophobicContact CG-CE2 4.41Å; R261-F280 HydrophobicContact CG-CZ 3.63Å; F262-F280 HydrophobicContact CB-CZ 4.03Å; A265-F280 HydrophobicContact CB-CE2 4.26Å; M276-F280 HydrophobicContact CG-CD2 4.16Å; M276-F280 HydrophobicContact CG-CE2 3.83Å; M276-F280 WeakPolarHBondContact O-CD2 3.46Å; M276-F280 HydrophobicContact SD-CE2 4.43Å; E277-F280 CarbonylContact O-C 3.44Å; E277-F280 PolarHBondContact O-N 3.39Å; K278-F280 VanDerWaalsContact C-N 3.31Å; F280-R282 PolarHBondContact O-N 2.88Å; F280-R283 HydrophobicContact CB-CB 3.84Å; F280-R283 HydrophobicContact CB-CG 4.22Å; F280-R283 PolarHBondContact O-N 3.21Å; F280-L288 HydrophobicContact CD2-CD1 4.24Å; F280-L288 HydrophobicContact CD2-CD2 3.75Å; F280-L288 HydrophobicContact CE2-CD2 3.9Å; F280-L288 HydrophobicContact CG-CD2 4.25Å; F280-L288 HydrophobicContact CZ-CD2 4.48Å | ||
| 281 | P | 87.7 | Confident | 92.4 | Very high | 98 Ų | 98 | 58.7 Ų | 58.7 | 64% | 0.636 | 29% | 0.292 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61 | -8.8 | -177.7 | 26 | -36.2 | 0 | 0 | 0 | 114.5 | P320 | P281-P320 HydrophobicContact CG-CG 3.78Š|
| 282 | R | 87.9 | Confident | 92.5 | Very high | 129 Ų | 129 | 56.3 Ų | 56.3 | 49% | 0.487 | 28% | 0.275 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -114.6 | 6 | -178.9 | -61.5 | -179.6 | 171.7 | -80.3 | 10.4 | 113.7 | F280 E324 | F280-R282 PolarHBondContact O-N 2.88Å; R282-E324 IonicContact CZ-OE1 3.14Å; R282-E324 IonicContact CZ-OE2 2.65Å; R282-E324 IonicContact NE-OE1 3.51Å; R282-E324 PolarHBondContact NE-OE1 2.9Å; R282-E324 IonicContact NE-OE2 3.57Å; R282-E324 VanDerWaalsContact NH2-CD 3.27Å; R282-E324 IonicContact NH2-OE1 2.68Å; R282-E324 PolarHBondContact NH2-OE1 3.08Å; R282-E324 VanDerWaalsContact NH2-OE1 3.14Å; R282-E324 IonicContact NH2-OE2 3.35Å; R282-E324 PolarHBondContact NH2-OE2 2.9Å |
| 283 | R | 91.2 | Very high | 92.6 | Very high | 14 Ų | 14 | 59 Ų | 59 | 5% | 0.053 | 28% | 0.284 | C | S | . | . | trans | -129.5 | 140.3 | 178.2 | -63.8 | -65.7 | -173.4 | 171.6 | -0.2 | 111.9 | R252 K253 W254 E258 F280 E287 | R252-R283 PolarHBondContact O-NH1 3.35Å; R252-R283 PolarHBondContact O-NH2 3.2Å; K253-R283 PolarHBondContact O-NH2 2.91Å; W254-R283 HydrophobicContact CH2-CG 4.14Å; W254-R283 HydrophobicContact CZ2-CG 4.4Å; E258-R283 VanDerWaalsContact OE1-CG 3.28Å; E258-R283 WeakPolarHBondContact OE1-CG 2.97Å; E258-R283 IonicContact OE1-CZ 3.05Å; E258-R283 IonicContact OE1-NE 2.89Å; E258-R283 PolarHBondContact OE1-NE 2.9Å; E258-R283 IonicContact OE1-NH2 3.61Å; E258-R283 PolarHBondContact OE1-NH2 2.82Å; E258-R283 IonicContact OE2-CZ 2.65Å; E258-R283 IonicContact OE2-NE 2.71Å; E258-R283 IonicContact OE2-NH2 3.71Å; E258-R283 PolarHBondContact OE2-NH2 3.26Å; F280-R283 HydrophobicContact CB-CB 3.84Å; F280-R283 HydrophobicContact CB-CG 4.22Å; F280-R283 PolarHBondContact O-N 3.21Å; R283-E287 VanDerWaalsContact CA-OE2 3.27Å; R283-E287 WeakPolarHBondContact CA-OE2 3.49Å; R283-E287 VanDerWaalsContact CD-OE2 3.24Å; R283-E287 WeakPolarHBondContact CD-OE2 3.46Å; R283-E287 IonicContact CZ-OE1 3.8Å; R283-E287 IonicContact NH1-OE1 3.7Å; R283-E287 PolarHBondContact NH1-OE1 3.38Å | ||
| 284 | K | 91.5 | Very high | 92.6 | Very high | 104 Ų | 104 | 61.5 Ų | 61.5 | 45% | 0.452 | 29% | 0.292 | S | S | . | . | trans | -88.4 | 154.7 | 173.9 | -63.7 | -179.6 | 176.8 | -179.4 | 0 | 111.2 | D248 E277 S286 E287 L288 | D248-K284 IonicContact OD2-NZ 2.76Å; D248-K284 PolarHBondContact OD2-NZ 2.72Å; E277-K284 VanDerWaalsContact OE1-CA 3.24Å; E277-K284 WeakPolarHBondContact OE1-CA 3.39Å; K284-S286 PolarHBondContact O-N 2.95Å; K284-S286 VanDerWaalsContact O-N 3.09Å; K284-E287 PolarHBondContact N-OE2 3.15Å; K284-E287 WeakPolarHBondContact O-CA 3.28Å; K284-E287 WeakPolarHBondContact O-CB 3.42Å; K284-E287 PolarHBondContact O-N 3.04Å; K284-L288 PolarHBondContact O-N 3.43Å | ||
| 285 | R | 93.5 | Very high | 92.6 | Very high | 107 Ų | 107 | 54.9 Ų | 54.9 | 40% | 0.404 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -49.1 | -37.5 | 176 | 169.9 | 173.4 | 168.9 | 103.3 | -6.9 | 112.9 | D272 F273 Y274 E277 E287 L288 V289 | D272-R285 IonicContact OD1-NH1 2.84Å; D272-R285 PolarHBondContact OD1-NH1 3.18Å; F273-R285 HydrophobicContact CB-CG 3.92Å; Y274-R285 VanDerWaalsContact CB-NH1 3.29Å; E277-R285 VanDerWaalsContact CD-N 3.29Å; E277-R285 PolarHBondContact OE1-N 3.04Å; E277-R285 WeakPolarHBondContact OE2-CB 3.31Å; R285-E287 VanDerWaalsContact C-N 3.33Å; R285-E287 PolarHBondContact O-N 2.94Å; R285-L288 PolarHBondContact O-N 2.82Å; R285-V289 WeakPolarHBondContact O-CG2 3.49Å; R285-V289 PolarHBondContact O-N 3.06Å |
| 286 | S | 92.5 | Very high | 92.7 | Very high | 79 Ų | 79 | 57 Ų | 57 | 55% | 0.552 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -64.7 | -32.5 | 176.5 | 57 | 0 | 0 | 0 | 0 | 113.6 | K284 S290 | K284-S286 PolarHBondContact O-N 2.95Å; K284-S286 VanDerWaalsContact O-N 3.09Å; S286-S290 WeakPolarHBondContact O-CB 3.08Å; S286-S290 PolarHBondContact O-N 2.95Å; S286-S290 VanDerWaalsContact O-N 3.12Å; S286-S290 PolarHBondContact O-OG 3.39Å |
| 287 | E | 93.1 | Very high | 92.8 | Very high | 31 Ų | 31 | 65.4 Ų | 65.4 | 15% | 0.145 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -73.2 | -37.9 | 173 | -64.3 | -175.8 | 96.6 | 0 | 0 | 111.7 | W254 R283 K284 R285 S290 K291 | W254-E287 HydrophobicContact CZ2-CB 4.41Å; R283-E287 VanDerWaalsContact CA-OE2 3.27Å; R283-E287 WeakPolarHBondContact CA-OE2 3.49Å; R283-E287 VanDerWaalsContact CD-OE2 3.24Å; R283-E287 WeakPolarHBondContact CD-OE2 3.46Å; R283-E287 IonicContact CZ-OE1 3.8Å; R283-E287 IonicContact NH1-OE1 3.7Å; R283-E287 PolarHBondContact NH1-OE1 3.38Å; K284-E287 PolarHBondContact N-OE2 3.15Å; K284-E287 WeakPolarHBondContact O-CA 3.28Å; K284-E287 WeakPolarHBondContact O-CB 3.42Å; K284-E287 PolarHBondContact O-N 3.04Å; R285-E287 VanDerWaalsContact C-N 3.33Å; R285-E287 PolarHBondContact O-N 2.94Å; E287-S290 CarbonylContact O-C 3.57Å; E287-S290 WeakPolarHBondContact O-CB 3.19Å; E287-S290 PolarHBondContact O-N 2.94Å; E287-K291 WeakPolarHBondContact O-CB 3.37Å; E287-K291 PolarHBondContact O-N 3.42Å |
| 288 | L | 94.5 | Very high | 92.7 | Very high | 0 Ų | 0 | 67.7 Ų | 67.7 | 0% | 0 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -64.6 | -45.7 | 175.9 | -69.9 | 167.4 | 0 | 0 | 0 | 111.7 | W254 F262 F273 M276 E277 F280 K284 R285 S290 K291 F292 | W254-L288 HydrophobicContact CH2-CD2 3.9Å; F262-L288 HydrophobicContact CD2-CD2 3.95Å; F262-L288 HydrophobicContact CE2-CD2 4.31Å; F273-L288 HydrophobicContact CB-CB 4.39Å; F273-L288 HydrophobicContact CD1-CB 4.14Å; M276-L288 HydrophobicContact CB-CD1 4.2Å; M276-L288 HydrophobicContact CG-CD1 4.04Å; M276-L288 HydrophobicContact CG-CD2 4.25Å; M276-L288 HydrophobicContact SD-CD1 4.46Å; M276-L288 HydrophobicContact SD-CD2 3.96Å; E277-L288 HydrophobicContact CB-CD1 4.14Å; F280-L288 HydrophobicContact CD2-CD1 4.24Å; F280-L288 HydrophobicContact CD2-CD2 3.75Å; F280-L288 HydrophobicContact CE2-CD2 3.9Å; F280-L288 HydrophobicContact CG-CD2 4.25Å; F280-L288 HydrophobicContact CZ-CD2 4.48Å; K284-L288 PolarHBondContact O-N 3.43Å; R285-L288 PolarHBondContact O-N 2.82Å; L288-S290 VanDerWaalsContact C-N 3.27Å; L288-S290 PolarHBondContact O-N 3.03Å; L288-K291 WeakPolarHBondContact O-CB 3.04Å; L288-K291 PolarHBondContact O-N 3.45Å; L288-K291 VanDerWaalsContact O-N 3.14Å; L288-F292 PolarHBondContact O-N 2.87Å |
| 289 | V | 94.9 | Very high | 92.8 | Very high | 38 Ų | 38 | 63 Ų | 63 | 23% | 0.23 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -57.8 | -42.2 | 171.2 | 173.1 | 0 | 0 | 0 | 0 | 111 | F273 R285 K291 F292 K293 | F273-V289 HydrophobicContact CB-CG2 4.11Å; F273-V289 HydrophobicContact CD1-CG2 4.49Å; F273-V289 HydrophobicContact CD2-CG2 3.42Å; F273-V289 VanDerWaalsContact CD2-CG2 3.42Å; F273-V289 HydrophobicContact CE2-CG2 3.93Å; F273-V289 HydrophobicContact CG-CG2 3.74Å; R285-V289 WeakPolarHBondContact O-CG2 3.49Å; R285-V289 PolarHBondContact O-N 3.06Å; V289-K291 VanDerWaalsContact C-N 3.32Å; V289-K291 PolarHBondContact O-N 2.86Å; V289-F292 PolarHBondContact O-N 3.03Å; V289-K293 HydrophobicContact CG1-CD 4.3Å; V289-K293 WeakPolarHBondContact O-CG 3.5Å; V289-K293 PolarHBondContact O-N 2.88Å |
| 290 | S | 94.1 | Very high | 93 | Very high | 65 Ų | 65 | 66 Ų | 66 | 46% | 0.455 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -70.8 | -26 | 178.6 | -61.1 | 0 | 0 | 0 | 0 | 113.5 | S286 E287 L288 R294 | S286-S290 WeakPolarHBondContact O-CB 3.08Å; S286-S290 PolarHBondContact O-N 2.95Å; S286-S290 VanDerWaalsContact O-N 3.12Å; S286-S290 PolarHBondContact O-OG 3.39Å; E287-S290 CarbonylContact O-C 3.57Å; E287-S290 WeakPolarHBondContact O-CB 3.19Å; E287-S290 PolarHBondContact O-N 2.94Å; L288-S290 VanDerWaalsContact C-N 3.27Å; L288-S290 PolarHBondContact O-N 3.03Å; S290-R294 WeakPolarHBondContact O-CB 3.47Å; S290-R294 PolarHBondContact O-N 3.15Å |
| 291 | K | 94.8 | Very high | 93.1 | Very high | 4 Ų | 4 | 72.7 Ų | 72.7 | 2% | 0.017 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -75.1 | -48.6 | 172.1 | 174.9 | 63.9 | 169.3 | 176.6 | 0 | 110.1 | W254 T259 F262 E287 L288 V289 K293 R294 E295 | W254-K291 HydrophobicContact CD2-CB 4.47Å; W254-K291 HydrophobicContact CD2-CD 3.59Å; W254-K291 HydrophobicContact CD2-CG 4.06Å; W254-K291 HydrophobicContact CE3-CD 3.75Å; W254-K291 HydrophobicContact CE3-CG 3.97Å; W254-K291 HydrophobicContact CG-CD 4.07Å; W254-K291 HydrophobicContact CH2-CB 3.84Å; W254-K291 HydrophobicContact CH2-CD 4.42Å; W254-K291 HydrophobicContact CH2-CG 3.8Å; W254-K291 HydrophobicContact CZ2-CB 3.53Å; W254-K291 HydrophobicContact CZ2-CD 4.26Å; W254-K291 HydrophobicContact CZ2-CG 3.86Å; W254-K291 HydrophobicContact CZ3-CB 4.39Å; W254-K291 HydrophobicContact CZ3-CD 4.16Å; W254-K291 HydrophobicContact CZ3-CG 3.84Å; T259-K291 PolarHBondContact OG1-NZ 3.12Å; F262-K291 HydrophobicContact CD1-CG 4.02Å; F262-K291 HydrophobicContact CD2-CG 3.89Å; F262-K291 HydrophobicContact CE1-CG 3.99Å; F262-K291 HydrophobicContact CE2-CB 4.28Å; F262-K291 HydrophobicContact CE2-CG 3.86Å; F262-K291 HydrophobicContact CG-CG 3.98Å; F262-K291 HydrophobicContact CZ-CB 4.48Å; F262-K291 HydrophobicContact CZ-CG 3.92Å; E287-K291 WeakPolarHBondContact O-CB 3.37Å; E287-K291 PolarHBondContact O-N 3.42Å; L288-K291 WeakPolarHBondContact O-CB 3.04Å; L288-K291 PolarHBondContact O-N 3.45Å; L288-K291 VanDerWaalsContact O-N 3.14Å; V289-K291 VanDerWaalsContact C-N 3.32Å; V289-K291 PolarHBondContact O-N 2.86Å; K291-K293 PolarHBondContact O-N 3.38Å; K291-R294 WeakPolarHBondContact O-CA 3.31Å; K291-R294 WeakPolarHBondContact O-CB 3.43Å; K291-R294 PolarHBondContact O-N 3.27Å; K291-E295 HydrophobicContact CD-CG 3.89Å; K291-E295 WeakPolarHBondContact CD-OE1 3.23Å; K291-E295 VanDerWaalsContact CE-OE1 3.3Å; K291-E295 WeakPolarHBondContact CE-OE1 3.19Å; K291-E295 HydrophobicContact CG-CG 4.34Å; K291-E295 IonicContact NZ-OE1 2.65Å; K291-E295 PolarHBondContact NZ-OE1 3.21Å; K291-E295 WeakPolarHBondContact O-CG 3.33Å; K291-E295 PolarHBondContact O-N 3.04Å |
