| 1 | M | 37.4 | Very low | 41.5 | Very low | 238 Ų | 238 | 162.5 Ų | 162.5 | 100% | 1.172 | 83% | 0.825 | S | S | * | * | | | | 0 | 133.6 | 0 | -88.1 | 86.6 | 167.8 | 0 | 0 | 108.6 | | |
| 2 | A | 39.8 | Very low | 41.1 | Very low | 100 Ų | 100 | 156.4 Ų | 156.4 | 83% | 0.826 | 82% | 0.818 | S | S | * | * | | | trans | 66.8 | 142.2 | 158.3 | 0 | 0 | 0 | 0 | 0 | 118.9 | | |
| 3 | D | 40.2 | Very low | 40.6 | Very low | 161 Ų | 161 | 150.9 Ų | 150.9 | 86% | 0.861 | 81% | 0.809 | S | S | * | * | | | cis | -173.6 | 149.4 | -28.7 | -143.6 | -26.4 | 0 | 0 | 0 | 106.2 | | |
| 4 | G | 41.5 | Very low | 40.2 | Very low | 56 Ų | 56 | 152.1 Ų | 152.1 | 58% | 0.577 | 82% | 0.815 | S | S | * | * | | | trans | 66.2 | 114.5 | 132.7 | 0 | 0 | 0 | 0 | 0 | 123.2 | | |
| 5 | R | 43.4 | Very low | 39.9 | Very low | 251 Ų | 251 | 147.5 Ų | 147.5 | 95% | 0.947 | 82% | 0.817 | S | S | * | * | | | | 102.3 | 117.6 | 122.4 | -64.2 | -173.2 | -170.2 | -178.5 | 3.4 | 119.4 | | |
| 6 | Q | 41.3 | Very low | 39.7 | Very low | 155 Ų | 155 | 149.8 Ų | 149.8 | 72% | 0.724 | 82% | 0.82 | S | S | * | * | | | trans | -75.2 | 175.9 | 151.3 | -57.3 | -148.1 | -42.6 | 0 | 0 | 111.4 | | |
| 7 | P | 57.5 | Low | 39.9 | Very low | 125 Ų | 125 | 152.1 Ų | 152.1 | 81% | 0.812 | 82% | 0.824 | S | S | * | * | | | | -143.4 | 166 | 86.1 | 31.7 | -11.5 | 0 | 0 | 0 | 116.2 | | |
| 8 | E | 40.6 | Very low | 39.8 | Very low | 127 Ų | 127 | 151.4 Ų | 151.4 | 59% | 0.593 | 82% | 0.82 | S | S | * | * | | | trans | -52.8 | 157.8 | 165.3 | -59.1 | -79.8 | 154.4 | 0 | 0 | 114 | | |
| 9 | D | 42.3 | Very low | 39.9 | Very low | 163 Ų | 163 | 147.1 Ų | 147.1 | 87% | 0.872 | 81% | 0.814 | S | S | * | * | | | | -180 | 126.8 | 123.6 | -86.6 | -28.8 | 0 | 0 | 0 | 112 | | |
| 10 | H | 39 | Very low | 39.9 | Very low | 157 Ų | 157 | 148.6 Ų | 148.6 | 73% | 0.727 | 82% | 0.815 | S | S | * | * | | | trans | -75.6 | 158.2 | 166.5 | -74.8 | -98.2 | 0 | 0 | 0 | 110.6 | | |
| 11 | W | 33.4 | Very low | 39.6 | Very low | 255 Ų | 255 | 149.2 Ų | 149.2 | 97% | 0.966 | 82% | 0.817 | S | S | * | * | | | | 167.3 | 154.2 | 117.6 | -94.3 | 65.8 | 0 | 0 | 0 | 112.6 | | |
| 12 | A | 36.3 | Very low | 39.6 | Very low | 89 Ų | 89 | 141.9 Ų | 141.9 | 74% | 0.736 | 80% | 0.802 | S | S | * | * | | | trans | -64.3 | 164.7 | -168.9 | 0 | 0 | 0 | 0 | 0 | 117.1 | | |
| 13 | A | 35.8 | Very low | 39 | Very low | 85 Ų | 85 | 148 Ų | 148 | 70% | 0.702 | 81% | 0.805 | S | S | * | * | | | | 158 | 130.7 | 102.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | | |
| 14 | N | 34 | Very low | 38.8 | Very low | 168 Ų | 168 | 145.1 Ų | 145.1 | 90% | 0.898 | 80% | 0.798 | S | S | * | * | | | trans | 44.9 | 124.9 | 135.8 | -59.4 | -24.9 | 0 | 0 | 0 | 121.4 | | |
| 15 | G | 36.3 | Very low | 38.5 | Very low | 82 Ų | 82 | 146.9 Ų | 146.9 | 85% | 0.845 | 80% | 0.802 | S | S | * | * | | | trans | -168.6 | 107.2 | 159.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | | |
| 16 | Q | 36.8 | Very low | 37.9 | Very low | 184 Ų | 184 | 145.2 Ų | 145.2 | 86% | 0.86 | 80% | 0.797 | S | S | * | * | | | trans | -88.3 | 131.9 | -173.5 | 175.5 | -175.6 | -46.6 | 0 | 0 | 110.6 | | |
| 17 | E | 43.7 | Very low | 37.5 | Very low | 189 Ų | 189 | 141.7 Ų | 141.7 | 88% | 0.883 | 80% | 0.802 | S | S | * | * | | | trans | -152.7 | 126.7 | 153.9 | -166.8 | 169.2 | 158.1 | 0 | 0 | 111.7 | | |
| 18 | N | 37.2 | Very low | 36.1 | Very low | 141 Ų | 141 | 145.6 Ų | 145.6 | 75% | 0.754 | 80% | 0.802 | S | S | * | * | | | trans | -87.2 | 149.6 | 176 | -69.2 | -52.3 | 0 | 0 | 0 | 109.9 | | |
| 19 | G | 41.5 | Very low | 35.7 | Very low | 69 Ų | 69 | 149.8 Ų | 149.8 | 71% | 0.711 | 81% | 0.813 | S | S | * | * | | | trans | -166.8 | 73.1 | 172.5 | 0 | 0 | 0 | 0 | 0 | 114 | | |
| 20 | E | 39.8 | Very low | 35.3 | Very low | 177 Ų | 177 | 150.1 Ų | 150.1 | 83% | 0.827 | 81% | 0.809 | S | S | * | * | | | trans | 47.9 | 113.9 | 138.6 | -61.6 | -177 | 134 | 0 | 0 | 121.6 | | |
| 21 | N | 34.1 | Very low | 35.1 | Very low | 162 Ų | 162 | 150.3 Ų | 150.3 | 87% | 0.866 | 82% | 0.815 | S | S | * | * | | | | 38.2 | 117.1 | 116.7 | -59.6 | -24.3 | 0 | 0 | 0 | 119.4 | | |
| 22 | G | 36.3 | Very low | 35.1 | Very low | 83 Ų | 83 | 141.8 Ų | 141.8 | 86% | 0.856 | 81% | 0.807 | S | S | * | * | | | trans | -165.1 | 95.3 | 163.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | | |
| 23 | Y | 28.6 | Very low | 34.9 | Very low | 228 Ų | 228 | 147.7 Ų | 147.7 | 89% | 0.894 | 81% | 0.812 | S | S | * | * | | | trans | -75.8 | 156.2 | -179.3 | -144.8 | -101.4 | 0 | 0 | 0 | 112.3 | | |
| 24 | S | 36.1 | Very low | 34.9 | Very low | 101 Ų | 101 | 153.1 Ų | 153.1 | 71% | 0.706 | 82% | 0.822 | S | S | * | * | | | trans | 73.6 | 152.3 | 158.6 | -119.3 | 0 | 0 | 0 | 0 | 115.9 | | |
| 25 | S | 34.3 | Very low | 34.7 | Very low | 94 Ų | 94 | 149.5 Ų | 149.5 | 66% | 0.657 | 82% | 0.816 | S | S | * | * | | | cis | -170.5 | 158.7 | 12.4 | -167.4 | 0 | 0 | 0 | 0 | 107.5 | | |
| 26 | Y | 31.3 | Very low | 34.5 | Very low | 215 Ų | 215 | 150.5 Ų | 150.5 | 84% | 0.843 | 82% | 0.816 | S | S | * | * | | | trans | -33 | 144.9 | 172.7 | -56.3 | -89.8 | 0 | 0 | 0 | 118.6 | | |
| 27 | G | 32 | Very low | 34.4 | Very low | 81 Ų | 81 | 146.5 Ų | 146.5 | 84% | 0.835 | 81% | 0.814 | S | S | * | * | | | trans | -168.3 | 90.1 | 161.2 | 0 | 0 | 0 | 0 | 0 | 112 | | |
| 28 | Y | 28.6 | Very low | 33.9 | Very low | 208 Ų | 208 | 142.5 Ų | 142.5 | 82% | 0.816 | 81% | 0.813 | S | S | * | * | | | trans | -82.9 | 147.5 | 172.6 | -96.2 | -90.1 | 0 | 0 | 0 | 111.6 | | |
| 29 | R | 32.8 | Very low | 33.8 | Very low | 215 Ų | 215 | 140.5 Ų | 140.5 | 81% | 0.811 | 82% | 0.817 | S | S | * | * | | | trans | 69.2 | 148.1 | 153.9 | -73.9 | 176.9 | -177.8 | 168.1 | -0 | 115.8 | | |
| 30 | E | 32.8 | Very low | 34.2 | Very low | 170 Ų | 170 | 143 Ų | 143 | 79% | 0.794 | 82% | 0.82 | S | S | * | * | | | cis | -164.2 | 132 | 22.8 | -141.2 | 169.6 | 177.9 | 0 | 0 | 106.6 | | |
| 31 | N | 34.7 | Very low | 35.1 | Very low | 160 Ų | 160 | 140 Ų | 140 | 86% | 0.856 | 82% | 0.816 | S | S | * | * | | | trans | -89.9 | 117.9 | 179.6 | -71.3 | -17.5 | 0 | 0 | 0 | 110 | | |
| 32 | G | 33.7 | Very low | 35.7 | Very low | 77 Ų | 77 | 138 Ų | 138 | 79% | 0.794 | 81% | 0.812 | S | S | * | * | | | trans | -73.1 | 150.8 | 170.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | | |
| 33 | Y | 32.9 | Very low | 35.9 | Very low | 213 Ų | 213 | 138.1 Ų | 138.1 | 84% | 0.835 | 81% | 0.805 | S | S | * | * | | | trans | -110.2 | 124.2 | 170.8 | -72.3 | -83.2 | 0 | 0 | 0 | 110.1 | | |
| 34 | H | 34.9 | Very low | 36.5 | Very low | 199 Ų | 199 | 133.4 Ų | 133.4 | 92% | 0.921 | 80% | 0.8 | S | S | * | * | | | trans | -174.5 | 139 | 145.3 | -77.6 | -59.8 | 0 | 0 | 0 | 105.1 | | |
| 35 | A | 31.3 | Very low | 36.9 | Very low | 92 Ų | 92 | 134.4 Ų | 134.4 | 76% | 0.76 | 80% | 0.801 | S | S | * | * | | | cis | -170.4 | 158.9 | -15 | 0 | 0 | 0 | 0 | 0 | 105.4 | | |
| 36 | A | 31.6 | Very low | 37.4 | Very low | 103 Ų | 103 | 136.7 Ų | 136.7 | 85% | 0.851 | 81% | 0.806 | S | S | * | * | | | trans | 92 | 130.3 | 155.4 | 0 | 0 | 0 | 0 | 0 | 122.3 | | |
| 37 | A | 34.4 | Very low | 38 | Very low | 99 Ų | 99 | 132.6 Ų | 132.6 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | | | trans | 88.2 | 91.7 | 142.5 | 0 | 0 | 0 | 0 | 0 | 122.1 | | |
| 38 | A | 33.1 | Very low | 38.6 | Very low | 105 Ų | 105 | 134 Ų | 134 | 87% | 0.868 | 80% | 0.796 | S | S | * | * | | | | 38.5 | 114.1 | 129.7 | 0 | 0 | 0 | 0 | 0 | 123.4 | | |
| 39 | A | 35.9 | Very low | 39.7 | Very low | 100 Ų | 100 | 128.5 Ų | 128.5 | 83% | 0.826 | 79% | 0.794 | S | S | * | * | | | | 169.4 | 150.6 | 115.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | | |
| 40 | P | 49 | Very low | 40.7 | Very low | 122 Ų | 122 | 125.4 Ų | 125.4 | 79% | 0.792 | 79% | 0.793 | S | S | * | * | | | trans | -110 | -163 | -171.1 | 40.7 | -28.8 | 0 | 0 | 0 | 114 | | |
| 41 | P | 59.5 | Low | 42.1 | Very low | 112 Ų | 112 | 125 Ų | 125 | 73% | 0.727 | 80% | 0.796 | S | S | * | * | | | | -113.4 | -166.1 | -68.3 | 42.7 | -25.5 | 0 | 0 | 0 | 111 | | |
| 42 | P | 45.6 | Very low | 43.3 | Very low | 121 Ų | 121 | 122.9 Ų | 122.9 | 79% | 0.786 | 79% | 0.79 | S | S | * | * | | | | -140.2 | 140 | 66.9 | 28.7 | -5.8 | 0 | 0 | 0 | 113.9 | | |
| 43 | A | 40.1 | Very low | 44.8 | Very low | 85 Ų | 85 | 125.2 Ų | 125.2 | 70% | 0.702 | 79% | 0.792 | S | S | * | * | | | | 62.7 | 97.3 | 79.2 | 0 | 0 | 0 | 0 | 0 | 115.9 | | |
| 44 | T | 41.8 | Very low | 45.6 | Very low | 129 Ų | 129 | 120.4 Ų | 120.4 | 79% | 0.791 | 79% | 0.789 | S | S | * | * | | | | -160 | 105.1 | 124.4 | 49.9 | 0 | 0 | 0 | 0 | 106.8 | | |
| 45 | V | 45.6 | Very low | 47 | Very low | 123 Ų | 123 | 116.6 Ų | 116.6 | 75% | 0.745 | 78% | 0.782 | S | S | * | * | | | | 40 | 133.8 | 88.3 | -44.5 | 0 | 0 | 0 | 0 | 111.8 | | |
| 46 | D | 44 | Very low | 48.8 | Very low | 142 Ų | 142 | 117.5 Ų | 117.5 | 76% | 0.759 | 78% | 0.78 | S | S | * | * | | | cis | -175.2 | 148.3 | 5.9 | -132.4 | -74.8 | 0 | 0 | 0 | 101.8 | | |
| 47 | D | 44.1 | Very low | 49.7 | Very low | 128 Ų | 128 | 118.8 Ų | 118.8 | 68% | 0.684 | 78% | 0.78 | S | S | * | * | | | | 149 | 128.1 | 77.8 | 172.3 | 34.4 | 0 | 0 | 0 | 105.5 | | |
| 48 | S | 44.2 | Very low | 50.1 | Low | 112 Ų | 112 | 119.7 Ų | 119.7 | 78% | 0.783 | 78% | 0.78 | S | S | * | * | | | trans | 170.5 | 62.2 | 147.6 | -88.3 | 0 | 0 | 0 | 0 | 109.9 | N50 | S48-N50 PolarHBondContact O-N 3.35Š|
| 49 | A | 51 | Low | 50.8 | Low | 92 Ų | 92 | 120.7 Ų | 120.7 | 76% | 0.76 | 78% | 0.778 | S | S | * | * | | | trans | -78.4 | 93.4 | 151.6 | 0 | 0 | 0 | 0 | 0 | 108 | | |
| 50 | N | 55.2 | Low | 50.9 | Low | 149 Ų | 149 | 121.9 Ų | 121.9 | 80% | 0.797 | 78% | 0.78 | S | S | * | * | | | trans | -166.5 | 77 | 150.3 | -120.5 | -47.8 | 0 | 0 | 0 | 112.9 | S48 | S48-N50 PolarHBondContact O-N 3.35Š|
| 51 | L | 60.6 | Low | 50.5 | Low | 163 Ų | 163 | 120.5 Ų | 120.5 | 85% | 0.853 | 78% | 0.779 | S | S | * | * | | | trans | -135.3 | 134.3 | 153.3 | -69.3 | 176.7 | 0 | 0 | 0 | 108.3 | | |
| 52 | P | 61.1 | Low | 49.4 | Very low | 114 Ų | 114 | 123 Ų | 123 | 74% | 0.74 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 143.9 | 178.3 | 28.4 | -33.9 | 0 | 0 | 0 | 110.5 | | |
| 53 | P | 64.8 | Low | 49 | Very low | 127 Ų | 127 | 124.8 Ų | 124.8 | 83% | 0.825 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -68.8 | 137.7 | -179.3 | 27.1 | -32.9 | 0 | 0 | 0 | 111.6 | | |
| 54 | S | 50.7 | Low | 48.5 | Very low | 111 Ų | 111 | 127.2 Ų | 127.2 | 78% | 0.776 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 145.8 | 176.2 | -59.2 | 0 | 0 | 0 | 0 | 112.3 | | |
| 55 | P | 64.3 | Low | 48 | Very low | 119 Ų | 119 | 124.2 Ų | 124.2 | 77% | 0.773 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 147.7 | -179.7 | 28.9 | -34.1 | 0 | 0 | 0 | 112.2 | | |
| 56 | P | 67.5 | Low | 48.1 | Very low | 112 Ų | 112 | 124.8 Ų | 124.8 | 73% | 0.727 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -72.5 | 153.9 | -175.8 | 29.4 | -34.8 | 0 | 0 | 0 | 112.8 | | |
| 57 | P | 51.5 | Low | 47.6 | Very low | 130 Ų | 130 | 126.3 Ų | 126.3 | 84% | 0.844 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 134.4 | 176.4 | 28.9 | -33 | 0 | 0 | 0 | 111.2 | | |
| 58 | S | 42.2 | Very low | 47.2 | Very low | 117 Ų | 117 | 124.1 Ų | 124.1 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -81.1 | 139.7 | 176 | -59.5 | 0 | 0 | 0 | 0 | 111.6 | | |
| 59 | P | 49.2 | Very low | 46.7 | Very low | 126 Ų | 126 | 128 Ų | 128 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -89.3 | 144.9 | -178.7 | 34.5 | -32.8 | 0 | 0 | 0 | 113.1 | | |
| 60 | S | 36.9 | Very low | 45.8 | Very low | 125 Ų | 125 | 126.7 Ų | 126.7 | 87% | 0.874 | 80% | 0.795 | S | S | * | * | | | trans | -142.6 | 133.2 | 157 | -72.6 | 0 | 0 | 0 | 0 | 104.4 | | |
| 61 | A | 40.5 | Very low | 44.9 | Very low | 93 Ų | 93 | 128.5 Ų | 128.5 | 77% | 0.769 | 80% | 0.8 | S | S | * | * | | | cis | -159.4 | 172.6 | 5.9 | 0 | 0 | 0 | 0 | 0 | 107.9 | | |
| 62 | E | 37 | Very low | 43.7 | Very low | 166 Ų | 166 | 124.5 Ų | 124.5 | 78% | 0.776 | 79% | 0.791 | S | S | * | * | | | trans | 104.8 | 121 | 158.8 | -60.1 | -134.4 | 97.1 | 0 | 0 | 120.3 | | |
| 63 | Q | 36.3 | Very low | 42.5 | Very low | 158 Ų | 158 | 126.7 Ų | 126.7 | 74% | 0.738 | 79% | 0.791 | S | S | * | * | | | trans | 58.7 | 128.3 | 151.4 | -68.7 | 178.4 | 22.7 | 0 | 0 | 118 | | |
| 64 | T | 29.7 | Very low | 41.2 | Very low | 136 Ų | 136 | 128.7 Ų | 128.7 | 83% | 0.834 | 79% | 0.789 | S | S | * | * | | | | -174.6 | 136.5 | 64.7 | -37.9 | 0 | 0 | 0 | 0 | 107.2 | | |
| 65 | G | 32.5 | Very low | 40.5 | Very low | 66 Ų | 66 | 130.7 Ų | 130.7 | 68% | 0.68 | 79% | 0.786 | S | S | * | * | | | | 119 | 158.3 | 98.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | | |
| 66 | P | 46 | Very low | 39.9 | Very low | 135 Ų | 135 | 130.4 Ų | 130.4 | 88% | 0.877 | 78% | 0.784 | S | S | * | * | | | trans | -102.7 | 167.2 | -150.1 | 38.5 | -32 | 0 | 0 | 0 | 114.7 | | |
| 67 | L | 34.7 | Very low | 38.4 | Very low | 173 Ų | 173 | 131.6 Ų | 131.6 | 91% | 0.906 | 78% | 0.783 | S | S | * | * | | | trans | -96.2 | 140 | 170.3 | -121.7 | 119.7 | 0 | 0 | 0 | 111 | | |
| 68 | A | 34.9 | Very low | 37.6 | Very low | 82 Ų | 82 | 130.4 Ų | 130.4 | 68% | 0.678 | 78% | 0.778 | S | S | * | * | | | trans | 94.1 | 111.2 | 148.2 | 0 | 0 | 0 | 0 | 0 | 119.9 | | |
| 69 | Q | 34.1 | Very low | 37.2 | Very low | 193 Ų | 193 | 131 Ų | 131 | 90% | 0.902 | 78% | 0.777 | S | S | * | * | | | | 78.3 | 116 | 127.3 | -139.4 | 91 | -18.2 | 0 | 0 | 119.7 | | |
