| 1 | M | 36.9 | Very low | 50.1 | Low | 247 Ų | 247 | 150.5 Ų | 150.5 | 100% | 1.217 | 84% | 0.836 | S | S | * | * | | | | 0 | 146.5 | 0 | -71.1 | -178.2 | 177.7 | 0 | 0 | 108.3 | | |
| 2 | S | 48.9 | Very low | 50.1 | Low | 121 Ų | 121 | 149.6 Ų | 149.6 | 85% | 0.846 | 84% | 0.842 | S | S | * | * | | | trans | -71.8 | 148.2 | -171.7 | -41.4 | 0 | 0 | 0 | 0 | 113.1 | | |
| 3 | K | 50.1 | Low | 50.2 | Low | 195 Ų | 195 | 145.8 Ų | 145.8 | 85% | 0.848 | 84% | 0.841 | S | S | * | * | | | trans | -158.6 | 106.5 | 138.8 | 41.2 | -173.9 | 173.7 | -179.1 | 0 | 109.7 | | |
| 4 | E | 44.7 | Very low | 50 | Low | 180 Ų | 180 | 140 Ų | 140 | 84% | 0.841 | 83% | 0.829 | S | S | * | * | | | trans | -67.4 | 144.5 | 165.7 | -173.8 | -179.2 | 113.9 | 0 | 0 | 109 | | |
| 5 | T | 57.5 | Low | 50 | Low | 124 Ų | 124 | 139.7 Ų | 139.7 | 76% | 0.761 | 83% | 0.832 | S | S | * | * | | | trans | -133.4 | 116.4 | 173.3 | -58.4 | 0 | 0 | 0 | 0 | 108.1 | | |
| 6 | V | 52 | Low | 49.6 | Very low | 120 Ų | 120 | 135.8 Ų | 135.8 | 73% | 0.727 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -73.3 | 137.6 | -174.4 | 175.2 | 0 | 0 | 0 | 0 | 110.9 | | |
| 7 | H | 54.5 | Low | 49.5 | Very low | 170 Ų | 170 | 139.8 Ų | 139.8 | 79% | 0.787 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -81.6 | 150.6 | 172.4 | -88.2 | -107.9 | 0 | 0 | 0 | 111.6 | | |
| 8 | P | 56.1 | Low | 49.1 | Very low | 114 Ų | 114 | 135.6 Ų | 135.6 | 74% | 0.74 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -76.2 | 158.6 | -170.3 | 31.8 | -36.9 | 0 | 0 | 0 | 113.9 | | |
| 9 | S | 48.7 | Very low | 48.9 | Very low | 124 Ų | 124 | 135.5 Ų | 135.5 | 87% | 0.867 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 136.1 | -177.7 | -43.9 | 0 | 0 | 0 | 0 | 114.1 | | |
| 10 | E | 49.1 | Very low | 48.4 | Very low | 198 Ų | 198 | 139.4 Ų | 139.4 | 93% | 0.925 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -77.2 | 129.7 | 165.9 | -67.4 | -179.5 | 96.6 | 0 | 0 | 110.6 | | |
| 11 | G | 52.7 | Low | 47.8 | Very low | 62 Ų | 62 | 141.1 Ų | 141.1 | 64% | 0.639 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -92.5 | 153.5 | 169 | 0 | 0 | 0 | 0 | 0 | 111.3 | A13 | G11-A13 PolarHBondContact O-N 3.23Š|
| 12 | P | 50.2 | Low | 47.7 | Very low | 140 Ų | 140 | 137 Ų | 137 | 91% | 0.909 | 81% | 0.806 | S | S | * | * | | | trans | -69.7 | 115.7 | -176.3 | 27.8 | -34.2 | 0 | 0 | 0 | 112.1 | | |
| 13 | A | 51.5 | Low | 47.1 | Very low | 100 Ų | 100 | 137.4 Ų | 137.4 | 83% | 0.826 | 80% | 0.804 | S | S | * | * | | | trans | -80.5 | 146.3 | 165.1 | 0 | 0 | 0 | 0 | 0 | 110.7 | G11 | G11-A13 PolarHBondContact O-N 3.23Š|
| 14 | G | 46.7 | Very low | 46.7 | Very low | 65 Ų | 65 | 132.4 Ų | 132.4 | 67% | 0.67 | 79% | 0.794 | S | S | * | * | | | trans | -73.8 | 169 | -170.1 | 0 | 0 | 0 | 0 | 0 | 116 | G16 | G14-G16 PolarHBondContact O-N 3.31Š|
| 15 | P | 50.3 | Low | 46.7 | Very low | 135 Ų | 135 | 129 Ų | 129 | 88% | 0.877 | 79% | 0.787 | S | S | * | * | | | trans | -72 | 108.4 | -176.1 | 29 | -34.8 | 0 | 0 | 0 | 112.4 | | |
| 16 | G | 44.5 | Very low | 45.4 | Very low | 78 Ų | 78 | 130.2 Ų | 130.2 | 80% | 0.804 | 79% | 0.788 | S | S | * | * | | | trans | -76.4 | 128.2 | 168.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | G14 | G14-G16 PolarHBondContact O-N 3.31Š|
| 17 | Q | 46.5 | Very low | 44.5 | Very low | 203 Ų | 203 | 131.9 Ų | 131.9 | 95% | 0.949 | 79% | 0.792 | S | S | * | * | | | trans | -78.8 | 138.3 | 172.7 | -62.5 | -177.5 | 19.2 | 0 | 0 | 110.9 | | |
| 18 | G | 42.5 | Very low | 43.3 | Very low | 65 Ų | 65 | 132.2 Ų | 132.2 | 67% | 0.67 | 80% | 0.799 | S | S | * | * | | | trans | -147.2 | 131.3 | 173.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | | |
| 19 | P | 45.8 | Very low | 42.6 | Very low | 134 Ų | 134 | 131.3 Ų | 131.3 | 87% | 0.87 | 80% | 0.801 | S | S | * | * | | | trans | -77.4 | 128.9 | -177.2 | 30.8 | -33.6 | 0 | 0 | 0 | 110.8 | | |
| 20 | R | 38.2 | Very low | 42.1 | Very low | 212 Ų | 212 | 131.1 Ų | 131.1 | 80% | 0.8 | 80% | 0.8 | S | S | * | * | | | trans | -104.2 | 113.1 | 172.1 | -155.6 | -169.9 | -173.2 | -70.6 | 2.1 | 110.9 | | |
| 21 | Q | 37.1 | Very low | 41.8 | Very low | 176 Ų | 176 | 130.4 Ų | 130.4 | 82% | 0.822 | 80% | 0.796 | S | S | * | * | | | trans | -79.2 | 172.1 | 172.7 | -74.1 | -177.9 | -21.6 | 0 | 0 | 112.4 | | |
| 22 | E | 33.5 | Very low | 41.1 | Very low | 161 Ų | 161 | 133.2 Ų | 133.2 | 75% | 0.752 | 80% | 0.796 | S | S | * | * | | | trans | -66.4 | 157.4 | -167.5 | -61.4 | 170.9 | 63.7 | 0 | 0 | 115.7 | | |
| 23 | T | 37.7 | Very low | 40.6 | Very low | 129 Ų | 129 | 131 Ų | 131 | 79% | 0.791 | 79% | 0.789 | S | S | * | * | | | trans | -142 | 85.1 | 142.1 | 48.1 | 0 | 0 | 0 | 0 | 109.7 | | |
| 24 | S | 41.2 | Very low | 40.2 | Very low | 91 Ų | 91 | 131.4 Ų | 131.4 | 64% | 0.636 | 79% | 0.786 | S | S | * | * | | | trans | -62.1 | 163.9 | 155.4 | -71.8 | 0 | 0 | 0 | 0 | 110 | | |
| 25 | P | 43.9 | Very low | 39.6 | Very low | 109 Ų | 109 | 135.6 Ų | 135.6 | 71% | 0.708 | 79% | 0.792 | S | S | * | * | | | cis | -141.1 | 175.7 | 24.5 | 43 | -25 | 0 | 0 | 0 | 116.8 | | |
| 26 | L | 31.7 | Very low | 39.2 | Very low | 149 Ų | 149 | 135.3 Ų | 135.3 | 78% | 0.78 | 79% | 0.792 | S | S | * | * | | | | -177.1 | 130 | 109 | -91.5 | -176.2 | 0 | 0 | 0 | 112.5 | | |
| 27 | L | 32.6 | Very low | 38.7 | Very low | 155 Ų | 155 | 140.3 Ų | 140.3 | 81% | 0.812 | 80% | 0.795 | S | S | * | * | | | trans | 52.1 | 100 | 154.1 | -51.3 | -178.7 | 0 | 0 | 0 | 120 | | |
| 28 | L | 29.1 | Very low | 38.4 | Very low | 176 Ų | 176 | 135.2 Ų | 135.2 | 92% | 0.921 | 78% | 0.781 | S | S | * | * | | | | -144.2 | 136 | 106.8 | -163.5 | 64.8 | 0 | 0 | 0 | 109.8 | | |
| 29 | A | 40.7 | Very low | 38.1 | Very low | 95 Ų | 95 | 138.4 Ų | 138.4 | 79% | 0.785 | 79% | 0.788 | S | S | * | * | | | trans | -134.7 | 122.1 | 178.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | | |
| 30 | S | 38.8 | Very low | 37.4 | Very low | 121 Ų | 121 | 135.2 Ų | 135.2 | 85% | 0.846 | 78% | 0.78 | S | S | * | * | | | trans | -145.2 | 155.8 | 161.3 | 54.7 | 0 | 0 | 0 | 0 | 108.3 | | |
| 31 | H | 42.2 | Very low | 37.2 | Very low | 182 Ų | 182 | 131.4 Ų | 131.4 | 84% | 0.843 | 79% | 0.785 | S | S | * | * | | | trans | -110.1 | 135.4 | -148.2 | -169.4 | -74.9 | 0 | 0 | 0 | 112.1 | | |
| 32 | D | 37.8 | Very low | 37 | Very low | 121 Ų | 121 | 127.5 Ų | 127.5 | 65% | 0.647 | 78% | 0.783 | S | S | * | * | | | trans | -76.7 | 146.5 | 172.2 | -162.9 | -64.8 | 0 | 0 | 0 | 110.9 | C34 | D32-C34 PolarHBondContact OD1-N 3.4Å; D32-C34 PolarHBondContact OD1-SG 3.3Å |
| 33 | A | 40.8 | Very low | 36.9 | Very low | 93 Ų | 93 | 125.3 Ų | 125.3 | 77% | 0.769 | 79% | 0.786 | S | S | * | * | | | trans | -154.2 | 62.3 | 171.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | D35 | A33-D35 PolarHBondContact O-N 2.85Š|
| 34 | C | 42 | Very low | 36.7 | Very low | 110 Ų | 110 | 124.5 Ų | 124.5 | 74% | 0.743 | 79% | 0.785 | S | S | * | * | | | trans | -69.7 | 114.9 | 162.7 | -63.2 | 0 | 0 | 0 | 0 | 110.6 | D32 | D32-C34 PolarHBondContact OD1-N 3.4Å; D32-C34 PolarHBondContact OD1-SG 3.3Å |
| 35 | D | 34.2 | Very low | 36.9 | Very low | 152 Ų | 152 | 125.7 Ų | 125.7 | 81% | 0.813 | 79% | 0.791 | S | S | * | * | | | trans | -142 | 144.5 | 166.4 | -125.8 | -39.2 | 0 | 0 | 0 | 111.3 | A33 | A33-D35 PolarHBondContact O-N 2.85Š|
| 36 | C | 42.1 | Very low | 36.7 | Very low | 129 Ų | 129 | 130 Ų | 130 | 87% | 0.872 | 79% | 0.793 | S | S | * | * | | | trans | -144.5 | 95.1 | -176.3 | -88.8 | 0 | 0 | 0 | 0 | 110.3 | | |
| 37 | E | 34.6 | Very low | 36.7 | Very low | 184 Ų | 184 | 132.8 Ų | 132.8 | 86% | 0.86 | 80% | 0.799 | S | S | * | * | | | trans | -128 | 149.1 | 172.5 | -95.2 | -76.5 | 46 | 0 | 0 | 112 | | |
| 38 | S | 39.2 | Very low | 36.9 | Very low | 95 Ų | 95 | 132.6 Ų | 132.6 | 66% | 0.664 | 79% | 0.794 | S | S | * | * | | | trans | -100.4 | 146.8 | -176.2 | 168.9 | 0 | 0 | 0 | 0 | 111.3 | | |
| 39 | T | 36.7 | Very low | 37 | Very low | 133 Ų | 133 | 130.3 Ų | 130.3 | 82% | 0.816 | 79% | 0.792 | S | S | * | * | | | | 156.6 | 129.8 | 118.4 | -69.1 | 0 | 0 | 0 | 0 | 114 | | |
| 40 | G | 31.5 | Very low | 36.8 | Very low | 67 Ų | 67 | 129.7 Ų | 129.7 | 69% | 0.691 | 79% | 0.787 | S | S | * | * | | | trans | 99.5 | 101.3 | 131.9 | 0 | 0 | 0 | 0 | 0 | 119.7 | | |
| 41 | S | 34.4 | Very low | 36.5 | Very low | 131 Ų | 131 | 133 Ų | 133 | 92% | 0.916 | 79% | 0.789 | S | S | * | * | | | trans | -156.2 | 142.3 | 142.6 | -82.2 | 0 | 0 | 0 | 0 | 110 | | |
| 42 | A | 33 | Very low | 36.1 | Very low | 95 Ų | 95 | 128 Ų | 128 | 79% | 0.785 | 79% | 0.787 | S | S | * | * | | | trans | -91.6 | 175.3 | -175.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | | |
| 43 | S | 31.1 | Very low | 36.1 | Very low | 115 Ų | 115 | 131.8 Ų | 131.8 | 80% | 0.804 | 80% | 0.801 | S | S | * | * | | | cis | -154.5 | 172.2 | 18.7 | -42.1 | 0 | 0 | 0 | 0 | 112.6 | | |
| 44 | S | 33.7 | Very low | 35.6 | Very low | 111 Ų | 111 | 132.9 Ų | 132.9 | 78% | 0.776 | 80% | 0.803 | S | S | * | * | | | trans | -76.4 | 178.8 | 170.1 | -122 | 0 | 0 | 0 | 0 | 112.8 | | |
| 45 | P | 45 | Very low | 35.3 | Very low | 117 Ų | 117 | 134.9 Ų | 134.9 | 76% | 0.76 | 81% | 0.805 | S | S | * | * | | | cis | -140 | 155.5 | 14.3 | 39.3 | -19.2 | 0 | 0 | 0 | 120.3 | | |
| 46 | R | 39.1 | Very low | 35.3 | Very low | 199 Ų | 199 | 134 Ų | 134 | 75% | 0.751 | 81% | 0.805 | S | S | * | * | | | trans | -16.8 | 136.5 | 146.1 | 178.6 | -174.9 | -176.3 | -174.7 | 2.6 | 117.5 | | |
| 47 | K | 32.1 | Very low | 34.9 | Very low | 208 Ų | 208 | 134.6 Ų | 134.6 | 90% | 0.904 | 81% | 0.805 | S | S | * | * | | | trans | -132.4 | 135.9 | 146.8 | -84.2 | -167.2 | 175 | -175.7 | 0 | 111.7 | | |
| 48 | Q | 36.4 | Very low | 35.1 | Very low | 151 Ų | 151 | 134.1 Ų | 134.1 | 71% | 0.706 | 80% | 0.803 | S | S | * | * | | | trans | -112.3 | 147.1 | 155.2 | -70.3 | 167.6 | -93.2 | 0 | 0 | 106.7 | | |