| 292 | F | 96.1 | Very high | 93.3 | Very high | 27 Ų | 27 | 68.2 Ų | 68.2 | 12% | 0.118 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -53 | -54.6 | 175.1 | -177 | -93.4 | 0 | 0 | 0 | 111.8 | F262 L266 T271 F273 L288 V289 R294 E295 E296 V303 L307 | F262-F292 HydrophobicContact CZ-CB 3.95Å; F262-F292 HydrophobicContact CZ-CD2 4.27Å; L266-F292 HydrophobicContact CD1-CD2 4.01Å; L266-F292 HydrophobicContact CD1-CE2 3.97Å; L266-F292 HydrophobicContact CD2-CD2 4.36Å; L266-F292 HydrophobicContact CD2-CE2 4.28Å; T271-F292 HydrophobicContact CG2-CE2 4.28Å; T271-F292 HydrophobicContact CG2-CZ 4.31Å; F273-F292 HydrophobicContact CE1-CB 3.69Å; F273-F292 HydrophobicContact CE1-CD2 4.16Å; F273-F292 AromaticContact CE1-CG 3.96Å; F273-F292 HydrophobicContact CE1-CG 3.96Å; F273-F292 HydrophobicContact CZ-CB 3.74Å; F273-F292 HydrophobicContact CZ-CD1 4.05Å; F273-F292 HydrophobicContact CZ-CD2 4.09Å; F273-F292 AromaticContact CZ-CG 3.67Å; F273-F292 HydrophobicContact CZ-CG 3.67Å; L288-F292 PolarHBondContact O-N 2.87Å; V289-F292 PolarHBondContact O-N 3.03Å; F292-R294 PolarHBondContact O-N 3.24Å; F292-E295 PolarHBondContact O-N 3.26Å; F292-E295 VanDerWaalsContact O-N 3.12Å; F292-E296 VanDerWaalsContact O-CB 3.29Å; F292-E296 WeakPolarHBondContact O-CB 3.4Å; F292-E296 PolarHBondContact O-N 3.26Å; F292-V303 HydrophobicContact CE2-CG1 3.69Å; F292-V303 HydrophobicContact CZ-CG1 4.02Å; F292-L307 HydrophobicContact CE2-CD1 4.39Å; F292-L307 HydrophobicContact CZ-CD1 4.5Å |
| 293 | K | 95.7 | Very high | 93.6 | Very high | 124 Ų | 124 | 62.3 Ų | 62.3 | 54% | 0.539 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -62.4 | -14.2 | 176.8 | -69.3 | -178.4 | 178.8 | -174.9 | 0 | 114.8 | V289 K291 K297 | V289-K293 HydrophobicContact CG1-CD 4.3Å; V289-K293 WeakPolarHBondContact O-CG 3.5Å; V289-K293 PolarHBondContact O-N 2.88Å; K291-K293 PolarHBondContact O-N 3.38Å; K293-K297 WeakPolarHBondContact O-CD 3.3Å; K293-K297 WeakPolarHBondContact O-CG 3.21Å |
| 294 | R | 94.8 | Very high | 93.7 | Very high | 80 Ų | 80 | 65.6 Ų | 65.6 | 30% | 0.302 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -89.9 | -44.6 | 174.1 | -178.2 | -170.1 | -60 | 137.8 | 6 | 110.8 | W254 S290 K291 F292 K297 R298 | W254-R294 VanDerWaalsContact CD1-NH1 3.3Å; S290-R294 WeakPolarHBondContact O-CB 3.47Å; S290-R294 PolarHBondContact O-N 3.15Å; K291-R294 WeakPolarHBondContact O-CA 3.31Å; K291-R294 WeakPolarHBondContact O-CB 3.43Å; K291-R294 PolarHBondContact O-N 3.27Å; F292-R294 PolarHBondContact O-N 3.24Å; R294-K297 PolarHBondContact O-N 2.85Å; R294-R298 WeakPolarHBondContact O-CG 3.4Å; R294-R298 PolarHBondContact O-N 3.09Å; R294-R298 VanDerWaalsContact O-N 3.16Å |
| 295 | E | 94.6 | Very high | 93.7 | Very high | 2 Ų | 2 | 61.8 Ų | 61.8 | 1% | 0.009 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -68.8 | -40.2 | 178.3 | -64.2 | -42 | 134.7 | 0 | 0 | 111.6 | F262 Y263 K291 F292 K297 R298 N299 V303 | F262-E295 HydrophobicContact CE1-CG 4.13Å; Y263-E295 HydrophobicContact CE2-CG 4.31Å; Y263-E295 WeakPolarHBondContact OH-CB 3.36Å; Y263-E295 PolarHBondContact OH-OE2 3.45Å; Y263-E295 VanDerWaalsContact OH-OE2 3.1Å; K291-E295 HydrophobicContact CD-CG 3.89Å; K291-E295 WeakPolarHBondContact CD-OE1 3.23Å; K291-E295 VanDerWaalsContact CE-OE1 3.3Å; K291-E295 WeakPolarHBondContact CE-OE1 3.19Å; K291-E295 HydrophobicContact CG-CG 4.34Å; K291-E295 IonicContact NZ-OE1 2.65Å; K291-E295 PolarHBondContact NZ-OE1 3.21Å; K291-E295 WeakPolarHBondContact O-CG 3.33Å; K291-E295 PolarHBondContact O-N 3.04Å; F292-E295 PolarHBondContact O-N 3.26Å; F292-E295 VanDerWaalsContact O-N 3.12Å; E295-K297 PolarHBondContact O-N 3.45Å; E295-K297 VanDerWaalsContact O-N 3.13Å; E295-R298 PolarHBondContact O-N 2.88Å; E295-N299 CarbonylContact O-C 3.52Å; E295-N299 WeakPolarHBondContact O-CA 3.41Å; E295-N299 PolarHBondContact O-N 2.85Å; E295-N299 PolarHBondContact OE2-ND2 3.48Å; E295-N299 VanDerWaalsContact OE2-ND2 3.14Å; E295-V303 HydrophobicContact CB-CG2 3.83Å |
| 296 | E | 94.9 | Very high | 93.7 | Very high | 95 Ų | 95 | 56.7 Ų | 56.7 | 44% | 0.444 | 28% | 0.275 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -52.9 | -34.3 | 171.2 | -179.8 | -178.3 | -136.9 | 0 | 0 | 112.6 | F292 | F292-E296 VanDerWaalsContact O-CB 3.29Å; F292-E296 WeakPolarHBondContact O-CB 3.4Å; F292-E296 PolarHBondContact O-N 3.26Å |
| 297 | K | 94.7 | Very high | 93.6 | Very high | 177 Ų | 177 | 56 Ų | 56 | 77% | 0.77 | 27% | 0.265 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.9 | -12 | 178.7 | -66.1 | -176.1 | -177.7 | -167.2 | 0 | 114.8 | K293 R294 E295 | K293-K297 WeakPolarHBondContact O-CD 3.3Å; K293-K297 WeakPolarHBondContact O-CG 3.21Å; R294-K297 PolarHBondContact O-N 2.85Å; E295-K297 PolarHBondContact O-N 3.45Å; E295-K297 VanDerWaalsContact O-N 3.13Å |
| 298 | R | 91.4 | Very high | 93.5 | Very high | 102 Ų | 102 | 64.1 Ų | 64.1 | 39% | 0.385 | 29% | 0.294 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -106.5 | -54.1 | -178.3 | -77.4 | 179.9 | 168.8 | -113.6 | -11.5 | 111.3 | R294 E295 P300 E380 | R294-R298 WeakPolarHBondContact O-CG 3.4Å; R294-R298 PolarHBondContact O-N 3.09Å; R294-R298 VanDerWaalsContact O-N 3.16Å; E295-R298 PolarHBondContact O-N 2.88Å; R298-P300 VanDerWaalsContact C-CD 3.41Å; R298-P300 WeakPolarHBondContact O-CD 3.34Å; R298-E380 IonicContact CZ-OE2 2.7Å; R298-E380 IonicContact NH1-OE1 3.31Å; R298-E380 PolarHBondContact NH1-OE1 3.19Å; R298-E380 IonicContact NH1-OE2 2.68Å; R298-E380 PolarHBondContact NH1-OE2 3.36Å |
| 299 | N | 91.3 | Very high | 92.9 | Very high | 36 Ų | 36 | 66.1 Ų | 66.1 | 19% | 0.193 | 31% | 0.305 | C | S | . | . | trans | -128.8 | 59.6 | -168.2 | -58 | -44.4 | 0 | 0 | 0 | 109.6 | E295 Y301 L302 V303 | E295-N299 CarbonylContact O-C 3.52Å; E295-N299 WeakPolarHBondContact O-CA 3.41Å; E295-N299 PolarHBondContact O-N 2.85Å; E295-N299 PolarHBondContact OE2-ND2 3.48Å; E295-N299 VanDerWaalsContact OE2-ND2 3.14Å; N299-Y301 PolarHBondContact O-N 3.36Å; N299-Y301 VanDerWaalsContact O-N 3.17Å; N299-L302 HydrophobicContact CB-CB 4.19Å; N299-L302 HydrophobicContact CB-CD1 3.73Å; N299-L302 HydrophobicContact CB-CG 3.96Å; N299-L302 PolarHBondContact O-N 2.83Å; N299-L302 VanDerWaalsContact O-N 3.17Å; N299-V303 PolarHBondContact O-N 3.02Å | ||
| 300 | P | 93.3 | Very high | 92.2 | Very high | 66 Ų | 66 | 73.9 Ų | 73.9 | 43% | 0.429 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -59.7 | -28.8 | -177.5 | 24.5 | -34.4 | 0 | 0 | 0 | 112.5 | R298 N304 | R298-P300 VanDerWaalsContact C-CD 3.41Å; R298-P300 WeakPolarHBondContact O-CD 3.34Å; P300-N304 WeakPolarHBondContact O-CB 3.38Å; P300-N304 VanDerWaalsContact O-CG 3.29Å; P300-N304 PolarHBondContact O-N 3.22Å; P300-N304 PolarHBondContact O-ND2 3.03Å |
| 301 | Y | 92.9 | Very high | 91.4 | Very high | 149 Ų | 149 | 72.2 Ų | 72.2 | 58% | 0.584 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -59.8 | -54.3 | 173.5 | 174.2 | -106.7 | 0 | 0 | 0 | 112.1 | N299 V303 N304 Q305 D388 | N299-Y301 PolarHBondContact O-N 3.36Å; N299-Y301 VanDerWaalsContact O-N 3.17Å; Y301-V303 VanDerWaalsContact C-N 3.31Å; Y301-V303 PolarHBondContact O-N 2.96Å; Y301-N304 PolarHBondContact O-N 3.47Å; Y301-Q305 WeakPolarHBondContact O-CB 3.39Å; Y301-Q305 PolarHBondContact O-N 2.99Å; Y301-Q305 PolarHBondContact OH-OE1 3.17Å; Y301-D388 WeakPolarHBondContact CE1-OD1 3.46Å |
| 302 | L | 92.1 | Very high | 90.4 | Very high | 4 Ų | 4 | 79.1 Ų | 79.1 | 2% | 0.021 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -59.5 | -40.9 | 179.9 | -57.5 | -178 | 0 | 0 | 0 | 112.2 | Y263 N299 Q305 A306 I387 D388 | Y263-L302 HydrophobicContact CD1-CB 4.16Å; Y263-L302 HydrophobicContact CE1-CB 3.45Å; Y263-L302 VanDerWaalsContact CE1-CB 3.45Å; Y263-L302 HydrophobicContact CE1-CD1 4.49Å; Y263-L302 HydrophobicContact CE2-CD1 4.48Å; N299-L302 HydrophobicContact CB-CB 4.19Å; N299-L302 HydrophobicContact CB-CD1 3.73Å; N299-L302 HydrophobicContact CB-CG 3.96Å; N299-L302 PolarHBondContact O-N 2.83Å; N299-L302 VanDerWaalsContact O-N 3.17Å; L302-Q305 PolarHBondContact O-N 2.84Å; L302-A306 WeakPolarHBondContact O-CB 3.42Å; L302-A306 PolarHBondContact O-N 3.19Å; L302-I387 HydrophobicContact CB-CG2 4.43Å; L302-I387 HydrophobicContact CD1-CB 4.32Å; L302-I387 HydrophobicContact CD1-CD1 3.88Å; L302-I387 HydrophobicContact CD1-CG2 4.2Å; L302-I387 HydrophobicContact CD2-CB 4.5Å; L302-I387 HydrophobicContact CD2-CG2 4.1Å; L302-I387 HydrophobicContact CG-CG2 4.49Å; L302-D388 VanDerWaalsContact CD2-CG 3.5Å; L302-D388 WeakPolarHBondContact CD2-OD1 3.4Å |
| 303 | V | 94 | Very high | 88.9 | Confident | 5 Ų | 5 | 80.8 Ų | 80.8 | 3% | 0.03 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -64 | -46.8 | 177.5 | 174.2 | 0 | 0 | 0 | 0 | 110.5 | Y263 L266 F292 E295 N299 Y301 A306 L307 | Y263-V303 HydrophobicContact CE1-CG2 3.95Å; L266-V303 HydrophobicContact CD2-CG1 4.29Å; F292-V303 HydrophobicContact CE2-CG1 3.69Å; F292-V303 HydrophobicContact CZ-CG1 4.02Å; E295-V303 HydrophobicContact CB-CG2 3.83Å; N299-V303 PolarHBondContact O-N 3.02Å; Y301-V303 VanDerWaalsContact C-N 3.31Å; Y301-V303 PolarHBondContact O-N 2.96Å; V303-A306 PolarHBondContact O-N 3.42Å; V303-L307 HydrophobicContact CG1-CD1 4.03Å; V303-L307 WeakPolarHBondContact O-CB 3.27Å; V303-L307 VanDerWaalsContact O-CG 3.3Å; V303-L307 WeakPolarHBondContact O-CG 3.38Å; V303-L307 PolarHBondContact O-N 3.11Å |
| 304 | N | 93.7 | Very high | 87.4 | Confident | 83 Ų | 83 | 80.2 Ų | 80.2 | 44% | 0.444 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -65.4 | -38.8 | 177.4 | -76.7 | -46.9 | 0 | 0 | 0 | 112.6 | P300 Y301 L307 R308 | P300-N304 WeakPolarHBondContact O-CB 3.38Å; P300-N304 VanDerWaalsContact O-CG 3.29Å; P300-N304 PolarHBondContact O-N 3.22Å; P300-N304 PolarHBondContact O-ND2 3.03Å; Y301-N304 PolarHBondContact O-N 3.47Å; N304-L307 PolarHBondContact O-N 2.73Å; N304-R308 WeakPolarHBondContact O-CB 3.33Å; N304-R308 WeakPolarHBondContact O-CG 3.47Å; N304-R308 PolarHBondContact O-N 3.11Å |
| 305 | Q | 91.8 | Very high | 86.1 | Confident | 23 Ų | 23 | 79.9 Ų | 79.9 | 11% | 0.107 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -68 | -42.6 | 177.5 | -175.6 | 176 | -9.1 | 0 | 0 | 111.8 | Y301 L302 L307 R308 N309 D388 L391 | Y301-Q305 WeakPolarHBondContact O-CB 3.39Å; Y301-Q305 PolarHBondContact O-N 2.99Å; Y301-Q305 PolarHBondContact OH-OE1 3.17Å; L302-Q305 PolarHBondContact O-N 2.84Å; Q305-L307 VanDerWaalsContact C-N 3.33Å; Q305-L307 PolarHBondContact O-N 3.16Å; Q305-R308 PolarHBondContact O-N 2.97Å; Q305-N309 VanDerWaalsContact O-CB 3.3Å; Q305-N309 WeakPolarHBondContact O-CB 3.41Å; Q305-N309 VanDerWaalsContact O-CG 3.32Å; Q305-N309 PolarHBondContact O-N 3.06Å; Q305-D388 PolarHBondContact OE1-OD1 3.15Å; Q305-D388 VanDerWaalsContact OE1-OD1 3.1Å; Q305-L391 HydrophobicContact CB-CD1 4.07Å; Q305-L391 HydrophobicContact CG-CB 4.27Å; Q305-L391 HydrophobicContact CG-CD1 3.89Å |
| 306 | A | 91.8 | Very high | 84.6 | Confident | 0 Ų | 0 | 85.7 Ų | 85.7 | 0% | 0 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -61.2 | -41.3 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y263 L266 S267 L302 V303 N309 L391 | Y263-A306 HydrophobicContact CD1-CB 4.21Å; L266-A306 HydrophobicContact CB-CB 4.37Å; L266-A306 HydrophobicContact CD2-CB 3.99Å; L266-A306 HydrophobicContact CG-CB 4.21Å; S267-A306 VanDerWaalsContact CA-O 3.3Å; S267-A306 WeakPolarHBondContact CA-O 3.32Å; L302-A306 WeakPolarHBondContact O-CB 3.42Å; L302-A306 PolarHBondContact O-N 3.19Å; V303-A306 PolarHBondContact O-N 3.42Å; A306-N309 CarbonylContact O-C 3.6Å; A306-L391 HydrophobicContact CB-CD1 4.21Å; A306-L391 HydrophobicContact CB-CD2 4.36Å |
| 307 | L | 92 | Very high | 83.1 | Confident | 64 Ų | 64 | 87.3 Ų | 87.3 | 34% | 0.335 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -73.3 | -32.4 | 178.7 | -70.1 | 173.5 | 0 | 0 | 0 | 113.8 | L266 T271 F292 V303 N304 Q305 | L266-L307 HydrophobicContact CD1-CD2 3.83Å; L266-L307 HydrophobicContact CD1-CG 4.48Å; L266-L307 HydrophobicContact CG-CD2 4.01Å; L266-L307 HydrophobicContact CG-CG 4.32Å; T271-L307 HydrophobicContact CG2-CD2 4.02Å; F292-L307 HydrophobicContact CE2-CD1 4.39Å; F292-L307 HydrophobicContact CZ-CD1 4.5Å; V303-L307 HydrophobicContact CG1-CD1 4.03Å; V303-L307 WeakPolarHBondContact O-CB 3.27Å; V303-L307 VanDerWaalsContact O-CG 3.3Å; V303-L307 WeakPolarHBondContact O-CG 3.38Å; V303-L307 PolarHBondContact O-N 3.11Å; N304-L307 PolarHBondContact O-N 2.73Å; Q305-L307 VanDerWaalsContact C-N 3.33Å; Q305-L307 PolarHBondContact O-N 3.16Å |