| 70 | G | 32.1 | Very low | 36.3 | Very low | 66 Ų | 66 | 129.4 Ų | 129.4 | 68% | 0.68 | 77% | 0.774 | S | S | * | * | | | trans | 114.7 | 109.9 | 131.4 | 0 | 0 | 0 | 0 | 0 | 117.5 | | |
| 71 | M | 35.7 | Very low | 36.4 | Very low | 187 Ų | 187 | 132.2 Ų | 132.2 | 92% | 0.921 | 77% | 0.774 | S | S | * | * | | | trans | 67.6 | 94.3 | 140.7 | -69.4 | 161.8 | 171.5 | 0 | 0 | 118.8 | | |
| 72 | A | 35.2 | Very low | 37 | Very low | 79 Ų | 79 | 132.6 Ų | 132.6 | 65% | 0.653 | 77% | 0.768 | S | S | * | * | | | | 55.9 | 135.3 | 115.4 | 0 | 0 | 0 | 0 | 0 | 121.2 | | |
| 73 | H | 35.8 | Very low | 36.7 | Very low | 160 Ų | 160 | 130 Ų | 130 | 74% | 0.741 | 77% | 0.768 | S | S | * | * | | | trans | 92.9 | 109 | 149.8 | -64.7 | -62.6 | 0 | 0 | 0 | 120.3 | | |
| 74 | H | 37.6 | Very low | 36.7 | Very low | 168 Ų | 168 | 132.1 Ų | 132.1 | 78% | 0.778 | 77% | 0.769 | S | S | * | * | | | trans | 67.7 | 106.7 | 140.2 | -62.2 | -74.6 | 0 | 0 | 0 | 121.5 | | |
| 75 | Q | 37.3 | Very low | 36.7 | Very low | 154 Ų | 154 | 132.8 Ų | 132.8 | 72% | 0.72 | 76% | 0.763 | S | S | * | * | | | trans | -35.6 | 153.5 | 135.6 | -85.2 | -119.7 | 35.8 | 0 | 0 | 113.4 | | |
| 76 | P | 50.8 | Low | 37 | Very low | 113 Ų | 113 | 140.8 Ų | 140.8 | 73% | 0.734 | 77% | 0.773 | S | S | * | * | | | | -147.9 | 146.9 | 67.9 | 36.9 | -15.9 | 0 | 0 | 0 | 119 | | |
| 77 | L | 35.6 | Very low | 37.2 | Very low | 136 Ų | 136 | 139 Ų | 139 | 71% | 0.712 | 76% | 0.761 | S | S | * | * | | | | 39.4 | 140.2 | 126.2 | -70 | 158.3 | 0 | 0 | 0 | 122.4 | | |
| 78 | S | 35.2 | Very low | 37.2 | Very low | 105 Ų | 105 | 136.8 Ų | 136.8 | 73% | 0.734 | 76% | 0.755 | S | S | * | * | | | trans | 85 | 148.1 | 137.7 | -75.3 | 0 | 0 | 0 | 0 | 118.2 | | |
| 79 | V | 34.7 | Very low | 37.2 | Very low | 131 Ų | 131 | 140.6 Ų | 140.6 | 79% | 0.794 | 76% | 0.759 | S | S | * | * | | | cis | -177 | 160.3 | -10.3 | 129.9 | 0 | 0 | 0 | 0 | 104.4 | | |
| 80 | A | 30.6 | Very low | 37.3 | Very low | 92 Ų | 92 | 141.9 Ų | 141.9 | 76% | 0.76 | 76% | 0.755 | S | S | * | * | | | trans | 84.7 | 117.3 | 154.7 | 0 | 0 | 0 | 0 | 0 | 120.9 | | |
| 81 | Q | 37.2 | Very low | 37.4 | Very low | 184 Ų | 184 | 142 Ų | 142 | 86% | 0.86 | 74% | 0.743 | S | S | * | * | | | trans | -65.3 | -163.8 | 147.5 | -41.1 | 174.3 | -83.4 | 0 | 0 | 109.9 | | |
| 82 | P | 53.3 | Low | 37.2 | Very low | 101 Ų | 101 | 144.1 Ų | 144.1 | 66% | 0.656 | 74% | 0.742 | S | S | * | * | | | cis | -142.1 | -175.1 | -12.2 | 34.2 | -11.9 | 0 | 0 | 0 | 114.6 | | |
| 83 | S | 31.6 | Very low | 37.2 | Very low | 110 Ų | 110 | 150.7 Ų | 150.7 | 77% | 0.769 | 75% | 0.75 | S | S | * | * | | | trans | 69.8 | 143 | 148.1 | -59.6 | 0 | 0 | 0 | 0 | 117.5 | | |
| 84 | R | 36.1 | Very low | 37.5 | Very low | 204 Ų | 204 | 148.2 Ų | 148.2 | 77% | 0.77 | 75% | 0.751 | S | S | * | * | | | cis | -178.6 | 149.7 | 47.2 | -158.1 | 173.8 | 165.5 | 165.6 | -10.8 | 109.6 | | |
| 85 | E | 30.6 | Very low | 38.1 | Very low | 149 Ų | 149 | 144.7 Ų | 144.7 | 70% | 0.696 | 74% | 0.743 | S | S | * | * | | | trans | 76.9 | 121 | 147 | -84.7 | 163.6 | -158.7 | 0 | 0 | 124.7 | | |
| 86 | R | 38.7 | Very low | 37.9 | Very low | 235 Ų | 235 | 144.9 Ų | 144.9 | 89% | 0.887 | 74% | 0.744 | S | S | * | * | | | trans | -28 | -175 | 149.6 | -113.1 | -170.2 | -95.4 | -147 | -8.8 | 117.9 | | |
| 87 | P | 49.8 | Very low | 37.1 | Very low | 98 Ų | 98 | 147.8 Ų | 147.8 | 64% | 0.636 | 75% | 0.745 | S | S | * | * | | | cis | -141.7 | -163.3 | -18.6 | 30.7 | -6.3 | 0 | 0 | 0 | 114.4 | | |
| 88 | T | 35.1 | Very low | 37.1 | Very low | 126 Ų | 126 | 152.4 Ų | 152.4 | 77% | 0.773 | 75% | 0.753 | S | S | * | * | | | trans | 99.5 | 106.6 | 163.3 | 64.3 | 0 | 0 | 0 | 0 | 115.6 | | |
| 89 | E | 33.7 | Very low | 37.2 | Very low | 162 Ų | 162 | 152.9 Ų | 152.9 | 76% | 0.757 | 76% | 0.756 | S | S | * | * | | | | 83.7 | 115.9 | 53.4 | -160.1 | -161.7 | 173.8 | 0 | 0 | 113.6 | | |
| 90 | R | 37.2 | Very low | 37.4 | Very low | 219 Ų | 219 | 151.1 Ų | 151.1 | 83% | 0.826 | 75% | 0.75 | S | S | * | * | | | trans | 137.6 | 142.2 | 137.9 | -81.2 | -153.4 | 161.4 | 140.2 | -5.3 | 111.6 | | |
| 91 | T | 34 | Very low | 38.1 | Very low | 70 Ų | 70 | 154.4 Ų | 154.4 | 43% | 0.429 | 75% | 0.754 | S | S | . | * | | | cis | 176.5 | 142.9 | -6.2 | -88.6 | 0 | 0 | 0 | 0 | 104.1 | R93 | T91-R93 HydrophobicContact CG2-CG 4.11Š|
| 92 | Y | 32.3 | Very low | 38.8 | Very low | 231 Ų | 231 | 150.9 Ų | 150.9 | 91% | 0.906 | 75% | 0.747 | S | S | * | * | | | trans | -170.5 | 86.4 | 131 | -90.7 | -68.9 | 0 | 0 | 0 | 106.1 | | |
| 93 | R | 34.7 | Very low | 38.6 | Very low | 217 Ų | 217 | 157.4 Ų | 157.4 | 82% | 0.819 | 76% | 0.759 | S | S | * | * | | | | 54.7 | 109.1 | 104.4 | -82.6 | -141 | -168.8 | -109.1 | 6.8 | 115.7 | T91 | T91-R93 HydrophobicContact CG2-CG 4.11Š|
| 94 | S | 41.2 | Very low | 39.2 | Very low | 108 Ų | 108 | 158.4 Ų | 158.4 | 76% | 0.755 | 76% | 0.762 | S | S | * | * | | | trans | -93.1 | 158.5 | 136.6 | -154.2 | 0 | 0 | 0 | 0 | 107.3 | | |
| 95 | P | 51.4 | Low | 39.2 | Very low | 94 Ų | 94 | 152.6 Ų | 152.6 | 61% | 0.61 | 76% | 0.758 | S | S | * | * | | | | -155.8 | 157 | 70.5 | 31.8 | -6.2 | 0 | 0 | 0 | 119.6 | | |
| 96 | E | 31.8 | Very low | 39.6 | Very low | 157 Ų | 157 | 155.6 Ų | 155.6 | 73% | 0.734 | 77% | 0.769 | S | S | * | * | | | trans | 50.9 | 131.6 | 133.8 | -53.8 | 177.6 | 142.4 | 0 | 0 | 124.3 | | |
| 97 | K | 34.8 | Very low | 39.7 | Very low | 174 Ų | 174 | 150 Ų | 150 | 76% | 0.757 | 77% | 0.765 | S | S | * | * | | | | 163.1 | 150.7 | 92.8 | -81.2 | -164.4 | 178.1 | 174.9 | 0 | 113.5 | | |
| 98 | R | 34.2 | Very low | 39.1 | Very low | 233 Ų | 233 | 153 Ų | 153 | 88% | 0.879 | 78% | 0.776 | S | S | * | * | | | trans | 94.3 | 106.1 | 152.6 | -59.3 | -162.4 | 172.7 | -162.5 | -3.6 | 119.4 | | |
| 99 | S | 38.6 | Very low | 39 | Very low | 115 Ų | 115 | 153.1 Ų | 153.1 | 80% | 0.804 | 78% | 0.776 | S | S | * | * | | | | -165.4 | 95.2 | 106.4 | 60.3 | 0 | 0 | 0 | 0 | 112.4 | | |
| 100 | S | 38.1 | Very low | 39 | Very low | 95 Ų | 95 | 156.7 Ų | 156.7 | 66% | 0.664 | 78% | 0.783 | S | S | * | * | | | trans | -19.4 | 143.2 | 130.4 | 38.4 | 0 | 0 | 0 | 0 | 114.6 | | |
| 101 | L | 46.5 | Very low | 38.8 | Very low | 160 Ų | 160 | 154.2 Ų | 154.2 | 84% | 0.838 | 78% | 0.78 | S | S | * | * | | | cis | -178.3 | -170.4 | 26.3 | -91.9 | 155.6 | 0 | 0 | 0 | 106.3 | | |
| 102 | P | 51.3 | Low | 39.5 | Very low | 111 Ų | 111 | 157.8 Ų | 157.8 | 72% | 0.721 | 80% | 0.795 | S | S | * | * | | | | -128.1 | 166.5 | -54.3 | 35 | -17.9 | 0 | 0 | 0 | 113.8 | | |
| 103 | R | 48.9 | Very low | 39.9 | Very low | 238 Ų | 238 | 152.4 Ų | 152.4 | 90% | 0.898 | 79% | 0.788 | S | S | * | * | | | trans | -67.3 | 152 | 162.4 | -75.8 | 173.4 | 168.9 | 174.3 | -4.5 | 111.5 | | |
| 104 | P | 44.3 | Very low | 39.7 | Very low | 130 Ų | 130 | 146.4 Ų | 146.4 | 84% | 0.844 | 79% | 0.786 | S | S | * | * | | | trans | -95.7 | 131.5 | 150.4 | 32.4 | -25.3 | 0 | 0 | 0 | 110.7 | | |
| 105 | A | 36.1 | Very low | 39.4 | Very low | 83 Ų | 83 | 145.7 Ų | 145.7 | 69% | 0.686 | 79% | 0.786 | S | S | * | * | | | trans | -113.4 | 142.1 | 166.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | | |
| 106 | K | 39.7 | Very low | 38.7 | Very low | 211 Ų | 211 | 149.8 Ų | 149.8 | 92% | 0.917 | 80% | 0.797 | S | S | * | * | | | trans | 61.4 | 110.3 | 152.2 | -59.1 | 172.4 | -178.2 | -177.4 | 0 | 118 | | |
| 107 | S | 39.9 | Very low | 38.9 | Very low | 117 Ų | 117 | 150.3 Ų | 150.3 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | | | trans | -129.3 | 100.4 | 148.2 | 59.1 | 0 | 0 | 0 | 0 | 107.4 | | |
| 108 | L | 36.3 | Very low | 38.8 | Very low | 163 Ų | 163 | 149.7 Ų | 149.7 | 85% | 0.853 | 80% | 0.799 | S | S | * | * | | | | 77 | 93.2 | 99.4 | -154.9 | 83.3 | 0 | 0 | 0 | 112.8 | R110 | L108-R110 PolarHBondContact O-N 3.03Š|
| 109 | T | 33 | Very low | 38.7 | Very low | 128 Ų | 128 | 145.1 Ų | 145.1 | 79% | 0.785 | 79% | 0.792 | S | S | * | * | | | trans | -46 | 121.5 | 152.4 | -55 | 0 | 0 | 0 | 0 | 110 | H111 | T109-H111 PolarHBondContact O-N 3.31Š|
| 110 | R | 34.3 | Very low | 38.5 | Very low | 237 Ų | 237 | 144.4 Ų | 144.4 | 89% | 0.894 | 79% | 0.787 | S | S | * | * | | | trans | -81.3 | 105.2 | 162.3 | -102.2 | -166.9 | -83.6 | -140 | -1.4 | 108.4 | L108 | L108-R110 PolarHBondContact O-N 3.03Š|
| 111 | H | 33.8 | Very low | 38.4 | Very low | 167 Ų | 167 | 146.3 Ų | 146.3 | 77% | 0.773 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 130.1 | 159.6 | -140.2 | -77.9 | 0 | 0 | 0 | 108 | T109 | T109-H111 PolarHBondContact O-N 3.31Š|
| 112 | I | 49.2 | Very low | 38.5 | Very low | 145 Ų | 145 | 144.1 Ų | 144.1 | 74% | 0.744 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -81.4 | 140.9 | 160.3 | -64.2 | 170.8 | 0 | 0 | 0 | 106 | | |
| 113 | P | 39.2 | Very low | 37.4 | Very low | 117 Ų | 117 | 144.6 Ų | 144.6 | 76% | 0.76 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 142.1 | -178.6 | 30 | -32.4 | 0 | 0 | 0 | 111.1 | | |
| 114 | A | 31 | Very low | 36.9 | Very low | 92 Ų | 92 | 143.8 Ų | 143.8 | 76% | 0.76 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -71.3 | 145.2 | 168.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | | |
| 115 | A | 34.8 | Very low | 36.6 | Very low | 93 Ų | 93 | 142.9 Ų | 142.9 | 77% | 0.769 | 79% | 0.788 | S | S | * | * | | | trans | -108.2 | 118.4 | 139.5 | 0 | 0 | 0 | 0 | 0 | 105.8 | | |
| 116 | E | 37.2 | Very low | 36.5 | Very low | 180 Ų | 180 | 143.3 Ų | 143.3 | 84% | 0.841 | 78% | 0.782 | S | S | * | * | | | trans | 36.3 | 130.5 | 141.1 | -42.5 | -165.2 | 142.4 | 0 | 0 | 117.1 | | |
| 117 | Q | 35.8 | Very low | 36.5 | Very low | 168 Ų | 168 | 138.2 Ų | 138.2 | 79% | 0.785 | 77% | 0.773 | S | S | * | * | | | cis | -174.2 | 133.1 | 34.9 | -164.6 | 165.6 | 14.9 | 0 | 0 | 108 | | |
| 118 | E | 31.6 | Very low | 36.7 | Very low | 161 Ų | 161 | 138.7 Ų | 138.7 | 75% | 0.752 | 77% | 0.773 | S | S | * | * | | | trans | 60.6 | 112.6 | 141.4 | -59 | -65.9 | 118.4 | 0 | 0 | 121.4 | | |
| 119 | D | 33.7 | Very low | 36.5 | Very low | 136 Ų | 136 | 136.9 Ų | 136.9 | 73% | 0.727 | 77% | 0.773 | S | S | * | * | | | | 112.7 | 118.4 | 117.8 | -139.3 | 4.8 | 0 | 0 | 0 | 119.3 | | |
| 120 | S | 33 | Very low | 36.4 | Very low | 100 Ų | 100 | 136.2 Ų | 136.2 | 70% | 0.699 | 77% | 0.773 | S | S | * | * | | | trans | 76.2 | 129.3 | 145 | -74.8 | 0 | 0 | 0 | 0 | 122.9 | | |
| 121 | T | 36.8 | Very low | 36.3 | Very low | 135 Ų | 135 | 131.8 Ų | 131.8 | 83% | 0.828 | 77% | 0.767 | S | S | * | * | | | trans | -59.2 | 171.2 | -178.2 | 41.5 | 0 | 0 | 0 | 0 | 117.4 | | |
| 122 | P | 48 | Very low | 36.3 | Very low | 115 Ų | 115 | 130.6 Ų | 130.6 | 75% | 0.747 | 77% | 0.765 | S | S | * | * | | | trans | -98.8 | 156 | -150.2 | 38.3 | -32.5 | 0 | 0 | 0 | 113.8 | | |
| 123 | S | 29.9 | Very low | 35.4 | Very low | 121 Ų | 121 | 133.5 Ų | 133.5 | 85% | 0.846 | 77% | 0.772 | S | S | * | * | | | trans | -157.2 | 126.8 | 165.3 | -74.4 | 0 | 0 | 0 | 0 | 112.5 | | |
| 124 | R | 38.3 | Very low | 35 | Very low | 221 Ų | 221 | 139.5 Ų | 139.5 | 83% | 0.834 | 78% | 0.78 | S | S | * | * | | | trans | -45.9 | 144.6 | 159.8 | -170.5 | -170 | 173.1 | -131 | -0.5 | 111.1 | | |
| 125 | P | 37.7 | Very low | 35 | Very low | 111 Ų | 111 | 140.4 Ų | 140.4 | 72% | 0.721 | 78% | 0.78 | S | S | * | * | | | | -148.4 | 145.2 | 109.3 | 26 | -3.5 | 0 | 0 | 0 | 112.7 | | |
| 126 | T | 33.4 | Very low | 34.9 | Very low | 91 Ų | 91 | 143.5 Ų | 143.5 | 56% | 0.558 | 78% | 0.779 | S | S | * | * | | | | 49.8 | 120.4 | 84.6 | -44.7 | 0 | 0 | 0 | 0 | 114 | | |
| 127 | S | 40.3 | Very low | 35.2 | Very low | 105 Ų | 105 | 140.7 Ų | 140.7 | 73% | 0.734 | 78% | 0.777 | S | S | * | * | | | trans | -40.1 | 158.1 | 167.1 | 48.2 | 0 | 0 | 0 | 0 | 115.1 | | |
| 128 | P | 43.2 | Very low | 35.2 | Very low | 126 Ų | 126 | 138.1 Ų | 138.1 | 82% | 0.818 | 77% | 0.773 | S | S | * | * | | | | -146.1 | 159.5 | 111 | 33.5 | -16.2 | 0 | 0 | 0 | 116.3 | | |
| 129 | C | 32.1 | Very low | 35.6 | Very low | 126 Ų | 126 | 136.7 Ų | 136.7 | 85% | 0.851 | 78% | 0.777 | S | S | * | * | | | trans | -64.1 | 152.2 | 163.9 | -66.6 | 0 | 0 | 0 | 0 | 113.2 | | |
| 130 | S | 31.8 | Very low | 35.3 | Very low | 113 Ų | 113 | 133.9 Ų | 133.9 | 79% | 0.79 | 78% | 0.78 | S | S | * | * | | | trans | -113.7 | 108.6 | 158.3 | 53.6 | 0 | 0 | 0 | 0 | 108.2 | | |
| 131 | L | 32.3 | Very low | 35.7 | Very low | 145 Ų | 145 | 135.5 Ų | 135.5 | 76% | 0.759 | 79% | 0.786 | S | S | * | * | | | | 70.4 | 106.3 | 89.2 | -74.3 | 170.5 | 0 | 0 | 0 | 116 | | |
| 132 | L | 32.6 | Very low | 35.3 | Very low | 142 Ų | 142 | 136.3 Ų | 136.3 | 74% | 0.743 | 79% | 0.786 | S | S | * | * | | | | 75.9 | 117.6 | 128.9 | -57.8 | 174 | 0 | 0 | 0 | 121.4 | | |
| 133 | K | 31.7 | Very low | 34.7 | Very low | 205 Ų | 205 | 135.4 Ų | 135.4 | 89% | 0.891 | 78% | 0.782 | S | S | * | * | | | | -168.2 | 102.8 | 112.8 | -92.3 | 161.9 | -171.7 | -174.3 | 0 | 107.1 | | |
| 134 | R | 30.3 | Very low | 35 | Very low | 243 Ų | 243 | 135.9 Ų | 135.9 | 92% | 0.917 | 78% | 0.78 | S | S | * | * | | | | 47.7 | 111.4 | 96.9 | -157 | 167.2 | -166.8 | 177.5 | 3.2 | 110.7 | | |
| 135 | S | 30.9 | Very low | 34.9 | Very low | 111 Ų | 111 | 136.2 Ų | 136.2 | 78% | 0.776 | 78% | 0.781 | S | S | * | * | | | | -172.3 | 142.9 | 59.7 | 42.5 | 0 | 0 | 0 | 0 | 112.5 | | |
| 136 | E | 31.8 | Very low | 34.9 | Very low | 158 Ų | 158 | 136 Ų | 136 | 74% | 0.738 | 78% | 0.782 | S | S | * | * | | | trans | -79.3 | 157.8 | 161.9 | -79.3 | -67.2 | 140.5 | 0 | 0 | 110.6 | | |