| 49 | S | 31.1 | Very low | 34.8 | Very low | 127 Ų | 127 | 138.2 Ų | 138.2 | 89% | 0.888 | 81% | 0.812 | S | S | * | * | | | trans | -146.9 | 148 | 163.2 | -167.6 | 0 | 0 | 0 | 0 | 108.7 | | |
| 50 | A | 36.5 | Very low | 35.1 | Very low | 82 Ų | 82 | 138.7 Ų | 138.7 | 68% | 0.678 | 80% | 0.802 | S | S | * | * | | | trans | -104.4 | -171.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111 | | |
| 51 | E | 33.5 | Very low | 35.7 | Very low | 191 Ų | 191 | 140.9 Ų | 140.9 | 89% | 0.893 | 80% | 0.804 | S | S | * | * | | | trans | 72.6 | 130.5 | 172.1 | -122.6 | 79.9 | 131.9 | 0 | 0 | 118.2 | | |
| 52 | G | 32.9 | Very low | 35.9 | Very low | 77 Ų | 77 | 140.8 Ų | 140.8 | 79% | 0.794 | 79% | 0.793 | S | S | * | * | | | trans | 159.6 | 74.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | | |
| 53 | Q | 39.3 | Very low | 36 | Very low | 200 Ų | 200 | 145.6 Ų | 145.6 | 94% | 0.935 | 79% | 0.793 | S | S | * | * | | | trans | -86 | 136 | 174.8 | -65.3 | 177.6 | -8.9 | 0 | 0 | 111.7 | | |
| 54 | S | 30.3 | Very low | 36.3 | Very low | 117 Ų | 117 | 145.7 Ų | 145.7 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | | | trans | -160 | 168.4 | 151.4 | -158.8 | 0 | 0 | 0 | 0 | 112 | | |
| 55 | L | 34.1 | Very low | 36.8 | Very low | 151 Ų | 151 | 148.9 Ų | 148.9 | 79% | 0.791 | 79% | 0.792 | S | S | * | * | | | trans | -84.2 | 143.3 | -159.8 | -72.5 | 79.4 | 0 | 0 | 0 | 115.8 | | |
| 56 | V | 34.4 | Very low | 36.7 | Very low | 133 Ų | 133 | 148.9 Ų | 148.9 | 81% | 0.806 | 79% | 0.792 | S | S | * | * | | | trans | 32.8 | 116 | 131.2 | -170.8 | 0 | 0 | 0 | 0 | 119.3 | | |
| 57 | T | 34 | Very low | 36.5 | Very low | 142 Ų | 142 | 145.8 Ų | 145.8 | 87% | 0.871 | 80% | 0.795 | S | S | * | * | | | trans | -140.3 | 153.3 | 133.2 | -29 | 0 | 0 | 0 | 0 | 110 | | |
| 58 | E | 38.6 | Very low | 36.8 | Very low | 174 Ų | 174 | 146.2 Ų | 146.2 | 81% | 0.813 | 79% | 0.791 | S | S | * | * | | | trans | -84.1 | 137.6 | 179.4 | -178.1 | -171.9 | 135.7 | 0 | 0 | 112 | | |
| 59 | E | 33.8 | Very low | 36.9 | Very low | 182 Ų | 182 | 145.2 Ų | 145.2 | 85% | 0.85 | 80% | 0.795 | S | S | * | * | | | trans | -137.7 | 142.5 | 159.3 | -157.5 | -165.5 | 96.4 | 0 | 0 | 110.5 | | |
| 60 | K | 43.3 | Very low | 37.2 | Very low | 142 Ų | 142 | 146.2 Ų | 146.2 | 62% | 0.617 | 79% | 0.786 | S | S | * | * | | | trans | -126.7 | 107.4 | -171.4 | 174.7 | -162.4 | 164.4 | -167.3 | 0 | 111.3 | | |
| 61 | P | 43.8 | Very low | 37.2 | Very low | 113 Ų | 113 | 148.3 Ų | 148.3 | 73% | 0.734 | 79% | 0.793 | S | S | * | * | | | trans | -65.8 | 139.7 | 165 | -20.8 | 34.1 | 0 | 0 | 0 | 111.3 | | |
| 62 | N | 37.3 | Very low | 37.1 | Very low | 129 Ų | 129 | 149.9 Ų | 149.9 | 69% | 0.69 | 79% | 0.79 | S | S | * | * | | | trans | -91.2 | 139.4 | -178.3 | -74.8 | -78 | 0 | 0 | 0 | 112.2 | | |
| 63 | Y | 36.6 | Very low | 37.3 | Very low | 196 Ų | 196 | 151.9 Ų | 151.9 | 77% | 0.769 | 79% | 0.793 | S | S | * | * | | | trans | -86.9 | 112.3 | 178 | -179 | -89.3 | 0 | 0 | 0 | 111.1 | K65 | Y63-K65 HydrophobicContact CD1-CG 4.25Å; Y63-K65 HydrophobicContact CE1-CG 4.19Å |
| 64 | C | 36.4 | Very low | 37.1 | Very low | 118 Ų | 118 | 151 Ų | 151 | 80% | 0.797 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -73.7 | 128.1 | 170.4 | -74.8 | 0 | 0 | 0 | 0 | 110.9 | | |
| 65 | K | 45.3 | Very low | 37.4 | Very low | 177 Ų | 177 | 150 Ų | 150 | 77% | 0.77 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -85 | 138.8 | 174 | -69.4 | -179.2 | 178.3 | 180 | 0 | 110.6 | Y63 | Y63-K65 HydrophobicContact CD1-CG 4.25Å; Y63-K65 HydrophobicContact CE1-CG 4.19Å |
| 66 | P | 42.1 | Very low | 37.6 | Very low | 118 Ų | 118 | 150 Ų | 150 | 77% | 0.766 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 136.1 | 169.8 | -21.4 | 33.3 | 0 | 0 | 0 | 111.8 | | |
| 67 | V | 34.7 | Very low | 37.5 | Very low | 134 Ų | 134 | 152.3 Ų | 152.3 | 81% | 0.812 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -86.4 | 128.3 | 171.1 | 173.6 | 0 | 0 | 0 | 0 | 109 | | |
| 68 | R | 39.4 | Very low | 37.5 | Very low | 216 Ų | 216 | 154.8 Ų | 154.8 | 82% | 0.815 | 79% | 0.788 | S | S | * | * | | | trans | -97.5 | 109.1 | 172.9 | -179.1 | 178.4 | -178 | 141.3 | 0.8 | 109.5 | | |
| 69 | T | 37.5 | Very low | 37.5 | Very low | 130 Ų | 130 | 152.2 Ų | 152.2 | 80% | 0.798 | 79% | 0.786 | S | S | * | * | | | trans | -73.1 | 137.6 | 167.9 | 38.4 | 0 | 0 | 0 | 0 | 110.6 | | |
| 70 | Q | 37.4 | Very low | 37.5 | Very low | 149 Ų | 149 | 147.3 Ų | 147.3 | 70% | 0.696 | 78% | 0.777 | S | S | * | * | | | trans | -133.1 | 130.5 | 166.9 | -83.3 | -102.8 | 80.4 | 0 | 0 | 105.9 | | |
| 71 | P | 36.3 | Very low | 37.8 | Very low | 125 Ų | 125 | 146.2 Ų | 146.2 | 81% | 0.812 | 79% | 0.785 | S | S | * | * | | | trans | -67.1 | 141.1 | 172.4 | 29.6 | -33.4 | 0 | 0 | 0 | 109.4 | | |
| 72 | R | 32.7 | Very low | 37.2 | Very low | 224 Ų | 224 | 145.2 Ų | 145.2 | 85% | 0.845 | 78% | 0.78 | S | S | * | * | | | trans | -106.4 | 123.3 | 178.1 | -150.5 | -175.3 | -163.6 | -151.5 | 5.4 | 108.7 | | |
| 73 | S | 36.3 | Very low | 37.2 | Very low | 120 Ų | 120 | 147.8 Ų | 147.8 | 84% | 0.839 | 79% | 0.788 | S | S | * | * | | | trans | -77.7 | 140.1 | 167.1 | 47.5 | 0 | 0 | 0 | 0 | 110 | | |
| 74 | E | 34.2 | Very low | 37 | Very low | 180 Ų | 180 | 148.1 Ų | 148.1 | 84% | 0.841 | 80% | 0.796 | S | S | * | * | | | trans | -133.7 | 147.4 | 176.2 | -164.8 | 160.9 | 107 | 0 | 0 | 109.2 | | |
| 75 | S | 37.7 | Very low | 37.1 | Very low | 98 Ų | 98 | 147 Ų | 147 | 69% | 0.685 | 80% | 0.796 | S | S | * | * | | | trans | -145 | 140.8 | -161.9 | 55.6 | 0 | 0 | 0 | 0 | 112.9 | | |
| 76 | D | 37.2 | Very low | 36.8 | Very low | 150 Ų | 150 | 145.8 Ų | 145.8 | 80% | 0.802 | 79% | 0.793 | S | S | * | * | | | trans | 57.4 | 109.2 | 158.4 | -67.9 | -73.2 | 0 | 0 | 0 | 120.6 | | |
| 77 | L | 32 | Very low | 36.6 | Very low | 181 Ų | 181 | 148.1 Ų | 148.1 | 95% | 0.948 | 79% | 0.787 | S | S | * | * | | | trans | -152.6 | 123.1 | 143.1 | -78.1 | -172 | 0 | 0 | 0 | 111.9 | | |
| 78 | K | 35.2 | Very low | 36.6 | Very low | 194 Ų | 194 | 148 Ų | 148 | 84% | 0.843 | 78% | 0.777 | S | S | * | * | | | trans | -162.4 | 135.1 | 159.3 | -165.4 | 170.1 | 72.1 | 174 | 0 | 112.3 | | |
| 79 | P | 37.8 | Very low | 36.5 | Very low | 120 Ų | 120 | 144.3 Ų | 144.3 | 78% | 0.779 | 78% | 0.779 | S | S | * | * | | | | -124.7 | 148.8 | 115.3 | 1.2 | 20.8 | 0 | 0 | 0 | 110.9 | | |
| 80 | A | 34.7 | Very low | 36.7 | Very low | 80 Ų | 80 | 142.8 Ų | 142.8 | 66% | 0.661 | 78% | 0.78 | S | S | * | * | | | | 69.6 | 144.4 | 56 | 0 | 0 | 0 | 0 | 0 | 113.3 | | |
| 81 | P | 48.2 | Very low | 36.7 | Very low | 119 Ų | 119 | 145.7 Ų | 145.7 | 77% | 0.773 | 79% | 0.79 | S | S | * | * | | | cis | -114 | -164 | 14.9 | 38 | -19.7 | 0 | 0 | 0 | 113 | | |
| 82 | S | 31.8 | Very low | 37 | Very low | 92 Ų | 92 | 145.6 Ų | 145.6 | 64% | 0.643 | 78% | 0.782 | S | S | * | * | | | cis | -142.8 | 141.6 | 12.1 | -41.2 | 0 | 0 | 0 | 0 | 111.4 | | |
| 83 | E | 36.8 | Very low | 37.6 | Very low | 182 Ų | 182 | 142.7 Ų | 142.7 | 85% | 0.85 | 78% | 0.779 | S | S | * | * | | | | 61.9 | 109.9 | 98.3 | -57.3 | -172.9 | 108 | 0 | 0 | 117.3 | | |
| 84 | E | 33.4 | Very low | 37.9 | Very low | 203 Ų | 203 | 144.4 Ų | 144.4 | 95% | 0.949 | 78% | 0.778 | S | S | * | * | | | | -147.3 | 161 | 123.7 | -71.3 | -154.6 | 153.1 | 0 | 0 | 108.3 | | |
| 85 | A | 37.5 | Very low | 37.7 | Very low | 96 Ų | 96 | 139 Ų | 139 | 79% | 0.793 | 77% | 0.771 | S | S | * | * | | | trans | -100.1 | 176.7 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | | |
| 86 | E | 39.7 | Very low | 37.6 | Very low | 151 Ų | 151 | 144.4 Ų | 144.4 | 71% | 0.706 | 78% | 0.782 | S | S | * | * | | | cis | -151.4 | 178.5 | 6.7 | -136.1 | -167.4 | 36.5 | 0 | 0 | 106.3 | | |
| 87 | R | 38.4 | Very low | 38.2 | Very low | 166 Ų | 166 | 141.5 Ų | 141.5 | 63% | 0.626 | 77% | 0.772 | S | S | * | * | | | cis | -157.7 | 152 | 9.7 | -156.6 | -163.1 | 173.8 | 71.4 | 18.8 | 113.6 | | |
| 88 | E | 34.8 | Very low | 38.2 | Very low | 132 Ų | 132 | 141 Ų | 141 | 62% | 0.617 | 76% | 0.764 | S | S | * | * | | | trans | -2.1 | 122.9 | 144.1 | -167.2 | -171.3 | 174.7 | 0 | 0 | 119.9 | | |
| 89 | T | 37.4 | Very low | 38.3 | Very low | 139 Ų | 139 | 138 Ų | 138 | 85% | 0.853 | 76% | 0.757 | S | S | * | * | | | | -162.8 | 140.5 | 107.4 | 9.8 | 0 | 0 | 0 | 0 | 111.5 | | |
| 90 | A | 40.2 | Very low | 38.2 | Very low | 98 Ų | 98 | 137.4 Ų | 137.4 | 81% | 0.81 | 76% | 0.757 | S | S | * | * | | | trans | -110.6 | 147.9 | -178.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | | |
| 91 | K | 38.8 | Very low | 38.2 | Very low | 210 Ų | 210 | 138.8 Ų | 138.8 | 91% | 0.913 | 76% | 0.761 | S | S | * | * | | | trans | -147.1 | 129.9 | 144.1 | -149 | 169 | -175.1 | 177.1 | 0 | 113.2 | | |
| 92 | D | 43.1 | Very low | 37.6 | Very low | 122 Ų | 122 | 136.9 Ų | 136.9 | 65% | 0.652 | 76% | 0.763 | S | S | * | * | | | trans | -79.5 | 150.3 | 172.7 | 174.1 | -105.5 | 0 | 0 | 0 | 111.1 | | |
| 93 | Q | 45.2 | Very low | 38 | Very low | 164 Ų | 164 | 138.4 Ų | 138.4 | 77% | 0.766 | 77% | 0.768 | S | S | * | * | | | | 173.3 | 162.7 | 127.5 | -94 | -62.4 | -31.6 | 0 | 0 | 113.1 | | |
| 94 | N | 40.8 | Very low | 38.3 | Very low | 156 Ų | 156 | 135.7 Ų | 135.7 | 83% | 0.834 | 77% | 0.767 | S | S | * | * | | | trans | -111 | 162.7 | -168 | -159.8 | -1.8 | 0 | 0 | 0 | 111.9 | | |
| 95 | G | 31.1 | Very low | 38.4 | Very low | 67 Ų | 67 | 132.9 Ų | 132.9 | 69% | 0.691 | 76% | 0.763 | S | S | * | * | | | trans | 121.9 | 116.7 | 156.7 | 0 | 0 | 0 | 0 | 0 | 119.2 | | |
| 96 | F | 35.6 | Very low | 38.5 | Very low | 210 Ų | 210 | 132.2 Ų | 132.2 | 92% | 0.921 | 76% | 0.758 | S | S | * | * | | | trans | -95.6 | 171.5 | 144.3 | -89.3 | -96.5 | 0 | 0 | 0 | 108.7 | | |
| 97 | P | 48.8 | Very low | 38.3 | Very low | 89 Ų | 89 | 131 Ų | 131 | 58% | 0.578 | 77% | 0.767 | S | S | * | * | | | cis | -128.3 | 180 | -11.1 | 27.2 | -5.3 | 0 | 0 | 0 | 113 | | |