| 308 | R | 90.4 | Very high | 81.6 | Confident | 202 Ų | 202 | 79.5 Ų | 79.5 | 76% | 0.762 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -69.5 | -44.3 | 173.1 | -76.2 | 169.1 | 179.1 | -174.2 | -1.4 | 111.5 | N304 Q305 R310 | N304-R308 WeakPolarHBondContact O-CB 3.33Å; N304-R308 WeakPolarHBondContact O-CG 3.47Å; N304-R308 PolarHBondContact O-N 3.11Å; Q305-R308 PolarHBondContact O-N 2.97Å; R308-R310 PolarHBondContact O-N 3.2Å |
| 309 | N | 81.4 | Confident | 80.3 | Confident | 42 Ų | 42 | 78.7 Ų | 78.7 | 23% | 0.225 | 38% | 0.377 | C | S | . | . | S | Bend | trans | -84.1 | 67.8 | 180 | -61.6 | -8.6 | 0 | 0 | 0 | 109.6 | S267 Q305 A306 R311 T395 | S267-N309 PolarHBondContact OG-O 3.35Å; Q305-N309 VanDerWaalsContact O-CB 3.3Å; Q305-N309 WeakPolarHBondContact O-CB 3.41Å; Q305-N309 VanDerWaalsContact O-CG 3.32Å; Q305-N309 PolarHBondContact O-N 3.06Å; A306-N309 CarbonylContact O-C 3.6Å; N309-R311 PolarHBondContact O-N 2.88Å; N309-T395 WeakPolarHBondContact ND2-CG2 3.39Å |
| 310 | R | 80.6 | Confident | 78.9 | Confident | 202 Ų | 202 | 78.6 Ų | 78.6 | 76% | 0.762 | 38% | 0.378 | S | S | * | . | trans | -69.8 | 122.4 | 173.7 | -171.7 | 176.6 | -176.3 | -120.3 | -0.6 | 109.5 | S267 R308 | S267-R310 CarbonylContact O-C 3.33Å; S267-R310 WeakPolarHBondContact O-CA 3.36Å; R308-R310 PolarHBondContact O-N 3.2Å | ||
| 311 | R | 76.3 | Confident | 76.9 | Confident | 30 Ų | 30 | 80.3 Ų | 80.3 | 11% | 0.113 | 39% | 0.391 | C | S | . | . | trans | -117.8 | 140.5 | -173.7 | -69.2 | 177.3 | -174.6 | 139.7 | -31.3 | 112.7 | S267 N309 Y313 V390 L391 | S267-R311 PolarHBondContact O-N 3.47Å; S267-R311 WeakPolarHBondContact OG-CD 3.43Å; S267-R311 PolarHBondContact OG-NH1 3.22Å; N309-R311 PolarHBondContact O-N 2.88Å; R311-Y313 VanDerWaalsContact C-N 3.29Å; R311-Y313 HydrophobicContact CB-CD2 3.7Å; R311-Y313 HydrophobicContact CB-CE2 3.76Å; R311-Y313 HydrophobicContact CB-CG 4.38Å; R311-Y313 VanDerWaalsContact CD-OH 3.29Å; R311-Y313 WeakPolarHBondContact CD-OH 3.45Å; R311-Y313 HydrophobicContact CG-CE2 4.18Å; R311-Y313 PolarHBondContact O-N 3.16Å; R311-Y313 VanDerWaalsContact O-N 3.16Å; R311-V390 PolarHBondContact NH2-O 3.15Å; R311-L391 VanDerWaalsContact NH2-CA 3.31Å; R311-L391 PolarHBondContact NH2-O 3.15Å | ||
| 312 | T | 74.3 | Confident | 74.9 | Confident | 149 Ų | 149 | 78.5 Ų | 78.5 | 91% | 0.914 | 40% | 0.4 | S | S | * | . | trans | -84.7 | 68.7 | 169.8 | 52.3 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 313 | Y | 65.5 | Low | 72.8 | Confident | 62 Ų | 62 | 80.1 Ų | 80.1 | 24% | 0.243 | 41% | 0.409 | C | S | . | . | trans | -84.1 | 140.1 | 168.1 | -67.5 | -66.9 | 0 | 0 | 0 | 110.4 | T268 R311 L315 L318 | T268-Y313 HydrophobicContact CG2-CD2 4.31Å; T268-Y313 VanDerWaalsContact OG1-CD2 3.31Å; T268-Y313 WeakPolarHBondContact OG1-CD2 3.29Å; R311-Y313 VanDerWaalsContact C-N 3.29Å; R311-Y313 HydrophobicContact CB-CD2 3.7Å; R311-Y313 HydrophobicContact CB-CE2 3.76Å; R311-Y313 HydrophobicContact CB-CG 4.38Å; R311-Y313 VanDerWaalsContact CD-OH 3.29Å; R311-Y313 WeakPolarHBondContact CD-OH 3.45Å; R311-Y313 HydrophobicContact CG-CE2 4.18Å; R311-Y313 PolarHBondContact O-N 3.16Å; R311-Y313 VanDerWaalsContact O-N 3.16Å; Y313-L315 PolarHBondContact O-N 3.25Å; Y313-L315 VanDerWaalsContact O-N 3.13Å; Y313-L318 HydrophobicContact CD2-CD1 4.3Å; Y313-L318 HydrophobicContact CG-CD1 4.12Å | ||
| 314 | D | 64.2 | Low | 70.9 | Confident | 111 Ų | 111 | 85.2 Ų | 85.2 | 59% | 0.594 | 43% | 0.433 | S | S | * | . | trans | -58.3 | 116.8 | 158.8 | -76.1 | -37.7 | 0 | 0 | 0 | 109.1 | I316 N317 | D314-I316 HydrophobicContact CB-CB 4.49Å; D314-I316 PolarHBondContact O-N 3.38Å; D314-N317 PolarHBondContact O-N 2.93Å | ||
| 315 | L | 68.1 | Low | 68.8 | Low | 73 Ų | 73 | 89.6 Ų | 89.6 | 38% | 0.382 | 45% | 0.451 | S | S | . | . | G | 310 helix | trans | -52.6 | -33.3 | 179.3 | -62.2 | 172.7 | 0 | 0 | 0 | 110.9 | T268 I269 M279 Y313 N317 L318 F319 | T268-L315 HydrophobicContact CG2-CD2 3.82Å; I269-L315 HydrophobicContact CD1-CD2 4.31Å; I269-L315 HydrophobicContact CG1-CD2 4.01Å; M279-L315 HydrophobicContact CE-CB 4.13Å; M279-L315 WeakPolarHBondContact CE-O 3.42Å; Y313-L315 PolarHBondContact O-N 3.25Å; Y313-L315 VanDerWaalsContact O-N 3.13Å; L315-N317 PolarHBondContact O-N 3.47Å; L315-N317 VanDerWaalsContact O-N 3.15Å; L315-L318 PolarHBondContact O-N 3.09Å; L315-F319 HydrophobicContact CB-CE2 4.31Å; L315-F319 WeakPolarHBondContact O-CD2 3.33Å; L315-F319 PolarHBondContact O-N 3.34Å |
| 316 | I | 62.2 | Low | 66.9 | Low | 124 Ų | 124 | 95.4 Ų | 95.4 | 64% | 0.636 | 48% | 0.478 | S | S | * | . | G | 310 helix | trans | -44.8 | -44.7 | 174.9 | -58.4 | 169.5 | 0 | 0 | 0 | 111.8 | D314 L318 F319 | D314-I316 HydrophobicContact CB-CB 4.49Å; D314-I316 PolarHBondContact O-N 3.38Å; I316-L318 VanDerWaalsContact C-N 3.3Å; I316-L318 PolarHBondContact O-N 3.33Å; I316-F319 PolarHBondContact O-N 2.9Å |
| 317 | N | 63.5 | Low | 64.7 | Low | 130 Ų | 130 | 100.7 Ų | 100.7 | 70% | 0.695 | 51% | 0.506 | S | S | * | . | G | 310 helix | trans | -78.7 | -8 | -176 | -68.1 | -25.9 | 0 | 0 | 0 | 114.4 | D314 L315 | D314-N317 PolarHBondContact O-N 2.93Å; L315-N317 PolarHBondContact O-N 3.47Å; L315-N317 VanDerWaalsContact O-N 3.15Å |
| 318 | L | 62.5 | Low | 62.4 | Low | 12 Ų | 12 | 101.8 Ų | 101.8 | 6% | 0.063 | 52% | 0.524 | C | S | . | . | G | 310 helix | trans | -95.8 | -15.2 | 174.1 | -78.2 | 90.4 | 0 | 0 | 0 | 113 | R261 R264 A265 T268 M279 Y313 L315 I316 | R261-L318 WeakPolarHBondContact CD-O 3.32Å; R261-L318 PolarHBondContact NE-O 3.47Å; R264-L318 HydrophobicContact CB-CD2 3.88Å; A265-L318 HydrophobicContact CB-CD2 4.13Å; T268-L318 WeakPolarHBondContact OG1-CD2 3.45Å; M279-L318 HydrophobicContact CE-CB 3.47Å; M279-L318 VanDerWaalsContact CE-CB 3.47Å; Y313-L318 HydrophobicContact CD2-CD1 4.3Å; Y313-L318 HydrophobicContact CG-CD1 4.12Å; L315-L318 PolarHBondContact O-N 3.09Å; I316-L318 VanDerWaalsContact C-N 3.3Å; I316-L318 PolarHBondContact O-N 3.33Å |
| 319 | F | 65.3 | Low | 60.1 | Low | 86 Ų | 86 | 100.9 Ų | 100.9 | 38% | 0.377 | 53% | 0.526 | S | S | . | . | S | Bend | trans | -61.9 | 149.4 | 173.5 | -73.9 | -88.1 | 0 | 0 | 0 | 110.9 | K278 M279 L315 I316 S321 | K278-F319 VanDerWaalsContact O-CE1 3.26Å; K278-F319 WeakPolarHBondContact O-CE1 3.29Å; M279-F319 HydrophobicContact CE-CD1 4.49Å; M279-F319 HydrophobicContact CE-CD2 3.71Å; M279-F319 HydrophobicContact CE-CE1 4.45Å; M279-F319 HydrophobicContact CE-CE2 3.68Å; M279-F319 HydrophobicContact CE-CG 4.14Å; M279-F319 HydrophobicContact CE-CZ 4.06Å; M279-F319 HydrophobicContact SD-CE1 4.16Å; M279-F319 HydrophobicContact SD-CE2 4.05Å; M279-F319 HydrophobicContact SD-CZ 3.83Å; L315-F319 HydrophobicContact CB-CE2 4.31Å; L315-F319 WeakPolarHBondContact O-CD2 3.33Å; L315-F319 PolarHBondContact O-N 3.34Å; I316-F319 PolarHBondContact O-N 2.9Å; F319-S321 VanDerWaalsContact C-N 3.29Å; F319-S321 PolarHBondContact O-N 3.4Å |
| 320 | P | 60.6 | Low | 57.8 | Low | 33 Ų | 33 | 103.9 Ų | 103.9 | 21% | 0.214 | 55% | 0.547 | C | S | . | . | trans | -74 | 78 | -179.8 | 30.1 | -35.2 | 0 | 0 | 0 | 112.8 | P281 S322 D323 | P281-P320 HydrophobicContact CG-CG 3.78Å; P320-S322 PolarHBondContact O-N 3.2Å; P320-D323 HydrophobicContact CB-CB 4.16Å | ||
| 321 | S | 51 | Low | 55.6 | Low | 102 Ų | 102 | 101 Ų | 101 | 71% | 0.713 | 55% | 0.547 | S | S | * | . | S | Bend | trans | -62.8 | 103.2 | 158.1 | -59.1 | 0 | 0 | 0 | 0 | 109.1 | F319 | F319-S321 VanDerWaalsContact C-N 3.29Å; F319-S321 PolarHBondContact O-N 3.4Å |
| 322 | S | 50.8 | Low | 53.8 | Low | 111 Ų | 111 | 108.2 Ų | 108.2 | 78% | 0.776 | 58% | 0.579 | S | S | * | * | S | Bend | trans | 71.1 | 27.4 | 170.4 | -55.4 | 0 | 0 | 0 | 0 | 119.5 | P320 E324 | P320-S322 PolarHBondContact O-N 3.2Å; S322-E324 PolarHBondContact O-N 3.25Å |
| 323 | D | 49.6 | Very low | 52.1 | Low | 38 Ų | 38 | 106.1 Ų | 106.1 | 20% | 0.203 | 57% | 0.571 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -82.1 | 6.4 | 171.4 | -78.3 | -9.1 | 0 | 0 | 0 | 114.6 | R257 R261 P320 E325 | R257-D323 IonicContact CZ-OD1 2.82Å; R257-D323 VanDerWaalsContact CZ-OD1 3.31Å; R257-D323 IonicContact NE-OD1 3.35Å; R257-D323 IonicContact NH2-OD1 3.84Å; R257-D323 PolarHBondContact NH2-OD1 3.17Å; R261-D323 IonicContact CZ-OD2 2.72Å; R261-D323 IonicContact NH1-OD2 3.42Å; R261-D323 PolarHBondContact NH1-OD2 3.05Å; R261-D323 IonicContact NH2-OD2 3.59Å; R261-D323 PolarHBondContact NH2-OD2 3.16Å; P320-D323 HydrophobicContact CB-CB 4.16Å; D323-E325 PolarHBondContact O-N 2.98Å |
| 324 | E | 52.6 | Low | 50.8 | Low | 112 Ų | 112 | 108.3 Ų | 108.3 | 52% | 0.523 | 60% | 0.595 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -79.8 | -8.5 | -167.8 | -73.9 | -70.5 | 106.3 | 0 | 0 | 115.2 | R282 S322 | R282-E324 IonicContact CZ-OE1 3.14Å; R282-E324 IonicContact CZ-OE2 2.65Å; R282-E324 IonicContact NE-OE1 3.51Å; R282-E324 PolarHBondContact NE-OE1 2.9Å; R282-E324 IonicContact NE-OE2 3.57Å; R282-E324 VanDerWaalsContact NH2-CD 3.27Å; R282-E324 IonicContact NH2-OE1 2.68Å; R282-E324 PolarHBondContact NH2-OE1 3.08Å; R282-E324 VanDerWaalsContact NH2-OE1 3.14Å; R282-E324 IonicContact NH2-OE2 3.35Å; R282-E324 PolarHBondContact NH2-OE2 2.9Å; S322-E324 PolarHBondContact O-N 3.25Å |
| 325 | E | 50.3 | Low | 49.8 | Very low | 176 Ų | 176 | 111.8 Ų | 111.8 | 82% | 0.822 | 61% | 0.605 | S | S | * | * | S | Bend | trans | -94.8 | -22.8 | -166.6 | -160.1 | 154.2 | -153 | 0 | 0 | 114.9 | D323 N327 | D323-E325 PolarHBondContact O-N 2.98Å; E325-N327 PolarHBondContact O-N 2.85Å |
| 326 | E | 51.5 | Low | 48.4 | Very low | 145 Ų | 145 | 112.4 Ų | 112.4 | 68% | 0.678 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.6 | -0.4 | -168.6 | -142.2 | -170.2 | 146.7 | 0 | 0 | 115.4 | R257 | R257-E326 IonicContact NH1-OE2 2.74Å; R257-E326 PolarHBondContact NH1-OE2 3.12Å |
| 327 | N | 46.8 | Very low | 47.5 | Very low | 111 Ų | 111 | 113.5 Ų | 113.5 | 59% | 0.594 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.4 | 8.6 | -178.7 | -83.7 | -92.5 | 0 | 0 | 0 | 114.7 | E325 K329 | E325-N327 PolarHBondContact O-N 2.85Å; N327-K329 VanDerWaalsContact C-N 3.35Å; N327-K329 PolarHBondContact O-N 2.73Å |
| 328 | A | 43.2 | Very low | 46.8 | Very low | 86 Ų | 86 | 118.7 Ų | 118.7 | 71% | 0.711 | 63% | 0.632 | S | S | * | * | trans | -68.4 | 91.9 | 164.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 329 | K | 40.9 | Very low | 46 | Very low | 184 Ų | 184 | 127.7 Ų | 127.7 | 80% | 0.8 | 67% | 0.671 | S | S | * | * | trans | -56.3 | 129.3 | 177 | -64.1 | 172.4 | -176.7 | 169.7 | 0 | 109.4 | N327 D331 | N327-K329 VanDerWaalsContact C-N 3.35Å; N327-K329 PolarHBondContact O-N 2.73Å; K329-D331 PolarHBondContact O-N 3.39Å | ||
| 330 | P | 34.6 | Very low | 45 | Very low | 105 Ų | 105 | 132 Ų | 132 | 68% | 0.682 | 69% | 0.689 | S | S | * | * | trans | -66.1 | 129.7 | 159.9 | 28.2 | -32.3 | 0 | 0 | 0 | 108.2 | K332 | P330-K332 PolarHBondContact O-N 2.72Š| ||
| 331 | D | 34.1 | Very low | 44.2 | Very low | 140 Ų | 140 | 134.8 Ų | 134.8 | 75% | 0.749 | 72% | 0.715 | S | S | * | * | trans | -60 | 108.5 | 176.8 | -75 | -49.2 | 0 | 0 | 0 | 110.5 | K329 S333 | K329-D331 PolarHBondContact O-N 3.39Å; D331-S333 PolarHBondContact O-N 2.67Å | ||