| 137 | P | 43.2 | Very low | 35.2 | Very low | 122 Ų | 122 | 143.4 Ų | 143.4 | 79% | 0.792 | 80% | 0.8 | S | S | * | * | | | | -144.7 | 157 | 54.6 | 37.3 | -15.8 | 0 | 0 | 0 | 119 | | |
| 138 | T | 36.7 | Very low | 34.8 | Very low | 114 Ų | 114 | 143.8 Ų | 143.8 | 70% | 0.699 | 80% | 0.802 | S | S | * | * | | | trans | -51.3 | 163.2 | 162.7 | 52.3 | 0 | 0 | 0 | 0 | 114.1 | | |
| 139 | P | 39.3 | Very low | 34.4 | Very low | 131 Ų | 131 | 143.9 Ų | 143.9 | 85% | 0.851 | 80% | 0.8 | S | S | * | * | | | cis | -149.2 | -176.5 | 35.7 | 39.5 | -16.6 | 0 | 0 | 0 | 116.7 | | |
| 140 | G | 28.6 | Very low | 34.5 | Very low | 77 Ų | 77 | 149.6 Ų | 149.6 | 79% | 0.794 | 80% | 0.804 | S | S | * | * | | | trans | 118.8 | 134.2 | 148.1 | 0 | 0 | 0 | 0 | 0 | 118.9 | | |
| 141 | T | 39.7 | Very low | 34.7 | Very low | 134 Ų | 134 | 150.5 Ų | 150.5 | 82% | 0.822 | 81% | 0.81 | S | S | * | * | | | trans | -74.7 | 179.3 | 175 | 36.6 | 0 | 0 | 0 | 0 | 114.7 | | |
| 142 | D | 29.6 | Very low | 34.6 | Very low | 152 Ų | 152 | 147 Ų | 147 | 81% | 0.813 | 81% | 0.809 | S | S | * | * | | | trans | 88.7 | 119 | 169.6 | -71.4 | -47.6 | 0 | 0 | 0 | 116.3 | | |
| 143 | S | 35.2 | Very low | 34.6 | Very low | 95 Ų | 95 | 144.9 Ų | 144.9 | 66% | 0.664 | 81% | 0.812 | S | S | * | * | | | | 115 | 122.4 | 55.2 | 178.9 | 0 | 0 | 0 | 0 | 107.4 | | |
| 144 | T | 35.9 | Very low | 34.7 | Very low | 131 Ų | 131 | 141.2 Ų | 141.2 | 80% | 0.804 | 81% | 0.812 | S | S | * | * | | | trans | -167.5 | 112.8 | 141.7 | 23.6 | 0 | 0 | 0 | 0 | 110.3 | | |
| 145 | R | 37.2 | Very low | 35.1 | Very low | 229 Ų | 229 | 136 Ų | 136 | 86% | 0.864 | 81% | 0.808 | S | S | * | * | | | | 43.5 | 133.2 | 123 | -84.5 | 177.1 | 152.7 | -176.4 | -5.8 | 118 | | |
| 146 | S | 36.4 | Very low | 35.6 | Very low | 105 Ų | 105 | 136.8 Ų | 136.8 | 73% | 0.734 | 81% | 0.81 | S | S | * | * | | | cis | -168.6 | 151.3 | 21.6 | -85.9 | 0 | 0 | 0 | 0 | 109.8 | | |
| 147 | R | 40.4 | Very low | 35.5 | Very low | 248 Ų | 248 | 132.7 Ų | 132.7 | 94% | 0.936 | 81% | 0.81 | S | S | * | * | | | trans | -75.5 | 146 | 165 | -63.1 | 172.1 | 175.4 | 149.5 | -1.6 | 110.2 | | |
| 148 | S | 31.3 | Very low | 34.8 | Very low | 113 Ų | 113 | 132.9 Ų | 132.9 | 79% | 0.79 | 81% | 0.814 | S | S | * | * | | | trans | -163.4 | 125.8 | 134.9 | -170.6 | 0 | 0 | 0 | 0 | 113.1 | | |
| 149 | V | 36.1 | Very low | 34.5 | Very low | 127 Ų | 127 | 131.6 Ų | 131.6 | 77% | 0.77 | 82% | 0.815 | S | S | * | * | | | trans | -50.6 | 145.1 | 162.7 | -90.5 | 0 | 0 | 0 | 0 | 115.1 | | |
| 150 | R | 34.3 | Very low | 34.4 | Very low | 247 Ų | 247 | 131.9 Ų | 131.9 | 93% | 0.932 | 81% | 0.814 | S | S | * | * | | | | 173.8 | 143.1 | 114 | -97.8 | 175.5 | 174.3 | -115.2 | 0.8 | 113.2 | | |
| 151 | S | 34.5 | Very low | 34.9 | Very low | 132 Ų | 132 | 134.4 Ų | 134.4 | 92% | 0.923 | 82% | 0.815 | S | S | * | * | | | trans | -96 | 162.1 | -177.6 | -37 | 0 | 0 | 0 | 0 | 112.9 | | |
| 152 | G | 31.1 | Very low | 34.9 | Very low | 71 Ų | 71 | 134.1 Ų | 134.1 | 73% | 0.732 | 82% | 0.815 | S | S | * | * | | | trans | 150.3 | 93.5 | 162.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | | |
| 153 | A | 33 | Very low | 35 | Very low | 98 Ų | 98 | 130.4 Ų | 130.4 | 81% | 0.81 | 81% | 0.812 | S | S | * | * | | | | 67.7 | 109.1 | 87.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | | |
| 154 | S | 33 | Very low | 35.6 | Very low | 128 Ų | 128 | 131.4 Ų | 131.4 | 90% | 0.895 | 82% | 0.815 | S | S | * | * | | | trans | 173.9 | 127.3 | 133.6 | -74.4 | 0 | 0 | 0 | 0 | 111.3 | | |
| 155 | T | 38.4 | Very low | 36.1 | Very low | 134 Ų | 134 | 131.2 Ų | 131.2 | 82% | 0.822 | 82% | 0.816 | S | S | * | * | | | trans | -102.4 | 147.9 | 156.2 | -11.9 | 0 | 0 | 0 | 0 | 106.2 | | |
| 156 | P | 42.8 | Very low | 36.7 | Very low | 126 Ų | 126 | 125.2 Ų | 125.2 | 82% | 0.818 | 81% | 0.806 | S | S | * | * | | | | -152.6 | 158.1 | 82.9 | 36.1 | -16 | 0 | 0 | 0 | 116.6 | | |
| 157 | G | 28.6 | Very low | 36.6 | Very low | 72 Ų | 72 | 125.4 Ų | 125.4 | 74% | 0.742 | 81% | 0.808 | S | S | * | * | | | trans | 83.7 | 106.2 | 130.8 | 0 | 0 | 0 | 0 | 0 | 122 | | |
| 158 | S | 29.7 | Very low | 36.2 | Very low | 126 Ų | 126 | 124.4 Ų | 124.4 | 88% | 0.881 | 81% | 0.805 | S | S | * | * | | | trans | 87.7 | 135.6 | 131.5 | -137.9 | 0 | 0 | 0 | 0 | 122.7 | | |
| 159 | A | 29.9 | Very low | 36.5 | Very low | 87 Ų | 87 | 124.3 Ų | 124.3 | 72% | 0.719 | 81% | 0.805 | S | S | * | * | | | trans | 72.5 | 110.3 | 157.8 | 0 | 0 | 0 | 0 | 0 | 119.5 | | |
| 160 | V | 36.1 | Very low | 36.4 | Very low | 137 Ų | 137 | 122.3 Ų | 122.3 | 83% | 0.83 | 80% | 0.795 | S | S | * | * | | | | 169.4 | 110 | 112.6 | 163.3 | 0 | 0 | 0 | 0 | 108 | | |
| 161 | T | 39 | Very low | 36.4 | Very low | 131 Ų | 131 | 121.1 Ų | 121.1 | 80% | 0.804 | 79% | 0.791 | S | S | * | * | | | trans | -85.7 | 143.2 | 155.9 | 29.8 | 0 | 0 | 0 | 0 | 108.7 | | |
| 162 | P | 41.3 | Very low | 36.4 | Very low | 127 Ų | 127 | 121.7 Ų | 121.7 | 83% | 0.825 | 79% | 0.789 | S | S | * | * | | | | -141.9 | 134.8 | 98.8 | 34.9 | -19.6 | 0 | 0 | 0 | 113.1 | | |
| 163 | G | 30.5 | Very low | 36.8 | Very low | 74 Ų | 74 | 124.3 Ų | 124.3 | 76% | 0.763 | 79% | 0.793 | S | S | * | * | | | trans | 160.4 | 76.4 | 169.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | | |
| 164 | T | 47.1 | Very low | 36.8 | Very low | 117 Ų | 117 | 123.5 Ų | 123.5 | 72% | 0.718 | 79% | 0.794 | S | S | * | * | | | trans | -121.3 | 148.7 | 160.5 | -14.7 | 0 | 0 | 0 | 0 | 107 | P166 | T164-P166 HydrophobicContact CG2-CB 4.47Å; T164-P166 HydrophobicContact CG2-CG 4.19Å |
| 165 | P | 48 | Very low | 36.7 | Very low | 127 Ų | 127 | 123.1 Ų | 123.1 | 83% | 0.825 | 79% | 0.792 | S | S | * | * | | | | -134.3 | 155.1 | 81.3 | 36.4 | -24 | 0 | 0 | 0 | 115.1 | | |
| 166 | P | 50.2 | Low | 36.8 | Very low | 102 Ų | 102 | 128 Ų | 128 | 66% | 0.662 | 80% | 0.795 | S | S | * | * | | | trans | -96.3 | 164.4 | 174.1 | 38.1 | -28.4 | 0 | 0 | 0 | 112.1 | T164 | T164-P166 HydrophobicContact CG2-CB 4.47Å; T164-P166 HydrophobicContact CG2-CG 4.19Å |
| 167 | S | 32.9 | Very low | 36.5 | Very low | 109 Ų | 109 | 128.4 Ų | 128.4 | 76% | 0.762 | 80% | 0.795 | S | S | * | * | | | trans | 53.3 | 102.6 | 143.7 | -160.7 | 0 | 0 | 0 | 0 | 119.1 | S169 | S167-S169 PolarHBondContact O-N 3.1Š|
| 168 | Y | 32.5 | Very low | 37.1 | Very low | 227 Ų | 227 | 130.8 Ų | 130.8 | 89% | 0.89 | 80% | 0.798 | S | S | * | * | | | trans | -85.4 | 99.4 | 152.7 | -77 | -84 | 0 | 0 | 0 | 109.5 | | |
| 169 | S | 37.4 | Very low | 37.1 | Very low | 112 Ų | 112 | 128.4 Ų | 128.4 | 78% | 0.783 | 79% | 0.794 | S | S | * | * | | | trans | -88.3 | 125.2 | 149.3 | -172.9 | 0 | 0 | 0 | 0 | 107.4 | S167 | S167-S169 PolarHBondContact O-N 3.1Š|
| 170 | C | 33.3 | Very low | 37.2 | Very low | 84 Ų | 84 | 129 Ų | 129 | 57% | 0.568 | 79% | 0.792 | S | S | * | * | | | trans | -123.3 | 116.8 | 178.3 | -91.9 | 0 | 0 | 0 | 0 | 111.8 | | |
| 171 | R | 35.8 | Very low | 37.2 | Very low | 223 Ų | 223 | 130.7 Ų | 130.7 | 84% | 0.842 | 79% | 0.791 | S | S | * | * | | | | 100.3 | 103.9 | 128.8 | -68 | 171.7 | -172.1 | -99.6 | 0.7 | 119.1 | | |
| 172 | T | 33.2 | Very low | 37.2 | Very low | 143 Ų | 143 | 130.6 Ų | 130.6 | 88% | 0.877 | 79% | 0.79 | S | S | * | * | | | | -112.2 | 133.5 | 125.8 | 17.9 | 0 | 0 | 0 | 0 | 108.3 | | |
| 173 | P | 41.1 | Very low | 37.5 | Very low | 126 Ų | 126 | 130.2 Ų | 130.2 | 82% | 0.818 | 79% | 0.788 | S | S | * | * | | | trans | -95.4 | 119.8 | 179.4 | 32.8 | -26.3 | 0 | 0 | 0 | 111.9 | | |
| 174 | G | 31 | Very low | 38.2 | Very low | 81 Ų | 81 | 136.2 Ų | 136.2 | 84% | 0.835 | 79% | 0.793 | S | S | * | * | | | trans | -117.6 | 122.5 | 155.7 | 0 | 0 | 0 | 0 | 0 | 108.2 | | |
| 175 | S | 32.3 | Very low | 37.5 | Very low | 121 Ų | 121 | 136.3 Ų | 136.3 | 85% | 0.846 | 80% | 0.798 | S | S | * | * | | | trans | -108.3 | 133.1 | 175.9 | -179.7 | 0 | 0 | 0 | 0 | 109.5 | | |
| 176 | R | 39.5 | Very low | 36.9 | Very low | 236 Ų | 236 | 139.7 Ų | 139.7 | 89% | 0.891 | 80% | 0.801 | S | S | * | * | | | trans | -141.1 | 137.5 | 161 | -80.5 | -172.2 | 124.4 | -161.5 | 0.5 | 108.6 | | |
| 177 | T | 36.5 | Very low | 36.5 | Very low | 134 Ų | 134 | 140.1 Ų | 140.1 | 82% | 0.822 | 81% | 0.806 | S | S | * | * | | | trans | -173.7 | 166.3 | 138.5 | 36.7 | 0 | 0 | 0 | 0 | 108.1 | | |
| 178 | P | 41.5 | Very low | 36.7 | Very low | 122 Ų | 122 | 140.6 Ų | 140.6 | 79% | 0.792 | 80% | 0.804 | S | S | * | * | | | cis | -136.5 | 169.1 | -46.3 | 37.2 | -20.7 | 0 | 0 | 0 | 113.1 | | |
| 179 | G | 30.7 | Very low | 37 | Very low | 77 Ų | 77 | 136.4 Ų | 136.4 | 79% | 0.794 | 80% | 0.796 | S | S | * | * | | | trans | 103.7 | 115 | 143.1 | 0 | 0 | 0 | 0 | 0 | 120.6 | | |
| 180 | S | 30.7 | Very low | 37 | Very low | 98 Ų | 98 | 139.1 Ų | 139.1 | 69% | 0.685 | 80% | 0.796 | S | S | * | * | | | trans | 100.4 | 120.4 | 134.7 | -106.9 | 0 | 0 | 0 | 0 | 123.5 | | |
| 181 | H | 37.5 | Very low | 37.3 | Very low | 173 Ų | 173 | 144.3 Ų | 144.3 | 80% | 0.801 | 81% | 0.813 | S | S | * | * | | | trans | 79.9 | 116.3 | 150.1 | -52.4 | -60.1 | 0 | 0 | 0 | 121.6 | | |
| 182 | T | 39 | Very low | 37.8 | Very low | 129 Ų | 129 | 143.4 Ų | 143.4 | 79% | 0.791 | 82% | 0.815 | S | S | * | * | | | trans | -50.9 | 176.9 | 159.7 | 49.1 | 0 | 0 | 0 | 0 | 115.1 | | |
| 183 | P | 47.3 | Very low | 38.5 | Very low | 120 Ų | 120 | 146.6 Ų | 146.6 | 78% | 0.779 | 82% | 0.816 | S | S | * | * | | | cis | -132.5 | 179.1 | -5.3 | 22.2 | 3.4 | 0 | 0 | 0 | 115.1 | | |
| 184 | K | 43.9 | Very low | 38.9 | Very low | 199 Ų | 199 | 147.4 Ų | 147.4 | 87% | 0.865 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 138.5 | 168.6 | -59.6 | 167.5 | 180 | 173 | 0 | 111.9 | | |
| 185 | S | 33.4 | Very low | 39.6 | Very low | 120 Ų | 120 | 147.9 Ų | 147.9 | 84% | 0.839 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -102.5 | 152.3 | 165.2 | 57.8 | 0 | 0 | 0 | 0 | 111.6 | | |
| 186 | F | 35 | Very low | 40.5 | Very low | 198 Ų | 198 | 147.3 Ų | 147.3 | 87% | 0.868 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -81.2 | 146.3 | -157.5 | -74.5 | -109.6 | 0 | 0 | 0 | 113.7 | | |
| 187 | S | 41.1 | Very low | 40.8 | Very low | 111 Ų | 111 | 143.5 Ų | 143.5 | 78% | 0.776 | 80% | 0.801 | S | S | * | * | | | trans | -90.2 | 115.7 | 160.5 | 50.3 | 0 | 0 | 0 | 0 | 109.9 | | |
| 188 | V | 38.1 | Very low | 41.5 | Very low | 119 Ų | 119 | 147.4 Ų | 147.4 | 72% | 0.721 | 80% | 0.801 | S | S | * | * | | | trans | -153.6 | 115.7 | 161.9 | 165 | 0 | 0 | 0 | 0 | 110.9 | | |
| 189 | L | 38.3 | Very low | 42.1 | Very low | 138 Ų | 138 | 147 Ų | 147 | 72% | 0.723 | 80% | 0.796 | S | S | * | * | | | trans | 65.6 | 120.1 | 140.9 | -60.8 | 175.1 | 0 | 0 | 0 | 124.2 | | |
| 190 | Q | 38.6 | Very low | 43.2 | Very low | 169 Ų | 169 | 148.7 Ų | 148.7 | 79% | 0.79 | 79% | 0.794 | S | S | * | * | | | trans | 66.9 | 137 | 141.6 | -57 | -175 | 6.8 | 0 | 0 | 115.3 | | |
| 191 | E | 38.7 | Very low | 44.1 | Very low | 194 Ų | 194 | 149.9 Ų | 149.9 | 91% | 0.907 | 80% | 0.799 | S | S | * | * | | | | -156.4 | 163.2 | 62.6 | -47.2 | -174.4 | 169.4 | 0 | 0 | 112.6 | | |
| 192 | K | 46.4 | Very low | 44.6 | Very low | 204 Ų | 204 | 151.4 Ų | 151.4 | 89% | 0.887 | 80% | 0.803 | S | S | * | * | | | trans | -64.1 | 124.7 | -175.8 | -67 | 148 | 170.9 | 166.2 | 0 | 113.1 | | |
| 193 | K | 47.2 | Very low | 44.8 | Very low | 210 Ų | 210 | 150.2 Ų | 150.2 | 91% | 0.913 | 80% | 0.8 | S | S | * | * | | | trans | -144.4 | 131 | 141.8 | -75.8 | -159.6 | 172.9 | 179.3 | 0 | 112.3 | | |
| 194 | V | 49.8 | Very low | 44.9 | Very low | 142 Ų | 142 | 150.8 Ų | 150.8 | 86% | 0.861 | 80% | 0.804 | S | S | * | * | | | trans | -65.3 | 129.5 | -178.7 | 173.6 | 0 | 0 | 0 | 0 | 110.6 | | |
| 195 | A | 46.9 | Very low | 44.8 | Very low | 92 Ų | 92 | 146.1 Ų | 146.1 | 76% | 0.76 | 80% | 0.796 | S | S | * | * | | | trans | -147.1 | 122.5 | 151.2 | 0 | 0 | 0 | 0 | 0 | 108.7 | I197 | A195-I197 PolarHBondContact O-N 2.94Š|
| 196 | V | 49.3 | Very low | 45.8 | Very low | 109 Ų | 109 | 145.6 Ų | 145.6 | 66% | 0.661 | 79% | 0.793 | S | S | * | * | | | trans | -48.6 | 125 | -179 | 176 | 0 | 0 | 0 | 0 | 110.8 | R198 | V196-R198 VanDerWaalsContact C-N 3.32Å; V196-R198 HydrophobicContact CG1-CG 3.83Å; V196-R198 PolarHBondContact O-N 2.99Å |
| 197 | I | 47.4 | Very low | 46.7 | Very low | 155 Ų | 155 | 142.1 Ų | 142.1 | 80% | 0.795 | 79% | 0.788 | S | S | * | * | | | trans | -59.8 | 96.9 | 164.8 | -60.9 | 172.6 | 0 | 0 | 0 | 107.1 | A195 T199 | A195-I197 PolarHBondContact O-N 2.94Å; I197-T199 HydrophobicContact CG2-CG2 4.36Å |
| 198 | R | 50.6 | Low | 47.1 | Very low | 217 Ų | 217 | 144.7 Ų | 144.7 | 82% | 0.819 | 79% | 0.787 | S | S | * | * | | | trans | -108.5 | 92.6 | 157.6 | -63.8 | -169 | 113.6 | 97.6 | -2 | 106.3 | V196 | V196-R198 VanDerWaalsContact C-N 3.32Å; V196-R198 HydrophobicContact CG1-CG 3.83Å; V196-R198 PolarHBondContact O-N 2.99Å |
| 199 | T | 53.5 | Low | 47.7 | Very low | 112 Ų | 112 | 150.5 Ų | 150.5 | 69% | 0.687 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -46.7 | 134 | 157.4 | 38.9 | 0 | 0 | 0 | 0 | 108.5 | I197 | I197-T199 HydrophobicContact CG2-CG2 4.36Š|
| 200 | P | 55 | Low | 48.3 | Very low | 114 Ų | 114 | 151.6 Ų | 151.6 | 74% | 0.74 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 138.7 | 174.2 | 20.7 | -28.8 | 0 | 0 | 0 | 108.8 | K202 | P200-K202 PolarHBondContact O-N 3.31Š|