| 98 | H | 32.5 | Very low | 38.1 | Very low | 170 Ų | 170 | 130.6 Ų | 130.6 | 79% | 0.787 | 78% | 0.777 | S | S | * | * | | | | 166.6 | 173.4 | 120.2 | -91 | -67 | 0 | 0 | 0 | 113.9 | | |
| 99 | N | 37 | Very low | 38.3 | Very low | 131 Ų | 131 | 128 Ų | 128 | 70% | 0.701 | 78% | 0.778 | S | S | * | * | | | trans | -79 | 163.7 | -172.3 | 56.1 | 69.7 | 0 | 0 | 0 | 114.6 | | |
| 100 | S | 37.3 | Very low | 38.5 | Very low | 109 Ų | 109 | 129.4 Ų | 129.4 | 76% | 0.762 | 78% | 0.78 | S | S | * | * | | | | -174.7 | 136.2 | 128.8 | -88.5 | 0 | 0 | 0 | 0 | 115.4 | | |
| 101 | S | 33.8 | Very low | 38.3 | Very low | 109 Ų | 109 | 127.9 Ų | 127.9 | 76% | 0.762 | 77% | 0.774 | S | S | * | * | | | trans | 46.9 | 98.7 | 142.7 | -172.7 | 0 | 0 | 0 | 0 | 121 | | |
| 102 | G | 36.4 | Very low | 38.2 | Very low | 78 Ų | 78 | 125.4 Ų | 125.4 | 80% | 0.804 | 77% | 0.769 | S | S | * | * | | | trans | -115.3 | 118.5 | 148.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | | |
| 103 | T | 40.3 | Very low | 38 | Very low | 124 Ų | 124 | 127.7 Ų | 127.7 | 76% | 0.761 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -93.3 | 130.1 | -175.4 | 46.3 | 0 | 0 | 0 | 0 | 113.3 | | |
| 104 | P | 43.2 | Very low | 37.5 | Very low | 125 Ų | 125 | 125.6 Ų | 125.6 | 81% | 0.812 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -88.4 | 137.6 | 159.2 | 33.5 | -30 | 0 | 0 | 0 | 111.4 | | |
| 105 | T | 35.3 | Very low | 37.3 | Very low | 144 Ų | 144 | 122 Ų | 122 | 88% | 0.883 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -74.3 | 144.7 | 175.6 | -60.2 | 0 | 0 | 0 | 0 | 111.6 | | |
| 106 | A | 39.9 | Very low | 37.7 | Very low | 83 Ų | 83 | 127.1 Ų | 127.1 | 69% | 0.686 | 79% | 0.789 | S | S | * | * | | | trans | -107.7 | 166 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | | |
| 107 | S | 33.5 | Very low | 37.9 | Very low | 126 Ų | 126 | 120.4 Ų | 120.4 | 88% | 0.881 | 78% | 0.778 | S | S | * | * | | | trans | 71.2 | 138.9 | -177.7 | -58.1 | 0 | 0 | 0 | 0 | 114.3 | | |
| 108 | N | 35.3 | Very low | 37.4 | Very low | 157 Ų | 157 | 121.8 Ų | 121.8 | 84% | 0.84 | 79% | 0.79 | S | S | * | * | | | cis | -127.1 | 159.1 | 31.5 | -172.7 | 30.6 | 0 | 0 | 0 | 114.1 | | |
| 109 | A | 39.6 | Very low | 38.1 | Very low | 78 Ų | 78 | 119.5 Ų | 119.5 | 65% | 0.645 | 79% | 0.79 | S | S | * | * | | | trans | -96.8 | 153.5 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | | |
| 110 | N | 39.9 | Very low | 38.5 | Very low | 167 Ų | 167 | 121.7 Ų | 121.7 | 89% | 0.893 | 80% | 0.797 | S | S | * | * | | | trans | -155 | 120 | 148.8 | -128.4 | 5.3 | 0 | 0 | 0 | 108.9 | | |
| 111 | G | 37 | Very low | 38.9 | Very low | 66 Ų | 66 | 120.1 Ų | 120.1 | 68% | 0.68 | 80% | 0.797 | S | S | * | * | | | trans | -98.8 | 137.6 | -178.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | | |
| 112 | I | 35.8 | Very low | 39.6 | Very low | 159 Ų | 159 | 119.6 Ų | 119.6 | 82% | 0.815 | 79% | 0.79 | S | S | * | * | | | trans | -120.6 | 121.7 | 162.8 | -53.6 | -178.6 | 0 | 0 | 0 | 108 | | |
| 113 | H | 40.1 | Very low | 40.4 | Very low | 169 Ų | 169 | 127.7 Ų | 127.7 | 78% | 0.782 | 80% | 0.796 | S | S | * | * | | | trans | -88.6 | 123.1 | 179.5 | 30.8 | -95.2 | 0 | 0 | 0 | 109.9 | | |
| 114 | S | 33.8 | Very low | 40.7 | Very low | 121 Ų | 121 | 126.7 Ų | 126.7 | 85% | 0.846 | 79% | 0.79 | S | S | * | * | | | trans | -143.6 | 92.8 | 167.7 | -79.9 | 0 | 0 | 0 | 0 | 109.4 | | |
| 115 | G | 38.1 | Very low | 40.8 | Very low | 81 Ų | 81 | 123.7 Ų | 123.7 | 84% | 0.835 | 77% | 0.771 | S | S | * | * | | | trans | -99.7 | 114.8 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | | |
| 116 | I | 38.1 | Very low | 41.9 | Very low | 174 Ų | 174 | 124.4 Ų | 124.4 | 89% | 0.892 | 78% | 0.775 | S | S | * | * | | | trans | -130.8 | 128.5 | 158 | -76.5 | 172.5 | 0 | 0 | 0 | 105.8 | | |
| 117 | G | 39.5 | Very low | 42.6 | Very low | 68 Ų | 68 | 125.7 Ų | 125.7 | 70% | 0.701 | 78% | 0.778 | S | S | * | * | | | trans | -83.8 | 156.8 | -169.5 | 0 | 0 | 0 | 0 | 0 | 115.1 | | |
| 118 | S | 38.6 | Very low | 43.1 | Very low | 118 Ų | 118 | 122.7 Ų | 122.7 | 83% | 0.825 | 77% | 0.767 | S | S | * | * | | | trans | -144.9 | 152.3 | 153.2 | -80.8 | 0 | 0 | 0 | 0 | 108.1 | | |
| 119 | P | 47.7 | Very low | 43.3 | Very low | 122 Ų | 122 | 118.5 Ų | 118.5 | 79% | 0.792 | 75% | 0.754 | S | S | * | * | | | trans | -75.2 | 173 | -164.4 | 31 | -37.2 | 0 | 0 | 0 | 113.7 | G121 | P119-G121 PolarHBondContact O-N 3.28Š|
| 120 | E | 46 | Very low | 43.5 | Very low | 178 Ų | 178 | 117.7 Ų | 117.7 | 83% | 0.832 | 75% | 0.753 | S | S | * | * | | | trans | -47.6 | 123.7 | 175.6 | -70.8 | 143.9 | 92.8 | 0 | 0 | 112.6 | T122 | E120-T122 PolarHBondContact O-N 3.24Š|
| 121 | G | 44 | Very low | 43.8 | Very low | 75 Ų | 75 | 116.3 Ų | 116.3 | 77% | 0.773 | 75% | 0.751 | S | S | * | * | | | trans | -75 | 66.4 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | P119 R123 | P119-G121 PolarHBondContact O-N 3.28Å; G121-R123 PolarHBondContact O-N 3.42Å |
| 122 | T | 49.7 | Very low | 43.9 | Very low | 99 Ų | 99 | 116.7 Ų | 116.7 | 61% | 0.607 | 76% | 0.755 | S | S | * | * | | | trans | -57.1 | 105.3 | 169 | -60.4 | 0 | 0 | 0 | 0 | 109 | E120 T124 | E120-T122 PolarHBondContact O-N 3.24Å; T122-T124 VanDerWaalsContact C-N 3.34Å; T122-T124 HydrophobicContact CG2-CG2 4.36Å; T122-T124 PolarHBondContact O-N 3.47Å |
| 123 | R | 52.1 | Low | 44.1 | Very low | 248 Ų | 248 | 114 Ų | 114 | 94% | 0.936 | 76% | 0.756 | S | S | * | * | | | trans | -70.6 | 88.1 | 177.1 | -71.9 | -172.3 | 174.2 | -160.5 | -1.5 | 109.9 | G121 | G121-R123 PolarHBondContact O-N 3.42Š|
| 124 | T | 48.1 | Very low | 44 | Very low | 102 Ų | 102 | 112 Ų | 112 | 63% | 0.626 | 76% | 0.761 | S | S | * | * | | | trans | -71.6 | 125.3 | 172 | 50.1 | 0 | 0 | 0 | 0 | 110.5 | T122 | T122-T124 VanDerWaalsContact C-N 3.34Å; T122-T124 HydrophobicContact CG2-CG2 4.36Å; T122-T124 PolarHBondContact O-N 3.47Å |
| 125 | C | 43.7 | Very low | 44.1 | Very low | 63 Ų | 63 | 111 Ų | 111 | 43% | 0.426 | 76% | 0.761 | S | S | . | * | | | trans | -67.4 | 152.6 | 170.7 | 51.4 | 0 | 0 | 0 | 0 | 111.8 | C127 G128 | C125-C127 PolarHBondContact O-N 3.19Å; C125-C127 PolarHBondContact SG-SG 3.31Å; C125-G128 PolarHBondContact O-N 3.37Å |
| 126 | T | 58.4 | Low | 44.2 | Very low | 158 Ų | 158 | 112.5 Ų | 112.5 | 97% | 0.969 | 77% | 0.765 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.4 | -15.4 | -174.9 | -42.5 | 0 | 0 | 0 | 0 | 113.9 | G128 | T126-G128 VanDerWaalsContact C-N 3.32Š|
| 127 | C | 55 | Low | 43.9 | Very low | 111 Ų | 111 | 108 Ų | 108 | 75% | 0.75 | 76% | 0.761 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.8 | -0.9 | 172.1 | 59.5 | 0 | 0 | 0 | 0 | 114.5 | C125 | C125-C127 PolarHBondContact O-N 3.19Å; C125-C127 PolarHBondContact SG-SG 3.31Å |
| 128 | G | 44.8 | Very low | 43.7 | Very low | 63 Ų | 63 | 116.1 Ų | 116.1 | 65% | 0.649 | 77% | 0.771 | S | S | * | * | | | trans | 82.3 | 11.2 | 165 | 0 | 0 | 0 | 0 | 0 | 116.8 | C125 T126 G130 | C125-G128 PolarHBondContact O-N 3.37Å; T126-G128 VanDerWaalsContact C-N 3.32Å; G128-G130 PolarHBondContact O-N 3.02Å |
| 129 | A | 40.2 | Very low | 43.5 | Very low | 68 Ų | 68 | 116.4 Ų | 116.4 | 56% | 0.562 | 77% | 0.773 | S | S | * | * | | | trans | -83.5 | 104.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | | |
| 130 | G | 43.8 | Very low | 42.8 | Very low | 61 Ų | 61 | 114 Ų | 114 | 63% | 0.629 | 77% | 0.77 | S | S | * | * | | | trans | -88.5 | 115.5 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | G128 G132 | G128-G130 PolarHBondContact O-N 3.02Å; G130-G132 PolarHBondContact O-N 3.13Å |
| 131 | V | 44.9 | Very low | 43 | Very low | 138 Ų | 138 | 111.3 Ų | 111.3 | 84% | 0.836 | 77% | 0.768 | S | S | * | * | | | trans | -78 | 99.9 | 174 | -76.5 | 0 | 0 | 0 | 0 | 111.4 | A133 | V131-A133 PolarHBondContact O-N 3.41Š|
| 132 | G | 39.4 | Very low | 42.4 | Very low | 75 Ų | 75 | 111.1 Ų | 111.1 | 77% | 0.773 | 77% | 0.766 | S | S | * | * | | | trans | -74.7 | 117.7 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | G130 S134 | G130-G132 PolarHBondContact O-N 3.13Å; G132-S134 PolarHBondContact O-N 3.11Å |
| 133 | A | 39.4 | Very low | 41.7 | Very low | 101 Ų | 101 | 115 Ų | 115 | 84% | 0.835 | 78% | 0.777 | S | S | * | * | | | trans | -69.1 | 127.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | V131 A135 | V131-A133 PolarHBondContact O-N 3.41Å; A133-A135 PolarHBondContact O-N 3.49Å |
| 134 | S | 38.9 | Very low | 41.1 | Very low | 128 Ų | 128 | 107.5 Ų | 107.5 | 90% | 0.895 | 77% | 0.768 | S | S | * | * | | | trans | -90.7 | 90.1 | -177.1 | 42.8 | 0 | 0 | 0 | 0 | 112.5 | G132 | G132-S134 PolarHBondContact O-N 3.11Š|
| 135 | A | 35.4 | Very low | 41.2 | Very low | 100 Ų | 100 | 108.7 Ų | 108.7 | 83% | 0.826 | 78% | 0.777 | S | S | * | * | | | trans | -105.2 | 142.8 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | A133 | A133-A135 PolarHBondContact O-N 3.49Š|
| 136 | A | 40.9 | Very low | 40.7 | Very low | 112 Ų | 112 | 110.7 Ų | 110.7 | 93% | 0.926 | 80% | 0.799 | S | S | * | * | | | trans | -89.9 | 143.2 | -174 | 0 | 0 | 0 | 0 | 0 | 113.8 | | |
| 137 | G | 30.5 | Very low | 39.5 | Very low | 79 Ų | 79 | 110.2 Ų | 110.2 | 81% | 0.814 | 80% | 0.796 | S | S | * | * | | | trans | -150.4 | 33.8 | -167.7 | 0 | 0 | 0 | 0 | 0 | 118.4 | | |
| 138 | R | 36.9 | Very low | 38.4 | Very low | 240 Ų | 240 | 109.6 Ų | 109.6 | 91% | 0.906 | 80% | 0.799 | S | S | * | * | | | trans | -9.8 | 127.6 | 164.8 | 178.1 | -169.4 | -174.5 | -144.4 | 5.2 | 118.9 | | |
| 139 | S | 33.3 | Very low | 38.2 | Very low | 124 Ų | 124 | 115 Ų | 115 | 87% | 0.867 | 81% | 0.809 | S | S | * | * | | | trans | -169.2 | 157.7 | 137.7 | -85.9 | 0 | 0 | 0 | 0 | 114.3 | | |