| 332 | K | 38.5 | Very low | 43.8 | Very low | 183 Ų | 183 | 139.6 Ų | 139.6 | 80% | 0.796 | 72% | 0.723 | S | S | * | * | trans | -81.3 | 45.2 | 176.9 | -67.8 | -174.8 | -179.8 | 177.1 | 0 | 111.6 | P330 S334 | P330-K332 PolarHBondContact O-N 2.72Å; K332-S334 VanDerWaalsContact C-N 3.3Å | ||
| 333 | S | 37.4 | Very low | 43.4 | Very low | 105 Ų | 105 | 139.5 Ų | 139.5 | 73% | 0.734 | 72% | 0.721 | S | S | * | * | trans | -79.5 | -9.2 | 173.6 | 51.7 | 0 | 0 | 0 | 0 | 113.4 | D331 | D331-S333 PolarHBondContact O-N 2.67Š| ||
| 334 | S | 38.9 | Very low | 43.1 | Very low | 107 Ų | 107 | 144.3 Ų | 144.3 | 75% | 0.748 | 75% | 0.747 | S | S | * | * | S | Bend | trans | -114 | 9.9 | -169.8 | 58.6 | 0 | 0 | 0 | 0 | 116.5 | K332 | K332-S334 VanDerWaalsContact C-N 3.3Š|
| 335 | K | 42.4 | Very low | 43.2 | Very low | 185 Ų | 185 | 147.7 Ų | 147.7 | 80% | 0.804 | 76% | 0.763 | S | S | * | * | S | Bend | trans | -130.9 | 4.1 | -172.9 | -119.4 | 166.2 | -174.2 | 166.2 | 0 | 117.6 | ||
| 336 | S | 40.6 | Very low | 42.9 | Very low | 85 Ų | 85 | 147.4 Ų | 147.4 | 59% | 0.594 | 77% | 0.767 | S | S | * | * | S | Bend | trans | -82.3 | -30.7 | 175.6 | 48.4 | 0 | 0 | 0 | 0 | 114.2 | R338 | S336-R338 PolarHBondContact O-N 3.24Å; S336-R338 VanDerWaalsContact O-N 3.13Å |
| 337 | N | 41.8 | Very low | 42.4 | Very low | 148 Ų | 148 | 145 Ų | 145 | 79% | 0.791 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.4 | -9 | -172 | -75.1 | -4.4 | 0 | 0 | 0 | 115.6 | ||
| 338 | R | 48.7 | Very low | 42.5 | Very low | 238 Ų | 238 | 147.1 Ų | 147.1 | 90% | 0.898 | 78% | 0.776 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94 | 4.7 | -177.2 | -149.4 | 171.1 | -177.3 | 167.5 | 0.6 | 115.1 | S336 | S336-R338 PolarHBondContact O-N 3.24Å; S336-R338 VanDerWaalsContact O-N 3.13Å |
| 339 | K | 45.5 | Very low | 42.3 | Very low | 202 Ų | 202 | 151.5 Ų | 151.5 | 88% | 0.878 | 78% | 0.782 | S | S | * | * | S | Bend | trans | -115.9 | -2 | 176.8 | -79.6 | -167 | 174.2 | -171.9 | 0 | 115.4 | ||
| 340 | K | 45.1 | Very low | 42.1 | Very low | 176 Ų | 176 | 149.3 Ų | 149.3 | 77% | 0.765 | 79% | 0.788 | S | S | * | * | S | Bend | trans | -96.2 | -14 | 177.7 | -162.5 | 161.6 | -178.6 | 179.6 | 0 | 114.3 | K342 | K340-K342 PolarHBondContact O-N 2.73Š|
| 341 | A | 44.1 | Very low | 42.4 | Very low | 92 Ų | 92 | 150.5 Ų | 150.5 | 76% | 0.76 | 79% | 0.789 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.3 | 31.9 | -178.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||
| 342 | K | 42.8 | Very low | 42.3 | Very low | 203 Ų | 203 | 151.1 Ų | 151.1 | 88% | 0.883 | 79% | 0.787 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -142.9 | 32.2 | 178.2 | -157.2 | 177.8 | 174.4 | 171.7 | 0 | 112.7 | K340 | K340-K342 PolarHBondContact O-N 2.73Š|
| 343 | C | 41.7 | Very low | 42.5 | Very low | 108 Ų | 108 | 151.6 Ų | 151.6 | 73% | 0.73 | 79% | 0.792 | S | S | * | * | S | Bend | trans | -128.5 | -1.1 | 178.5 | -154.2 | 0 | 0 | 0 | 0 | 113.5 | ||
| 344 | D | 43 | Very low | 42.5 | Very low | 140 Ų | 140 | 152 Ų | 152 | 75% | 0.749 | 80% | 0.795 | S | S | * | * | S | Bend | trans | -109.7 | 41.7 | -167.2 | -51.9 | -49.2 | 0 | 0 | 0 | 112 | ||
| 345 | Q | 55.8 | Low | 42.3 | Very low | 182 Ų | 182 | 152.3 Ų | 152.3 | 85% | 0.85 | 80% | 0.796 | S | S | * | * | S | Bend | trans | -134.1 | -7.7 | -178.5 | -131.6 | 174.3 | 4.9 | 0 | 0 | 116 | ||
| 346 | D | 43 | Very low | 42.1 | Very low | 170 Ų | 170 | 150.9 Ų | 150.9 | 91% | 0.909 | 80% | 0.797 | S | S | * | * | trans | -107 | 81.2 | 172.6 | -62.1 | -35.1 | 0 | 0 | 0 | 109.2 | ||||
| 347 | S | 42.4 | Very low | 42.4 | Very low | 95 Ų | 95 | 156.1 Ų | 156.1 | 66% | 0.664 | 81% | 0.812 | S | S | * | * | trans | -116.7 | 166.1 | 170.8 | 56.7 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 348 | I | 47.7 | Very low | 42.4 | Very low | 156 Ų | 156 | 156.9 Ų | 156.9 | 80% | 0.8 | 82% | 0.816 | S | S | * | * | trans | 103 | 137.6 | 174 | -54.8 | 155.9 | 0 | 0 | 0 | 114.4 | ||||
| 349 | E | 39 | Very low | 42.3 | Very low | 177 Ų | 177 | 150.9 Ų | 150.9 | 83% | 0.827 | 81% | 0.808 | S | S | * | * | trans | 67.3 | 90.5 | 172.8 | -85.9 | 176.5 | 174.2 | 0 | 0 | 119.8 | ||||
| 350 | C | 37.6 | Very low | 41.9 | Very low | 138 Ų | 138 | 149.1 Ų | 149.1 | 93% | 0.932 | 81% | 0.808 | S | S | * | * | -163.3 | 121 | 104.6 | -92.5 | 0 | 0 | 0 | 0 | 109.5 | |||||
| 351 | N | 39.2 | Very low | 42 | Very low | 131 Ų | 131 | 144.7 Ų | 144.7 | 70% | 0.701 | 81% | 0.805 | S | S | * | * | trans | -95.4 | 154 | -177.8 | -166.8 | 35.4 | 0 | 0 | 0 | 112.3 | ||||
| 352 | E | 33.3 | Very low | 41.9 | Very low | 153 Ų | 153 | 146.4 Ų | 146.4 | 72% | 0.715 | 81% | 0.805 | S | S | * | * | trans | 5.3 | 123.3 | 159.5 | -68 | 158 | 160.9 | 0 | 0 | 118.8 | ||||
| 353 | Q | 42.8 | Very low | 41.9 | Very low | 193 Ų | 193 | 142.6 Ų | 142.6 | 90% | 0.902 | 80% | 0.804 | S | S | * | * | -170.5 | 134.1 | 113.2 | -102.5 | 160.8 | 32.5 | 0 | 0 | 114.9 | |||||
| 354 | S | 36.1 | Very low | 42.3 | Very low | 113 Ų | 113 | 146.2 Ų | 146.2 | 79% | 0.79 | 81% | 0.808 | S | S | * | * | trans | 75.7 | 118.6 | 138.7 | -149.5 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 355 | C | 34.8 | Very low | 42.2 | Very low | 113 Ų | 113 | 145.4 Ų | 145.4 | 76% | 0.764 | 81% | 0.81 | S | S | * | * | trans | 87.3 | 112.3 | 137.9 | -132.4 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 356 | N | 39.3 | Very low | 41.7 | Very low | 155 Ų | 155 | 146.3 Ų | 146.3 | 83% | 0.829 | 81% | 0.811 | S | S | * | * | trans | -49.8 | 138 | 160.6 | -49.7 | -65.5 | 0 | 0 | 0 | 113.2 | ||||
| 357 | Q | 47.1 | Very low | 41.9 | Very low | 196 Ų | 196 | 143.2 Ų | 143.2 | 92% | 0.916 | 80% | 0.803 | S | S | * | * | trans | -133.8 | 141.3 | 142.8 | -68.7 | -164.5 | 11.2 | 0 | 0 | 109.8 | ||||
| 358 | N | 42.1 | Very low | 42 | Very low | 164 Ų | 164 | 149.6 Ų | 149.6 | 88% | 0.877 | 81% | 0.813 | S | S | * | * | trans | -83.3 | 173.2 | -170 | -116.4 | -11.7 | 0 | 0 | 0 | 112 | ||||
| 359 | P | 46.2 | Very low | 41.7 | Very low | 111 Ų | 111 | 153.3 Ų | 153.3 | 72% | 0.721 | 82% | 0.816 | S | S | * | * | trans | -91.1 | 138.3 | -157.8 | 34.9 | -36.1 | 0 | 0 | 0 | 114.2 | ||||
| 360 | D | 36.9 | Very low | 41.7 | Very low | 165 Ų | 165 | 154 Ų | 154 | 88% | 0.882 | 82% | 0.817 | S | S | * | * | trans | -169.9 | 111.6 | 130.5 | -134 | -22.7 | 0 | 0 | 0 | 110.5 | ||||
| 361 | A | 46.1 | Very low | 41.9 | Very low | 84 Ų | 84 | 152.6 Ų | 152.6 | 69% | 0.694 | 81% | 0.809 | S | S | * | * | trans | -174.9 | 101 | 167.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | S363 | A361-S363 PolarHBondContact O-N 3.05Š| ||
| 362 | T | 42.9 | Very low | 42 | Very low | 127 Ų | 127 | 151.6 Ų | 151.6 | 78% | 0.779 | 81% | 0.807 | S | S | * | * | trans | 36.7 | 86.1 | 143.5 | 62.7 | 0 | 0 | 0 | 0 | 117.7 | K364 | T362-K364 PolarHBondContact O-N 2.99Š| ||
| 363 | S | 43.8 | Very low | 42.6 | Very low | 123 Ų | 123 | 150.3 Ų | 150.3 | 86% | 0.86 | 80% | 0.804 | S | S | * | * | trans | -69.7 | 104.2 | 169.5 | 64.6 | 0 | 0 | 0 | 0 | 111.2 | A361 | A361-S363 PolarHBondContact O-N 3.05Š| ||
| 364 | K | 49.5 | Very low | 43 | Very low | 184 Ų | 184 | 152.4 Ų | 152.4 | 80% | 0.8 | 80% | 0.804 | S | S | * | * | trans | -58.5 | 135.2 | 172.7 | -69 | 177.3 | -179.8 | 173.5 | 0 | 109.5 | T362 K366 | T362-K364 PolarHBondContact O-N 2.99Å; K364-K366 PolarHBondContact O-N 2.83Å | ||
| 365 | P | 39.8 | Very low | 44.1 | Very low | 124 Ų | 124 | 151.8 Ų | 151.8 | 81% | 0.805 | 78% | 0.784 | S | S | * | * | trans | -63.4 | 115.2 | -179.7 | 25.2 | -33.2 | 0 | 0 | 0 | 109.6 | S367 | P365-S367 VanDerWaalsContact C-N 3.33Å; P365-S367 PolarHBondContact O-N 2.97Å | ||
| 366 | K | 46.9 | Very low | 45.7 | Very low | 200 Ų | 200 | 152 Ų | 152 | 87% | 0.87 | 78% | 0.778 | S | S | * | * | trans | -62.1 | 96.6 | 172.6 | -76 | -178.6 | 178.6 | 174.5 | 0 | 108.5 | K364 R368 | K364-K366 PolarHBondContact O-N 2.83Å; K366-R368 VanDerWaalsContact C-N 3.32Å; K366-R368 PolarHBondContact O-N 3.3Å | ||
| 367 | S | 46.5 | Very low | 47.3 | Very low | 105 Ų | 105 | 148.8 Ų | 148.8 | 73% | 0.734 | 77% | 0.765 | S | S | * | * | trans | -58.1 | 94.8 | 175.4 | -179.1 | 0 | 0 | 0 | 0 | 109.4 | P365 R369 | P365-S367 VanDerWaalsContact C-N 3.33Å; P365-S367 PolarHBondContact O-N 2.97Å; S367-R369 PolarHBondContact O-N 2.93Å | ||
| 368 | R | 44.5 | Very low | 48.8 | Very low | 230 Ų | 230 | 145 Ų | 145 | 87% | 0.868 | 75% | 0.752 | S | S | * | * | trans | -65.7 | 86.5 | 168 | -80.4 | 177.4 | 57 | 97.9 | 3.5 | 107 | K366 K370 | K366-R368 VanDerWaalsContact C-N 3.32Å; K366-R368 PolarHBondContact O-N 3.3Å; R368-K370 VanDerWaalsContact C-N 3.32Å; R368-K370 PolarHBondContact O-N 3.12Å | ||
| 369 | R | 42.4 | Very low | 50.5 | Low | 233 Ų | 233 | 140.8 Ų | 140.8 | 88% | 0.879 | 73% | 0.726 | S | S | * | * | trans | -50.8 | 104.3 | 163 | -62.9 | -177.3 | 87.2 | 150 | 4.7 | 105.6 | S367 S371 | S367-R369 PolarHBondContact O-N 2.93Å; R369-S371 PolarHBondContact O-N 2.98Å | ||
| 370 | K | 38.4 | Very low | 52 | Low | 191 Ų | 191 | 137 Ų | 137 | 83% | 0.83 | 70% | 0.698 | S | S | * | * | trans | -54.7 | 116.2 | 173 | -81.5 | 172.6 | 178.2 | 166.2 | 0 | 104.9 | R368 V372 | R368-K370 VanDerWaalsContact C-N 3.32Å; R368-K370 PolarHBondContact O-N 3.12Å; K370-V372 HydrophobicContact CB-CG2 4.45Å; K370-V372 PolarHBondContact O-N 3.05Å | ||
| 371 | S | 40.4 | Very low | 54.1 | Low | 110 Ų | 110 | 133 Ų | 133 | 77% | 0.769 | 68% | 0.677 | S | S | * | * | trans | -64.9 | 77.5 | 157.4 | 45.8 | 0 | 0 | 0 | 0 | 106.5 | R369 L373 | R369-S371 PolarHBondContact O-N 2.98Å; S371-L373 VanDerWaalsContact C-N 3.26Å; S371-L373 PolarHBondContact O-N 3.35Å | ||
| 372 | V | 41.8 | Very low | 55.9 | Low | 109 Ų | 109 | 133.9 Ų | 133.9 | 66% | 0.661 | 67% | 0.666 | S | S | * | * | trans | -51 | 109 | 151 | 178.6 | 0 | 0 | 0 | 0 | 102.8 | K370 R374 | K370-V372 HydrophobicContact CB-CG2 4.45Å; K370-V372 PolarHBondContact O-N 3.05Å; V372-R374 PolarHBondContact O-N 3.45Å | ||
| 373 | L | 47.3 | Very low | 57.8 | Low | 126 Ų | 126 | 128.2 Ų | 128.2 | 66% | 0.66 | 63% | 0.631 | S | S | * | * | trans | -53.7 | 99.7 | 167.9 | -72.9 | 170.3 | 0 | 0 | 0 | 104.9 | S371 R375 | S371-L373 VanDerWaalsContact C-N 3.26Å; S371-L373 PolarHBondContact O-N 3.35Å; L373-R375 PolarHBondContact O-N 3.09Å | ||
| 374 | R | 49.5 | Very low | 59.6 | Low | 238 Ų | 238 | 123.3 Ų | 123.3 | 90% | 0.898 | 60% | 0.597 | S | S | * | * | trans | -62 | 100.8 | 167.8 | -74.1 | -168.4 | 176.6 | -166.3 | -0.8 | 103.2 | V372 | V372-R374 PolarHBondContact O-N 3.45Š| ||
| 375 | R | 59.1 | Low | 61.4 | Low | 100 Ų | 100 | 120.4 Ų | 120.4 | 38% | 0.377 | 59% | 0.586 | S | S | . | * | trans | -75.6 | 144.3 | 168.1 | -64.8 | 177.9 | -168.4 | 171.7 | 0.9 | 105.8 | L373 E380 | L373-R375 PolarHBondContact O-N 3.09Å; R375-E380 HydrophobicContact CB-CG 4.47Å; R375-E380 WeakPolarHBondContact CD-OE1 3.41Å; R375-E380 IonicContact CZ-OE1 2.73Å; R375-E380 IonicContact NE-OE1 2.67Å; R375-E380 IonicContact NH1-OE1 3.28Å; R375-E380 PolarHBondContact NH1-OE1 3.35Å | ||
| 376 | D | 68.8 | Low | 63.5 | Low | 116 Ų | 116 | 116.5 Ų | 116.5 | 62% | 0.62 | 56% | 0.56 | S | S | * | * | trans | -59.4 | 123.3 | 178.2 | -51.1 | -64.5 | 0 | 0 | 0 | 107.5 | D378 F379 E380 | D376-D378 PolarHBondContact O-N 3.4Å; D376-F379 HydrophobicContact CB-CB 4.41Å; D376-F379 WeakPolarHBondContact O-CB 3.3Å; D376-F379 PolarHBondContact O-N 2.99Å; D376-E380 PolarHBondContact O-N 3.25Å | ||