| 201 | P | 49.4 | Very low | 48.8 | Very low | 122 Ų | 122 | 151.4 Ų | 151.4 | 79% | 0.792 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 128.8 | -176.3 | 23.7 | -32.2 | 0 | 0 | 0 | 109.2 | S203 | P201-S203 PolarHBondContact O-N 2.9Å; P201-S203 VanDerWaalsContact O-N 3.09Å |
| 202 | K | 47.4 | Very low | 49.7 | Very low | 206 Ų | 206 | 150.5 Ų | 150.5 | 90% | 0.896 | 79% | 0.794 | S | S | * | * | | | trans | -45.6 | 118 | 170.8 | -78.2 | 160.8 | 174.4 | 166.5 | 0 | 108.6 | P200 | P200-K202 PolarHBondContact O-N 3.31Š|
| 203 | S | 42.3 | Very low | 50 | Low | 104 Ų | 104 | 146.9 Ų | 146.9 | 73% | 0.727 | 79% | 0.789 | S | S | * | * | | | trans | -42 | 141.6 | 161.6 | -31.2 | 0 | 0 | 0 | 0 | 109.1 | P201 S205 | P201-S203 PolarHBondContact O-N 2.9Å; P201-S203 VanDerWaalsContact O-N 3.09Å; S203-S205 PolarHBondContact O-N 2.96Å |
| 204 | P | 49.8 | Very low | 50.5 | Low | 131 Ų | 131 | 142.7 Ų | 142.7 | 85% | 0.851 | 78% | 0.775 | S | S | * | * | | | trans | -60.1 | 115 | -179.5 | 25.6 | -31.4 | 0 | 0 | 0 | 108.3 | S206 | P204-S206 PolarHBondContact O-N 2.97Š|
| 205 | S | 43.3 | Very low | 51 | Low | 101 Ų | 101 | 143.5 Ų | 143.5 | 71% | 0.706 | 78% | 0.775 | S | S | * | * | | | trans | -40.7 | 126.8 | 173.8 | -175.9 | 0 | 0 | 0 | 0 | 109.8 | S203 V207 | S203-S205 PolarHBondContact O-N 2.96Å; S205-V207 VanDerWaalsContact C-N 3.26Å; S205-V207 PolarHBondContact O-N 3.19Å |
| 206 | S | 54.4 | Low | 51.9 | Low | 110 Ų | 110 | 146.1 Ų | 146.1 | 77% | 0.769 | 77% | 0.771 | S | S | * | * | | | trans | -61.8 | 96.2 | 167.4 | 69.5 | 0 | 0 | 0 | 0 | 107.2 | P204 Q208 | P204-S206 PolarHBondContact O-N 2.97Å; S206-Q208 PolarHBondContact O-N 2.98Å |
| 207 | V | 52.2 | Low | 52.9 | Low | 125 Ų | 125 | 146.3 Ų | 146.3 | 76% | 0.758 | 77% | 0.774 | S | S | * | * | | | trans | -58.6 | 115.7 | 171.4 | 175.1 | 0 | 0 | 0 | 0 | 106.2 | S205 R209 | S205-V207 VanDerWaalsContact C-N 3.26Å; S205-V207 PolarHBondContact O-N 3.19Å; V207-R209 PolarHBondContact O-N 3.04Å; V207-R209 VanDerWaalsContact O-N 3.07Å |
| 208 | Q | 49.7 | Very low | 53.8 | Low | 165 Ų | 165 | 146.4 Ų | 146.4 | 77% | 0.771 | 78% | 0.776 | S | S | * | * | | | trans | -44.4 | 116.3 | 170.8 | -66.4 | 173 | -21.2 | 0 | 0 | 108 | S206 Q210 | S206-Q208 PolarHBondContact O-N 2.98Å; Q208-Q210 PolarHBondContact O-N 3.17Å |
| 209 | R | 51.2 | Low | 54.9 | Low | 240 Ų | 240 | 141.4 Ų | 141.4 | 91% | 0.906 | 77% | 0.771 | S | S | * | * | | | trans | -67.3 | 80.9 | 168.1 | -69.4 | -171.7 | -177 | 108.1 | -1.8 | 107.8 | V207 L211 | V207-R209 PolarHBondContact O-N 3.04Å; V207-R209 VanDerWaalsContact O-N 3.07Å; R209-L211 PolarHBondContact O-N 3.02Å |
| 210 | Q | 50.4 | Low | 55.8 | Low | 162 Ų | 162 | 140.9 Ų | 140.9 | 76% | 0.757 | 77% | 0.765 | S | S | * | * | | | trans | -64.5 | 114.4 | 149.1 | -85.3 | -178.2 | -21.6 | 0 | 0 | 106 | Q208 K212 | Q208-Q210 PolarHBondContact O-N 3.17Å; Q210-K212 PolarHBondContact O-N 2.83Å |
| 211 | L | 50 | Low | 56.7 | Low | 164 Ų | 164 | 141.7 Ų | 141.7 | 86% | 0.859 | 76% | 0.762 | S | S | * | * | | | trans | -63 | 84.7 | 171.7 | -69.7 | 160.5 | 0 | 0 | 0 | 108.7 | R209 | R209-L211 PolarHBondContact O-N 3.02Š|
| 212 | K | 57.7 | Low | 57.6 | Low | 176 Ų | 176 | 143.7 Ų | 143.7 | 77% | 0.765 | 76% | 0.758 | S | S | * | * | | | trans | -87.4 | 103.4 | 150.8 | -94.7 | 172.6 | 176.1 | 167.5 | 0 | 106.4 | Q210 I214 | Q210-K212 PolarHBondContact O-N 2.83Å; K212-I214 PolarHBondContact O-N 3.4Å |
| 213 | V | 52.8 | Low | 58.6 | Low | 128 Ų | 128 | 141 Ų | 141 | 78% | 0.776 | 75% | 0.753 | S | S | * | * | | | trans | -63.7 | 92.3 | 163.4 | 176 | 0 | 0 | 0 | 0 | 106.6 | | |
| 214 | I | 56.7 | Low | 59.9 | Low | 121 Ų | 121 | 141.4 Ų | 141.4 | 62% | 0.621 | 75% | 0.751 | S | S | * | * | | | trans | -103 | 108.1 | 165.9 | -99.2 | 175.3 | 0 | 0 | 0 | 105.1 | K212 Q216 | K212-I214 PolarHBondContact O-N 3.4Å; I214-Q216 VanDerWaalsContact C-N 3.29Å; I214-Q216 HydrophobicContact CG2-CB 4.3Å; I214-Q216 HydrophobicContact CG2-CG 3.28Å; I214-Q216 PolarHBondContact O-N 3.27Å |
| 215 | N | 60.2 | Low | 60.7 | Low | 160 Ų | 160 | 143.9 Ų | 143.9 | 86% | 0.856 | 75% | 0.749 | S | S | * | * | | | trans | -62.9 | 89.2 | 169.3 | -94.4 | -61.3 | 0 | 0 | 0 | 108.4 | | |
| 216 | Q | 65.4 | Low | 61.8 | Low | 147 Ų | 147 | 143.4 Ų | 143.4 | 69% | 0.687 | 75% | 0.746 | S | S | * | * | | | trans | -106.8 | 128.7 | 167.8 | -72.8 | -82.6 | -7.5 | 0 | 0 | 108.3 | I214 | I214-Q216 VanDerWaalsContact C-N 3.29Å; I214-Q216 HydrophobicContact CG2-CB 4.3Å; I214-Q216 HydrophobicContact CG2-CG 3.28Å; I214-Q216 PolarHBondContact O-N 3.27Å |
| 217 | P | 71.1 | Confident | 62.5 | Low | 112 Ų | 112 | 148.4 Ų | 148.4 | 73% | 0.727 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -63 | 140.9 | 177.4 | 25.5 | -31.5 | 0 | 0 | 0 | 110.3 | | |
| 218 | L | 66.7 | Low | 62.9 | Low | 158 Ų | 158 | 147.6 Ų | 147.6 | 83% | 0.827 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 141.8 | -179.5 | -79.6 | 75.5 | 0 | 0 | 0 | 110.7 | D220 | L218-D220 PolarHBondContact O-N 3.22Š|
| 219 | P | 73.9 | Confident | 63.4 | Low | 111 Ų | 111 | 142.8 Ų | 142.8 | 72% | 0.721 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 131.7 | 177.4 | 23.8 | -31.3 | 0 | 0 | 0 | 110.8 | L221 | P219-L221 PolarHBondContact O-N 2.9Š|
| 220 | D | 71.8 | Confident | 63.6 | Low | 102 Ų | 102 | 136.2 Ų | 136.2 | 55% | 0.545 | 73% | 0.734 | S | S | . | * | | | trans | -73.6 | 105.9 | -175.6 | -164.1 | -6.4 | 0 | 0 | 0 | 111.1 | L218 K222 | L218-D220 PolarHBondContact O-N 3.22Å; D220-K222 PolarHBondContact O-N 2.99Å; D220-K222 WeakPolarHBondContact OD1-CB 3.41Å; D220-K222 WeakPolarHBondContact OD1-CD 3.35Å; D220-K222 WeakPolarHBondContact OD1-CE 3.26Å; D220-K222 WeakPolarHBondContact OD1-CG 3.07Å; D220-K222 PolarHBondContact OD1-N 3.17Å; D220-K222 IonicContact OD1-NZ 2.83Å; D220-K222 PolarHBondContact OD1-NZ 2.98Å; D220-K222 WeakPolarHBondContact OD2-CD 3.17Å; D220-K222 WeakPolarHBondContact OD2-CE 3.43Å; D220-K222 IonicContact OD2-NZ 3.84Å; D220-K222 PolarHBondContact OD2-NZ 2.92Å |
| 221 | L | 73.7 | Confident | 64.1 | Low | 130 Ų | 130 | 134.1 Ų | 134.1 | 68% | 0.681 | 73% | 0.732 | S | S | * | * | G | 310 helix | trans | -80.2 | 2.9 | -176.3 | -66.6 | 167.9 | 0 | 0 | 0 | 113.7 | P219 N223 V224 | P219-L221 PolarHBondContact O-N 2.9Å; L221-N223 PolarHBondContact O-N 3.22Å; L221-V224 HydrophobicContact CD2-CG2 3.91Å; L221-V224 PolarHBondContact O-N 3.15Å |
| 222 | K | 69.2 | Low | 64.6 | Low | 165 Ų | 165 | 130.2 Ų | 130.2 | 72% | 0.717 | 72% | 0.724 | S | S | * | * | G | 310 helix | trans | -60.1 | -20.3 | -173.2 | -73.1 | 168.3 | -153.2 | 149.7 | 0 | 114.7 | D220 | D220-K222 PolarHBondContact O-N 2.99Å; D220-K222 WeakPolarHBondContact OD1-CB 3.41Å; D220-K222 WeakPolarHBondContact OD1-CD 3.35Å; D220-K222 WeakPolarHBondContact OD1-CE 3.26Å; D220-K222 WeakPolarHBondContact OD1-CG 3.07Å; D220-K222 PolarHBondContact OD1-N 3.17Å; D220-K222 IonicContact OD1-NZ 2.83Å; D220-K222 PolarHBondContact OD1-NZ 2.98Å; D220-K222 WeakPolarHBondContact OD2-CD 3.17Å; D220-K222 WeakPolarHBondContact OD2-CE 3.43Å; D220-K222 IonicContact OD2-NZ 3.84Å; D220-K222 PolarHBondContact OD2-NZ 2.92Å |
| 223 | N | 67.6 | Low | 64.7 | Low | 149 Ų | 149 | 129 Ų | 129 | 80% | 0.797 | 73% | 0.726 | S | S | * | * | G | 310 helix | trans | -113.4 | 10.8 | -177.1 | -60.3 | -33.1 | 0 | 0 | 0 | 114.1 | L221 K225 | L221-N223 PolarHBondContact O-N 3.22Å; N223-K225 PolarHBondContact O-N 3.49Å |
| 224 | V | 70.1 | Confident | 65.1 | Low | 113 Ų | 113 | 129.4 Ų | 129.4 | 69% | 0.685 | 72% | 0.723 | S | S | * | * | | | trans | -81.2 | 88.7 | 177.5 | -176.3 | 0 | 0 | 0 | 0 | 109.4 | L221 | L221-V224 HydrophobicContact CD2-CG2 3.91Å; L221-V224 PolarHBondContact O-N 3.15Å |
| 225 | K | 66.1 | Low | 65.5 | Low | 183 Ų | 183 | 133.3 Ų | 133.3 | 80% | 0.796 | 74% | 0.735 | S | S | * | * | | | trans | -90.6 | 132.6 | 170.7 | 59.8 | -176.1 | 178.2 | -177.7 | 0 | 110.6 | N223 K227 | N223-K225 PolarHBondContact O-N 3.49Å; K225-K227 PolarHBondContact O-N 2.91Å |
| 226 | S | 67.3 | Low | 65.9 | Low | 91 Ų | 91 | 132.1 Ų | 132.1 | 64% | 0.636 | 72% | 0.724 | S | S | * | * | | | trans | -57.6 | 128.3 | 170.7 | 171.8 | 0 | 0 | 0 | 0 | 109.7 | V228 | S226-V228 PolarHBondContact OG-N 3.3Å; S226-V228 PolarHBondContact OG-O 3.04Å |
| 227 | K | 69 | Low | 66 | Low | 214 Ų | 214 | 132.9 Ų | 132.9 | 93% | 0.93 | 73% | 0.728 | S | S | * | * | S | Bend | trans | -79.6 | -6.6 | 173.1 | -69.5 | -171.5 | 177.7 | -177.9 | 0 | 113.2 | K225 | K225-K227 PolarHBondContact O-N 2.91Š|
| 228 | V | 59.7 | Low | 65.4 | Low | 109 Ų | 109 | 132.1 Ų | 132.1 | 66% | 0.661 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -95.9 | 116.5 | 172.8 | -176.3 | 0 | 0 | 0 | 0 | 107 | S226 S230 | S226-V228 PolarHBondContact OG-N 3.3Å; S226-V228 PolarHBondContact OG-O 3.04Å; V228-S230 PolarHBondContact O-N 2.88Å |
| 229 | G | 60.1 | Low | 65.3 | Low | 64 Ų | 64 | 134.5 Ų | 134.5 | 66% | 0.66 | 73% | 0.727 | S | S | * | * | | | trans | -67.3 | 48.6 | -177.2 | 0 | 0 | 0 | 0 | 0 | 115 | T231 A232 | G229-T231 PolarHBondContact O-N 3.18Å; G229-T231 VanDerWaalsContact O-N 3.13Å; G229-A232 PolarHBondContact O-N 3.33Å |
| 230 | S | 56.7 | Low | 64.3 | Low | 102 Ų | 102 | 132.7 Ų | 132.7 | 71% | 0.713 | 73% | 0.728 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.8 | -8.4 | -172.3 | -160.8 | 0 | 0 | 0 | 0 | 114.1 | V228 | V228-S230 PolarHBondContact O-N 2.88Š|
| 231 | T | 60 | Low | 63.7 | Low | 117 Ų | 117 | 131.7 Ų | 131.7 | 72% | 0.718 | 74% | 0.742 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.2 | -2 | -174.6 | 57 | 0 | 0 | 0 | 0 | 114.2 | G229 N233 | G229-T231 PolarHBondContact O-N 3.18Å; G229-T231 VanDerWaalsContact O-N 3.13Å; T231-N233 VanDerWaalsContact C-N 3.26Å; T231-N233 PolarHBondContact O-N 3.02Å |
| 232 | A | 61.9 | Low | 62.7 | Low | 83 Ų | 83 | 134.8 Ų | 134.8 | 69% | 0.686 | 75% | 0.753 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.9 | -15.5 | -171.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | G229 | G229-A232 PolarHBondContact O-N 3.33Š|
| 233 | N | 58.7 | Low | 62.3 | Low | 150 Ų | 150 | 132.8 Ų | 132.8 | 80% | 0.802 | 75% | 0.754 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.6 | 16.1 | -176.6 | -80.9 | -41 | 0 | 0 | 0 | 114.6 | T231 K235 | T231-N233 VanDerWaalsContact C-N 3.26Å; T231-N233 PolarHBondContact O-N 3.02Å; N233-K235 PolarHBondContact O-N 3.18Å |
| 234 | L | 62.4 | Low | 61.8 | Low | 137 Ų | 137 | 133.9 Ų | 133.9 | 72% | 0.717 | 76% | 0.755 | S | S | * | * | | | trans | -84.3 | 76.5 | -178.3 | -147.9 | 73.6 | 0 | 0 | 0 | 111.1 | H236 | L234-H236 HydrophobicContact CG-CB 4.43Å; L234-H236 PolarHBondContact O-N 3.31Å; L234-H236 VanDerWaalsContact O-N 3.11Å |
| 235 | K | 63.3 | Low | 61.5 | Low | 203 Ų | 203 | 135.4 Ų | 135.4 | 88% | 0.883 | 76% | 0.757 | S | S | * | * | | | trans | -76.9 | 23 | 171.4 | -64.5 | -175.9 | -178.6 | 179.3 | 0 | 113.3 | N233 Q237 | N233-K235 PolarHBondContact O-N 3.18Å; K235-Q237 PolarHBondContact O-N 3.38Å |
| 236 | H | 69 | Low | 61.4 | Low | 134 Ų | 134 | 133.6 Ų | 133.6 | 62% | 0.62 | 76% | 0.755 | S | S | * | * | | | trans | -86.9 | 101.7 | 179.5 | 179.1 | -96.3 | 0 | 0 | 0 | 109.3 | L234 P238 | L234-H236 HydrophobicContact CG-CB 4.43Å; L234-H236 PolarHBondContact O-N 3.31Å; L234-H236 VanDerWaalsContact O-N 3.11Å; H236-P238 VanDerWaalsContact O-CD 3.31Å; H236-P238 WeakPolarHBondContact O-CD 3.33Å |
| 237 | Q | 67.1 | Low | 60.7 | Low | 164 Ų | 164 | 134 Ų | 134 | 77% | 0.766 | 76% | 0.758 | S | S | * | * | | | trans | -82.3 | 111.5 | 165.6 | -72.1 | -69.5 | 62.3 | 0 | 0 | 108.6 | K235 K239 | K235-Q237 PolarHBondContact O-N 3.38Å; Q237-K239 PolarHBondContact O-N 3.48Å |
| 238 | P | 60.1 | Low | 60.5 | Low | 95 Ų | 95 | 131.9 Ų | 131.9 | 62% | 0.617 | 75% | 0.752 | S | S | * | * | | | trans | -67.3 | 102.8 | 175.2 | 28.5 | -32.1 | 0 | 0 | 0 | 107.9 | H236 G240 | H236-P238 VanDerWaalsContact O-CD 3.31Å; H236-P238 WeakPolarHBondContact O-CD 3.33Å; P238-G240 PolarHBondContact O-N 3.08Å |
| 239 | K | 63.3 | Low | 60.8 | Low | 209 Ų | 209 | 135.1 Ų | 135.1 | 91% | 0.909 | 76% | 0.757 | S | S | * | * | | | trans | -70 | 74.7 | 166.9 | -73.1 | -177.9 | 176.8 | 179.8 | 0 | 108.5 | Q237 | Q237-K239 PolarHBondContact O-N 3.48Š|
| 240 | G | 53.4 | Low | 61 | Low | 73 Ų | 73 | 138.1 Ų | 138.1 | 75% | 0.753 | 76% | 0.757 | S | S | * | * | | | trans | -72.8 | 136.1 | 170.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | P238 | P238-G240 PolarHBondContact O-N 3.08Š|
| 241 | G | 58.3 | Low | 61.1 | Low | 81 Ų | 81 | 140 Ų | 140 | 84% | 0.835 | 76% | 0.759 | S | S | * | * | | | trans | 116.3 | 18.7 | 153.5 | 0 | 0 | 0 | 0 | 0 | 119.1 | | |
| 242 | Q | 54.2 | Low | 60.9 | Low | 194 Ų | 194 | 141.1 Ų | 141.1 | 91% | 0.907 | 75% | 0.754 | S | S | * | * | | | trans | -123.2 | 47.5 | 173 | -153.1 | 172.4 | 4.5 | 0 | 0 | 113.3 | | |
| 243 | V | 60.2 | Low | 61 | Low | 123 Ų | 123 | 142.5 Ų | 142.5 | 75% | 0.745 | 75% | 0.754 | S | S | * | * | | | trans | -125 | 106.8 | 160 | -176 | 0 | 0 | 0 | 0 | 106.6 | I245 | V243-I245 VanDerWaalsContact C-N 3.32Å; V243-I245 HydrophobicContact CG1-CG1 4.18Å; V243-I245 PolarHBondContact O-N 2.8Å |
| 244 | Q | 56.7 | Low | 60.9 | Low | 173 Ų | 173 | 143.6 Ų | 143.6 | 81% | 0.808 | 75% | 0.754 | S | S | * | * | | | trans | -72.1 | 93.3 | 170.9 | -168.9 | 171.1 | 17.2 | 0 | 0 | 107.1 | L246 | Q244-L246 PolarHBondContact O-N 3.08Š|
