| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 40.8 | Very low | 42.3 | Very low | 246 Ų | 246 | 145.7 Ų | 145.7 | 100% | 1.212 | 84% | 0.844 | S | S | * | * | 0 | 112.8 | 0 | -74 | 177.9 | 169.7 | 0 | 0 | 107.4 | |||||
| 2 | L | 40.3 | Very low | 42.1 | Very low | 179 Ų | 179 | 153.6 Ų | 153.6 | 94% | 0.937 | 85% | 0.852 | S | S | * | * | trans | -67.1 | 143.1 | 173 | -98.5 | 80.1 | 0 | 0 | 0 | 109.7 | ||||
| 3 | A | 44.4 | Very low | 41.7 | Very low | 104 Ų | 104 | 147.9 Ų | 147.9 | 86% | 0.86 | 85% | 0.85 | S | S | * | * | trans | -117.9 | 134.3 | 158 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 4 | S | 42.1 | Very low | 41.9 | Very low | 119 Ų | 119 | 147 Ų | 147 | 83% | 0.832 | 85% | 0.848 | S | S | * | * | trans | -92.5 | 170.6 | -158.1 | -158.9 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 5 | Q | 44.9 | Very low | 42 | Very low | 176 Ų | 176 | 144.5 Ų | 144.5 | 82% | 0.822 | 84% | 0.839 | S | S | * | * | trans | -61 | 154.4 | -177.1 | -58.1 | 179.3 | -21 | 0 | 0 | 114.7 | ||||
| 6 | G | 42.4 | Very low | 41.7 | Very low | 82 Ų | 82 | 147.2 Ų | 147.2 | 85% | 0.845 | 84% | 0.844 | S | S | * | * | trans | -139.5 | 92 | 164 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 7 | V | 39 | Very low | 41.8 | Very low | 121 Ų | 121 | 147.6 Ų | 147.6 | 73% | 0.733 | 84% | 0.841 | S | S | * | * | trans | -94 | 124.3 | 166.9 | 171.8 | 0 | 0 | 0 | 0 | 107.4 | L9 | V7-L9 HydrophobicContact CG1-CG 4.31Š| ||
| 8 | L | 43 | Very low | 41.5 | Very low | 150 Ų | 150 | 147.1 Ų | 147.1 | 79% | 0.785 | 84% | 0.841 | S | S | * | * | trans | -112.8 | 107.4 | 169.6 | -159.8 | 90.3 | 0 | 0 | 0 | 109.1 | ||||
| 9 | L | 37.3 | Very low | 41.7 | Very low | 157 Ų | 157 | 145.6 Ų | 145.6 | 82% | 0.822 | 84% | 0.837 | S | S | * | * | trans | -77.8 | 131.5 | 171.9 | -72.5 | 159.7 | 0 | 0 | 0 | 109.7 | V7 | V7-L9 HydrophobicContact CG1-CG 4.31Š| ||
| 10 | H | 43.2 | Very low | 41.3 | Very low | 165 Ų | 165 | 143.3 Ų | 143.3 | 76% | 0.764 | 84% | 0.837 | S | S | * | * | trans | -104.3 | 138.5 | 164 | -76.8 | 90.7 | 0 | 0 | 0 | 109.9 | ||||
| 11 | P | 47.9 | Very low | 41.1 | Very low | 104 Ų | 104 | 140.9 Ų | 140.9 | 68% | 0.675 | 83% | 0.833 | S | S | * | * | trans | -95.1 | 134.7 | -174.9 | 37.5 | -33.2 | 0 | 0 | 0 | 112.7 | ||||
| 12 | Y | 39.7 | Very low | 41.3 | Very low | 240 Ų | 240 | 135.2 Ų | 135.2 | 94% | 0.941 | 82% | 0.815 | S | S | * | * | trans | 58.2 | 118.7 | 160.6 | -56.9 | -77.1 | 0 | 0 | 0 | 120.8 | ||||
| 13 | G | 37.3 | Very low | 41.1 | Very low | 80 Ų | 80 | 137.7 Ų | 137.7 | 83% | 0.825 | 81% | 0.813 | S | S | * | * | trans | 157 | 103.9 | 156.1 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 14 | V | 44.1 | Very low | 41 | Very low | 135 Ų | 135 | 140.7 Ų | 140.7 | 82% | 0.818 | 81% | 0.814 | S | S | * | * | trans | -40.6 | 142.7 | -175.5 | -177.3 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 15 | P | 44.1 | Very low | 41.2 | Very low | 110 Ų | 110 | 141 Ų | 141 | 71% | 0.714 | 81% | 0.813 | S | S | * | * | trans | -83 | 136.6 | 177.4 | 33.2 | -34.3 | 0 | 0 | 0 | 113.7 | ||||
| 16 | M | 36.2 | Very low | 40.7 | Very low | 187 Ų | 187 | 136.3 Ų | 136.3 | 92% | 0.921 | 81% | 0.812 | S | S | * | * | trans | -111.7 | 120.6 | 166.5 | -75.8 | -77.1 | -88.5 | 0 | 0 | 109.5 | ||||
| 17 | I | 44.5 | Very low | 40.7 | Very low | 155 Ų | 155 | 140.5 Ų | 140.5 | 80% | 0.795 | 81% | 0.814 | S | S | * | * | trans | -108.5 | 125.9 | 174.3 | -73 | 162.4 | 0 | 0 | 0 | 107.8 | ||||
| 18 | V | 36.3 | Very low | 40.5 | Very low | 138 Ų | 138 | 142 Ų | 142 | 84% | 0.836 | 82% | 0.817 | S | S | * | * | trans | -153 | 144.5 | 152.3 | -179.9 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 19 | P | 45.8 | Very low | 40 | Very low | 119 Ų | 119 | 143.7 Ų | 143.7 | 77% | 0.773 | 82% | 0.821 | S | S | * | * | trans | -111.8 | 170.3 | -150.9 | 40.8 | -30.4 | 0 | 0 | 0 | 115.5 | ||||
| 20 | A | 33.8 | Very low | 39.6 | Very low | 99 Ų | 99 | 139.9 Ų | 139.9 | 82% | 0.818 | 82% | 0.819 | S | S | * | * | trans | -154.9 | 120.4 | 159.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 21 | A | 37 | Very low | 39.3 | Very low | 93 Ų | 93 | 139.7 Ų | 139.7 | 77% | 0.769 | 82% | 0.824 | S | S | * | * | trans | 62.6 | 134.6 | 145.3 | 0 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 22 | P | 43.6 | Very low | 38.7 | Very low | 127 Ų | 127 | 142.7 Ų | 142.7 | 83% | 0.825 | 83% | 0.829 | S | S | * | * | trans | -94.4 | 144.7 | 177.5 | 37.1 | -31.7 | 0 | 0 | 0 | 113.4 | ||||
| 23 | Y | 37.1 | Very low | 38.4 | Very low | 230 Ų | 230 | 139.9 Ų | 139.9 | 90% | 0.902 | 82% | 0.824 | S | S | * | * | trans | -112.2 | 127 | 169.7 | -100.3 | -93.2 | 0 | 0 | 0 | 111 | ||||
| 24 | L | 42.6 | Very low | 38.3 | Very low | 167 Ų | 167 | 140.6 Ų | 140.6 | 87% | 0.874 | 82% | 0.822 | S | S | * | * | trans | -76.7 | 154.3 | 168.4 | -76.3 | 158.9 | 0 | 0 | 0 | 111.1 | ||||
| 25 | P | 46 | Very low | 37.7 | Very low | 125 Ų | 125 | 138.9 Ų | 138.9 | 81% | 0.812 | 82% | 0.823 | S | S | * | * | trans | -121.5 | 138.1 | 146.2 | 33.2 | -21.3 | 0 | 0 | 0 | 112.3 | ||||
| 26 | G | 33.4 | Very low | 37.2 | Very low | 78 Ų | 78 | 138.7 Ų | 138.7 | 80% | 0.804 | 83% | 0.83 | S | S | * | * | trans | -86.4 | 167 | -176.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 27 | L | 43 | Very low | 37.3 | Very low | 170 Ų | 170 | 134 Ų | 134 | 89% | 0.89 | 82% | 0.821 | S | S | * | * | trans | -69.6 | 146.7 | 163.5 | -80.9 | 157.2 | 0 | 0 | 0 | 110.8 | ||||
| 28 | I | 35.2 | Very low | 37.6 | Very low | 154 Ų | 154 | 132.3 Ų | 132.3 | 79% | 0.79 | 82% | 0.82 | S | S | * | * | trans | -179.5 | 115.9 | 135.9 | -86.9 | 149.3 | 0 | 0 | 0 | 109.8 | ||||
| 29 | Q | 32.2 | Very low | 38.1 | Very low | 185 Ų | 185 | 133.2 Ų | 133.2 | 86% | 0.864 | 82% | 0.82 | S | S | * | * | 51.3 | 126.2 | 126.4 | -144.6 | 143.2 | -7.8 | 0 | 0 | 122.5 | |||||
| 30 | G | 29.6 | Very low | 37.7 | Very low | 77 Ų | 77 | 134.3 Ų | 134.3 | 79% | 0.794 | 83% | 0.825 | S | S | * | * | trans | -159.7 | 119.5 | 158.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 31 | N | 36 | Very low | 38 | Very low | 160 Ų | 160 | 138 Ų | 138 | 86% | 0.856 | 83% | 0.828 | S | S | * | * | trans | -136.1 | 130.8 | 175.9 | -129.9 | 32.4 | 0 | 0 | 0 | 106.8 | ||||
| 32 | Q | 35.2 | Very low | 38 | Very low | 168 Ų | 168 | 137.3 Ų | 137.3 | 79% | 0.785 | 82% | 0.822 | S | S | * | * | trans | 167.7 | 105.5 | 153.4 | -94.3 | 176 | 22.2 | 0 | 0 | 108.9 | ||||
| 33 | E | 34.6 | Very low | 37.7 | Very low | 180 Ų | 180 | 139.4 Ų | 139.4 | 84% | 0.841 | 82% | 0.821 | S | S | * | * | 75.3 | 141.1 | 101.8 | -71.9 | 177.6 | 134.8 | 0 | 0 | 114.1 | |||||
| 34 | A | 33.8 | Very low | 38.2 | Very low | 95 Ų | 95 | 132.8 Ų | 132.8 | 79% | 0.785 | 81% | 0.806 | S | S | * | * | cis | -176.2 | 149.1 | -14.8 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 35 | A | 32.8 | Very low | 37.7 | Very low | 100 Ų | 100 | 135.5 Ų | 135.5 | 83% | 0.826 | 81% | 0.806 | S | S | * | * | trans | 172.8 | 113.4 | 142.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 36 | A | 32.6 | Very low | 37 | Very low | 105 Ų | 105 | 133.3 Ų | 133.3 | 87% | 0.868 | 80% | 0.799 | S | S | * | * | trans | 27 | 145.6 | 140 | 0 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 37 | A | 39 | Very low | 37.1 | Very low | 90 Ų | 90 | 134.9 Ų | 134.9 | 74% | 0.744 | 80% | 0.797 | S | S | * | * | cis | 179.8 | -172.2 | 2.9 | 0 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 38 | P | 49.6 | Very low | 36.7 | Very low | 118 Ų | 118 | 131.4 Ų | 131.4 | 77% | 0.766 | 79% | 0.793 | S | S | * | * | cis | -125.8 | 169.1 | -39.1 | 30.6 | -11.2 | 0 | 0 | 0 | 114.2 | ||||
| 39 | D | 47.2 | Very low | 36.5 | Very low | 158 Ų | 158 | 131.7 Ų | 131.7 | 85% | 0.845 | 79% | 0.791 | S | S | * | * | trans | -57.5 | 150.7 | 163.7 | -74.3 | -85.1 | 0 | 0 | 0 | 114.5 | ||||
| 40 | T | 36.9 | Very low | 36.6 | Very low | 142 Ų | 142 | 131.7 Ų | 131.7 | 87% | 0.871 | 79% | 0.788 | S | S | * | * | trans | -142.7 | 121.7 | 152.8 | -45.9 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 41 | M | 40.7 | Very low | 37.2 | Very low | 176 Ų | 176 | 131.9 Ų | 131.9 | 87% | 0.867 | 78% | 0.782 | S | S | * | * | trans | -81.3 | 140.2 | 179 | -96.1 | 179 | 175.1 | 0 | 0 | 112.7 | ||||
| 42 | A | 37.4 | Very low | 38.2 | Very low | 79 Ų | 79 | 129.9 Ų | 129.9 | 65% | 0.653 | 78% | 0.778 | S | S | * | * | 80.1 | 141.3 | 125.3 | 0 | 0 | 0 | 0 | 0 | 124.1 | |||||
| 43 | Q | 37.2 | Very low | 39 | Very low | 170 Ų | 170 | 127.4 Ų | 127.4 | 79% | 0.794 | 78% | 0.776 | S | S | * | * | trans | 90 | 166.3 | 149.3 | -56.6 | -53.7 | -31 | 0 | 0 | 118.9 | ||||
| 44 | P | 47.1 | Very low | 39.1 | Very low | 91 Ų | 91 | 127 Ų | 127 | 59% | 0.591 | 78% | 0.775 | S | S | * | * | -137.4 | -173.8 | -94.4 | 35.5 | -11 | 0 | 0 | 0 | 114.6 | |||||
| 45 | Y | 31.5 | Very low | 39.1 | Very low | 225 Ų | 225 | 130.1 Ų | 130.1 | 88% | 0.882 | 78% | 0.778 | S | S | * | * | trans | 74.9 | 131.8 | 158.5 | -86.1 | -80.9 | 0 | 0 | 0 | 124 | ||||
| 46 | A | 31.9 | Very low | 39 | Very low | 79 Ų | 79 | 129.2 Ų | 129.2 | 65% | 0.653 | 78% | 0.778 | S | S | * | * | 81.5 | 107.3 | 130 | 0 | 0 | 0 | 0 | 0 | 123.5 | |||||
| 47 | S | 35.8 | Very low | 39.4 | Very low | 111 Ų | 111 | 131.7 Ų | 131.7 | 78% | 0.776 | 78% | 0.775 | S | S | * | * | 46.4 | 124.2 | 127.6 | 58 | 0 | 0 | 0 | 0 | 123 | |||||
| 48 | A | 34.1 | Very low | 39.6 | Very low | 96 Ų | 96 | 133.3 Ų | 133.3 | 79% | 0.793 | 78% | 0.778 | S | S | * | * | trans | -161.3 | 119.9 | 140.2 | 0 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 49 | Q | 30.9 | Very low | 39.3 | Very low | 160 Ų | 160 | 131.5 Ų | 131.5 | 75% | 0.748 | 77% | 0.773 | S | S | * | * | cis | 66.5 | 118.6 | 45.4 | -122.2 | 175 | -27.3 | 0 | 0 | 114 | ||||
| 50 | F | 35.4 | Very low | 38.5 | Very low | 185 Ų | 185 | 133.3 Ų | 133.3 | 81% | 0.811 | 78% | 0.777 | S | S | * | * | trans | 83.1 | 112.8 | 161.8 | -73 | -83.7 | 0 | 0 | 0 | 121.4 | ||||
| 51 | A | 42.4 | Very low | 38.6 | Very low | 81 Ų | 81 | 137 Ų | 137 | 67% | 0.669 | 78% | 0.776 | S | S | * | * | trans | -87.2 | 174.8 | 133.9 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 52 | P | 56.4 | Low | 38.2 | Very low | 118 Ų | 118 | 134.8 Ų | 134.8 | 77% | 0.766 | 77% | 0.773 | S | S | * | * | cis | -130.1 | -161.9 | -18.9 | 35.2 | -13.3 | 0 | 0 | 0 | 111.5 | ||||
| 53 | P | 51.1 | Low | 38.6 | Very low | 116 Ų | 116 | 135.4 Ų | 135.4 | 75% | 0.753 | 78% | 0.778 | S | S | * | * | -147.7 | 174.4 | 111.5 | 38.3 | -21.9 | 0 | 0 | 0 | 111.9 | |||||
| 54 | Q | 37.2 | Very low | 38.8 | Very low | 172 Ų | 172 | 132.9 Ų | 132.9 | 80% | 0.804 | 78% | 0.776 | S | S | * | * | cis | -164.4 | 140.8 | -1.9 | -122.7 | 174.7 | -4 | 0 | 0 | 105.2 | ||||
| 55 | N | 33.2 | Very low | 38.5 | Very low | 161 Ų | 161 | 137.3 Ų | 137.3 | 86% | 0.861 | 79% | 0.788 | S | S | * | * | 175.5 | 116.6 | 123 | -99.3 | 7.6 | 0 | 0 | 0 | 112.5 | |||||
| 56 | G | 31.9 | Very low | 38.8 | Very low | 80 Ų | 80 | 132.2 Ų | 132.2 | 83% | 0.825 | 78% | 0.783 | S | S | * | * | trans | 99.6 | 66.9 | 139.4 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 57 | I | 41 | Very low | 39 | Very low | 157 Ų | 157 | 137.1 Ų | 137.1 | 81% | 0.805 | 79% | 0.792 | S | S | * | * | trans | -81.4 | 169.6 | 152.9 | 59.7 | 168.4 | 0 | 0 | 0 | 109.2 | ||||
| 58 | P | 43.8 | Very low | 39.3 | Very low | 124 Ų | 124 | 138 Ų | 138 | 81% | 0.805 | 80% | 0.795 | S | S | * | * | -121.2 | 137.9 | 59.7 | 6.4 | 16.8 | 0 | 0 | 0 | 113.6 | |||||
| 59 | A | 42.1 | Very low | 39.2 | Very low | 80 Ų | 80 | 137.8 Ų | 137.8 | 66% | 0.661 | 79% | 0.793 | S | S | * | * | trans | -84.6 | 149.4 | 146.6 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 60 | E | 31.1 | Very low | 40.1 | Very low | 197 Ų | 197 | 135.7 Ų | 135.7 | 92% | 0.921 | 79% | 0.794 | S | S | * | * | trans | -136 | 126.2 | 152.1 | -127.5 | 174.4 | 156.7 | 0 | 0 | 111.1 | ||||
| 61 | Y | 39.5 | Very low | 39.8 | Very low | 220 Ų | 220 | 136.8 Ų | 136.8 | 86% | 0.863 | 80% | 0.801 | S | S | * | * | trans | -75.7 | 148.6 | -179.7 | -119.6 | -105 | 0 | 0 | 0 | 110.2 | ||||
| 62 | T | 31.7 | Very low | 39.2 | Very low | 129 Ų | 129 | 140.9 Ų | 140.9 | 79% | 0.791 | 80% | 0.8 | S | S | * | * | trans | 170.9 | 125.3 | 132.6 | -77.6 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 63 | A | 45 | Very low | 38.1 | Very low | 92 Ų | 92 | 142.1 Ų | 142.1 | 76% | 0.76 | 81% | 0.806 | S | S | * | * | trans | -80.2 | 140.1 | 159.9 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 64 | P | 41.6 | Very low | 37.4 | Very low | 116 Ų | 116 | 140.1 Ų | 140.1 | 75% | 0.753 | 81% | 0.806 | S | S | * | * | -149.7 | 168.3 | 83.8 | 33.4 | -12.1 | 0 | 0 | 0 | 115.2 | |||||
| 65 | H | 40.4 | Very low | 37.2 | Very low | 184 Ų | 184 | 139.2 Ų | 139.2 | 85% | 0.852 | 80% | 0.802 | S | S | * | * | trans | -50.6 | 144.1 | 170.3 | -66.2 | -67.3 | 0 | 0 | 0 | 112.9 | ||||
| 66 | P | 38.8 | Very low | 37.1 | Very low | 118 Ų | 118 | 137 Ų | 137 | 77% | 0.766 | 80% | 0.795 | S | S | * | * | -152.1 | 161.9 | 87.6 | 36.5 | -16.1 | 0 | 0 | 0 | 116.3 | |||||
| 67 | H | 36.1 | Very low | 37.3 | Very low | 182 Ų | 182 | 139 Ų | 139 | 84% | 0.843 | 79% | 0.791 | S | S | * | * | trans | -68.2 | 150.3 | 158.7 | -68.1 | -81.3 | 0 | 0 | 0 | 109.7 | ||||
| 68 | P | 41.2 | Very low | 37.2 | Very low | 130 Ų | 130 | 137.4 Ų | 137.4 | 84% | 0.844 | 79% | 0.788 | S | S | * | * | -144.9 | -176.5 | 59.3 | 33.9 | -9.8 | 0 | 0 | 0 | 116.4 | |||||
| 69 | A | 32.6 | Very low | 37.2 | Very low | 91 Ų | 91 | 136.6 Ų | 136.6 | 75% | 0.752 | 78% | 0.783 | S | S | * | * | trans | -71 | -159.1 | -172.4 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 70 | P | 49.6 | Very low | 36.6 | Very low | 117 Ų | 117 | 140.2 Ų | 140.2 | 76% | 0.76 | 79% | 0.786 | S | S | * | * | cis | -124.2 | 167.3 | -42.7 | 29.2 | -11.5 | 0 | 0 | 0 | 111.9 | ||||
| 71 | E | 28.2 | Very low | 36.6 | Very low | 207 Ų | 207 | 140 Ų | 140 | 97% | 0.967 | 79% | 0.785 | S | S | * | * | trans | -152.9 | 140.2 | 143.5 | -115 | 167.2 | -156.2 | 0 | 0 | 111.9 | ||||
| 72 | Y | 30.3 | Very low | 36.2 | Very low | 167 Ų | 167 | 134.6 Ų | 134.6 | 66% | 0.655 | 78% | 0.775 | S | S | * | * | trans | -104 | 141.7 | -154.9 | -172.2 | -93.4 | 0 | 0 | 0 | 109.5 | Q75 | Y72-Q75 WeakPolarHBondContact OH-CG 3.4Š| ||
| 73 | T | 34.3 | Very low | 36.5 | Very low | 145 Ų | 145 | 136.6 Ų | 136.6 | 89% | 0.89 | 78% | 0.78 | S | S | * | * | trans | -176.3 | 120.4 | 134.1 | 23.4 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 74 | G | 35 | Very low | 36.1 | Very low | 73 Ų | 73 | 139.3 Ų | 139.3 | 75% | 0.753 | 78% | 0.782 | S | S | * | * | trans | 131 | 74.8 | 164.7 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 75 | Q | 33.1 | Very low | 35.5 | Very low | 154 Ų | 154 | 140.9 Ų | 140.9 | 72% | 0.72 | 78% | 0.783 | S | S | * | * | trans | -56.3 | 154.8 | 160 | -67 | 161.8 | -60.3 | 0 | 0 | 110.3 | Y72 | Y72-Q75 WeakPolarHBondContact OH-CG 3.4Š| ||
| 76 | T | 31.7 | Very low | 35.2 | Very low | 114 Ų | 114 | 142 Ų | 142 | 70% | 0.699 | 78% | 0.781 | S | S | * | * | cis | -160.9 | 127.1 | 26.1 | -138.4 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 77 | T | 35.4 | Very low | 35.6 | Very low | 122 Ų | 122 | 141.8 Ų | 141.8 | 75% | 0.748 | 78% | 0.78 | S | S | * | * | trans | 42 | 110.8 | 134.5 | 59.6 | 0 | 0 | 0 | 0 | 123.9 | ||||
| 78 | V | 39.2 | Very low | 35.8 | Very low | 124 Ų | 124 | 139.1 Ų | 139.1 | 75% | 0.752 | 78% | 0.779 | S | S | * | * | trans | -52.7 | 172.7 | 141.1 | -133.7 | 0 | 0 | 0 | 0 | 112 | ||||
| 79 | P | 44.1 | Very low | 35.5 | Very low | 107 Ų | 107 | 137.4 Ų | 137.4 | 70% | 0.695 | 78% | 0.775 | S | S | * | * | -144.3 | 153.9 | 52.7 | 18.9 | 9.9 | 0 | 0 | 0 | 115.2 | |||||
| 80 | E | 29.1 | Very low | 35.4 | Very low | 155 Ų | 155 | 141.7 Ų | 141.7 | 72% | 0.724 | 78% | 0.78 | S | S | * | * | 72 | 110.1 | 73.5 | -150.9 | 167.4 | 148.6 | 0 | 0 | 114.3 | |||||
| 81 | H | 31.5 | Very low | 34.3 | Very low | 193 Ų | 193 | 141.7 Ų | 141.7 | 89% | 0.894 | 78% | 0.778 | S | S | * | * | trans | -107.8 | 112.4 | 172.2 | -60.5 | -70.3 | 0 | 0 | 0 | 109.8 | ||||
| 82 | T | 32.3 | Very low | 34.4 | Very low | 107 Ų | 107 | 140.3 Ų | 140.3 | 66% | 0.656 | 77% | 0.771 | S | S | * | * | trans | -127.5 | 130.1 | 164 | 53.2 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 83 | L | 36.3 | Very low | 34.6 | Very low | 171 Ų | 171 | 136 Ų | 136 | 90% | 0.895 | 77% | 0.765 | S | S | * | * | trans | 71 | 112.3 | 146 | -81.8 | 146.8 | 0 | 0 | 0 | 121.1 | ||||
| 84 | N | 37.3 | Very low | 34.3 | Very low | 149 Ų | 149 | 136.1 Ų | 136.1 | 80% | 0.797 | 76% | 0.756 | S | S | * | * | trans | -47.3 | 137.9 | 151.8 | -80.6 | -25.7 | 0 | 0 | 0 | 113.2 | ||||
