| 1 | M | 47.4 | Very low | 51.3 | Low | 241 Ų | 241 | 152.1 Ų | 152.1 | 100% | 1.187 | 80% | 0.803 | S | S | * | * | | | | 0 | 129.5 | 0 | -76.6 | 175.1 | 172.5 | 0 | 0 | 107 | | |
| 2 | A | 44.4 | Very low | 50.2 | Low | 97 Ų | 97 | 150.3 Ų | 150.3 | 80% | 0.802 | 81% | 0.813 | S | S | * | * | | | trans | 70.5 | 101.2 | 180 | 0 | 0 | 0 | 0 | 0 | 113.9 | | |
| 3 | D | 46.2 | Very low | 49.6 | Very low | 128 Ų | 128 | 145.2 Ų | 145.2 | 68% | 0.684 | 80% | 0.795 | S | S | * | * | | | cis | 62.2 | 98.1 | 31.2 | -95.2 | -6.4 | 0 | 0 | 0 | 112.9 | | |
| 4 | H | 63.9 | Low | 48.7 | Very low | 144 Ų | 144 | 145.1 Ų | 145.1 | 67% | 0.667 | 80% | 0.801 | S | S | * | * | | | trans | 91.8 | 145.8 | 135.3 | -48.6 | -48.1 | 0 | 0 | 0 | 122.7 | | |
| 5 | L | 54.5 | Low | 47.8 | Very low | 155 Ų | 155 | 139.9 Ų | 139.9 | 81% | 0.812 | 79% | 0.794 | S | S | * | * | | | trans | 85.5 | 105.8 | 152 | -66.4 | 124.3 | 0 | 0 | 0 | 118 | | |
| 6 | M | 55.7 | Low | 47.4 | Very low | 176 Ų | 176 | 136.7 Ų | 136.7 | 87% | 0.867 | 80% | 0.801 | S | S | * | * | | | | -169.2 | 102.8 | 109.5 | -93.4 | 162.4 | -148.4 | 0 | 0 | 112.3 | | |
| 7 | M | 55.3 | Low | 46.7 | Very low | 176 Ų | 176 | 132.9 Ų | 132.9 | 87% | 0.867 | 80% | 0.797 | S | S | * | * | | | trans | 67.5 | 114.8 | 137.3 | -65.6 | 163.4 | 156.2 | 0 | 0 | 121.6 | | |
| 8 | P | 59.8 | Low | 47 | Very low | 118 Ų | 118 | 134.7 Ų | 134.7 | 77% | 0.766 | 80% | 0.801 | S | S | * | * | | | trans | -91.8 | 132.2 | 152.5 | 34.1 | -24 | 0 | 0 | 0 | 110.2 | | |
| 9 | M | 51.6 | Low | 46.6 | Very low | 158 Ų | 158 | 137.9 Ų | 137.9 | 78% | 0.778 | 81% | 0.807 | S | S | * | * | | | trans | -171.4 | 113.4 | 156.5 | -135 | 87 | -169.9 | 0 | 0 | 112.9 | H11 | M9-H11 WeakPolarHBondContact CE-CD2 3.31Å; M9-H11 VanDerWaalsContact CE-NE2 3.31Å; M9-H11 WeakPolarHBondContact CE-NE2 3.32Å |
| 10 | N | 40 | Very low | 46.2 | Very low | 156 Ų | 156 | 133.8 Ų | 133.8 | 83% | 0.834 | 80% | 0.795 | S | S | * | * | | | | -160.3 | 91 | 124.5 | -154.4 | 1.7 | 0 | 0 | 0 | 107.3 | | |
| 11 | H | 45.2 | Very low | 46.3 | Very low | 124 Ų | 124 | 139.2 Ų | 139.2 | 57% | 0.574 | 80% | 0.803 | S | S | * | * | | | | 50.6 | 91 | 97.6 | -100.4 | -88.6 | 0 | 0 | 0 | 114.6 | M9 | M9-H11 WeakPolarHBondContact CE-CD2 3.31Å; M9-H11 VanDerWaalsContact CE-NE2 3.31Å; M9-H11 WeakPolarHBondContact CE-NE2 3.32Å |
| 12 | S | 38.3 | Very low | 46.4 | Very low | 131 Ų | 131 | 138.9 Ų | 138.9 | 92% | 0.916 | 79% | 0.789 | S | S | * | * | | | | -127.5 | 83.4 | 127.8 | -165.2 | 0 | 0 | 0 | 0 | 107.4 | | |
| 13 | S | 42.3 | Very low | 46.8 | Very low | 83 Ų | 83 | 143.5 Ų | 143.5 | 58% | 0.58 | 80% | 0.796 | S | S | * | * | | | trans | -92.2 | 123.7 | 161.3 | 166.2 | 0 | 0 | 0 | 0 | 105.9 | | |
| 14 | V | 37.2 | Very low | 46.9 | Very low | 145 Ų | 145 | 140.7 Ų | 140.7 | 88% | 0.879 | 80% | 0.797 | S | S | * | * | | | | -153.4 | 120 | 119.2 | -169.1 | 0 | 0 | 0 | 0 | 109.2 | | |
| 15 | G | 35.6 | Very low | 46.3 | Very low | 67 Ų | 67 | 142.8 Ų | 142.8 | 69% | 0.691 | 81% | 0.81 | S | S | * | * | | | trans | 95.5 | 97.8 | 136.9 | 0 | 0 | 0 | 0 | 0 | 117.6 | | |
| 16 | G | 40.8 | Very low | 45.6 | Very low | 88 Ų | 88 | 143.2 Ų | 143.2 | 91% | 0.907 | 81% | 0.813 | S | S | * | * | | | trans | -61.1 | 153.3 | 154.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | | |
| 17 | G | 35.2 | Very low | 44.9 | Very low | 72 Ų | 72 | 138 Ų | 138 | 74% | 0.742 | 80% | 0.804 | S | S | * | * | | | trans | 165.8 | 103.8 | 176 | 0 | 0 | 0 | 0 | 0 | 111.7 | | |
| 18 | L | 52 | Low | 44.4 | Very low | 165 Ų | 165 | 133.1 Ų | 133.1 | 86% | 0.864 | 80% | 0.799 | S | S | * | * | | | trans | -51.2 | 160.7 | 155.1 | -62.7 | 150.9 | 0 | 0 | 0 | 109.8 | | |
| 19 | H | 40.7 | Very low | 43.5 | Very low | 196 Ų | 196 | 135.6 Ų | 135.6 | 91% | 0.907 | 81% | 0.805 | S | S | * | * | | | trans | 89.5 | 126.6 | -175.6 | -56.7 | -80 | 0 | 0 | 0 | 113.5 | | |
| 20 | G | 37.6 | Very low | 43.1 | Very low | 55 Ų | 55 | 137.1 Ų | 137.1 | 57% | 0.567 | 81% | 0.81 | S | S | * | * | | | cis | 158.8 | 150.6 | 15.4 | 0 | 0 | 0 | 0 | 0 | 107 | R22 | G20-R22 PolarHBondContact O-N 3.48Å; G20-R22 VanDerWaalsContact O-N 3.11Å |
| 21 | Y | 49.5 | Very low | 43.1 | Very low | 249 Ų | 249 | 134.2 Ų | 134.2 | 98% | 0.976 | 81% | 0.807 | S | S | * | * | | | trans | -32 | 111.9 | 166.7 | -43.4 | -89.8 | 0 | 0 | 0 | 111.9 | | |
| 22 | R | 47.9 | Very low | 42.6 | Very low | 234 Ų | 234 | 131.5 Ų | 131.5 | 88% | 0.883 | 81% | 0.813 | S | S | * | * | | | trans | -119.3 | 93.1 | 167.8 | -176.1 | -180 | -77 | -102.1 | 3.5 | 109.5 | G20 | G20-R22 PolarHBondContact O-N 3.48Å; G20-R22 VanDerWaalsContact O-N 3.11Å |
| 23 | M | 53.8 | Low | 42.7 | Very low | 193 Ų | 193 | 133.9 Ų | 133.9 | 95% | 0.951 | 81% | 0.81 | S | S | * | * | | | trans | -46.3 | 130.4 | 146.6 | -128.8 | 178.2 | -78.5 | 0 | 0 | 109 | | |
| 24 | G | 47.7 | Very low | 42.7 | Very low | 69 Ų | 69 | 137.7 Ų | 137.7 | 71% | 0.711 | 82% | 0.818 | S | S | * | * | | | trans | -160.9 | 77.7 | -175.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | N26 | G24-N26 PolarHBondContact O-N 2.89Š|
| 25 | M | 51.8 | Low | 42.7 | Very low | 188 Ų | 188 | 139 Ų | 139 | 93% | 0.926 | 82% | 0.815 | S | S | * | * | | | trans | -73.6 | 107.4 | 170.9 | -176.1 | 144.2 | 89.3 | 0 | 0 | 111.2 | | |
| 26 | N | 39.6 | Very low | 42.9 | Very low | 165 Ų | 165 | 144.8 Ų | 144.8 | 88% | 0.882 | 82% | 0.824 | S | S | * | * | | | trans | 177.3 | 138.2 | 152.4 | -128.4 | -105.5 | 0 | 0 | 0 | 108.1 | G24 | G24-N26 PolarHBondContact O-N 2.89Š|
| 27 | G | 40.5 | Very low | 42.6 | Very low | 66 Ų | 66 | 146.6 Ų | 146.6 | 68% | 0.68 | 82% | 0.816 | S | S | * | * | | | cis | 157.9 | 136.6 | 13.3 | 0 | 0 | 0 | 0 | 0 | 107 | | |
| 28 | G | 45 | Very low | 43.2 | Very low | 74 Ų | 74 | 149.7 Ų | 149.7 | 76% | 0.763 | 82% | 0.821 | S | S | * | * | | | trans | 100.2 | 102.7 | 168.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | | |
| 29 | L | 41.3 | Very low | 43.5 | Very low | 170 Ų | 170 | 147.2 Ų | 147.2 | 89% | 0.89 | 82% | 0.815 | S | S | * | * | | | | 178.7 | 87.4 | 121.4 | -84.6 | 173.4 | 0 | 0 | 0 | 108.5 | | |
| 30 | Q | 42.3 | Very low | 43.8 | Very low | 190 Ų | 190 | 146.7 Ų | 146.7 | 89% | 0.888 | 81% | 0.812 | S | S | * | * | | | trans | 30.5 | 103.5 | 130.8 | -167 | 173.4 | 55 | 0 | 0 | 118.6 | | |
| 31 | A | 41.7 | Very low | 44.4 | Very low | 94 Ų | 94 | 150 Ų | 150 | 78% | 0.777 | 82% | 0.824 | S | S | * | * | | | | 174.1 | 85.9 | 127 | 0 | 0 | 0 | 0 | 0 | 109.5 | | |
| 32 | G | 34.8 | Very low | 44 | Very low | 68 Ų | 68 | 141.3 Ų | 141.3 | 70% | 0.701 | 81% | 0.811 | S | S | * | * | | | trans | -134.6 | 96.7 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q34 | G32-Q34 PolarHBondContact O-N 3.34Å; G32-Q34 VanDerWaalsContact O-N 3.16Å |
| 33 | H | 39.7 | Very low | 44.6 | Very low | 181 Ų | 181 | 138.1 Ų | 138.1 | 84% | 0.838 | 81% | 0.81 | S | S | * | * | | | trans | -43 | 104.7 | 152.4 | 26.8 | 30.6 | 0 | 0 | 0 | 112.4 | | |
| 34 | Q | 41.8 | Very low | 44 | Very low | 162 Ų | 162 | 140.6 Ų | 140.6 | 76% | 0.757 | 81% | 0.809 | S | S | * | * | | | trans | 13.6 | 116.2 | 132 | -71.2 | -145.6 | 57.6 | 0 | 0 | 117.9 | G32 | G32-Q34 PolarHBondContact O-N 3.34Å; G32-Q34 VanDerWaalsContact O-N 3.16Å |
| 35 | Q | 38.1 | Very low | 43.8 | Very low | 174 Ų | 174 | 141.5 Ų | 141.5 | 81% | 0.813 | 81% | 0.81 | S | S | * | * | | | | 167.8 | 137.8 | 89.7 | -107.4 | 162.9 | 42.3 | 0 | 0 | 112 | | |