| 245 | I | 63.9 | Low | 60.5 | Low | 144 Ų | 144 | 141.9 Ų | 141.9 | 74% | 0.738 | 75% | 0.749 | S | S | * | * | | | trans | -72.4 | 98.5 | 171.6 | -57.1 | 173 | 0 | 0 | 0 | 105.9 | V243 S247 | V243-I245 VanDerWaalsContact C-N 3.32Å; V243-I245 HydrophobicContact CG1-CG1 4.18Å; V243-I245 PolarHBondContact O-N 2.8Å; I245-S247 PolarHBondContact O-N 3.29Å |
| 246 | L | 63.3 | Low | 60.3 | Low | 145 Ų | 145 | 140.8 Ų | 140.8 | 76% | 0.759 | 75% | 0.747 | S | S | * | * | | | trans | -61.6 | 105.3 | 170 | -77 | 164.5 | 0 | 0 | 0 | 107.8 | Q244 E248 | Q244-L246 PolarHBondContact O-N 3.08Å; L246-E248 PolarHBondContact O-N 3.04Å |
| 247 | S | 53.1 | Low | 59.7 | Low | 99 Ų | 99 | 138.9 Ų | 138.9 | 69% | 0.692 | 75% | 0.749 | S | S | * | * | | | trans | -76 | 75.1 | 166.8 | 65.4 | 0 | 0 | 0 | 0 | 108.2 | I245 K249 | I245-S247 PolarHBondContact O-N 3.29Å; S247-K249 VanDerWaalsContact C-N 3.29Å; S247-K249 PolarHBondContact O-N 3.2Å |
| 248 | E | 64.9 | Low | 59.3 | Low | 171 Ų | 171 | 141.3 Ų | 141.3 | 80% | 0.799 | 76% | 0.757 | S | S | * | * | | | trans | -69 | 94.3 | 167.1 | -168.7 | 176.1 | 175 | 0 | 0 | 107.1 | L246 L250 | L246-E248 PolarHBondContact O-N 3.04Å; E248-L250 PolarHBondContact O-N 3.4Å |
| 249 | K | 66 | Low | 59 | Low | 177 Ų | 177 | 141.2 Ų | 141.2 | 77% | 0.77 | 76% | 0.758 | S | S | * | * | | | trans | -66.1 | 116.8 | 170.9 | -67.9 | -173.5 | 177.1 | -168.1 | 0 | 106.3 | S247 D251 | S247-K249 VanDerWaalsContact C-N 3.29Å; S247-K249 PolarHBondContact O-N 3.2Å; K249-D251 PolarHBondContact O-N 2.97Å; K249-D251 VanDerWaalsContact O-N 3.14Å |
| 250 | L | 64.8 | Low | 58.5 | Low | 126 Ų | 126 | 134.1 Ų | 134.1 | 66% | 0.66 | 74% | 0.744 | S | S | * | * | | | trans | -55.3 | 119.7 | 171.8 | -69.5 | 169.6 | 0 | 0 | 0 | 108.7 | E248 F252 | E248-L250 PolarHBondContact O-N 3.4Å; L250-F252 HydrophobicContact CB-CE1 3.93Å; L250-F252 HydrophobicContact CB-CE2 4.23Å; L250-F252 HydrophobicContact CB-CZ 3.74Å; L250-F252 HydrophobicContact CD1-CE1 4.47Å; L250-F252 HydrophobicContact CD1-CZ 4.35Å; L250-F252 WeakPolarHBondContact O-CD2 3.48Å; L250-F252 VanDerWaalsContact O-CE2 3.31Å; L250-F252 WeakPolarHBondContact O-CE2 3.32Å; L250-F252 PolarHBondContact O-N 2.94Å |
| 251 | D | 58.8 | Low | 58.4 | Low | 142 Ų | 142 | 135.1 Ų | 135.1 | 76% | 0.759 | 74% | 0.739 | S | S | * | * | | | trans | -72.8 | 99.5 | 177.7 | -90.2 | -22.8 | 0 | 0 | 0 | 109.6 | K249 T253 | K249-D251 PolarHBondContact O-N 2.97Å; K249-D251 VanDerWaalsContact O-N 3.14Å; D251-T253 PolarHBondContact O-N 3.06Å |
| 252 | F | 54.7 | Low | 58.4 | Low | 141 Ų | 141 | 138.6 Ų | 138.6 | 62% | 0.618 | 73% | 0.732 | S | S | * | * | G | 310 helix | trans | -78 | 22.9 | 178.2 | -58 | -67.1 | 0 | 0 | 0 | 113.6 | L250 H254 V255 | L250-F252 HydrophobicContact CB-CE1 3.93Å; L250-F252 HydrophobicContact CB-CE2 4.23Å; L250-F252 HydrophobicContact CB-CZ 3.74Å; L250-F252 HydrophobicContact CD1-CE1 4.47Å; L250-F252 HydrophobicContact CD1-CZ 4.35Å; L250-F252 WeakPolarHBondContact O-CD2 3.48Å; L250-F252 VanDerWaalsContact O-CE2 3.31Å; L250-F252 WeakPolarHBondContact O-CE2 3.32Å; L250-F252 PolarHBondContact O-N 2.94Å; F252-H254 PolarHBondContact O-N 3.17Å; F252-V255 HydrophobicContact CB-CB 4.19Å; F252-V255 HydrophobicContact CB-CG2 4.31Å; F252-V255 HydrophobicContact CD1-CB 4.26Å; F252-V255 HydrophobicContact CD1-CG2 3.85Å; F252-V255 PolarHBondContact O-N 3.41Å; F252-V255 VanDerWaalsContact O-N 3.08Å |
| 253 | T | 65.1 | Low | 58.4 | Low | 111 Ų | 111 | 136.7 Ų | 136.7 | 68% | 0.681 | 73% | 0.727 | S | S | * | * | G | 310 helix | trans | -57.8 | -23.5 | -177 | 47 | 0 | 0 | 0 | 0 | 113.5 | D251 | D251-T253 PolarHBondContact O-N 3.06Š|
| 254 | H | 56.2 | Low | 58.2 | Low | 174 Ų | 174 | 137.8 Ų | 137.8 | 81% | 0.806 | 73% | 0.729 | S | S | * | * | G | 310 helix | trans | -116.3 | 7.7 | 180 | -63.6 | 81.4 | 0 | 0 | 0 | 113.9 | F252 Q256 | F252-H254 PolarHBondContact O-N 3.17Å; H254-Q256 PolarHBondContact O-N 3.04Å |
| 255 | V | 53.8 | Low | 58.1 | Low | 101 Ų | 101 | 135.6 Ų | 135.6 | 61% | 0.612 | 72% | 0.722 | S | S | * | * | | | trans | -89.7 | 94.3 | 178.2 | -178.3 | 0 | 0 | 0 | 0 | 109.3 | F252 S257 | F252-V255 HydrophobicContact CB-CB 4.19Å; F252-V255 HydrophobicContact CB-CG2 4.31Å; F252-V255 HydrophobicContact CD1-CB 4.26Å; F252-V255 HydrophobicContact CD1-CG2 3.85Å; F252-V255 PolarHBondContact O-N 3.41Å; F252-V255 VanDerWaalsContact O-N 3.08Å; V255-S257 PolarHBondContact O-N 2.78Å |
| 256 | Q | 59.3 | Low | 57.5 | Low | 179 Ų | 179 | 137.7 Ų | 137.7 | 84% | 0.836 | 73% | 0.726 | S | S | * | * | | | trans | -73.9 | 116.4 | 163.6 | -68.5 | -176.4 | -1.3 | 0 | 0 | 108.1 | H254 K258 | H254-Q256 PolarHBondContact O-N 3.04Å; Q256-K258 PolarHBondContact O-N 3.07Å |
| 257 | S | 56.8 | Low | 56.7 | Low | 94 Ų | 94 | 137.4 Ų | 137.4 | 66% | 0.657 | 72% | 0.721 | S | S | * | * | | | trans | -58.5 | 116.5 | 170.9 | 66.5 | 0 | 0 | 0 | 0 | 108.1 | V255 C259 | V255-S257 PolarHBondContact O-N 2.78Å; S257-C259 PolarHBondContact O-N 2.88Å |
| 258 | K | 58.1 | Low | 56.8 | Low | 215 Ų | 215 | 138.6 Ų | 138.6 | 94% | 0.935 | 72% | 0.724 | S | S | * | * | | | trans | -69.2 | 23.3 | 167 | -62.4 | -171.8 | -177.9 | -179.3 | 0 | 112.3 | Q256 G260 | Q256-K258 PolarHBondContact O-N 3.07Å; K258-G260 PolarHBondContact O-N 3.13Å |
| 259 | C | 54.3 | Low | 56 | Low | 93 Ų | 93 | 134.3 Ų | 134.3 | 63% | 0.628 | 71% | 0.711 | S | S | * | * | | | trans | -75.3 | 70.5 | 166.4 | -166.3 | 0 | 0 | 0 | 0 | 107.8 | S257 S261 | S257-C259 PolarHBondContact O-N 2.88Å; C259-S261 PolarHBondContact O-N 2.94Å; C259-S261 WeakPolarHBondContact SG-CB 3.25Å |
| 260 | G | 53.2 | Low | 55.3 | Low | 61 Ų | 61 | 135.6 Ų | 135.6 | 63% | 0.629 | 72% | 0.717 | S | S | * | * | | | trans | -66.9 | 36.7 | 158.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | K258 K262 | K258-G260 PolarHBondContact O-N 3.13Å; G260-K262 PolarHBondContact O-N 3.33Å |
| 261 | S | 51.2 | Low | 54.3 | Low | 93 Ų | 93 | 133.3 Ų | 133.3 | 65% | 0.65 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.9 | 52.2 | -176.9 | -167.2 | 0 | 0 | 0 | 0 | 110.7 | C259 | C259-S261 PolarHBondContact O-N 2.94Å; C259-S261 WeakPolarHBondContact SG-CB 3.25Å |
| 262 | K | 56.9 | Low | 54.1 | Low | 155 Ų | 155 | 130.4 Ų | 130.4 | 67% | 0.674 | 73% | 0.727 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -144.9 | 13.5 | 170.8 | -85.8 | -152.7 | 148.9 | 68.2 | 0 | 116 | G260 N264 | G260-K262 PolarHBondContact O-N 3.33Å; K262-N264 PolarHBondContact O-N 2.92Å |
| 263 | D | 55.4 | Low | 53.6 | Low | 153 Ų | 153 | 131.2 Ų | 131.2 | 82% | 0.818 | 73% | 0.732 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.9 | 3.3 | 171.6 | -61.5 | -23.4 | 0 | 0 | 0 | 113.5 | | |
| 264 | N | 54.8 | Low | 53.1 | Low | 147 Ų | 147 | 130.9 Ų | 130.9 | 79% | 0.786 | 73% | 0.73 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.2 | 44.5 | 170.4 | -86.1 | -52.4 | 0 | 0 | 0 | 112.4 | K262 K266 | K262-N264 PolarHBondContact O-N 2.92Å; N264-K266 PolarHBondContact O-N 3.11Å |
| 265 | L | 54.6 | Low | 52.8 | Low | 126 Ų | 126 | 129.2 Ų | 129.2 | 66% | 0.66 | 72% | 0.723 | S | S | * | * | | | trans | -77.1 | 62.2 | 166.8 | -148.7 | 80.7 | 0 | 0 | 0 | 110.6 | H267 | L265-H267 HydrophobicContact CG-CB 4.29Å; L265-H267 PolarHBondContact O-N 3.35Å |
| 266 | K | 53.1 | Low | 53.1 | Low | 188 Ų | 188 | 129.2 Ų | 129.2 | 82% | 0.817 | 72% | 0.718 | S | S | * | * | | | trans | -76.8 | 61.9 | 161.8 | -65.8 | -117.4 | -174.2 | -170.3 | 0 | 108.7 | N264 T268 | N264-K266 PolarHBondContact O-N 3.11Å; K266-T268 PolarHBondContact O-N 2.81Å |
| 267 | H | 46.4 | Very low | 53.1 | Low | 139 Ų | 139 | 127 Ų | 127 | 64% | 0.644 | 71% | 0.708 | S | S | * | * | | | trans | -82.2 | 105.9 | 168.6 | -178.8 | -118.1 | 0 | 0 | 0 | 107.7 | L265 P269 | L265-H267 HydrophobicContact CG-CB 4.29Å; L265-H267 PolarHBondContact O-N 3.35Å; H267-P269 VanDerWaalsContact C-CD 3.46Å; H267-P269 VanDerWaalsContact CE1-CD 3.48Å; H267-P269 WeakPolarHBondContact CE1-CD 3.45Å; H267-P269 WeakPolarHBondContact CE1-CG 3.21Å; H267-P269 VanDerWaalsContact ND1-CD 3.32Å; H267-P269 WeakPolarHBondContact ND1-CD 3.03Å; H267-P269 VanDerWaalsContact O-CD 3.25Å; H267-P269 WeakPolarHBondContact O-CD 3.1Å |
| 268 | T | 53.8 | Low | 53.1 | Low | 124 Ų | 124 | 127.5 Ų | 127.5 | 76% | 0.761 | 71% | 0.707 | S | S | * | * | | | trans | -107.4 | 88 | 167.8 | -46 | 0 | 0 | 0 | 0 | 108.9 | K266 | K266-T268 PolarHBondContact O-N 2.81Š|
| 269 | P | 47.6 | Very low | 53.3 | Low | 82 Ų | 82 | 125.4 Ų | 125.4 | 53% | 0.532 | 70% | 0.698 | S | S | . | * | | | trans | -83.7 | 114.6 | 165.1 | 36.2 | -33.2 | 0 | 0 | 0 | 107.4 | H267 G271 | H267-P269 VanDerWaalsContact C-CD 3.46Å; H267-P269 VanDerWaalsContact CE1-CD 3.48Å; H267-P269 WeakPolarHBondContact CE1-CD 3.45Å; H267-P269 WeakPolarHBondContact CE1-CG 3.21Å; H267-P269 VanDerWaalsContact ND1-CD 3.32Å; H267-P269 WeakPolarHBondContact ND1-CD 3.03Å; H267-P269 VanDerWaalsContact O-CD 3.25Å; H267-P269 WeakPolarHBondContact O-CD 3.1Å; P269-G271 PolarHBondContact O-N 3.01Å |
| 270 | K | 52 | Low | 53.8 | Low | 204 Ų | 204 | 129.8 Ų | 129.8 | 89% | 0.887 | 71% | 0.706 | S | S | * | * | | | trans | -57 | 118.8 | 170.8 | -69.2 | 173.6 | 175.9 | 176.9 | 0 | 109.2 | | |
| 271 | G | 44.6 | Very low | 54.3 | Low | 77 Ų | 77 | 133.4 Ų | 133.4 | 79% | 0.794 | 71% | 0.71 | S | S | * | * | S | Bend | trans | 78.6 | 104.4 | 156.4 | 0 | 0 | 0 | 0 | 0 | 117.3 | P269 | P269-G271 PolarHBondContact O-N 3.01Š|
| 272 | G | 53.9 | Low | 54.6 | Low | 82 Ų | 82 | 135.3 Ų | 135.3 | 85% | 0.845 | 71% | 0.713 | S | S | * | * | S | Bend | trans | 79.3 | 60.6 | 140.6 | 0 | 0 | 0 | 0 | 0 | 118.7 | | |
| 273 | H | 45 | Very low | 54.9 | Low | 157 Ų | 157 | 133 Ų | 133 | 73% | 0.727 | 71% | 0.707 | S | S | * | * | | | trans | -165.6 | 104.2 | 140.9 | -172.8 | 50.1 | 0 | 0 | 0 | 108.2 | Q275 | H273-Q275 VanDerWaalsContact C-N 3.33Å; H273-Q275 PolarHBondContact O-N 3Å |
| 274 | V | 52.9 | Low | 55.3 | Low | 105 Ų | 105 | 129.1 Ų | 129.1 | 64% | 0.636 | 69% | 0.692 | S | S | * | * | | | trans | -76.7 | 87.3 | 174.9 | 175 | 0 | 0 | 0 | 0 | 107.6 | I276 I307 | V274-I276 HydrophobicContact CG1-CD1 3.9Å; V274-I276 HydrophobicContact CG1-CG1 3.72Å; V274-I276 PolarHBondContact O-N 2.99Å; V274-I307 HydrophobicContact CG1-CD1 3.92Å |
| 275 | Q | 51.8 | Low | 55.4 | Low | 139 Ų | 139 | 130.2 Ų | 130.2 | 65% | 0.65 | 69% | 0.692 | S | S | * | * | | | trans | -83.5 | 86.7 | 173.3 | -158.3 | 179.8 | 25.8 | 0 | 0 | 108.9 | H273 Q277 | H273-Q275 VanDerWaalsContact C-N 3.33Å; H273-Q275 PolarHBondContact O-N 3Å; Q275-Q277 PolarHBondContact O-N 2.96Å |
| 276 | I | 58.9 | Low | 55.7 | Low | 101 Ų | 101 | 130.2 Ų | 130.2 | 52% | 0.518 | 69% | 0.691 | S | S | . | * | | | trans | -71 | 99.9 | 170.5 | -66.3 | 160.8 | 0 | 0 | 0 | 107.2 | V274 T278 I307 | V274-I276 HydrophobicContact CG1-CD1 3.9Å; V274-I276 HydrophobicContact CG1-CG1 3.72Å; V274-I276 PolarHBondContact O-N 2.99Å; I276-T278 VanDerWaalsContact C-N 3.31Å; I276-T278 PolarHBondContact O-N 2.96Å; I276-I307 HydrophobicContact CD1-CD1 3.89Å |
| 277 | Q | 59.2 | Low | 55.9 | Low | 133 Ų | 133 | 126.6 Ų | 126.6 | 62% | 0.621 | 69% | 0.685 | S | S | * | * | | | trans | -73.7 | 89.3 | 169.5 | -70.2 | -175.8 | 17.8 | 0 | 0 | 108.8 | Q275 K279 | Q275-Q277 PolarHBondContact O-N 2.96Å; Q277-K279 VanDerWaalsContact C-N 3.25Å; Q277-K279 PolarHBondContact O-N 3.14Å |
| 278 | T | 57.5 | Low | 56.4 | Low | 103 Ų | 103 | 123.9 Ų | 123.9 | 63% | 0.632 | 69% | 0.687 | S | S | * | * | | | trans | -70.2 | 85.5 | 168.8 | -45.2 | 0 | 0 | 0 | 0 | 108.8 | I276 K280 | I276-T278 VanDerWaalsContact C-N 3.31Å; I276-T278 PolarHBondContact O-N 2.96Å; T278-K280 VanDerWaalsContact C-N 3.26Å; T278-K280 HydrophobicContact CG2-CG 3.98Å; T278-K280 PolarHBondContact O-N 3.2Å |
| 279 | K | 63 | Low | 56.7 | Low | 171 Ų | 171 | 128.1 Ų | 128.1 | 74% | 0.743 | 70% | 0.695 | S | S | * | * | | | trans | -72.8 | 87.3 | 165.6 | -68.6 | -175 | -179.4 | -178.3 | 0 | 107.7 | Q277 I281 | Q277-K279 VanDerWaalsContact C-N 3.25Å; Q277-K279 PolarHBondContact O-N 3.14Å; K279-I281 PolarHBondContact O-N 3.03Å |
| 280 | K | 63.4 | Low | 57.2 | Low | 186 Ų | 186 | 128.5 Ų | 128.5 | 81% | 0.809 | 70% | 0.698 | S | S | * | * | | | trans | -61.4 | 109.1 | 169.1 | -64.4 | -175.1 | -179.5 | 179.9 | 0 | 106.8 | T278 D282 | T278-K280 VanDerWaalsContact C-N 3.26Å; T278-K280 HydrophobicContact CG2-CG 3.98Å; T278-K280 PolarHBondContact O-N 3.2Å; K280-D282 PolarHBondContact O-N 3.07Å |
| 281 | I | 63.6 | Low | 57.5 | Low | 136 Ų | 136 | 122.9 Ų | 122.9 | 70% | 0.697 | 70% | 0.698 | S | S | * | * | | | trans | -71.5 | 115.7 | 170.7 | -58.7 | 173.6 | 0 | 0 | 0 | 105.3 | K279 L283 | K279-I281 PolarHBondContact O-N 3.03Å; I281-L283 HydrophobicContact CB-CG 4.43Å; I281-L283 HydrophobicContact CG2-CD2 3.71Å; I281-L283 HydrophobicContact CG2-CG 3.92Å; I281-L283 PolarHBondContact O-N 3.06Å; I281-L283 VanDerWaalsContact O-N 3.15Å |
| 282 | D | 58.7 | Low | 57.7 | Low | 133 Ų | 133 | 122.5 Ų | 122.5 | 71% | 0.711 | 68% | 0.683 | S | S | * | * | | | trans | -76.8 | 101.2 | 176.6 | -168.6 | 18.8 | 0 | 0 | 0 | 108.7 | K280 S284 | K280-D282 PolarHBondContact O-N 3.07Å; D282-S284 VanDerWaalsContact CG-OG 3.24Å; D282-S284 WeakPolarHBondContact OD1-CB 3.31Å; D282-S284 PolarHBondContact OD1-N 2.8Å; D282-S284 PolarHBondContact OD1-OG 2.92Å; D282-S284 PolarHBondContact OD2-OG 3.08Å |