| 85 | L | 30.1 | Very low | 34.2 | Very low | 148 Ų | 148 | 140.3 Ų | 140.3 | 78% | 0.775 | 76% | 0.756 | S | S | * | * | -167.7 | 126 | 129.6 | -128.3 | 67.5 | 0 | 0 | 0 | 113.5 | |||||
| 86 | Y | 33.4 | Very low | 34.3 | Very low | 207 Ų | 207 | 138.3 Ų | 138.3 | 81% | 0.812 | 76% | 0.759 | S | S | * | * | trans | 77.6 | 127.1 | 162.5 | -73.6 | -78.6 | 0 | 0 | 0 | 122.4 | ||||
| 87 | P | 46.8 | Very low | 34.7 | Very low | 114 Ų | 114 | 138.7 Ų | 138.7 | 74% | 0.74 | 76% | 0.763 | S | S | * | * | trans | -101 | 164.6 | 159.7 | 38.4 | -28.7 | 0 | 0 | 0 | 111.9 | ||||
| 88 | P | 41 | Very low | 34.7 | Very low | 127 Ų | 127 | 137 Ų | 137 | 83% | 0.825 | 76% | 0.761 | S | S | * | * | trans | -119.8 | 143 | 144 | 33.1 | -21.8 | 0 | 0 | 0 | 111.6 | ||||
| 89 | A | 33.9 | Very low | 34.2 | Very low | 94 Ų | 94 | 137.9 Ų | 137.9 | 78% | 0.777 | 76% | 0.762 | S | S | * | * | trans | -64.5 | 153.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 90 | Q | 31.4 | Very low | 33.7 | Very low | 180 Ų | 180 | 138.2 Ų | 138.2 | 84% | 0.841 | 76% | 0.762 | S | S | * | * | trans | -168.5 | 120.5 | 139.4 | -107.7 | 168.5 | 29.8 | 0 | 0 | 113 | ||||
| 91 | T | 25.5 | Very low | 33.8 | Very low | 117 Ų | 117 | 136.1 Ų | 136.1 | 72% | 0.718 | 77% | 0.765 | S | S | * | * | trans | 48.1 | 127.3 | 134.8 | 55.7 | 0 | 0 | 0 | 0 | 121 | ||||
| 92 | H | 30.9 | Very low | 33.8 | Very low | 178 Ų | 178 | 131.3 Ų | 131.3 | 82% | 0.824 | 76% | 0.759 | S | S | * | * | 176.3 | 166.3 | 88.4 | -136.3 | -91.8 | 0 | 0 | 0 | 112.4 | |||||
| 93 | S | 33.9 | Very low | 33.8 | Very low | 77 Ų | 77 | 135 Ų | 135 | 54% | 0.538 | 77% | 0.768 | S | S | . | * | trans | -78.5 | 168.2 | -157.3 | -39.7 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 94 | E | 29 | Very low | 33.6 | Very low | 147 Ų | 147 | 133.9 Ų | 133.9 | 69% | 0.687 | 77% | 0.769 | S | S | * | * | trans | 84.2 | 124.5 | 134.1 | -89.5 | 166.5 | 92.3 | 0 | 0 | 122.9 | ||||
| 95 | Q | 32.7 | Very low | 33.4 | Very low | 161 Ų | 161 | 132.5 Ų | 132.5 | 75% | 0.752 | 77% | 0.766 | S | S | * | * | trans | 88.6 | 102.2 | 130.7 | -80 | 162.1 | 7.3 | 0 | 0 | 121 | ||||
| 96 | S | 34.3 | Very low | 33.5 | Very low | 112 Ų | 112 | 131.5 Ų | 131.5 | 78% | 0.783 | 77% | 0.771 | S | S | * | * | trans | -55.5 | 167.1 | 144.8 | -34.8 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 97 | P | 41.3 | Very low | 33.5 | Very low | 123 Ų | 123 | 124.8 Ų | 124.8 | 80% | 0.799 | 76% | 0.764 | S | S | * | * | -155.9 | 175.6 | 75.1 | 37.7 | -15.5 | 0 | 0 | 0 | 118.3 | |||||
| 98 | A | 34.6 | Very low | 32.9 | Very low | 85 Ų | 85 | 126 Ų | 126 | 70% | 0.702 | 77% | 0.77 | S | S | * | * | trans | 78.3 | 134.4 | 153.5 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 99 | D | 28.9 | Very low | 32.7 | Very low | 143 Ų | 143 | 124.1 Ų | 124.1 | 77% | 0.765 | 77% | 0.765 | S | S | * | * | cis | -165.5 | 145.4 | 7.8 | -122.9 | -37.3 | 0 | 0 | 0 | 113.3 | ||||
| 100 | T | 33.3 | Very low | 32.8 | Very low | 115 Ų | 115 | 126.4 Ų | 126.4 | 71% | 0.706 | 77% | 0.77 | S | S | * | * | trans | 57.1 | 119 | 137.2 | -62.8 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 101 | S | 30.5 | Very low | 33.1 | Very low | 110 Ų | 110 | 125.8 Ų | 125.8 | 77% | 0.769 | 77% | 0.767 | S | S | * | * | -178.9 | 129.7 | 65.6 | 18.3 | 0 | 0 | 0 | 0 | 108.1 | |||||
| 102 | A | 33.3 | Very low | 33.6 | Very low | 93 Ų | 93 | 125.8 Ų | 125.8 | 77% | 0.769 | 77% | 0.767 | S | S | * | * | 115.4 | 102.3 | 68.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 103 | Q | 32.1 | Very low | 33.9 | Very low | 183 Ų | 183 | 124.2 Ų | 124.2 | 86% | 0.855 | 76% | 0.764 | S | S | * | * | trans | 32.1 | 131.7 | 140.7 | -65.5 | 175.2 | -22.6 | 0 | 0 | 122.3 | ||||
| 104 | T | 31.3 | Very low | 34 | Very low | 148 Ų | 148 | 127.7 Ų | 127.7 | 91% | 0.908 | 78% | 0.777 | S | S | * | * | -153 | 136.6 | 116.8 | -28.1 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 105 | V | 34.2 | Very low | 34.4 | Very low | 121 Ų | 121 | 124.6 Ų | 124.6 | 73% | 0.733 | 78% | 0.777 | S | S | * | * | trans | -91.8 | 143.1 | 178.3 | 170.3 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 106 | S | 32.3 | Very low | 34.8 | Very low | 126 Ų | 126 | 121.4 Ų | 121.4 | 88% | 0.881 | 78% | 0.778 | S | S | * | * | trans | -164.6 | 112.9 | 142.3 | -96 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 107 | G | 33.3 | Very low | 35.4 | Very low | 66 Ų | 66 | 122.1 Ų | 122.1 | 68% | 0.68 | 78% | 0.78 | S | S | * | * | trans | -86.7 | 163 | 168.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 108 | T | 34.3 | Very low | 35.7 | Very low | 141 Ų | 141 | 122.6 Ų | 122.6 | 87% | 0.865 | 78% | 0.78 | S | S | * | * | trans | -145.6 | 112 | 143.2 | -37.1 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 109 | A | 36.4 | Very low | 35.9 | Very low | 87 Ų | 87 | 126.4 Ų | 126.4 | 72% | 0.719 | 79% | 0.789 | S | S | * | * | trans | -87.2 | 142.3 | 165.8 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 110 | T | 34.7 | Very low | 36.4 | Very low | 141 Ų | 141 | 122.6 Ų | 122.6 | 87% | 0.865 | 78% | 0.783 | S | S | * | * | trans | -151.2 | 123.8 | 137.7 | -14.4 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 111 | Q | 38.5 | Very low | 36.4 | Very low | 168 Ų | 168 | 124.3 Ų | 124.3 | 79% | 0.785 | 78% | 0.783 | S | S | * | * | trans | -62.2 | 161.7 | 169.1 | -60.4 | 161.9 | 5.3 | 0 | 0 | 109 | ||||
| 112 | T | 35 | Very low | 37 | Very low | 116 Ų | 116 | 124.4 Ų | 124.4 | 71% | 0.712 | 78% | 0.781 | S | S | * | * | -177 | 150.2 | 61.6 | 41.7 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 113 | D | 38 | Very low | 37.3 | Very low | 145 Ų | 145 | 126.9 Ų | 126.9 | 78% | 0.775 | 78% | 0.777 | S | S | * | * | trans | 60.9 | 119.3 | 142.2 | -86.6 | -81 | 0 | 0 | 0 | 124.6 | ||||
| 114 | D | 36.8 | Very low | 37.9 | Very low | 150 Ų | 150 | 124 Ų | 124 | 80% | 0.802 | 77% | 0.772 | S | S | * | * | 84.5 | 141.2 | 124.4 | -142.5 | -104.1 | 0 | 0 | 0 | 122.2 | |||||
| 115 | A | 36.5 | Very low | 38.2 | Very low | 83 Ų | 83 | 123.6 Ų | 123.6 | 69% | 0.686 | 76% | 0.76 | S | S | * | * | trans | 85.7 | 108.4 | 164 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 116 | A | 41.9 | Very low | 38.8 | Very low | 93 Ų | 93 | 123.3 Ų | 123.3 | 77% | 0.769 | 76% | 0.761 | S | S | * | * | trans | -61.6 | 159 | 154.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 117 | P | 46.4 | Very low | 39.3 | Very low | 128 Ų | 128 | 121.5 Ų | 121.5 | 83% | 0.831 | 75% | 0.748 | S | S | * | * | -143.7 | 149.7 | 102.2 | 34 | -17.4 | 0 | 0 | 0 | 116 | |||||
| 118 | T | 47.4 | Very low | 40 | Very low | 132 Ų | 132 | 127 Ų | 127 | 81% | 0.81 | 76% | 0.756 | S | S | * | * | trans | -41.7 | 136.2 | 162.1 | -55.2 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 119 | D | 39.1 | Very low | 40.3 | Very low | 166 Ų | 166 | 126.8 Ų | 126.8 | 89% | 0.888 | 75% | 0.749 | S | S | * | * | trans | -163.9 | 143.5 | 137.4 | -128.6 | -40.8 | 0 | 0 | 0 | 113.7 | ||||
| 120 | G | 38.5 | Very low | 41.1 | Very low | 62 Ų | 62 | 128 Ų | 128 | 64% | 0.639 | 75% | 0.748 | S | S | * | * | trans | 102.5 | 64.1 | 157.3 | 0 | 0 | 0 | 0 | 0 | 120.5 | P122 | G120-P122 WeakPolarHBondContact O-CD 3.46Š| ||
| 121 | Q | 34.8 | Very low | 41.7 | Very low | 151 Ų | 151 | 129.3 Ų | 129.3 | 71% | 0.706 | 74% | 0.744 | S | S | * | * | trans | -69.3 | 133.9 | 156.6 | -89 | -180 | -54.1 | 0 | 0 | 111.4 | Q123 | Q121-Q123 VanDerWaalsContact NE2-CG 3.31Š| ||
| 122 | P | 42.6 | Very low | 42.2 | Very low | 112 Ų | 112 | 128 Ų | 128 | 73% | 0.727 | 74% | 0.743 | S | S | * | * | trans | -96.5 | 106.5 | 133.4 | 27.4 | -25.7 | 0 | 0 | 0 | 108.4 | G120 T124 | G120-P122 WeakPolarHBondContact O-CD 3.46Å; P122-T124 PolarHBondContact O-N 3.09Å | ||
| 123 | Q | 39.2 | Very low | 43.3 | Very low | 145 Ų | 145 | 131.3 Ų | 131.3 | 68% | 0.678 | 75% | 0.747 | S | S | * | * | trans | -68.2 | 85.8 | 167.1 | -85.7 | -179.5 | -43.7 | 0 | 0 | 109.6 | Q121 | Q121-Q123 VanDerWaalsContact NE2-CG 3.31Š| ||
| 124 | T | 43.9 | Very low | 45 | Very low | 124 Ų | 124 | 126.7 Ų | 126.7 | 76% | 0.761 | 73% | 0.726 | S | S | * | * | trans | -108.1 | 90.4 | 151.1 | 26.6 | 0 | 0 | 0 | 0 | 106.4 | P122 P126 | P122-T124 PolarHBondContact O-N 3.09Å; T124-P126 WeakPolarHBondContact O-CD 3.19Å | ||
| 125 | Q | 38.1 | Very low | 47.4 | Very low | 139 Ų | 139 | 126.5 Ų | 126.5 | 65% | 0.65 | 72% | 0.721 | S | S | * | * | trans | -101.5 | 106.7 | 166.5 | -71.2 | -172.7 | 1.3 | 0 | 0 | 108.1 | S127 | Q125-S127 VanDerWaalsContact C-N 3.3Å; Q125-S127 PolarHBondContact O-N 3.37Å; Q125-S127 PolarHBondContact OE1-OG 3.42Å | ||
| 126 | P | 47.6 | Very low | 50 | Low | 115 Ų | 115 | 126.4 Ų | 126.4 | 75% | 0.747 | 71% | 0.713 | S | S | * | * | trans | -78.5 | 91.2 | 146.6 | 30.9 | -22.8 | 0 | 0 | 0 | 106.1 | T124 E128 | T124-P126 WeakPolarHBondContact O-CD 3.19Å; P126-E128 VanDerWaalsContact C-N 3.29Å; P126-E128 PolarHBondContact O-N 3.42Å | ||
| 127 | S | 42.1 | Very low | 52.6 | Low | 87 Ų | 87 | 124 Ų | 124 | 61% | 0.608 | 69% | 0.686 | S | S | * | * | trans | -73.9 | 89.5 | 171.5 | -52 | 0 | 0 | 0 | 0 | 108.2 | Q125 N129 | Q125-S127 VanDerWaalsContact C-N 3.3Å; Q125-S127 PolarHBondContact O-N 3.37Å; Q125-S127 PolarHBondContact OE1-OG 3.42Å; S127-N129 VanDerWaalsContact C-N 3.33Å; S127-N129 PolarHBondContact O-N 2.95Å | ||
| 128 | E | 48.9 | Very low | 54.9 | Low | 182 Ų | 182 | 119.7 Ų | 119.7 | 85% | 0.85 | 65% | 0.653 | S | S | * | * | trans | -63.9 | 95.6 | 159.2 | -86.6 | 179 | 107 | 0 | 0 | 108 | P126 | P126-E128 VanDerWaalsContact C-N 3.29Å; P126-E128 PolarHBondContact O-N 3.42Å | ||
| 129 | N | 39.6 | Very low | 57.3 | Low | 136 Ų | 136 | 113.4 Ų | 113.4 | 73% | 0.727 | 61% | 0.614 | S | S | * | * | trans | -105.1 | 97.5 | 166.4 | -169.8 | 1.3 | 0 | 0 | 0 | 108.7 | S127 E131 | S127-N129 VanDerWaalsContact C-N 3.33Å; S127-N129 PolarHBondContact O-N 2.95Å; N129-E131 PolarHBondContact O-N 3.27Å | ||
| 130 | T | 53.2 | Low | 60.1 | Low | 113 Ų | 113 | 107.5 Ų | 107.5 | 69% | 0.693 | 58% | 0.581 | S | S | * | * | trans | -75.9 | 59.2 | -179.2 | -54.5 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 131 | E | 47.6 | Very low | 62.9 | Low | 168 Ų | 168 | 104.6 Ų | 104.6 | 79% | 0.785 | 55% | 0.551 | S | S | * | * | S | Bend | trans | -131.3 | 88.6 | 158.1 | -156.9 | 174 | 156.5 | 0 | 0 | 107.5 | N129 K133 | N129-E131 PolarHBondContact O-N 3.27Å; E131-K133 PolarHBondContact O-N 3.32Å |
| 132 | N | 49.7 | Very low | 65.8 | Low | 142 Ų | 142 | 98.5 Ų | 98.5 | 76% | 0.759 | 53% | 0.525 | S | S | * | . | trans | -70.7 | 56 | -159.5 | -58.5 | -34.6 | 0 | 0 | 0 | 114.4 | S134 | N132-S134 PolarHBondContact O-N 3.1Å; N132-S134 VanDerWaalsContact O-N 3.11Å | ||
| 133 | K | 58.6 | Low | 68.4 | Low | 184 Ų | 184 | 96.8 Ų | 96.8 | 80% | 0.8 | 51% | 0.51 | S | S | * | . | trans | -80 | 80.7 | 153.1 | -77.2 | -169.9 | 167.1 | -176.4 | 0 | 107.5 | E131 Q135 | E131-K133 PolarHBondContact O-N 3.32Å; K133-Q135 VanDerWaalsContact O-CG 3.3Å; K133-Q135 WeakPolarHBondContact O-CG 3.37Å; K133-Q135 PolarHBondContact O-N 2.82Å | ||
| 134 | S | 73.1 | Confident | 71.2 | Confident | 48 Ų | 48 | 90 Ų | 90 | 34% | 0.336 | 48% | 0.478 | S | S | . | . | trans | -34 | 99.4 | 159.8 | 165.7 | 0 | 0 | 0 | 0 | 109.5 | N132 E184 N185 | N132-S134 PolarHBondContact O-N 3.1Å; N132-S134 VanDerWaalsContact O-N 3.11Å; S134-E184 PolarHBondContact OG-O 2.65Å; S134-N185 WeakPolarHBondContact CB-OD1 2.98Å; S134-N185 WeakPolarHBondContact OG-CA 3.45Å; S134-N185 WeakPolarHBondContact OG-CB 3.33Å; S134-N185 VanDerWaalsContact OG-CG 3.24Å; S134-N185 PolarHBondContact OG-N 2.96Å; S134-N185 PolarHBondContact OG-OD1 2.86Å | ||
| 135 | Q | 86.8 | Confident | 73.7 | Confident | 146 Ų | 146 | 84.4 Ų | 84.4 | 68% | 0.682 | 44% | 0.444 | S | S | * | . | trans | -80.3 | 133.9 | -178.6 | -65.5 | -145.5 | 0.5 | 0 | 0 | 108.6 | K133 K137 E184 S186 | K133-Q135 VanDerWaalsContact O-CG 3.3Å; K133-Q135 WeakPolarHBondContact O-CG 3.37Å; K133-Q135 PolarHBondContact O-N 2.82Å; Q135-K137 PolarHBondContact O-N 3.18Å; Q135-E184 CarbonylContact C-O 3.6Å; Q135-S186 PolarHBondContact O-N 3.03Å | ||
| 136 | P | 91.9 | Very high | 76.4 | Confident | 82 Ų | 82 | 83.1 Ų | 83.1 | 53% | 0.532 | 44% | 0.436 | S | S | . | . | trans | -64.2 | 132 | 179.9 | 26.2 | -33.8 | 0 | 0 | 0 | 110 | L164 T182 F183 E184 | P136-L164 HydrophobicContact CB-CD1 3.65Å; P136-T182 HydrophobicContact CB-CG2 4.21Å; P136-F183 CarbonylContact C-O 3.56Å; P136-F183 WeakPolarHBondContact CA-O 3.33Å; P136-F183 VanDerWaalsContact CB-O 3.31Å; P136-F183 WeakPolarHBondContact CB-O 3.09Å; P136-E184 WeakPolarHBondContact CA-O 2.93Å | ||
| 137 | K | 94.9 | Very high | 78.7 | Confident | 43 Ų | 43 | 87.6 Ų | 87.6 | 19% | 0.187 | 44% | 0.438 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.5 | 130.6 | -177.7 | -177.5 | 161.5 | 171.3 | 174.3 | 0 | 110.2 | Q135 T182 F183 A189 D190 | Q135-K137 PolarHBondContact O-N 3.18Å; K137-T182 WeakPolarHBondContact O-CA 3.42Å; K137-F183 PolarHBondContact N-O 2.9Å; K137-F183 VanDerWaalsContact N-O 3.08Å; K137-F183 PolarHBondContact O-N 3.32Å; K137-A189 HydrophobicContact CB-CB 3.84Å; K137-A189 HydrophobicContact CD-CB 3.94Å; K137-A189 HydrophobicContact CG-CB 3.84Å; K137-D190 IonicContact NZ-OD1 3.83Å; K137-D190 PolarHBondContact NZ-OD1 3.35Å; K137-D190 IonicContact NZ-OD2 3.19Å; K137-D190 PolarHBondContact NZ-OD2 3.33Å |
| 138 | R | 95.6 | Very high | 81.3 | Confident | 37 Ų | 37 | 84.4 Ų | 84.4 | 14% | 0.14 | 41% | 0.413 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.8 | 129.3 | 179.9 | -166.5 | 170.9 | 177.2 | -118.6 | 6 | 110.2 | E167 F180 V181 T182 A211 T212 | R138-E167 IonicContact CZ-OE2 3.86Å; R138-E167 IonicContact NH2-OE2 2.67Å; R138-E167 PolarHBondContact NH2-OE2 3.22Å; R138-F180 HydrophobicContact CG-CB 4.22Å; R138-V181 CarbonylContact C-O 3.58Å; R138-V181 WeakPolarHBondContact CA-O 3.47Å; R138-T182 HydrophobicContact CB-CG2 4.47Å; R138-A211 HydrophobicContact CB-CB 4Å; R138-A211 HydrophobicContact CG-CB 3.74Å; R138-A211 WeakPolarHBondContact O-CB 3.17Å; R138-A211 PolarHBondContact O-N 2.75Å; R138-T212 PolarHBondContact NH1-O 2.98Å |
| 139 | L | 97.1 | Very high | 83.6 | Confident | 0 Ų | 0 | 80.3 Ų | 80.3 | 0% | 0 | 39% | 0.39 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.9 | 146.2 | 174.1 | -58.6 | -179.1 | 0 | 0 | 0 | 109.6 | F157 F180 V181 F183 A189 A192 R193 V208 N209 | L139-F157 HydrophobicContact CD1-CE1 4.31Å; L139-F180 CarbonylContact O-C 3.57Å; L139-F180 WeakPolarHBondContact O-CA 3.12Å; L139-V181 PolarHBondContact N-O 3.13Å; L139-V181 PolarHBondContact O-N 2.78Å; L139-F183 HydrophobicContact CD1-CD2 4.11Å; L139-F183 HydrophobicContact CD1-CE2 3.78Å; L139-F183 HydrophobicContact CG-CD2 4.47Å; L139-A189 HydrophobicContact CD1-CB 4.04Å; L139-A189 WeakPolarHBondContact CD1-O 3.35Å; L139-A189 HydrophobicContact CD2-CB 4.12Å; L139-A189 HydrophobicContact CG-CB 4.05Å; L139-A192 HydrophobicContact CD1-CB 4.43Å; L139-R193 HydrophobicContact CD1-CB 4.37Å; L139-R193 HydrophobicContact CD2-CB 4.45Å; L139-V208 HydrophobicContact CB-CG1 4.11Å; L139-V208 HydrophobicContact CD1-CG1 3.88Å; L139-V208 HydrophobicContact CG-CG1 4.45Å; L139-N209 CarbonylContact C-O 3.52Å; L139-N209 WeakPolarHBondContact CA-O 3.39Å |
| 140 | H | 97.7 | Very high | 86.2 | Confident | 42 Ų | 42 | 76.8 Ų | 76.8 | 19% | 0.194 | 37% | 0.371 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.1 | 125.1 | 170.2 | 171.9 | -125.3 | 0 | 0 | 0 | 108.2 | S142 F178 F180 V208 N209 A211 | H140-S142 PolarHBondContact CE1-OG 2.81Å; H140-S142 PolarHBondContact NE2-OG 2.71Å; H140-S142 VanDerWaalsContact NE2-OG 3.08Å; H140-F178 AromaticContact CD2-CD2 3.94Å; H140-F178 AromaticContact NE2-CD2 3.52Å; H140-F178 AromaticContact NE2-CG 3.88Å; H140-F180 HydrophobicContact CB-CD1 4.03Å; H140-F180 HydrophobicContact CB-CE1 3.93Å; H140-F180 AromaticContact CD2-CE1 3.57Å; H140-F180 AromaticContact CD2-CZ 3.96Å; H140-V208 CarbonylContact O-C 3.48Å; H140-V208 WeakPolarHBondContact O-CA 3.39Å; H140-N209 PolarHBondContact N-O 3.34Å; H140-N209 PolarHBondContact O-N 3.19Å; H140-A211 HydrophobicContact CB-CB 4.09Å |
| 141 | V | 97.5 | Very high | 88.3 | Confident | 0 Ų | 0 | 75 Ų | 75 | 0% | 0 | 36% | 0.362 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.9 | 114.6 | -177.7 | -169.7 | 0 | 0 | 0 | 0 | 108 | I144 L153 F157 F178 G179 V181 E207 V208 | V141-I144 HydrophobicContact CG1-CG2 3.6Å; V141-L153 HydrophobicContact CG1-CD2 4.42Å; V141-F157 HydrophobicContact CB-CE2 4.43Å; V141-F157 HydrophobicContact CB-CZ 4.26Å; V141-F157 HydrophobicContact CG1-CE2 3.94Å; V141-F157 HydrophobicContact CG1-CZ 3.84Å; V141-F157 HydrophobicContact CG2-CE1 4.12Å; V141-F157 HydrophobicContact CG2-CE2 3.69Å; V141-F157 HydrophobicContact CG2-CZ 3.34Å; V141-F178 CarbonylContact O-C 3.36Å; V141-F178 WeakPolarHBondContact O-CA 3.32Å; V141-F178 WeakPolarHBondContact O-CB 3.44Å; V141-G179 PolarHBondContact N-O 3.43Å; V141-G179 PolarHBondContact O-N 2.95Å; V141-V181 HydrophobicContact CG2-CG2 4.08Å; V141-E207 CarbonylContact C-O 3.53Å; V141-E207 WeakPolarHBondContact CA-O 3.34Å; V141-V208 HydrophobicContact CG1-CG2 4.37Å; V141-V208 HydrophobicContact CG2-CG1 4.47Å |