| 36 | H | 38.5 | Very low | 44.1 | Very low | 188 Ų | 188 | 141.1 Ų | 141.1 | 87% | 0.87 | 81% | 0.811 | S | S | * | * | | | trans | -80.9 | 163.6 | 175.1 | -105 | -104.5 | 0 | 0 | 0 | 112.2 | | |
| 37 | V | 36.3 | Very low | 44.5 | Very low | 125 Ų | 125 | 139 Ų | 139 | 76% | 0.758 | 81% | 0.805 | S | S | * | * | | | trans | 112.8 | 94.7 | 150.1 | -170 | 0 | 0 | 0 | 0 | 117.9 | | |
| 38 | V | 46.9 | Very low | 44.6 | Very low | 138 Ų | 138 | 143.8 Ų | 143.8 | 84% | 0.836 | 82% | 0.816 | S | S | * | * | | | | 55.2 | 146.6 | 119.6 | 179.2 | 0 | 0 | 0 | 0 | 120.5 | | |
| 39 | P | 58.3 | Low | 44.7 | Very low | 113 Ų | 113 | 143.6 Ų | 143.6 | 73% | 0.734 | 81% | 0.813 | S | S | * | * | | | trans | -98 | 165.6 | -147.4 | 38.7 | -32.4 | 0 | 0 | 0 | 117 | | |
| 40 | Q | 46.2 | Very low | 45 | Very low | 184 Ų | 184 | 144 Ų | 144 | 86% | 0.86 | 81% | 0.811 | S | S | * | * | | | trans | 12.5 | 145.5 | 157.9 | -71.6 | -162.2 | 44.3 | 0 | 0 | 119.7 | | |
| 41 | P | 51.7 | Low | 45.6 | Very low | 124 Ų | 124 | 142.4 Ų | 142.4 | 81% | 0.805 | 81% | 0.805 | S | S | * | * | | | | -154.5 | 167.4 | 52.1 | 37.5 | -14.6 | 0 | 0 | 0 | 117.6 | | |
| 42 | G | 40.3 | Very low | 46.1 | Very low | 68 Ų | 68 | 145.1 Ų | 145.1 | 70% | 0.701 | 80% | 0.804 | S | S | * | * | | | trans | 109 | 111.8 | 148.4 | 0 | 0 | 0 | 0 | 0 | 119 | | |
| 43 | L | 60.2 | Low | 46.5 | Very low | 167 Ų | 167 | 150.8 Ų | 150.8 | 87% | 0.874 | 81% | 0.811 | S | S | * | * | | | trans | 57 | 93.1 | 135.5 | -57.4 | 170.2 | 0 | 0 | 0 | 119.7 | | |
| 44 | R | 41.7 | Very low | 46.6 | Very low | 245 Ų | 245 | 152 Ų | 152 | 93% | 0.925 | 81% | 0.81 | S | S | * | * | | | trans | -171.7 | 106.9 | 133.1 | -131.3 | 151.9 | -90.2 | -132 | -2.8 | 111.6 | | |
| 45 | A | 43.5 | Very low | 46.5 | Very low | 88 Ų | 88 | 147.8 Ų | 147.8 | 73% | 0.727 | 81% | 0.81 | S | S | * | * | | | | 80.6 | 92.6 | 106.2 | 0 | 0 | 0 | 0 | 0 | 115.4 | | |
| 46 | L | 58.2 | Low | 46.6 | Very low | 180 Ų | 180 | 143.8 Ų | 143.8 | 94% | 0.942 | 82% | 0.816 | S | S | * | * | | | trans | -92 | 121.1 | 156.4 | -68.6 | 165.5 | 0 | 0 | 0 | 107.7 | | |
| 47 | P | 48.1 | Very low | 46.8 | Very low | 119 Ų | 119 | 138.1 Ų | 138.1 | 77% | 0.773 | 81% | 0.809 | S | S | * | * | | | trans | -86.1 | 145.9 | 171.9 | 32.8 | -27.9 | 0 | 0 | 0 | 110.5 | | |
| 48 | N | 42.9 | Very low | 47.7 | Very low | 168 Ų | 168 | 138 Ų | 138 | 90% | 0.898 | 81% | 0.81 | S | S | * | * | | | trans | 80.4 | 91 | 178.7 | -87.6 | 13.1 | 0 | 0 | 0 | 117.7 | | |
| 49 | G | 46.3 | Very low | 48 | Very low | 69 Ų | 69 | 139.8 Ų | 139.8 | 71% | 0.711 | 81% | 0.809 | S | S | * | * | | | trans | -74.6 | 151.3 | 166.5 | 0 | 0 | 0 | 0 | 0 | 114 | | |
| 50 | Q | 48.4 | Very low | 47.8 | Very low | 180 Ų | 180 | 143.2 Ų | 143.2 | 84% | 0.841 | 82% | 0.815 | S | S | * | * | | | trans | -123.2 | 140.9 | 133.2 | -70.9 | -71.7 | 11.4 | 0 | 0 | 107.3 | | |
| 51 | M | 55.1 | Low | 48 | Very low | 156 Ų | 156 | 141.4 Ų | 141.4 | 77% | 0.768 | 81% | 0.807 | S | S | * | * | | | trans | -73.8 | 151.2 | -155.3 | -67.3 | 169.6 | -85.8 | 0 | 0 | 114.3 | H53 | M51-H53 PolarHBondContact O-N 3.16Š|
| 52 | M | 51.6 | Low | 48.1 | Very low | 151 Ų | 151 | 138.3 Ų | 138.3 | 74% | 0.744 | 79% | 0.792 | S | S | * | * | | | trans | -38 | 122.5 | 160.9 | -68.1 | -112.3 | -70.2 | 0 | 0 | 112.3 | Y54 | M52-Y54 HydrophobicContact CB-CD2 4.44Å; M52-Y54 HydrophobicContact CE-CD2 3.38Å; M52-Y54 HydrophobicContact CE-CE2 3.27Å; M52-Y54 HydrophobicContact SD-CD2 3.74Å; M52-Y54 HydrophobicContact SD-CE2 3.39Å; M52-Y54 WeakPolarHBondContact SD-CE2 3.45Å |
| 53 | H | 43.2 | Very low | 48.6 | Very low | 186 Ų | 186 | 140.7 Ų | 140.7 | 86% | 0.861 | 79% | 0.793 | S | S | * | * | | | trans | -108.7 | 93.7 | 156.6 | -85.4 | 76.4 | 0 | 0 | 0 | 108 | M51 | M51-H53 PolarHBondContact O-N 3.16Š|
| 54 | Y | 41.6 | Very low | 48.4 | Very low | 206 Ų | 206 | 139.8 Ų | 139.8 | 81% | 0.808 | 79% | 0.786 | S | S | * | * | | | trans | -86.8 | 123.2 | 158 | -88.7 | -102.4 | 0 | 0 | 0 | 107.9 | M52 | M52-Y54 HydrophobicContact CB-CD2 4.44Å; M52-Y54 HydrophobicContact CE-CD2 3.38Å; M52-Y54 HydrophobicContact CE-CE2 3.27Å; M52-Y54 HydrophobicContact SD-CD2 3.74Å; M52-Y54 HydrophobicContact SD-CE2 3.39Å; M52-Y54 WeakPolarHBondContact SD-CE2 3.45Å |
| 55 | G | 39.8 | Very low | 49 | Very low | 74 Ų | 74 | 133.7 Ų | 133.7 | 76% | 0.763 | 77% | 0.768 | S | S | * | * | | | trans | 145.8 | 100.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 108 | | |
| 56 | G | 40.3 | Very low | 49.5 | Very low | 90 Ų | 90 | 134.3 Ų | 134.3 | 93% | 0.928 | 76% | 0.762 | S | S | * | * | | | | 84.6 | 88.3 | 51.8 | 0 | 0 | 0 | 0 | 0 | 108.7 | | |
| 57 | G | 42.9 | Very low | 49.3 | Very low | 70 Ų | 70 | 129.7 Ų | 129.7 | 72% | 0.722 | 75% | 0.751 | S | S | * | * | | | trans | 163.5 | 115.3 | 173 | 0 | 0 | 0 | 0 | 0 | 115.3 | | |
| 58 | P | 54.7 | Low | 49.6 | Very low | 121 Ų | 121 | 132.1 Ų | 132.1 | 79% | 0.786 | 75% | 0.754 | S | S | * | * | | | trans | -89.5 | 126.3 | -171.7 | 34.5 | -30 | 0 | 0 | 0 | 111.2 | | |
| 59 | Q | 54.1 | Low | 50.3 | Low | 176 Ų | 176 | 134.4 Ų | 134.4 | 82% | 0.822 | 75% | 0.75 | S | S | * | * | | | trans | -149.5 | 1.3 | 171.9 | -124.3 | 173.4 | -33.4 | 0 | 0 | 116.3 | | |
| 60 | Q | 52.3 | Low | 50.8 | Low | 185 Ų | 185 | 139 Ų | 139 | 86% | 0.864 | 75% | 0.752 | S | S | * | * | S | Bend | trans | -106.3 | -12.5 | 174.9 | -68.5 | 178.8 | 15.7 | 0 | 0 | 113.6 | | |
| 61 | Q | 50.8 | Low | 50.6 | Low | 147 Ų | 147 | 142.1 Ų | 142.1 | 69% | 0.687 | 76% | 0.757 | S | S | * | * | S | Bend | trans | -85.4 | -21.9 | 177 | -159.9 | 161.2 | 3.7 | 0 | 0 | 113.1 | T63 M64 E65 | Q61-T63 PolarHBondContact O-N 3.09Å; Q61-M64 PolarHBondContact O-N 3.15Å; Q61-E65 PolarHBondContact O-N 3.31Å |
| 62 | A | 53.3 | Low | 50.1 | Low | 58 Ų | 58 | 144.2 Ų | 144.2 | 48% | 0.479 | 77% | 0.765 | S | S | . | * | H | α-helix | trans | -71.8 | -27.3 | -178.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | M64 V66 | A62-M64 VanDerWaalsContact C-N 3.34Å; A62-V66 VanDerWaalsContact O-CG2 3.28Å; A62-V66 WeakPolarHBondContact O-CG2 3.19Å; A62-V66 PolarHBondContact O-N 2.76Å |
| 63 | T | 52 | Low | 49.7 | Very low | 118 Ų | 118 | 140.3 Ų | 140.3 | 72% | 0.724 | 76% | 0.763 | S | S | * | * | H | α-helix | trans | -73.8 | -27.9 | 177.1 | -65.3 | 0 | 0 | 0 | 0 | 112.1 | Q61 | Q61-T63 PolarHBondContact O-N 3.09Å |
| 64 | M | 54.8 | Low | 49.6 | Very low | 148 Ų | 148 | 140.8 Ų | 140.8 | 73% | 0.729 | 77% | 0.768 | S | S | * | * | H | α-helix | trans | -85.1 | -29.3 | -179 | -148.5 | 169.3 | -85.6 | 0 | 0 | 112.3 | Q61 A62 | Q61-M64 PolarHBondContact O-N 3.15Å; A62-M64 VanDerWaalsContact C-N 3.34Å |
| 65 | E | 54.8 | Low | 50.1 | Low | 117 Ų | 117 | 138.2 Ų | 138.2 | 55% | 0.547 | 77% | 0.774 | S | S | . | * | H | α-helix | trans | -75.3 | -29.3 | 174.4 | -90.8 | -172 | 91.8 | 0 | 0 | 114.4 | Q61 A67 M68 | Q61-E65 PolarHBondContact O-N 3.31Å; E65-A67 VanDerWaalsContact C-N 3.34Å; E65-A67 PolarHBondContact O-N 3.45Å; E65-M68 PolarHBondContact O-N 3.28Å |
| 66 | V | 54.3 | Low | 50.2 | Low | 101 Ų | 101 | 137.8 Ų | 137.8 | 61% | 0.612 | 77% | 0.769 | S | S | * | * | H | α-helix | trans | -72.6 | -25.9 | -179.8 | 173.2 | 0 | 0 | 0 | 0 | 112.3 | A62 | A62-V66 VanDerWaalsContact O-CG2 3.28Å; A62-V66 WeakPolarHBondContact O-CG2 3.19Å; A62-V66 PolarHBondContact O-N 2.76Å |