| 140 | G | 33.8 | Very low | 38.4 | Very low | 71 Ų | 71 | 116.4 Ų | 116.4 | 73% | 0.732 | 81% | 0.812 | S | S | * | * | | | trans | -136.8 | -151.6 | 170.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | | |
| 141 | P | 49.1 | Very low | 37.9 | Very low | 121 Ų | 121 | 121.9 Ų | 121.9 | 79% | 0.786 | 82% | 0.822 | S | S | * | * | | | cis | -131.4 | -177 | 2.3 | 42.7 | -26.6 | 0 | 0 | 0 | 114.8 | | |
| 142 | G | 32 | Very low | 37.2 | Very low | 72 Ų | 72 | 120.3 Ų | 120.3 | 74% | 0.742 | 81% | 0.813 | S | S | * | * | | | trans | -141.2 | 154.4 | 169.9 | 0 | 0 | 0 | 0 | 0 | 112 | | |
| 143 | H | 34.8 | Very low | 36.9 | Very low | 180 Ų | 180 | 124.7 Ų | 124.7 | 83% | 0.833 | 81% | 0.813 | S | S | * | * | | | trans | -109.5 | 125 | -163.3 | -84.9 | 73.9 | 0 | 0 | 0 | 116.3 | | |
| 144 | A | 39.9 | Very low | 36.8 | Very low | 90 Ų | 90 | 128.1 Ų | 128.1 | 74% | 0.744 | 81% | 0.812 | S | S | * | * | | | trans | 68.4 | 176.2 | 136.6 | 0 | 0 | 0 | 0 | 0 | 118.1 | | |
| 145 | P | 49.5 | Very low | 37.1 | Very low | 127 Ų | 127 | 127.2 Ų | 127.2 | 83% | 0.825 | 80% | 0.803 | S | S | * | * | | | | -134.6 | 169.9 | -100 | 37 | -17.5 | 0 | 0 | 0 | 116.1 | | |
| 146 | A | 33.4 | Very low | 36.8 | Very low | 106 Ų | 106 | 132.5 Ų | 132.5 | 88% | 0.876 | 80% | 0.801 | S | S | * | * | | | trans | -138.5 | 144 | 164.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | | |
| 147 | T | 32.9 | Very low | 36.4 | Very low | 147 Ų | 147 | 137 Ų | 137 | 90% | 0.902 | 79% | 0.794 | S | S | * | * | | | trans | -101.7 | 134.6 | -167.7 | 48.9 | 0 | 0 | 0 | 0 | 114.3 | | |
| 148 | A | 33.2 | Very low | 36.7 | Very low | 99 Ų | 99 | 141.2 Ų | 141.2 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | | | trans | -153.9 | 142.6 | 155.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | | |
| 149 | M | 39.6 | Very low | 37 | Very low | 177 Ų | 177 | 134.8 Ų | 134.8 | 87% | 0.872 | 78% | 0.782 | S | S | * | * | | | trans | -161.1 | 167.6 | 179.6 | -91.5 | -79.5 | 102.6 | 0 | 0 | 106.4 | | |
| 150 | P | 45.8 | Very low | 36.9 | Very low | 96 Ų | 96 | 134.1 Ų | 134.1 | 62% | 0.623 | 78% | 0.778 | S | S | * | * | | | cis | -133.6 | -152 | 8.7 | 27.8 | -1.4 | 0 | 0 | 0 | 113.1 | | |
| 151 | Q | 33.2 | Very low | 37.2 | Very low | 176 Ų | 176 | 139 Ų | 139 | 82% | 0.822 | 78% | 0.784 | S | S | * | * | | | trans | 85.2 | 137.5 | 160 | -62.3 | -178.5 | -6.2 | 0 | 0 | 117.7 | | |
| 152 | T | 30.4 | Very low | 36.9 | Very low | 106 Ų | 106 | 138.8 Ų | 138.8 | 65% | 0.65 | 78% | 0.782 | S | S | * | * | | | cis | -161.3 | 155.2 | -7.5 | -85.9 | 0 | 0 | 0 | 0 | 111.6 | | |
| 153 | E | 31.9 | Very low | 37.1 | Very low | 167 Ų | 167 | 141.4 Ų | 141.4 | 78% | 0.78 | 78% | 0.783 | S | S | * | * | | | trans | 56.5 | 112.6 | 162.2 | -82.1 | -178.3 | 82.1 | 0 | 0 | 125.6 | | |
| 154 | Q | 37.7 | Very low | 37.6 | Very low | 173 Ų | 173 | 137.8 Ų | 137.8 | 81% | 0.808 | 78% | 0.778 | S | S | * | * | | | | 60.3 | 158.7 | 112.2 | -63.3 | -73 | 59 | 0 | 0 | 123.7 | | |
| 155 | P | 44.3 | Very low | 37.6 | Very low | 108 Ų | 108 | 142.2 Ų | 142.2 | 70% | 0.701 | 78% | 0.783 | S | S | * | * | | | trans | -130.1 | 148.8 | -154.8 | 40.1 | -22.4 | 0 | 0 | 0 | 118 | | |
| 156 | R | 30.4 | Very low | 37.2 | Very low | 212 Ų | 212 | 144.9 Ų | 144.9 | 80% | 0.8 | 78% | 0.777 | S | S | * | * | | | trans | -164.5 | 141.2 | 166.9 | -93.8 | -177.8 | 137.7 | 84.3 | -14.2 | 108.2 | | |
| 157 | R | 32.7 | Very low | 38 | Very low | 206 Ų | 206 | 146.5 Ų | 146.5 | 78% | 0.777 | 78% | 0.776 | S | S | * | * | | | cis | -151.4 | 145.6 | -5.8 | -92.2 | -157.3 | 168.9 | -172.9 | -6.9 | 111.3 | | |
| 158 | Q | 36.7 | Very low | 38.6 | Very low | 167 Ų | 167 | 146.4 Ų | 146.4 | 78% | 0.78 | 77% | 0.765 | S | S | * | * | | | trans | -87.5 | 171.5 | 150.6 | -77.3 | -84.3 | 2.5 | 0 | 0 | 108.6 | | |
| 159 | P | 43.3 | Very low | 39.1 | Very low | 106 Ų | 106 | 151.2 Ų | 151.2 | 69% | 0.688 | 76% | 0.762 | S | S | * | * | | | cis | -147.2 | 168.6 | 21.9 | 44.2 | -24.7 | 0 | 0 | 0 | 120 | | |
| 160 | S | 29.9 | Very low | 39 | Very low | 110 Ų | 110 | 152 Ų | 152 | 77% | 0.769 | 76% | 0.76 | S | S | * | * | | | trans | 70 | 151.2 | 139.5 | -67.6 | 0 | 0 | 0 | 0 | 124.1 | | |
| 161 | M | 40.7 | Very low | 39.1 | Very low | 174 Ų | 174 | 156 Ų | 156 | 86% | 0.857 | 78% | 0.775 | S | S | * | * | | | trans | -89.4 | 178.4 | 175.5 | -52.8 | -177.2 | 77 | 0 | 0 | 112.9 | | |
| 162 | P | 41.9 | Very low | 39.4 | Very low | 116 Ų | 116 | 156 Ų | 156 | 75% | 0.753 | 77% | 0.773 | S | S | * | * | | | | -148.8 | 137.3 | 100.4 | 37.1 | -20.2 | 0 | 0 | 0 | 118.3 | | |
| 163 | V | 36.9 | Very low | 39.9 | Very low | 127 Ų | 127 | 156 Ų | 156 | 77% | 0.77 | 78% | 0.777 | S | S | * | * | | | | 47.9 | 115.1 | 128 | -171.5 | 0 | 0 | 0 | 0 | 121.5 | | |
| 164 | S | 44.5 | Very low | 40.1 | Very low | 104 Ų | 104 | 152 Ų | 152 | 73% | 0.727 | 77% | 0.767 | S | S | * | * | | | trans | 60.4 | 117.3 | 144.2 | -164.2 | 0 | 0 | 0 | 0 | 121.2 | | |
| 165 | H | 40.2 | Very low | 40.2 | Very low | 182 Ų | 182 | 151.4 Ų | 151.4 | 84% | 0.843 | 77% | 0.769 | S | S | * | * | | | trans | -139.7 | 91.7 | 145.8 | -151.5 | -100.5 | 0 | 0 | 0 | 113.6 | | |
| 166 | R | 41.3 | Very low | 39.8 | Very low | 184 Ų | 184 | 151.2 Ų | 151.2 | 69% | 0.694 | 77% | 0.77 | S | S | * | * | | | trans | 51.9 | 118.6 | 144.5 | -63.4 | -179.8 | 174.7 | 143.9 | -1.1 | 119.5 | Q168 | R166-Q168 PolarHBondContact O-N 2.96Š|
| 167 | V | 50.5 | Low | 40.1 | Very low | 140 Ų | 140 | 147.5 Ų | 147.5 | 85% | 0.848 | 77% | 0.771 | S | S | * | * | | | trans | -43.9 | 120.5 | 139.7 | -74 | 0 | 0 | 0 | 0 | 111.3 | | |
| 168 | Q | 46.3 | Very low | 40 | Very low | 144 Ų | 144 | 144.8 Ų | 144.8 | 67% | 0.673 | 77% | 0.772 | S | S | * | * | | | trans | 175.2 | 135.1 | 139.5 | -101 | 177.1 | 29.1 | 0 | 0 | 113.6 | R166 | R166-Q168 PolarHBondContact O-N 2.96Š|
| 169 | R | 42.7 | Very low | 40.3 | Very low | 201 Ų | 201 | 142.5 Ų | 142.5 | 76% | 0.758 | 77% | 0.774 | S | S | * | * | | | trans | 57.2 | 100.2 | 146.2 | -63.3 | -177.5 | -76.8 | 167.2 | -6.5 | 117.5 | | |
| 170 | K | 36.8 | Very low | 40 | Very low | 193 Ų | 193 | 143.9 Ų | 143.9 | 84% | 0.839 | 78% | 0.776 | S | S | * | * | | | | -167.2 | 135.1 | 87.4 | -101.6 | 152.1 | -176.4 | 174.1 | 0 | 114 | K172 | K170-K172 PolarHBondContact O-N 3.19Š|
| 171 | L | 48.2 | Very low | 40.9 | Very low | 180 Ų | 180 | 143.9 Ų | 143.9 | 94% | 0.942 | 78% | 0.776 | S | S | * | * | | | trans | -49.8 | 123.2 | 149.7 | -72 | 152.3 | 0 | 0 | 0 | 108.2 | | |
| 172 | K | 39.4 | Very low | 41.2 | Very low | 177 Ų | 177 | 140.2 Ų | 140.2 | 77% | 0.77 | 77% | 0.767 | S | S | * | * | | | trans | -149.5 | 62.7 | 170.4 | -143 | -174.8 | -177.1 | -162.2 | 0 | 111.5 | K170 S174 | K170-K172 PolarHBondContact O-N 3.19Å; K172-S174 PolarHBondContact O-N 3.34Å; K172-S174 PolarHBondContact O-OG 2.96Å |
| 173 | S | 41 | Very low | 41.5 | Very low | 106 Ų | 106 | 145 Ų | 145 | 74% | 0.741 | 77% | 0.77 | S | S | * | * | | | trans | -46.5 | 132.3 | 154.4 | 175.3 | 0 | 0 | 0 | 0 | 108.4 | | |
| 174 | S | 36.7 | Very low | 42 | Very low | 82 Ų | 82 | 150 Ų | 150 | 57% | 0.573 | 78% | 0.775 | S | S | * | * | | | trans | -145.3 | 55.2 | -178 | -69.7 | 0 | 0 | 0 | 0 | 108.8 | K172 S176 | K172-S174 PolarHBondContact O-N 3.34Å; K172-S174 PolarHBondContact O-OG 2.96Å; S174-S176 PolarHBondContact O-N 2.98Å |
| 175 | L | 40.4 | Very low | 42.3 | Very low | 160 Ų | 160 | 151.3 Ų | 151.3 | 84% | 0.838 | 79% | 0.785 | S | S | * | * | | | trans | -61.7 | 83 | 160.8 | -75 | 168.6 | 0 | 0 | 0 | 109.3 | | |
| 176 | S | 36.2 | Very low | 42.8 | Very low | 105 Ų | 105 | 152.6 Ų | 152.6 | 73% | 0.734 | 79% | 0.788 | S | S | * | * | | | trans | -102.2 | 89.6 | 166.2 | 61.7 | 0 | 0 | 0 | 0 | 109 | S174 N178 | S174-S176 PolarHBondContact O-N 2.98Å; S176-N178 PolarHBondContact O-N 3.48Å |
| 177 | V | 35.9 | Very low | 42.7 | Very low | 134 Ų | 134 | 147.2 Ų | 147.2 | 81% | 0.812 | 79% | 0.79 | S | S | * | * | | | trans | -59.6 | 129.3 | 170.7 | -69.4 | 0 | 0 | 0 | 0 | 109.9 | | |
| 178 | N | 29.6 | Very low | 42.4 | Very low | 149 Ų | 149 | 146.7 Ų | 146.7 | 80% | 0.797 | 79% | 0.792 | S | S | * | * | | | trans | -148.9 | 83.5 | 175.2 | -165.4 | 68 | 0 | 0 | 0 | 110.9 | S176 D180 | S176-N178 PolarHBondContact O-N 3.48Å; N178-D180 PolarHBondContact O-N 3Å; N178-D180 VanDerWaalsContact O-N 3.13Å |
| 179 | S | 44.2 | Very low | 42.2 | Very low | 119 Ų | 119 | 145.4 Ų | 145.4 | 83% | 0.832 | 80% | 0.799 | S | S | * | * | | | trans | -77.8 | 90 | -174.2 | -50.1 | 0 | 0 | 0 | 0 | 112.3 | | |
| 180 | D | 36.8 | Very low | 42 | Very low | 135 Ų | 135 | 142.1 Ų | 142.1 | 72% | 0.722 | 80% | 0.802 | S | S | * | * | | | trans | -78.1 | 133.9 | 168.2 | -170.6 | -99.9 | 0 | 0 | 0 | 111.6 | N178 S182 | N178-D180 PolarHBondContact O-N 3Å; N178-D180 VanDerWaalsContact O-N 3.13Å; D180-S182 PolarHBondContact OD1-N 3.39Å |
| 181 | S | 48.7 | Very low | 42.6 | Very low | 109 Ų | 109 | 137.1 Ų | 137.1 | 76% | 0.762 | 81% | 0.805 | S | S | * | * | | | trans | -113.6 | 60.1 | -170.5 | 45.4 | 0 | 0 | 0 | 0 | 112.6 | R183 | S181-R183 PolarHBondContact O-N 3.3Š|
| 182 | S | 47.3 | Very low | 42.3 | Very low | 98 Ų | 98 | 133.4 Ų | 133.4 | 69% | 0.685 | 79% | 0.794 | S | S | * | * | | | trans | -76.6 | 78 | -176.3 | -158.2 | 0 | 0 | 0 | 0 | 115.4 | D180 | D180-S182 PolarHBondContact OD1-N 3.39Š|
| 183 | R | 47.4 | Very low | 42.9 | Very low | 216 Ų | 216 | 134.4 Ų | 134.4 | 82% | 0.815 | 80% | 0.801 | S | S | * | * | | | trans | 49.5 | 102.6 | 134.3 | -59.6 | 174.4 | -177.3 | -87.2 | -7.3 | 119.9 | S181 | S181-R183 PolarHBondContact O-N 3.3Š|
| 184 | R | 47.3 | Very low | 42.9 | Very low | 232 Ų | 232 | 136.1 Ų | 136.1 | 88% | 0.875 | 80% | 0.795 | S | S | * | * | | | trans | 53 | 85.8 | 137.7 | -59 | 176.2 | 75.1 | -144.2 | 10.5 | 118.1 | | |
| 185 | S | 50.8 | Low | 43.4 | Very low | 132 Ų | 132 | 137 Ų | 137 | 92% | 0.923 | 80% | 0.799 | S | S | * | * | | | trans | -99.2 | 120.7 | 147.8 | -71.1 | 0 | 0 | 0 | 0 | 109.7 | | |