| 142 | S | 97.2 | Very high | 90.6 | Very high | 23 Ų | 23 | 69.8 Ų | 69.8 | 16% | 0.161 | 34% | 0.339 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.6 | 162.3 | -175.4 | -88.1 | 0 | 0 | 0 | 0 | 112.9 | H140 I144 I206 E207 | H140-S142 PolarHBondContact CE1-OG 2.81Å; H140-S142 PolarHBondContact NE2-OG 2.71Å; H140-S142 VanDerWaalsContact NE2-OG 3.08Å; S142-I144 PolarHBondContact O-N 2.8Å; S142-I206 WeakPolarHBondContact O-CA 3.44Å; S142-E207 PolarHBondContact N-O 2.79Å; S142-E207 PolarHBondContact O-N 3.25Å |
| 143 | N | 97.3 | Very high | 92.9 | Very high | 77 Ų | 77 | 63 Ų | 63 | 41% | 0.412 | 30% | 0.303 | S | S | . | . | S | Bend | trans | 58.6 | 31.7 | -179.8 | -160.8 | 31 | 0 | 0 | 0 | 114.1 | G177 K205 | N143-G177 PolarHBondContact N-O 2.89Å; N143-K205 WeakPolarHBondContact CB-O 3.22Å; N143-K205 PolarHBondContact ND2-O 3.49Å |
| 144 | I | 97.1 | Very high | 94.7 | Very high | 2 Ų | 2 | 58.6 Ų | 58.6 | 1% | 0.01 | 28% | 0.281 | C | S | . | . | trans | -79 | 153.4 | 174.6 | 59.3 | 172.7 | 0 | 0 | 0 | 110.9 | V141 S142 F148 L153 G177 R204 I206 | V141-I144 HydrophobicContact CG1-CG2 3.6Å; S142-I144 PolarHBondContact O-N 2.8Å; I144-F148 HydrophobicContact CB-CD1 4.23Å; I144-F148 HydrophobicContact CB-CG 4.42Å; I144-F148 HydrophobicContact CD1-CB 4.03Å; I144-F148 HydrophobicContact CD1-CD1 4.49Å; I144-L153 HydrophobicContact CD1-CD1 4.28Å; I144-L153 HydrophobicContact CD1-CD2 4.26Å; I144-L153 HydrophobicContact CG2-CD2 4.49Å; I144-G177 VanDerWaalsContact CG1-C 3.47Å; I144-G177 WeakPolarHBondContact CG1-O 3.37Å; I144-G177 PolarHBondContact N-O 2.81Å; I144-R204 PolarHBondContact O-NH1 3.26Å; I144-I206 HydrophobicContact CG2-CB 4.49Å; I144-I206 HydrophobicContact CG2-CG2 3.95Å | ||
| 145 | P | 95.7 | Very high | 95.7 | Very high | 7 Ų | 7 | 64 Ų | 64 | 5% | 0.045 | 30% | 0.301 | C | S | . | . | trans | -57.2 | 145 | 175 | -24.4 | 34.5 | 0 | 0 | 0 | 112.6 | R147 F148 E202 | P145-R147 PolarHBondContact O-N 3.2Å; P145-R147 VanDerWaalsContact O-N 3.09Å; P145-F148 HydrophobicContact CB-CD2 3.72Å; P145-F148 HydrophobicContact CB-CE2 4.11Å; P145-F148 HydrophobicContact CG-CD2 3.74Å; P145-F148 HydrophobicContact CG-CE2 3.67Å; P145-F148 HydrophobicContact CG-CZ 4.42Å; P145-F148 WeakPolarHBondContact O-CB 3.43Å; P145-F148 PolarHBondContact O-N 2.83Å; P145-E202 HydrophobicContact CB-CB 4.49Å; P145-E202 WeakPolarHBondContact CB-OE2 3.29Å; P145-E202 HydrophobicContact CG-CB 3.77Å; P145-E202 HydrophobicContact CG-CG 4.01Å; P145-E202 WeakPolarHBondContact CG-OE2 3.3Å | ||
| 146 | F | 96.4 | Very high | 96.1 | Very high | 111 Ų | 111 | 58.3 Ų | 58.3 | 49% | 0.487 | 28% | 0.275 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.9 | -13.6 | -176.9 | -60 | -48.9 | 0 | 0 | 0 | 114 | R149 S175 | F146-R149 PolarHBondContact O-NH1 3.08Å; F146-S175 VanDerWaalsContact C-OG 3.29Å; F146-S175 WeakPolarHBondContact CA-OG 3.48Å; F146-S175 VanDerWaalsContact CB-OG 3.29Å; F146-S175 WeakPolarHBondContact CB-OG 3.5Å; F146-S175 VanDerWaalsContact CD1-O 3.3Å; F146-S175 WeakPolarHBondContact CD1-O 3.44Å; F146-S175 PolarHBondContact O-OG 3.46Å |
| 147 | R | 95.6 | Very high | 96.3 | Very high | 210 Ų | 210 | 54.4 Ų | 54.4 | 79% | 0.792 | 25% | 0.25 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -83.3 | -15.4 | 175.8 | -65.7 | -69.9 | 169.3 | 174.5 | -3.5 | 112.7 | P145 | P145-R147 PolarHBondContact O-N 3.2Å; P145-R147 VanDerWaalsContact O-N 3.09Å |
| 148 | F | 96.1 | Very high | 96.4 | Very high | 19 Ų | 19 | 54 Ų | 54 | 8% | 0.083 | 26% | 0.258 | C | S | . | . | trans | -60.9 | 139.7 | -178.4 | -91.6 | -134.6 | 0 | 0 | 0 | 112.3 | I144 P145 D152 L153 M156 I168 V201 E202 | I144-F148 HydrophobicContact CB-CD1 4.23Å; I144-F148 HydrophobicContact CB-CG 4.42Å; I144-F148 HydrophobicContact CD1-CB 4.03Å; I144-F148 HydrophobicContact CD1-CD1 4.49Å; P145-F148 HydrophobicContact CB-CD2 3.72Å; P145-F148 HydrophobicContact CB-CE2 4.11Å; P145-F148 HydrophobicContact CG-CD2 3.74Å; P145-F148 HydrophobicContact CG-CE2 3.67Å; P145-F148 HydrophobicContact CG-CZ 4.42Å; P145-F148 WeakPolarHBondContact O-CB 3.43Å; P145-F148 PolarHBondContact O-N 2.83Å; F148-D152 WeakPolarHBondContact CA-OD2 3.33Å; F148-D152 HydrophobicContact CB-CB 4.5Å; F148-D152 HydrophobicContact CD1-CB 3.84Å; F148-D152 HydrophobicContact CD2-CB 4.37Å; F148-D152 HydrophobicContact CE1-CB 3.99Å; F148-D152 HydrophobicContact CE2-CB 4.5Å; F148-D152 HydrophobicContact CG-CB 4.02Å; F148-D152 HydrophobicContact CZ-CB 4.29Å; F148-L153 HydrophobicContact CD1-CD2 3.96Å; F148-L153 HydrophobicContact CD1-CG 4.34Å; F148-L153 HydrophobicContact CE1-CD2 4.44Å; F148-M156 HydrophobicContact CE1-CE 4.39Å; F148-I168 WeakPolarHBondContact O-CD1 3.4Å; F148-V201 HydrophobicContact CE1-CG1 4.2Å; F148-V201 HydrophobicContact CE2-CG1 4.09Å; F148-V201 HydrophobicContact CZ-CG1 3.43Å; F148-V201 VanDerWaalsContact CZ-CG1 3.43Å; F148-E202 HydrophobicContact CE2-CG 4.48Å | ||
| 149 | R | 96.3 | Very high | 96.4 | Very high | 96 Ų | 96 | 58.9 Ų | 58.9 | 36% | 0.362 | 28% | 0.282 | S | S | . | . | trans | -129.7 | 176.5 | 177.9 | -61.9 | -60.3 | 178.3 | -102.1 | 1.3 | 110.5 | F146 P151 D152 L153 | F146-R149 PolarHBondContact O-NH1 3.08Å; R149-P151 VanDerWaalsContact C-CD 3.49Å; R149-P151 VanDerWaalsContact C-N 3.34Å; R149-P151 HydrophobicContact CB-CG 4.2Å; R149-D152 PolarHBondContact N-OD2 3.36Å; R149-D152 PolarHBondContact O-N 3.24Å; R149-L153 PolarHBondContact O-N 3.44Å | ||
| 150 | D | 95.9 | Very high | 96.3 | Very high | 62 Ų | 62 | 60.7 Ų | 60.7 | 33% | 0.332 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -45.1 | -50 | 174.1 | 166.5 | -89.9 | 0 | 0 | 0 | 113.2 | D152 L153 R154 V166 | D150-D152 VanDerWaalsContact C-N 3.34Å; D150-D152 PolarHBondContact O-N 3.42Å; D150-L153 PolarHBondContact O-N 3.4Å; D150-R154 WeakPolarHBondContact O-CB 3.44Å; D150-R154 WeakPolarHBondContact O-CG 3.45Å; D150-R154 PolarHBondContact O-N 2.9Å; D150-R154 WeakPolarHBondContact OD1-CD 3.3Å; D150-R154 IonicContact OD1-NE 3.95Å; D150-R154 PolarHBondContact OD1-NE 2.91Å; D150-R154 IonicContact OD2-CZ 2.75Å; D150-R154 IonicContact OD2-NE 2.73Å; D150-R154 PolarHBondContact OD2-NE 2.95Å; D150-R154 IonicContact OD2-NH2 3.13Å; D150-V166 VanDerWaalsContact OD2-CB 3.3Å; D150-V166 WeakPolarHBondContact OD2-CB 3.38Å |
| 151 | P | 96.9 | Very high | 96.2 | Very high | 77 Ų | 77 | 59.4 Ų | 59.4 | 50% | 0.5 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -62.7 | -36.8 | -179 | 22.6 | -35.3 | 0 | 0 | 0 | 113.5 | R149 R154 Q155 | R149-P151 VanDerWaalsContact C-CD 3.49Å; R149-P151 VanDerWaalsContact C-N 3.34Å; R149-P151 HydrophobicContact CB-CG 4.2Å; P151-R154 PolarHBondContact O-N 2.91Å; P151-Q155 WeakPolarHBondContact O-CB 3.3Å; P151-Q155 PolarHBondContact O-N 3.25Å |
| 152 | D | 96 | Very high | 96.2 | Very high | 58 Ų | 58 | 65.2 Ų | 65.2 | 31% | 0.31 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -66.5 | -43.5 | -179.3 | -52.6 | -57.3 | 0 | 0 | 0 | 111.1 | F148 R149 D150 Q155 M156 | F148-D152 WeakPolarHBondContact CA-OD2 3.33Å; F148-D152 HydrophobicContact CB-CB 4.5Å; F148-D152 HydrophobicContact CD1-CB 3.84Å; F148-D152 HydrophobicContact CD2-CB 4.37Å; F148-D152 HydrophobicContact CE1-CB 3.99Å; F148-D152 HydrophobicContact CE2-CB 4.5Å; F148-D152 HydrophobicContact CG-CB 4.02Å; F148-D152 HydrophobicContact CZ-CB 4.29Å; R149-D152 PolarHBondContact N-OD2 3.36Å; R149-D152 PolarHBondContact O-N 3.24Å; D150-D152 VanDerWaalsContact C-N 3.34Å; D150-D152 PolarHBondContact O-N 3.42Å; D152-Q155 PolarHBondContact O-N 3.05Å; D152-M156 WeakPolarHBondContact O-CB 3.34Å; D152-M156 PolarHBondContact O-N 2.89Å |
| 153 | L | 96.2 | Very high | 96.1 | Very high | 0 Ų | 0 | 65 Ų | 65 | 0% | 0 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -67.3 | -40.6 | 174.6 | -69.9 | 179.5 | 0 | 0 | 0 | 111.1 | V141 I144 F148 R149 D150 Q155 M156 F157 V166 I168 V181 | V141-L153 HydrophobicContact CG1-CD2 4.42Å; I144-L153 HydrophobicContact CD1-CD1 4.28Å; I144-L153 HydrophobicContact CD1-CD2 4.26Å; I144-L153 HydrophobicContact CG2-CD2 4.49Å; F148-L153 HydrophobicContact CD1-CD2 3.96Å; F148-L153 HydrophobicContact CD1-CG 4.34Å; F148-L153 HydrophobicContact CE1-CD2 4.44Å; R149-L153 PolarHBondContact O-N 3.44Å; D150-L153 PolarHBondContact O-N 3.4Å; L153-Q155 VanDerWaalsContact C-N 3.32Å; L153-Q155 PolarHBondContact O-N 2.96Å; L153-M156 HydrophobicContact CD2-CE 4.16Å; L153-M156 PolarHBondContact O-N 3.41Å; L153-F157 HydrophobicContact CD2-CD2 4.25Å; L153-F157 HydrophobicContact CD2-CE2 3.95Å; L153-F157 VanDerWaalsContact O-CB 3.32Å; L153-F157 WeakPolarHBondContact O-CB 3.37Å; L153-F157 WeakPolarHBondContact O-CD2 2.97Å; L153-F157 PolarHBondContact O-N 3.09Å; L153-V166 HydrophobicContact CB-CG1 3.87Å; L153-V166 HydrophobicContact CD1-CG1 3.58Å; L153-V166 HydrophobicContact CG-CG1 4.36Å; L153-I168 HydrophobicContact CD1-CD1 3.91Å; L153-I168 HydrophobicContact CD1-CG1 3.75Å; L153-V181 HydrophobicContact CB-CG2 4.3Å; L153-V181 HydrophobicContact CD1-CG2 4.32Å |
| 154 | R | 96.4 | Very high | 96 | Very high | 91 Ų | 91 | 65 Ų | 65 | 34% | 0.343 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -61.2 | -40.5 | 175.2 | -76.4 | -178.9 | 179.5 | -89.7 | -3.5 | 112.3 | D150 P151 G158 I163 V166 | D150-R154 WeakPolarHBondContact O-CB 3.44Å; D150-R154 WeakPolarHBondContact O-CG 3.45Å; D150-R154 PolarHBondContact O-N 2.9Å; D150-R154 WeakPolarHBondContact OD1-CD 3.3Å; D150-R154 IonicContact OD1-NE 3.95Å; D150-R154 PolarHBondContact OD1-NE 2.91Å; D150-R154 IonicContact OD2-CZ 2.75Å; D150-R154 IonicContact OD2-NE 2.73Å; D150-R154 PolarHBondContact OD2-NE 2.95Å; D150-R154 IonicContact OD2-NH2 3.13Å; P151-R154 PolarHBondContact O-N 2.91Å; R154-G158 WeakPolarHBondContact O-CA 3.27Å; R154-G158 PolarHBondContact O-N 2.67Å; R154-I163 HydrophobicContact CB-CD1 4.31Å; R154-I163 HydrophobicContact CG-CD1 4.19Å; R154-I163 PolarHBondContact NH1-O 3.43Å; R154-V166 HydrophobicContact CG-CG2 3.8Å |
| 155 | Q | 96.1 | Very high | 95.9 | Very high | 160 Ų | 160 | 67.8 Ų | 67.8 | 75% | 0.748 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -66.5 | -44.4 | 177.9 | -177.1 | 170 | -4.4 | 0 | 0 | 111.5 | P151 D152 L153 | P151-Q155 WeakPolarHBondContact O-CB 3.3Å; P151-Q155 PolarHBondContact O-N 3.25Å; D152-Q155 PolarHBondContact O-N 3.05Å; L153-Q155 VanDerWaalsContact C-N 3.32Å; L153-Q155 PolarHBondContact O-N 2.96Å |
| 156 | M | 94.6 | Very high | 95.9 | Very high | 28 Ų | 28 | 68.2 Ų | 68.2 | 14% | 0.138 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -71.8 | -41.3 | -177.8 | -172.1 | 170.8 | 70 | 0 | 0 | 113.1 | F148 D152 L153 Q159 L196 V201 I206 | F148-M156 HydrophobicContact CE1-CE 4.39Å; D152-M156 WeakPolarHBondContact O-CB 3.34Å; D152-M156 PolarHBondContact O-N 2.89Å; L153-M156 HydrophobicContact CD2-CE 4.16Å; L153-M156 PolarHBondContact O-N 3.41Å; M156-Q159 WeakPolarHBondContact O-CG 3.37Å; M156-Q159 PolarHBondContact O-NE2 3.3Å; M156-L196 HydrophobicContact CE-CD1 4.48Å; M156-L196 HydrophobicContact CG-CD1 3.97Å; M156-L196 HydrophobicContact CG-CD2 3.83Å; M156-L196 HydrophobicContact SD-CD2 4.27Å; M156-V201 HydrophobicContact SD-CG2 3.93Å; M156-I206 HydrophobicContact CE-CD1 3.58Å; M156-I206 HydrophobicContact SD-CD1 3.96Å |
| 157 | F | 96.3 | Very high | 95.9 | Very high | 0 Ų | 0 | 65.4 Ų | 65.4 | 0% | 0 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -91.2 | -24.4 | -177.3 | -76.7 | -88.8 | 0 | 0 | 0 | 113.3 | L139 V141 L153 Q159 F160 I163 V181 F183 A192 L196 V208 | L139-F157 HydrophobicContact CD1-CE1 4.31Å; V141-F157 HydrophobicContact CB-CE2 4.43Å; V141-F157 HydrophobicContact CB-CZ 4.26Å; V141-F157 HydrophobicContact CG1-CE2 3.94Å; V141-F157 HydrophobicContact CG1-CZ 3.84Å; V141-F157 HydrophobicContact CG2-CE1 4.12Å; V141-F157 HydrophobicContact CG2-CE2 3.69Å; V141-F157 HydrophobicContact CG2-CZ 3.34Å; L153-F157 HydrophobicContact CD2-CD2 4.25Å; L153-F157 HydrophobicContact CD2-CE2 3.95Å; L153-F157 VanDerWaalsContact O-CB 3.32Å; L153-F157 WeakPolarHBondContact O-CB 3.37Å; L153-F157 WeakPolarHBondContact O-CD2 2.97Å; L153-F157 PolarHBondContact O-N 3.09Å; F157-Q159 PolarHBondContact O-N 2.61Å; F157-F160 PolarHBondContact O-N 3.07Å; F157-F160 VanDerWaalsContact O-N 3.1Å; F157-I163 HydrophobicContact CB-CD1 3.77Å; F157-V181 HydrophobicContact CB-CG1 4.18Å; F157-V181 HydrophobicContact CD2-CG2 4.07Å; F157-V181 HydrophobicContact CE2-CG2 4.33Å; F157-V181 HydrophobicContact CG-CG1 4.32Å; F157-V181 HydrophobicContact CG-CG2 4.33Å; F157-F183 HydrophobicContact CB-CE2 4.32Å; F157-F183 HydrophobicContact CB-CZ 3.8Å; F157-F183 AromaticContact CD1-CE2 3.93Å; F157-F183 HydrophobicContact CD1-CE2 3.93Å; F157-F183 AromaticContact CD1-CZ 3.94Å; F157-F183 HydrophobicContact CD1-CZ 3.94Å; F157-F183 HydrophobicContact CG-CZ 4.36Å; F157-F183 WeakPolarHBondContact O-CZ 2.99Å; F157-A192 HydrophobicContact CD1-CB 3.96Å; F157-A192 HydrophobicContact CE1-CB 4.39Å; F157-L196 HydrophobicContact CD1-CD1 3.5Å; F157-L196 VanDerWaalsContact CD1-CD1 3.5Å; F157-L196 HydrophobicContact CD2-CD1 4.11Å; F157-L196 HydrophobicContact CE1-CD1 3.35Å; F157-L196 HydrophobicContact CE2-CD1 4Å; F157-L196 HydrophobicContact CG-CD1 3.87Å; F157-L196 HydrophobicContact CZ-CD1 3.61Å; F157-V208 HydrophobicContact CE1-CG1 4.1Å; F157-V208 HydrophobicContact CE1-CG2 4.16Å; F157-V208 HydrophobicContact CZ-CG1 4.35Å; F157-V208 HydrophobicContact CZ-CG2 3.83Å |
| 158 | G | 95.8 | Very high | 95.9 | Very high | 35 Ų | 35 | 56.4 Ų | 56.4 | 36% | 0.361 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -69.5 | -20.4 | -173.1 | 0 | 0 | 0 | 0 | 0 | 114 | R154 F160 | R154-G158 WeakPolarHBondContact O-CA 3.27Å; R154-G158 PolarHBondContact O-N 2.67Å; G158-F160 PolarHBondContact O-N 3.48Å |
| 159 | Q | 96.2 | Very high | 95.9 | Very high | 138 Ų | 138 | 57.6 Ų | 57.6 | 65% | 0.645 | 29% | 0.29 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.2 | -22.2 | 172.2 | 66.3 | -175.9 | -28.7 | 0 | 0 | 113.4 | M156 F157 | M156-Q159 WeakPolarHBondContact O-CG 3.37Å; M156-Q159 PolarHBondContact O-NE2 3.3Å; F157-Q159 PolarHBondContact O-N 2.61Å |
| 160 | F | 95.9 | Very high | 95.9 | Very high | 39 Ų | 39 | 58 Ų | 58 | 17% | 0.171 | 29% | 0.294 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -91.2 | -24.9 | -177.6 | -61.3 | -73.4 | 0 | 0 | 0 | 113.3 | F157 G158 F183 R191 A192 K195 L196 | F157-F160 PolarHBondContact O-N 3.07Å; F157-F160 VanDerWaalsContact O-N 3.1Å; G158-F160 PolarHBondContact O-N 3.48Å; F160-F183 HydrophobicContact CB-CE1 4.39Å; F160-R191 PolarHBondContact O-NH2 3.19Å; F160-A192 HydrophobicContact CB-CB 3.7Å; F160-A192 HydrophobicContact CD1-CB 4.45Å; F160-A192 HydrophobicContact CD2-CB 3.58Å; F160-A192 HydrophobicContact CE2-CB 4.36Å; F160-A192 HydrophobicContact CG-CB 3.64Å; F160-K195 HydrophobicContact CE1-CB 3.71Å; F160-K195 HydrophobicContact CE1-CG 3.89Å; F160-K195 HydrophobicContact CZ-CB 3.73Å; F160-K195 HydrophobicContact CZ-CG 4.41Å; F160-L196 HydrophobicContact CD2-CD1 4.13Å; F160-L196 HydrophobicContact CE2-CD1 3.55Å; F160-L196 HydrophobicContact CE2-CD2 4.08Å; F160-L196 HydrophobicContact CE2-CG 3.63Å; F160-L196 HydrophobicContact CZ-CD1 4.46Å; F160-L196 HydrophobicContact CZ-CD2 4.37Å; F160-L196 HydrophobicContact CZ-CG 4.07Å |
| 161 | G | 95.1 | Very high | 95.9 | Very high | 15 Ų | 15 | 59.9 Ų | 59.9 | 16% | 0.155 | 31% | 0.305 | C | S | . | . | S | Bend | trans | 172.1 | 173.5 | -177.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||
| 162 | K | 96.4 | Very high | 95.7 | Very high | 121 Ų | 121 | 65.7 Ų | 65.7 | 53% | 0.526 | 33% | 0.325 | S | S | . | . | trans | -73.1 | 128.8 | -177.4 | -169.3 | -160.5 | -178.7 | -171.8 | 0 | 111.3 | F183 E184 | K162-F183 WeakPolarHBondContact O-CA 3.4Å; K162-E184 HydrophobicContact CB-CB 4.34Å; K162-E184 HydrophobicContact CD-CB 4.32Å; K162-E184 WeakPolarHBondContact CD-OE2 3.47Å; K162-E184 IonicContact NZ-OE1 2.67Å; K162-E184 PolarHBondContact NZ-OE1 3.31Å; K162-E184 IonicContact NZ-OE2 3.24Å; K162-E184 PolarHBondContact NZ-OE2 2.84Å; K162-E184 PolarHBondContact O-N 2.97Å | ||