| 67 | A | 53.6 | Low | 50.7 | Low | 84 Ų | 84 | 139.9 Ų | 139.9 | 69% | 0.694 | 77% | 0.766 | S | S | * | * | H | α-helix | trans | -74.4 | -28.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | E65 | E65-A67 VanDerWaalsContact C-N 3.34Å; E65-A67 PolarHBondContact O-N 3.45Å |
| 68 | M | 55.7 | Low | 50.9 | Low | 170 Ų | 170 | 143.7 Ų | 143.7 | 84% | 0.837 | 78% | 0.775 | S | S | * | * | H | α-helix | trans | -90.9 | -11.5 | -177.9 | -67.2 | -154.9 | -156.1 | 0 | 0 | 114.5 | E65 | E65-M68 PolarHBondContact O-N 3.28Å |
| 69 | R | 57.7 | Low | 50.4 | Low | 215 Ų | 215 | 145.5 Ų | 145.5 | 81% | 0.811 | 78% | 0.778 | S | S | * | * | S | Bend | trans | -95.1 | -1.3 | -179.3 | -75.8 | -176.6 | 143.8 | -141 | -4.9 | 115.3 | | |
| 70 | Q | 54.9 | Low | 50.1 | Low | 165 Ų | 165 | 140.1 Ų | 140.1 | 77% | 0.771 | 77% | 0.77 | S | S | * | * | | | trans | -118.8 | 63 | -173.2 | -156.4 | 176.5 | 38.1 | 0 | 0 | 113.6 | | |
| 71 | R | 44.8 | Very low | 49.3 | Very low | 246 Ų | 246 | 140.8 Ų | 140.8 | 93% | 0.928 | 77% | 0.773 | S | S | * | * | S | Bend | trans | -155.6 | 39.5 | 153.7 | -123.7 | -175.2 | -148.5 | -86.5 | 1.8 | 115.9 | | |
| 72 | Q | 44.6 | Very low | 49.2 | Very low | 201 Ų | 201 | 141.4 Ų | 141.4 | 94% | 0.939 | 78% | 0.78 | S | S | * | * | | | trans | -122.4 | 119.7 | 155.8 | -84 | -172.4 | -7.1 | 0 | 0 | 109.1 | | |
| 73 | G | 42.7 | Very low | 48.6 | Very low | 69 Ų | 69 | 146.7 Ų | 146.7 | 71% | 0.711 | 80% | 0.8 | S | S | * | * | | | trans | 152.3 | 70.1 | 171.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | | |
| 74 | M | 42.2 | Very low | 48 | Very low | 195 Ų | 195 | 144.5 Ų | 144.5 | 96% | 0.961 | 80% | 0.801 | S | S | * | * | | | trans | -151.7 | 49.8 | 149.7 | -122.4 | 160.3 | 154.8 | 0 | 0 | 111.5 | | |
| 75 | V | 51.2 | Low | 47.4 | Very low | 153 Ų | 153 | 142.2 Ų | 142.2 | 93% | 0.927 | 81% | 0.806 | S | S | * | * | | | trans | -84.8 | 98.3 | 149.8 | -87.9 | 0 | 0 | 0 | 0 | 106.8 | | |
| 76 | G | 42.8 | Very low | 46.9 | Very low | 64 Ų | 64 | 145.8 Ų | 145.8 | 66% | 0.66 | 82% | 0.823 | S | S | * | * | | | trans | -103.9 | 159.5 | 167.6 | 0 | 0 | 0 | 0 | 0 | 110.5 | | |
| 77 | P | 49.8 | Very low | 46.6 | Very low | 135 Ų | 135 | 149.9 Ų | 149.9 | 88% | 0.877 | 84% | 0.837 | S | S | * | * | | | trans | -75.4 | 141.9 | -145.9 | 29.6 | -35.6 | 0 | 0 | 0 | 115 | N79 | P77-N79 PolarHBondContact O-N 3.41Š|
| 78 | V | 48.8 | Very low | 45.9 | Very low | 150 Ų | 150 | 149 Ų | 149 | 91% | 0.909 | 84% | 0.837 | S | S | * | * | | | trans | -67.6 | 102.9 | 156.9 | 169.4 | 0 | 0 | 0 | 0 | 107.8 | | |
| 79 | N | 43.4 | Very low | 45.1 | Very low | 158 Ų | 158 | 149.5 Ų | 149.5 | 85% | 0.845 | 84% | 0.837 | S | S | * | * | | | trans | -174.9 | 119.7 | 135.4 | -156 | 7.9 | 0 | 0 | 0 | 112.2 | P77 | P77-N79 PolarHBondContact O-N 3.41Š|
| 80 | G | 46.8 | Very low | 44.3 | Very low | 63 Ų | 63 | 147.9 Ų | 147.9 | 65% | 0.649 | 84% | 0.838 | S | S | * | * | | | trans | 90.6 | 93.9 | 148.5 | 0 | 0 | 0 | 0 | 0 | 118.9 | | |
| 81 | Q | 36.8 | Very low | 43.5 | Very low | 199 Ų | 199 | 148.7 Ų | 148.7 | 93% | 0.93 | 84% | 0.842 | S | S | * | * | | | | -164.4 | 115.2 | 124.1 | -128.1 | 167.7 | -79.5 | 0 | 0 | 111.7 | | |
| 82 | L | 48.1 | Very low | 43.3 | Very low | 161 Ų | 161 | 145 Ų | 145 | 84% | 0.843 | 84% | 0.837 | S | S | * | * | | | trans | -70.5 | 154.9 | 163.3 | -67.2 | 155.6 | 0 | 0 | 0 | 109.5 | | |
| 83 | N | 40.5 | Very low | 43.2 | Very low | 169 Ų | 169 | 142 Ų | 142 | 90% | 0.904 | 83% | 0.832 | S | S | * | * | | | trans | 91.8 | 125.4 | 147.4 | -138.1 | -31.4 | 0 | 0 | 0 | 117.9 | | |
| 84 | G | 39.7 | Very low | 43.3 | Very low | 71 Ų | 71 | 143.9 Ų | 143.9 | 73% | 0.732 | 84% | 0.835 | S | S | * | * | | | trans | 144.8 | 92.3 | 160 | 0 | 0 | 0 | 0 | 0 | 115.3 | | |
| 85 | A | 43.4 | Very low | 43.2 | Very low | 101 Ų | 101 | 137.9 Ų | 137.9 | 84% | 0.835 | 82% | 0.823 | S | S | * | * | | | trans | -67.4 | 144.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 114 | | |
| 86 | Q | 43.9 | Very low | 42.7 | Very low | 192 Ų | 192 | 137.7 Ų | 137.7 | 90% | 0.897 | 82% | 0.817 | S | S | * | * | | | trans | -164.4 | 93.6 | 151.3 | -135.8 | 174.3 | -8 | 0 | 0 | 107.7 | | |
| 87 | M | 47.7 | Very low | 43.1 | Very low | 186 Ų | 186 | 142.6 Ų | 142.6 | 92% | 0.916 | 83% | 0.826 | S | S | * | * | | | | 63 | 105.3 | 76.5 | -159.4 | -174.9 | -70.2 | 0 | 0 | 114.2 | | |
| 88 | G | 39.1 | Very low | 42.8 | Very low | 67 Ų | 67 | 143.6 Ų | 143.6 | 69% | 0.691 | 82% | 0.821 | S | S | * | * | | | trans | 108.1 | 107.5 | 141.2 | 0 | 0 | 0 | 0 | 0 | 117.8 | | |
| 89 | H | 38.9 | Very low | 42.7 | Very low | 180 Ų | 180 | 147.1 Ų | 147.1 | 83% | 0.833 | 82% | 0.82 | S | S | * | * | | | | -172.7 | 95.6 | 105.2 | -132.1 | -85.1 | 0 | 0 | 0 | 111.5 | | |
| 90 | H | 39.6 | Very low | 42.5 | Very low | 180 Ų | 180 | 146.3 Ų | 146.3 | 83% | 0.833 | 82% | 0.815 | S | S | * | * | | | trans | -83.6 | 120.9 | 160 | -65.4 | -86.1 | 0 | 0 | 0 | 107.7 | M92 | H90-M92 PolarHBondContact O-N 3.15Š|
| 91 | Q | 38.1 | Very low | 42.3 | Very low | 183 Ų | 183 | 150.5 Ų | 150.5 | 86% | 0.855 | 82% | 0.823 | S | S | * | * | | | trans | -88 | 99.1 | 168.1 | -170.4 | 167.6 | 67.1 | 0 | 0 | 108.4 | | |
| 92 | M | 41.8 | Very low | 42.3 | Very low | 168 Ų | 168 | 144.3 Ų | 144.3 | 83% | 0.828 | 81% | 0.813 | S | S | * | * | | | trans | -85 | 112.3 | 165.3 | -69.4 | -114.9 | -86.1 | 0 | 0 | 108.2 | H90 | H90-M92 PolarHBondContact O-N 3.15Š|
| 93 | T | 42.7 | Very low | 42.3 | Very low | 137 Ų | 137 | 146.4 Ų | 146.4 | 84% | 0.84 | 82% | 0.818 | S | S | * | * | | | trans | -99.3 | 107.2 | 153.2 | -96.2 | 0 | 0 | 0 | 0 | 107.6 | | |
| 94 | S | 44.4 | Very low | 42.2 | Very low | 110 Ų | 110 | 143 Ų | 143 | 77% | 0.769 | 81% | 0.813 | S | S | * | * | | | trans | -62 | 144.2 | 168.2 | -46.5 | 0 | 0 | 0 | 0 | 111.3 | | |
| 95 | G | 38.8 | Very low | 42.4 | Very low | 69 Ų | 69 | 148 Ų | 148 | 71% | 0.711 | 82% | 0.817 | S | S | * | * | | | trans | 162.4 | 98.9 | 158.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | | |
| 96 | N | 41.4 | Very low | 42.5 | Very low | 149 Ų | 149 | 150.5 Ų | 150.5 | 80% | 0.797 | 81% | 0.812 | S | S | * | * | | | trans | 79.8 | 88.3 | 153.1 | -65.8 | 23.1 | 0 | 0 | 0 | 119.5 | M98 | N96-M98 PolarHBondContact O-N 3.01Š|
| 97 | I | 50.9 | Low | 42.5 | Very low | 167 Ų | 167 | 148.2 Ų | 148.2 | 86% | 0.856 | 80% | 0.801 | S | S | * | * | | | trans | -55.6 | 121.1 | 131.2 | -60.1 | 131.3 | 0 | 0 | 0 | 108.3 | | |
| 98 | M | 43.2 | Very low | 41.9 | Very low | 155 Ų | 155 | 147.8 Ų | 147.8 | 76% | 0.764 | 80% | 0.797 | S | S | * | * | | | trans | -141.2 | 90.5 | 151 | -170.9 | 172.9 | -77.6 | 0 | 0 | 108.9 | N96 N100 | N96-M98 PolarHBondContact O-N 3.01Å; M98-N100 HydrophobicContact CG-CB 4.39Å; M98-N100 PolarHBondContact O-N 2.89Å |
| 99 | Y | 46.8 | Very low | 42.1 | Very low | 225 Ų | 225 | 153.1 Ų | 153.1 | 88% | 0.882 | 80% | 0.803 | S | S | * | * | | | trans | -65.2 | 112.5 | 156 | -141.8 | -95.4 | 0 | 0 | 0 | 106.5 | | |
| 100 | N | 39.3 | Very low | 42.6 | Very low | 140 Ų | 140 | 150.5 Ų | 150.5 | 75% | 0.749 | 80% | 0.802 | S | S | * | * | | | trans | -147.7 | 113.6 | 158.9 | -160.3 | 23.7 | 0 | 0 | 0 | 112.2 | M98 | M98-N100 HydrophobicContact CG-CB 4.39Å; M98-N100 PolarHBondContact O-N 2.89Å |