| 283 | L | 62.5 | Low | 58 | Low | 107 Ų | 107 | 128.1 Ų | 128.1 | 56% | 0.56 | 69% | 0.69 | S | S | * | * | | | trans | -93.8 | 20.9 | -178.3 | -61.4 | 159.3 | 0 | 0 | 0 | 111.1 | I281 H285 I286 | I281-L283 HydrophobicContact CB-CG 4.43Å; I281-L283 HydrophobicContact CG2-CD2 3.71Å; I281-L283 HydrophobicContact CG2-CG 3.92Å; I281-L283 PolarHBondContact O-N 3.06Å; I281-L283 VanDerWaalsContact O-N 3.15Å; L283-H285 PolarHBondContact O-N 3.37Å; L283-I286 HydrophobicContact CB-CD1 4.16Å; L283-I286 HydrophobicContact CB-CG1 4.42Å; L283-I286 HydrophobicContact CD2-CD1 3.38Å; L283-I286 HydrophobicContact CD2-CG1 4.35Å; L283-I286 HydrophobicContact CG-CD1 4.32Å; L283-I286 PolarHBondContact O-N 2.86Å |
| 284 | S | 63 | Low | 58.5 | Low | 71 Ų | 71 | 124.5 Ų | 124.5 | 50% | 0.497 | 68% | 0.682 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -54.2 | -20.1 | -176.2 | 49.2 | 0 | 0 | 0 | 0 | 114.9 | D282 | D282-S284 VanDerWaalsContact CG-OG 3.24Å; D282-S284 WeakPolarHBondContact OD1-CB 3.31Å; D282-S284 PolarHBondContact OD1-N 2.8Å; D282-S284 PolarHBondContact OD1-OG 2.92Å; D282-S284 PolarHBondContact OD2-OG 3.08Å |
| 285 | H | 57.3 | Low | 58.7 | Low | 171 Ų | 171 | 126.3 Ų | 126.3 | 79% | 0.792 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105 | 4.6 | -177.8 | -63.9 | 77 | 0 | 0 | 0 | 114.3 | L283 T287 | L283-H285 PolarHBondContact O-N 3.37Å; H285-T287 PolarHBondContact O-N 3.11Å |
| 286 | I | 60.3 | Low | 59.2 | Low | 125 Ų | 125 | 126.1 Ų | 126.1 | 64% | 0.641 | 69% | 0.691 | S | S | * | * | | | trans | -87.6 | 86 | 174.2 | -54.4 | -174.2 | 0 | 0 | 0 | 108.8 | L283 A288 | L283-I286 HydrophobicContact CB-CD1 4.16Å; L283-I286 HydrophobicContact CB-CG1 4.42Å; L283-I286 HydrophobicContact CD2-CD1 3.38Å; L283-I286 HydrophobicContact CD2-CG1 4.35Å; L283-I286 HydrophobicContact CG-CD1 4.32Å; L283-I286 PolarHBondContact O-N 2.86Å; I286-A288 PolarHBondContact O-N 3.04Å |
| 287 | T | 58.4 | Low | 59.4 | Low | 112 Ų | 112 | 129.6 Ų | 129.6 | 69% | 0.687 | 70% | 0.704 | S | S | * | * | | | trans | -78.5 | 111.8 | 165.3 | 57.5 | 0 | 0 | 0 | 0 | 108.1 | H285 K289 | H285-T287 PolarHBondContact O-N 3.11Å; T287-K289 PolarHBondContact O-N 2.91Å; T287-K289 VanDerWaalsContact O-N 3.13Å |
| 288 | A | 57.5 | Low | 59.7 | Low | 83 Ų | 83 | 130.1 Ų | 130.1 | 69% | 0.686 | 71% | 0.706 | S | S | * | * | | | trans | -58.5 | 118.7 | 170.7 | 0 | 0 | 0 | 0 | 0 | 108.8 | I286 C290 | I286-A288 PolarHBondContact O-N 3.04Å; A288-C290 PolarHBondContact O-N 2.87Å |
| 289 | K | 60.4 | Low | 60.2 | Low | 213 Ų | 213 | 136.2 Ų | 136.2 | 93% | 0.926 | 72% | 0.718 | S | S | * | * | | | trans | -77.1 | 37.6 | 172.6 | -64.9 | -158 | 178.1 | -173.5 | 0 | 112 | T287 | T287-K289 PolarHBondContact O-N 2.91Å; T287-K289 VanDerWaalsContact O-N 3.13Å |
| 290 | C | 57.4 | Low | 60 | Low | 90 Ų | 90 | 132.9 Ų | 132.9 | 61% | 0.608 | 71% | 0.714 | S | S | * | * | | | trans | -100.5 | 98.1 | 173 | -172.1 | 0 | 0 | 0 | 0 | 107.5 | A288 S292 | A288-C290 PolarHBondContact O-N 2.87Å; C290-S292 PolarHBondContact O-N 3.49Å |
| 291 | G | 57.9 | Low | 59.9 | Low | 86 Ų | 86 | 127.8 Ų | 127.8 | 89% | 0.887 | 71% | 0.714 | S | S | * | * | | | trans | -73.8 | 59.5 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113 | | |
| 292 | S | 47.9 | Very low | 60.1 | Low | 68 Ų | 68 | 124.2 Ų | 124.2 | 48% | 0.476 | 71% | 0.711 | S | S | . | * | | | trans | -132.3 | 86.5 | 169.4 | -170.8 | 0 | 0 | 0 | 0 | 109.4 | C290 S294 | C290-S292 PolarHBondContact O-N 3.49Å; S292-S294 PolarHBondContact O-N 3.19Å; S292-S294 VanDerWaalsContact O-N 3.08Å |
| 293 | M | 60.4 | Low | 60.4 | Low | 201 Ų | 201 | 121.3 Ų | 121.3 | 99% | 0.99 | 71% | 0.712 | S | S | * | * | | | trans | -82.1 | 51.6 | 178.7 | -69.1 | -163.8 | 68.6 | 0 | 0 | 112.2 | | |
| 294 | S | 56 | Low | 60.5 | Low | 80 Ų | 80 | 123.7 Ų | 123.7 | 56% | 0.559 | 73% | 0.726 | S | S | * | * | S | Bend | trans | -134 | 103.4 | 167 | 56.7 | 0 | 0 | 0 | 0 | 110.3 | S292 | S292-S294 PolarHBondContact O-N 3.19Å; S292-S294 VanDerWaalsContact O-N 3.08Å |
| 295 | N | 58.3 | Low | 60.3 | Low | 143 Ų | 143 | 126.8 Ų | 126.8 | 77% | 0.765 | 74% | 0.735 | S | S | * | * | | | trans | 69.2 | 57.3 | 159.8 | -56.3 | -18.8 | 0 | 0 | 0 | 117.8 | | |
| 296 | I | 60.9 | Low | 60.8 | Low | 136 Ų | 136 | 130 Ų | 130 | 70% | 0.697 | 74% | 0.74 | S | S | * | * | | | trans | -103 | 85.5 | 160.9 | -50.8 | 179.5 | 0 | 0 | 0 | 109 | H298 | I296-H298 HydrophobicContact CG2-CB 3.96Å; I296-H298 PolarHBondContact O-N 2.94Å |
| 297 | H | 63.3 | Low | 60.9 | Low | 173 Ų | 173 | 128.5 Ų | 128.5 | 80% | 0.801 | 73% | 0.733 | S | S | * | * | | | trans | -77.4 | 66.5 | 166.4 | -72.4 | -69 | 0 | 0 | 0 | 110.2 | R299 | H297-R299 PolarHBondContact O-N 3.13Å; H297-R299 VanDerWaalsContact O-N 3.17Å |
| 298 | H | 66 | Low | 61.3 | Low | 145 Ų | 145 | 131.1 Ų | 131.1 | 67% | 0.671 | 74% | 0.737 | S | S | * | * | | | trans | -81.5 | 96.2 | 172.1 | -176.3 | -99.7 | 0 | 0 | 0 | 109.2 | I296 P300 | I296-H298 HydrophobicContact CG2-CB 3.96Å; I296-H298 PolarHBondContact O-N 2.94Å; H298-P300 VanDerWaalsContact O-CD 3.26Å; H298-P300 WeakPolarHBondContact O-CD 3.16Å |
| 299 | R | 67.3 | Low | 61.4 | Low | 230 Ų | 230 | 134.5 Ų | 134.5 | 87% | 0.868 | 74% | 0.743 | S | S | * | * | | | trans | -86.3 | 105.9 | 162.9 | -70.6 | -172.3 | 178.6 | -120 | 1.1 | 107.1 | H297 G301 | H297-R299 PolarHBondContact O-N 3.13Å; H297-R299 VanDerWaalsContact O-N 3.17Å; R299-G301 PolarHBondContact O-N 3.19Å |
| 300 | P | 59.7 | Low | 62.1 | Low | 101 Ų | 101 | 128.4 Ų | 128.4 | 66% | 0.656 | 72% | 0.724 | S | S | * | * | | | trans | -62.8 | 107.2 | 173.6 | 25.7 | -31.6 | 0 | 0 | 0 | 107.4 | H298 G302 | H298-P300 VanDerWaalsContact O-CD 3.26Å; H298-P300 WeakPolarHBondContact O-CD 3.16Å; P300-G302 PolarHBondContact O-N 3.1Å |
| 301 | G | 61 | Low | 62.7 | Low | 80 Ų | 80 | 132.6 Ų | 132.6 | 83% | 0.825 | 73% | 0.732 | S | S | * | * | | | trans | -62.5 | 99.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 109 | R299 | R299-G301 PolarHBondContact O-N 3.19Š|
| 302 | G | 68.5 | Low | 63.1 | Low | 61 Ų | 61 | 133.7 Ų | 133.7 | 63% | 0.629 | 72% | 0.717 | S | S | * | * | | | trans | -67.5 | 131.4 | 169 | 0 | 0 | 0 | 0 | 0 | 109.4 | P300 N304 | P300-G302 PolarHBondContact O-N 3.1Å; G302-N304 PolarHBondContact O-N 3.33Å |
| 303 | G | 65.3 | Low | 63.7 | Low | 71 Ų | 71 | 136.3 Ų | 136.3 | 73% | 0.732 | 73% | 0.726 | S | S | * | * | | | trans | -64.5 | 114.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | I305 | G303-I305 PolarHBondContact O-N 2.9Š|
| 304 | N | 63.2 | Low | 63.7 | Low | 158 Ų | 158 | 133.1 Ų | 133.1 | 85% | 0.845 | 71% | 0.706 | S | S | * | * | | | trans | -75.3 | 76.8 | 169.8 | -70.3 | -17.5 | 0 | 0 | 0 | 109.3 | G302 R306 | G302-N304 PolarHBondContact O-N 3.33Å; N304-R306 PolarHBondContact O-N 3.05Å; N304-R306 VanDerWaalsContact O-N 3.1Å |
| 305 | I | 59.4 | Low | 64.2 | Low | 136 Ų | 136 | 137.7 Ų | 137.7 | 70% | 0.697 | 72% | 0.716 | S | S | * | * | | | trans | -79.5 | 93 | 173 | -51.7 | -179.6 | 0 | 0 | 0 | 108 | G303 I307 | G303-I305 PolarHBondContact O-N 2.9Å; I305-I307 HydrophobicContact CG2-CD1 4.36Å; I305-I307 HydrophobicContact CG2-CG1 3.8Å |
| 306 | R | 67.4 | Low | 64.5 | Low | 238 Ų | 238 | 137.9 Ų | 137.9 | 90% | 0.898 | 72% | 0.717 | S | S | * | * | | | trans | -83.7 | 110 | 164.2 | -78.7 | 179.9 | 169.9 | 168.1 | -3.5 | 108 | N304 | N304-R306 PolarHBondContact O-N 3.05Å; N304-R306 VanDerWaalsContact O-N 3.1Å |
| 307 | I | 63 | Low | 64.5 | Low | 94 Ų | 94 | 141 Ų | 141 | 48% | 0.482 | 73% | 0.726 | S | S | . | * | | | trans | -89.7 | 106.2 | 172.9 | -57.3 | 178.9 | 0 | 0 | 0 | 107.2 | V274 I276 I305 | V274-I307 HydrophobicContact CG1-CD1 3.92Å; I276-I307 HydrophobicContact CD1-CD1 3.89Å; I305-I307 HydrophobicContact CG2-CD1 4.36Å; I305-I307 HydrophobicContact CG2-CG1 3.8Å |
| 308 | E | 67.1 | Low | 64.3 | Low | 167 Ų | 167 | 136 Ų | 136 | 78% | 0.78 | 72% | 0.715 | S | S | * | * | | | trans | -79.5 | 121.9 | 172.9 | -163.7 | -179.7 | 173.4 | 0 | 0 | 109.3 | V310 | E308-V310 HydrophobicContact CG-CG2 3.95Å; E308-V310 PolarHBondContact O-N 3.27Å |
| 309 | N | 59.9 | Low | 64.1 | Low | 153 Ų | 153 | 136.6 Ų | 136.6 | 82% | 0.818 | 72% | 0.717 | S | S | * | * | | | trans | -87.9 | 62.3 | -174.5 | -136.8 | 69.1 | 0 | 0 | 0 | 109.9 | K311 | N309-K311 PolarHBondContact O-N 3.34Š|
| 310 | V | 73.8 | Confident | 63.7 | Low | 86 Ų | 86 | 130.2 Ų | 130.2 | 52% | 0.521 | 71% | 0.714 | S | S | . | * | | | trans | -74.7 | 112.2 | 171.8 | 178.4 | 0 | 0 | 0 | 0 | 108.2 | E308 L312 | E308-V310 HydrophobicContact CG-CG2 3.95Å; E308-V310 PolarHBondContact O-N 3.27Å; V310-L312 HydrophobicContact CG1-CD2 4.05Å; V310-L312 HydrophobicContact CG1-CG 4.19Å; V310-L312 PolarHBondContact O-N 3.04Å |
| 311 | K | 69.4 | Low | 63.9 | Low | 177 Ų | 177 | 135.3 Ų | 135.3 | 77% | 0.77 | 73% | 0.726 | S | S | * | * | | | trans | -72.8 | 89.9 | 179.3 | -168.3 | -179 | 178.6 | -169.9 | 0 | 109.2 | N309 | N309-K311 PolarHBondContact O-N 3.34Š|
| 312 | L | 66.9 | Low | 63.7 | Low | 110 Ų | 110 | 137 Ų | 137 | 58% | 0.576 | 72% | 0.72 | S | S | * | * | | | trans | -82.7 | 116.2 | 171.3 | -65.5 | 174.9 | 0 | 0 | 0 | 108.8 | V310 F314 | V310-L312 HydrophobicContact CG1-CD2 4.05Å; V310-L312 HydrophobicContact CG1-CG 4.19Å; V310-L312 PolarHBondContact O-N 3.04Å; L312-F314 HydrophobicContact CB-CD2 3.92Å; L312-F314 HydrophobicContact CB-CE1 4.35Å; L312-F314 HydrophobicContact CB-CE2 3.29Å; L312-F314 HydrophobicContact CB-CZ 3.54Å; L312-F314 HydrophobicContact CD1-CE2 3.98Å; L312-F314 HydrophobicContact CD1-CZ 3.62Å; L312-F314 HydrophobicContact CG-CE2 4.27Å; L312-F314 HydrophobicContact CG-CZ 4.22Å; L312-F314 WeakPolarHBondContact O-CD2 3.31Å; L312-F314 PolarHBondContact O-N 3.01Å |
| 313 | D | 60.6 | Low | 63.4 | Low | 123 Ų | 123 | 138.1 Ų | 138.1 | 66% | 0.658 | 73% | 0.732 | S | S | * | * | | | trans | -77.5 | 84.3 | -177.3 | -69.3 | -45.6 | 0 | 0 | 0 | 111.1 | K315 | D313-K315 PolarHBondContact O-N 3.14Š|
| 314 | F | 61 | Low | 63 | Low | 134 Ų | 134 | 138.6 Ų | 138.6 | 59% | 0.588 | 72% | 0.724 | S | S | * | * | | | trans | -81.5 | 8.8 | -179.7 | -65.9 | -70.7 | 0 | 0 | 0 | 115 | L312 D316 A318 | L312-F314 HydrophobicContact CB-CD2 3.92Å; L312-F314 HydrophobicContact CB-CE1 4.35Å; L312-F314 HydrophobicContact CB-CE2 3.29Å; L312-F314 HydrophobicContact CB-CZ 3.54Å; L312-F314 HydrophobicContact CD1-CE2 3.98Å; L312-F314 HydrophobicContact CD1-CZ 3.62Å; L312-F314 HydrophobicContact CG-CE2 4.27Å; L312-F314 HydrophobicContact CG-CZ 4.22Å; L312-F314 WeakPolarHBondContact O-CD2 3.31Å; L312-F314 PolarHBondContact O-N 3.01Å; F314-D316 VanDerWaalsContact C-N 3.29Å; F314-D316 PolarHBondContact O-N 2.75Å; F314-A318 HydrophobicContact CB-CB 4.15Å; F314-A318 WeakPolarHBondContact O-CB 3.29Å; F314-A318 PolarHBondContact O-N 3.2Å |
| 315 | K | 66.5 | Low | 63 | Low | 175 Ų | 175 | 138.6 Ų | 138.6 | 76% | 0.761 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.5 | -34.5 | -168.1 | -71.1 | -177.5 | 175.1 | -178.4 | 0 | 114 | D313 | D313-K315 PolarHBondContact O-N 3.14Š|
| 316 | D | 64.1 | Low | 63 | Low | 148 Ų | 148 | 139.4 Ų | 139.4 | 79% | 0.791 | 73% | 0.729 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.2 | -10.2 | -171.1 | -63.9 | -21.4 | 0 | 0 | 0 | 114.5 | F314 | F314-D316 VanDerWaalsContact C-N 3.29Å; F314-D316 PolarHBondContact O-N 2.75Å |
| 317 | K | 61.3 | Low | 62.5 | Low | 201 Ų | 201 | 135.3 Ų | 135.3 | 87% | 0.874 | 73% | 0.725 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -114.9 | -12.4 | -177.9 | -67.4 | -172.7 | -180 | -177 | 0 | 114.6 | H319 | K317-H319 PolarHBondContact O-N 3.09Š|
| 318 | A | 59.1 | Low | 62.3 | Low | 69 Ų | 69 | 135.2 Ų | 135.2 | 57% | 0.57 | 74% | 0.738 | S | S | * | * | | | trans | -102.7 | 58.9 | -175.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | F314 | F314-A318 HydrophobicContact CB-CB 4.15Å; F314-A318 WeakPolarHBondContact O-CB 3.29Å; F314-A318 PolarHBondContact O-N 3.2Å |
| 319 | H | 60.8 | Low | 62 | Low | 156 Ų | 156 | 132.5 Ų | 132.5 | 72% | 0.722 | 74% | 0.738 | S | S | * | * | | | trans | -82.7 | 119.7 | 164.3 | -68.7 | -52.1 | 0 | 0 | 0 | 109.6 | K317 K321 | K317-H319 PolarHBondContact O-N 3.09Å; H319-K321 PolarHBondContact O-N 3.07Å; H319-K321 VanDerWaalsContact O-N 3.08Å |
| 320 | A | 58.5 | Low | 62.1 | Low | 97 Ų | 97 | 132.6 Ų | 132.6 | 80% | 0.802 | 73% | 0.733 | S | S | * | * | | | trans | -66.2 | 108.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 109.9 | V322 | A320-V322 PolarHBondContact O-N 3.43Š|
| 321 | K | 64 | Low | 61.5 | Low | 207 Ų | 207 | 136.2 Ų | 136.2 | 90% | 0.9 | 75% | 0.746 | S | S | * | * | | | trans | -76.7 | 32.3 | 176.1 | -73.7 | -177.7 | 166.3 | -179.3 | 0 | 113.6 | H319 | H319-K321 PolarHBondContact O-N 3.07Å; H319-K321 VanDerWaalsContact O-N 3.08Å |
| 322 | V | 58.3 | Low | 61 | Low | 115 Ų | 115 | 132.5 Ų | 132.5 | 70% | 0.697 | 74% | 0.74 | S | S | * | * | | | trans | -128.8 | 88.7 | -179.2 | -176.4 | 0 | 0 | 0 | 0 | 109.5 | A320 S324 | A320-V322 PolarHBondContact O-N 3.43Å; V322-S324 PolarHBondContact O-N 2.78Å; V322-S324 VanDerWaalsContact O-N 3.11Å |
| 323 | G | 60.8 | Low | 60.7 | Low | 86 Ų | 86 | 130.7 Ų | 130.7 | 89% | 0.887 | 75% | 0.748 | S | S | * | * | | | trans | -80.4 | 63.3 | 168.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | | |
| 324 | S | 57.1 | Low | 60.8 | Low | 81 Ų | 81 | 128.6 Ų | 128.6 | 57% | 0.566 | 76% | 0.756 | S | S | * | * | | | trans | -134.6 | 64.5 | -176.8 | -161.6 | 0 | 0 | 0 | 0 | 111.3 | V322 | V322-S324 PolarHBondContact O-N 2.78Å; V322-S324 VanDerWaalsContact O-N 3.11Å |
| 325 | L | 63 | Low | 60.8 | Low | 158 Ų | 158 | 125.4 Ų | 125.4 | 83% | 0.827 | 76% | 0.76 | S | S | * | * | | | trans | -129 | 1.6 | 168.9 | -75 | 176.7 | 0 | 0 | 0 | 114.1 | | |