| 377 | P | 74.2 | Confident | 65.2 | Low | 88 Ų | 88 | 107 Ų | 107 | 57% | 0.571 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -60.4 | -35.8 | -175.1 | 23.2 | -31.9 | 0 | 0 | 0 | 110.7 | F379 E380 L381 | P377-F379 PolarHBondContact O-N 3.37Å; P377-E380 PolarHBondContact O-N 3.13Å; P377-E380 VanDerWaalsContact O-N 3.1Å; P377-L381 WeakPolarHBondContact O-CG 3.46Å; P377-L381 PolarHBondContact O-N 3.36Å |
| 378 | D | 78.5 | Confident | 67 | Low | 118 Ų | 118 | 104 Ų | 104 | 63% | 0.631 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -56.6 | -35 | 176 | -45.6 | -16.9 | 0 | 0 | 0 | 112.2 | D376 H382 | D376-D378 PolarHBondContact O-N 3.4Å; D378-H382 VanDerWaalsContact O-CB 3.29Å; D378-H382 WeakPolarHBondContact O-CB 3.26Å; D378-H382 PolarHBondContact O-N 2.97Å |
| 379 | F | 77 | Confident | 68.8 | Low | 75 Ų | 75 | 95.7 Ų | 95.7 | 33% | 0.329 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -70.5 | -42.9 | 175.5 | 173.5 | -93.4 | 0 | 0 | 0 | 112.2 | E256 D376 P377 L381 L383 | E256-F379 HydrophobicContact CB-CE2 3.9Å; E256-F379 HydrophobicContact CB-CZ 3.94Å; D376-F379 HydrophobicContact CB-CB 4.41Å; D376-F379 WeakPolarHBondContact O-CB 3.3Å; D376-F379 PolarHBondContact O-N 2.99Å; P377-F379 PolarHBondContact O-N 3.37Å; F379-L381 VanDerWaalsContact C-N 3.33Å; F379-L383 HydrophobicContact CE1-CD2 4.01Å; F379-L383 HydrophobicContact CZ-CD2 4.31Å; F379-L383 WeakPolarHBondContact O-CB 3.46Å; F379-L383 PolarHBondContact O-N 3.05Å |
| 380 | E | 78.4 | Confident | 70.6 | Confident | 30 Ų | 30 | 85.3 Ų | 85.3 | 14% | 0.14 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -72.2 | -30.9 | 177.9 | -59.2 | -98.4 | 159.5 | 0 | 0 | 110.9 | R298 R375 D376 P377 S384 | R298-E380 IonicContact CZ-OE2 2.7Å; R298-E380 IonicContact NH1-OE1 3.31Å; R298-E380 PolarHBondContact NH1-OE1 3.19Å; R298-E380 IonicContact NH1-OE2 2.68Å; R298-E380 PolarHBondContact NH1-OE2 3.36Å; R375-E380 HydrophobicContact CB-CG 4.47Å; R375-E380 WeakPolarHBondContact CD-OE1 3.41Å; R375-E380 IonicContact CZ-OE1 2.73Å; R375-E380 IonicContact NE-OE1 2.67Å; R375-E380 IonicContact NH1-OE1 3.28Å; R375-E380 PolarHBondContact NH1-OE1 3.35Å; D376-E380 PolarHBondContact O-N 3.25Å; P377-E380 PolarHBondContact O-N 3.13Å; P377-E380 VanDerWaalsContact O-N 3.1Å; E380-S384 WeakPolarHBondContact O-CB 3.44Å; E380-S384 PolarHBondContact O-N 3.34Å; E380-S384 PolarHBondContact O-OG 3.13Å |
| 381 | L | 80.7 | Confident | 72.5 | Confident | 83 Ų | 83 | 76.2 Ų | 76.2 | 44% | 0.435 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -64.7 | -56.7 | 171 | -75.3 | 173.2 | 0 | 0 | 0 | 111.5 | P377 F379 L383 S384 E385 | P377-L381 WeakPolarHBondContact O-CG 3.46Å; P377-L381 PolarHBondContact O-N 3.36Å; F379-L381 VanDerWaalsContact C-N 3.33Å; L381-L383 VanDerWaalsContact C-N 3.25Å; L381-L383 PolarHBondContact O-N 2.76Å; L381-S384 WeakPolarHBondContact CA-OG 3.35Å; L381-S384 CarbonylContact O-C 3.37Å; L381-S384 WeakPolarHBondContact O-CA 3.44Å; L381-S384 PolarHBondContact O-N 3.47Å; L381-S384 PolarHBondContact O-OG 3.13Å; L381-E385 WeakPolarHBondContact O-CG 3.38Å; L381-E385 PolarHBondContact O-N 3.22Å |
| 382 | H | 83.1 | Confident | 74.3 | Confident | 102 Ų | 102 | 73.1 Ų | 73.1 | 47% | 0.472 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -57.3 | -39.6 | 178.5 | -176.6 | 64.2 | 0 | 0 | 0 | 112.4 | E256 D378 E385 T386 | E256-H382 IonicContact OE1-CD2 3.99Å; E256-H382 PolarHBondContact OE1-CD2 2.65Å; D378-H382 VanDerWaalsContact O-CB 3.29Å; D378-H382 WeakPolarHBondContact O-CB 3.26Å; D378-H382 PolarHBondContact O-N 2.97Å; H382-E385 PolarHBondContact O-N 3.31Å; H382-T386 VanDerWaalsContact O-CB 3.24Å; H382-T386 WeakPolarHBondContact O-CB 3.42Å; H382-T386 PolarHBondContact O-N 3.28Å; H382-T386 PolarHBondContact O-OG1 3.38Å |
| 383 | L | 83.3 | Confident | 75.5 | Confident | 7 Ų | 7 | 71.9 Ų | 71.9 | 4% | 0.037 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -63.2 | -44.9 | 173.8 | 177.6 | 59.2 | 0 | 0 | 0 | 111.3 | E256 T259 F379 L381 T386 I387 | E256-L383 HydrophobicContact CB-CD1 4.35Å; E256-L383 HydrophobicContact CG-CD1 3.91Å; E256-L383 WeakPolarHBondContact OE1-CA 3.36Å; T259-L383 HydrophobicContact CG2-CD1 4.13Å; T259-L383 HydrophobicContact CG2-CD2 3.97Å; T259-L383 HydrophobicContact CG2-CG 4.39Å; F379-L383 HydrophobicContact CE1-CD2 4.01Å; F379-L383 HydrophobicContact CZ-CD2 4.31Å; F379-L383 WeakPolarHBondContact O-CB 3.46Å; F379-L383 PolarHBondContact O-N 3.05Å; L381-L383 VanDerWaalsContact C-N 3.25Å; L381-L383 PolarHBondContact O-N 2.76Å; L383-T386 PolarHBondContact O-N 2.74Å; L383-I387 HydrophobicContact CD1-CD1 3.8Å; L383-I387 HydrophobicContact CD1-CG1 4.25Å; L383-I387 HydrophobicContact CG-CD1 3.79Å; L383-I387 WeakPolarHBondContact O-CB 3.31Å; L383-I387 WeakPolarHBondContact O-CD1 3.27Å; L383-I387 WeakPolarHBondContact O-CG1 3.42Å; L383-I387 PolarHBondContact O-N 2.86Å |
| 384 | S | 82.6 | Confident | 75.9 | Confident | 20 Ų | 20 | 70.8 Ų | 70.8 | 14% | 0.14 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -63.8 | -43.3 | 177.1 | 68.5 | 0 | 0 | 0 | 0 | 112.6 | E380 L381 I387 D388 | E380-S384 WeakPolarHBondContact O-CB 3.44Å; E380-S384 PolarHBondContact O-N 3.34Å; E380-S384 PolarHBondContact O-OG 3.13Å; L381-S384 WeakPolarHBondContact CA-OG 3.35Å; L381-S384 CarbonylContact O-C 3.37Å; L381-S384 WeakPolarHBondContact O-CA 3.44Å; L381-S384 PolarHBondContact O-N 3.47Å; L381-S384 PolarHBondContact O-OG 3.13Å; S384-I387 PolarHBondContact O-N 2.95Å; S384-D388 WeakPolarHBondContact O-CB 3.24Å; S384-D388 PolarHBondContact O-N 3.37Å |
| 385 | E | 85.6 | Confident | 76.3 | Confident | 123 Ų | 123 | 62.6 Ų | 62.6 | 58% | 0.575 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -63.9 | -40.6 | 174.6 | -70.1 | 175 | 179.1 | 0 | 0 | 111.8 | L381 H382 D388 C389 | L381-E385 WeakPolarHBondContact O-CG 3.38Å; L381-E385 PolarHBondContact O-N 3.22Å; H382-E385 PolarHBondContact O-N 3.31Å; E385-D388 PolarHBondContact O-N 3.48Å; E385-C389 WeakPolarHBondContact O-CB 3.42Å; E385-C389 PolarHBondContact O-N 3.15Å |
| 386 | T | 85.1 | Confident | 75.9 | Confident | 42 Ų | 42 | 62.1 Ų | 62.1 | 26% | 0.258 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -63.9 | -42.3 | 175.3 | -65.8 | 0 | 0 | 0 | 0 | 111.4 | H382 L383 V390 | H382-T386 VanDerWaalsContact O-CB 3.24Å; H382-T386 WeakPolarHBondContact O-CB 3.42Å; H382-T386 PolarHBondContact O-N 3.28Å; H382-T386 PolarHBondContact O-OG1 3.38Å; L383-T386 PolarHBondContact O-N 2.74Å; T386-V390 WeakPolarHBondContact O-CB 3.34Å; T386-V390 VanDerWaalsContact O-CG2 3.27Å; T386-V390 WeakPolarHBondContact O-CG2 3.13Å; T386-V390 PolarHBondContact O-N 3.34Å |
| 387 | I | 82.2 | Confident | 75 | Confident | 2 Ų | 2 | 61.1 Ų | 61.1 | 1% | 0.01 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -64.9 | -49 | 174.5 | -66.6 | 155.4 | 0 | 0 | 0 | 109.9 | T259 Y263 L302 L383 S384 C389 V390 L391 | T259-I387 HydrophobicContact CG2-CD1 4.27Å; Y263-I387 HydrophobicContact CD1-CG2 4.1Å; Y263-I387 HydrophobicContact CD2-CD1 3.36Å; Y263-I387 HydrophobicContact CD2-CG1 3.83Å; Y263-I387 HydrophobicContact CD2-CG2 4.01Å; Y263-I387 HydrophobicContact CE2-CD1 3.39Å; Y263-I387 HydrophobicContact CE2-CG1 4.35Å; Y263-I387 HydrophobicContact CG-CD1 4.22Å; Y263-I387 HydrophobicContact CG-CG1 4.34Å; Y263-I387 HydrophobicContact CG-CG2 3.72Å; L302-I387 HydrophobicContact CB-CG2 4.43Å; L302-I387 HydrophobicContact CD1-CB 4.32Å; L302-I387 HydrophobicContact CD1-CD1 3.88Å; L302-I387 HydrophobicContact CD1-CG2 4.2Å; L302-I387 HydrophobicContact CD2-CB 4.5Å; L302-I387 HydrophobicContact CD2-CG2 4.1Å; L302-I387 HydrophobicContact CG-CG2 4.49Å; L383-I387 HydrophobicContact CD1-CD1 3.8Å; L383-I387 HydrophobicContact CD1-CG1 4.25Å; L383-I387 HydrophobicContact CG-CD1 3.79Å; L383-I387 WeakPolarHBondContact O-CB 3.31Å; L383-I387 WeakPolarHBondContact O-CD1 3.27Å; L383-I387 WeakPolarHBondContact O-CG1 3.42Å; L383-I387 PolarHBondContact O-N 2.86Å; S384-I387 PolarHBondContact O-N 2.95Å; I387-C389 VanDerWaalsContact C-N 3.34Å; I387-C389 PolarHBondContact O-N 3.05Å; I387-V390 CarbonylContact O-C 3.32Å; I387-V390 WeakPolarHBondContact O-CA 3.24Å; I387-V390 WeakPolarHBondContact O-CB 3.28Å; I387-V390 PolarHBondContact O-N 2.97Å; I387-V390 VanDerWaalsContact O-N 3.13Å; I387-L391 HydrophobicContact CG2-CD1 3.8Å; I387-L391 HydrophobicContact CG2-CG 4.01Å; I387-L391 WeakPolarHBondContact O-CB 3.02Å; I387-L391 VanDerWaalsContact O-CG 3.28Å; I387-L391 WeakPolarHBondContact O-CG 3.45Å; I387-L391 PolarHBondContact O-N 3Å |
| 388 | D | 83.5 | Confident | 73.7 | Confident | 40 Ų | 40 | 64.9 Ų | 64.9 | 21% | 0.214 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -61.4 | -39.9 | 179.7 | -83.9 | -22.8 | 0 | 0 | 0 | 112.4 | Y301 L302 Q305 S384 E385 L391 S392 | Y301-D388 WeakPolarHBondContact CE1-OD1 3.46Å; L302-D388 VanDerWaalsContact CD2-CG 3.5Å; L302-D388 WeakPolarHBondContact CD2-OD1 3.4Å; Q305-D388 PolarHBondContact OE1-OD1 3.15Å; Q305-D388 VanDerWaalsContact OE1-OD1 3.1Å; S384-D388 WeakPolarHBondContact O-CB 3.24Å; S384-D388 PolarHBondContact O-N 3.37Å; E385-D388 PolarHBondContact O-N 3.48Å; D388-L391 CarbonylContact O-C 3.57Å; D388-L391 PolarHBondContact O-N 3.44Å; D388-S392 WeakPolarHBondContact O-CB 3.39Å; D388-S392 PolarHBondContact O-N 2.72Å |
| 389 | C | 83.8 | Confident | 72 | Confident | 56 Ų | 56 | 62.9 Ų | 62.9 | 38% | 0.378 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -61.1 | -48.2 | 172.7 | -169.1 | 0 | 0 | 0 | 0 | 110.7 | E385 I387 L391 S392 Q393 | E385-C389 WeakPolarHBondContact O-CB 3.42Å; E385-C389 PolarHBondContact O-N 3.15Å; I387-C389 VanDerWaalsContact C-N 3.34Å; I387-C389 PolarHBondContact O-N 3.05Å; C389-L391 VanDerWaalsContact C-N 3.28Å; C389-L391 PolarHBondContact O-N 3.37Å; C389-S392 PolarHBondContact O-N 3Å; C389-Q393 WeakPolarHBondContact O-CB 3.36Å; C389-Q393 WeakPolarHBondContact O-CG 3.49Å; C389-Q393 PolarHBondContact O-N 3.14Å; C389-Q393 PolarHBondContact SG-NE2 3.46Å |
| 390 | V | 78.7 | Confident | 70.1 | Confident | 15 Ų | 15 | 62.2 Ų | 62.2 | 9% | 0.091 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -64.3 | -27.9 | 174.2 | 166.5 | 0 | 0 | 0 | 0 | 113 | T260 R264 R311 T386 I387 | T260-V390 HydrophobicContact CG2-CG2 4.3Å; R264-V390 HydrophobicContact CG-CG1 3.76Å; R264-V390 VanDerWaalsContact NE-CG1 3.34Å; R311-V390 PolarHBondContact NH2-O 3.15Å; T386-V390 WeakPolarHBondContact O-CB 3.34Å; T386-V390 VanDerWaalsContact O-CG2 3.27Å; T386-V390 WeakPolarHBondContact O-CG2 3.13Å; T386-V390 PolarHBondContact O-N 3.34Å; I387-V390 CarbonylContact O-C 3.32Å; I387-V390 WeakPolarHBondContact O-CA 3.24Å; I387-V390 WeakPolarHBondContact O-CB 3.28Å; I387-V390 PolarHBondContact O-N 2.97Å; I387-V390 VanDerWaalsContact O-N 3.13Å |
| 391 | L | 79.9 | Confident | 68.1 | Low | 0 Ų | 0 | 69 Ų | 69 | 0% | 0 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -82.1 | -33 | 175.8 | -68.2 | -173.6 | 0 | 0 | 0 | 112.2 | Q305 A306 R311 I387 D388 C389 | Q305-L391 HydrophobicContact CB-CD1 4.07Å; Q305-L391 HydrophobicContact CG-CB 4.27Å; Q305-L391 HydrophobicContact CG-CD1 3.89Å; A306-L391 HydrophobicContact CB-CD1 4.21Å; A306-L391 HydrophobicContact CB-CD2 4.36Å; R311-L391 VanDerWaalsContact NH2-CA 3.31Å; R311-L391 PolarHBondContact NH2-O 3.15Å; I387-L391 HydrophobicContact CG2-CD1 3.8Å; I387-L391 HydrophobicContact CG2-CG 4.01Å; I387-L391 WeakPolarHBondContact O-CB 3.02Å; I387-L391 VanDerWaalsContact O-CG 3.28Å; I387-L391 WeakPolarHBondContact O-CG 3.45Å; I387-L391 PolarHBondContact O-N 3Å; D388-L391 CarbonylContact O-C 3.57Å; D388-L391 PolarHBondContact O-N 3.44Å; C389-L391 VanDerWaalsContact C-N 3.28Å; C389-L391 PolarHBondContact O-N 3.37Å |