| 101 | N | 43.6 | Very low | 42.6 | Very low | 151 Ų | 151 | 149.2 Ų | 149.2 | 81% | 0.807 | 80% | 0.796 | S | S | * | * | | | trans | -72.2 | 125.4 | 168.4 | -175.3 | 63.1 | 0 | 0 | 0 | 108.8 | | |
| 102 | G | 37.6 | Very low | 42.5 | Very low | 70 Ų | 70 | 149.5 Ų | 149.5 | 72% | 0.722 | 80% | 0.797 | S | S | * | * | | | trans | 178.9 | 104.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 115.5 | | |
| 103 | Q | 46.8 | Very low | 42.3 | Very low | 205 Ų | 205 | 148.7 Ų | 148.7 | 96% | 0.958 | 79% | 0.791 | S | S | * | * | | | trans | -63.3 | 135.4 | 164.5 | -60.1 | 166.7 | -77.8 | 0 | 0 | 111.1 | | |
| 104 | A | 38.9 | Very low | 42 | Very low | 96 Ų | 96 | 150.5 Ų | 150.5 | 79% | 0.793 | 79% | 0.79 | S | S | * | * | | | trans | -179 | 108.8 | 150.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | | |
| 105 | Q | 42.6 | Very low | 41.5 | Very low | 177 Ų | 177 | 153.3 Ų | 153.3 | 83% | 0.827 | 79% | 0.793 | S | S | * | * | | | | 64.9 | 110.4 | 89.1 | -109.7 | -176.8 | -6.5 | 0 | 0 | 117.3 | | |
| 106 | Q | 45.8 | Very low | 41.5 | Very low | 154 Ų | 154 | 154.6 Ų | 154.6 | 72% | 0.72 | 79% | 0.791 | S | S | * | * | | | trans | 58 | 132.6 | 134.4 | -85.1 | -178.4 | 21.3 | 0 | 0 | 124.8 | | |
| 107 | Q | 44.9 | Very low | 41.3 | Very low | 144 Ų | 144 | 155.7 Ų | 155.7 | 67% | 0.673 | 79% | 0.791 | S | S | * | * | | | trans | 74.5 | 126.2 | 145.5 | -70.3 | -178.4 | 22.1 | 0 | 0 | 119.9 | | |
| 108 | H | 35.9 | Very low | 41 | Very low | 177 Ų | 177 | 156 Ų | 156 | 82% | 0.819 | 79% | 0.789 | S | S | * | * | | | | 174.5 | 140.6 | 106.7 | -94 | -91.1 | 0 | 0 | 0 | 111.4 | | |
| 109 | H | 41.4 | Very low | 41 | Very low | 179 Ų | 179 | 157.9 Ų | 157.9 | 83% | 0.829 | 80% | 0.796 | S | S | * | * | | | trans | -74.5 | 163.7 | 174.7 | -103.8 | 87.8 | 0 | 0 | 0 | 111.6 | | |
| 110 | P | 50.7 | Low | 40.7 | Very low | 124 Ų | 124 | 156.2 Ų | 156.2 | 81% | 0.805 | 80% | 0.796 | S | S | * | * | | | | -155.9 | 164.3 | 72.9 | 37.8 | -13.9 | 0 | 0 | 0 | 120.7 | | |
| 111 | Q | 39.7 | Very low | 41 | Very low | 154 Ų | 154 | 154.4 Ų | 154.4 | 72% | 0.72 | 80% | 0.8 | S | S | * | * | | | trans | -26.2 | 139 | 161.4 | -170 | 170.6 | 7.9 | 0 | 0 | 119.3 | | |
| 112 | H | 35.9 | Very low | 40.8 | Very low | 189 Ų | 189 | 156.4 Ų | 156.4 | 88% | 0.875 | 81% | 0.805 | S | S | * | * | | | trans | -169.8 | 161.2 | 137.5 | -100.4 | -69.6 | 0 | 0 | 0 | 113.4 | | |
| 113 | H | 36.3 | Very low | 41 | Very low | 150 Ų | 150 | 160.7 Ų | 160.7 | 69% | 0.694 | 81% | 0.806 | S | S | * | * | | | trans | -81.8 | 166.2 | -155.3 | -79.7 | -25.5 | 0 | 0 | 0 | 120 | | |
| 114 | H | 37.1 | Very low | 40.6 | Very low | 176 Ų | 176 | 158.8 Ų | 158.8 | 82% | 0.815 | 80% | 0.797 | S | S | * | * | | | trans | 70.4 | 137 | 151.1 | -81.4 | 9.9 | 0 | 0 | 0 | 116.5 | | |
| 115 | M | 34.8 | Very low | 41 | Very low | 168 Ų | 168 | 159.2 Ų | 159.2 | 83% | 0.828 | 79% | 0.792 | S | S | * | * | | | cis | -163.2 | 153.3 | 46.4 | -159 | -165 | -68.6 | 0 | 0 | 110.6 | | |
| 116 | S | 37.2 | Very low | 41 | Very low | 97 Ų | 97 | 158.9 Ų | 158.9 | 68% | 0.678 | 79% | 0.79 | S | S | * | * | | | trans | -41.1 | 142.2 | 165.9 | 50.8 | 0 | 0 | 0 | 0 | 116.1 | | |
| 117 | Q | 38.9 | Very low | 41 | Very low | 171 Ų | 171 | 160.1 Ų | 160.1 | 80% | 0.799 | 80% | 0.796 | S | S | * | * | | | | -176.8 | 130.7 | 117 | -148.1 | 167.6 | 88.1 | 0 | 0 | 113 | | |
| 118 | Q | 43.3 | Very low | 41 | Very low | 173 Ų | 173 | 162.6 Ų | 162.6 | 81% | 0.808 | 81% | 0.808 | S | S | * | * | | | trans | 54.5 | 100.7 | 154.5 | -84.7 | 171.2 | -20.9 | 0 | 0 | 121.2 | Q120 | Q118-Q120 PolarHBondContact O-N 3.02Š|
| 119 | Q | 42.7 | Very low | 41.7 | Very low | 196 Ų | 196 | 162.3 Ų | 162.3 | 92% | 0.916 | 81% | 0.807 | S | S | * | * | | | trans | -62.3 | 115.3 | 148.2 | -76.7 | 163.8 | 0.8 | 0 | 0 | 110.4 | | |
| 120 | Q | 41.9 | Very low | 41.9 | Very low | 190 Ų | 190 | 162.1 Ų | 162.1 | 89% | 0.888 | 81% | 0.806 | S | S | * | * | | | trans | -111.1 | 109.8 | 145.7 | -97.4 | -179.8 | -28.1 | 0 | 0 | 107.6 | Q118 Q122 | Q118-Q120 PolarHBondContact O-N 3.02Å; Q120-Q122 PolarHBondContact O-N 3.36Å |
| 121 | A | 44.5 | Very low | 41.5 | Very low | 101 Ų | 101 | 166.7 Ų | 166.7 | 84% | 0.835 | 81% | 0.809 | S | S | * | * | | | trans | -69.4 | 114.6 | 167.8 | 0 | 0 | 0 | 0 | 0 | 108.5 | | |
| 122 | Q | 39.6 | Very low | 41.7 | Very low | 193 Ų | 193 | 165.8 Ų | 165.8 | 90% | 0.902 | 81% | 0.806 | S | S | * | * | | | trans | -133.2 | 113.7 | 159.1 | -158.5 | 150.7 | 10.9 | 0 | 0 | 108.9 | Q120 | Q120-Q122 PolarHBondContact O-N 3.36Š|
| 123 | Q | 41.8 | Very low | 42.3 | Very low | 161 Ų | 161 | 165.1 Ų | 165.1 | 75% | 0.752 | 81% | 0.809 | S | S | * | * | | | trans | -75.6 | 144.3 | -179.1 | -61.5 | 175 | 5.5 | 0 | 0 | 110.6 | | |
| 124 | H | 39.6 | Very low | 42.8 | Very low | 164 Ų | 164 | 160.5 Ų | 160.5 | 76% | 0.759 | 80% | 0.802 | S | S | * | * | | | trans | 88.6 | 146.9 | 158.6 | -61.2 | -77.2 | 0 | 0 | 0 | 120.8 | | |
| 125 | P | 46.8 | Very low | 43.6 | Very low | 106 Ų | 106 | 155.7 Ų | 155.7 | 69% | 0.688 | 80% | 0.8 | S | S | * | * | | | cis | -125.3 | 147.1 | -25 | 32.4 | -14.4 | 0 | 0 | 0 | 114.3 | Q127 | P125-Q127 PolarHBondContact O-N 2.84Š|
| 126 | Q | 42 | Very low | 44.7 | Very low | 170 Ų | 170 | 153.1 Ų | 153.1 | 79% | 0.794 | 79% | 0.789 | S | S | * | * | | | trans | -65.7 | 104.4 | 169.3 | -169.4 | -180 | 13.4 | 0 | 0 | 109.9 | | |
| 127 | Q | 45.1 | Very low | 46 | Very low | 179 Ų | 179 | 152.2 Ų | 152.2 | 84% | 0.836 | 78% | 0.779 | S | S | * | * | | | trans | -145.3 | 27.9 | 172.8 | -130.6 | -171.3 | 82.8 | 0 | 0 | 115.8 | P125 | P125-Q127 PolarHBondContact O-N 2.84Š|
| 128 | Q | 46.3 | Very low | 46.9 | Very low | 196 Ų | 196 | 148.4 Ų | 148.4 | 92% | 0.916 | 77% | 0.772 | S | S | * | * | | | trans | -133.1 | 36.6 | 176 | -91.6 | -175.5 | 2.1 | 0 | 0 | 114.5 | | |
| 129 | Q | 49.9 | Very low | 47.7 | Very low | 172 Ų | 172 | 147.3 Ų | 147.3 | 80% | 0.804 | 77% | 0.767 | S | S | * | * | | | trans | -114.8 | 30 | 176.4 | -101.3 | 170 | 7.3 | 0 | 0 | 114.4 | | |
| 130 | Q | 45.2 | Very low | 48.9 | Very low | 175 Ų | 175 | 142.7 Ų | 142.7 | 82% | 0.818 | 75% | 0.745 | S | S | * | * | | | trans | -135.6 | 46.3 | 179.2 | -147.3 | 176.5 | -24.5 | 0 | 0 | 113.7 | | |
| 131 | Y | 42.9 | Very low | 50.5 | Low | 220 Ų | 220 | 138.3 Ų | 138.3 | 86% | 0.863 | 73% | 0.728 | S | S | * | * | S | Bend | trans | -112.2 | 93.9 | 153.8 | -148.4 | -101.2 | 0 | 0 | 0 | 109.5 | | |
| 132 | M | 43.5 | Very low | 51.7 | Low | 135 Ų | 135 | 138.7 Ų | 138.7 | 67% | 0.665 | 71% | 0.713 | S | S | * | * | | | trans | 3.4 | 118.1 | 153.9 | -90.1 | 73 | 171.1 | 0 | 0 | 114.3 | G134 | M132-G134 VanDerWaalsContact C-N 3.27Å; M132-G134 PolarHBondContact O-N 2.96Å; M132-G134 VanDerWaalsContact O-N 3.13Å |
| 133 | N | 48.3 | Very low | 52.9 | Low | 175 Ų | 175 | 131.6 Ų | 131.6 | 94% | 0.936 | 69% | 0.688 | S | S | * | * | | | | 37.2 | 59.2 | 80.1 | -160.8 | 34.8 | 0 | 0 | 0 | 113.4 | | |
| 134 | G | 46.9 | Very low | 54.1 | Low | 52 Ų | 52 | 126.3 Ų | 126.3 | 54% | 0.536 | 67% | 0.669 | S | S | . | * | | | trans | -167.2 | 120.3 | 170.2 | 0 | 0 | 0 | 0 | 0 | 107.1 | M132 L136 | M132-G134 VanDerWaalsContact C-N 3.27Å; M132-G134 PolarHBondContact O-N 2.96Å; M132-G134 VanDerWaalsContact O-N 3.13Å; G134-L136 PolarHBondContact O-N 3.48Å |