| 186 | K | 51.5 | Low | 43.7 | Very low | 208 Ų | 208 | 134 Ų | 134 | 90% | 0.904 | 79% | 0.789 | S | S | * | * | | | trans | -116.8 | 87.7 | -178.8 | -172.5 | -177.1 | -178.6 | -176.8 | 0 | 109.4 | | |
| 187 | G | 38.3 | Very low | 44.4 | Very low | 72 Ų | 72 | 132.9 Ų | 132.9 | 74% | 0.742 | 78% | 0.775 | S | S | * | * | | | trans | -166.4 | 120.1 | -178 | 0 | 0 | 0 | 0 | 0 | 111.7 | | |
| 188 | S | 45.3 | Very low | 45.1 | Very low | 129 Ų | 129 | 131.2 Ų | 131.2 | 90% | 0.902 | 77% | 0.767 | S | S | * | * | | | trans | -64 | 137.7 | 179.7 | 48.6 | 0 | 0 | 0 | 0 | 113.8 | | |
| 189 | S | 41.8 | Very low | 46.2 | Very low | 117 Ų | 117 | 131.7 Ų | 131.7 | 82% | 0.818 | 76% | 0.764 | S | S | * | * | | | trans | -141 | 156.1 | 152.8 | 57.7 | 0 | 0 | 0 | 0 | 110.2 | | |
| 190 | T | 37.8 | Very low | 46.6 | Very low | 132 Ų | 132 | 129.4 Ų | 129.4 | 81% | 0.81 | 74% | 0.742 | S | S | * | * | | | trans | -56.2 | 153.3 | -177.4 | 44.8 | 0 | 0 | 0 | 0 | 113.4 | S192 | T190-S192 PolarHBondContact O-N 2.96Š|
| 191 | G | 49.1 | Very low | 47.5 | Very low | 87 Ų | 87 | 126.3 Ų | 126.3 | 90% | 0.897 | 73% | 0.731 | S | S | * | * | | | trans | -53 | 104 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | | |
| 192 | S | 43.7 | Very low | 47.9 | Very low | 103 Ų | 103 | 123.1 Ų | 123.1 | 72% | 0.72 | 71% | 0.708 | S | S | * | * | | | trans | -93.1 | 115 | 169.8 | 179.7 | 0 | 0 | 0 | 0 | 107.4 | T190 K194 | T190-S192 PolarHBondContact O-N 2.96Å; S192-K194 PolarHBondContact O-N 3.32Å |
| 193 | Q | 51.2 | Low | 48.9 | Very low | 198 Ų | 198 | 122.2 Ų | 122.2 | 93% | 0.925 | 70% | 0.698 | S | S | * | * | | | trans | -66.5 | 87.2 | 157.6 | -78.1 | -176.6 | -23.5 | 0 | 0 | 107 | | |
| 194 | K | 40.4 | Very low | 49.4 | Very low | 141 Ų | 141 | 117.7 Ų | 117.7 | 61% | 0.613 | 69% | 0.686 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 128.5 | 168 | -170.8 | -175 | 176.6 | -170 | 0 | 106.6 | S192 | S192-K194 PolarHBondContact O-N 3.32Š|
| 195 | P | 47.7 | Very low | 50.1 | Low | 100 Ų | 100 | 107 Ų | 107 | 65% | 0.649 | 65% | 0.647 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 139.4 | 170.3 | -25.4 | 34.5 | 0 | 0 | 0 | 109.6 | L197 | P195-L197 PolarHBondContact O-N 3Š|
| 196 | P | 46.9 | Very low | 51 | Low | 98 Ų | 98 | 102.6 Ų | 102.6 | 64% | 0.636 | 61% | 0.613 | S | S | * | * | P | Polyproline II helix | trans | -49.6 | 138.1 | 170.8 | -25.1 | 34.2 | 0 | 0 | 0 | 109.6 | D200 | P196-D200 HydrophobicContact CB-CB 3.9Š|
| 197 | L | 50.1 | Low | 52.1 | Low | 81 Ų | 81 | 97.7 Ų | 97.7 | 42% | 0.424 | 60% | 0.595 | S | S | . | * | P | Polyproline II helix | trans | -70.3 | 158 | 175.3 | -70.1 | 168.9 | 0 | 0 | 0 | 109.2 | P195 E199 D200 C201 | P195-L197 PolarHBondContact O-N 3Å; L197-E199 PolarHBondContact O-N 3.05Å; L197-D200 WeakPolarHBondContact CB-OD2 3.4Å; L197-D200 PolarHBondContact N-OD2 3.14Å; L197-D200 WeakPolarHBondContact O-CB 3.36Å; L197-D200 PolarHBondContact O-N 3.49Å; L197-C201 PolarHBondContact O-N 3.06Å |
| 198 | P | 51.8 | Low | 53.5 | Low | 99 Ų | 99 | 95.9 Ų | 95.9 | 64% | 0.643 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -58.6 | -18.6 | -177.9 | -27.6 | 36.8 | 0 | 0 | 0 | 115.3 | C201 C202 | P198-C201 PolarHBondContact O-SG 3.2Å; P198-C202 PolarHBondContact O-SG 2.91Å |
| 199 | E | 51.5 | Low | 54.4 | Low | 159 Ų | 159 | 92 Ų | 92 | 74% | 0.743 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -80 | -31.6 | 171.2 | -74.4 | 160 | 84.4 | 0 | 0 | 112.6 | L197 C202 V203 | L197-E199 PolarHBondContact O-N 3.05Å; E199-C202 PolarHBondContact O-N 3.4Å; E199-V203 PolarHBondContact O-N 2.95Å |
| 200 | D | 53.2 | Low | 55.8 | Low | 71 Ų | 71 | 89.5 Ų | 89.5 | 38% | 0.38 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -66.9 | -42.7 | -179.7 | -65.6 | -54.8 | 0 | 0 | 0 | 111.4 | P196 L197 C202 V203 H204 | P196-D200 HydrophobicContact CB-CB 3.9Å; L197-D200 WeakPolarHBondContact CB-OD2 3.4Å; L197-D200 PolarHBondContact N-OD2 3.14Å; L197-D200 WeakPolarHBondContact O-CB 3.36Å; L197-D200 PolarHBondContact O-N 3.49Å; D200-C202 VanDerWaalsContact C-N 3.32Å; D200-C202 PolarHBondContact O-N 2.71Å; D200-V203 PolarHBondContact O-N 2.84Å; D200-H204 PolarHBondContact O-N 3.23Å; D200-H204 PolarHBondContact O-ND1 3.29Å |
| 201 | C | 55.4 | Low | 57.1 | Low | 71 Ų | 71 | 89.3 Ų | 89.3 | 48% | 0.48 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.2 | -35.6 | -179.8 | 58.9 | 0 | 0 | 0 | 0 | 112.3 | L197 P198 H204 C205 | L197-C201 PolarHBondContact O-N 3.06Å; P198-C201 PolarHBondContact O-SG 3.2Å; C201-H204 PolarHBondContact O-N 3.3Å; C201-C205 VanDerWaalsContact O-CB 3.31Å; C201-C205 WeakPolarHBondContact O-CB 3.44Å; C201-C205 PolarHBondContact O-N 3.29Å |
| 202 | C | 58.2 | Low | 57.5 | Low | 42 Ų | 42 | 88.9 Ų | 88.9 | 28% | 0.284 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.1 | -48.5 | 174.3 | -61.2 | 0 | 0 | 0 | 0 | 111.2 | P198 E199 D200 C205 I206 C268 | P198-C202 PolarHBondContact O-SG 2.91Å; E199-C202 PolarHBondContact O-N 3.4Å; D200-C202 VanDerWaalsContact C-N 3.32Å; D200-C202 PolarHBondContact O-N 2.71Å; C202-C205 PolarHBondContact O-N 3.09Å; C202-I206 WeakPolarHBondContact O-CD1 3.43Å; C202-I206 VanDerWaalsContact O-CG1 3.27Å; C202-I206 WeakPolarHBondContact O-CG1 3.44Å; C202-I206 PolarHBondContact O-N 2.91Å; C202-C268 VanDerWaalsContact SG-SG 3.65Å |
| 203 | V | 67.6 | Low | 58.4 | Low | 78 Ų | 78 | 87.5 Ų | 87.5 | 47% | 0.473 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -63.9 | -42.6 | 178.8 | 175.1 | 0 | 0 | 0 | 0 | 111.7 | E199 D200 C205 I206 L207 | E199-V203 PolarHBondContact O-N 2.95Å; D200-V203 PolarHBondContact O-N 2.84Å; V203-C205 VanDerWaalsContact C-N 3.35Å; V203-I206 PolarHBondContact O-N 3Å; V203-L207 HydrophobicContact CG1-CD1 3.93Å; V203-L207 HydrophobicContact CG1-CG 4.47Å; V203-L207 WeakPolarHBondContact O-CB 3.44Å; V203-L207 VanDerWaalsContact O-CG 3.27Å; V203-L207 WeakPolarHBondContact O-CG 3.38Å; V203-L207 PolarHBondContact O-N 3.19Å |
| 204 | H | 58.5 | Low | 58.8 | Low | 121 Ų | 121 | 83.9 Ų | 83.9 | 56% | 0.56 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -66.5 | -36.5 | 176.8 | -72 | 78 | 0 | 0 | 0 | 111.9 | D200 C201 L207 A208 | D200-H204 PolarHBondContact O-N 3.23Å; D200-H204 PolarHBondContact O-ND1 3.29Å; C201-H204 PolarHBondContact O-N 3.3Å; H204-L207 PolarHBondContact O-N 3.47Å; H204-A208 VanDerWaalsContact O-CB 3.3Å; H204-A208 WeakPolarHBondContact O-CB 3.42Å; H204-A208 PolarHBondContact O-N 3.26Å |
| 205 | C | 61.8 | Low | 60 | Low | 9 Ų | 9 | 80.6 Ų | 80.6 | 6% | 0.061 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -68 | -44.1 | 175.7 | -160.8 | 0 | 0 | 0 | 0 | 112.1 | C201 C202 V203 L207 A208 C209 I258 C262 | C201-C205 VanDerWaalsContact O-CB 3.31Å; C201-C205 WeakPolarHBondContact O-CB 3.44Å; C201-C205 PolarHBondContact O-N 3.29Å; C202-C205 PolarHBondContact O-N 3.09Å; V203-C205 VanDerWaalsContact C-N 3.35Å; C205-L207 VanDerWaalsContact C-N 3.34Å; C205-L207 PolarHBondContact O-N 3.48Å; C205-A208 PolarHBondContact O-N 3.43Å; C205-C209 WeakPolarHBondContact O-CB 3.3Å; C205-C209 PolarHBondContact O-N 2.9Å; C205-C209 PolarHBondContact O-SG 3.49Å; C205-I258 HydrophobicContact CB-CG2 4.5Å; C205-C262 HydrophobicContact CB-CB 4.36Å; C205-C262 WeakPolarHBondContact CB-SG 3.15Å; C205-C262 WeakPolarHBondContact SG-CB 3.27Å; C205-C262 CovalentContact SG-SG 2.03Å; C205-C262 PolarHBondContact SG-SG 3.22Å |
| 206 | I | 69.8 | Low | 60.6 | Low | 39 Ų | 39 | 79.6 Ų | 79.6 | 20% | 0.2 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -59 | -45.4 | 174.8 | -66.5 | 159.4 | 0 | 0 | 0 | 110.7 | C202 V203 C209 L210 I271 | C202-I206 WeakPolarHBondContact O-CD1 3.43Å; C202-I206 VanDerWaalsContact O-CG1 3.27Å; C202-I206 WeakPolarHBondContact O-CG1 3.44Å; C202-I206 PolarHBondContact O-N 2.91Å; V203-I206 PolarHBondContact O-N 3Å; I206-C209 PolarHBondContact O-N 2.96Å; I206-L210 HydrophobicContact CG2-CD1 3.96Å; I206-L210 WeakPolarHBondContact O-CB 3.31Å; I206-L210 VanDerWaalsContact O-CG 3.3Å; I206-L210 WeakPolarHBondContact O-CG 3.44Å; I206-L210 PolarHBondContact O-N 3.47Å; I206-I271 HydrophobicContact CD1-CG2 3.8Å; I206-I271 HydrophobicContact CG1-CG2 4.3Å |
| 207 | L | 73.8 | Confident | 61.2 | Low | 104 Ų | 104 | 78.3 Ų | 78.3 | 55% | 0.545 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -65.5 | -37.1 | 177.2 | -69.9 | 171.7 | 0 | 0 | 0 | 112.4 | V203 H204 C205 F211 | V203-L207 HydrophobicContact CG1-CD1 3.93Å; V203-L207 HydrophobicContact CG1-CG 4.47Å; V203-L207 WeakPolarHBondContact O-CB 3.44Å; V203-L207 VanDerWaalsContact O-CG 3.27Å; V203-L207 WeakPolarHBondContact O-CG 3.38Å; V203-L207 PolarHBondContact O-N 3.19Å; H204-L207 PolarHBondContact O-N 3.47Å; C205-L207 VanDerWaalsContact C-N 3.34Å; C205-L207 PolarHBondContact O-N 3.48Å; L207-F211 VanDerWaalsContact O-CB 3.26Å; L207-F211 WeakPolarHBondContact O-CB 3.37Å; L207-F211 PolarHBondContact O-N 3Å |
| 208 | A | 67.8 | Low | 61.4 | Low | 34 Ų | 34 | 76.8 Ų | 76.8 | 28% | 0.281 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -65.9 | -46 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | H204 C205 L210 F211 C212 | H204-A208 VanDerWaalsContact O-CB 3.3Å; H204-A208 WeakPolarHBondContact O-CB 3.42Å; H204-A208 PolarHBondContact O-N 3.26Å; C205-A208 PolarHBondContact O-N 3.43Å; A208-L210 PolarHBondContact O-N 3.28Å; A208-F211 PolarHBondContact O-N 3.35Å; A208-C212 WeakPolarHBondContact O-CB 3.31Å; A208-C212 PolarHBondContact O-N 3.44Å; A208-C212 PolarHBondContact O-SG 3.31Å; A208-C212 VanDerWaalsContact O-SG 3.35Å |
| 209 | C | 64.7 | Low | 61.5 | Low | 47 Ų | 47 | 77.2 Ų | 77.2 | 32% | 0.318 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -58.5 | -48.9 | 175.7 | -69.4 | 0 | 0 | 0 | 0 | 111.8 | C205 I206 F211 C212 E213 | C205-C209 WeakPolarHBondContact O-CB 3.3Å; C205-C209 PolarHBondContact O-N 2.9Å; C205-C209 PolarHBondContact O-SG 3.49Å; I206-C209 PolarHBondContact O-N 2.96Å; C209-F211 VanDerWaalsContact C-N 3.29Å; C209-F211 PolarHBondContact O-N 3.5Å; C209-C212 PolarHBondContact O-N 2.03Å; C209-E213 PolarHBondContact O-N 2.93Å |