| 392 | S | 77.4 | Confident | 66.6 | Low | 46 Ų | 46 | 76 Ų | 76 | 32% | 0.322 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -89.4 | -30 | -174.9 | -175.3 | 0 | 0 | 0 | 0 | 114.4 | D388 C389 F394 T395 N396 | D388-S392 WeakPolarHBondContact O-CB 3.39Å; D388-S392 PolarHBondContact O-N 2.72Å; C389-S392 PolarHBondContact O-N 3Å; S392-F394 PolarHBondContact O-N 3.4Å; S392-T395 PolarHBondContact O-N 2.96Å; S392-T395 PolarHBondContact O-OG1 3.4Å; S392-T395 VanDerWaalsContact O-OG1 3.05Å; S392-N396 PolarHBondContact O-ND2 2.65Å |
| 393 | Q | 67.5 | Low | 64.5 | Low | 83 Ų | 83 | 80 Ų | 80 | 39% | 0.388 | 44% | 0.436 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -52.9 | -17.4 | 177 | -84.6 | 171.6 | 21.3 | 0 | 0 | 114.5 | C389 | C389-Q393 WeakPolarHBondContact O-CB 3.36Å; C389-Q393 WeakPolarHBondContact O-CG 3.49Å; C389-Q393 PolarHBondContact O-N 3.14Å; C389-Q393 PolarHBondContact SG-NE2 3.46Å |
| 394 | F | 55.8 | Low | 62.4 | Low | 102 Ų | 102 | 83.9 Ų | 83.9 | 45% | 0.447 | 46% | 0.463 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -123.4 | 0.8 | -176.5 | -51.8 | -83.9 | 0 | 0 | 0 | 113.8 | S392 | S392-F394 PolarHBondContact O-N 3.4Š|
| 395 | T | 56.8 | Low | 60.4 | Low | 66 Ų | 66 | 90.8 Ų | 90.8 | 41% | 0.405 | 49% | 0.493 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.9 | -20 | 169.1 | 53.4 | 0 | 0 | 0 | 0 | 112.2 | N309 S392 | N309-T395 WeakPolarHBondContact ND2-CG2 3.39Å; S392-T395 PolarHBondContact O-N 2.96Å; S392-T395 PolarHBondContact O-OG1 3.4Å; S392-T395 VanDerWaalsContact O-OG1 3.05Å |
| 396 | N | 50.6 | Low | 58.3 | Low | 90 Ų | 90 | 89.4 Ų | 89.4 | 48% | 0.481 | 50% | 0.497 | S | S | . | . | S | Bend | trans | -99.8 | 6.6 | -175.3 | -52.7 | -31.7 | 0 | 0 | 0 | 112.6 | S392 D398 A399 | S392-N396 PolarHBondContact O-ND2 2.65Å; N396-D398 PolarHBondContact O-N 3.37Å; N396-A399 CarbonylContact O-C 3.54Å; N396-A399 WeakPolarHBondContact O-CA 3.31Å; N396-A399 PolarHBondContact O-N 3.06Å |
| 397 | S | 50.3 | Low | 56.3 | Low | 95 Ų | 95 | 95.1 Ų | 95.1 | 66% | 0.664 | 52% | 0.524 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.7 | -4.5 | -179.8 | -56.9 | 0 | 0 | 0 | 0 | 114.3 | ||
| 398 | D | 46.7 | Very low | 54.1 | Low | 168 Ų | 168 | 103.1 Ų | 103.1 | 90% | 0.898 | 56% | 0.562 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.3 | 6.8 | 166.3 | -153.2 | 25.3 | 0 | 0 | 0 | 111.8 | N396 | N396-D398 PolarHBondContact O-N 3.37Š|
| 399 | A | 43.9 | Very low | 52 | Low | 75 Ų | 75 | 108.6 Ų | 108.6 | 62% | 0.62 | 59% | 0.591 | S | S | * | * | S | Bend | trans | -148.1 | 57.2 | -171.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | N396 | N396-A399 CarbonylContact O-C 3.54Å; N396-A399 WeakPolarHBondContact O-CA 3.31Å; N396-A399 PolarHBondContact O-N 3.06Å |
| 400 | G | 36.7 | Very low | 50 | Low | 62 Ų | 62 | 112.5 Ų | 112.5 | 64% | 0.639 | 61% | 0.613 | S | S | * | * | trans | 75 | 129.4 | 155.7 | 0 | 0 | 0 | 0 | 0 | 117.5 | R402 | G400-R402 PolarHBondContact O-N 3.12Å; G400-R402 VanDerWaalsContact O-N 3.07Å | ||
| 401 | D | 35.5 | Very low | 47.9 | Very low | 172 Ų | 172 | 115.7 Ų | 115.7 | 92% | 0.92 | 65% | 0.649 | S | S | * | * | trans | -42.3 | 109.5 | 178.1 | -79.1 | -58.9 | 0 | 0 | 0 | 114.9 | ||||
| 402 | R | 48.9 | Very low | 46 | Very low | 230 Ų | 230 | 121.1 Ų | 121.1 | 87% | 0.868 | 69% | 0.687 | S | S | * | * | trans | -127.6 | 95.3 | 158.3 | -68.1 | -167.7 | -169.6 | 172.6 | 6.3 | 109.9 | G400 C404 | G400-R402 PolarHBondContact O-N 3.12Å; G400-R402 VanDerWaalsContact O-N 3.07Å; R402-C404 PolarHBondContact O-N 3.42Å | ||
| 403 | K | 39.1 | Very low | 44.1 | Very low | 186 Ų | 186 | 126.5 Ų | 126.5 | 81% | 0.809 | 71% | 0.712 | S | S | * | * | trans | -53.2 | 97.1 | 174.4 | -173.6 | 173.3 | -175.5 | 173.8 | 0 | 111 | Q405 | K403-Q405 PolarHBondContact O-N 3.41Š| ||
| 404 | C | 39.8 | Very low | 43 | Very low | 88 Ų | 88 | 131.4 Ų | 131.4 | 60% | 0.595 | 74% | 0.735 | S | S | * | * | trans | -65 | 104 | 169.8 | -67.2 | 0 | 0 | 0 | 0 | 109.1 | R402 S406 | R402-C404 PolarHBondContact O-N 3.42Å; C404-S406 PolarHBondContact O-N 3.38Å | ||
| 405 | Q | 41.8 | Very low | 42.1 | Very low | 165 Ų | 165 | 134.8 Ų | 134.8 | 77% | 0.771 | 75% | 0.752 | S | S | * | * | trans | -71.6 | 128.4 | 174.5 | -63.9 | -173.2 | 14.6 | 0 | 0 | 109.3 | K403 I407 | K403-Q405 PolarHBondContact O-N 3.41Å; Q405-I407 PolarHBondContact O-N 3.39Å | ||
| 406 | S | 41 | Very low | 41 | Very low | 94 Ų | 94 | 139.8 Ų | 139.8 | 66% | 0.657 | 77% | 0.769 | S | S | * | * | trans | -63.5 | 125 | 176.7 | 172.9 | 0 | 0 | 0 | 0 | 110 | C404 Q408 | C404-S406 PolarHBondContact O-N 3.38Å; S406-Q408 VanDerWaalsContact C-N 3.34Å; S406-Q408 PolarHBondContact O-N 2.68Å | ||
| 407 | I | 42.6 | Very low | 40.3 | Very low | 163 Ų | 163 | 145 Ų | 145 | 84% | 0.836 | 79% | 0.787 | S | S | * | * | trans | -71.1 | 93.7 | 169.1 | -58.4 | 174.1 | 0 | 0 | 0 | 108 | Q405 | Q405-I407 PolarHBondContact O-N 3.39Š| ||
| 408 | Q | 36.1 | Very low | 39.9 | Very low | 169 Ų | 169 | 150 Ų | 150 | 79% | 0.79 | 79% | 0.791 | S | S | * | * | trans | -122.3 | 83.1 | 158.7 | -72.5 | -170.4 | 22.6 | 0 | 0 | 107.2 | S406 | S406-Q408 VanDerWaalsContact C-N 3.34Å; S406-Q408 PolarHBondContact O-N 2.68Å | ||
| 409 | D | 39.6 | Very low | 39.3 | Very low | 156 Ų | 156 | 149.5 Ų | 149.5 | 83% | 0.834 | 79% | 0.789 | S | S | * | * | trans | -125.7 | 130.9 | 169.5 | -89.7 | -50.3 | 0 | 0 | 0 | 111.1 | ||||
| 410 | T | 41.8 | Very low | 39.2 | Very low | 138 Ų | 138 | 151.5 Ų | 151.5 | 85% | 0.847 | 79% | 0.793 | S | S | * | * | trans | -92.6 | 131.9 | -170.1 | 49.5 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 411 | G | 34.7 | Very low | 39.3 | Very low | 81 Ų | 81 | 156.1 Ų | 156.1 | 84% | 0.835 | 80% | 0.803 | S | S | * | * | trans | 49 | 101.2 | 144.7 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 412 | S | 40 | Very low | 39.6 | Very low | 114 Ų | 114 | 155.5 Ų | 155.5 | 80% | 0.797 | 79% | 0.794 | S | S | * | * | trans | -155.6 | 111.7 | 144.9 | -175.2 | 0 | 0 | 0 | 0 | 110.3 | Q414 | S412-Q414 PolarHBondContact O-N 3.08Š| ||
| 413 | D | 36.8 | Very low | 38.8 | Very low | 159 Ų | 159 | 154 Ų | 154 | 85% | 0.85 | 79% | 0.789 | S | S | * | * | trans | -68.7 | 117.2 | 172.9 | -81.4 | -57.7 | 0 | 0 | 0 | 110.7 | ||||
| 414 | Q | 43.5 | Very low | 38.7 | Very low | 187 Ų | 187 | 155.6 Ų | 155.6 | 87% | 0.874 | 79% | 0.791 | S | S | * | * | trans | -155.4 | 123 | 141.7 | -118.1 | 156.5 | 97.3 | 0 | 0 | 115.2 | S412 | S412-Q414 PolarHBondContact O-N 3.08Š| ||
| 415 | Q | 38.5 | Very low | 38.7 | Very low | 173 Ų | 173 | 157.4 Ų | 157.4 | 81% | 0.808 | 79% | 0.791 | S | S | * | * | trans | -28.2 | 120.5 | 176.8 | -51.2 | -179.9 | 19.7 | 0 | 0 | 117.2 | ||||
| 416 | F | 33.8 | Very low | 38.3 | Very low | 170 Ų | 170 | 157.4 Ų | 157.4 | 75% | 0.746 | 79% | 0.789 | S | S | * | * | trans | -139.7 | 96.9 | 141.4 | -106 | -72.1 | 0 | 0 | 0 | 111.8 | R418 | F416-R418 PolarHBondContact O-N 3.2Š| ||
| 417 | K | 34.9 | Very low | 38.1 | Very low | 199 Ų | 199 | 164.3 Ų | 164.3 | 87% | 0.865 | 80% | 0.8 | S | S | * | * | trans | -74.9 | 106.6 | 168.3 | -67.6 | 174.3 | -180 | 171.5 | 0 | 109.2 | ||||
| 418 | R | 41.6 | Very low | 37.9 | Very low | 201 Ų | 201 | 163.7 Ų | 163.7 | 76% | 0.758 | 79% | 0.794 | S | S | * | * | trans | -136.5 | 130.6 | 161.2 | -74.1 | -164.8 | 172.5 | 105.4 | 0.5 | 111.4 | F416 | F416-R418 PolarHBondContact O-N 3.2Š| ||
| 419 | N | 34.4 | Very low | 38 | Very low | 157 Ų | 157 | 160.1 Ų | 160.1 | 84% | 0.84 | 79% | 0.787 | S | S | * | * | trans | -60.9 | 134.8 | 178 | -73 | -41.4 | 0 | 0 | 0 | 111.7 | ||||
| 420 | T | 42.8 | Very low | 38 | Very low | 117 Ų | 117 | 158.1 Ų | 158.1 | 72% | 0.718 | 79% | 0.786 | S | S | * | * | trans | -130 | 74 | 165.4 | 47.4 | 0 | 0 | 0 | 0 | 111.2 | H422 | T420-H422 PolarHBondContact O-N 2.95Š| ||
| 421 | N | 38.2 | Very low | 38.5 | Very low | 159 Ų | 159 | 162.5 Ų | 162.5 | 85% | 0.85 | 79% | 0.787 | S | S | * | * | trans | -71.8 | 63.6 | 154.8 | -78.5 | -52.3 | 0 | 0 | 0 | 109.3 | R423 | N421-R423 PolarHBondContact O-N 3.31Š| ||
| 422 | H | 40.9 | Very low | 39.8 | Very low | 159 Ų | 159 | 163.8 Ų | 163.8 | 74% | 0.736 | 78% | 0.783 | S | S | * | * | trans | -94.5 | 88.9 | 175.6 | -96.2 | -63.7 | 0 | 0 | 0 | 111.7 | T420 Y424 | T420-H422 PolarHBondContact O-N 2.95Å; H422-Y424 PolarHBondContact O-N 3.35Å | ||
| 423 | R | 33.9 | Very low | 41.2 | Very low | 200 Ų | 200 | 164.1 Ų | 164.1 | 76% | 0.755 | 78% | 0.78 | S | S | * | * | trans | -39 | 118.4 | 156 | -176.7 | 177.8 | -177.5 | 135.2 | -1.2 | 110.8 | N421 E425 | N421-R423 PolarHBondContact O-N 3.31Å; R423-E425 VanDerWaalsContact C-N 3.33Å; R423-E425 WeakPolarHBondContact CD-OE1 3.07Å; R423-E425 HydrophobicContact CG-CG 4.25Å; R423-E425 IonicContact CZ-OE1 3.52Å; R423-E425 IonicContact NE-OE1 3.39Å; R423-E425 PolarHBondContact NE-OE1 2.96Å; R423-E425 IonicContact NH2-OE1 3.49Å; R423-E425 PolarHBondContact NH2-OE1 3.45Å; R423-E425 PolarHBondContact O-N 2.8Å | ||
| 424 | Y | 35.5 | Very low | 43.1 | Very low | 218 Ų | 218 | 159.4 Ų | 159.4 | 86% | 0.855 | 76% | 0.758 | S | S | * | * | trans | -66.7 | 90.9 | 168.8 | -101.8 | -102.7 | 0 | 0 | 0 | 109.1 | H422 | H422-Y424 PolarHBondContact O-N 3.35Š| ||
| 425 | E | 39.5 | Very low | 45.2 | Very low | 127 Ų | 127 | 153.1 Ų | 153.1 | 59% | 0.593 | 74% | 0.735 | S | S | * | * | trans | -81.9 | 123 | 164.9 | -76.2 | -60.1 | 156.2 | 0 | 0 | 109.4 | R423 R427 | R423-E425 VanDerWaalsContact C-N 3.33Å; R423-E425 WeakPolarHBondContact CD-OE1 3.07Å; R423-E425 HydrophobicContact CG-CG 4.25Å; R423-E425 IonicContact CZ-OE1 3.52Å; R423-E425 IonicContact NE-OE1 3.39Å; R423-E425 PolarHBondContact NE-OE1 2.96Å; R423-E425 IonicContact NH2-OE1 3.49Å; R423-E425 PolarHBondContact NH2-OE1 3.45Å; R423-E425 PolarHBondContact O-N 2.8Å; E425-R427 PolarHBondContact O-N 2.71Å | ||
| 426 | F | 33.4 | Very low | 47.4 | Very low | 164 Ų | 164 | 150.6 Ų | 150.6 | 72% | 0.719 | 73% | 0.727 | S | S | * | * | trans | -74 | 97.3 | -170.5 | -155.3 | -70 | 0 | 0 | 0 | 109.4 | H428 | F426-H428 AromaticContact CD1-CD2 3.31Å; F426-H428 WeakPolarHBondContact CD1-CD2 3.26Å; F426-H428 AromaticContact CD1-CG 3.79Å; F426-H428 AromaticContact CD1-NE2 3.51Å; F426-H428 AromaticContact CE1-CD2 3.54Å; F426-H428 AromaticContact CE1-CE1 3.45Å; F426-H428 VanDerWaalsContact CE1-CE1 3.45Å; F426-H428 WeakPolarHBondContact CE1-CE1 3.15Å; F426-H428 AromaticContact CE1-CG 3.9Å; F426-H428 AromaticContact CE1-ND1 3.84Å; F426-H428 AromaticContact CE1-NE2 3.23Å; F426-H428 WeakPolarHBondContact CE1-NE2 3.12Å; F426-H428 PolarHBondContact O-N 2.8Å | ||
| 427 | R | 38.4 | Very low | 50 | Low | 239 Ų | 239 | 149.7 Ų | 149.7 | 90% | 0.902 | 72% | 0.724 | S | S | * | * | trans | -70.9 | 76.5 | 170.6 | -73.7 | -164.8 | -177.4 | -149.8 | 2.8 | 110.7 | E425 S429 | E425-R427 PolarHBondContact O-N 2.71Å; R427-S429 PolarHBondContact O-N 3.46Å | ||
| 428 | H | 37.7 | Very low | 52.6 | Low | 150 Ų | 150 | 145.3 Ų | 145.3 | 69% | 0.694 | 71% | 0.707 | S | S | * | * | trans | -61.8 | 86.8 | 144.7 | -78.2 | -67.4 | 0 | 0 | 0 | 107 | F426 S430 | F426-H428 AromaticContact CD1-CD2 3.31Å; F426-H428 WeakPolarHBondContact CD1-CD2 3.26Å; F426-H428 AromaticContact CD1-CG 3.79Å; F426-H428 AromaticContact CD1-NE2 3.51Å; F426-H428 AromaticContact CE1-CD2 3.54Å; F426-H428 AromaticContact CE1-CE1 3.45Å; F426-H428 VanDerWaalsContact CE1-CE1 3.45Å; F426-H428 WeakPolarHBondContact CE1-CE1 3.15Å; F426-H428 AromaticContact CE1-CG 3.9Å; F426-H428 AromaticContact CE1-ND1 3.84Å; F426-H428 AromaticContact CE1-NE2 3.23Å; F426-H428 WeakPolarHBondContact CE1-NE2 3.12Å; F426-H428 PolarHBondContact O-N 2.8Å; H428-S430 VanDerWaalsContact C-N 3.32Å; H428-S430 PolarHBondContact O-N 3.02Å | ||