| 135 | G | 54.3 | Low | 55.7 | Low | 76 Ų | 76 | 123.9 Ų | 123.9 | 78% | 0.784 | 66% | 0.659 | S | S | * | * | | | trans | -45.3 | 111.4 | -169.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | T137 | G135-T137 PolarHBondContact O-N 2.77Š|
| 136 | L | 58.2 | Low | 56.7 | Low | 113 Ų | 113 | 124.5 Ų | 124.5 | 59% | 0.592 | 65% | 0.652 | S | S | * | * | | | trans | -59.4 | 112.3 | 173.3 | -68.4 | 169.6 | 0 | 0 | 0 | 107 | G134 Q140 | G134-L136 PolarHBondContact O-N 3.48Å; L136-Q140 HydrophobicContact CD2-CB 4.23Å |
| 137 | T | 63.7 | Low | 58 | Low | 78 Ų | 78 | 122.1 Ų | 122.1 | 48% | 0.479 | 64% | 0.644 | S | S | . | * | | | trans | -62.1 | 148.3 | 170.5 | 61.9 | 0 | 0 | 0 | 0 | 108 | G135 Q139 Q140 L141 | G135-T137 PolarHBondContact O-N 2.77Å; T137-Q139 PolarHBondContact O-N 3.17Å; T137-Q140 PolarHBondContact O-N 2.72Å; T137-L141 PolarHBondContact O-N 2.85Å |
| 138 | S | 58.3 | Low | 58.9 | Low | 92 Ų | 92 | 119.7 Ų | 119.7 | 64% | 0.643 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -52.1 | -27.5 | -177.8 | 56.2 | 0 | 0 | 0 | 0 | 113.3 | M142 | S138-M142 PolarHBondContact O-N 2.97Å |
| 139 | Q | 60.5 | Low | 59.5 | Low | 149 Ų | 149 | 118.3 Ų | 118.3 | 70% | 0.696 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -68.3 | -40.9 | 175 | -63.4 | -159.5 | 44 | 0 | 0 | 113.4 | T137 L141 M142 A143 | T137-Q139 PolarHBondContact O-N 3.17Å; Q139-L141 VanDerWaalsContact C-N 3.32Å; Q139-M142 PolarHBondContact O-N 3.22Å; Q139-A143 WeakPolarHBondContact O-CB 3.27Å; Q139-A143 PolarHBondContact O-N 3.11Å |
| 140 | Q | 67 | Low | 59.9 | Low | 99 Ų | 99 | 116.8 Ų | 116.8 | 46% | 0.463 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -69.7 | -32.4 | 177 | -75.5 | 168 | 9.3 | 0 | 0 | 111.5 | L136 T137 A143 S144 | L136-Q140 HydrophobicContact CD2-CB 4.23Å; T137-Q140 PolarHBondContact O-N 2.72Å; Q140-A143 PolarHBondContact O-N 3.26Å; Q140-S144 VanDerWaalsContact O-CB 3.3Å; Q140-S144 WeakPolarHBondContact O-CB 3.21Å; Q140-S144 PolarHBondContact O-N 3.47Å; Q140-S144 PolarHBondContact O-OG 2.83Å |
| 141 | L | 75.9 | Confident | 60.3 | Low | 99 Ų | 99 | 113.7 Ų | 113.7 | 52% | 0.518 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -67.4 | -44.8 | 173 | -178.2 | 64.9 | 0 | 0 | 0 | 111.8 | T137 Q139 A143 S144 M145 | T137-L141 PolarHBondContact O-N 2.85Å; Q139-L141 VanDerWaalsContact C-N 3.32Å; L141-A143 VanDerWaalsContact C-N 3.34Å; L141-A143 PolarHBondContact O-N 2.92Å; L141-S144 PolarHBondContact O-N 3.31Å; L141-M145 WeakPolarHBondContact O-CG 3.48Å; L141-M145 PolarHBondContact O-N 2.73Å |
| 142 | M | 70.8 | Confident | 60.9 | Low | 108 Ų | 108 | 108.3 Ų | 108.3 | 53% | 0.532 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -58.8 | -46.1 | 173.5 | -91.4 | -172.5 | -73.8 | 0 | 0 | 111.3 | S138 Q139 S144 M145 H146 | S138-M142 PolarHBondContact O-N 2.97Å; Q139-M142 PolarHBondContact O-N 3.22Å; M142-S144 VanDerWaalsContact C-N 3.31Å; M142-S144 PolarHBondContact O-N 3.31Å; M142-M145 PolarHBondContact O-N 2.91Å; M142-H146 VanDerWaalsContact O-CG 3.25Å; M142-H146 PolarHBondContact O-N 2.94Å; M142-H146 PolarHBondContact O-ND1 2.83Å |
| 143 | A | 63.7 | Low | 61.5 | Low | 45 Ų | 45 | 110.3 Ų | 110.3 | 37% | 0.372 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -59.3 | -42.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q139 Q140 L141 M145 H146 L147 | Q139-A143 WeakPolarHBondContact O-CB 3.27Å; Q139-A143 PolarHBondContact O-N 3.11Å; Q140-A143 PolarHBondContact O-N 3.26Å; L141-A143 VanDerWaalsContact C-N 3.34Å; L141-A143 PolarHBondContact O-N 2.92Å; A143-M145 PolarHBondContact O-N 3.47Å; A143-H146 PolarHBondContact O-N 3.24Å; A143-L147 WeakPolarHBondContact O-CD1 3.21Å; A143-L147 PolarHBondContact O-N 3.07Å |
| 144 | S | 67.5 | Low | 61.5 | Low | 50 Ų | 50 | 112.5 Ų | 112.5 | 35% | 0.35 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -66.6 | -35.2 | 178.8 | -58.1 | 0 | 0 | 0 | 0 | 113.2 | Q140 L141 M142 Q148 | Q140-S144 VanDerWaalsContact O-CB 3.3Å; Q140-S144 WeakPolarHBondContact O-CB 3.21Å; Q140-S144 PolarHBondContact O-N 3.47Å; Q140-S144 PolarHBondContact O-OG 2.83Å; L141-S144 PolarHBondContact O-N 3.31Å; M142-S144 VanDerWaalsContact C-N 3.31Å; M142-S144 PolarHBondContact O-N 3.31Å; S144-Q148 PolarHBondContact O-N 3.48Å |
| 145 | M | 72.4 | Confident | 61.8 | Low | 113 Ų | 113 | 117.9 Ų | 117.9 | 56% | 0.557 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -69 | -41.4 | 172.8 | -76.5 | -68.4 | -65.9 | 0 | 0 | 111.8 | L141 M142 A143 L147 Q148 K149 | L141-M145 WeakPolarHBondContact O-CG 3.48Å; L141-M145 PolarHBondContact O-N 2.73Å; M142-M145 PolarHBondContact O-N 2.91Å; A143-M145 PolarHBondContact O-N 3.47Å; M145-L147 VanDerWaalsContact C-N 3.35Å; M145-Q148 PolarHBondContact O-N 3.29Å; M145-K149 WeakPolarHBondContact O-CB 3.43Å; M145-K149 PolarHBondContact O-N 2.6Å |
| 146 | H | 67.2 | Low | 61.6 | Low | 118 Ų | 118 | 116.9 Ų | 116.9 | 55% | 0.546 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -62.7 | -41.6 | 175.1 | -65.7 | 131.5 | 0 | 0 | 0 | 111.7 | M142 A143 K149 L150 | M142-H146 VanDerWaalsContact O-CG 3.25Å; M142-H146 PolarHBondContact O-N 2.94Å; M142-H146 PolarHBondContact O-ND1 2.83Å; A143-H146 PolarHBondContact O-N 3.24Å; H146-K149 WeakPolarHBondContact O-CB 3.45Å; H146-K149 PolarHBondContact O-N 3.07Å; H146-L150 WeakPolarHBondContact O-CG 3.35Å; H146-L150 PolarHBondContact O-N 3.1Å |
| 147 | L | 69.4 | Low | 61 | Low | 120 Ų | 120 | 120 Ų | 120 | 63% | 0.628 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -66 | -40.8 | 175 | -89.2 | 143.6 | 0 | 0 | 0 | 112.6 | A143 M145 K149 L150 N151 | A143-L147 WeakPolarHBondContact O-CD1 3.21Å; A143-L147 PolarHBondContact O-N 3.07Å; M145-L147 VanDerWaalsContact C-N 3.35Å; L147-K149 VanDerWaalsContact C-N 3.33Å; L147-K149 PolarHBondContact O-N 3.27Å; L147-L150 PolarHBondContact O-N 2.91Å; L147-N151 PolarHBondContact O-N 3.14Å; L147-N151 VanDerWaalsContact O-N 3.15Å |
| 148 | Q | 65.4 | Low | 60.3 | Low | 128 Ų | 128 | 122.1 Ų | 122.1 | 60% | 0.598 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -60.2 | -42.8 | 172.9 | -97.7 | 174.4 | 82.2 | 0 | 0 | 112 | S144 M145 L150 N151 T152 | S144-Q148 PolarHBondContact O-N 3.48Å; M145-Q148 PolarHBondContact O-N 3.29Å; Q148-L150 PolarHBondContact O-N 2.98Å; Q148-N151 PolarHBondContact O-N 3.24Å; Q148-T152 PolarHBondContact O-N 3.47Å; Q148-T152 PolarHBondContact O-OG1 2.77Å |
| 149 | K | 57.9 | Low | 59.9 | Low | 168 Ų | 168 | 126 Ų | 126 | 73% | 0.73 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -60.1 | -25.9 | 178.3 | -167.2 | -179.7 | 174.9 | -172.2 | 0 | 113 | M145 H146 L147 | M145-K149 WeakPolarHBondContact O-CB 3.43Å; M145-K149 PolarHBondContact O-N 2.6Å; H146-K149 WeakPolarHBondContact O-CB 3.45Å; H146-K149 PolarHBondContact O-N 3.07Å; L147-K149 VanDerWaalsContact C-N 3.33Å; L147-K149 PolarHBondContact O-N 3.27Å |
| 150 | L | 57.9 | Low | 59.1 | Low | 140 Ų | 140 | 121.8 Ų | 121.8 | 73% | 0.733 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -87.8 | -23.9 | 176 | -63.2 | 173 | 0 | 0 | 0 | 113 | H146 L147 Q148 | H146-L150 WeakPolarHBondContact O-CG 3.35Å; H146-L150 PolarHBondContact O-N 3.1Å; L147-L150 PolarHBondContact O-N 2.91Å; Q148-L150 PolarHBondContact O-N 2.98Å |
| 151 | N | 53.9 | Low | 58.7 | Low | 109 Ų | 109 | 123.4 Ų | 123.4 | 58% | 0.583 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -86.9 | -20.4 | -177.9 | -156.3 | -55.9 | 0 | 0 | 0 | 113.1 | L147 Q148 Q153 | L147-N151 PolarHBondContact O-N 3.14Å; L147-N151 VanDerWaalsContact O-N 3.15Å; Q148-N151 PolarHBondContact O-N 3.24Å; N151-Q153 PolarHBondContact O-N 3.44Å |