| 163 | I | 96.3 | Very high | 95.6 | Very high | 18 Ų | 18 | 74.8 Ų | 74.8 | 9% | 0.092 | 36% | 0.355 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.3 | 124 | 179.4 | -60.4 | 166.4 | 0 | 0 | 0 | 110 | R154 F157 V166 V181 T182 F183 | R154-I163 HydrophobicContact CB-CD1 4.31Å; R154-I163 HydrophobicContact CG-CD1 4.19Å; R154-I163 PolarHBondContact NH1-O 3.43Å; F157-I163 HydrophobicContact CB-CD1 3.77Å; I163-V166 HydrophobicContact CG2-CG2 3.46Å; I163-V166 VanDerWaalsContact CG2-CG2 3.46Å; I163-V181 HydrophobicContact CD1-CG1 4.1Å; I163-V181 HydrophobicContact CG1-CG1 4.01Å; I163-V181 HydrophobicContact CG2-CG1 3.87Å; I163-T182 CarbonylContact C-O 3.59Å; I163-F183 HydrophobicContact CG1-CD1 4.46Å; I163-F183 HydrophobicContact CG1-CE1 4.18Å; I163-F183 HydrophobicContact CG1-CZ 4.41Å |
| 164 | L | 94.9 | Very high | 95.5 | Very high | 79 Ų | 79 | 76.2 Ų | 76.2 | 41% | 0.414 | 37% | 0.37 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.1 | -50.1 | 175.7 | -63.2 | 178.9 | 0 | 0 | 0 | 111.7 | P136 T182 E184 | P136-L164 HydrophobicContact CB-CD1 3.65Å; L164-T182 HydrophobicContact CB-CG2 4.46Å; L164-T182 HydrophobicContact CD1-CG2 4.45Å; L164-T182 PolarHBondContact N-O 2.9Å; L164-E184 HydrophobicContact CD1-CB 4.3Å; L164-E184 HydrophobicContact CD2-CB 4Å; L164-E184 HydrophobicContact CD2-CG 4.34Å; L164-E184 HydrophobicContact CG-CB 4Å |
| 165 | D | 94.5 | Very high | 95.4 | Very high | 60 Ų | 60 | 72.6 Ų | 72.6 | 32% | 0.321 | 36% | 0.358 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -143.9 | 142.6 | -172.6 | -172.6 | 32.8 | 0 | 0 | 0 | 110.5 | T182 R214 | D165-T182 PolarHBondContact N-O 2.74Å; D165-T182 PolarHBondContact O-N 2.72Å; D165-R214 IonicContact OD2-NH1 3.7Å; D165-R214 PolarHBondContact OD2-NH1 2.91Å |
| 166 | V | 96.3 | Very high | 95.5 | Very high | 15 Ų | 15 | 71 Ų | 71 | 9% | 0.091 | 35% | 0.349 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.9 | 132.4 | 171.6 | -177.7 | 0 | 0 | 0 | 0 | 108.2 | D150 L153 R154 I163 F180 V181 | D150-V166 VanDerWaalsContact OD2-CB 3.3Å; D150-V166 WeakPolarHBondContact OD2-CB 3.38Å; L153-V166 HydrophobicContact CB-CG1 3.87Å; L153-V166 HydrophobicContact CD1-CG1 3.58Å; L153-V166 HydrophobicContact CG-CG1 4.36Å; R154-V166 HydrophobicContact CG-CG2 3.8Å; I163-V166 HydrophobicContact CG2-CG2 3.46Å; I163-V166 VanDerWaalsContact CG2-CG2 3.46Å; V166-F180 WeakPolarHBondContact CA-O 3.46Å; V166-V181 HydrophobicContact CG1-CG2 4.3Å; V166-V181 HydrophobicContact CG2-CG1 4.41Å; V166-V181 HydrophobicContact CG2-CG2 4.42Å |
| 167 | E | 95.9 | Very high | 95.5 | Very high | 52 Ų | 52 | 69.9 Ų | 69.9 | 24% | 0.243 | 35% | 0.345 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.7 | 125.7 | -178.9 | 178 | -175.4 | -153.1 | 0 | 0 | 109.1 | R138 I169 G179 F180 R214 | R138-E167 IonicContact CZ-OE2 3.86Å; R138-E167 IonicContact NH2-OE2 2.67Å; R138-E167 PolarHBondContact NH2-OE2 3.22Å; E167-I169 HydrophobicContact CG-CD1 3.96Å; E167-G179 CarbonylContact O-C 3.55Å; E167-G179 WeakPolarHBondContact O-CA 3.33Å; E167-F180 HydrophobicContact CB-CB 4.47Å; E167-F180 PolarHBondContact N-O 3.38Å; E167-F180 PolarHBondContact O-N 2.77Å; E167-R214 IonicContact OE1-CZ 2.98Å; E167-R214 IonicContact OE1-NH2 3.43Å; E167-R214 PolarHBondContact OE1-NH2 3.23Å; E167-R214 IonicContact OE2-CZ 3.25Å; E167-R214 IonicContact OE2-NE 3.66Å; E167-R214 PolarHBondContact OE2-NE 3.23Å; E167-R214 IonicContact OE2-NH1 3.88Å; E167-R214 IonicContact OE2-NH2 3.34Å; E167-R214 PolarHBondContact OE2-NH2 3.11Å |
| 168 | I | 96.5 | Very high | 95.6 | Very high | 21 Ų | 21 | 71.6 Ų | 71.6 | 11% | 0.108 | 35% | 0.352 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.4 | 133.3 | 172.2 | -66.9 | 168.3 | 0 | 0 | 0 | 108.1 | F148 L153 F170 | F148-I168 WeakPolarHBondContact O-CD1 3.4Å; L153-I168 HydrophobicContact CD1-CD1 3.91Å; L153-I168 HydrophobicContact CD1-CG1 3.75Å; I168-F170 HydrophobicContact CB-CD2 4.44Å; I168-F170 HydrophobicContact CB-CE2 3.67Å; I168-F170 HydrophobicContact CB-CZ 4.03Å; I168-F170 HydrophobicContact CG2-CD2 4.17Å; I168-F170 HydrophobicContact CG2-CE1 4.24Å; I168-F170 HydrophobicContact CG2-CE2 3.56Å; I168-F170 HydrophobicContact CG2-CZ 3.59Å; I168-F170 WeakPolarHBondContact O-CD2 3.37Å; I168-F170 WeakPolarHBondContact O-CE2 3.46Å |
| 169 | I | 95.6 | Very high | 95.6 | Very high | 44 Ų | 44 | 69.9 Ų | 69.9 | 23% | 0.226 | 34% | 0.335 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.1 | 123.6 | 179.5 | -57.5 | -51.5 | 0 | 0 | 0 | 108.9 | E167 K176 F178 F180 | E167-I169 HydrophobicContact CG-CD1 3.96Å; I169-K176 HydrophobicContact CG2-CB 4.31Å; I169-K176 HydrophobicContact CG2-CD 4.26Å; I169-K176 WeakPolarHBondContact O-CB 3.42Å; I169-K176 PolarHBondContact O-N 3.03Å; I169-F178 HydrophobicContact CB-CD2 4.23Å; I169-F178 HydrophobicContact CB-CE1 4.37Å; I169-F178 HydrophobicContact CB-CE2 3.68Å; I169-F178 HydrophobicContact CB-CZ 3.75Å; I169-F178 HydrophobicContact CG1-CD2 3.97Å; I169-F178 HydrophobicContact CG1-CE2 3.33Å; I169-F178 HydrophobicContact CG1-CZ 3.85Å; I169-F178 HydrophobicContact CG2-CE1 4.42Å; I169-F178 HydrophobicContact CG2-CE2 4.19Å; I169-F178 HydrophobicContact CG2-CZ 3.79Å; I169-F178 PolarHBondContact N-O 3.11Å; I169-F180 HydrophobicContact CD1-CD2 4.31Å; I169-F180 HydrophobicContact CD1-CE2 4.03Å; I169-F180 HydrophobicContact CG1-CD2 4.26Å; I169-F180 HydrophobicContact CG1-CE2 3.81Å |
| 170 | F | 95.6 | Very high | 95.6 | Very high | 104 Ų | 104 | 65 Ų | 65 | 46% | 0.456 | 31% | 0.311 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.4 | 146.2 | 175.5 | -64.2 | -91.5 | 0 | 0 | 0 | 110.2 | I168 S175 | I168-F170 HydrophobicContact CB-CD2 4.44Å; I168-F170 HydrophobicContact CB-CE2 3.67Å; I168-F170 HydrophobicContact CB-CZ 4.03Å; I168-F170 HydrophobicContact CG2-CD2 4.17Å; I168-F170 HydrophobicContact CG2-CE1 4.24Å; I168-F170 HydrophobicContact CG2-CE2 3.56Å; I168-F170 HydrophobicContact CG2-CZ 3.59Å; I168-F170 WeakPolarHBondContact O-CD2 3.37Å; I168-F170 WeakPolarHBondContact O-CE2 3.46Å; F170-S175 VanDerWaalsContact CD1-CA 3.43Å; F170-S175 VanDerWaalsContact CD1-N 3.35Å |
| 171 | N | 95.5 | Very high | 95.7 | Very high | 103 Ų | 103 | 63.1 Ų | 63.1 | 55% | 0.551 | 30% | 0.303 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -107.6 | 175.7 | 163.6 | -163.3 | 3.3 | 0 | 0 | 0 | 108.3 | R173 G174 | N171-R173 PolarHBondContact O-N 3.45Å; N171-R173 VanDerWaalsContact O-N 3.11Å; N171-G174 PolarHBondContact N-O 3.28Å; N171-G174 PolarHBondContact O-N 3.41Å |
| 172 | E | 94.1 | Very high | 95.7 | Very high | 198 Ų | 198 | 63.4 Ų | 63.4 | 93% | 0.925 | 30% | 0.302 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.5 | -29.3 | 178.9 | -60 | -176.6 | 150 | 0 | 0 | 113 | ||
| 173 | R | 93.5 | Very high | 95.7 | Very high | 250 Ų | 250 | 57.7 Ų | 57.7 | 94% | 0.943 | 28% | 0.277 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82 | -8.2 | 176.7 | -71.6 | -178 | 160.9 | -125.5 | -2.2 | 114.5 | N171 | N171-R173 PolarHBondContact O-N 3.45Å; N171-R173 VanDerWaalsContact O-N 3.11Å |
| 174 | G | 94.1 | Very high | 95.7 | Very high | 30 Ų | 30 | 60.5 Ų | 60.5 | 31% | 0.309 | 29% | 0.29 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 123.2 | -162.4 | -174.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | N171 K176 | N171-G174 PolarHBondContact N-O 3.28Å; N171-G174 PolarHBondContact O-N 3.41Å; G174-K176 PolarHBondContact O-N 2.94Å |
| 175 | S | 95.4 | Very high | 95.7 | Very high | 14 Ų | 14 | 58.7 Ų | 58.7 | 10% | 0.098 | 28% | 0.281 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -61.5 | 139.5 | -174.3 | 63.6 | 0 | 0 | 0 | 0 | 111.5 | F146 F170 G177 | F146-S175 VanDerWaalsContact C-OG 3.29Å; F146-S175 WeakPolarHBondContact CA-OG 3.48Å; F146-S175 VanDerWaalsContact CB-OG 3.29Å; F146-S175 WeakPolarHBondContact CB-OG 3.5Å; F146-S175 VanDerWaalsContact CD1-O 3.3Å; F146-S175 WeakPolarHBondContact CD1-O 3.44Å; F146-S175 PolarHBondContact O-OG 3.46Å; F170-S175 VanDerWaalsContact CD1-CA 3.43Å; F170-S175 VanDerWaalsContact CD1-N 3.35Å; S175-G177 PolarHBondContact O-N 3.49Å |
| 176 | K | 96.3 | Very high | 95.7 | Very high | 126 Ų | 126 | 57.9 Ų | 57.9 | 55% | 0.548 | 28% | 0.28 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.3 | 2.7 | 177.8 | -158.1 | 169.2 | 163 | -158.1 | 0 | 113.2 | I169 G174 F178 | I169-K176 HydrophobicContact CG2-CB 4.31Å; I169-K176 HydrophobicContact CG2-CD 4.26Å; I169-K176 WeakPolarHBondContact O-CB 3.42Å; I169-K176 PolarHBondContact O-N 3.03Å; G174-K176 PolarHBondContact O-N 2.94Å; K176-F178 VanDerWaalsContact C-N 3.32Å; K176-F178 HydrophobicContact CB-CD1 3.92Å; K176-F178 HydrophobicContact CB-CE1 3.73Å; K176-F178 HydrophobicContact CD-CD1 4.25Å; K176-F178 HydrophobicContact CD-CE1 3.3Å; K176-F178 HydrophobicContact CD-CZ 3.9Å; K176-F178 HydrophobicContact CG-CD1 3.92Å; K176-F178 HydrophobicContact CG-CE1 3.46Å; K176-F178 VanDerWaalsContact CG-CE1 3.46Å; K176-F178 HydrophobicContact CG-CZ 4.45Å |
| 177 | G | 95.8 | Very high | 95.6 | Very high | 6 Ų | 6 | 59.4 Ų | 59.4 | 6% | 0.062 | 29% | 0.294 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 75.4 | 20.2 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | N143 I144 S175 | N143-G177 PolarHBondContact N-O 2.89Å; I144-G177 VanDerWaalsContact CG1-C 3.47Å; I144-G177 WeakPolarHBondContact CG1-O 3.37Å; I144-G177 PolarHBondContact N-O 2.81Å; S175-G177 PolarHBondContact O-N 3.49Å |
| 178 | F | 97 | Very high | 95.6 | Very high | 35 Ų | 35 | 58.1 Ų | 58.1 | 15% | 0.154 | 29% | 0.289 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -147.6 | 160.4 | 170.6 | 72.5 | -93.7 | 0 | 0 | 0 | 111.3 | H140 V141 I169 K176 F180 | H140-F178 AromaticContact CD2-CD2 3.94Å; H140-F178 AromaticContact NE2-CD2 3.52Å; H140-F178 AromaticContact NE2-CG 3.88Å; V141-F178 CarbonylContact O-C 3.36Å; V141-F178 WeakPolarHBondContact O-CA 3.32Å; V141-F178 WeakPolarHBondContact O-CB 3.44Å; I169-F178 HydrophobicContact CB-CD2 4.23Å; I169-F178 HydrophobicContact CB-CE1 4.37Å; I169-F178 HydrophobicContact CB-CE2 3.68Å; I169-F178 HydrophobicContact CB-CZ 3.75Å; I169-F178 HydrophobicContact CG1-CD2 3.97Å; I169-F178 HydrophobicContact CG1-CE2 3.33Å; I169-F178 HydrophobicContact CG1-CZ 3.85Å; I169-F178 HydrophobicContact CG2-CE1 4.42Å; I169-F178 HydrophobicContact CG2-CE2 4.19Å; I169-F178 HydrophobicContact CG2-CZ 3.79Å; I169-F178 PolarHBondContact N-O 3.11Å; K176-F178 VanDerWaalsContact C-N 3.32Å; K176-F178 HydrophobicContact CB-CD1 3.92Å; K176-F178 HydrophobicContact CB-CE1 3.73Å; K176-F178 HydrophobicContact CD-CD1 4.25Å; K176-F178 HydrophobicContact CD-CE1 3.3Å; K176-F178 HydrophobicContact CD-CZ 3.9Å; K176-F178 HydrophobicContact CG-CD1 3.92Å; K176-F178 HydrophobicContact CG-CE1 3.46Å; K176-F178 VanDerWaalsContact CG-CE1 3.46Å; K176-F178 HydrophobicContact CG-CZ 4.45Å; F178-F180 HydrophobicContact CD2-CE2 4.33Å; F178-F180 HydrophobicContact CD2-CZ 4.48Å; F178-F180 AromaticContact CE2-CE2 4Å; F178-F180 HydrophobicContact CE2-CE2 4Å; F178-F180 HydrophobicContact CE2-CZ 4.17Å |
| 179 | G | 96.6 | Very high | 95.6 | Very high | 0 Ų | 0 | 57.1 Ų | 57.1 | 0% | 0 | 28% | 0.284 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -154.3 | -175.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112 | V141 E167 | V141-G179 PolarHBondContact N-O 3.43Å; V141-G179 PolarHBondContact O-N 2.95Å; E167-G179 CarbonylContact O-C 3.55Å; E167-G179 WeakPolarHBondContact O-CA 3.33Å |
| 180 | F | 97.2 | Very high | 95.6 | Very high | 34 Ų | 34 | 56.8 Ų | 56.8 | 15% | 0.149 | 28% | 0.283 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.7 | 139 | 178.9 | -58.1 | -84.3 | 0 | 0 | 0 | 109.7 | R138 L139 H140 V166 E167 I169 F178 A211 | R138-F180 HydrophobicContact CG-CB 4.22Å; L139-F180 CarbonylContact O-C 3.57Å; L139-F180 WeakPolarHBondContact O-CA 3.12Å; H140-F180 HydrophobicContact CB-CD1 4.03Å; H140-F180 HydrophobicContact CB-CE1 3.93Å; H140-F180 AromaticContact CD2-CE1 3.57Å; H140-F180 AromaticContact CD2-CZ 3.96Å; V166-F180 WeakPolarHBondContact CA-O 3.46Å; E167-F180 HydrophobicContact CB-CB 4.47Å; E167-F180 PolarHBondContact N-O 3.38Å; E167-F180 PolarHBondContact O-N 2.77Å; I169-F180 HydrophobicContact CD1-CD2 4.31Å; I169-F180 HydrophobicContact CD1-CE2 4.03Å; I169-F180 HydrophobicContact CG1-CD2 4.26Å; I169-F180 HydrophobicContact CG1-CE2 3.81Å; F178-F180 HydrophobicContact CD2-CE2 4.33Å; F178-F180 HydrophobicContact CD2-CZ 4.48Å; F178-F180 AromaticContact CE2-CE2 4Å; F178-F180 HydrophobicContact CE2-CE2 4Å; F178-F180 HydrophobicContact CE2-CZ 4.17Å; F180-A211 HydrophobicContact CD1-CB 3.75Å; F180-A211 HydrophobicContact CE1-CB 4.05Å |
| 181 | V | 96.9 | Very high | 95.7 | Very high | 0 Ų | 0 | 57.4 Ų | 57.4 | 0% | 0 | 28% | 0.282 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.5 | 124.3 | 176.5 | 179.8 | 0 | 0 | 0 | 0 | 107.7 | R138 L139 V141 L153 F157 I163 V166 F183 | R138-V181 CarbonylContact C-O 3.58Å; R138-V181 WeakPolarHBondContact CA-O 3.47Å; L139-V181 PolarHBondContact N-O 3.13Å; L139-V181 PolarHBondContact O-N 2.78Å; V141-V181 HydrophobicContact CG2-CG2 4.08Å; L153-V181 HydrophobicContact CB-CG2 4.3Å; L153-V181 HydrophobicContact CD1-CG2 4.32Å; F157-V181 HydrophobicContact CB-CG1 4.18Å; F157-V181 HydrophobicContact CD2-CG2 4.07Å; F157-V181 HydrophobicContact CE2-CG2 4.33Å; F157-V181 HydrophobicContact CG-CG1 4.32Å; F157-V181 HydrophobicContact CG-CG2 4.33Å; I163-V181 HydrophobicContact CD1-CG1 4.1Å; I163-V181 HydrophobicContact CG1-CG1 4.01Å; I163-V181 HydrophobicContact CG2-CG1 3.87Å; V166-V181 HydrophobicContact CG1-CG2 4.3Å; V166-V181 HydrophobicContact CG2-CG1 4.41Å; V166-V181 HydrophobicContact CG2-CG2 4.42Å; V181-F183 HydrophobicContact CG1-CD2 4.1Å; V181-F183 HydrophobicContact CG1-CE2 3.75Å; V181-F183 HydrophobicContact CG1-CZ 4.41Å |
| 182 | T | 95.7 | Very high | 95.7 | Very high | 22 Ų | 22 | 52.5 Ų | 52.5 | 14% | 0.135 | 26% | 0.255 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.1 | 115.4 | 177.7 | -49.9 | 0 | 0 | 0 | 0 | 109.1 | P136 K137 R138 I163 L164 D165 | P136-T182 HydrophobicContact CB-CG2 4.21Å; K137-T182 WeakPolarHBondContact O-CA 3.42Å; R138-T182 HydrophobicContact CB-CG2 4.47Å; I163-T182 CarbonylContact C-O 3.59Å; L164-T182 HydrophobicContact CB-CG2 4.46Å; L164-T182 HydrophobicContact CD1-CG2 4.45Å; L164-T182 PolarHBondContact N-O 2.9Å; D165-T182 PolarHBondContact N-O 2.74Å; D165-T182 PolarHBondContact O-N 2.72Å |
| 183 | F | 96.6 | Very high | 95.9 | Very high | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 22% | 0.223 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -85.5 | 152.2 | 172.8 | -78.2 | -93.8 | 0 | 0 | 0 | 111 | P136 K137 L139 F157 F160 K162 I163 V181 N185 D188 A189 A192 | P136-F183 CarbonylContact C-O 3.56Å; P136-F183 WeakPolarHBondContact CA-O 3.33Å; P136-F183 VanDerWaalsContact CB-O 3.31Å; P136-F183 WeakPolarHBondContact CB-O 3.09Å; K137-F183 PolarHBondContact N-O 2.9Å; K137-F183 VanDerWaalsContact N-O 3.08Å; K137-F183 PolarHBondContact O-N 3.32Å; L139-F183 HydrophobicContact CD1-CD2 4.11Å; L139-F183 HydrophobicContact CD1-CE2 3.78Å; L139-F183 HydrophobicContact CG-CD2 4.47Å; F157-F183 HydrophobicContact CB-CE2 4.32Å; F157-F183 HydrophobicContact CB-CZ 3.8Å; F157-F183 AromaticContact CD1-CE2 3.93Å; F157-F183 HydrophobicContact CD1-CE2 3.93Å; F157-F183 AromaticContact CD1-CZ 3.94Å; F157-F183 HydrophobicContact CD1-CZ 3.94Å; F157-F183 HydrophobicContact CG-CZ 4.36Å; F157-F183 WeakPolarHBondContact O-CZ 2.99Å; F160-F183 HydrophobicContact CB-CE1 4.39Å; K162-F183 WeakPolarHBondContact O-CA 3.4Å; I163-F183 HydrophobicContact CG1-CD1 4.46Å; I163-F183 HydrophobicContact CG1-CE1 4.18Å; I163-F183 HydrophobicContact CG1-CZ 4.41Å; V181-F183 HydrophobicContact CG1-CD2 4.1Å; V181-F183 HydrophobicContact CG1-CE2 3.75Å; V181-F183 HydrophobicContact CG1-CZ 4.41Å; F183-N185 VanDerWaalsContact C-N 3.29Å; F183-N185 WeakPolarHBondContact CB-O 3.16Å; F183-D188 HydrophobicContact CD1-CB 4.09Å; F183-A189 HydrophobicContact CB-CB 3.94Å; F183-A189 HydrophobicContact CD2-CB 3.67Å; F183-A189 HydrophobicContact CE2-CB 4.4Å; F183-A189 HydrophobicContact CG-CB 3.9Å; F183-A192 HydrophobicContact CE2-CB 4.12Å; F183-A192 HydrophobicContact CZ-CB 3.73Å |
| 184 | E | 95 | Very high | 96 | Very high | 78 Ų | 78 | 40.4 Ų | 40.4 | 36% | 0.364 | 21% | 0.207 | S | C | . | . | S | Bend | trans | -66.7 | -35.4 | 168.6 | -175.9 | 171.8 | -120.6 | 0 | 0 | 111.5 | S134 Q135 P136 K162 L164 | S134-E184 PolarHBondContact OG-O 2.65Å; Q135-E184 CarbonylContact C-O 3.6Å; P136-E184 WeakPolarHBondContact CA-O 2.93Å; K162-E184 HydrophobicContact CB-CB 4.34Å; K162-E184 HydrophobicContact CD-CB 4.32Å; K162-E184 WeakPolarHBondContact CD-OE2 3.47Å; K162-E184 IonicContact NZ-OE1 2.67Å; K162-E184 PolarHBondContact NZ-OE1 3.31Å; K162-E184 IonicContact NZ-OE2 3.24Å; K162-E184 PolarHBondContact NZ-OE2 2.84Å; K162-E184 PolarHBondContact O-N 2.97Å; L164-E184 HydrophobicContact CD1-CB 4.3Å; L164-E184 HydrophobicContact CD2-CB 4Å; L164-E184 HydrophobicContact CD2-CG 4.34Å; L164-E184 HydrophobicContact CG-CB 4Å |