| 326 | D | 59.8 | Low | 60.6 | Low | 152 Ų | 152 | 124.8 Ų | 124.8 | 81% | 0.813 | 77% | 0.765 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.7 | 1.4 | -173.8 | -57.8 | -28.1 | 0 | 0 | 0 | 114.1 | | |
| 327 | N | 57.5 | Low | 60.5 | Low | 152 Ų | 152 | 123.4 Ų | 123.4 | 81% | 0.813 | 76% | 0.762 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.8 | 19.9 | -175.1 | -65.9 | -18.3 | 0 | 0 | 0 | 114.4 | S329 | N327-S329 VanDerWaalsContact C-N 3.32Å; N327-S329 PolarHBondContact O-N 2.86Å; N327-S329 VanDerWaalsContact O-N 3.14Å |
| 328 | A | 58.5 | Low | 60.8 | Low | 92 Ų | 92 | 121.6 Ų | 121.6 | 76% | 0.76 | 76% | 0.759 | S | S | * | * | | | trans | -86.4 | 71.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | H330 | A328-H330 PolarHBondContact O-N 3.08Å; A328-H330 VanDerWaalsContact O-N 3.1Å |
| 329 | S | 59.8 | Low | 61.4 | Low | 111 Ų | 111 | 125 Ų | 125 | 78% | 0.776 | 77% | 0.766 | S | S | * | * | | | trans | -78.1 | 89.1 | 167.3 | -174.2 | 0 | 0 | 0 | 0 | 109.2 | N327 | N327-S329 VanDerWaalsContact C-N 3.32Å; N327-S329 PolarHBondContact O-N 2.86Å; N327-S329 VanDerWaalsContact O-N 3.14Å |
| 330 | H | 62 | Low | 62 | Low | 154 Ų | 154 | 124.2 Ų | 124.2 | 71% | 0.713 | 76% | 0.762 | S | S | * | * | | | trans | -98.9 | 99.5 | 167.2 | 179.6 | -100.5 | 0 | 0 | 0 | 108.5 | A328 P332 | A328-H330 PolarHBondContact O-N 3.08Å; A328-H330 VanDerWaalsContact O-N 3.1Å; H330-P332 VanDerWaalsContact O-CD 3.22Å; H330-P332 WeakPolarHBondContact O-CD 3.22Å |
| 331 | M | 61.8 | Low | 62.6 | Low | 163 Ų | 163 | 124.9 Ų | 124.9 | 80% | 0.803 | 76% | 0.761 | S | S | * | * | | | trans | -83.6 | 106.9 | 163.4 | -83 | 176.6 | 40.9 | 0 | 0 | 108.1 | G333 | M331-G333 PolarHBondContact O-N 3.22Å; M331-G333 VanDerWaalsContact O-N 3.08Å |
| 332 | P | 60.3 | Low | 63.2 | Low | 98 Ų | 98 | 122.1 Ų | 122.1 | 64% | 0.636 | 75% | 0.751 | S | S | * | * | | | trans | -62.4 | 117.4 | 170.9 | 26.3 | -31.9 | 0 | 0 | 0 | 107.8 | H330 G334 | H330-P332 VanDerWaalsContact O-CD 3.22Å; H330-P332 WeakPolarHBondContact O-CD 3.22Å; P332-G334 PolarHBondContact O-N 3.25Å |
| 333 | G | 60.2 | Low | 64.2 | Low | 72 Ų | 72 | 126.1 Ų | 126.1 | 74% | 0.742 | 76% | 0.759 | S | S | * | * | | | trans | -62.9 | 87.6 | 172.6 | 0 | 0 | 0 | 0 | 0 | 109.8 | M331 G335 | M331-G333 PolarHBondContact O-N 3.22Å; M331-G333 VanDerWaalsContact O-N 3.08Å; G333-G335 PolarHBondContact O-N 3.06Å |
| 334 | G | 62.3 | Low | 64.8 | Low | 80 Ų | 80 | 128.6 Ų | 128.6 | 83% | 0.825 | 75% | 0.752 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.4 | 126.7 | 169.2 | 0 | 0 | 0 | 0 | 0 | 109 | P332 | P332-G334 PolarHBondContact O-N 3.25Š|
| 335 | G | 60.6 | Low | 65.4 | Low | 67 Ų | 67 | 128.1 Ų | 128.1 | 69% | 0.691 | 75% | 0.748 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 156 | -21.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | G333 V337 | G333-G335 PolarHBondContact O-N 3.06Å; G335-V337 VanDerWaalsContact C-N 3.29Å; G335-V337 PolarHBondContact O-N 3.2Å |
| 336 | N | 62.2 | Low | 65.4 | Low | 162 Ų | 162 | 127.6 Ų | 127.6 | 87% | 0.866 | 74% | 0.739 | S | S | * | * | | | trans | -89 | 60 | -178.9 | -63.9 | -11.2 | 0 | 0 | 0 | 111.8 | M338 | N336-M338 PolarHBondContact O-N 3.03Š|
| 337 | V | 63 | Low | 65.7 | Low | 119 Ų | 119 | 130.7 Ų | 130.7 | 72% | 0.721 | 74% | 0.739 | S | S | * | * | | | trans | -91.5 | 93.3 | 162.8 | -172.1 | 0 | 0 | 0 | 0 | 106.9 | G335 I339 | G335-V337 VanDerWaalsContact C-N 3.29Å; G335-V337 PolarHBondContact O-N 3.2Å; V337-I339 VanDerWaalsContact C-N 3.34Å; V337-I339 HydrophobicContact CG1-CD1 4.3Å; V337-I339 HydrophobicContact CG1-CG1 3.65Å; V337-I339 PolarHBondContact O-N 3.48Å |
| 338 | M | 68.1 | Low | 66 | Low | 162 Ų | 162 | 131.3 Ų | 131.3 | 80% | 0.798 | 74% | 0.737 | S | S | * | * | | | trans | -74.8 | 91.2 | 171.3 | -175.6 | 158.4 | 44.3 | 0 | 0 | 108 | N336 E340 | N336-M338 PolarHBondContact O-N 3.03Å; M338-E340 HydrophobicContact CG-CG 4.45Å; M338-E340 PolarHBondContact O-N 3.35Å |
| 339 | I | 71.2 | Confident | 66.1 | Low | 141 Ų | 141 | 132.6 Ų | 132.6 | 72% | 0.723 | 74% | 0.736 | S | S | * | * | | | trans | -78.8 | 98.8 | 174.5 | -55.5 | 177.6 | 0 | 0 | 0 | 107.4 | V337 S341 | V337-I339 VanDerWaalsContact C-N 3.34Å; V337-I339 HydrophobicContact CG1-CD1 4.3Å; V337-I339 HydrophobicContact CG1-CG1 3.65Å; V337-I339 PolarHBondContact O-N 3.48Å; I339-S341 PolarHBondContact O-N 2.8Å |
| 340 | E | 73.4 | Confident | 66 | Low | 139 Ų | 139 | 130.9 Ų | 130.9 | 65% | 0.65 | 73% | 0.728 | S | S | * | * | | | trans | -69.6 | 99.7 | 172.5 | -68.7 | -178.2 | -177.4 | 0 | 0 | 109.9 | M338 H342 | M338-E340 HydrophobicContact CG-CG 4.45Å; M338-E340 PolarHBondContact O-N 3.35Å; E340-H342 PolarHBondContact O-N 3.05Å; E340-H342 IonicContact OE2-CE1 3.4Å |
| 341 | S | 71.5 | Confident | 66 | Low | 111 Ų | 111 | 132.7 Ų | 132.7 | 78% | 0.776 | 73% | 0.734 | S | S | * | * | | | trans | -82.6 | 98.7 | 178.5 | 61.2 | 0 | 0 | 0 | 0 | 111.3 | I339 K343 | I339-S341 PolarHBondContact O-N 2.8Å; S341-K343 PolarHBondContact O-N 3.25Å |
| 342 | H | 75.6 | Confident | 66.1 | Low | 150 Ų | 150 | 129 Ų | 129 | 69% | 0.694 | 73% | 0.73 | S | S | * | * | | | trans | -89.3 | 90.7 | 170 | -72.8 | 80.1 | 0 | 0 | 0 | 109.5 | E340 L344 | E340-H342 PolarHBondContact O-N 3.05Å; E340-H342 IonicContact OE2-CE1 3.4Å; H342-L344 PolarHBondContact O-N 3.15Å |
| 343 | K | 78.8 | Confident | 66.1 | Low | 199 Ų | 199 | 136.1 Ų | 136.1 | 87% | 0.865 | 74% | 0.744 | S | S | * | * | | | trans | -77.1 | 102.8 | 175.6 | -172 | -176.8 | 179 | -167.3 | 0 | 109.6 | S341 S345 | S341-K343 PolarHBondContact O-N 3.25Å; K343-S345 PolarHBondContact O-N 3.02Å |
| 344 | L | 73.2 | Confident | 66 | Low | 138 Ų | 138 | 137 Ų | 137 | 72% | 0.723 | 74% | 0.735 | S | S | * | * | | | trans | -74.7 | 117.7 | 173.4 | -63.3 | 172.4 | 0 | 0 | 0 | 110 | H342 F346 | H342-L344 PolarHBondContact O-N 3.15Å; L344-F346 VanDerWaalsContact C-N 3.27Å; L344-F346 HydrophobicContact CB-CD1 4.02Å; L344-F346 WeakPolarHBondContact O-CD1 3.32Å; L344-F346 WeakPolarHBondContact O-CE1 3.11Å; L344-F346 PolarHBondContact O-N 3Å; L344-F346 VanDerWaalsContact O-N 3.14Å |
| 345 | S | 71.1 | Confident | 65.6 | Low | 70 Ų | 70 | 141.1 Ų | 141.1 | 49% | 0.49 | 74% | 0.738 | S | S | . | * | | | trans | -86.6 | 55.2 | 178 | 55.4 | 0 | 0 | 0 | 0 | 112.4 | K343 R347 E348 | K343-S345 PolarHBondContact O-N 3.02Å; S345-R347 PolarHBondContact O-N 3.36Å; S345-E348 PolarHBondContact O-N 3.22Å |
| 346 | F | 63.6 | Low | 65.2 | Low | 147 Ų | 147 | 145 Ų | 145 | 65% | 0.645 | 74% | 0.738 | S | S | * | * | H | α-helix | trans | -62.5 | -11.7 | -179.7 | 47.8 | -97.5 | 0 | 0 | 0 | 114.5 | L344 A350 | L344-F346 VanDerWaalsContact C-N 3.27Å; L344-F346 HydrophobicContact CB-CD1 4.02Å; L344-F346 WeakPolarHBondContact O-CD1 3.32Å; L344-F346 WeakPolarHBondContact O-CE1 3.11Å; L344-F346 PolarHBondContact O-N 3Å; L344-F346 VanDerWaalsContact O-N 3.14Å; F346-A350 WeakPolarHBondContact O-CB 3.18Å; F346-A350 PolarHBondContact O-N 3.14Å |
| 347 | R | 65.6 | Low | 64.9 | Low | 217 Ų | 217 | 141.9 Ų | 141.9 | 82% | 0.819 | 74% | 0.744 | S | S | * | * | H | α-helix | trans | -78 | -24.4 | 177.4 | -76 | -173.4 | 171.2 | 178.5 | -2.4 | 114.2 | S345 | S345-R347 PolarHBondContact O-N 3.36Å |
| 348 | E | 63 | Low | 64.4 | Low | 165 Ų | 165 | 140 Ų | 140 | 77% | 0.771 | 74% | 0.74 | S | S | * | * | H | α-helix | trans | -83.7 | -28 | -178.4 | -72.3 | 168 | 172 | 0 | 0 | 112.4 | S345 | S345-E348 PolarHBondContact O-N 3.22Å |
| 349 | T | 60.7 | Low | 63.5 | Low | 120 Ų | 120 | 140.5 Ų | 140.5 | 74% | 0.736 | 74% | 0.741 | S | S | * | * | H | α-helix | trans | -98.7 | -16.2 | -177.8 | 42.9 | 0 | 0 | 0 | 0 | 113.7 | K351 | T349-K351 PolarHBondContact O-N 3.42Å |
| 350 | A | 58.4 | Low | 62.9 | Low | 74 Ų | 74 | 140.9 Ų | 140.9 | 61% | 0.612 | 74% | 0.743 | S | S | * | * | | | trans | -77.2 | 88.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | F346 A352 | F346-A350 WeakPolarHBondContact O-CB 3.18Å; F346-A350 PolarHBondContact O-N 3.14Å; A350-A352 PolarHBondContact O-N 3.36Å |
| 351 | K | 62.5 | Low | 61.8 | Low | 192 Ų | 192 | 140 Ų | 140 | 84% | 0.835 | 74% | 0.741 | S | S | * | * | | | trans | -68.2 | 112.8 | 162.5 | -78.6 | -174.3 | 175.1 | -177.6 | 0 | 108.9 | T349 R353 | T349-K351 PolarHBondContact O-N 3.42Å; K351-R353 PolarHBondContact O-N 2.67Å; K351-R353 VanDerWaalsContact O-N 3.15Å |
| 352 | A | 62.3 | Low | 61 | Low | 85 Ų | 85 | 140.4 Ų | 140.4 | 70% | 0.702 | 73% | 0.733 | S | S | * | * | | | trans | -58.1 | 118.1 | 170.4 | 0 | 0 | 0 | 0 | 0 | 108.9 | A350 V354 | A350-A352 PolarHBondContact O-N 3.36Å; A352-V354 HydrophobicContact CB-CG2 4.39Å; A352-V354 PolarHBondContact O-N 3.03Å |
| 353 | R | 61 | Low | 59.5 | Low | 249 Ų | 249 | 138.6 Ų | 138.6 | 94% | 0.94 | 73% | 0.733 | S | S | * | * | | | trans | -79.3 | 35.1 | 172.8 | -67.3 | -84.3 | -176.5 | 104 | 0.6 | 110.9 | K351 | K351-R353 PolarHBondContact O-N 2.67Å; K351-R353 VanDerWaalsContact O-N 3.15Å |
| 354 | V | 58.9 | Low | 57.6 | Low | 90 Ų | 90 | 136.8 Ų | 136.8 | 55% | 0.545 | 73% | 0.727 | S | S | . | * | | | trans | -97.9 | 102.1 | 177.3 | -171.4 | 0 | 0 | 0 | 0 | 105.4 | A352 H356 | A352-V354 HydrophobicContact CB-CG2 4.39Å; A352-V354 PolarHBondContact O-N 3.03Å; V354-H356 HydrophobicContact CG1-CB 4.18Å; V354-H356 PolarHBondContact O-N 3.26Å |
| 355 | D | 53.7 | Low | 56.2 | Low | 167 Ų | 167 | 134.8 Ų | 134.8 | 89% | 0.893 | 73% | 0.725 | S | S | * | * | | | trans | -73.8 | 57.4 | -178 | -143.7 | 4 | 0 | 0 | 0 | 109.9 | | |
| 356 | H | 51.7 | Low | 55.1 | Low | 148 Ų | 148 | 138.1 Ų | 138.1 | 69% | 0.685 | 75% | 0.745 | S | S | * | * | | | trans | -119.8 | 101.8 | 176.8 | -61.7 | 12.1 | 0 | 0 | 0 | 104 | V354 A358 | V354-H356 HydrophobicContact CG1-CB 4.18Å; V354-H356 PolarHBondContact O-N 3.26Å; H356-A358 PolarHBondContact O-N 3.46Å |
| 357 | G | 54.9 | Low | 54.3 | Low | 97 Ų | 97 | 134.2 Ų | 134.2 | 100% | 1 | 75% | 0.746 | S | S | * | * | | | trans | -60.4 | 63.1 | -172 | 0 | 0 | 0 | 0 | 0 | 115.1 | | |
| 358 | A | 52.5 | Low | 53.3 | Low | 78 Ų | 78 | 130.6 Ų | 130.6 | 65% | 0.645 | 75% | 0.748 | S | S | * | * | | | trans | -114.9 | 94.7 | 165.7 | 0 | 0 | 0 | 0 | 0 | 106.9 | H356 I360 | H356-A358 PolarHBondContact O-N 3.46Å; A358-I360 PolarHBondContact O-N 3.09Å; A358-I360 VanDerWaalsContact O-N 3.09Å |
| 359 | E | 50.5 | Low | 52.4 | Low | 173 Ų | 173 | 130.8 Ų | 130.8 | 81% | 0.808 | 75% | 0.749 | S | S | * | * | | | trans | -55.5 | 112.9 | 156.3 | -95.8 | -171.8 | 156.2 | 0 | 0 | 107.5 | I361 | E359-I361 HydrophobicContact CB-CG1 4.15Å; E359-I361 PolarHBondContact O-N 3.42Å |
| 360 | I | 57.3 | Low | 51.7 | Low | 150 Ų | 150 | 131.8 Ų | 131.8 | 77% | 0.769 | 76% | 0.755 | S | S | * | * | | | trans | -76.8 | 87.2 | 164.1 | -55.4 | 179.7 | 0 | 0 | 0 | 105.6 | A358 I362 | A358-I360 PolarHBondContact O-N 3.09Å; A358-I360 VanDerWaalsContact O-N 3.09Å; I360-I362 HydrophobicContact CG2-CG1 4.23Å; I360-I362 PolarHBondContact O-N 2.97Å |
| 361 | I | 50.3 | Low | 50.8 | Low | 120 Ų | 120 | 131.6 Ų | 131.6 | 62% | 0.615 | 76% | 0.76 | S | S | * | * | | | trans | -65.3 | 100.5 | 168 | -56.5 | 175.8 | 0 | 0 | 0 | 106.3 | E359 T363 | E359-I361 HydrophobicContact CB-CG1 4.15Å; E359-I361 PolarHBondContact O-N 3.42Å; I361-T363 VanDerWaalsContact C-N 3.27Å; I361-T363 HydrophobicContact CG2-CG2 3.74Å; I361-T363 PolarHBondContact O-N 2.98Å |
| 362 | I | 55.7 | Low | 50.1 | Low | 119 Ų | 119 | 126.1 Ų | 126.1 | 61% | 0.61 | 76% | 0.758 | S | S | * | * | | | trans | -76 | 90.6 | 164 | -57.5 | 171.6 | 0 | 0 | 0 | 105.2 | I360 H364 | I360-I362 HydrophobicContact CG2-CG1 4.23Å; I360-I362 PolarHBondContact O-N 2.97Å; I362-H364 VanDerWaalsContact C-N 3.3Å; I362-H364 WeakPolarHBondContact CG2-NE2 3.08Å; I362-H364 PolarHBondContact O-CD2 3.04Å; I362-H364 PolarHBondContact O-N 2.8Å |
| 363 | T | 44.1 | Very low | 49.1 | Very low | 112 Ų | 112 | 128.7 Ų | 128.7 | 69% | 0.687 | 77% | 0.765 | S | S | * | * | | | trans | -65.9 | 95.5 | 168.1 | 46.3 | 0 | 0 | 0 | 0 | 107.8 | I361 S365 | I361-T363 VanDerWaalsContact C-N 3.27Å; I361-T363 HydrophobicContact CG2-CG2 3.74Å; I361-T363 PolarHBondContact O-N 2.98Å; T363-S365 PolarHBondContact O-N 2.85Å; T363-S365 VanDerWaalsContact O-N 3.09Å |
| 364 | H | 39.6 | Very low | 48.2 | Very low | 161 Ų | 161 | 121.8 Ų | 121.8 | 75% | 0.745 | 76% | 0.755 | S | S | * | * | | | trans | -69.1 | 97.7 | 163.2 | -68.4 | -82.1 | 0 | 0 | 0 | 107.8 | I362 | I362-H364 VanDerWaalsContact C-N 3.3Å; I362-H364 WeakPolarHBondContact CG2-NE2 3.08Å; I362-H364 PolarHBondContact O-CD2 3.04Å; I362-H364 PolarHBondContact O-N 2.8Å |
| 365 | S | 42.5 | Very low | 47.6 | Very low | 97 Ų | 97 | 123.4 Ų | 123.4 | 68% | 0.678 | 77% | 0.767 | S | S | * | * | | | trans | -61.9 | 132.5 | 162 | -45.1 | 0 | 0 | 0 | 0 | 108.2 | T363 G367 | T363-S365 PolarHBondContact O-N 2.85Å; T363-S365 VanDerWaalsContact O-N 3.09Å; S365-G367 PolarHBondContact O-N 2.78Å |
| 366 | P | 48.1 | Very low | 46.9 | Very low | 140 Ų | 140 | 125.6 Ų | 125.6 | 91% | 0.909 | 76% | 0.763 | S | S | * | * | S | Bend | trans | -79.3 | 108.1 | -177.5 | 31.3 | -29.8 | 0 | 0 | 0 | 108.9 | | |
| 367 | G | 46.3 | Very low | 46.9 | Very low | 65 Ų | 65 | 126.9 Ų | 126.9 | 67% | 0.67 | 77% | 0.774 | S | S | * | * | | | trans | 136 | 126.6 | 167.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | S365 | S365-G367 PolarHBondContact O-N 2.78Š|
| 368 | V | 44.8 | Very low | 46.1 | Very low | 140 Ų | 140 | 124.9 Ų | 124.9 | 85% | 0.848 | 75% | 0.745 | S | S | * | * | | | trans | 90.7 | 80.5 | 177.9 | -166.9 | 0 | 0 | 0 | 0 | 114 | | |