| 152 | T | 56.3 | Low | 57.3 | Low | 107 Ų | 107 | 127.7 Ų | 127.7 | 66% | 0.656 | 68% | 0.679 | S | S | * | * | G | 310 helix | trans | -65.2 | -12.1 | -177.8 | -7.3 | 0 | 0 | 0 | 0 | 114.7 | Q148 Y154 | Q148-T152 PolarHBondContact O-N 3.47Å; Q148-T152 PolarHBondContact O-OG1 2.77Å; T152-Y154 VanDerWaalsContact C-N 3.26Å; T152-Y154 PolarHBondContact O-N 3.45Å |
| 153 | Q | 54.9 | Low | 56.3 | Low | 178 Ų | 178 | 129.3 Ų | 129.3 | 83% | 0.832 | 69% | 0.69 | S | S | * | * | G | 310 helix | trans | -79.6 | -1.7 | -171.3 | -140.7 | 175.2 | -65.1 | 0 | 0 | 114.9 | N151 | N151-Q153 PolarHBondContact O-N 3.44Š|
| 154 | Y | 49.9 | Very low | 54.9 | Low | 220 Ų | 220 | 132.6 Ų | 132.6 | 86% | 0.863 | 71% | 0.71 | S | S | * | * | G | 310 helix | trans | -115.5 | -3.5 | -178.8 | -104.2 | -90.2 | 0 | 0 | 0 | 115.7 | T152 | T152-Y154 VanDerWaalsContact C-N 3.26Å; T152-Y154 PolarHBondContact O-N 3.45Å |
| 155 | H | 51.9 | Low | 53.7 | Low | 166 Ų | 166 | 137.2 Ų | 137.2 | 77% | 0.769 | 73% | 0.731 | S | S | * | * | S | Bend | trans | -104.5 | 18.2 | -168.8 | -85.9 | 87.8 | 0 | 0 | 0 | 116.6 | | |
| 156 | G | 50.5 | Low | 52.3 | Low | 54 Ų | 54 | 140.8 Ų | 140.8 | 56% | 0.557 | 75% | 0.746 | S | S | * | * | | | trans | 178.5 | 89.8 | 171.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | | |
| 157 | H | 46.1 | Very low | 51.3 | Low | 178 Ų | 178 | 144.1 Ų | 144.1 | 82% | 0.824 | 76% | 0.764 | S | S | * | * | | | trans | -121.7 | 102.5 | 149.8 | -87.1 | 45.5 | 0 | 0 | 0 | 107.4 | L159 | H157-L159 PolarHBondContact O-N 3.02Š|
| 158 | P | 47.8 | Very low | 49.9 | Very low | 123 Ų | 123 | 141.6 Ų | 141.6 | 80% | 0.799 | 77% | 0.767 | S | S | * | * | | | trans | -69.4 | 115 | 164.3 | 29.3 | -27.9 | 0 | 0 | 0 | 106.4 | G160 | P158-G160 VanDerWaalsContact C-N 3.31Å; P158-G160 PolarHBondContact O-N 2.97Å |
| 159 | L | 50 | Low | 48.6 | Very low | 174 Ų | 174 | 143.7 Ų | 143.7 | 91% | 0.911 | 78% | 0.782 | S | S | * | * | | | trans | -63.8 | 92.9 | 174.2 | -68 | 170.3 | 0 | 0 | 0 | 109 | H157 | H157-L159 PolarHBondContact O-N 3.02Š|
| 160 | G | 44.2 | Very low | 47.7 | Very low | 60 Ų | 60 | 138.7 Ų | 138.7 | 62% | 0.619 | 78% | 0.779 | S | S | * | * | | | trans | -75.4 | 145.6 | 161 | 0 | 0 | 0 | 0 | 0 | 110.1 | P158 M162 | P158-G160 VanDerWaalsContact C-N 3.31Å; P158-G160 PolarHBondContact O-N 2.97Å; G160-M162 PolarHBondContact O-N 2.71Å |
| 161 | P | 58.8 | Low | 47.4 | Very low | 133 Ų | 133 | 137.2 Ų | 137.2 | 86% | 0.864 | 79% | 0.786 | S | S | * | * | | | trans | -80.8 | 121.1 | -173.8 | 32.3 | -30.6 | 0 | 0 | 0 | 109.8 | | |
| 162 | M | 47.3 | Very low | 47.1 | Very low | 189 Ų | 189 | 135.7 Ų | 135.7 | 93% | 0.931 | 79% | 0.789 | S | S | * | * | | | trans | -127.5 | 95.4 | 163.3 | -110.8 | -164.2 | 178.1 | 0 | 0 | 111.6 | G160 S164 | G160-M162 PolarHBondContact O-N 2.71Å; M162-S164 PolarHBondContact O-N 2.73Å |
| 163 | N | 48.4 | Very low | 46.8 | Very low | 143 Ų | 143 | 139 Ų | 139 | 77% | 0.765 | 80% | 0.797 | S | S | * | * | | | trans | -37.3 | 118.2 | 143.2 | 179.2 | 10.2 | 0 | 0 | 0 | 112 | | |
| 164 | S | 35.8 | Very low | 46.1 | Very low | 114 Ų | 114 | 140.7 Ų | 140.7 | 80% | 0.797 | 80% | 0.797 | S | S | * | * | | | trans | -162 | 123.6 | 145.3 | -161.2 | 0 | 0 | 0 | 0 | 111 | M162 | M162-S164 PolarHBondContact O-N 2.73Š|
| 165 | N | 42.2 | Very low | 46.1 | Very low | 146 Ų | 146 | 141.7 Ų | 141.7 | 78% | 0.781 | 80% | 0.799 | S | S | * | * | | | trans | -63.6 | 126.5 | 179 | -67.1 | -21.1 | 0 | 0 | 0 | 112.1 | | |
| 166 | H | 43.3 | Very low | 46.2 | Very low | 189 Ų | 189 | 141.4 Ų | 141.4 | 88% | 0.875 | 80% | 0.802 | S | S | * | * | | | trans | -123.8 | 105.6 | 149 | -157.2 | 71.6 | 0 | 0 | 0 | 108.9 | | |
| 167 | M | 45.3 | Very low | 46.2 | Very low | 187 Ų | 187 | 141 Ų | 141 | 92% | 0.921 | 80% | 0.797 | S | S | * | * | | | trans | -75.8 | 131.5 | -176 | -171 | 148.4 | 167.6 | 0 | 0 | 110 | | |
| 168 | G | 40.1 | Very low | 46.6 | Very low | 68 Ų | 68 | 138.8 Ų | 138.8 | 70% | 0.701 | 80% | 0.799 | S | S | * | * | | | trans | 178.5 | 60.5 | 179.2 | 0 | 0 | 0 | 0 | 0 | 117.3 | | |
| 169 | N | 38.4 | Very low | 46.8 | Very low | 171 Ų | 171 | 137.3 Ų | 137.3 | 91% | 0.914 | 80% | 0.797 | S | S | * | * | | | trans | 74.6 | 116.7 | 143.1 | -149.6 | 16.2 | 0 | 0 | 0 | 120.2 | | |
| 170 | G | 39.2 | Very low | 46.7 | Very low | 64 Ų | 64 | 137.9 Ų | 137.9 | 66% | 0.66 | 80% | 0.795 | S | S | * | * | | | trans | 85.8 | 80.5 | 138 | 0 | 0 | 0 | 0 | 0 | 118 | A172 | G170-A172 PolarHBondContact O-N 3.31Å; G170-A172 VanDerWaalsContact O-N 3.07Å |
| 171 | A | 51.6 | Low | 46.9 | Very low | 108 Ų | 108 | 142.3 Ų | 142.3 | 89% | 0.893 | 80% | 0.804 | S | S | * | * | | | trans | -61.7 | 104.4 | 155.5 | 0 | 0 | 0 | 0 | 0 | 110.2 | | |
| 172 | A | 46.7 | Very low | 46.5 | Very low | 77 Ų | 77 | 139.9 Ų | 139.9 | 64% | 0.636 | 80% | 0.795 | S | S | * | * | | | trans | -130.2 | 100.9 | 158.5 | 0 | 0 | 0 | 0 | 0 | 108 | G170 Y174 | G170-A172 PolarHBondContact O-N 3.31Å; G170-A172 VanDerWaalsContact O-N 3.07Å; A172-Y174 HydrophobicContact CB-CE2 4.38Å; A172-Y174 PolarHBondContact O-N 3.44Å |
| 173 | Q | 51.6 | Low | 46.3 | Very low | 177 Ų | 177 | 138.1 Ų | 138.1 | 83% | 0.827 | 79% | 0.789 | S | S | * | * | | | trans | -62.3 | 109.9 | 174.6 | -64.9 | -91.6 | -54.6 | 0 | 0 | 109.7 | | |
| 174 | Y | 40 | Very low | 46.4 | Very low | 214 Ų | 214 | 140 Ų | 140 | 84% | 0.839 | 80% | 0.796 | S | S | * | * | | | trans | -115.8 | 89.8 | 160.3 | -78.4 | -86 | 0 | 0 | 0 | 108.8 | A172 I176 | A172-Y174 HydrophobicContact CB-CE2 4.38Å; A172-Y174 PolarHBondContact O-N 3.44Å; Y174-I176 PolarHBondContact O-N 3.01Å |
| 175 | R | 49.7 | Very low | 46.9 | Very low | 240 Ų | 240 | 142.6 Ų | 142.6 | 91% | 0.906 | 80% | 0.795 | S | S | * | * | | | trans | -56.2 | 111 | 160.2 | -98.3 | -176.4 | -176.8 | -103.4 | 3.4 | 108 | G177 | R175-G177 PolarHBondContact O-N 2.98Š|
| 176 | I | 54.1 | Low | 47.1 | Very low | 161 Ų | 161 | 144.2 Ų | 144.2 | 83% | 0.826 | 80% | 0.798 | S | S | * | * | | | trans | -76.8 | 115 | 161.9 | -61.7 | 173.1 | 0 | 0 | 0 | 106.4 | Y174 | Y174-I176 PolarHBondContact O-N 3.01Š|
| 177 | G | 49.3 | Very low | 47.1 | Very low | 44 Ų | 44 | 144 Ų | 144 | 45% | 0.454 | 80% | 0.8 | S | S | . | * | | | trans | -79.8 | 158.5 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | R175 A179 | R175-G177 PolarHBondContact O-N 2.98Å; G177-A179 PolarHBondContact O-N 3.13Å |
| 178 | P | 54.7 | Low | 46.9 | Very low | 133 Ų | 133 | 139.8 Ų | 139.8 | 86% | 0.864 | 80% | 0.795 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.4 | 22.7 | -168.8 | 32.9 | -36.2 | 0 | 0 | 0 | 115 | | |
| 179 | A | 51.5 | Low | 46.8 | Very low | 91 Ų | 91 | 139.8 Ų | 139.8 | 75% | 0.752 | 80% | 0.795 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.2 | -2.8 | -171.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | G177 | G177-A179 PolarHBondContact O-N 3.13Š|
| 180 | Q | 48.2 | Very low | 47.5 | Very low | 186 Ų | 186 | 138.4 Ų | 138.4 | 87% | 0.869 | 80% | 0.795 | S | S | * | * | S | Bend | trans | -97.1 | 9 | -179.8 | -71.4 | -148 | 2.2 | 0 | 0 | 115.2 | | |
| 181 | L | 49.8 | Very low | 48.1 | Very low | 153 Ų | 153 | 139.3 Ų | 139.3 | 80% | 0.801 | 80% | 0.796 | S | S | * | * | S | Bend | trans | -95.8 | 1 | 179.8 | -103.2 | 138.8 | 0 | 0 | 0 | 114.5 | | |