| 210 | L | 70.6 | Confident | 61.9 | Low | 65 Ų | 65 | 74.7 Ų | 74.7 | 34% | 0.34 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -61.8 | -35.9 | 176.5 | -69.9 | 170.1 | 0 | 0 | 0 | 112.3 | I206 A208 F214 | I206-L210 HydrophobicContact CG2-CD1 3.96Å; I206-L210 WeakPolarHBondContact O-CB 3.31Å; I206-L210 VanDerWaalsContact O-CG 3.3Å; I206-L210 WeakPolarHBondContact O-CG 3.44Å; I206-L210 PolarHBondContact O-N 3.47Å; A208-L210 PolarHBondContact O-N 3.28Å; L210-F214 VanDerWaalsContact O-CB 3.27Å; L210-F214 WeakPolarHBondContact O-CB 3.06Å; L210-F214 PolarHBondContact O-N 2.76Å |
| 211 | F | 64.9 | Low | 62.2 | Low | 129 Ų | 129 | 76.2 Ų | 76.2 | 57% | 0.566 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -71.2 | -39.2 | 175.3 | -172.5 | -106.9 | 0 | 0 | 0 | 112.2 | L207 A208 C209 F214 L215 | L207-F211 VanDerWaalsContact O-CB 3.26Å; L207-F211 WeakPolarHBondContact O-CB 3.37Å; L207-F211 PolarHBondContact O-N 3Å; A208-F211 PolarHBondContact O-N 3.35Å; C209-F211 VanDerWaalsContact C-N 3.29Å; C209-F211 PolarHBondContact O-N 3.5Å; F211-F214 PolarHBondContact O-N 3.49Å; F211-L215 HydrophobicContact CD1-CD1 4.04Å; F211-L215 HydrophobicContact CD1-CD2 4.45Å; F211-L215 HydrophobicContact CD2-CD1 3.94Å; F211-L215 HydrophobicContact CE1-CD1 3.69Å; F211-L215 HydrophobicContact CE1-CD2 3.85Å; F211-L215 HydrophobicContact CE1-CG 4.43Å; F211-L215 HydrophobicContact CE2-CD1 3.58Å; F211-L215 HydrophobicContact CG-CD1 4.16Å; F211-L215 HydrophobicContact CZ-CD1 3.46Å; F211-L215 VanDerWaalsContact CZ-CD1 3.46Å; F211-L215 HydrophobicContact CZ-CD2 4.2Å; F211-L215 HydrophobicContact CZ-CG 4.49Å; F211-L215 WeakPolarHBondContact O-CB 3.27Å; F211-L215 WeakPolarHBondContact O-CD1 3.27Å; F211-L215 PolarHBondContact O-N 3.06Å |
| 212 | C | 57.3 | Low | 62.3 | Low | 77 Ų | 77 | 77.2 Ų | 77.2 | 52% | 0.52 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -65.7 | -42.5 | 173.9 | -73.5 | 0 | 0 | 0 | 0 | 112.2 | A208 C209 L215 T216 | A208-C212 WeakPolarHBondContact O-CB 3.31Å; A208-C212 PolarHBondContact O-N 3.44Å; A208-C212 PolarHBondContact O-SG 3.31Å; A208-C212 VanDerWaalsContact O-SG 3.35Å; C209-C212 PolarHBondContact O-N 2.03Å; C212-L215 PolarHBondContact O-N 3.25Å; C212-T216 VanDerWaalsContact O-CB 3.3Å; C212-T216 WeakPolarHBondContact O-CB 3.01Å; C212-T216 PolarHBondContact O-N 3.29Å; C212-T216 PolarHBondContact O-OG1 2.82Å |
| 213 | E | 63.4 | Low | 62 | Low | 75 Ų | 75 | 76.6 Ų | 76.6 | 35% | 0.35 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -61.9 | -45.3 | 171.9 | -74.9 | -173 | 179.1 | 0 | 0 | 111 | C209 T216 L217 | C209-E213 PolarHBondContact O-N 2.93Å; E213-T216 PolarHBondContact O-N 3.5Å; E213-L217 WeakPolarHBondContact O-CB 3.26Å; E213-L217 VanDerWaalsContact O-CG 3.31Å; E213-L217 WeakPolarHBondContact O-CG 3.48Å; E213-L217 PolarHBondContact O-N 3.19Å |
| 214 | F | 59.7 | Low | 61 | Low | 122 Ų | 122 | 77.8 Ų | 77.8 | 54% | 0.535 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -62.5 | -44.7 | 177 | 179.9 | -104.8 | 0 | 0 | 0 | 112.6 | L210 F211 T216 L217 C218 | L210-F214 VanDerWaalsContact O-CB 3.27Å; L210-F214 WeakPolarHBondContact O-CB 3.06Å; L210-F214 PolarHBondContact O-N 2.76Å; F211-F214 PolarHBondContact O-N 3.49Å; F214-T216 VanDerWaalsContact C-N 3.32Å; F214-T216 PolarHBondContact O-N 2.98Å; F214-L217 PolarHBondContact O-N 3.42Å; F214-C218 VanDerWaalsContact CZ-SG 3.52Å; F214-C218 WeakPolarHBondContact O-CB 3.5Å; F214-C218 PolarHBondContact O-N 2.88Å |
| 215 | L | 65.2 | Low | 60.4 | Low | 71 Ų | 71 | 76.3 Ų | 76.3 | 37% | 0.372 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -64.4 | -36.5 | 174.3 | -98.4 | 65.6 | 0 | 0 | 0 | 111.7 | F211 C212 N219 | F211-L215 HydrophobicContact CD1-CD1 4.04Å; F211-L215 HydrophobicContact CD1-CD2 4.45Å; F211-L215 HydrophobicContact CD2-CD1 3.94Å; F211-L215 HydrophobicContact CE1-CD1 3.69Å; F211-L215 HydrophobicContact CE1-CD2 3.85Å; F211-L215 HydrophobicContact CE1-CG 4.43Å; F211-L215 HydrophobicContact CE2-CD1 3.58Å; F211-L215 HydrophobicContact CG-CD1 4.16Å; F211-L215 HydrophobicContact CZ-CD1 3.46Å; F211-L215 VanDerWaalsContact CZ-CD1 3.46Å; F211-L215 HydrophobicContact CZ-CD2 4.2Å; F211-L215 HydrophobicContact CZ-CG 4.49Å; F211-L215 WeakPolarHBondContact O-CB 3.27Å; F211-L215 WeakPolarHBondContact O-CD1 3.27Å; F211-L215 PolarHBondContact O-N 3.06Å; C212-L215 PolarHBondContact O-N 3.25Å; L215-N219 WeakPolarHBondContact O-CB 3.46Å; L215-N219 PolarHBondContact O-N 3.4Å; L215-N219 PolarHBondContact O-ND2 3.23Å; L215-N219 VanDerWaalsContact O-ND2 3.17Å |
| 216 | T | 60.3 | Low | 59.9 | Low | 79 Ų | 79 | 81 Ų | 81 | 49% | 0.485 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -67 | -44 | 176.3 | -57.4 | 0 | 0 | 0 | 0 | 111.1 | C212 E213 F214 N219 M220 | C212-T216 VanDerWaalsContact O-CB 3.3Å; C212-T216 WeakPolarHBondContact O-CB 3.01Å; C212-T216 PolarHBondContact O-N 3.29Å; C212-T216 PolarHBondContact O-OG1 2.82Å; E213-T216 PolarHBondContact O-N 3.5Å; F214-T216 VanDerWaalsContact C-N 3.32Å; F214-T216 PolarHBondContact O-N 2.98Å; T216-N219 PolarHBondContact O-N 2.98Å; T216-M220 HydrophobicContact CG2-CE 4.47Å; T216-M220 WeakPolarHBondContact O-CG 3.3Å; T216-M220 PolarHBondContact O-N 3.33Å |
| 217 | L | 60.2 | Low | 58.6 | Low | 71 Ų | 71 | 81.8 Ų | 81.8 | 37% | 0.372 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -64.4 | -44.6 | 174.5 | -72.2 | 163.4 | 0 | 0 | 0 | 111.7 | E213 F214 M220 V221 F280 | E213-L217 WeakPolarHBondContact O-CB 3.26Å; E213-L217 VanDerWaalsContact O-CG 3.31Å; E213-L217 WeakPolarHBondContact O-CG 3.48Å; E213-L217 PolarHBondContact O-N 3.19Å; F214-L217 PolarHBondContact O-N 3.42Å; L217-M220 HydrophobicContact CD2-CE 3.86Å; L217-M220 PolarHBondContact O-N 3.39Å; L217-V221 WeakPolarHBondContact O-CG2 3.45Å; L217-V221 PolarHBondContact O-N 2.8Å; L217-F280 HydrophobicContact CD1-CZ 3.91Å |
| 218 | C | 53.3 | Low | 57 | Low | 50 Ų | 50 | 80 Ų | 80 | 34% | 0.338 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -60.8 | -43.9 | 173 | -89.2 | 0 | 0 | 0 | 0 | 111.9 | F214 M220 V221 V222 | F214-C218 VanDerWaalsContact CZ-SG 3.52Å; F214-C218 WeakPolarHBondContact O-CB 3.5Å; F214-C218 PolarHBondContact O-N 2.88Å; C218-M220 PolarHBondContact O-N 3.35Å; C218-V221 PolarHBondContact O-N 3.37Å; C218-V222 VanDerWaalsContact O-CB 3.3Å; C218-V222 WeakPolarHBondContact O-CB 3.43Å; C218-V222 VanDerWaalsContact O-CG2 3.25Å; C218-V222 WeakPolarHBondContact O-CG2 3.42Å; C218-V222 PolarHBondContact O-N 3.49Å |
| 219 | N | 54.4 | Low | 56 | Low | 108 Ų | 108 | 81.8 Ų | 81.8 | 58% | 0.578 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -65.6 | -36.6 | 177 | -75.6 | -27.2 | 0 | 0 | 0 | 111.8 | L215 T216 A223 | L215-N219 WeakPolarHBondContact O-CB 3.46Å; L215-N219 PolarHBondContact O-N 3.4Å; L215-N219 PolarHBondContact O-ND2 3.23Å; L215-N219 VanDerWaalsContact O-ND2 3.17Å; T216-N219 PolarHBondContact O-N 2.98Å; N219-A223 WeakPolarHBondContact O-CB 3.44Å; N219-A223 PolarHBondContact O-N 3.29Å |
| 220 | M | 59.6 | Low | 54.8 | Low | 105 Ų | 105 | 82 Ų | 82 | 52% | 0.517 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -66.6 | -42 | 171.7 | -73.5 | -166.7 | -63.7 | 0 | 0 | 112.4 | T216 L217 C218 A223 Q224 | T216-M220 HydrophobicContact CG2-CE 4.47Å; T216-M220 WeakPolarHBondContact O-CG 3.3Å; T216-M220 PolarHBondContact O-N 3.33Å; L217-M220 HydrophobicContact CD2-CE 3.86Å; L217-M220 PolarHBondContact O-N 3.39Å; C218-M220 PolarHBondContact O-N 3.35Å; M220-A223 PolarHBondContact O-N 3.22Å; M220-Q224 VanDerWaalsContact O-CG 3.27Å; M220-Q224 WeakPolarHBondContact O-CG 3.3Å; M220-Q224 PolarHBondContact O-N 3.38Å |
| 221 | V | 59.2 | Low | 53.4 | Low | 103 Ų | 103 | 83.9 Ų | 83.9 | 62% | 0.624 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -68 | -41.1 | 177.6 | 170.6 | 0 | 0 | 0 | 0 | 111.7 | L217 C218 Q224 A225 | L217-V221 WeakPolarHBondContact O-CG2 3.45Å; L217-V221 PolarHBondContact O-N 2.8Å; C218-V221 PolarHBondContact O-N 3.37Å; V221-Q224 PolarHBondContact O-N 2.95Å; V221-A225 PolarHBondContact O-N 3.19Å; V221-A225 VanDerWaalsContact O-N 3.14Å |
| 222 | V | 58 | Low | 52.4 | Low | 93 Ų | 93 | 83.8 Ų | 83.8 | 56% | 0.564 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -69 | -36.8 | 175 | 171.2 | 0 | 0 | 0 | 0 | 111 | C218 A225 S226 | C218-V222 VanDerWaalsContact O-CB 3.3Å; C218-V222 WeakPolarHBondContact O-CB 3.43Å; C218-V222 VanDerWaalsContact O-CG2 3.25Å; C218-V222 WeakPolarHBondContact O-CG2 3.42Å; C218-V222 PolarHBondContact O-N 3.49Å; V222-A225 PolarHBondContact O-N 2.86Å; V222-S226 VanDerWaalsContact O-CB 3.3Å; V222-S226 WeakPolarHBondContact O-CB 3.27Å; V222-S226 PolarHBondContact O-N 3.35Å |
| 223 | A | 51.7 | Low | 51.9 | Low | 29 Ų | 29 | 88.3 Ų | 88.3 | 24% | 0.24 | 54% | 0.537 | C | S | . | . | H | α-helix | trans | -61.2 | -50.5 | 170.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | N219 M220 A225 S226 C227 | N219-A223 WeakPolarHBondContact O-CB 3.44Å; N219-A223 PolarHBondContact O-N 3.29Å; M220-A223 PolarHBondContact O-N 3.22Å; A223-A225 PolarHBondContact O-N 2.71Å; A223-A225 VanDerWaalsContact O-N 3.08Å; A223-S226 CarbonylContact O-C 3.59Å; A223-S226 PolarHBondContact O-N 2.82Å; A223-C227 PolarHBondContact O-N 2.88Å; A223-C227 PolarHBondContact O-SG 3.49Å |
| 224 | Q | 47.2 | Very low | 51 | Low | 103 Ų | 103 | 89.4 Ų | 89.4 | 48% | 0.481 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -59 | -24.1 | 176.8 | -70.3 | -70.7 | -30.9 | 0 | 0 | 113.6 | M220 V221 | M220-Q224 VanDerWaalsContact O-CG 3.27Å; M220-Q224 WeakPolarHBondContact O-CG 3.3Å; M220-Q224 PolarHBondContact O-N 3.38Å; V221-Q224 PolarHBondContact O-N 2.95Å |