| 369 | E | 45.7 | Very low | 45.6 | Very low | 169 Ų | 169 | 126.9 Ų | 126.9 | 79% | 0.79 | 75% | 0.754 | S | S | * | * | | | trans | -6.7 | 135.3 | 134.7 | -31.2 | -81.3 | 135.9 | 0 | 0 | 115.1 | | |
| 370 | T | 45.4 | Very low | 45.5 | Very low | 142 Ų | 142 | 123.7 Ų | 123.7 | 87% | 0.871 | 76% | 0.757 | S | S | * | * | | | trans | 93.6 | 116.8 | 152.8 | -40 | 0 | 0 | 0 | 0 | 118.1 | | |
| 371 | G | 39.7 | Very low | 45.3 | Very low | 70 Ų | 70 | 120 Ų | 120 | 72% | 0.722 | 76% | 0.756 | S | S | * | * | | | trans | 100.3 | 96.6 | 141.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | | |
| 372 | G | 47.3 | Very low | 45.1 | Very low | 76 Ų | 76 | 119 Ų | 119 | 78% | 0.784 | 76% | 0.76 | S | S | * | * | | | trans | -65.1 | 146.7 | 170.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | | |
| 373 | T | 41.9 | Very low | 45 | Very low | 140 Ų | 140 | 120.7 Ų | 120.7 | 86% | 0.859 | 77% | 0.769 | S | S | * | * | | | trans | -147 | 132.1 | 146 | 51.7 | 0 | 0 | 0 | 0 | 108.5 | | |
| 374 | S | 41.5 | Very low | 45.1 | Very low | 103 Ų | 103 | 122.2 Ų | 122.2 | 72% | 0.72 | 77% | 0.773 | S | S | * | * | | | trans | -54.9 | 154.4 | 162.7 | -66.1 | 0 | 0 | 0 | 0 | 110.4 | R376 | S374-R376 VanDerWaalsContact C-N 3.32Å; S374-R376 PolarHBondContact O-N 3.18Å |
| 375 | P | 46.7 | Very low | 45.6 | Very low | 124 Ų | 124 | 121.9 Ų | 121.9 | 81% | 0.805 | 77% | 0.773 | S | S | * | * | | | trans | -68.1 | 93.7 | 175.5 | 28.2 | -31.4 | 0 | 0 | 0 | 108.9 | L377 | P375-L377 VanDerWaalsContact C-N 3.32Å; P375-L377 PolarHBondContact O-N 3.22Å |
| 376 | R | 39.4 | Very low | 46.2 | Very low | 214 Ų | 214 | 126 Ų | 126 | 81% | 0.808 | 78% | 0.784 | S | S | * | * | | | trans | -72.5 | 92.1 | 168.5 | -166 | -165.5 | 171.7 | -127.4 | 7.7 | 106.5 | S374 S378 | S374-R376 VanDerWaalsContact C-N 3.32Å; S374-R376 PolarHBondContact O-N 3.18Å; R376-S378 WeakPolarHBondContact CD-OG 3.46Å; R376-S378 WeakPolarHBondContact CG-OG 3.06Å; R376-S378 VanDerWaalsContact CZ-OG 3.25Å; R376-S378 PolarHBondContact NE-OG 3.3Å; R376-S378 PolarHBondContact NH1-OG 2.91Å; R376-S378 PolarHBondContact O-N 3.39Å; R376-S378 PolarHBondContact O-OG 3.07Å; R376-S378 VanDerWaalsContact O-OG 3.04Å |
| 377 | L | 50.5 | Low | 46.4 | Very low | 175 Ų | 175 | 128 Ų | 128 | 92% | 0.916 | 78% | 0.781 | S | S | * | * | | | trans | -57.9 | 92.6 | 160.2 | -68.1 | 174.7 | 0 | 0 | 0 | 107.2 | P375 | P375-L377 VanDerWaalsContact C-N 3.32Å; P375-L377 PolarHBondContact O-N 3.22Å |
| 378 | S | 39.3 | Very low | 46.5 | Very low | 55 Ų | 55 | 128.8 Ų | 128.8 | 39% | 0.385 | 78% | 0.776 | S | S | . | * | | | trans | -107.3 | 117.1 | 178.2 | -45.2 | 0 | 0 | 0 | 0 | 106.4 | R376 A380 | R376-S378 WeakPolarHBondContact CD-OG 3.46Å; R376-S378 WeakPolarHBondContact CG-OG 3.06Å; R376-S378 VanDerWaalsContact CZ-OG 3.25Å; R376-S378 PolarHBondContact NE-OG 3.3Å; R376-S378 PolarHBondContact NH1-OG 2.91Å; R376-S378 PolarHBondContact O-N 3.39Å; R376-S378 PolarHBondContact O-OG 3.07Å; R376-S378 VanDerWaalsContact O-OG 3.04Å; S378-A380 PolarHBondContact O-N 3.25Å |
| 379 | S | 42.2 | Very low | 47.1 | Very low | 119 Ų | 119 | 126.3 Ų | 126.3 | 83% | 0.832 | 76% | 0.764 | S | S | * | * | | | trans | -35.9 | 119.9 | 164.8 | -172.6 | 0 | 0 | 0 | 0 | 111.3 | G381 | S379-G381 PolarHBondContact O-N 3.43Š|
| 380 | A | 48.1 | Very low | 47.7 | Very low | 106 Ų | 106 | 125.2 Ų | 125.2 | 88% | 0.876 | 76% | 0.758 | S | S | * | * | S | Bend | trans | -63.9 | 112.3 | 165.8 | 0 | 0 | 0 | 0 | 0 | 108 | S378 | S378-A380 PolarHBondContact O-N 3.25Š|
| 381 | G | 53.4 | Low | 48.2 | Very low | 73 Ų | 73 | 124.7 Ų | 124.7 | 75% | 0.753 | 75% | 0.749 | S | S | * | * | | | trans | 179.6 | 39.7 | -175.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | S379 | S379-G381 PolarHBondContact O-N 3.43Š|
| 382 | S | 45.4 | Very low | 49.1 | Very low | 99 Ų | 99 | 125.1 Ų | 125.1 | 69% | 0.692 | 74% | 0.741 | S | S | * | * | | | trans | -124.3 | 98 | 165.8 | 62.8 | 0 | 0 | 0 | 0 | 107.9 | N384 | S382-N384 PolarHBondContact O-N 3.13Š|
| 383 | I | 54.1 | Low | 50 | Low | 154 Ų | 154 | 124.9 Ų | 124.9 | 79% | 0.79 | 73% | 0.725 | S | S | * | * | | | trans | -64.4 | 115.3 | 167.9 | 54.1 | 162.4 | 0 | 0 | 0 | 108 | M385 | I383-M385 HydrophobicContact CD1-CG 4.49Å; I383-M385 PolarHBondContact O-N 3.09Å |
| 384 | N | 45.4 | Very low | 51.3 | Low | 145 Ų | 145 | 123.3 Ų | 123.3 | 78% | 0.775 | 71% | 0.711 | S | S | * | * | | | trans | -75 | 107.1 | 168.7 | -75.3 | -27.4 | 0 | 0 | 0 | 107.7 | S382 M386 | S382-N384 PolarHBondContact O-N 3.13Å; N384-M386 PolarHBondContact O-N 3.19Å; N384-M386 VanDerWaalsContact O-N 3.13Å |
| 385 | M | 50.5 | Low | 52.7 | Low | 154 Ų | 154 | 121.1 Ų | 121.1 | 76% | 0.759 | 70% | 0.699 | S | S | * | * | | | trans | -83.3 | 58.4 | 171.4 | -83.7 | -132.1 | 79.8 | 0 | 0 | 111.4 | I383 | I383-M385 HydrophobicContact CD1-CG 4.49Å; I383-M385 PolarHBondContact O-N 3.09Å |
| 386 | M | 54.9 | Low | 53.9 | Low | 183 Ų | 183 | 121.6 Ų | 121.6 | 90% | 0.901 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -131.1 | 17.2 | 173.1 | -99.7 | 97.1 | 98 | 0 | 0 | 115.3 | N384 | N384-M386 PolarHBondContact O-N 3.19Å; N384-M386 VanDerWaalsContact O-N 3.13Å |
| 387 | E | 52.1 | Low | 55.6 | Low | 181 Ų | 181 | 116.7 Ų | 116.7 | 85% | 0.846 | 68% | 0.68 | S | S | * | * | | | trans | -146.5 | 100.1 | 171.6 | -159.1 | 146.1 | -165.4 | 0 | 0 | 109.4 | P389 | E387-P389 VanDerWaalsContact O-CD 3.27Å; E387-P389 WeakPolarHBondContact O-CD 3.27Å |
| 388 | S | 48.7 | Very low | 57 | Low | 82 Ų | 82 | 112 Ų | 112 | 57% | 0.573 | 66% | 0.659 | S | S | * | * | | | trans | -110.7 | 91 | 177.5 | -162.7 | 0 | 0 | 0 | 0 | 108.8 | Q390 | S388-Q390 PolarHBondContact O-N 3.3Š|
| 389 | P | 57.6 | Low | 58.9 | Low | 89 Ų | 89 | 114 Ų | 114 | 58% | 0.578 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.3 | 10.7 | 175.2 | 32.6 | -33.5 | 0 | 0 | 0 | 112.9 | E387 S392 T393 | E387-P389 VanDerWaalsContact O-CD 3.27Å; E387-P389 WeakPolarHBondContact O-CD 3.27Å; P389-S392 PolarHBondContact O-OG 3.12Å; P389-T393 PolarHBondContact O-OG1 3.47Å; P389-T393 VanDerWaalsContact O-OG1 3.12Å |
| 390 | Q | 58.7 | Low | 60.5 | Low | 146 Ų | 146 | 111 Ų | 111 | 68% | 0.682 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -98.4 | -9 | -167.1 | -63.3 | -164.2 | -29.2 | 0 | 0 | 115.6 | S388 L394 | S388-Q390 PolarHBondContact O-N 3.3Å; Q390-L394 WeakPolarHBondContact O-CB 3.49Å; Q390-L394 PolarHBondContact O-N 3.08Å |
| 391 | L | 55.6 | Low | 61.8 | Low | 130 Ų | 130 | 108.5 Ų | 108.5 | 68% | 0.681 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -85 | -29.1 | 178.8 | -66.8 | 179.1 | 0 | 0 | 0 | 113.1 | A395 | L391-A395 PolarHBondContact O-N 3.03Å |
| 392 | S | 58.3 | Low | 63 | Low | 79 Ų | 79 | 108.8 Ų | 108.8 | 55% | 0.552 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -71.7 | -39.1 | 176.7 | 52.8 | 0 | 0 | 0 | 0 | 112 | P389 Q396 | P389-S392 PolarHBondContact O-OG 3.12Å; S392-Q396 PolarHBondContact O-N 3.48Å |
| 393 | T | 64.9 | Low | 64.3 | Low | 72 Ų | 72 | 107.7 Ų | 107.7 | 44% | 0.442 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -69 | -40.4 | 178 | 10.6 | 0 | 0 | 0 | 0 | 111.6 | P389 A395 Q396 D397 | P389-T393 PolarHBondContact O-OG1 3.47Å; P389-T393 VanDerWaalsContact O-OG1 3.12Å; T393-A395 VanDerWaalsContact C-N 3.34Å; T393-A395 PolarHBondContact O-N 3.26Å; T393-Q396 PolarHBondContact O-N 3.31Å; T393-D397 PolarHBondContact O-N 3.44Å |
| 394 | L | 70.4 | Confident | 65.3 | Low | 106 Ų | 106 | 109.5 Ų | 109.5 | 56% | 0.555 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -64.8 | -37.7 | 177.6 | -173.4 | 65.8 | 0 | 0 | 0 | 112.4 | Q390 D397 V398 | Q390-L394 WeakPolarHBondContact O-CB 3.49Å; Q390-L394 PolarHBondContact O-N 3.08Å; L394-D397 PolarHBondContact O-N 3.48Å; L394-V398 VanDerWaalsContact O-CG2 3.3Å; L394-V398 WeakPolarHBondContact O-CG2 3.33Å; L394-V398 PolarHBondContact O-N 3.32Å; L394-V398 VanDerWaalsContact O-N 3.08Å |
| 395 | A | 70.4 | Confident | 66.5 | Low | 58 Ų | 58 | 110 Ų | 110 | 48% | 0.479 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -65.7 | -41.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | L391 T393 V398 T399 | L391-A395 PolarHBondContact O-N 3.03Å; T393-A395 VanDerWaalsContact C-N 3.34Å; T393-A395 PolarHBondContact O-N 3.26Å; A395-V398 PolarHBondContact O-N 2.9Å; A395-T399 PolarHBondContact O-N 3.29Å; A395-T399 VanDerWaalsContact O-N 3.08Å; A395-T399 PolarHBondContact O-OG1 3.49Å; A395-T399 VanDerWaalsContact O-OG1 3.06Å |
| 396 | Q | 72.3 | Confident | 67 | Low | 133 Ų | 133 | 106.2 Ų | 106.2 | 62% | 0.621 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -65.5 | -38.9 | 176.7 | -79.2 | 174.8 | -37.8 | 0 | 0 | 112.5 | S392 T393 T399 A400 | S392-Q396 PolarHBondContact O-N 3.48Å; T393-Q396 PolarHBondContact O-N 3.31Å; Q396-T399 PolarHBondContact O-N 3.43Å; Q396-A400 WeakPolarHBondContact O-CB 3.3Å; Q396-A400 PolarHBondContact O-N 3.44Å |
| 397 | D | 75.4 | Confident | 67 | Low | 111 Ų | 111 | 106.5 Ų | 106.5 | 59% | 0.594 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -69 | -37.2 | 178 | -79.3 | -10.7 | 0 | 0 | 0 | 112.5 | T393 L394 A400 A401 | T393-D397 PolarHBondContact O-N 3.44Å; L394-D397 PolarHBondContact O-N 3.48Å; D397-A400 PolarHBondContact O-N 3.08Å; D397-A401 VanDerWaalsContact O-CB 3.28Å; D397-A401 WeakPolarHBondContact O-CB 3.28Å; D397-A401 PolarHBondContact O-N 3.06Å |
| 398 | V | 79.1 | Confident | 67.7 | Low | 77 Ų | 77 | 102.8 Ų | 102.8 | 47% | 0.467 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -66.4 | -43.8 | 174.9 | 171.6 | 0 | 0 | 0 | 0 | 110.8 | L394 A395 A400 A401 L402 | L394-V398 VanDerWaalsContact O-CG2 3.3Å; L394-V398 WeakPolarHBondContact O-CG2 3.33Å; L394-V398 PolarHBondContact O-N 3.32Å; L394-V398 VanDerWaalsContact O-N 3.08Å; A395-V398 PolarHBondContact O-N 2.9Å; V398-A400 PolarHBondContact O-N 3.46Å; V398-A401 PolarHBondContact O-N 3.37Å; V398-L402 HydrophobicContact CG1-CD1 3.84Å; V398-L402 WeakPolarHBondContact O-CD1 3.45Å; V398-L402 PolarHBondContact O-N 3.02Å |
| 399 | T | 79 | Confident | 68.7 | Low | 97 Ų | 97 | 103.9 Ų | 103.9 | 60% | 0.595 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -63 | -40.9 | 175.2 | -56.9 | 0 | 0 | 0 | 0 | 112 | A395 Q396 L402 A403 | A395-T399 PolarHBondContact O-N 3.29Å; A395-T399 VanDerWaalsContact O-N 3.08Å; A395-T399 PolarHBondContact O-OG1 3.49Å; A395-T399 VanDerWaalsContact O-OG1 3.06Å; Q396-T399 PolarHBondContact O-N 3.43Å; T399-L402 PolarHBondContact O-N 3.09Å; T399-A403 PolarHBondContact O-N 2.91Å; T399-A403 VanDerWaalsContact O-N 3.09Å |
| 400 | A | 76.1 | Confident | 69.3 | Low | 55 Ų | 55 | 104.7 Ų | 104.7 | 46% | 0.455 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -67.7 | -34 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q396 D397 V398 K404 | Q396-A400 WeakPolarHBondContact O-CB 3.3Å; Q396-A400 PolarHBondContact O-N 3.44Å; D397-A400 PolarHBondContact O-N 3.08Å; V398-A400 PolarHBondContact O-N 3.46Å; A400-K404 PolarHBondContact O-N 2.99Å |
| 401 | A | 75.9 | Confident | 70 | Confident | 54 Ų | 54 | 102.3 Ų | 102.3 | 45% | 0.446 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -70.2 | -40.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | D397 V398 K404 Q405 | D397-A401 VanDerWaalsContact O-CB 3.28Å; D397-A401 WeakPolarHBondContact O-CB 3.28Å; D397-A401 PolarHBondContact O-N 3.06Å; V398-A401 PolarHBondContact O-N 3.37Å; A401-K404 PolarHBondContact O-N 3.35Å; A401-Q405 PolarHBondContact O-N 3.49Å |
| 402 | L | 77.5 | Confident | 70.9 | Confident | 80 Ų | 80 | 100.6 Ų | 100.6 | 42% | 0.419 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -64.1 | -44 | 174.4 | -84.8 | 146.8 | 0 | 0 | 0 | 111.8 | V398 T399 K404 Q405 G406 L407 | V398-L402 HydrophobicContact CG1-CD1 3.84Å; V398-L402 WeakPolarHBondContact O-CD1 3.45Å; V398-L402 PolarHBondContact O-N 3.02Å; T399-L402 PolarHBondContact O-N 3.09Å; L402-K404 PolarHBondContact O-N 3.26Å; L402-Q405 PolarHBondContact O-N 3.25Å; L402-G406 PolarHBondContact O-N 3.35Å; L402-L407 HydrophobicContact CD2-CB 4.34Å |
| 403 | A | 74.3 | Confident | 71.7 | Confident | 76 Ų | 76 | 102 Ų | 102 | 63% | 0.628 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -61.5 | -30.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | T399 Q405 | T399-A403 PolarHBondContact O-N 2.91Å; T399-A403 VanDerWaalsContact O-N 3.09Å; A403-Q405 VanDerWaalsContact C-N 3.34Å |
| 404 | K | 73.4 | Confident | 72.2 | Confident | 191 Ų | 191 | 104.1 Ų | 104.1 | 83% | 0.83 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -75.7 | -19.4 | 174.4 | -86 | -175.5 | 174.5 | 179.9 | 0 | 114.1 | A400 A401 L402 | A400-K404 PolarHBondContact O-N 2.99Å; A401-K404 PolarHBondContact O-N 3.35Å; L402-K404 PolarHBondContact O-N 3.26Å |
| 405 | Q | 70.9 | Confident | 72.3 | Confident | 157 Ų | 157 | 104 Ų | 104 | 73% | 0.734 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -93.5 | -1.1 | 176.8 | -71.2 | -177.4 | -17.1 | 0 | 0 | 113.1 | A401 L402 A403 | A401-Q405 PolarHBondContact O-N 3.49Å; L402-Q405 PolarHBondContact O-N 3.25Å; A403-Q405 VanDerWaalsContact C-N 3.34Å |
| 406 | G | 62.6 | Low | 72.5 | Confident | 73 Ų | 73 | 107.8 Ų | 107.8 | 75% | 0.753 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 70.5 | 31.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | L402 | L402-G406 PolarHBondContact O-N 3.35Š|
| 407 | L | 53.5 | Low | 72.5 | Confident | 190 Ų | 190 | 105.5 Ų | 105.5 | 100% | 0.995 | 63% | 0.629 | S | S | * | * | | | trans | -101.9 | 0 | 172.4 | -105.7 | 153 | 0 | 0 | 0 | 111.4 | L402 | L402-L407 HydrophobicContact CD2-CB 4.34Š|