| 182 | A | 49.8 | Very low | 47.9 | Very low | 82 Ų | 82 | 140.1 Ų | 140.1 | 68% | 0.678 | 79% | 0.785 | S | S | * | * | S | Bend | trans | -91.9 | -8 | -173.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | | |
| 183 | N | 42.8 | Very low | 47.7 | Very low | 153 Ų | 153 | 140.4 Ų | 140.4 | 82% | 0.818 | 79% | 0.787 | S | S | * | * | S | Bend | trans | -105.4 | 18.2 | -174.5 | -150.4 | -9.8 | 0 | 0 | 0 | 114.5 | | |
| 184 | M | 50.8 | Low | 47.5 | Very low | 182 Ų | 182 | 139.3 Ų | 139.3 | 90% | 0.897 | 79% | 0.786 | S | S | * | * | S | Bend | trans | -132.1 | 37.9 | 174.6 | -78.2 | -154 | 77.8 | 0 | 0 | 112.5 | | |
| 185 | Q | 46.8 | Very low | 48 | Very low | 168 Ų | 168 | 135.9 Ų | 135.9 | 79% | 0.785 | 78% | 0.782 | S | S | * | * | | | trans | -109.1 | 22.9 | 174 | -66.7 | -162.7 | -60.1 | 0 | 0 | 113.4 | | |
| 186 | Q | 45.4 | Very low | 48.2 | Very low | 180 Ų | 180 | 127.2 Ų | 127.2 | 84% | 0.841 | 77% | 0.768 | S | S | * | * | | | trans | -114.9 | 57.5 | -179.9 | -65.7 | -84.6 | -42.2 | 0 | 0 | 111 | | |
| 187 | M | 44.4 | Very low | 48.2 | Very low | 186 Ų | 186 | 127.4 Ų | 127.4 | 92% | 0.916 | 77% | 0.767 | S | S | * | * | S | Bend | trans | 178 | 122.5 | 135.3 | -122.2 | 120.9 | 179.4 | 0 | 0 | 111.4 | | |
| 188 | A | 40.3 | Very low | 48.6 | Very low | 98 Ų | 98 | 130.7 Ų | 130.7 | 81% | 0.81 | 77% | 0.774 | S | S | * | * | | | trans | 42.3 | 114.6 | 142 | 0 | 0 | 0 | 0 | 0 | 121.3 | | |
| 189 | G | 38.6 | Very low | 48.8 | Very low | 68 Ų | 68 | 127.7 Ų | 127.7 | 70% | 0.701 | 76% | 0.76 | S | S | * | * | | | trans | 87.2 | 134.7 | 135.8 | 0 | 0 | 0 | 0 | 0 | 118.3 | A191 | G189-A191 PolarHBondContact O-N 3.11Š|
| 190 | P | 53.3 | Low | 49.4 | Very low | 141 Ų | 141 | 130.1 Ų | 130.1 | 92% | 0.916 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -89.6 | 83.8 | 168.6 | 35.4 | -26.2 | 0 | 0 | 0 | 109.1 | | |
| 191 | A | 50.1 | Low | 50.3 | Low | 83 Ų | 83 | 128.3 Ų | 128.3 | 69% | 0.686 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -152.9 | 118.3 | 164.9 | 0 | 0 | 0 | 0 | 0 | 109.5 | G189 | G189-A191 PolarHBondContact O-N 3.11Š|
| 192 | L | 47.4 | Very low | 51.7 | Low | 125 Ų | 125 | 125 Ų | 125 | 65% | 0.654 | 74% | 0.736 | S | S | * | * | | | trans | 68.5 | 76.9 | 167.5 | -43.6 | -174.6 | 0 | 0 | 0 | 114.8 | L194 L227 | L192-L194 PolarHBondContact O-N 3.26Å; L192-L227 HydrophobicContact CD2-CD1 4.13Å |
| 193 | A | 42.3 | Very low | 53.4 | Low | 83 Ų | 83 | 125.3 Ų | 125.3 | 69% | 0.686 | 73% | 0.727 | S | S | * | * | | | trans | -68.6 | 64.7 | 152.6 | 0 | 0 | 0 | 0 | 0 | 109.8 | N195 | A193-N195 VanDerWaalsContact CB-ND2 3.31Å; A193-N195 WeakPolarHBondContact CB-ND2 3.27Å; A193-N195 PolarHBondContact O-N 2.83Å; A193-N195 PolarHBondContact O-ND2 2.81Å |
| 194 | L | 49.1 | Very low | 55.4 | Low | 155 Ų | 155 | 124 Ų | 124 | 81% | 0.812 | 72% | 0.716 | S | S | * | * | | | trans | -67.5 | 82 | 150.7 | -78.8 | 169.2 | 0 | 0 | 0 | 105.1 | L192 G196 | L192-L194 PolarHBondContact O-N 3.26Å; L194-G196 PolarHBondContact O-N 2.9Å |
| 195 | N | 48.8 | Very low | 57.1 | Low | 142 Ų | 142 | 122.4 Ų | 122.4 | 76% | 0.759 | 71% | 0.706 | S | S | * | * | | | trans | -65.3 | 91.6 | -170 | -79.2 | -85.8 | 0 | 0 | 0 | 110.9 | A193 M197 | A193-N195 VanDerWaalsContact CB-ND2 3.31Å; A193-N195 WeakPolarHBondContact CB-ND2 3.27Å; A193-N195 PolarHBondContact O-N 2.83Å; A193-N195 PolarHBondContact O-ND2 2.81Å; N195-M197 PolarHBondContact O-N 2.96Å |
| 196 | G | 55.8 | Low | 59.2 | Low | 58 Ų | 58 | 118.1 Ų | 118.1 | 60% | 0.598 | 69% | 0.691 | S | S | * | * | S | Bend | | 70.4 | 22.5 | 125 | 0 | 0 | 0 | 0 | 0 | 120 | L194 | L194-G196 PolarHBondContact O-N 2.9Š|
| 197 | M | 53.2 | Low | 61.3 | Low | 164 Ų | 164 | 113.5 Ų | 113.5 | 81% | 0.808 | 67% | 0.672 | S | S | * | * | S | Bend | trans | -133.8 | -13.2 | 171.3 | -72.9 | -160.8 | 155.3 | 0 | 0 | 116.5 | N195 M201 | N195-M197 PolarHBondContact O-N 2.96Å; M197-M201 WeakPolarHBondContact O-CE 3.32Å |
| 198 | D | 57.7 | Low | 63.4 | Low | 114 Ų | 114 | 108 Ų | 108 | 61% | 0.61 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -113.8 | -25.7 | -173.1 | -159.1 | -114 | 0 | 0 | 0 | 113.8 | M201 | D198-M201 PolarHBondContact O-N 3.26Š|
| 199 | A | 58.7 | Low | 65.7 | Low | 69 Ų | 69 | 106.3 Ų | 106.3 | 57% | 0.57 | 63% | 0.631 | S | S | * | * | G | 310 helix | trans | -70.9 | -32 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | M201 I202 | A199-M201 PolarHBondContact O-N 3.36Å; A199-I202 WeakPolarHBondContact O-CB 3.35Å; A199-I202 PolarHBondContact O-N 2.87Å; A199-I202 VanDerWaalsContact O-N 3.11Å |
| 200 | D | 63.4 | Low | 68.2 | Low | 143 Ų | 143 | 106.9 Ų | 106.9 | 77% | 0.765 | 62% | 0.617 | S | S | * | * | G | 310 helix | trans | -70.5 | -16.2 | -178.7 | -57.6 | -46 | 0 | 0 | 0 | 113.4 | | |
| 201 | M | 67.4 | Low | 70 | Confident | 148 Ų | 148 | 102.4 Ų | 102.4 | 73% | 0.729 | 59% | 0.587 | S | S | * | * | G | 310 helix | trans | -88.9 | -10.7 | 174.4 | -70.8 | -172 | -79.6 | 0 | 0 | 112.8 | M197 D198 A199 | M197-M201 WeakPolarHBondContact O-CE 3.32Å; D198-M201 PolarHBondContact O-N 3.26Å; A199-M201 PolarHBondContact O-N 3.36Å |
| 202 | I | 79.1 | Confident | 71.8 | Confident | 83 Ų | 83 | 104.4 Ų | 104.4 | 43% | 0.426 | 58% | 0.584 | S | S | . | * | S | Bend | trans | -85.8 | 125.5 | 179.8 | -59.4 | 173.5 | 0 | 0 | 0 | 107.8 | A199 E204 | A199-I202 WeakPolarHBondContact O-CB 3.35Å; A199-I202 PolarHBondContact O-N 2.87Å; A199-I202 VanDerWaalsContact O-N 3.11Å; I202-E204 PolarHBondContact O-N 2.95Å |
| 203 | D | 86.9 | Confident | 73.9 | Confident | 88 Ų | 88 | 105.9 Ų | 105.9 | 47% | 0.471 | 59% | 0.588 | S | S | . | * | | | trans | -70 | 128 | 177.2 | -170.9 | -2.3 | 0 | 0 | 0 | 110.5 | E205 V206 L207 | D203-E205 PolarHBondContact O-N 2.94Å; D203-E205 PolarHBondContact OD1-N 3.06Å; D203-E205 VanDerWaalsContact OD1-N 3.14Å; D203-V206 HydrophobicContact CB-CB 4.38Å; D203-V206 HydrophobicContact CB-CG2 4.05Å; D203-V206 WeakPolarHBondContact O-CB 3.19Å; D203-V206 PolarHBondContact O-N 2.87Å; D203-L207 PolarHBondContact O-N 3.31Å |
| 204 | E | 84.4 | Confident | 76.2 | Confident | 126 Ų | 126 | 107.8 Ų | 107.8 | 59% | 0.589 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -58.9 | -30.3 | 177.4 | -65.5 | -64.8 | 161 | 0 | 0 | 111.7 | I202 V206 L207 T208 | I202-E204 PolarHBondContact O-N 2.95Å; E204-V206 VanDerWaalsContact C-N 3.34Å; E204-L207 PolarHBondContact O-N 3.39Å; E204-T208 VanDerWaalsContact O-CB 3.27Å; E204-T208 WeakPolarHBondContact O-CB 3.45Å; E204-T208 PolarHBondContact O-N 3.19Å; E204-T208 PolarHBondContact O-OG1 3.2Å |
| 205 | E | 86.3 | Confident | 78 | Confident | 148 Ų | 148 | 100.8 Ų | 100.8 | 69% | 0.692 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -68 | -36.2 | 176 | -62.3 | -160.3 | 111 | 0 | 0 | 111.7 | D203 S209 | D203-E205 PolarHBondContact O-N 2.94Å; D203-E205 PolarHBondContact OD1-N 3.06Å; D203-E205 VanDerWaalsContact OD1-N 3.14Å; E205-S209 WeakPolarHBondContact O-CB 3.48Å; E205-S209 PolarHBondContact O-N 2.69Å; E205-S209 PolarHBondContact O-OG 2.95Å |
| 206 | V | 90.1 | Very high | 79.8 | Confident | 79 Ų | 79 | 98 Ų | 98 | 48% | 0.479 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -72.2 | -42.9 | 175.1 | 177 | 0 | 0 | 0 | 0 | 110.1 | D203 E204 T208 S209 L210 | D203-V206 HydrophobicContact CB-CB 4.38Å; D203-V206 HydrophobicContact CB-CG2 4.05Å; D203-V206 WeakPolarHBondContact O-CB 3.19Å; D203-V206 PolarHBondContact O-N 2.87Å; E204-V206 VanDerWaalsContact C-N 3.34Å; V206-T208 PolarHBondContact O-N 3.49Å; V206-S209 WeakPolarHBondContact O-CB 3.31Å; V206-S209 PolarHBondContact O-N 3.49Å; V206-L210 HydrophobicContact CG1-CD1 4.25Å; V206-L210 WeakPolarHBondContact O-CG 3.48Å; V206-L210 PolarHBondContact O-N 3.48Å |