| 185 | N | 95.1 | Very high | 96.1 | Very high | 40 Ų | 40 | 46 Ų | 46 | 21% | 0.214 | 22% | 0.223 | C | C | . | . | trans | -117.7 | 134 | -176.7 | -166.8 | 31.1 | 0 | 0 | 0 | 113.2 | S134 F183 D188 A189 | S134-N185 WeakPolarHBondContact CB-OD1 2.98Å; S134-N185 WeakPolarHBondContact OG-CA 3.45Å; S134-N185 WeakPolarHBondContact OG-CB 3.33Å; S134-N185 VanDerWaalsContact OG-CG 3.24Å; S134-N185 PolarHBondContact OG-N 2.96Å; S134-N185 PolarHBondContact OG-OD1 2.86Å; F183-N185 VanDerWaalsContact C-N 3.29Å; F183-N185 WeakPolarHBondContact CB-O 3.16Å; N185-D188 HydrophobicContact CB-CB 4.2Å; N185-D188 PolarHBondContact ND2-OD1 3.34Å; N185-D188 PolarHBondContact O-N 3.17Å; N185-A189 PolarHBondContact O-N 2.74Å | ||
| 186 | S | 94.3 | Very high | 96.2 | Very high | 44 Ų | 44 | 46 Ų | 46 | 31% | 0.308 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -66.4 | -41.5 | -179.6 | 57 | 0 | 0 | 0 | 0 | 112 | Q135 D188 A189 D190 | Q135-S186 PolarHBondContact O-N 3.03Å; S186-D188 VanDerWaalsContact C-N 3.32Å; S186-D188 PolarHBondContact O-N 2.84Å; S186-A189 WeakPolarHBondContact O-CB 3.45Å; S186-A189 PolarHBondContact O-N 3.25Å; S186-D190 PolarHBondContact O-N 3.35Å; S186-D190 VanDerWaalsContact O-N 3.07Å |
| 187 | A | 95.5 | Very high | 96.2 | Very high | 46 Ų | 46 | 44.2 Ų | 44.2 | 38% | 0.38 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -62.4 | -39.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | A189 D190 R191 | A187-A189 VanDerWaalsContact C-N 3.33Å; A187-A189 PolarHBondContact O-N 2.77Å; A187-D190 PolarHBondContact O-N 3.18Å; A187-R191 WeakPolarHBondContact O-CG 3.36Å; A187-R191 PolarHBondContact O-N 3.38Å; A187-R191 VanDerWaalsContact O-N 3.09Å |
| 188 | D | 96 | Very high | 96.2 | Very high | 26 Ų | 26 | 45 Ų | 45 | 14% | 0.139 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -65.9 | -38.4 | 178.1 | -61.1 | -5.4 | 0 | 0 | 0 | 111.5 | F183 N185 S186 R191 A192 | F183-D188 HydrophobicContact CD1-CB 4.09Å; N185-D188 HydrophobicContact CB-CB 4.2Å; N185-D188 PolarHBondContact ND2-OD1 3.34Å; N185-D188 PolarHBondContact O-N 3.17Å; S186-D188 VanDerWaalsContact C-N 3.32Å; S186-D188 PolarHBondContact O-N 2.84Å; D188-R191 PolarHBondContact O-N 2.99Å; D188-R191 IonicContact OD1-CZ 3.14Å; D188-R191 IonicContact OD1-NH1 2.86Å; D188-R191 PolarHBondContact OD1-NH1 2.85Å; D188-R191 IonicContact OD1-NH2 2.65Å; D188-R191 PolarHBondContact OD1-NH2 2.88Å; D188-A192 WeakPolarHBondContact O-CB 3.43Å; D188-A192 PolarHBondContact O-N 3.44Å |
| 189 | A | 95.9 | Very high | 96.2 | Very high | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -63.5 | -40.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | K137 L139 F183 N185 S186 A187 A192 R193 | K137-A189 HydrophobicContact CB-CB 3.84Å; K137-A189 HydrophobicContact CD-CB 3.94Å; K137-A189 HydrophobicContact CG-CB 3.84Å; L139-A189 HydrophobicContact CD1-CB 4.04Å; L139-A189 WeakPolarHBondContact CD1-O 3.35Å; L139-A189 HydrophobicContact CD2-CB 4.12Å; L139-A189 HydrophobicContact CG-CB 4.05Å; F183-A189 HydrophobicContact CB-CB 3.94Å; F183-A189 HydrophobicContact CD2-CB 3.67Å; F183-A189 HydrophobicContact CE2-CB 4.4Å; F183-A189 HydrophobicContact CG-CB 3.9Å; N185-A189 PolarHBondContact O-N 2.74Å; S186-A189 WeakPolarHBondContact O-CB 3.45Å; S186-A189 PolarHBondContact O-N 3.25Å; A187-A189 VanDerWaalsContact C-N 3.33Å; A187-A189 PolarHBondContact O-N 2.77Å; A189-A192 PolarHBondContact O-N 2.78Å; A189-R193 WeakPolarHBondContact O-CB 3.36Å; A189-R193 PolarHBondContact O-N 2.83Å |
| 190 | D | 95.9 | Very high | 96.2 | Very high | 37 Ų | 37 | 50.5 Ų | 50.5 | 20% | 0.198 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -64.9 | -43.7 | 176.4 | -75.7 | -53.4 | 0 | 0 | 0 | 111.9 | K137 S186 A187 A192 R193 E194 | K137-D190 IonicContact NZ-OD1 3.83Å; K137-D190 PolarHBondContact NZ-OD1 3.35Å; K137-D190 IonicContact NZ-OD2 3.19Å; K137-D190 PolarHBondContact NZ-OD2 3.33Å; S186-D190 PolarHBondContact O-N 3.35Å; S186-D190 VanDerWaalsContact O-N 3.07Å; A187-D190 PolarHBondContact O-N 3.18Å; D190-A192 VanDerWaalsContact C-N 3.34Å; D190-A192 PolarHBondContact O-N 2.78Å; D190-R193 WeakPolarHBondContact O-CB 3.4Å; D190-R193 PolarHBondContact O-N 3.08Å; D190-R193 IonicContact OD1-CZ 2.61Å; D190-R193 VanDerWaalsContact OD1-CZ 3.25Å; D190-R193 IonicContact OD1-NE 2.78Å; D190-R193 IonicContact OD1-NH1 3.38Å; D190-R193 PolarHBondContact OD1-NH1 3.34Å; D190-R193 IonicContact OD1-NH2 2.9Å; D190-R193 PolarHBondContact OD1-NH2 2.83Å; D190-E194 WeakPolarHBondContact O-CG 3.3Å; D190-E194 PolarHBondContact O-N 3.42Å |
| 191 | R | 96.9 | Very high | 96.1 | Very high | 116 Ų | 116 | 50.1 Ų | 50.1 | 44% | 0.438 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -59.2 | -45 | 174.3 | -65.8 | -165.8 | -50.1 | -96.9 | 1.5 | 111.8 | F160 A187 D188 E194 K195 | F160-R191 PolarHBondContact O-NH2 3.19Å; A187-R191 WeakPolarHBondContact O-CG 3.36Å; A187-R191 PolarHBondContact O-N 3.38Å; A187-R191 VanDerWaalsContact O-N 3.09Å; D188-R191 PolarHBondContact O-N 2.99Å; D188-R191 IonicContact OD1-CZ 3.14Å; D188-R191 IonicContact OD1-NH1 2.86Å; D188-R191 PolarHBondContact OD1-NH1 2.85Å; D188-R191 IonicContact OD1-NH2 2.65Å; D188-R191 PolarHBondContact OD1-NH2 2.88Å; R191-E194 PolarHBondContact O-N 2.86Å; R191-K195 WeakPolarHBondContact O-CB 3.35Å; R191-K195 WeakPolarHBondContact O-CG 3.36Å; R191-K195 PolarHBondContact O-N 2.97Å; R191-K195 VanDerWaalsContact O-N 3.09Å |
| 192 | A | 96.8 | Very high | 95.9 | Very high | 0 Ų | 0 | 56.9 Ų | 56.9 | 0% | 0 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -62.6 | -43.7 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | L139 F157 F160 F183 D188 A189 D190 K195 L196 | L139-A192 HydrophobicContact CD1-CB 4.43Å; F157-A192 HydrophobicContact CD1-CB 3.96Å; F157-A192 HydrophobicContact CE1-CB 4.39Å; F160-A192 HydrophobicContact CB-CB 3.7Å; F160-A192 HydrophobicContact CD1-CB 4.45Å; F160-A192 HydrophobicContact CD2-CB 3.58Å; F160-A192 HydrophobicContact CE2-CB 4.36Å; F160-A192 HydrophobicContact CG-CB 3.64Å; F183-A192 HydrophobicContact CE2-CB 4.12Å; F183-A192 HydrophobicContact CZ-CB 3.73Å; D188-A192 WeakPolarHBondContact O-CB 3.43Å; D188-A192 PolarHBondContact O-N 3.44Å; A189-A192 PolarHBondContact O-N 2.78Å; D190-A192 VanDerWaalsContact C-N 3.34Å; D190-A192 PolarHBondContact O-N 2.78Å; A192-K195 PolarHBondContact O-N 3.02Å; A192-L196 VanDerWaalsContact O-CB 3.27Å; A192-L196 WeakPolarHBondContact O-CB 3.46Å; A192-L196 PolarHBondContact O-N 2.8Å |
| 193 | R | 97.1 | Very high | 95.8 | Very high | 63 Ų | 63 | 59.2 Ų | 59.2 | 24% | 0.238 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -58.2 | -51.3 | 176.3 | -179.8 | -168.1 | 67.3 | -174.4 | 0.4 | 110.9 | L139 A189 D190 K195 H197 V208 N210 | L139-R193 HydrophobicContact CD1-CB 4.37Å; L139-R193 HydrophobicContact CD2-CB 4.45Å; A189-R193 WeakPolarHBondContact O-CB 3.36Å; A189-R193 PolarHBondContact O-N 2.83Å; D190-R193 WeakPolarHBondContact O-CB 3.4Å; D190-R193 PolarHBondContact O-N 3.08Å; D190-R193 IonicContact OD1-CZ 2.61Å; D190-R193 VanDerWaalsContact OD1-CZ 3.25Å; D190-R193 IonicContact OD1-NE 2.78Å; D190-R193 IonicContact OD1-NH1 3.38Å; D190-R193 PolarHBondContact OD1-NH1 3.34Å; D190-R193 IonicContact OD1-NH2 2.9Å; D190-R193 PolarHBondContact OD1-NH2 2.83Å; R193-K195 VanDerWaalsContact C-N 3.3Å; R193-K195 PolarHBondContact O-N 3.08Å; R193-H197 WeakPolarHBondContact O-CB 3.42Å; R193-H197 PolarHBondContact O-N 3.09Å; R193-V208 HydrophobicContact CB-CG1 4.01Å; R193-V208 HydrophobicContact CG-CB 4.21Å; R193-V208 HydrophobicContact CG-CG1 4.01Å; R193-N210 PolarHBondContact NH1-OD1 3.43Å |
| 194 | E | 96.3 | Very high | 95.8 | Very high | 132 Ų | 132 | 63.2 Ų | 63.2 | 62% | 0.617 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -63.9 | -34.8 | -177.3 | -72.6 | 168 | -162.8 | 0 | 0 | 113.1 | D190 R191 | D190-E194 WeakPolarHBondContact O-CG 3.3Å; D190-E194 PolarHBondContact O-N 3.42Å; R191-E194 PolarHBondContact O-N 2.86Å |
| 195 | K | 96.5 | Very high | 95.9 | Very high | 147 Ų | 147 | 65.4 Ų | 65.4 | 64% | 0.639 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -83 | -36.4 | -179 | -68.7 | -64.5 | -176.1 | -175.5 | 0 | 114 | F160 R191 A192 R193 T199 | F160-K195 HydrophobicContact CE1-CB 3.71Å; F160-K195 HydrophobicContact CE1-CG 3.89Å; F160-K195 HydrophobicContact CZ-CB 3.73Å; F160-K195 HydrophobicContact CZ-CG 4.41Å; R191-K195 WeakPolarHBondContact O-CB 3.35Å; R191-K195 WeakPolarHBondContact O-CG 3.36Å; R191-K195 PolarHBondContact O-N 2.97Å; R191-K195 VanDerWaalsContact O-N 3.09Å; A192-K195 PolarHBondContact O-N 3.02Å; R193-K195 VanDerWaalsContact C-N 3.3Å; R193-K195 PolarHBondContact O-N 3.08Å; K195-T199 WeakPolarHBondContact O-CG2 3.31Å |
| 196 | L | 96.4 | Very high | 96 | Very high | 14 Ų | 14 | 63.5 Ų | 63.5 | 7% | 0.073 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -94.8 | -22.8 | -175.2 | -68.2 | 174.5 | 0 | 0 | 0 | 113.3 | M156 F157 F160 A192 G198 T199 I206 V208 | M156-L196 HydrophobicContact CE-CD1 4.48Å; M156-L196 HydrophobicContact CG-CD1 3.97Å; M156-L196 HydrophobicContact CG-CD2 3.83Å; M156-L196 HydrophobicContact SD-CD2 4.27Å; F157-L196 HydrophobicContact CD1-CD1 3.5Å; F157-L196 VanDerWaalsContact CD1-CD1 3.5Å; F157-L196 HydrophobicContact CD2-CD1 4.11Å; F157-L196 HydrophobicContact CE1-CD1 3.35Å; F157-L196 HydrophobicContact CE2-CD1 4Å; F157-L196 HydrophobicContact CG-CD1 3.87Å; F157-L196 HydrophobicContact CZ-CD1 3.61Å; F160-L196 HydrophobicContact CD2-CD1 4.13Å; F160-L196 HydrophobicContact CE2-CD1 3.55Å; F160-L196 HydrophobicContact CE2-CD2 4.08Å; F160-L196 HydrophobicContact CE2-CG 3.63Å; F160-L196 HydrophobicContact CZ-CD1 4.46Å; F160-L196 HydrophobicContact CZ-CD2 4.37Å; F160-L196 HydrophobicContact CZ-CG 4.07Å; A192-L196 VanDerWaalsContact O-CB 3.27Å; A192-L196 WeakPolarHBondContact O-CB 3.46Å; A192-L196 PolarHBondContact O-N 2.8Å; L196-G198 PolarHBondContact O-N 2.82Å; L196-T199 WeakPolarHBondContact O-CB 3.5Å; L196-T199 WeakPolarHBondContact O-CG2 3.09Å; L196-T199 PolarHBondContact O-N 2.85Å; L196-T199 VanDerWaalsContact O-N 3.08Å; L196-T199 PolarHBondContact O-OG1 2.72Å; L196-I206 HydrophobicContact CB-CD1 4.22Å; L196-I206 WeakPolarHBondContact O-CG1 3.04Å; L196-V208 HydrophobicContact CB-CG2 3.96Å |
| 197 | H | 97 | Very high | 96.2 | Very high | 89 Ų | 89 | 65.6 Ų | 65.6 | 41% | 0.412 | 34% | 0.338 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.2 | 123.7 | 177.6 | -177.6 | 93.8 | 0 | 0 | 0 | 110.6 | R193 T199 V208 | R193-H197 WeakPolarHBondContact O-CB 3.42Å; R193-H197 PolarHBondContact O-N 3.09Å; H197-T199 VanDerWaalsContact C-N 3.29Å; H197-T199 PolarHBondContact O-N 3.44Å; H197-V208 HydrophobicContact CB-CB 4.21Å; H197-V208 PolarHBondContact ND1-N 2.76Å; H197-V208 VanDerWaalsContact ND1-N 3.17Å; H197-V208 PolarHBondContact ND1-O 2.97Å |
| 198 | G | 96.1 | Very high | 96.3 | Very high | 23 Ų | 23 | 63.4 Ų | 63.4 | 24% | 0.237 | 32% | 0.32 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 79.6 | 5.6 | 179.7 | 0 | 0 | 0 | 0 | 0 | 115 | L196 K205 I206 | L196-G198 PolarHBondContact O-N 2.82Å; G198-K205 WeakPolarHBondContact O-CE 3.4Å; G198-K205 WeakPolarHBondContact O-CG 3.12Å; G198-I206 VanDerWaalsContact CA-O 3.3Å; G198-I206 WeakPolarHBondContact CA-O 3.49Å; G198-I206 PolarHBondContact N-O 2.86Å |
| 199 | T | 96.4 | Very high | 96.3 | Very high | 46 Ų | 46 | 65.6 Ų | 65.6 | 28% | 0.282 | 33% | 0.332 | S | S | . | . | trans | -72.6 | 153.4 | 172.1 | 60.2 | 0 | 0 | 0 | 0 | 111.2 | K195 L196 H197 K205 I206 | K195-T199 WeakPolarHBondContact O-CG2 3.31Å; L196-T199 WeakPolarHBondContact O-CB 3.5Å; L196-T199 WeakPolarHBondContact O-CG2 3.09Å; L196-T199 PolarHBondContact O-N 2.85Å; L196-T199 VanDerWaalsContact O-N 3.08Å; L196-T199 PolarHBondContact O-OG1 2.72Å; H197-T199 VanDerWaalsContact C-N 3.29Å; H197-T199 PolarHBondContact O-N 3.44Å; T199-K205 CarbonylContact O-C 3.48Å; T199-K205 WeakPolarHBondContact O-CA 3.05Å; T199-I206 WeakPolarHBondContact O-CG1 3.34Å; T199-I206 PolarHBondContact O-N 2.77Å; T199-I206 WeakPolarHBondContact OG1-CD1 3.3Å; T199-I206 VanDerWaalsContact OG1-CG1 3.3Å; T199-I206 WeakPolarHBondContact OG1-CG1 3.19Å | ||
| 200 | V | 96.4 | Very high | 96.3 | Very high | 103 Ų | 103 | 69.8 Ų | 69.8 | 62% | 0.624 | 35% | 0.354 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -100.7 | 121.2 | 179.5 | -178.3 | 0 | 0 | 0 | 0 | 109.3 | R204 K205 | V200-R204 CarbonylContact C-O 3.54Å; V200-R204 WeakPolarHBondContact CA-O 3.35Å; V200-K205 HydrophobicContact CG2-CB 4.45Å |
| 201 | V | 94.3 | Very high | 96.2 | Very high | 27 Ų | 27 | 68.9 Ų | 68.9 | 16% | 0.164 | 35% | 0.352 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.1 | 122.1 | -179.2 | -175.1 | 0 | 0 | 0 | 0 | 108.4 | F148 M156 G203 R204 I206 | F148-V201 HydrophobicContact CE1-CG1 4.2Å; F148-V201 HydrophobicContact CE2-CG1 4.09Å; F148-V201 HydrophobicContact CZ-CG1 3.43Å; F148-V201 VanDerWaalsContact CZ-CG1 3.43Å; M156-V201 HydrophobicContact SD-CG2 3.93Å; V201-G203 PolarHBondContact O-N 2.89Å; V201-G203 VanDerWaalsContact O-N 3.13Å; V201-R204 PolarHBondContact N-O 2.78Å; V201-R204 PolarHBondContact O-N 2.97Å; V201-I206 HydrophobicContact CB-CG2 3.95Å; V201-I206 HydrophobicContact CG2-CD1 4Å; V201-I206 HydrophobicContact CG2-CG1 4.24Å; V201-I206 HydrophobicContact CG2-CG2 3.88Å |
| 202 | E | 93.1 | Very high | 95.8 | Very high | 141 Ų | 141 | 69.4 Ų | 69.4 | 66% | 0.659 | 37% | 0.368 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.5 | 37.7 | -173.1 | -55.3 | -167.7 | 140.3 | 0 | 0 | 113.6 | P145 F148 R204 | P145-E202 HydrophobicContact CB-CB 4.49Å; P145-E202 WeakPolarHBondContact CB-OE2 3.29Å; P145-E202 HydrophobicContact CG-CB 3.77Å; P145-E202 HydrophobicContact CG-CG 4.01Å; P145-E202 WeakPolarHBondContact CG-OE2 3.3Å; F148-E202 HydrophobicContact CE2-CG 4.48Å; E202-R204 VanDerWaalsContact C-N 3.3Å; E202-R204 PolarHBondContact O-N 2.96Å |
| 203 | G | 94.8 | Very high | 94.9 | Very high | 71 Ų | 71 | 73 Ų | 73 | 73% | 0.732 | 40% | 0.398 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 79.2 | 5.5 | -179.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | V201 | V201-G203 PolarHBondContact O-N 2.89Å; V201-G203 VanDerWaalsContact O-N 3.13Å |
| 204 | R | 96 | Very high | 94 | Very high | 84 Ų | 84 | 75.5 Ų | 75.5 | 32% | 0.317 | 41% | 0.408 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.5 | 131.6 | 175.2 | -65.1 | -175.6 | 169.9 | -179.2 | -4 | 111.3 | I144 V200 V201 E202 I206 | I144-R204 PolarHBondContact O-NH1 3.26Å; V200-R204 CarbonylContact C-O 3.54Å; V200-R204 WeakPolarHBondContact CA-O 3.35Å; V201-R204 PolarHBondContact N-O 2.78Å; V201-R204 PolarHBondContact O-N 2.97Å; E202-R204 VanDerWaalsContact C-N 3.3Å; E202-R204 PolarHBondContact O-N 2.96Å; R204-I206 PolarHBondContact O-N 3.33Å |
| 205 | K | 97.4 | Very high | 92.9 | Very high | 124 Ų | 124 | 75.7 Ų | 75.7 | 54% | 0.539 | 42% | 0.417 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.4 | 105.7 | 175 | -172.4 | 177.4 | -178.8 | -177.5 | 0 | 109.9 | N143 G198 T199 V200 | N143-K205 WeakPolarHBondContact CB-O 3.22Å; N143-K205 PolarHBondContact ND2-O 3.49Å; G198-K205 WeakPolarHBondContact O-CE 3.4Å; G198-K205 WeakPolarHBondContact O-CG 3.12Å; T199-K205 CarbonylContact O-C 3.48Å; T199-K205 WeakPolarHBondContact O-CA 3.05Å; V200-K205 HydrophobicContact CG2-CB 4.45Å |
| 206 | I | 97.6 | Very high | 91.4 | Very high | 0 Ų | 0 | 76.8 Ų | 76.8 | 0% | 0 | 43% | 0.427 | C | S | . | . | trans | -75.5 | 149.8 | -179.7 | 68 | 166.7 | 0 | 0 | 0 | 110.7 | S142 I144 M156 L196 G198 T199 V201 R204 | S142-I206 WeakPolarHBondContact O-CA 3.44Å; I144-I206 HydrophobicContact CG2-CB 4.49Å; I144-I206 HydrophobicContact CG2-CG2 3.95Å; M156-I206 HydrophobicContact CE-CD1 3.58Å; M156-I206 HydrophobicContact SD-CD1 3.96Å; L196-I206 HydrophobicContact CB-CD1 4.22Å; L196-I206 WeakPolarHBondContact O-CG1 3.04Å; G198-I206 VanDerWaalsContact CA-O 3.3Å; G198-I206 WeakPolarHBondContact CA-O 3.49Å; G198-I206 PolarHBondContact N-O 2.86Å; T199-I206 WeakPolarHBondContact O-CG1 3.34Å; T199-I206 PolarHBondContact O-N 2.77Å; T199-I206 WeakPolarHBondContact OG1-CD1 3.3Å; T199-I206 VanDerWaalsContact OG1-CG1 3.3Å; T199-I206 WeakPolarHBondContact OG1-CG1 3.19Å; V201-I206 HydrophobicContact CB-CG2 3.95Å; V201-I206 HydrophobicContact CG2-CD1 4Å; V201-I206 HydrophobicContact CG2-CG1 4.24Å; V201-I206 HydrophobicContact CG2-CG2 3.88Å; R204-I206 PolarHBondContact O-N 3.33Å | ||
| 207 | E | 97.1 | Very high | 89.8 | Confident | 89 Ų | 89 | 81.2 Ų | 81.2 | 42% | 0.416 | 45% | 0.454 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.1 | 127.8 | 177 | -66.1 | -177.4 | 174.7 | 0 | 0 | 109.5 | V141 S142 | V141-E207 CarbonylContact C-O 3.53Å; V141-E207 WeakPolarHBondContact CA-O 3.34Å; S142-E207 PolarHBondContact N-O 2.79Å; S142-E207 PolarHBondContact O-N 3.25Å |