| 225 | A | 46.3 | Very low | 50.1 | Low | 89 Ų | 89 | 87 Ų | 87 | 74% | 0.736 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -84.8 | -17.7 | 172.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | V221 V222 A223 | V221-A225 PolarHBondContact O-N 3.19Å; V221-A225 VanDerWaalsContact O-N 3.14Å; V222-A225 PolarHBondContact O-N 2.86Å; A223-A225 PolarHBondContact O-N 2.71Å; A223-A225 VanDerWaalsContact O-N 3.08Å |
| 226 | S | 50.9 | Low | 48.8 | Very low | 109 Ų | 109 | 87.1 Ų | 87.1 | 76% | 0.762 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -107.5 | -43.4 | -174.5 | -170.6 | 0 | 0 | 0 | 0 | 112.6 | V222 A223 | V222-S226 VanDerWaalsContact O-CB 3.3Å; V222-S226 WeakPolarHBondContact O-CB 3.27Å; V222-S226 PolarHBondContact O-N 3.35Å; A223-S226 CarbonylContact O-C 3.59Å; A223-S226 PolarHBondContact O-N 2.82Å |
| 227 | C | 42.2 | Very low | 48 | Very low | 54 Ų | 54 | 88.2 Ų | 88.2 | 37% | 0.365 | 57% | 0.572 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -108.8 | 99.4 | 164.4 | 51.9 | 0 | 0 | 0 | 0 | 109.4 | A223 A229 | A223-C227 PolarHBondContact O-N 2.88Å; A223-C227 PolarHBondContact O-SG 3.49Å; C227-A229 PolarHBondContact O-N 3.48Å |
| 228 | G | 41.2 | Very low | 47 | Very low | 68 Ų | 68 | 90.3 Ų | 90.3 | 70% | 0.701 | 59% | 0.592 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61 | 117.9 | -173.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | C230 | G228-C230 PolarHBondContact O-N 3.22Š|
| 229 | A | 45.7 | Very low | 46.3 | Very low | 71 Ų | 71 | 93 Ų | 93 | 59% | 0.587 | 61% | 0.61 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 53.4 | 50.2 | 166.6 | 0 | 0 | 0 | 0 | 0 | 115.9 | C227 T231 | C227-A229 PolarHBondContact O-N 3.48Å; A229-T231 PolarHBondContact O-N 3.39Å; A229-T231 VanDerWaalsContact O-N 3.09Å |
| 230 | C | 38.8 | Very low | 45.4 | Very low | 52 Ų | 52 | 92.7 Ų | 92.7 | 35% | 0.351 | 62% | 0.615 | S | S | . | * | | | trans | -63 | 109.9 | 168.2 | -63.9 | 0 | 0 | 0 | 0 | 110.9 | G228 S232 C235 | G228-C230 PolarHBondContact O-N 3.22Å; C230-S232 PolarHBondContact O-N 2.81Å; C230-C235 HydrophobicContact CB-CB 4.13Å |
| 231 | T | 41.3 | Very low | 44.5 | Very low | 103 Ų | 103 | 92.2 Ų | 92.2 | 63% | 0.632 | 63% | 0.628 | S | S | * | * | | | trans | -79.6 | 106 | -177 | 49.5 | 0 | 0 | 0 | 0 | 112.2 | A229 E233 | A229-T231 PolarHBondContact O-N 3.39Å; A229-T231 VanDerWaalsContact O-N 3.09Å; T231-E233 VanDerWaalsContact C-N 3.28Å; T231-E233 PolarHBondContact O-N 2.83Å |
| 232 | S | 45.2 | Very low | 43.6 | Very low | 127 Ų | 127 | 95.3 Ų | 95.3 | 89% | 0.888 | 64% | 0.641 | S | S | * | * | S | Bend | trans | 47.5 | -15.8 | 148 | -154.7 | 0 | 0 | 0 | 0 | 123.6 | C230 | C230-S232 PolarHBondContact O-N 2.81Š|
| 233 | E | 47.3 | Very low | 43 | Very low | 172 Ų | 172 | 96.7 Ų | 96.7 | 80% | 0.804 | 65% | 0.645 | S | S | * | * | S | Bend | trans | -129.2 | -6.5 | -165.7 | 67 | -147.5 | 115.2 | 0 | 0 | 115.5 | T231 | T231-E233 VanDerWaalsContact C-N 3.28Å; T231-E233 PolarHBondContact O-N 2.83Å |
| 234 | A | 42.7 | Very low | 42.9 | Very low | 99 Ų | 99 | 103.5 Ų | 103.5 | 82% | 0.818 | 67% | 0.674 | S | S | * | * | S | Bend | trans | -143.8 | 19.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | | |
| 235 | C | 40.9 | Very low | 42.8 | Very low | 72 Ų | 72 | 102 Ų | 102 | 49% | 0.486 | 69% | 0.686 | S | S | . | * | | | trans | -112 | 94.9 | 177.9 | -166 | 0 | 0 | 0 | 0 | 110.6 | C230 | C230-C235 HydrophobicContact CB-CB 4.13Š|
| 236 | C | 37.9 | Very low | 43 | Very low | 73 Ų | 73 | 105.8 Ų | 105.8 | 49% | 0.493 | 69% | 0.694 | S | S | . | * | | | trans | -131.6 | 93.1 | 171.7 | -173.3 | 0 | 0 | 0 | 0 | 108.7 | C240 | C236-C240 PolarHBondContact O-SG 3.49Š|
| 237 | C | 43.2 | Very low | 42.8 | Very low | 101 Ų | 101 | 106.7 Ų | 106.7 | 68% | 0.682 | 69% | 0.69 | S | S | * | * | | | trans | -70.5 | 148.1 | 169.4 | -69.8 | 0 | 0 | 0 | 0 | 110.2 | C239 | C237-C239 VanDerWaalsContact C-N 3.3Å; C237-C239 PolarHBondContact O-N 2.86Å; C237-C239 VanDerWaalsContact O-N 3.11Å |
| 238 | C | 39.6 | Very low | 43.1 | Very low | 115 Ų | 115 | 109.6 Ų | 109.6 | 78% | 0.777 | 71% | 0.71 | S | S | * | * | S | Bend | trans | 70.4 | -14.3 | 169.2 | -51.5 | 0 | 0 | 0 | 0 | 119.1 | | |
| 239 | C | 40 | Very low | 43.3 | Very low | 108 Ų | 108 | 113 Ų | 113 | 73% | 0.73 | 71% | 0.712 | S | S | * | * | | | trans | -132.3 | 17.5 | -177.2 | -65.3 | 0 | 0 | 0 | 0 | 116.1 | C237 | C237-C239 VanDerWaalsContact C-N 3.3Å; C237-C239 PolarHBondContact O-N 2.86Å; C237-C239 VanDerWaalsContact O-N 3.11Å |
| 240 | C | 35 | Very low | 43.4 | Very low | 101 Ų | 101 | 112.6 Ų | 112.6 | 68% | 0.682 | 71% | 0.705 | S | S | * | * | | | trans | -62.4 | 137.1 | 172.5 | -78.4 | 0 | 0 | 0 | 0 | 111.2 | C236 | C236-C240 PolarHBondContact O-SG 3.49Š|
| 241 | A | 39.3 | Very low | 43.8 | Very low | 94 Ų | 94 | 116.6 Ų | 116.6 | 78% | 0.777 | 73% | 0.73 | S | S | * | * | | | trans | -69.2 | 130.8 | -166.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | D243 | A241-D243 PolarHBondContact O-N 3.3Š|
| 242 | D | 41.8 | Very low | 43.8 | Very low | 169 Ų | 169 | 115.8 Ų | 115.8 | 90% | 0.904 | 73% | 0.727 | S | S | * | * | S | Bend | trans | 21.6 | 62.8 | 132.3 | -140.6 | -78.1 | 0 | 0 | 0 | 117.4 | | |
| 243 | D | 44.9 | Very low | 43.7 | Very low | 122 Ų | 122 | 116.6 Ų | 116.6 | 65% | 0.652 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -157.6 | 131.3 | 139.5 | -141.5 | 174.5 | 0 | 0 | 0 | 111.6 | A241 | A241-D243 PolarHBondContact O-N 3.3Š|
| 244 | M | 49.3 | Very low | 43.8 | Very low | 171 Ų | 171 | 116.6 Ų | 116.6 | 84% | 0.842 | 72% | 0.724 | S | S | * | * | S | Bend | trans | 51.5 | 92.2 | 167.2 | -56.6 | 139.7 | -167.6 | 0 | 0 | 119 | | |
| 245 | G | 45.1 | Very low | 43.9 | Very low | 72 Ų | 72 | 116.6 Ų | 116.6 | 74% | 0.742 | 71% | 0.71 | S | S | * | * | | | trans | 171.7 | 104.8 | 160 | 0 | 0 | 0 | 0 | 0 | 115.8 | | |
| 246 | D | 50.7 | Low | 44.2 | Very low | 169 Ų | 169 | 118.1 Ų | 118.1 | 90% | 0.904 | 72% | 0.72 | S | S | * | * | | | trans | -75.9 | 165.7 | 169.2 | -154.8 | 155.5 | 0 | 0 | 0 | 111.1 | | |
| 247 | D | 47.1 | Very low | 44.6 | Very low | 127 Ų | 127 | 117.1 Ų | 117.1 | 68% | 0.679 | 72% | 0.723 | S | S | * | * | | | trans | 64.2 | 43.1 | 176.5 | -156.8 | 35.4 | 0 | 0 | 0 | 117.5 | N249 | D247-N249 PolarHBondContact O-N 3.35Š|
| 248 | C | 47.1 | Very low | 44.9 | Very low | 115 Ų | 115 | 115.3 Ų | 115.3 | 78% | 0.777 | 71% | 0.706 | S | S | * | * | | | trans | -74.6 | 72 | 152.4 | -86 | 0 | 0 | 0 | 0 | 111 | C250 | C248-C250 PolarHBondContact O-N 2.89Å; C248-C250 PolarHBondContact O-SG 3.28Å |
| 249 | N | 47.1 | Very low | 45.5 | Very low | 139 Ų | 139 | 116.3 Ų | 116.3 | 74% | 0.743 | 70% | 0.7 | S | S | * | * | | | trans | -71.3 | 63.3 | 172.3 | -164.7 | -19.7 | 0 | 0 | 0 | 111.5 | D247 | D247-N249 PolarHBondContact O-N 3.35Š|
| 250 | C | 46.5 | Very low | 45.8 | Very low | 64 Ų | 64 | 117.8 Ų | 117.8 | 43% | 0.432 | 70% | 0.701 | S | S | . | * | | | trans | -82.1 | 134.6 | 170.5 | 57.3 | 0 | 0 | 0 | 0 | 109 | C248 C252 | C248-C250 PolarHBondContact O-N 2.89Å; C248-C250 PolarHBondContact O-SG 3.28Å; C250-C252 HydrophobicContact CB-CB 4.49Å; C250-C252 PolarHBondContact O-N 3.42Å |
| 251 | P | 47.3 | Very low | 46.3 | Very low | 135 Ų | 135 | 116.6 Ų | 116.6 | 88% | 0.877 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.7 | 43 | 178 | 33.6 | -36.8 | 0 | 0 | 0 | 111.9 | | |
| 252 | C | 42.4 | Very low | 46.7 | Very low | 86 Ų | 86 | 113.2 Ų | 113.2 | 58% | 0.581 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.2 | -6.9 | 177.4 | -60.6 | 0 | 0 | 0 | 0 | 112.2 | C250 M254 | C250-C252 HydrophobicContact CB-CB 4.49Å; C250-C252 PolarHBondContact O-N 3.42Å; C252-M254 PolarHBondContact O-N 2.89Å; C252-M254 VanDerWaalsContact O-N 3.09Å |
| 253 | D | 42.9 | Very low | 47 | Very low | 144 Ų | 144 | 109 Ų | 109 | 77% | 0.77 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.1 | 81.7 | 178.3 | -167.1 | 0.5 | 0 | 0 | 0 | 111.3 | | |
| 254 | M | 48 | Very low | 47.1 | Very low | 173 Ų | 173 | 112 Ų | 112 | 85% | 0.852 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -148.6 | -33.4 | 157.6 | -93 | -60.5 | 104.2 | 0 | 0 | 113.4 | C252 | C252-M254 PolarHBondContact O-N 2.89Å; C252-M254 VanDerWaalsContact O-N 3.09Å |
| 255 | D | 45.3 | Very low | 47 | Very low | 98 Ų | 98 | 106.9 Ų | 106.9 | 52% | 0.524 | 64% | 0.643 | S | S | . | * | | | trans | -149.6 | 40.5 | -169 | -132 | -32 | 0 | 0 | 0 | 118.2 | G257 I258 | D255-G257 PolarHBondContact O-N 3.14Å; D255-I258 WeakPolarHBondContact OD1-CB 3.41Å; D255-I258 WeakPolarHBondContact OD1-CD1 3.4Å; D255-I258 WeakPolarHBondContact OD1-CG1 3.32Å; D255-I258 PolarHBondContact OD1-N 3.17Å; D255-I258 VanDerWaalsContact OD2-CD1 3.32Å; D255-I258 WeakPolarHBondContact OD2-CD1 3.34Å |
| 256 | C | 47.4 | Very low | 47.5 | Very low | 104 Ų | 104 | 107.9 Ų | 107.9 | 70% | 0.703 | 64% | 0.638 | S | S | * | * | S | Bend | trans | -69.9 | -9.6 | 162.5 | -152.6 | 0 | 0 | 0 | 0 | 112.2 | | |
| 257 | G | 46.3 | Very low | 47.6 | Very low | 53 Ų | 53 | 105.6 Ų | 105.6 | 55% | 0.546 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -76.4 | -32.3 | -179.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | D255 M259 D260 | D255-G257 PolarHBondContact O-N 3.14Å; G257-M259 VanDerWaalsContact C-N 3.27Å; G257-M259 PolarHBondContact O-N 3.43Å; G257-D260 PolarHBondContact O-N 3.44Å |
| 258 | I | 50.2 | Low | 48 | Very low | 63 Ų | 63 | 100.7 Ų | 100.7 | 32% | 0.323 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -63.1 | -32.4 | 176 | -84.7 | 175.4 | 0 | 0 | 0 | 112.3 | C205 D255 D260 A261 C262 | C205-I258 HydrophobicContact CB-CG2 4.5Å; D255-I258 WeakPolarHBondContact OD1-CB 3.41Å; D255-I258 WeakPolarHBondContact OD1-CD1 3.4Å; D255-I258 WeakPolarHBondContact OD1-CG1 3.32Å; D255-I258 PolarHBondContact OD1-N 3.17Å; D255-I258 VanDerWaalsContact OD2-CD1 3.32Å; D255-I258 WeakPolarHBondContact OD2-CD1 3.34Å; I258-D260 VanDerWaalsContact C-N 3.32Å; I258-D260 PolarHBondContact O-N 3.41Å; I258-A261 PolarHBondContact O-N 2.85Å; I258-C262 PolarHBondContact O-N 3.23Å; I258-C262 PolarHBondContact O-SG 3.32Å |