| 429 | S | 37.8 | Very low | 54.7 | Low | 94 Ų | 94 | 140.2 Ų | 140.2 | 66% | 0.657 | 69% | 0.693 | S | S | * | * | trans | -67.2 | 100.4 | 164.4 | -174.2 | 0 | 0 | 0 | 0 | 106.7 | R427 R431 | R427-S429 PolarHBondContact O-N 3.46Å; S429-R431 PolarHBondContact O-N 3.45Å | ||
| 430 | S | 40.5 | Very low | 57.4 | Low | 114 Ų | 114 | 137.5 Ų | 137.5 | 80% | 0.797 | 68% | 0.678 | S | S | * | * | trans | -60 | 87.5 | 166.8 | -58 | 0 | 0 | 0 | 0 | 107.6 | H428 S432 | H428-S430 VanDerWaalsContact C-N 3.32Å; H428-S430 PolarHBondContact O-N 3.02Å; S430-S432 VanDerWaalsContact C-N 3.33Å; S430-S432 PolarHBondContact O-N 2.75Å | ||
| 431 | R | 51.1 | Low | 59.7 | Low | 231 Ų | 231 | 135.6 Ų | 135.6 | 87% | 0.872 | 67% | 0.669 | S | S | * | * | trans | -63.9 | 99 | 173.2 | -74.3 | -171.5 | 176.9 | -159.2 | -0.4 | 107.2 | S429 T433 | S429-R431 PolarHBondContact O-N 3.45Å; R431-T433 PolarHBondContact O-N 3.35Å | ||
| 432 | S | 62 | Low | 62 | Low | 107 Ų | 107 | 132.9 Ų | 132.9 | 75% | 0.748 | 65% | 0.653 | S | S | * | * | P | Polyproline II helix | trans | -49 | 131 | 161.8 | -173.9 | 0 | 0 | 0 | 0 | 107.6 | S430 | S430-S432 VanDerWaalsContact C-N 3.33Å; S430-S432 PolarHBondContact O-N 2.75Å |
| 433 | T | 70.8 | Confident | 64.3 | Low | 121 Ų | 121 | 131 Ų | 131 | 74% | 0.742 | 64% | 0.643 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 127.4 | 169.9 | 45.9 | 0 | 0 | 0 | 0 | 108 | R431 | R431-T433 PolarHBondContact O-N 3.35Š|
| 434 | P | 76.3 | Confident | 66.9 | Low | 61 Ų | 61 | 127.9 Ų | 127.9 | 40% | 0.396 | 64% | 0.635 | S | S | . | * | P | Polyproline II helix | trans | -61.6 | 145.4 | 179.2 | 25.2 | -33.4 | 0 | 0 | 0 | 110.1 | E438 M439 | P434-E438 VanDerWaalsContact CA-OE2 3.24Å; P434-E438 WeakPolarHBondContact CA-OE2 3.31Å; P434-E438 HydrophobicContact CB-CB 4.02Å; P434-M439 HydrophobicContact CB-CG 4.22Å; P434-M439 HydrophobicContact CG-CG 3.83Å; P434-M439 HydrophobicContact CG-SD 4.31Å |
| 435 | S | 86.6 | Confident | 69.3 | Low | 55 Ų | 55 | 120.3 Ų | 120.3 | 39% | 0.385 | 62% | 0.617 | S | S | . | * | P | Polyproline II helix | trans | -56.6 | 152.1 | 174.2 | 172.4 | 0 | 0 | 0 | 0 | 110.7 | Q437 E438 M439 | S435-Q437 PolarHBondContact O-N 3.11Å; S435-Q437 PolarHBondContact OG-N 2.8Å; S435-E438 PolarHBondContact N-OE2 3.23Å; S435-E438 WeakPolarHBondContact O-CA 3.24Å; S435-E438 WeakPolarHBondContact O-CB 3.46Å; S435-E438 PolarHBondContact O-N 2.87Å; S435-M439 PolarHBondContact O-N 3.19Å |
| 436 | L | 85.7 | Confident | 71.4 | Confident | 120 Ų | 120 | 118.8 Ų | 118.8 | 63% | 0.628 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -54 | -37.8 | 173.6 | -150.1 | 176.3 | 0 | 0 | 0 | 110.9 | M439 I440 | L436-M439 PolarHBondContact O-N 2.86Å; L436-I440 HydrophobicContact CD2-CD1 3.44Å; L436-I440 VanDerWaalsContact CD2-CD1 3.44Å; L436-I440 HydrophobicContact CD2-CG1 3.86Å; L436-I440 WeakPolarHBondContact O-CG1 3.31Å; L436-I440 PolarHBondContact O-N 3.26Å |
| 437 | Q | 89.1 | Confident | 73.7 | Confident | 150 Ų | 150 | 116.3 Ų | 116.3 | 70% | 0.701 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -66.8 | -34.3 | 174.5 | -76.7 | 175.7 | -59.9 | 0 | 0 | 113.7 | S435 S441 | S435-Q437 PolarHBondContact O-N 3.11Å; S435-Q437 PolarHBondContact OG-N 2.8Å; Q437-S441 WeakPolarHBondContact O-CB 3.46Å; Q437-S441 PolarHBondContact O-N 3.13Å; Q437-S441 PolarHBondContact O-OG 3.34Å |
| 438 | E | 87.8 | Confident | 75.8 | Confident | 107 Ų | 107 | 108.8 Ų | 108.8 | 50% | 0.5 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -69.7 | -42.9 | 174.3 | -67.8 | 174.8 | 135.8 | 0 | 0 | 110.4 | P434 S435 I440 S441 I442 | P434-E438 VanDerWaalsContact CA-OE2 3.24Å; P434-E438 WeakPolarHBondContact CA-OE2 3.31Å; P434-E438 HydrophobicContact CB-CB 4.02Å; S435-E438 PolarHBondContact N-OE2 3.23Å; S435-E438 WeakPolarHBondContact O-CA 3.24Å; S435-E438 WeakPolarHBondContact O-CB 3.46Å; S435-E438 PolarHBondContact O-N 2.87Å; E438-I440 PolarHBondContact O-N 3.01Å; E438-S441 PolarHBondContact O-N 3.09Å; E438-S441 VanDerWaalsContact O-N 3.16Å; E438-I442 VanDerWaalsContact O-CG1 3.28Å; E438-I442 WeakPolarHBondContact O-CG1 3.26Å; E438-I442 PolarHBondContact O-N 3.36Å |
| 439 | M | 87.2 | Confident | 77.7 | Confident | 95 Ų | 95 | 104.1 Ų | 104.1 | 47% | 0.468 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -61.4 | -41.7 | 175.1 | -66.9 | -168.5 | -71.4 | 0 | 0 | 112.5 | P434 S435 L436 I442 K443 | P434-M439 HydrophobicContact CB-CG 4.22Å; P434-M439 HydrophobicContact CG-CG 3.83Å; P434-M439 HydrophobicContact CG-SD 4.31Å; S435-M439 PolarHBondContact O-N 3.19Å; L436-M439 PolarHBondContact O-N 2.86Å; M439-I442 PolarHBondContact O-N 3.47Å; M439-K443 WeakPolarHBondContact O-CB 3.41Å; M439-K443 PolarHBondContact O-N 3.05Å |
| 440 | I | 90.9 | Very high | 79.1 | Confident | 100 Ų | 100 | 102.7 Ų | 102.7 | 51% | 0.513 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -61.8 | -44 | 172.8 | -71.9 | 168.6 | 0 | 0 | 0 | 110.7 | L436 E438 K443 K444 | L436-I440 HydrophobicContact CD2-CD1 3.44Å; L436-I440 VanDerWaalsContact CD2-CD1 3.44Å; L436-I440 HydrophobicContact CD2-CG1 3.86Å; L436-I440 WeakPolarHBondContact O-CG1 3.31Å; L436-I440 PolarHBondContact O-N 3.26Å; E438-I440 PolarHBondContact O-N 3.01Å; I440-K443 PolarHBondContact O-N 3.39Å; I440-K444 WeakPolarHBondContact O-CB 3.46Å; I440-K444 PolarHBondContact O-N 3.01Å |
| 441 | S | 89.5 | Confident | 80.2 | Confident | 76 Ų | 76 | 104.5 Ų | 104.5 | 53% | 0.531 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -64.3 | -42.4 | -179.5 | -59.9 | 0 | 0 | 0 | 0 | 111.9 | Q437 E438 K444 A445 | Q437-S441 WeakPolarHBondContact O-CB 3.46Å; Q437-S441 PolarHBondContact O-N 3.13Å; Q437-S441 PolarHBondContact O-OG 3.34Å; E438-S441 PolarHBondContact O-N 3.09Å; E438-S441 VanDerWaalsContact O-N 3.16Å; S441-K444 PolarHBondContact O-N 2.93Å; S441-A445 PolarHBondContact O-N 3.02Å |
| 442 | I | 87.2 | Confident | 80.7 | Confident | 102 Ų | 102 | 102 Ų | 102 | 52% | 0.523 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -62.6 | -48.3 | 174.8 | -67.7 | 162.7 | 0 | 0 | 0 | 110.4 | E438 M439 K444 A445 E446 | E438-I442 VanDerWaalsContact O-CG1 3.28Å; E438-I442 WeakPolarHBondContact O-CG1 3.26Å; E438-I442 PolarHBondContact O-N 3.36Å; M439-I442 PolarHBondContact O-N 3.47Å; I442-K444 VanDerWaalsContact C-N 3.3Å; I442-K444 PolarHBondContact O-N 3.5Å; I442-A445 PolarHBondContact O-N 3.42Å; I442-E446 WeakPolarHBondContact O-CB 3.39Å; I442-E446 PolarHBondContact O-N 2.89Å |
| 443 | K | 88.4 | Confident | 80.5 | Confident | 119 Ų | 119 | 103.4 Ų | 103.4 | 52% | 0.517 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -65.5 | -31.2 | 179 | -81.6 | -74.2 | 164.7 | -157.6 | 0 | 113.3 | M439 I440 E446 L447 | M439-K443 WeakPolarHBondContact O-CB 3.41Å; M439-K443 PolarHBondContact O-N 3.05Å; I440-K443 PolarHBondContact O-N 3.39Å; K443-E446 WeakPolarHBondContact CD-OE2 3.37Å; K443-E446 VanDerWaalsContact CE-OE2 3.24Å; K443-E446 WeakPolarHBondContact CE-OE2 3.33Å; K443-E446 IonicContact NZ-OE1 2.72Å; K443-E446 PolarHBondContact NZ-OE1 2.79Å; K443-E446 IonicContact NZ-OE2 3.55Å; K443-E446 PolarHBondContact NZ-OE2 3.19Å; K443-L447 PolarHBondContact O-N 3.11Å; K443-L447 VanDerWaalsContact O-N 3.14Å |
| 444 | K | 89.6 | Confident | 79.6 | Confident | 136 Ų | 136 | 104.2 Ų | 104.2 | 59% | 0.591 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -68 | -45.7 | 172.6 | -171.4 | 169.2 | -178.8 | 175.6 | 0 | 111.5 | I440 S441 I442 E446 L447 D448 | I440-K444 WeakPolarHBondContact O-CB 3.46Å; I440-K444 PolarHBondContact O-N 3.01Å; S441-K444 PolarHBondContact O-N 2.93Å; I442-K444 VanDerWaalsContact C-N 3.3Å; I442-K444 PolarHBondContact O-N 3.5Å; K444-E446 VanDerWaalsContact C-N 3.31Å; K444-E446 PolarHBondContact O-N 2.67Å; K444-L447 PolarHBondContact O-N 2.8Å; K444-D448 PolarHBondContact O-N 3.16Å |
| 445 | A | 85.6 | Confident | 78.3 | Confident | 59 Ų | 59 | 108.7 Ų | 108.7 | 49% | 0.488 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -62.2 | -36.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | S441 I442 D448 A449 | S441-A445 PolarHBondContact O-N 3.02Å; I442-A445 PolarHBondContact O-N 3.42Å; A445-D448 PolarHBondContact O-N 3.48Å; A445-A449 WeakPolarHBondContact O-CB 3.46Å; A445-A449 PolarHBondContact O-N 2.97Å |
| 446 | E | 83.7 | Confident | 76.4 | Confident | 94 Ų | 94 | 115.1 Ų | 115.1 | 44% | 0.439 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -66 | -39.7 | 175.7 | -169 | -178.4 | 166.8 | 0 | 0 | 112.5 | I442 K443 K444 S450 | I442-E446 WeakPolarHBondContact O-CB 3.39Å; I442-E446 PolarHBondContact O-N 2.89Å; K443-E446 WeakPolarHBondContact CD-OE2 3.37Å; K443-E446 VanDerWaalsContact CE-OE2 3.24Å; K443-E446 WeakPolarHBondContact CE-OE2 3.33Å; K443-E446 IonicContact NZ-OE1 2.72Å; K443-E446 PolarHBondContact NZ-OE1 2.79Å; K443-E446 IonicContact NZ-OE2 3.55Å; K443-E446 PolarHBondContact NZ-OE2 3.19Å; K444-E446 VanDerWaalsContact C-N 3.31Å; K444-E446 PolarHBondContact O-N 2.67Å; E446-S450 WeakPolarHBondContact O-CB 3.34Å; E446-S450 PolarHBondContact O-N 3.26Å; E446-S450 PolarHBondContact O-OG 2.89Å |
| 447 | L | 82.1 | Confident | 74.3 | Confident | 112 Ų | 112 | 114.5 Ų | 114.5 | 59% | 0.586 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -67.8 | -40.9 | 173.1 | -85.3 | 167.7 | 0 | 0 | 0 | 112.4 | K443 K444 A449 S450 K451 | K443-L447 PolarHBondContact O-N 3.11Å; K443-L447 VanDerWaalsContact O-N 3.14Å; K444-L447 PolarHBondContact O-N 2.8Å; L447-A449 VanDerWaalsContact C-N 3.32Å; L447-S450 PolarHBondContact O-N 2.88Å; L447-K451 WeakPolarHBondContact O-CG 3.27Å; L447-K451 PolarHBondContact O-N 2.82Å; L447-K451 VanDerWaalsContact O-N 3.08Å |
| 448 | D | 82.4 | Confident | 72.3 | Confident | 81 Ų | 81 | 114.2 Ų | 114.2 | 43% | 0.433 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -70.3 | -29.8 | 178.8 | -69.6 | -23.5 | 0 | 0 | 0 | 111.8 | K444 A445 | K444-D448 PolarHBondContact O-N 3.16Å; A445-D448 PolarHBondContact O-N 3.48Å |
| 449 | A | 76.4 | Confident | 70.6 | Confident | 52 Ų | 52 | 116.4 Ų | 116.4 | 43% | 0.43 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -70.9 | -46.9 | 169.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | A445 L447 K451 K452 | A445-A449 WeakPolarHBondContact O-CB 3.46Å; A445-A449 PolarHBondContact O-N 2.97Å; L447-A449 VanDerWaalsContact C-N 3.32Å; A449-K451 PolarHBondContact O-N 3.45Å; A449-K452 PolarHBondContact O-N 3.06Å |
| 450 | S | 68.1 | Low | 68.4 | Low | 64 Ų | 64 | 119.2 Ų | 119.2 | 45% | 0.448 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -63.6 | -25.6 | 179.4 | -59.3 | 0 | 0 | 0 | 0 | 113.5 | E446 L447 K452 N454 | E446-S450 WeakPolarHBondContact O-CB 3.34Å; E446-S450 PolarHBondContact O-N 3.26Å; E446-S450 PolarHBondContact O-OG 2.89Å; L447-S450 PolarHBondContact O-N 2.88Å; S450-K452 VanDerWaalsContact C-N 3.33Å; S450-N454 PolarHBondContact O-ND2 2.95Å |
| 451 | K | 63.8 | Low | 66.2 | Low | 153 Ų | 153 | 120 Ų | 120 | 67% | 0.665 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.3 | -18.9 | 173.4 | -77.9 | 177.2 | 177.8 | 177.6 | 0 | 114.3 | L447 A449 | L447-K451 WeakPolarHBondContact O-CG 3.27Å; L447-K451 PolarHBondContact O-N 2.82Å; L447-K451 VanDerWaalsContact O-N 3.08Å; A449-K451 PolarHBondContact O-N 3.45Å |
| 452 | K | 61.6 | Low | 63.9 | Low | 178 Ų | 178 | 121.9 Ų | 121.9 | 77% | 0.774 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.7 | -11.5 | 178.3 | -73.1 | -177.1 | 176.9 | -179.3 | 0 | 114 | A449 S450 | A449-K452 PolarHBondContact O-N 3.06Å; S450-K452 VanDerWaalsContact C-N 3.33Å |