| 208 | V | 97.8 | Very high | 87.8 | Confident | 0 Ų | 0 | 83.6 Ų | 83.6 | 0% | 0 | 47% | 0.47 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.7 | 122.5 | 176.4 | -169.3 | 0 | 0 | 0 | 0 | 109 | L139 H140 V141 F157 R193 L196 H197 | L139-V208 HydrophobicContact CB-CG1 4.11Å; L139-V208 HydrophobicContact CD1-CG1 3.88Å; L139-V208 HydrophobicContact CG-CG1 4.45Å; H140-V208 CarbonylContact O-C 3.48Å; H140-V208 WeakPolarHBondContact O-CA 3.39Å; V141-V208 HydrophobicContact CG1-CG2 4.37Å; V141-V208 HydrophobicContact CG2-CG1 4.47Å; F157-V208 HydrophobicContact CE1-CG1 4.1Å; F157-V208 HydrophobicContact CE1-CG2 4.16Å; F157-V208 HydrophobicContact CZ-CG1 4.35Å; F157-V208 HydrophobicContact CZ-CG2 3.83Å; R193-V208 HydrophobicContact CB-CG1 4.01Å; R193-V208 HydrophobicContact CG-CB 4.21Å; R193-V208 HydrophobicContact CG-CG1 4.01Å; L196-V208 HydrophobicContact CB-CG2 3.96Å; H197-V208 HydrophobicContact CB-CB 4.21Å; H197-V208 PolarHBondContact ND1-N 2.76Å; H197-V208 VanDerWaalsContact ND1-N 3.17Å; H197-V208 PolarHBondContact ND1-O 2.97Å |
| 209 | N | 96.9 | Very high | 85.8 | Confident | 72 Ų | 72 | 90.8 Ų | 90.8 | 39% | 0.385 | 50% | 0.495 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.7 | 163.3 | -179.5 | -75.8 | -42.6 | 0 | 0 | 0 | 110.4 | L139 H140 A211 | L139-N209 CarbonylContact C-O 3.52Å; L139-N209 WeakPolarHBondContact CA-O 3.39Å; H140-N209 PolarHBondContact N-O 3.34Å; H140-N209 PolarHBondContact O-N 3.19Å; N209-A211 PolarHBondContact O-N 3.41Å |
| 210 | N | 95.8 | Very high | 83.8 | Confident | 87 Ų | 87 | 96.9 Ų | 96.9 | 47% | 0.465 | 52% | 0.518 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -65.8 | 133.8 | 169.9 | -67 | -5.4 | 0 | 0 | 0 | 108.9 | R193 | R193-N210 PolarHBondContact NH1-OD1 3.43Å |
| 211 | A | 94 | Very high | 81.8 | Confident | 19 Ų | 19 | 97.5 Ų | 97.5 | 16% | 0.157 | 52% | 0.522 | C | S | . | . | P | Polyproline II helix | trans | -85.1 | 148.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | R138 H140 F180 N209 A213 | R138-A211 HydrophobicContact CB-CB 4Å; R138-A211 HydrophobicContact CG-CB 3.74Å; R138-A211 WeakPolarHBondContact O-CB 3.17Å; R138-A211 PolarHBondContact O-N 2.75Å; H140-A211 HydrophobicContact CB-CB 4.09Å; F180-A211 HydrophobicContact CD1-CB 3.75Å; F180-A211 HydrophobicContact CE1-CB 4.05Å; N209-A211 PolarHBondContact O-N 3.41Å; A211-A213 PolarHBondContact O-N 2.73Å |
| 212 | T | 87.3 | Confident | 80 | Confident | 127 Ų | 127 | 101.4 Ų | 101.4 | 78% | 0.779 | 55% | 0.545 | S | S | * | . | P | Polyproline II helix | trans | -60.8 | 129.8 | 161.7 | -47.5 | 0 | 0 | 0 | 0 | 108.4 | R138 R214 | R138-T212 PolarHBondContact NH1-O 2.98Å; T212-R214 PolarHBondContact O-N 3.43Å |
| 213 | A | 77.7 | Confident | 78.1 | Confident | 76 Ų | 76 | 99.6 Ų | 99.6 | 63% | 0.628 | 54% | 0.54 | S | S | * | . | P | Polyproline II helix | trans | -53.8 | 137.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | A211 V215 | A211-A213 PolarHBondContact O-N 2.73Å; A213-V215 PolarHBondContact O-N 2.67Å |
| 214 | R | 78.7 | Confident | 76.4 | Confident | 115 Ų | 115 | 101.9 Ų | 101.9 | 43% | 0.434 | 54% | 0.542 | S | S | . | . | P | Polyproline II helix | trans | -62.6 | 126 | 165.7 | -78.7 | 174.5 | 156.8 | 179.4 | -18.1 | 106.2 | D165 E167 T212 M216 | D165-R214 IonicContact OD2-NH1 3.7Å; D165-R214 PolarHBondContact OD2-NH1 2.91Å; E167-R214 IonicContact OE1-CZ 2.98Å; E167-R214 IonicContact OE1-NH2 3.43Å; E167-R214 PolarHBondContact OE1-NH2 3.23Å; E167-R214 IonicContact OE2-CZ 3.25Å; E167-R214 IonicContact OE2-NE 3.66Å; E167-R214 PolarHBondContact OE2-NE 3.23Å; E167-R214 IonicContact OE2-NH1 3.88Å; E167-R214 IonicContact OE2-NH2 3.34Å; E167-R214 PolarHBondContact OE2-NH2 3.11Å; T212-R214 PolarHBondContact O-N 3.43Å; R214-M216 PolarHBondContact O-N 2.75Å |
| 215 | V | 73.3 | Confident | 74.3 | Confident | 136 Ų | 136 | 108.7 Ų | 108.7 | 82% | 0.824 | 57% | 0.57 | S | S | * | * | trans | -65.3 | 90.3 | 168.2 | 179.4 | 0 | 0 | 0 | 0 | 106.3 | A213 T217 | A213-V215 PolarHBondContact O-N 2.67Å; V215-T217 PolarHBondContact O-N 2.82Å | ||
| 216 | M | 65.9 | Low | 72.4 | Confident | 169 Ų | 169 | 106.9 Ų | 106.9 | 83% | 0.833 | 57% | 0.569 | S | S | * | * | trans | -70.9 | 88.6 | 165.3 | -78.2 | 179 | 159.3 | 0 | 0 | 105.6 | R214 N218 | R214-M216 PolarHBondContact O-N 2.75Å; M216-N218 PolarHBondContact O-N 2.92Å | ||
| 217 | T | 62.8 | Low | 69.9 | Low | 107 Ų | 107 | 114 Ų | 114 | 66% | 0.656 | 61% | 0.607 | S | S | * | * | trans | -60.1 | 96.9 | 155.1 | 152 | 0 | 0 | 0 | 0 | 104.7 | V215 K219 | V215-T217 PolarHBondContact O-N 2.82Å; T217-K219 PolarHBondContact O-N 2.74Å | ||
| 218 | N | 53.8 | Low | 67.8 | Low | 140 Ų | 140 | 113.2 Ų | 113.2 | 75% | 0.749 | 62% | 0.623 | S | S | * | * | trans | -67.6 | 78.4 | 172.5 | -163.8 | -33.9 | 0 | 0 | 0 | 105.4 | M216 K220 | M216-N218 PolarHBondContact O-N 2.92Å; N218-K220 PolarHBondContact O-N 3.42Å; N218-K220 PolarHBondContact OD1-N 2.78Å | ||
| 219 | K | 55.6 | Low | 65.4 | Low | 174 Ų | 174 | 124.6 Ų | 124.6 | 76% | 0.757 | 67% | 0.666 | S | S | * | * | trans | -65.2 | 85.5 | 157.7 | -68.7 | -167.7 | 72.8 | 173.2 | 0 | 104 | T217 T221 | T217-K219 PolarHBondContact O-N 2.74Å; K219-T221 PolarHBondContact O-N 2.81Å | ||
| 220 | K | 53.3 | Low | 63.1 | Low | 174 Ų | 174 | 130 Ų | 130 | 76% | 0.757 | 69% | 0.686 | S | S | * | * | trans | -55.4 | 102.6 | 156.6 | -169.7 | 149.6 | -172.5 | 169.5 | 0 | 103.5 | N218 V222 | N218-K220 PolarHBondContact O-N 3.42Å; N218-K220 PolarHBondContact OD1-N 2.78Å; K220-V222 PolarHBondContact O-N 3.45Å | ||
| 221 | T | 55.1 | Low | 60.9 | Low | 115 Ų | 115 | 132.3 Ų | 132.3 | 71% | 0.706 | 70% | 0.698 | S | S | * | * | trans | -58.6 | 92.4 | 165.2 | -63 | 0 | 0 | 0 | 0 | 104.1 | K219 N223 | K219-T221 PolarHBondContact O-N 2.81Å; T221-N223 VanDerWaalsContact C-N 3.3Å; T221-N223 PolarHBondContact O-N 3.37Å; T221-N223 PolarHBondContact O-OD1 3.45Å | ||
| 222 | V | 56 | Low | 58.4 | Low | 109 Ų | 109 | 137.8 Ų | 137.8 | 66% | 0.661 | 73% | 0.725 | S | S | * | * | trans | -63.3 | 105.2 | 164.3 | 159.1 | 0 | 0 | 0 | 0 | 103.2 | K220 P224 | K220-V222 PolarHBondContact O-N 3.45Å; V222-P224 WeakPolarHBondContact O-CD 3.34Å; V222-P224 VanDerWaalsContact O-N 3.16Å | ||
| 223 | N | 53.7 | Low | 56.9 | Low | 103 Ų | 103 | 138 Ų | 138 | 55% | 0.551 | 73% | 0.728 | S | S | * | * | trans | -52.8 | 122 | 164 | -71 | 30.8 | 0 | 0 | 0 | 106.1 | T221 Y225 T226 | T221-N223 VanDerWaalsContact C-N 3.3Å; T221-N223 PolarHBondContact O-N 3.37Å; T221-N223 PolarHBondContact O-OD1 3.45Å; N223-Y225 PolarHBondContact O-N 2.72Å; N223-T226 HydrophobicContact CB-CG2 4.2Å; N223-T226 PolarHBondContact O-N 3.02Å | ||
| 224 | P | 59.4 | Low | 55.6 | Low | 120 Ų | 120 | 140.1 Ų | 140.1 | 78% | 0.779 | 73% | 0.733 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66 | 7.4 | -178 | 25.5 | -33.8 | 0 | 0 | 0 | 114.2 | V222 | V222-P224 WeakPolarHBondContact O-CD 3.34Å; V222-P224 VanDerWaalsContact O-N 3.16Å |
| 225 | Y | 51.8 | Low | 54.3 | Low | 227 Ų | 227 | 141.5 Ų | 141.5 | 89% | 0.89 | 75% | 0.754 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.5 | 3 | -177 | -80.8 | -68.7 | 0 | 0 | 0 | 115.3 | N223 | N223-Y225 PolarHBondContact O-N 2.72Š|
| 226 | T | 57.1 | Low | 53 | Low | 86 Ų | 86 | 138.9 Ų | 138.9 | 53% | 0.528 | 75% | 0.754 | S | S | . | * | S | Bend | trans | -122.4 | 90.7 | 175.3 | 178.8 | 0 | 0 | 0 | 0 | 109.3 | N223 | N223-T226 HydrophobicContact CB-CG2 4.2Å; N223-T226 PolarHBondContact O-N 3.02Å |
| 227 | N | 44.6 | Very low | 52.4 | Low | 149 Ų | 149 | 135.5 Ų | 135.5 | 80% | 0.797 | 75% | 0.753 | S | S | * | * | S | Bend | 156.1 | 110.9 | 128.7 | -78.4 | -60.3 | 0 | 0 | 0 | 111.1 | |||
| 228 | G | 52.3 | Low | 51.8 | Low | 73 Ų | 73 | 136.8 Ų | 136.8 | 75% | 0.753 | 76% | 0.761 | S | S | * | * | 64.6 | 76.8 | 123.5 | 0 | 0 | 0 | 0 | 0 | 118.2 | K230 | G228-K230 PolarHBondContact O-N 2.83Š| |||
| 229 | W | 48.9 | Very low | 51.1 | Low | 239 Ų | 239 | 140.7 Ų | 140.7 | 91% | 0.905 | 77% | 0.767 | S | S | * | * | trans | -70 | 77.3 | 145.6 | -71 | 95.3 | 0 | 0 | 0 | 108.8 | L231 | W229-L231 HydrophobicContact CB-CG 4.47Å; W229-L231 HydrophobicContact CE3-CD2 4.03Å; W229-L231 PolarHBondContact O-N 3.38Å | ||
| 230 | K | 49 | Very low | 50.1 | Low | 186 Ų | 186 | 137.8 Ų | 137.8 | 81% | 0.809 | 77% | 0.768 | S | S | * | * | trans | -75.7 | 82.1 | 160 | -171.5 | 173.9 | 173.5 | -178.1 | 0 | 106.4 | G228 N232 | G228-K230 PolarHBondContact O-N 2.83Å; K230-N232 PolarHBondContact O-N 3.47Å | ||
| 231 | L | 48.8 | Very low | 49.8 | Very low | 134 Ų | 134 | 134.6 Ų | 134.6 | 70% | 0.702 | 77% | 0.765 | S | S | * | * | trans | -61 | 119 | 169.9 | -66.7 | 171.8 | 0 | 0 | 0 | 107.9 | W229 | W229-L231 HydrophobicContact CB-CG 4.47Å; W229-L231 HydrophobicContact CE3-CD2 4.03Å; W229-L231 PolarHBondContact O-N 3.38Å | ||
| 232 | N | 41.7 | Very low | 49 | Very low | 135 Ų | 135 | 136.4 Ų | 136.4 | 72% | 0.722 | 77% | 0.766 | S | S | * | * | trans | -67.9 | 125.3 | 161.7 | -74.4 | -26.7 | 0 | 0 | 0 | 107.5 | K230 V234 | K230-N232 PolarHBondContact O-N 3.47Å; N232-V234 PolarHBondContact O-N 3.41Å | ||
| 233 | P | 55.4 | Low | 48.1 | Very low | 131 Ų | 131 | 141 Ų | 141 | 85% | 0.851 | 78% | 0.777 | S | S | * | * | S | Bend | trans | -82.5 | 29.5 | -168.5 | 33.1 | -37.3 | 0 | 0 | 0 | 115 | ||
| 234 | V | 50.7 | Low | 47.5 | Very low | 120 Ų | 120 | 146.1 Ų | 146.1 | 73% | 0.727 | 79% | 0.79 | S | S | * | * | S | Bend | trans | -138.7 | 133.5 | 177.8 | 149.7 | 0 | 0 | 0 | 0 | 108 | N232 | N232-V234 PolarHBondContact O-N 3.41Š|
| 235 | V | 50.4 | Low | 46.3 | Very low | 144 Ų | 144 | 145 Ų | 145 | 87% | 0.873 | 79% | 0.791 | S | S | * | * | S | Bend | trans | 90.9 | 26.9 | -177.3 | -152.6 | 0 | 0 | 0 | 0 | 116.9 | ||
| 236 | G | 47.7 | Very low | 45.5 | Very low | 81 Ų | 81 | 137.4 Ų | 137.4 | 84% | 0.835 | 78% | 0.782 | S | S | * | * | trans | -98.7 | 3.7 | 168.1 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 237 | A | 52 | Low | 44.7 | Very low | 99 Ų | 99 | 139.9 Ų | 139.9 | 82% | 0.818 | 80% | 0.797 | S | S | * | * | trans | -102.1 | 12.6 | -164.3 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 238 | V | 49.9 | Very low | 44.2 | Very low | 134 Ų | 134 | 139.2 Ų | 139.2 | 81% | 0.812 | 80% | 0.798 | S | S | * | * | S | Bend | trans | -129.6 | 118.6 | 175.2 | 172.8 | 0 | 0 | 0 | 0 | 108.8 | ||
| 239 | Y | 39.2 | Very low | 43.5 | Very low | 221 Ų | 221 | 143 Ų | 143 | 87% | 0.867 | 80% | 0.801 | S | S | * | * | trans | 87 | 85.3 | 177.1 | -108.9 | -98.1 | 0 | 0 | 0 | 117.4 | ||||
| 240 | S | 34.2 | Very low | 42.9 | Very low | 113 Ų | 113 | 139.2 Ų | 139.2 | 79% | 0.79 | 80% | 0.797 | S | S | * | * | trans | -124.9 | 130.8 | 146.8 | -70.9 | 0 | 0 | 0 | 0 | 108 | ||||
| 241 | P | 47.2 | Very low | 42 | Very low | 108 Ų | 108 | 135.2 Ų | 135.2 | 70% | 0.701 | 79% | 0.791 | S | S | * | * | trans | -82.6 | 122.1 | 165.2 | 30.6 | -25.8 | 0 | 0 | 0 | 109.1 | F243 | P241-F243 PolarHBondContact O-N 3.39Š| ||
| 242 | E | 39.9 | Very low | 41.1 | Very low | 153 Ų | 153 | 137.1 Ų | 137.1 | 72% | 0.715 | 80% | 0.797 | S | S | * | * | trans | -44.4 | 121.9 | 165.6 | -75.9 | -85.3 | 146 | 0 | 0 | 111.8 | ||||
| 243 | F | 36.9 | Very low | 40.6 | Very low | 204 Ų | 204 | 134.4 Ų | 134.4 | 90% | 0.895 | 79% | 0.793 | S | S | * | * | trans | -131.5 | 105 | 144.7 | -92.7 | -79 | 0 | 0 | 0 | 109.4 | P241 | P241-F243 PolarHBondContact O-N 3.39Š| ||
| 244 | Y | 39.4 | Very low | 39.4 | Very low | 211 Ų | 211 | 135.7 Ų | 135.7 | 83% | 0.827 | 79% | 0.793 | S | S | * | * | trans | -54.1 | 121.6 | 171.3 | -139.5 | -99.9 | 0 | 0 | 0 | 111.4 | ||||
| 245 | A | 35 | Very low | 38.5 | Very low | 97 Ų | 97 | 138 Ų | 138 | 80% | 0.802 | 80% | 0.796 | S | S | * | * | trans | -163.4 | 101.9 | 150.9 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 246 | G | 35.2 | Very low | 37.5 | Very low | 67 Ų | 67 | 138.8 Ų | 138.8 | 69% | 0.691 | 79% | 0.79 | S | S | * | * | trans | -70.3 | 158.8 | -173.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 247 | T | 40.1 | Very low | 36.6 | Very low | 139 Ų | 139 | 138.8 Ų | 138.8 | 85% | 0.853 | 79% | 0.79 | S | S | * | * | trans | -163.3 | 109.1 | 140.7 | 22.5 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 248 | V | 34.2 | Very low | 35.9 | Very low | 135 Ų | 135 | 139.8 Ų | 139.8 | 82% | 0.818 | 79% | 0.791 | S | S | * | * | trans | 36.5 | 113 | 140.7 | -170.6 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 249 | L | 38.4 | Very low | 34.9 | Very low | 153 Ų | 153 | 138.4 Ų | 138.4 | 80% | 0.801 | 79% | 0.787 | S | S | * | * | trans | -63.1 | 120.9 | 166.1 | -150.8 | 156.3 | 0 | 0 | 0 | 110.7 | C251 | L249-C251 HydrophobicContact CD2-CB 4.27Š| ||
| 250 | L | 34.8 | Very low | 34.4 | Very low | 159 Ų | 159 | 135.6 Ų | 135.6 | 83% | 0.832 | 78% | 0.784 | S | S | * | * | trans | -141.6 | 87.5 | 152.5 | -102.8 | 155.1 | 0 | 0 | 0 | 107.7 | Q252 | L250-Q252 PolarHBondContact O-N 2.94Š| ||
| 251 | C | 31.6 | Very low | 34.4 | Very low | 102 Ų | 102 | 140.9 Ų | 140.9 | 69% | 0.689 | 79% | 0.788 | S | S | * | * | trans | -67.5 | 118.2 | 163.6 | 167.4 | 0 | 0 | 0 | 0 | 107.9 | L249 | L249-C251 HydrophobicContact CD2-CB 4.27Š| ||
| 252 | Q | 29.7 | Very low | 33.5 | Very low | 173 Ų | 173 | 140.9 Ų | 140.9 | 81% | 0.808 | 79% | 0.791 | S | S | * | * | trans | -116.3 | 101.5 | 158.6 | -163.7 | 120.3 | 26.9 | 0 | 0 | 107.7 | L250 | L250-Q252 PolarHBondContact O-N 2.94Š| ||
| 253 | A | 31.1 | Very low | 33.1 | Very low | 78 Ų | 78 | 137.7 Ų | 137.7 | 65% | 0.645 | 79% | 0.79 | S | S | * | * | trans | -61.3 | 136.8 | 169.8 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 254 | N | 30.8 | Very low | 33.5 | Very low | 159 Ų | 159 | 133.4 Ų | 133.4 | 85% | 0.85 | 78% | 0.783 | S | S | * | * | trans | -141.4 | 91.6 | 158.9 | -90.3 | -41.7 | 0 | 0 | 0 | 108.2 | ||||
| 255 | Q | 29.8 | Very low | 33.3 | Very low | 168 Ų | 168 | 128.7 Ų | 128.7 | 79% | 0.785 | 78% | 0.781 | S | S | * | * | trans | -125.5 | 137.2 | 154.2 | -85.5 | 172.6 | 14.8 | 0 | 0 | 103.1 | ||||
| 256 | E | 30.4 | Very low | 33.2 | Very low | 160 Ų | 160 | 129 Ų | 129 | 75% | 0.748 | 78% | 0.777 | S | S | * | * | cis | -175.4 | 142.7 | 7.3 | 44.4 | -153 | 138.8 | 0 | 0 | 104.4 | S258 | E256-S258 PolarHBondContact O-N 3.01Š| ||
| 257 | G | 28.6 | Very low | 33.2 | Very low | 82 Ų | 82 | 133.4 Ų | 133.4 | 85% | 0.845 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 124.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||
| 258 | S | 36.5 | Very low | 32.8 | Very low | 120 Ų | 120 | 133.1 Ų | 133.1 | 84% | 0.839 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 149.6 | 177.8 | -31.6 | 0 | 0 | 0 | 0 | 113.5 | E256 | E256-S258 PolarHBondContact O-N 3.01Š|
| 259 | S | 30.5 | Very low | 32.7 | Very low | 104 Ų | 104 | 137.5 Ų | 137.5 | 73% | 0.727 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -95.8 | 120.3 | 151 | 161.8 | 0 | 0 | 0 | 0 | 108.2 | ||
| 260 | M | 28.9 | Very low | 32.4 | Very low | 163 Ų | 163 | 136.9 Ų | 136.9 | 80% | 0.803 | 79% | 0.788 | S | S | * | * | 174.8 | 114.7 | 126.9 | -88.1 | -49 | -152.9 | 0 | 0 | 111.4 | |||||
| 261 | Y | 33 | Very low | 32.6 | Very low | 223 Ų | 223 | 134 Ų | 134 | 88% | 0.875 | 78% | 0.781 | S | S | * | * | trans | 55.4 | 134.7 | 138.4 | -121.4 | -99.2 | 0 | 0 | 0 | 124.1 | ||||
| 262 | S | 27.9 | Very low | 32.6 | Very low | 108 Ų | 108 | 133.6 Ų | 133.6 | 76% | 0.755 | 79% | 0.785 | S | S | * | * | trans | 90.8 | 110.1 | 152.3 | -145.1 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 263 | A | 32.9 | Very low | 33 | Very low | 86 Ų | 86 | 134 Ų | 134 | 71% | 0.711 | 79% | 0.79 | S | S | * | * | trans | -60.1 | 167 | 154.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 264 | P | 44.6 | Very low | 33.4 | Very low | 114 Ų | 114 | 136.1 Ų | 136.1 | 74% | 0.74 | 80% | 0.797 | S | S | * | * | cis | -141.7 | 163.2 | 32.8 | 38.6 | -17.2 | 0 | 0 | 0 | 119.3 | ||||
| 265 | S | 35.1 | Very low | 33.5 | Very low | 112 Ų | 112 | 131.3 Ų | 131.3 | 78% | 0.783 | 79% | 0.785 | S | S | * | * | trans | 55.5 | 114.6 | 141.9 | -60.6 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 266 | S | 32.3 | Very low | 33.7 | Very low | 104 Ų | 104 | 133.5 Ų | 133.5 | 73% | 0.727 | 79% | 0.792 | S | S | * | * | 137.5 | 130.5 | 107.8 | 65.9 | 0 | 0 | 0 | 0 | 115.6 | |||||
| 267 | L | 35.2 | Very low | 34.5 | Very low | 159 Ų | 159 | 131.1 Ų | 131.1 | 83% | 0.832 | 79% | 0.791 | S | S | * | * | trans | 55.6 | 125.8 | 146.6 | -68.6 | 157.1 | 0 | 0 | 0 | 117.7 | ||||
| 268 | V | 32 | Very low | 35 | Very low | 134 Ų | 134 | 138.1 Ų | 138.1 | 81% | 0.812 | 79% | 0.793 | S | S | * | * | -168.5 | 149.6 | 55.2 | -89.8 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 269 | Y | 33.6 | Very low | 35.6 | Very low | 227 Ų | 227 | 138.4 Ų | 138.4 | 89% | 0.89 | 79% | 0.792 | S | S | * | * | trans | -87.7 | 134.7 | 172.8 | -156.7 | -95.5 | 0 | 0 | 0 | 109.7 | ||||