| 259 | M | 51.1 | Low | 48.5 | Very low | 135 Ų | 135 | 99 Ų | 99 | 67% | 0.665 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -60 | -38.2 | 178.7 | -83.9 | -179.1 | 56.6 | 0 | 0 | 113.4 | G257 C262 C263 | G257-M259 VanDerWaalsContact C-N 3.27Å; G257-M259 PolarHBondContact O-N 3.43Å; M259-C262 PolarHBondContact O-N 3.37Å; M259-C263 WeakPolarHBondContact O-CB 3.32Å; M259-C263 PolarHBondContact O-N 3.17Å |
| 260 | D | 47 | Very low | 49.4 | Very low | 139 Ų | 139 | 98.7 Ų | 98.7 | 74% | 0.743 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -66.2 | -43.4 | -178.9 | -158.5 | 59 | 0 | 0 | 0 | 110.7 | G257 I258 C263 | G257-D260 PolarHBondContact O-N 3.44Å; I258-D260 VanDerWaalsContact C-N 3.32Å; I258-D260 PolarHBondContact O-N 3.41Å; D260-C263 WeakPolarHBondContact O-CB 3.43Å; D260-C263 PolarHBondContact O-N 2.79Å |
| 261 | A | 46.5 | Very low | 50.2 | Low | 77 Ų | 77 | 99 Ų | 99 | 64% | 0.636 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -68.9 | -35.8 | 178 | 0 | 0 | 0 | 0 | 0 | 113.5 | I258 C263 | I258-A261 PolarHBondContact O-N 2.85Å; A261-C263 VanDerWaalsContact C-N 3.26Å; A261-C263 PolarHBondContact O-N 3.44Å |
| 262 | C | 46.8 | Very low | 50.9 | Low | 22 Ų | 22 | 93.6 Ų | 93.6 | 15% | 0.149 | 54% | 0.54 | C | S | . | . | H | α-helix | trans | -73.2 | -18 | 176.3 | -58.3 | 0 | 0 | 0 | 0 | 113.1 | C205 I258 M259 | C205-C262 HydrophobicContact CB-CB 4.36Å; C205-C262 WeakPolarHBondContact CB-SG 3.15Å; C205-C262 WeakPolarHBondContact SG-CB 3.27Å; C205-C262 CovalentContact SG-SG 2.03Å; C205-C262 PolarHBondContact SG-SG 3.22Å; I258-C262 PolarHBondContact O-N 3.23Å; I258-C262 PolarHBondContact O-SG 3.32Å; M259-C262 PolarHBondContact O-N 3.37Å |
| 263 | C | 47.9 | Very low | 51.8 | Low | 80 Ų | 80 | 96 Ų | 96 | 54% | 0.541 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -77 | -26.9 | -177.7 | -160.6 | 0 | 0 | 0 | 0 | 113.4 | M259 D260 A261 S265 | M259-C263 WeakPolarHBondContact O-CB 3.32Å; M259-C263 PolarHBondContact O-N 3.17Å; D260-C263 WeakPolarHBondContact O-CB 3.43Å; D260-C263 PolarHBondContact O-N 2.79Å; A261-C263 VanDerWaalsContact C-N 3.26Å; A261-C263 PolarHBondContact O-N 3.44Å; C263-S265 PolarHBondContact O-N 2.79Å |
| 264 | E | 47.2 | Very low | 52.6 | Low | 187 Ų | 187 | 95 Ų | 95 | 87% | 0.874 | 54% | 0.535 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.3 | -17 | 179.2 | -169.8 | 163.5 | 76 | 0 | 0 | 113.1 | | |
| 265 | S | 46.3 | Very low | 52.8 | Low | 62 Ų | 62 | 88.7 Ų | 88.7 | 43% | 0.434 | 51% | 0.508 | S | S | . | . | | | trans | -110.4 | 94.3 | 176.7 | -66.2 | 0 | 0 | 0 | 0 | 111.6 | C263 D267 C268 | C263-S265 PolarHBondContact O-N 2.79Å; S265-D267 PolarHBondContact O-N 3.11Å; S265-D267 VanDerWaalsContact O-N 3.11Å; S265-C268 WeakPolarHBondContact O-CB 3.34Å; S265-C268 PolarHBondContact O-N 3.05Å |
| 266 | S | 56.4 | Low | 53.1 | Low | 93 Ų | 93 | 85.9 Ų | 85.9 | 65% | 0.65 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -55.3 | -31.3 | -180 | 59.4 | 0 | 0 | 0 | 0 | 114.1 | C268 L269 E270 | S266-C268 PolarHBondContact O-N 3.27Å; S266-L269 PolarHBondContact O-N 3.32Å; S266-E270 PolarHBondContact O-N 2.75Å |
| 267 | D | 53.6 | Low | 53.4 | Low | 122 Ų | 122 | 83.6 Ų | 83.6 | 65% | 0.652 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -55.6 | -37.8 | 175.2 | -140.9 | -95.2 | 0 | 0 | 0 | 111.8 | S265 E270 I271 | S265-D267 PolarHBondContact O-N 3.11Å; S265-D267 VanDerWaalsContact O-N 3.11Å; D267-E270 PolarHBondContact O-N 2.84Å; D267-I271 PolarHBondContact O-N 2.8Å |
| 268 | C | 54.8 | Low | 53.8 | Low | 23 Ų | 23 | 86.9 Ų | 86.9 | 16% | 0.155 | 49% | 0.493 | C | S | . | . | H | α-helix | trans | -71.5 | -38.2 | 178.6 | -58.9 | 0 | 0 | 0 | 0 | 112.3 | C202 S265 S266 C272 | C202-C268 VanDerWaalsContact SG-SG 3.65Å; S265-C268 WeakPolarHBondContact O-CB 3.34Å; S265-C268 PolarHBondContact O-N 3.05Å; S266-C268 PolarHBondContact O-N 3.27Å; C268-C272 WeakPolarHBondContact O-CB 3.2Å; C268-C272 PolarHBondContact O-N 2.9Å; C268-C272 PolarHBondContact O-SG 3.08Å |
| 269 | L | 58.3 | Low | 53.4 | Low | 81 Ų | 81 | 87.5 Ų | 87.5 | 42% | 0.424 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -72 | -34.3 | 176 | -63.8 | 177.9 | 0 | 0 | 0 | 111.5 | S266 M273 | S266-L269 PolarHBondContact O-N 3.32Å; L269-M273 WeakPolarHBondContact O-CG 3.25Å; L269-M273 PolarHBondContact O-N 3.19Å |
| 270 | E | 64.6 | Low | 52.8 | Low | 132 Ų | 132 | 86.9 Ų | 86.9 | 62% | 0.617 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -64.1 | -46.8 | 173.1 | -169 | 165.2 | -178.3 | 0 | 0 | 111.2 | S266 D267 C272 M273 E274 | S266-E270 PolarHBondContact O-N 2.75Å; D267-E270 PolarHBondContact O-N 2.84Å; E270-C272 PolarHBondContact O-N 2.98Å; E270-M273 PolarHBondContact O-N 2.91Å; E270-E274 PolarHBondContact O-N 2.87Å |
| 271 | I | 63.3 | Low | 52.5 | Low | 70 Ų | 70 | 85.3 Ų | 85.3 | 36% | 0.359 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -66.9 | -36.1 | 177.5 | -137.8 | 72.9 | 0 | 0 | 0 | 112.6 | I206 D267 E274 C275 | I206-I271 HydrophobicContact CD1-CG2 3.8Å; I206-I271 HydrophobicContact CG1-CG2 4.3Å; D267-I271 PolarHBondContact O-N 2.8Å; I271-E274 PolarHBondContact O-N 3.39Å; I271-C275 PolarHBondContact O-N 3.43Å; I271-C275 PolarHBondContact O-SG 2.86Å |
| 272 | C | 61.7 | Low | 52.3 | Low | 21 Ų | 21 | 91.7 Ų | 91.7 | 14% | 0.142 | 53% | 0.525 | C | S | . | . | H | α-helix | trans | -62 | -47.3 | 173.5 | -77.7 | 0 | 0 | 0 | 0 | 111.4 | C268 E270 E274 C275 C276 | C268-C272 WeakPolarHBondContact O-CB 3.2Å; C268-C272 PolarHBondContact O-N 2.9Å; C268-C272 PolarHBondContact O-SG 3.08Å; E270-C272 PolarHBondContact O-N 2.98Å; C272-E274 VanDerWaalsContact C-N 3.33Å; C272-E274 PolarHBondContact O-N 3.43Å; C272-C275 WeakPolarHBondContact O-CB 3.3Å; C272-C275 PolarHBondContact O-N 2.92Å; C272-C275 VanDerWaalsContact O-N 3.14Å; C272-C276 PolarHBondContact O-N 3.09Å; C272-C276 PolarHBondContact O-SG 3.3Å |
| 273 | M | 62.5 | Low | 52.5 | Low | 137 Ų | 137 | 95.2 Ų | 95.2 | 68% | 0.675 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -64.4 | -34.8 | 177.4 | -72.2 | -170.7 | -64.3 | 0 | 0 | 112.9 | L269 E270 C276 G277 | L269-M273 WeakPolarHBondContact O-CG 3.25Å; L269-M273 PolarHBondContact O-N 3.19Å; E270-M273 PolarHBondContact O-N 2.91Å; M273-C276 PolarHBondContact O-N 2.8Å; M273-G277 PolarHBondContact O-N 3.45Å |
| 274 | E | 59.1 | Low | 52.8 | Low | 124 Ų | 124 | 96 Ų | 96 | 58% | 0.579 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -63.3 | -43 | 171.3 | -171.4 | 172.8 | -169.5 | 0 | 0 | 111.1 | E270 I271 C272 G277 I278 | E270-E274 PolarHBondContact O-N 2.87Å; I271-E274 PolarHBondContact O-N 3.39Å; C272-E274 VanDerWaalsContact C-N 3.33Å; C272-E274 PolarHBondContact O-N 3.43Å; E274-G277 PolarHBondContact O-N 3.38Å; E274-I278 HydrophobicContact CG-CD1 4.24Å; E274-I278 WeakPolarHBondContact O-CG1 3.09Å; E274-I278 PolarHBondContact O-N 2.93Å |
| 275 | C | 53 | Low | 53.1 | Low | 40 Ų | 40 | 90.9 Ų | 90.9 | 27% | 0.27 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.1 | -43.9 | 174.6 | -69.9 | 0 | 0 | 0 | 0 | 113 | I271 C272 G277 I278 C279 | I271-C275 PolarHBondContact O-N 3.43Å; I271-C275 PolarHBondContact O-SG 2.86Å; C272-C275 WeakPolarHBondContact O-CB 3.3Å; C272-C275 PolarHBondContact O-N 2.92Å; C272-C275 VanDerWaalsContact O-N 3.14Å; C275-G277 VanDerWaalsContact C-N 3.26Å; C275-G277 PolarHBondContact O-N 3.01Å; C275-I278 PolarHBondContact O-N 3.19Å; C275-C279 PolarHBondContact O-N 3.05Å |
| 276 | C | 51.9 | Low | 53.5 | Low | 39 Ų | 39 | 92.6 Ų | 92.6 | 26% | 0.264 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -56.3 | -41.3 | 175.5 | -62 | 0 | 0 | 0 | 0 | 111.5 | C272 M273 I278 C279 F280 | C272-C276 PolarHBondContact O-N 3.09Å; C272-C276 PolarHBondContact O-SG 3.3Å; M273-C276 PolarHBondContact O-N 2.8Å; C276-I278 VanDerWaalsContact C-N 3.28Å; C276-I278 PolarHBondContact O-N 3.22Å; C276-C279 PolarHBondContact O-N 2.77Å; C276-F280 PolarHBondContact O-N 3Å |
| 277 | G | 52 | Low | 53.3 | Low | 56 Ų | 56 | 92.6 Ų | 92.6 | 58% | 0.577 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -69.2 | -18.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | M273 E274 C275 | M273-G277 PolarHBondContact O-N 3.45Å; E274-G277 PolarHBondContact O-N 3.38Å; C275-G277 VanDerWaalsContact C-N 3.26Å; C275-G277 PolarHBondContact O-N 3.01Å |
| 278 | I | 55.3 | Low | 53.3 | Low | 121 Ų | 121 | 90.7 Ų | 90.7 | 62% | 0.621 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -90.9 | -35.2 | 174.7 | -65 | 164.5 | 0 | 0 | 0 | 111 | E274 C275 C276 | E274-I278 HydrophobicContact CG-CD1 4.24Å; E274-I278 WeakPolarHBondContact O-CG1 3.09Å; E274-I278 PolarHBondContact O-N 2.93Å; C275-I278 PolarHBondContact O-N 3.19Å; C276-I278 VanDerWaalsContact C-N 3.28Å; C276-I278 PolarHBondContact O-N 3.22Å |
| 279 | C | 43.2 | Very low | 53.2 | Low | 76 Ų | 76 | 95.5 Ų | 95.5 | 51% | 0.514 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -76.9 | -26.1 | 178.8 | -70.3 | 0 | 0 | 0 | 0 | 113.6 | C275 C276 P281 | C275-C279 PolarHBondContact O-N 3.05Å; C276-C279 PolarHBondContact O-N 2.77Å; C279-P281 VanDerWaalsContact C-CD 3.45Å; C279-P281 WeakPolarHBondContact O-CD 3.3Å |
| 280 | F | 36.8 | Very low | 52.8 | Low | 122 Ų | 122 | 96.6 Ų | 96.6 | 54% | 0.535 | 55% | 0.549 | S | S | . | . | | | trans | -119.2 | 73.7 | 176.2 | -67.2 | -77.5 | 0 | 0 | 0 | 112.8 | L217 C276 | L217-F280 HydrophobicContact CD1-CZ 3.91Å; C276-F280 PolarHBondContact O-N 3Å |
| 281 | P | 40.7 | Very low | 51.8 | Low | 106 Ų | 106 | 93.7 Ų | 93.7 | 69% | 0.688 | 54% | 0.544 | S | S | * | . | | | trans | -66.9 | 135.3 | 164.7 | 30.3 | -33.5 | 0 | 0 | 0 | 110.3 | C279 | C279-P281 VanDerWaalsContact C-CD 3.45Å; C279-P281 WeakPolarHBondContact O-CD 3.3Å |
| 282 | T | 42.4 | Very low | 50.8 | Low | 212 Ų | 212 | 95.8 Ų | 95.8 | 100% | 1.301 | 56% | 0.56 | S | S | * | * | | | trans | -69.4 | 0 | -179.6 | 58.2 | 0 | 0 | 0 | 0 | 114 | | |