| 453 | N | 58.4 | Low | 61.8 | Low | 136 Ų | 136 | 126 Ų | 126 | 73% | 0.727 | 67% | 0.671 | S | S | * | * | S | Bend | trans | -101.4 | 13.5 | -177.7 | -59.7 | -13.3 | 0 | 0 | 0 | 113.1 | ||
| 454 | N | 52.1 | Low | 59.2 | Low | 138 Ų | 138 | 128.2 Ų | 128.2 | 74% | 0.738 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -122.1 | 27.1 | -176.3 | -95.4 | -54.1 | 0 | 0 | 0 | 112.5 | S450 | S450-N454 PolarHBondContact O-ND2 2.95Š|
| 455 | L | 48.6 | Very low | 56.9 | Low | 155 Ų | 155 | 126.6 Ų | 126.6 | 81% | 0.812 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -147.5 | 47.3 | -178.7 | -141.1 | 109.6 | 0 | 0 | 0 | 112.6 | ||
| 456 | E | 47.1 | Very low | 54.5 | Low | 190 Ų | 190 | 129.9 Ų | 129.9 | 89% | 0.888 | 71% | 0.707 | S | S | * | * | trans | -156.9 | 83.1 | 167.4 | -159.4 | 73.6 | -119.7 | 0 | 0 | 108.9 | ||||
| 457 | S | 41.5 | Very low | 52.3 | Low | 107 Ų | 107 | 131.2 Ų | 131.2 | 75% | 0.748 | 72% | 0.722 | S | S | * | * | trans | -155.9 | 91.7 | 176.7 | 62.9 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 458 | D | 45.5 | Very low | 50.3 | Low | 144 Ų | 144 | 130.5 Ų | 130.5 | 77% | 0.77 | 73% | 0.726 | S | S | * | * | trans | -152.4 | 131 | 166.6 | -96.1 | -42 | 0 | 0 | 0 | 110.4 | ||||
| 459 | M | 52.4 | Low | 48.2 | Very low | 154 Ų | 154 | 135 Ų | 135 | 76% | 0.759 | 74% | 0.744 | S | S | * | * | trans | 59.2 | 118.9 | 168.8 | -41.4 | -50.4 | 163.8 | 0 | 0 | 116.7 | ||||
| 460 | D | 42.6 | Very low | 46.9 | Very low | 154 Ų | 154 | 138 Ų | 138 | 82% | 0.824 | 76% | 0.762 | S | S | * | * | cis | -161.2 | 168.9 | 35.9 | -103.2 | -39.7 | 0 | 0 | 0 | 111.7 | ||||
| 461 | S | 43.3 | Very low | 45.7 | Very low | 116 Ų | 116 | 142 Ų | 142 | 81% | 0.811 | 78% | 0.779 | S | S | * | * | trans | -137.1 | 162.8 | -178.6 | -97.9 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 462 | P | 41.6 | Very low | 45 | Very low | 115 Ų | 115 | 140.3 Ų | 140.3 | 75% | 0.747 | 78% | 0.783 | S | S | * | * | trans | -98.3 | 170.6 | -142.8 | 37.6 | -38.7 | 0 | 0 | 0 | 116 | ||||
| 463 | Q | 42.3 | Very low | 44.4 | Very low | 190 Ų | 190 | 138.7 Ų | 138.7 | 89% | 0.888 | 79% | 0.788 | S | S | * | * | trans | -127.5 | 147.3 | 167.8 | -81.5 | -69.8 | -6.8 | 0 | 0 | 112.1 | ||||
| 464 | L | 34.3 | Very low | 43.7 | Very low | 164 Ų | 164 | 139.2 Ų | 139.2 | 86% | 0.859 | 79% | 0.791 | S | S | * | * | trans | -111.2 | 138.5 | -173.9 | -80.8 | 155.7 | 0 | 0 | 0 | 112 | ||||
| 465 | S | 41.1 | Very low | 43.4 | Very low | 103 Ų | 103 | 139.9 Ų | 139.9 | 72% | 0.72 | 80% | 0.8 | S | S | * | * | trans | -173.9 | 121.2 | 156.1 | 12.3 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 466 | T | 34.9 | Very low | 43 | Very low | 127 Ų | 127 | 137.8 Ų | 137.8 | 78% | 0.779 | 80% | 0.799 | S | S | * | * | 44.3 | 123.6 | 83 | 64.8 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 467 | T | 38.1 | Very low | 43.1 | Very low | 123 Ų | 123 | 139 Ų | 139 | 76% | 0.755 | 80% | 0.801 | S | S | * | * | -170.9 | 161.7 | 52.4 | -36.1 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 468 | S | 40.9 | Very low | 43 | Very low | 96 Ų | 96 | 142.4 Ų | 142.4 | 67% | 0.671 | 81% | 0.805 | S | S | * | * | trans | 44.2 | 113.5 | 152.6 | 56.1 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 469 | E | 37 | Very low | 43 | Very low | 175 Ų | 175 | 145.7 Ų | 145.7 | 82% | 0.818 | 81% | 0.812 | S | S | * | * | 76.3 | 107.2 | 72.1 | -170.8 | 175 | -151.2 | 0 | 0 | 115.4 | |||||
| 470 | S | 49.6 | Very low | 42.4 | Very low | 115 Ų | 115 | 142.9 Ų | 142.9 | 80% | 0.804 | 81% | 0.814 | S | S | * | * | trans | -170.8 | 141.5 | 146.3 | 32 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 471 | N | 42.8 | Very low | 42.6 | Very low | 149 Ų | 149 | 140.4 Ų | 140.4 | 80% | 0.797 | 81% | 0.808 | S | S | * | * | trans | -104.4 | -160.8 | -177.1 | -62.5 | -78.1 | 0 | 0 | 0 | 111.2 | ||||
| 472 | P | 48.6 | Very low | 42.9 | Very low | 117 Ų | 117 | 144.2 Ų | 144.2 | 76% | 0.76 | 81% | 0.81 | S | S | * | * | -123.1 | -177.8 | -110.5 | 36.6 | -16.1 | 0 | 0 | 0 | 113.7 | |||||
| 473 | V | 50.6 | Low | 42.9 | Very low | 145 Ų | 145 | 150.7 Ų | 150.7 | 88% | 0.879 | 82% | 0.82 | S | S | * | * | trans | -135.5 | 136.7 | 167.2 | 178.3 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 474 | D | 42 | Very low | 43.1 | Very low | 147 Ų | 147 | 147.5 Ų | 147.5 | 79% | 0.786 | 82% | 0.815 | S | S | * | * | trans | -64.4 | 160.1 | -179 | -61.7 | -80 | 0 | 0 | 0 | 115.2 | ||||
| 475 | T | 46.8 | Very low | 43.6 | Very low | 152 Ų | 152 | 148.7 Ų | 148.7 | 93% | 0.933 | 81% | 0.814 | S | S | * | * | -152.4 | 144.2 | 125.8 | 10.5 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 476 | S | 40.6 | Very low | 43.6 | Very low | 111 Ų | 111 | 149.5 Ų | 149.5 | 78% | 0.776 | 82% | 0.82 | S | S | * | * | trans | -91.9 | 150.4 | -168.1 | 50.7 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 477 | K | 49.5 | Very low | 44.4 | Very low | 214 Ų | 214 | 153.5 Ų | 153.5 | 93% | 0.93 | 82% | 0.822 | S | S | * | * | trans | -153.9 | 123.2 | 139.4 | -118.5 | 161.1 | -170.5 | 167.5 | 0 | 113.7 | ||||
| 478 | E | 39.5 | Very low | 44.6 | Very low | 179 Ų | 179 | 158 Ų | 158 | 84% | 0.836 | 83% | 0.827 | S | S | * | * | trans | -80.2 | 140.5 | -176.8 | 178.2 | -172.7 | 168.5 | 0 | 0 | 112.2 | ||||
| 479 | K | 45.4 | Very low | 45.1 | Very low | 214 Ų | 214 | 164.3 Ų | 164.3 | 93% | 0.93 | 84% | 0.836 | S | S | * | * | trans | -159.3 | 126.8 | 146.5 | -115 | 168.9 | -172 | 179.5 | 0 | 111.7 | ||||
| 480 | A | 38.1 | Very low | 45.6 | Very low | 95 Ų | 95 | 160.7 Ų | 160.7 | 79% | 0.785 | 83% | 0.827 | S | S | * | * | trans | -85.3 | 142.3 | -170.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 481 | S | 46.9 | Very low | 45.5 | Very low | 102 Ų | 102 | 164.4 Ų | 164.4 | 71% | 0.713 | 83% | 0.829 | S | S | * | * | trans | -159.3 | 110.1 | 149.5 | -161.6 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 482 | K | 51.2 | Low | 45.9 | Very low | 196 Ų | 196 | 164 Ų | 164 | 85% | 0.852 | 83% | 0.825 | S | S | * | * | trans | 52.5 | 108.3 | 141.6 | -60.6 | 175.6 | -177.1 | 176.7 | 0 | 119.8 | ||||
| 483 | R | 40.5 | Very low | 46.1 | Very low | 251 Ų | 251 | 164.8 Ų | 164.8 | 95% | 0.947 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 141.4 | 169.4 | -57.2 | 178.3 | 178.9 | -162.2 | -1.1 | 113.2 | ||
| 484 | P | 45.9 | Very low | 46 | Very low | 122 Ų | 122 | 164.8 Ų | 164.8 | 79% | 0.792 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -91.2 | 167.5 | 151.6 | 34 | -28.2 | 0 | 0 | 0 | 111.9 | ||
| 485 | K | 45.6 | Very low | 46.4 | Very low | 189 Ų | 189 | 167 Ų | 167 | 82% | 0.822 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -79.6 | 132.4 | -165.9 | -62.2 | 167 | -178.5 | 175.4 | 0 | 112.7 | ||
| 486 | S | 41.2 | Very low | 46.5 | Very low | 121 Ų | 121 | 168.8 Ų | 168.8 | 85% | 0.846 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -76 | 120 | 172.5 | 53.9 | 0 | 0 | 0 | 0 | 111.5 | ||
| 487 | Y | 51 | Low | 46.7 | Very low | 211 Ų | 211 | 170.3 Ų | 170.3 | 83% | 0.827 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -95 | 123.4 | 163.6 | -79.9 | -85 | 0 | 0 | 0 | 109.9 | R489 | Y487-R489 PolarHBondContact O-N 2.79Š|
| 488 | Y | 43 | Very low | 46.4 | Very low | 217 Ų | 217 | 164.9 Ų | 164.9 | 85% | 0.851 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 116.5 | 176 | -165.9 | -91.2 | 0 | 0 | 0 | 109.3 | ||
| 489 | R | 50.6 | Low | 46.9 | Very low | 229 Ų | 229 | 164.9 Ų | 164.9 | 86% | 0.864 | 80% | 0.803 | S | S | * | * | trans | -104.5 | 125.4 | 162 | -84 | -168.3 | 179 | -108 | 5.4 | 108.3 | Y487 K491 | Y487-R489 PolarHBondContact O-N 2.79Å; R489-K491 PolarHBondContact O-N 2.85Å | ||
| 490 | P | 48.2 | Very low | 47.1 | Very low | 98 Ų | 98 | 160.5 Ų | 160.5 | 64% | 0.636 | 79% | 0.794 | S | S | * | * | trans | -64.7 | 134.6 | 173.1 | 28.1 | -33 | 0 | 0 | 0 | 109.2 | I492 | P490-I492 PolarHBondContact O-N 2.89Š| ||
| 491 | K | 48.5 | Very low | 47.6 | Very low | 193 Ų | 193 | 163.4 Ų | 163.4 | 84% | 0.839 | 80% | 0.795 | S | S | * | * | trans | -67.5 | 121.5 | 166.5 | -67.2 | 179.5 | 179.2 | 179.9 | 0 | 107.3 | R489 | R489-K491 PolarHBondContact O-N 2.85Š| ||
| 492 | I | 51.1 | Low | 47.5 | Very low | 141 Ų | 141 | 167.2 Ų | 167.2 | 72% | 0.723 | 81% | 0.807 | S | S | * | * | trans | -86.1 | 107.9 | 167 | -60.9 | 170.3 | 0 | 0 | 0 | 105.5 | P490 L494 | P490-I492 PolarHBondContact O-N 2.89Å; I492-L494 PolarHBondContact O-N 3.12Å; I492-L494 VanDerWaalsContact O-N 3.08Å | ||
| 493 | D | 51.3 | Low | 47.1 | Very low | 134 Ų | 134 | 161.5 Ų | 161.5 | 72% | 0.717 | 80% | 0.803 | S | S | * | * | trans | -66.6 | 108.1 | 173.9 | -80.7 | -30 | 0 | 0 | 0 | 109.3 | F495 | D493-F495 PolarHBondContact O-N 3.09Š| ||
| 494 | L | 49.8 | Very low | 47.3 | Very low | 145 Ų | 145 | 158.4 Ų | 158.4 | 76% | 0.759 | 80% | 0.799 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.7 | 13.5 | -179.4 | -78.5 | 159.6 | 0 | 0 | 0 | 114 | I492 | I492-L494 PolarHBondContact O-N 3.12Å; I492-L494 VanDerWaalsContact O-N 3.08Å |
| 495 | F | 48.8 | Very low | 47.2 | Very low | 194 Ų | 194 | 167.6 Ų | 167.6 | 85% | 0.851 | 82% | 0.82 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.1 | 8.7 | -176.8 | -100.1 | -87.6 | 0 | 0 | 0 | 114.8 | D493 | D493-F495 PolarHBondContact O-N 3.09Š|
| 496 | K | 50.8 | Low | 47.3 | Very low | 189 Ų | 189 | 166.5 Ų | 166.5 | 82% | 0.822 | 82% | 0.82 | S | S | * | * | S | Bend | trans | -120.2 | 22 | -179.2 | -91.1 | -174.4 | 173.3 | -178.1 | 0 | 115.6 | ||
| 497 | L | 43.6 | Very low | 47.6 | Very low | 142 Ų | 142 | 168.9 Ų | 168.9 | 74% | 0.743 | 82% | 0.819 | S | S | * | * | S | Bend | trans | -118.9 | 18.5 | 179.4 | -71.8 | 174.3 | 0 | 0 | 0 | 114.2 | ||
| 498 | S | 44.4 | Very low | 47.5 | Very low | 101 Ų | 101 | 166.6 Ų | 166.6 | 71% | 0.706 | 82% | 0.818 | S | S | * | * | S | Bend | trans | -101.1 | -8.2 | 176.2 | 50.1 | 0 | 0 | 0 | 0 | 114.7 | ||
| 499 | E | 48.8 | Very low | 47.7 | Very low | 178 Ų | 178 | 163.6 Ų | 163.6 | 83% | 0.832 | 82% | 0.816 | S | S | * | * | S | Bend | trans | -114.2 | 69.3 | -175.3 | -67.2 | -178.8 | 149 | 0 | 0 | 111.3 | ||
| 500 | T | 50.5 | Low | 47.5 | Very low | 122 Ų | 122 | 159.5 Ų | 159.5 | 75% | 0.748 | 81% | 0.813 | S | S | * | * | S | Bend | trans | -159.6 | 9.9 | 170.3 | -1.8 | 0 | 0 | 0 | 0 | 114.4 | ||
| 501 | I | 47.7 | Very low | 47.5 | Very low | 156 Ų | 156 | 163.6 Ų | 163.6 | 80% | 0.8 | 83% | 0.825 | S | S | * | * | S | Bend | trans | -129.2 | 27 | -175.5 | -40.8 | -177.2 | 0 | 0 | 0 | 111.3 | ||
| 502 | L | 46 | Very low | 47.4 | Very low | 183 Ų | 183 | 161.5 Ų | 161.5 | 96% | 0.958 | 82% | 0.824 | S | S | * | * | trans | -142.6 | 87.1 | 170.2 | -75.4 | 175.6 | 0 | 0 | 0 | 108.1 | ||||
| 503 | G | 41.2 | Very low | 47.1 | Very low | 75 Ų | 75 | 163.1 Ų | 163.1 | 77% | 0.773 | 83% | 0.832 | S | S | * | * | trans | -171.3 | 23.5 | -170.9 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 504 | E | 44.5 | Very low | 46.8 | Very low | 186 Ų | 186 | 165.5 Ų | 165.5 | 87% | 0.869 | 84% | 0.841 | S | S | * | * | trans | -145.1 | 91.2 | 165.9 | -75.6 | -163.8 | 157.6 | 0 | 0 | 109.5 | ||||
| 505 | Y | 45.5 | Very low | 46.5 | Very low | 315 Ų | 315 | 167.4 Ų | 167.4 | 100% | 1.235 | 85% | 0.849 | S | S | * | * | trans | -163.2 | 0 | 157.3 | -105.7 | -66.1 | 0 | 0 | 0 | 109.9 |
Retrieved 505 of 505 residues in 153.8 ms
(Link to these results)