| 270 | T | 31.9 | Very low | 36 | Very low | 139 Ų | 139 | 138 Ų | 138 | 85% | 0.853 | 80% | 0.795 | S | S | * | * | trans | -147.7 | 138.9 | 157.3 | -180 | 0 | 0 | 0 | 0 | 112 | ||||
| 271 | S | 38.2 | Very low | 36.4 | Very low | 98 Ų | 98 | 134.7 Ų | 134.7 | 69% | 0.685 | 79% | 0.794 | S | S | * | * | trans | -75 | 152.2 | -167.9 | 150.2 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 272 | A | 32.1 | Very low | 36.3 | Very low | 94 Ų | 94 | 130.7 Ų | 130.7 | 78% | 0.777 | 79% | 0.793 | S | S | * | * | trans | -168.8 | 119.9 | 135.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 273 | M | 38.3 | Very low | 36.6 | Very low | 182 Ų | 182 | 130 Ų | 130 | 90% | 0.897 | 79% | 0.793 | S | S | * | * | trans | -80.6 | 146.7 | 155.9 | -74.5 | -78.3 | -176.9 | 0 | 0 | 109.2 | ||||
| 274 | P | 39.5 | Very low | 36.7 | Very low | 122 Ų | 122 | 131.1 Ų | 131.1 | 79% | 0.792 | 80% | 0.803 | S | S | * | * | -147.5 | 142.9 | 96.7 | 31.4 | -11.5 | 0 | 0 | 0 | 112.7 | |||||
| 275 | G | 32.3 | Very low | 36.5 | Very low | 59 Ų | 59 | 130.4 Ų | 130.4 | 61% | 0.608 | 81% | 0.807 | S | S | * | * | 83.3 | 119 | 70.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 276 | F | 33.5 | Very low | 36.6 | Very low | 213 Ų | 213 | 129.7 Ų | 129.7 | 93% | 0.934 | 81% | 0.807 | S | S | * | * | trans | 165.3 | 162.2 | 149.6 | -93.7 | -56.5 | 0 | 0 | 0 | 113.7 | ||||
| 277 | P | 47.8 | Very low | 36.8 | Very low | 110 Ų | 110 | 136 Ų | 136 | 71% | 0.714 | 82% | 0.817 | S | S | * | * | -116.1 | 171.6 | -121.4 | 42.1 | -28.6 | 0 | 0 | 0 | 115.8 | |||||
| 278 | Y | 39.8 | Very low | 37 | Very low | 230 Ų | 230 | 139.9 Ų | 139.9 | 90% | 0.902 | 82% | 0.82 | S | S | * | * | trans | -83.3 | 156.3 | 168.8 | -85.5 | -88.8 | 0 | 0 | 0 | 113 | ||||
| 279 | P | 49.2 | Very low | 36.9 | Very low | 125 Ų | 125 | 136.3 Ų | 136.3 | 81% | 0.812 | 81% | 0.811 | S | S | * | * | trans | -125.9 | 152.4 | 140.1 | 35.3 | -23.5 | 0 | 0 | 0 | 113 | ||||
| 280 | A | 37.3 | Very low | 37 | Very low | 96 Ų | 96 | 130.1 Ų | 130.1 | 79% | 0.793 | 81% | 0.806 | S | S | * | * | trans | -105.7 | 155.7 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 281 | A | 38.5 | Very low | 37.5 | Very low | 94 Ų | 94 | 132.9 Ų | 132.9 | 78% | 0.777 | 81% | 0.809 | S | S | * | * | trans | 66.5 | 129.6 | 158.9 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 282 | T | 30.9 | Very low | 37.8 | Very low | 139 Ų | 139 | 136.5 Ų | 136.5 | 85% | 0.853 | 82% | 0.82 | S | S | * | * | 173.5 | 138.9 | 110 | -61.2 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 283 | A | 34.7 | Very low | 38.2 | Very low | 93 Ų | 93 | 144.1 Ų | 144.1 | 77% | 0.769 | 83% | 0.829 | S | S | * | * | trans | 9 | 121.3 | 163 | 0 | 0 | 0 | 0 | 0 | 121 | ||||
| 284 | A | 34.2 | Very low | 37.8 | Very low | 110 Ų | 110 | 138.9 Ų | 138.9 | 91% | 0.909 | 82% | 0.821 | S | S | * | * | trans | -97.9 | 103.4 | 159.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 285 | A | 40 | Very low | 38 | Very low | 99 Ų | 99 | 145.5 Ų | 145.5 | 82% | 0.818 | 83% | 0.831 | S | S | * | * | trans | -100.2 | 117.2 | 153 | 0 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 286 | A | 37.7 | Very low | 38 | Very low | 97 Ų | 97 | 146 Ų | 146 | 80% | 0.802 | 84% | 0.836 | S | S | * | * | trans | -147 | 94.9 | 168.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 287 | Y | 36.8 | Very low | 38.4 | Very low | 235 Ų | 235 | 148 Ų | 148 | 92% | 0.922 | 84% | 0.837 | S | S | * | * | trans | -56.5 | 127.1 | 156.6 | -132.6 | -103.9 | 0 | 0 | 0 | 108.7 | ||||
| 288 | R | 37.9 | Very low | 37.9 | Very low | 241 Ų | 241 | 149 Ų | 149 | 91% | 0.909 | 84% | 0.841 | S | S | * | * | trans | -149.7 | 115.5 | 151.2 | -154.3 | -165.7 | -77.5 | -129.3 | 5.4 | 111.1 | ||||
| 289 | G | 31.9 | Very low | 37.8 | Very low | 59 Ų | 59 | 144.3 Ų | 144.3 | 61% | 0.608 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 158.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||
| 290 | A | 35.1 | Very low | 37 | Very low | 97 Ų | 97 | 148.6 Ų | 148.6 | 80% | 0.802 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 144.6 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||
| 291 | H | 42.1 | Very low | 37 | Very low | 197 Ų | 197 | 150 Ų | 150 | 91% | 0.912 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -99.8 | 124.7 | 155.7 | -78.1 | -78.5 | 0 | 0 | 0 | 109.4 | ||
| 292 | L | 44.5 | Very low | 37.1 | Very low | 174 Ų | 174 | 151.8 Ų | 151.8 | 91% | 0.911 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 136.7 | -179.3 | -68.5 | 154.1 | 0 | 0 | 0 | 111.7 | ||
| 293 | R | 39.9 | Very low | 37.5 | Very low | 254 Ų | 254 | 153.5 Ų | 153.5 | 96% | 0.958 | 83% | 0.83 | S | S | * | * | trans | -149.5 | 112.9 | 147 | -152.5 | 176.2 | -151.7 | -179.6 | 6.5 | 111.1 | ||||
| 294 | G | 29.8 | Very low | 37.7 | Very low | 72 Ų | 72 | 160.7 Ų | 160.7 | 74% | 0.742 | 84% | 0.837 | S | S | * | * | trans | 112.4 | 84.1 | 145 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 295 | R | 43.3 | Very low | 37.8 | Very low | 261 Ų | 261 | 160 Ų | 160 | 99% | 0.985 | 83% | 0.831 | S | S | * | * | trans | 44 | 97.5 | 139.6 | -72 | -173.1 | 170.9 | 175.7 | -1.9 | 119.9 | ||||
| 296 | G | 34.3 | Very low | 38 | Very low | 70 Ų | 70 | 159.8 Ų | 159.8 | 72% | 0.722 | 83% | 0.829 | S | S | * | * | trans | -161 | 121 | 149.4 | 0 | 0 | 0 | 0 | 0 | 108.8 | T298 | G296-T298 PolarHBondContact O-N 3.48Š| ||
| 297 | R | 41.2 | Very low | 38.5 | Very low | 254 Ų | 254 | 159.4 Ų | 159.4 | 96% | 0.958 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 116.8 | -171.2 | -62.5 | 168.1 | 97 | -179.3 | 5.9 | 110.5 | ||
| 298 | T | 36.5 | Very low | 39 | Very low | 131 Ų | 131 | 153.8 Ų | 153.8 | 80% | 0.804 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -87.9 | 120.5 | 167.1 | 10.6 | 0 | 0 | 0 | 0 | 109.2 | G296 | G296-T298 PolarHBondContact O-N 3.48Š|
| 299 | V | 37.8 | Very low | 39.9 | Very low | 132 Ų | 132 | 147.8 Ų | 147.8 | 80% | 0.8 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 124.7 | 164.8 | 176.2 | 0 | 0 | 0 | 0 | 107 | N301 | V299-N301 PolarHBondContact O-N 3.43Å; V299-N301 VanDerWaalsContact O-N 3.17Å |
| 300 | Y | 33.2 | Very low | 41 | Very low | 215 Ų | 215 | 150.3 Ų | 150.3 | 84% | 0.843 | 82% | 0.816 | S | S | * | * | trans | -65.1 | 111.7 | 172.1 | -86.8 | -94.3 | 0 | 0 | 0 | 109 | ||||
| 301 | N | 36.2 | Very low | 41.5 | Very low | 125 Ų | 125 | 151.7 Ų | 151.7 | 67% | 0.668 | 82% | 0.817 | S | S | * | * | trans | -83.6 | 110.5 | 156.2 | -120 | 6.5 | 0 | 0 | 0 | 106.7 | V299 F303 | V299-N301 PolarHBondContact O-N 3.43Å; V299-N301 VanDerWaalsContact O-N 3.17Å; N301-F303 HydrophobicContact CB-CD2 4.03Å; N301-F303 HydrophobicContact CB-CE2 3.98Å; N301-F303 VanDerWaalsContact ND2-CE2 3.31Å; N301-F303 WeakPolarHBondContact ND2-CE2 3.31Å; N301-F303 PolarHBondContact O-N 3.27Å | ||
| 302 | T | 41.4 | Very low | 41.4 | Very low | 132 Ų | 132 | 149.8 Ų | 149.8 | 81% | 0.81 | 81% | 0.812 | S | S | * | * | trans | -73.9 | 72.1 | 172.8 | 42.1 | 0 | 0 | 0 | 0 | 110 | R304 | T302-R304 PolarHBondContact O-N 3.38Å; T302-R304 VanDerWaalsContact O-N 3.11Å | ||
| 303 | F | 39.5 | Very low | 41.5 | Very low | 176 Ų | 176 | 146.4 Ų | 146.4 | 77% | 0.772 | 80% | 0.801 | S | S | * | * | trans | -73.5 | 102.1 | 158.6 | -72.1 | -70.7 | 0 | 0 | 0 | 107.9 | N301 A305 | N301-F303 HydrophobicContact CB-CD2 4.03Å; N301-F303 HydrophobicContact CB-CE2 3.98Å; N301-F303 VanDerWaalsContact ND2-CE2 3.31Å; N301-F303 WeakPolarHBondContact ND2-CE2 3.31Å; N301-F303 PolarHBondContact O-N 3.27Å; F303-A305 VanDerWaalsContact C-N 3.32Å; F303-A305 PolarHBondContact O-N 3.48Å | ||
| 304 | R | 39.1 | Very low | 41.6 | Very low | 244 Ų | 244 | 139.1 Ų | 139.1 | 92% | 0.921 | 80% | 0.795 | S | S | * | * | trans | -57.6 | 95.7 | 163.5 | -171.5 | -179.9 | -143 | -124.2 | 3.1 | 107.9 | T302 A306 | T302-R304 PolarHBondContact O-N 3.38Å; T302-R304 VanDerWaalsContact O-N 3.11Å; R304-A306 PolarHBondContact O-N 3.28Å; R304-A306 VanDerWaalsContact O-N 3.08Å | ||
| 305 | A | 35.9 | Very low | 42 | Very low | 96 Ų | 96 | 146.2 Ų | 146.2 | 79% | 0.793 | 80% | 0.801 | S | S | * | * | trans | -64.5 | 106.7 | 169.9 | 0 | 0 | 0 | 0 | 0 | 108.1 | F303 | F303-A305 VanDerWaalsContact C-N 3.32Å; F303-A305 PolarHBondContact O-N 3.48Å | ||
| 306 | A | 44.9 | Very low | 41.5 | Very low | 93 Ų | 93 | 137.3 Ų | 137.3 | 77% | 0.769 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 132.8 | 167.9 | 0 | 0 | 0 | 0 | 0 | 108.5 | R304 | R304-A306 PolarHBondContact O-N 3.28Å; R304-A306 VanDerWaalsContact O-N 3.08Å |
| 307 | A | 46.8 | Very low | 41.5 | Very low | 90 Ų | 90 | 137.7 Ų | 137.7 | 74% | 0.744 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 144.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||
| 308 | P | 48.8 | Very low | 41.4 | Very low | 117 Ų | 117 | 131.6 Ų | 131.6 | 76% | 0.76 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 143.8 | 173.8 | 26.6 | -32.9 | 0 | 0 | 0 | 110.4 | ||
| 309 | P | 54.9 | Low | 41.3 | Very low | 114 Ų | 114 | 132.2 Ų | 132.2 | 74% | 0.74 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 147 | 177.7 | 27.3 | -33.5 | 0 | 0 | 0 | 110.8 | ||
| 310 | P | 55.4 | Low | 41.3 | Very low | 112 Ų | 112 | 136.4 Ų | 136.4 | 73% | 0.727 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 146.9 | 175.1 | 28.1 | -33.7 | 0 | 0 | 0 | 110.9 | I312 | P310-I312 PolarHBondContact O-N 3.25Š|
| 311 | P | 45.6 | Very low | 41.1 | Very low | 126 Ų | 126 | 134.2 Ų | 134.2 | 82% | 0.818 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 131.5 | 177.5 | 26.7 | -32.7 | 0 | 0 | 0 | 111.1 | ||
| 312 | I | 40.8 | Very low | 40.9 | Very low | 158 Ų | 158 | 135.6 Ų | 135.6 | 81% | 0.81 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 130 | 174.2 | -56.4 | 169.8 | 0 | 0 | 0 | 108.2 | P310 A314 | P310-I312 PolarHBondContact O-N 3.25Å; I312-A314 PolarHBondContact O-N 2.99Å |
| 313 | P | 46.3 | Very low | 40.4 | Very low | 103 Ų | 103 | 132.7 Ų | 132.7 | 67% | 0.669 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 117.9 | 171.9 | 26 | -30.4 | 0 | 0 | 0 | 110 | Y315 | P313-Y315 PolarHBondContact O-N 3.03Å; P313-Y315 VanDerWaalsContact O-N 3.11Å |
| 314 | A | 41.8 | Very low | 40.1 | Very low | 101 Ų | 101 | 134.3 Ų | 134.3 | 84% | 0.835 | 80% | 0.799 | S | S | * | * | trans | -67.3 | 103.9 | 170.1 | 0 | 0 | 0 | 0 | 0 | 109.1 | I312 | I312-A314 PolarHBondContact O-N 2.99Š| ||
| 315 | Y | 37.5 | Very low | 39.7 | Very low | 221 Ų | 221 | 133.8 Ų | 133.8 | 87% | 0.867 | 80% | 0.799 | S | S | * | * | trans | -67.2 | 130.9 | 165.2 | -99.2 | -94.3 | 0 | 0 | 0 | 109.2 | P313 G317 | P313-Y315 PolarHBondContact O-N 3.03Å; P313-Y315 VanDerWaalsContact O-N 3.11Å; Y315-G317 PolarHBondContact O-N 3.41Å | ||
| 316 | G | 33.8 | Very low | 39.5 | Very low | 74 Ų | 74 | 132.4 Ų | 132.4 | 76% | 0.763 | 79% | 0.794 | S | S | * | * | trans | -60.3 | 124.4 | -174.8 | 0 | 0 | 0 | 0 | 0 | 113 | V318 | G316-V318 PolarHBondContact O-N 3.48Š| ||
| 317 | G | 34.1 | Very low | 38.9 | Very low | 77 Ų | 77 | 132.4 Ų | 132.4 | 79% | 0.794 | 79% | 0.794 | S | S | * | * | trans | -78.9 | 107.1 | 161.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | Y315 V319 | Y315-G317 PolarHBondContact O-N 3.41Å; G317-V319 PolarHBondContact O-N 3.16Å | ||
| 318 | V | 38.9 | Very low | 38.5 | Very low | 126 Ų | 126 | 135.8 Ų | 135.8 | 76% | 0.764 | 80% | 0.8 | S | S | * | * | trans | -70.9 | 114.8 | 160.2 | -87.3 | 0 | 0 | 0 | 0 | 108 | G316 Y320 | G316-V318 PolarHBondContact O-N 3.48Å; V318-Y320 PolarHBondContact O-N 3.18Å | ||
| 319 | V | 33.9 | Very low | 38.1 | Very low | 145 Ų | 145 | 137.5 Ų | 137.5 | 88% | 0.879 | 80% | 0.801 | S | S | * | * | trans | -59.6 | 121.5 | 166 | -102.3 | 0 | 0 | 0 | 0 | 109.1 | G317 | G317-V319 PolarHBondContact O-N 3.16Š| ||
| 320 | Y | 37.7 | Very low | 37 | Very low | 220 Ų | 220 | 142.9 Ų | 142.9 | 86% | 0.863 | 81% | 0.808 | S | S | * | * | trans | -110 | 133.3 | 157.8 | -97.6 | -90 | 0 | 0 | 0 | 109.1 | V318 | V318-Y320 PolarHBondContact O-N 3.18Š| ||
| 321 | Q | 30.6 | Very low | 35.7 | Very low | 168 Ų | 168 | 140.7 Ų | 140.7 | 79% | 0.785 | 81% | 0.806 | S | S | * | * | trans | -90.4 | 138.6 | 178.5 | -163.7 | -164.3 | 76.8 | 0 | 0 | 109.2 | ||||
| 322 | D | 30.4 | Very low | 34.9 | Very low | 154 Ų | 154 | 137.8 Ų | 137.8 | 82% | 0.824 | 80% | 0.799 | S | S | * | * | trans | 65.3 | 135.5 | 159.4 | -91.5 | -60.8 | 0 | 0 | 0 | 121 | ||||
| 323 | G | 32.1 | Very low | 34.5 | Very low | 72 Ų | 72 | 141.8 Ų | 141.8 | 74% | 0.742 | 81% | 0.805 | S | S | * | * | trans | 149.8 | 88.8 | 165.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | Y325 | G323-Y325 PolarHBondContact O-N 3.27Š| ||
| 324 | F | 32.1 | Very low | 33.9 | Very low | 209 Ų | 209 | 142.1 Ų | 142.1 | 92% | 0.917 | 82% | 0.816 | S | S | * | * | trans | -43.7 | 126.3 | 158.3 | -122.7 | -104.2 | 0 | 0 | 0 | 111.9 | ||||
| 325 | Y | 31.5 | Very low | 33.6 | Very low | 233 Ų | 233 | 141.7 Ų | 141.7 | 91% | 0.914 | 81% | 0.813 | S | S | * | * | trans | -169.1 | 123.6 | 144 | -106.6 | -77.7 | 0 | 0 | 0 | 109.2 | G323 | G323-Y325 PolarHBondContact O-N 3.27Š| ||
| 326 | G | 31.4 | Very low | 33.2 | Very low | 68 Ų | 68 | 141.2 Ų | 141.2 | 70% | 0.701 | 81% | 0.811 | S | S | * | * | trans | -82.8 | 156.5 | 164.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 327 | A | 32.6 | Very low | 33 | Very low | 92 Ų | 92 | 149.4 Ų | 149.4 | 76% | 0.76 | 82% | 0.819 | S | S | * | * | trans | -174.4 | 123.8 | 149.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 328 | D | 38.1 | Very low | 32.8 | Very low | 161 Ų | 161 | 155.1 Ų | 155.1 | 86% | 0.861 | 82% | 0.818 | S | S | * | * | trans | -58.7 | 125 | 161.1 | -58.6 | -74.6 | 0 | 0 | 0 | 110.8 | ||||
| 329 | I | 40.4 | Very low | 32.6 | Very low | 153 Ų | 153 | 153.8 Ų | 153.8 | 79% | 0.785 | 82% | 0.82 | S | S | * | * | trans | -143.4 | 99.1 | 160.9 | -57.7 | -75.2 | 0 | 0 | 0 | 109.5 | ||||
| 330 | Y | 31.7 | Very low | 32.5 | Very low | 228 Ų | 228 | 155.1 Ų | 155.1 | 89% | 0.894 | 82% | 0.817 | S | S | * | * | 38.5 | 121 | 124.8 | -129.4 | -101.9 | 0 | 0 | 0 | 120.1 | |||||
| 331 | G | 29 | Very low | 32.4 | Very low | 66 Ų | 66 | 150.3 Ų | 150.3 | 68% | 0.68 | 81% | 0.812 | S | S | * | * | 94.1 | 87 | 124.7 | 0 | 0 | 0 | 0 | 0 | 118.3 | |||||
| 332 | G | 27.8 | Very low | 32.5 | Very low | 65 Ų | 65 | 148.6 Ų | 148.6 | 67% | 0.67 | 81% | 0.814 | S | S | * | * | 76 | 113.1 | 121.2 | 0 | 0 | 0 | 0 | 0 | 119.3 | |||||
| 333 | Y | 31.8 | Very low | 32.7 | Very low | 242 Ų | 242 | 147 Ų | 147 | 95% | 0.949 | 81% | 0.812 | S | S | * | * | trans | -146.7 | 126.1 | 131.7 | -80.2 | -73.7 | 0 | 0 | 0 | 109.5 | ||||
| 334 | A | 35 | Very low | 32.9 | Very low | 109 Ų | 109 | 148.3 Ų | 148.3 | 90% | 0.901 | 82% | 0.815 | S | S | * | * | trans | -70.1 | 129.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 335 | A | 34.3 | Very low | 33.1 | Very low | 92 Ų | 92 | 144.9 Ų | 144.9 | 76% | 0.76 | 81% | 0.812 | S | S | * | * | trans | -116 | 117.6 | 166.3 | 0 | 0 | 0 | 0 | 0 | 109.7 | R337 | A335-R337 PolarHBondContact O-N 3.1Š| ||
| 336 | Y | 29.9 | Very low | 33.3 | Very low | 212 Ų | 212 | 138.3 Ų | 138.3 | 83% | 0.831 | 81% | 0.806 | S | S | * | * | trans | -32.7 | 120.2 | 169.7 | -116 | -108 | 0 | 0 | 0 | 113.4 | Y338 | Y336-Y338 AromaticContact CD1-CD2 3.97Å; Y336-Y338 HydrophobicContact CD1-CD2 3.97Å; Y336-Y338 HydrophobicContact CE1-CD2 4.11Å; Y336-Y338 HydrophobicContact CE1-CE2 4.31Å; Y336-Y338 PolarHBondContact O-N 3.29Å | ||
| 337 | R | 30.4 | Very low | 33.7 | Very low | 246 Ų | 246 | 139.8 Ų | 139.8 | 93% | 0.928 | 81% | 0.812 | S | S | * | * | trans | -95.8 | 88.3 | 168.2 | 17.4 | -167 | 169.6 | -163.1 | -1.9 | 107.6 | A335 | A335-R337 PolarHBondContact O-N 3.1Š| ||
| 338 | Y | 29.3 | Very low | 33.9 | Very low | 196 Ų | 196 | 140.4 Ų | 140.4 | 77% | 0.769 | 82% | 0.816 | S | S | * | * | trans | -83.8 | 104.3 | 162.1 | -128.3 | -94 | 0 | 0 | 0 | 106.8 | Y336 Q340 | Y336-Y338 AromaticContact CD1-CD2 3.97Å; Y336-Y338 HydrophobicContact CD1-CD2 3.97Å; Y336-Y338 HydrophobicContact CE1-CD2 4.11Å; Y336-Y338 HydrophobicContact CE1-CE2 4.31Å; Y336-Y338 PolarHBondContact O-N 3.29Å; Y338-Q340 PolarHBondContact O-N 3.28Å; Y338-Q340 VanDerWaalsContact O-N 3.16Å | ||
| 339 | A | 33.9 | Very low | 33.8 | Very low | 98 Ų | 98 | 143.3 Ų | 143.3 | 81% | 0.81 | 82% | 0.817 | S | S | * | * | trans | -68.5 | 106.5 | 169.2 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 340 | Q | 32 | Very low | 33.7 | Very low | 173 Ų | 173 | 141 Ų | 141 | 81% | 0.808 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -82.5 | 136.8 | 163.2 | -78.6 | -162.4 | -23.3 | 0 | 0 | 109.4 | Y338 | Y338-Q340 PolarHBondContact O-N 3.28Å; Y338-Q340 VanDerWaalsContact O-N 3.16Å |
| 341 | P | 35.6 | Very low | 34 | Very low | 119 Ų | 119 | 135.7 Ų | 135.7 | 77% | 0.773 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -72.3 | 129.4 | 176.6 | 28.6 | -31.5 | 0 | 0 | 0 | 110.6 | ||
| 342 | T | 32.5 | Very low | 34.7 | Very low | 133 Ų | 133 | 137.6 Ų | 137.6 | 82% | 0.816 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -54 | 131.4 | 166.9 | 12.7 | 0 | 0 | 0 | 0 | 111.1 | A344 | T342-A344 PolarHBondContact O-N 3.47Š|
| 343 | P | 36.1 | Very low | 35.5 | Very low | 121 Ų | 121 | 144.3 Ų | 144.3 | 79% | 0.786 | 81% | 0.811 | S | S | * | * | trans | -73 | 108.1 | 165.7 | 28.1 | -29.1 | 0 | 0 | 0 | 108.8 | T345 | P343-T345 PolarHBondContact O-N 2.78Š| ||
| 344 | A | 36.5 | Very low | 36.1 | Very low | 98 Ų | 98 | 136.2 Ų | 136.2 | 81% | 0.81 | 80% | 0.802 | S | S | * | * | trans | -72.2 | 107.8 | 169.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | T342 A346 | T342-A344 PolarHBondContact O-N 3.47Å; A344-A346 PolarHBondContact O-N 3.24Å; A344-A346 VanDerWaalsContact O-N 3.1Å | ||
| 345 | T | 35.2 | Very low | 36.6 | Very low | 138 Ų | 138 | 140.8 Ų | 140.8 | 85% | 0.847 | 80% | 0.796 | S | S | * | * | trans | -74.8 | 94.6 | 170.9 | -40.1 | 0 | 0 | 0 | 0 | 108.6 | P343 A347 | P343-T345 PolarHBondContact O-N 2.78Å; T345-A347 PolarHBondContact O-N 3.45Å | ||
| 346 | A | 36.8 | Very low | 36.9 | Very low | 94 Ų | 94 | 143.2 Ų | 143.2 | 78% | 0.777 | 80% | 0.801 | S | S | * | * | trans | -69.5 | 111.8 | 170.4 | 0 | 0 | 0 | 0 | 0 | 109.6 | A344 A348 | A344-A346 PolarHBondContact O-N 3.24Å; A344-A346 VanDerWaalsContact O-N 3.1Å; A346-A348 PolarHBondContact O-N 3.11Å | ||
| 347 | A | 39.4 | Very low | 37.4 | Very low | 100 Ų | 100 | 143.3 Ų | 143.3 | 83% | 0.826 | 80% | 0.801 | S | S | * | * | trans | -81 | 98.9 | 171.2 | 0 | 0 | 0 | 0 | 0 | 109.2 | T345 Y349 | T345-A347 PolarHBondContact O-N 3.45Å; A347-Y349 PolarHBondContact O-N 3.11Å | ||
| 348 | A | 36.6 | Very low | 37.9 | Very low | 104 Ų | 104 | 136.3 Ų | 136.3 | 86% | 0.86 | 80% | 0.796 | S | S | * | * | trans | -77.8 | 114 | 167.3 | 0 | 0 | 0 | 0 | 0 | 108.9 | A346 | A346-A348 PolarHBondContact O-N 3.11Š| ||
| 349 | Y | 36.1 | Very low | 38.4 | Very low | 222 Ų | 222 | 131.9 Ų | 131.9 | 87% | 0.871 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -92.3 | 120.2 | 173.9 | -151.2 | -92.5 | 0 | 0 | 0 | 108.5 | A347 | A347-Y349 PolarHBondContact O-N 3.11Š|
| 350 | S | 37.6 | Very low | 38.4 | Very low | 106 Ų | 106 | 133.9 Ų | 133.9 | 74% | 0.741 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -98.9 | 121.5 | 172.7 | 40.3 | 0 | 0 | 0 | 0 | 109.9 | ||
| 351 | D | 37.3 | Very low | 39 | Very low | 115 Ų | 115 | 130.8 Ų | 130.8 | 62% | 0.615 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -80.8 | 150.5 | 167.1 | -162.3 | -79.5 | 0 | 0 | 0 | 109.9 | Y353 G354 | D351-Y353 PolarHBondContact O-N 3.08Å; D351-G354 PolarHBondContact O-N 2.92Å |
| 352 | S | 45.1 | Very low | 39.1 | Very low | 107 Ų | 107 | 134.3 Ų | 134.3 | 75% | 0.748 | 79% | 0.791 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.4 | 8.4 | -175.5 | 61.9 | 0 | 0 | 0 | 0 | 116.9 | ||
| 353 | Y | 44.5 | Very low | 39.3 | Very low | 205 Ų | 205 | 137.3 Ų | 137.3 | 80% | 0.804 | 80% | 0.795 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -132.5 | 50.1 | 171.8 | -86.5 | -91.2 | 0 | 0 | 0 | 112.3 | D351 R355 | D351-Y353 PolarHBondContact O-N 3.08Å; Y353-R355 PolarHBondContact O-N 2.91Å |
| 354 | G | 44.2 | Very low | 39.2 | Very low | 73 Ų | 73 | 140.4 Ų | 140.4 | 75% | 0.753 | 80% | 0.799 | S | S | * | * | trans | 54.9 | 33.2 | 148.4 | 0 | 0 | 0 | 0 | 0 | 119 | D351 | D351-G354 PolarHBondContact O-N 2.92Š| ||
| 355 | R | 46 | Very low | 38.9 | Very low | 205 Ų | 205 | 140 Ų | 140 | 77% | 0.774 | 80% | 0.795 | S | S | * | * | trans | -111.2 | 124.4 | 170.7 | -63.1 | -66.3 | -174.9 | 174.4 | -0.2 | 110.1 | Y353 Y357 | Y353-R355 PolarHBondContact O-N 2.91Å; R355-Y357 HydrophobicContact CB-CE2 4.49Å | ||
| 356 | V | 40.2 | Very low | 38.8 | Very low | 143 Ų | 143 | 142 Ų | 142 | 87% | 0.867 | 80% | 0.8 | S | S | * | * | trans | -101.3 | 123 | 176.5 | -176.3 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 357 | Y | 40.2 | Very low | 38.5 | Very low | 213 Ų | 213 | 141.7 Ų | 141.7 | 84% | 0.835 | 80% | 0.797 | S | S | * | * | trans | -105.2 | 122 | 167 | -71.4 | -83.3 | 0 | 0 | 0 | 108.7 | R355 | R355-Y357 HydrophobicContact CB-CE2 4.49Š| ||
| 358 | A | 40.2 | Very low | 38.6 | Very low | 100 Ų | 100 | 143.2 Ų | 143.2 | 83% | 0.826 | 80% | 0.799 | S | S | * | * | trans | -85.2 | 123.8 | 168.2 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 359 | A | 39.7 | Very low | 38.2 | Very low | 102 Ų | 102 | 142.6 Ų | 142.6 | 84% | 0.843 | 79% | 0.794 | S | S | * | * | trans | -86.5 | 111.8 | 170 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 360 | D | 33.8 | Very low | 38.6 | Very low | 140 Ų | 140 | 137.9 Ų | 137.9 | 75% | 0.749 | 79% | 0.79 | S | S | * | * | trans | -83.4 | 125.9 | 173 | -160.4 | -5.5 | 0 | 0 | 0 | 109.3 | Y362 | D360-Y362 PolarHBondContact O-N 3.17Š| ||
| 361 | P | 44.3 | Very low | 38.2 | Very low | 108 Ų | 108 | 138.8 Ų | 138.8 | 70% | 0.701 | 79% | 0.792 | S | S | * | * | S | Bend | trans | -95.5 | 55.2 | -171.7 | 38 | -34.4 | 0 | 0 | 0 | 112.4 | ||
| 362 | Y | 37.7 | Very low | 37.9 | Very low | 193 Ų | 193 | 144.4 Ų | 144.4 | 76% | 0.757 | 81% | 0.806 | S | S | * | * | trans | -157 | 111.4 | 160.7 | -84.4 | -78.9 | 0 | 0 | 0 | 107.9 | D360 | D360-Y362 PolarHBondContact O-N 3.17Š| ||
| 363 | H | 37.8 | Very low | 37.1 | Very low | 196 Ų | 196 | 142.5 Ų | 142.5 | 91% | 0.907 | 80% | 0.803 | S | S | * | * | trans | -178.4 | 113.7 | 144.1 | -89.5 | -59.6 | 0 | 0 | 0 | 109.1 | ||||
| 364 | H | 33.8 | Very low | 36.4 | Very low | 187 Ų | 187 | 139.7 Ų | 139.7 | 87% | 0.866 | 81% | 0.807 | S | S | * | * | trans | -83.1 | 138.1 | 171.6 | -78.9 | -92.3 | 0 | 0 | 0 | 110.7 | ||||
| 365 | A | 29.6 | Very low | 35.7 | Very low | 89 Ų | 89 | 139.7 Ų | 139.7 | 74% | 0.736 | 81% | 0.807 | S | S | * | * | trans | 56.1 | 123.7 | 149.8 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 366 | L | 33 | Very low | 35.1 | Very low | 179 Ų | 179 | 133.3 Ų | 133.3 | 94% | 0.937 | 80% | 0.798 | S | S | * | * | 172.2 | 153.8 | 115.8 | -85.2 | 160.5 | 0 | 0 | 0 | 110.9 | |||||
| 367 | A | 31.5 | Very low | 34.6 | Very low | 88 Ų | 88 | 134.7 Ų | 134.7 | 73% | 0.727 | 80% | 0.797 | S | S | * | * | trans | -55.4 | 165 | -166.7 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 368 | P | 40.4 | Very low | 34.2 | Very low | 133 Ų | 133 | 132.1 Ų | 132.1 | 86% | 0.864 | 80% | 0.798 | S | S | * | * | trans | -82.4 | 125 | -175.5 | 32.7 | -31.5 | 0 | 0 | 0 | 112 | ||||
| 369 | A | 29.9 | Very low | 33.7 | Very low | 90 Ų | 90 | 132.2 Ų | 132.2 | 74% | 0.744 | 80% | 0.799 | S | S | * | * | trans | -127.2 | 124.7 | 164.1 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 370 | P | 42.9 | Very low | 33.2 | Very low | 124 Ų | 124 | 137.4 Ų | 137.4 | 81% | 0.805 | 80% | 0.803 | S | S | * | * | trans | -89 | 126.6 | 173.6 | 33.4 | -27.1 | 0 | 0 | 0 | 109.1 | ||||
| 371 | T | 30.8 | Very low | 33.2 | Very low | 125 Ų | 125 | 134.7 Ų | 134.7 | 77% | 0.767 | 80% | 0.8 | S | S | * | * | trans | -148.5 | 106.9 | 167.8 | -61 | 0 | 0 | 0 | 0 | 111 | ||||
| 372 | Y | 29.5 | Very low | 33.2 | Very low | 232 Ų | 232 | 135.4 Ų | 135.4 | 91% | 0.91 | 80% | 0.804 | S | S | * | * | trans | 42 | 122.3 | 136.2 | -83.9 | -95.3 | 0 | 0 | 0 | 122.2 | ||||
| 373 | G | 29.2 | Very low | 32.9 | Very low | 67 Ų | 67 | 134.3 Ų | 134.3 | 69% | 0.691 | 81% | 0.811 | S | S | * | * | 146.3 | 136 | 124 | 0 | 0 | 0 | 0 | 0 | 114 | |||||
| 374 | V | 29.8 | Very low | 32.9 | Very low | 147 Ų | 147 | 130.8 Ų | 130.8 | 89% | 0.891 | 80% | 0.803 | S | S | * | * | cis | -164.4 | 144.6 | -3.7 | 160.6 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 375 | G | 29.1 | Very low | 32.7 | Very low | 73 Ų | 73 | 129.7 Ų | 129.7 | 75% | 0.753 | 80% | 0.804 | S | S | * | * | trans | 105.9 | 122 | 151.5 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 376 | A | 32.8 | Very low | 32.7 | Very low | 71 Ų | 71 | 129.1 Ų | 129.1 | 59% | 0.587 | 80% | 0.798 | S | S | * | * | cis | -169 | 152.7 | 7 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 377 | M | 29.6 | Very low | 32.7 | Very low | 171 Ų | 171 | 129.5 Ų | 129.5 | 84% | 0.842 | 79% | 0.792 | S | S | * | * | trans | 39.7 | 125.8 | 151.3 | 48.6 | -127.7 | 168.4 | 0 | 0 | 119.8 | ||||
| 378 | N | 32.9 | Very low | 32.7 | Very low | 159 Ų | 159 | 130.6 Ų | 130.6 | 85% | 0.85 | 79% | 0.79 | S | S | * | * | cis | -161.9 | 133 | 32.8 | -106.2 | 0.5 | 0 | 0 | 0 | 108.8 | ||||
| 379 | A | 29.8 | Very low | 32.2 | Very low | 102 Ų | 102 | 135.3 Ų | 135.3 | 84% | 0.843 | 79% | 0.791 | S | S | * | * | trans | -130.3 | 119.8 | 160.9 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 380 | F | 29.6 | Very low | 32.2 | Very low | 212 Ų | 212 | 135.9 Ų | 135.9 | 93% | 0.93 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -83.7 | 120.7 | 171.9 | -126.1 | -92.9 | 0 | 0 | 0 | 108.2 | ||
| 381 | A | 33.2 | Very low | 31.8 | Very low | 83 Ų | 83 | 138.3 Ų | 138.3 | 69% | 0.686 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -79.3 | 159.4 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||
| 382 | P | 43.8 | Very low | 31.9 | Very low | 122 Ų | 122 | 136.8 Ų | 136.8 | 79% | 0.792 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -89.3 | 140.2 | 170 | 34.7 | -28.2 | 0 | 0 | 0 | 110.4 | ||
| 383 | L | 31.4 | Very low | 32.1 | Very low | 171 Ų | 171 | 132.1 Ų | 132.1 | 90% | 0.895 | 78% | 0.781 | S | S | * | * | trans | -139.5 | 133.4 | 163.2 | -155.8 | 78.5 | 0 | 0 | 0 | 110.7 | ||||
| 384 | T | 37.5 | Very low | 32.2 | Very low | 121 Ų | 121 | 135.9 Ų | 135.9 | 74% | 0.742 | 79% | 0.785 | S | S | * | * | trans | -59.1 | 143.5 | 169.5 | 49.4 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 385 | D | 29.4 | Very low | 32.5 | Very low | 165 Ų | 165 | 135.6 Ų | 135.6 | 88% | 0.882 | 78% | 0.783 | S | S | * | * | 172.5 | -179.7 | 116.2 | -160 | -104.7 | 0 | 0 | 0 | 109.9 | |||||
| 386 | A | 31.1 | Very low | 32.5 | Very low | 76 Ų | 76 | 135.2 Ų | 135.2 | 63% | 0.628 | 78% | 0.779 | S | S | * | * | trans | -110 | 171.4 | -138.8 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 387 | K | 32 | Very low | 32.7 | Very low | 187 Ų | 187 | 139.9 Ų | 139.9 | 81% | 0.813 | 79% | 0.793 | S | S | * | * | trans | 96.3 | 138.3 | 138.3 | -149.9 | 117.2 | -176.7 | 175.4 | 0 | 120 | ||||
| 388 | T | 31.5 | Very low | 32.9 | Very low | 111 Ų | 111 | 137.5 Ų | 137.5 | 68% | 0.681 | 79% | 0.788 | S | S | * | * | trans | 85 | 115.8 | 152.5 | 26.8 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 389 | R | 29.4 | Very low | 33 | Very low | 232 Ų | 232 | 137.6 Ų | 137.6 | 88% | 0.875 | 79% | 0.788 | S | S | * | * | 62 | 134.6 | 114.7 | -95.2 | -177.6 | 168.6 | 164.7 | -4.8 | 113.5 | |||||
| 390 | S | 31.3 | Very low | 33.1 | Very low | 103 Ų | 103 | 137.8 Ų | 137.8 | 72% | 0.72 | 78% | 0.783 | S | S | * | * | cis | 177.2 | 150.2 | 20.5 | 35.7 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 391 | H | 33.7 | Very low | 33.4 | Very low | 175 Ų | 175 | 133.3 Ų | 133.3 | 81% | 0.81 | 78% | 0.778 | S | S | * | * | trans | 30.5 | 123.1 | 138.8 | -133 | -58.1 | 0 | 0 | 0 | 120.3 | ||||
| 392 | A | 33 | Very low | 33.6 | Very low | 93 Ų | 93 | 137.3 Ų | 137.3 | 77% | 0.769 | 79% | 0.787 | S | S | * | * | 154 | 148.6 | 121.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 393 | D | 33.9 | Very low | 33.3 | Very low | 133 Ų | 133 | 140.7 Ų | 140.7 | 71% | 0.711 | 79% | 0.792 | S | S | * | * | trans | -73.7 | 178.2 | -170.1 | -56.2 | -87.6 | 0 | 0 | 0 | 116 | ||||
| 394 | D | 31.9 | Very low | 33.5 | Very low | 147 Ų | 147 | 136.4 Ų | 136.4 | 79% | 0.786 | 78% | 0.782 | S | S | * | * | trans | 104.3 | 101.7 | 151.4 | -68.2 | -49 | 0 | 0 | 0 | 121.3 | ||||
| 395 | V | 35.2 | Very low | 33.8 | Very low | 141 Ų | 141 | 136.5 Ų | 136.5 | 86% | 0.855 | 79% | 0.787 | S | S | * | * | 39 | 122.3 | 128.3 | -141.3 | 0 | 0 | 0 | 0 | 121 | |||||
| 396 | G | 29.2 | Very low | 34.3 | Very low | 64 Ų | 64 | 136.4 Ų | 136.4 | 66% | 0.66 | 79% | 0.785 | S | S | * | * | trans | 136 | 131 | 133.4 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 397 | L | 36.8 | Very low | 34.4 | Very low | 169 Ų | 169 | 143.2 Ų | 143.2 | 89% | 0.885 | 80% | 0.796 | S | S | * | * | trans | 88.5 | 93 | 160.8 | -61.3 | 158.1 | 0 | 0 | 0 | 116.6 | ||||
| 398 | V | 34.4 | Very low | 34.5 | Very low | 121 Ų | 121 | 145.5 Ų | 145.5 | 73% | 0.733 | 80% | 0.799 | S | S | * | * | 69.5 | 93.5 | 77.7 | 177.9 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 399 | L | 34.1 | Very low | 34.6 | Very low | 161 Ų | 161 | 143.8 Ų | 143.8 | 84% | 0.843 | 80% | 0.804 | S | S | * | * | 166.6 | 130.1 | 120.7 | -97.4 | 148.4 | 0 | 0 | 0 | 113.1 | |||||
| 400 | S | 32.8 | Very low | 34.6 | Very low | 107 Ų | 107 | 136.6 Ų | 136.6 | 75% | 0.748 | 80% | 0.802 | S | S | * | * | trans | 70.9 | 95.7 | 143.7 | -155.6 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 401 | S | 36.2 | Very low | 35 | Very low | 117 Ų | 117 | 142 Ų | 142 | 82% | 0.818 | 81% | 0.808 | S | S | * | * | 164.5 | 106 | 110.9 | 44.4 | 0 | 0 | 0 | 0 | 110.5 | Q403 | S401-Q403 PolarHBondContact O-N 3.28Š| |||
| 402 | L | 37.9 | Very low | 35.6 | Very low | 167 Ų | 167 | 140 Ų | 140 | 87% | 0.874 | 80% | 0.803 | S | S | * | * | trans | -67.4 | 122.2 | 164.1 | -106.8 | 75.4 | 0 | 0 | 0 | 108.4 | ||||
| 403 | Q | 36.4 | Very low | 35.9 | Very low | 193 Ų | 193 | 147.4 Ų | 147.4 | 90% | 0.902 | 81% | 0.811 | S | S | * | * | trans | -145.4 | 88 | 142.5 | -155.4 | 123.9 | -32.5 | 0 | 0 | 109 | S401 | S401-Q403 PolarHBondContact O-N 3.28Š| ||
| 404 | A | 36.6 | Very low | 36.1 | Very low | 82 Ų | 82 | 150.7 Ų | 150.7 | 68% | 0.678 | 82% | 0.82 | S | S | * | * | trans | -72.3 | 134.6 | 168 | 0 | 0 | 0 | 0 | 0 | 109.8 | I406 | A404-I406 PolarHBondContact O-N 3.37Š| ||
| 405 | S | 42.3 | Very low | 36.4 | Very low | 122 Ų | 122 | 148.3 Ų | 148.3 | 85% | 0.853 | 82% | 0.821 | S | S | * | * | trans | -46.5 | 124.5 | 162 | -34.4 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 406 | I | 39.9 | Very low | 37.5 | Very low | 163 Ų | 163 | 146.9 Ų | 146.9 | 84% | 0.836 | 81% | 0.814 | S | S | * | * | trans | -124.2 | 129.8 | 162.9 | -65.7 | -170.7 | 0 | 0 | 0 | 110.2 | A404 | A404-I406 PolarHBondContact O-N 3.37Š| ||
| 407 | Y | 34.5 | Very low | 38.1 | Very low | 220 Ų | 220 | 158.4 Ų | 158.4 | 86% | 0.863 | 84% | 0.84 | S | S | * | * | trans | -64 | -179.4 | 177.2 | -147.3 | -105 | 0 | 0 | 0 | 114.1 | ||||
| 408 | R | 34.3 | Very low | 38.2 | Very low | 234 Ų | 234 | 157.9 Ų | 157.9 | 88% | 0.883 | 84% | 0.838 | S | S | * | * | trans | 95.2 | 118.2 | 159.9 | -141.6 | 175.1 | -161.9 | -136.8 | 3.4 | 113.7 | ||||
| 409 | G | 31.8 | Very low | 38.4 | Very low | 76 Ų | 76 | 159.8 Ų | 159.8 | 78% | 0.784 | 84% | 0.843 | S | S | * | * | cis | 95.5 | 117.8 | 42.2 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 410 | G | 31.3 | Very low | 38.6 | Very low | 81 Ų | 81 | 159.8 Ų | 159.8 | 84% | 0.835 | 84% | 0.843 | S | S | * | * | trans | 162.9 | 107.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 411 | Y | 39.1 | Very low | 39 | Very low | 216 Ų | 216 | 162.9 Ų | 162.9 | 85% | 0.847 | 85% | 0.849 | S | S | * | * | trans | -63.5 | 151.6 | 168.3 | -114 | -113.2 | 0 | 0 | 0 | 113.7 | ||||
| 412 | N | 44.9 | Very low | 39.1 | Very low | 133 Ų | 133 | 165.8 Ų | 165.8 | 71% | 0.711 | 85% | 0.851 | S | S | * | * | trans | 47.6 | 125.1 | 151.8 | -71.3 | -16.9 | 0 | 0 | 0 | 120.7 | ||||
| 413 | R | 39.5 | Very low | 39.2 | Very low | 248 Ų | 248 | 165.7 Ų | 165.7 | 94% | 0.936 | 85% | 0.849 | S | S | * | * | -157.3 | 131.1 | 123.9 | -93.5 | -145.7 | -73.5 | -161.5 | -1.8 | 113.3 | |||||
| 414 | F | 39.7 | Very low | 39.4 | Very low | 203 Ų | 203 | 163.7 Ų | 163.7 | 89% | 0.89 | 85% | 0.845 | S | S | * | * | trans | -38.7 | 143.9 | 157.3 | -81.7 | -108 | 0 | 0 | 0 | 113.6 | ||||
| 415 | A | 37.4 | Very low | 39.6 | Very low | 97 Ų | 97 | 170 Ų | 170 | 80% | 0.802 | 86% | 0.858 | S | S | * | * | trans | -148.2 | 132.1 | 142.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 416 | P | 58.1 | Low | 39.4 | Very low | 110 Ų | 110 | 174 Ų | 174 | 71% | 0.714 | 86% | 0.859 | S | S | * | * | trans | -90 | 153.3 | 178.3 | 36.8 | -31.6 | 0 | 0 | 0 | 111.1 | ||||
| 417 | Y | 42.6 | Very low | 39.4 | Very low | 307 Ų | 307 | 175 Ų | 175 | 100% | 1.204 | 86% | 0.861 | S | S | * | * | trans | -169.2 | 0 | 132.9 | -105.7 | -72.1 | 0 | 0 | 0 | 109.9 |
Retrieved 417 of 417 residues in 70.5 ms
(Link to these results)