| 207 | L | 90.3 | Very high | 81.3 | Confident | 82 Ų | 82 | 101.7 Ų | 101.7 | 43% | 0.429 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -60.9 | -45.1 | 176.4 | -175.6 | 60.9 | 0 | 0 | 0 | 111.5 | D203 E204 S209 L210 V211 | D203-L207 PolarHBondContact O-N 3.31Å; E204-L207 PolarHBondContact O-N 3.39Å; L207-S209 VanDerWaalsContact C-N 3.33Å; L207-S209 PolarHBondContact O-N 2.94Å; L207-L210 PolarHBondContact O-N 3.5Å; L207-V211 VanDerWaalsContact O-CG2 3.32Å; L207-V211 WeakPolarHBondContact O-CG2 2.99Å; L207-V211 PolarHBondContact O-N 3.29Å |
| 208 | T | 87.4 | Confident | 82.9 | Confident | 72 Ų | 72 | 103.1 Ų | 103.1 | 44% | 0.442 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -64.2 | -39.3 | 176.5 | -56.2 | 0 | 0 | 0 | 0 | 111.4 | E204 V206 V211 M212 | E204-T208 VanDerWaalsContact O-CB 3.27Å; E204-T208 WeakPolarHBondContact O-CB 3.45Å; E204-T208 PolarHBondContact O-N 3.19Å; E204-T208 PolarHBondContact O-OG1 3.2Å; V206-T208 PolarHBondContact O-N 3.49Å; T208-V211 PolarHBondContact O-N 3.41Å; T208-M212 HydrophobicContact CG2-CE 4.2Å; T208-M212 WeakPolarHBondContact O-CG 3.3Å; T208-M212 PolarHBondContact O-N 2.98Å |
| 209 | S | 89.9 | Confident | 84.2 | Confident | 61 Ų | 61 | 101.8 Ų | 101.8 | 43% | 0.427 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -60.5 | -46.3 | 174.4 | -62.4 | 0 | 0 | 0 | 0 | 111.3 | E205 V206 L207 V211 M212 E213 | E205-S209 WeakPolarHBondContact O-CB 3.48Å; E205-S209 PolarHBondContact O-N 2.69Å; E205-S209 PolarHBondContact O-OG 2.95Å; V206-S209 WeakPolarHBondContact O-CB 3.31Å; V206-S209 PolarHBondContact O-N 3.49Å; L207-S209 VanDerWaalsContact C-N 3.33Å; L207-S209 PolarHBondContact O-N 2.94Å; S209-V211 PolarHBondContact O-N 3.47Å; S209-M212 PolarHBondContact O-N 3.28Å; S209-E213 WeakPolarHBondContact O-CB 3.47Å; S209-E213 PolarHBondContact O-N 2.89Å |
| 210 | L | 91.3 | Very high | 85.2 | Confident | 80 Ų | 80 | 108 Ų | 108 | 42% | 0.419 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -63.7 | -38.8 | 176.6 | -69.5 | 171.1 | 0 | 0 | 0 | 112.2 | V206 L207 E213 L214 | V206-L210 HydrophobicContact CG1-CD1 4.25Å; V206-L210 WeakPolarHBondContact O-CG 3.48Å; V206-L210 PolarHBondContact O-N 3.48Å; L207-L210 PolarHBondContact O-N 3.5Å; L210-E213 PolarHBondContact O-N 3.35Å; L210-L214 WeakPolarHBondContact O-CB 3.44Å; L210-L214 VanDerWaalsContact O-CG 3.27Å; L210-L214 WeakPolarHBondContact O-CG 3.44Å; L210-L214 PolarHBondContact O-N 3.15Å |
| 211 | V | 90.7 | Very high | 85.9 | Confident | 47 Ų | 47 | 109.4 Ų | 109.4 | 29% | 0.285 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -60.6 | -45.7 | 175.3 | 164.1 | 0 | 0 | 0 | 0 | 111.4 | L207 T208 S209 G215 L216 D217 | L207-V211 VanDerWaalsContact O-CG2 3.32Å; L207-V211 WeakPolarHBondContact O-CG2 2.99Å; L207-V211 PolarHBondContact O-N 3.29Å; T208-V211 PolarHBondContact O-N 3.41Å; S209-V211 PolarHBondContact O-N 3.47Å; V211-G215 CarbonylContact O-C 3.54Å; V211-G215 WeakPolarHBondContact O-CA 3.46Å; V211-G215 PolarHBondContact O-N 2.87Å; V211-L216 HydrophobicContact CG1-CB 4.21Å; V211-L216 HydrophobicContact CG2-CD1 4.35Å; V211-L216 PolarHBondContact O-N 3.19Å; V211-D217 HydrophobicContact CG1-CB 4.29Å |
| 212 | M | 88.1 | Confident | 86.4 | Confident | 125 Ų | 125 | 109.3 Ų | 109.3 | 62% | 0.616 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -68.6 | -42.9 | 177.4 | -70.2 | -172.2 | -66.7 | 0 | 0 | 111.8 | T208 S209 G215 | T208-M212 HydrophobicContact CG2-CE 4.2Å; T208-M212 WeakPolarHBondContact O-CG 3.3Å; T208-M212 PolarHBondContact O-N 2.98Å; S209-M212 PolarHBondContact O-N 3.28Å; M212-G215 PolarHBondContact O-N 3.34Å; M212-G215 VanDerWaalsContact O-N 3.15Å |
| 213 | E | 91.4 | Very high | 86.3 | Confident | 157 Ų | 157 | 109.3 Ų | 109.3 | 73% | 0.734 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -67.3 | -42.3 | -177.5 | -175.3 | 162 | -150.7 | 0 | 0 | 112.2 | S209 L210 G215 | S209-E213 WeakPolarHBondContact O-CB 3.47Å; S209-E213 PolarHBondContact O-N 2.89Å; L210-E213 PolarHBondContact O-N 3.35Å; E213-G215 PolarHBondContact O-N 3.02Å |
| 214 | L | 89.8 | Confident | 85.9 | Confident | 122 Ų | 122 | 113 Ų | 113 | 64% | 0.639 | 57% | 0.571 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.5 | -7.2 | 173.7 | -62.4 | 173.9 | 0 | 0 | 0 | 112.6 | L210 L216 | L210-L214 WeakPolarHBondContact O-CB 3.44Å; L210-L214 VanDerWaalsContact O-CG 3.27Å; L210-L214 WeakPolarHBondContact O-CG 3.44Å; L210-L214 PolarHBondContact O-N 3.15Å; L214-L216 VanDerWaalsContact C-N 3.25Å; L214-L216 HydrophobicContact CB-CD1 4.42Å; L214-L216 HydrophobicContact CB-CD2 4.3Å; L214-L216 HydrophobicContact CB-CG 3.91Å; L214-L216 HydrophobicContact CD1-CD1 4.41Å; L214-L216 PolarHBondContact O-N 3.17Å |
| 215 | G | 86.8 | Confident | 85.4 | Confident | 8 Ų | 8 | 113.5 Ų | 113.5 | 8% | 0.082 | 58% | 0.577 | C | S | . | * | T | Hydrogen-bonded Turn | trans | 65.6 | 25.7 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114 | V211 M212 E213 D217 R218 | V211-G215 CarbonylContact O-C 3.54Å; V211-G215 WeakPolarHBondContact O-CA 3.46Å; V211-G215 PolarHBondContact O-N 2.87Å; M212-G215 PolarHBondContact O-N 3.34Å; M212-G215 VanDerWaalsContact O-N 3.15Å; E213-G215 PolarHBondContact O-N 3.02Å; G215-D217 PolarHBondContact O-N 3.21Å; G215-R218 PolarHBondContact O-N 3.47Å; G215-R218 VanDerWaalsContact O-N 3.09Å |
| 216 | L | 88 | Confident | 84.6 | Confident | 85 Ų | 85 | 115.1 Ų | 115.1 | 45% | 0.445 | 58% | 0.582 | S | S | . | * | G | 310 helix | trans | -62.8 | -26.4 | 179.9 | -59.3 | 179.5 | 0 | 0 | 0 | 111.9 | V211 L214 R218 I219 | V211-L216 HydrophobicContact CG1-CB 4.21Å; V211-L216 HydrophobicContact CG2-CD1 4.35Å; V211-L216 PolarHBondContact O-N 3.19Å; L214-L216 VanDerWaalsContact C-N 3.25Å; L214-L216 HydrophobicContact CB-CD1 4.42Å; L214-L216 HydrophobicContact CB-CD2 4.3Å; L214-L216 HydrophobicContact CB-CG 3.91Å; L214-L216 HydrophobicContact CD1-CD1 4.41Å; L214-L216 PolarHBondContact O-N 3.17Å; L216-R218 PolarHBondContact O-N 2.98Å; L216-R218 VanDerWaalsContact O-N 3.16Å; L216-I219 HydrophobicContact CD2-CD1 3.57Å; L216-I219 PolarHBondContact O-N 3.19Å; L216-I219 VanDerWaalsContact O-N 3.15Å |
| 217 | D | 86.2 | Confident | 83.4 | Confident | 135 Ų | 135 | 117.2 Ų | 117.2 | 72% | 0.722 | 59% | 0.59 | S | S | * | * | G | 310 helix | trans | -57.4 | -24.8 | 172.9 | 178.8 | 75 | 0 | 0 | 0 | 113.6 | V211 G215 | V211-D217 HydrophobicContact CG1-CB 4.29Å; G215-D217 PolarHBondContact O-N 3.21Å |
| 218 | R | 86.6 | Confident | 82 | Confident | 193 Ų | 193 | 115.5 Ų | 115.5 | 73% | 0.728 | 59% | 0.592 | S | S | * | * | G | 310 helix | trans | -94.9 | -5.3 | -177.7 | -60.8 | -177.7 | -70 | -151.8 | -4.1 | 113.5 | G215 L216 Q220 | G215-R218 PolarHBondContact O-N 3.47Å; G215-R218 VanDerWaalsContact O-N 3.09Å; L216-R218 PolarHBondContact O-N 2.98Å; L216-R218 VanDerWaalsContact O-N 3.16Å; R218-Q220 PolarHBondContact O-N 2.92Å |
| 219 | I | 86 | Confident | 80.5 | Confident | 87 Ų | 87 | 121.3 Ų | 121.3 | 45% | 0.446 | 61% | 0.614 | S | S | . | * | | | trans | -78.7 | 111.5 | -178.7 | -61 | -179.1 | 0 | 0 | 0 | 108.3 | L216 E221 | L216-I219 HydrophobicContact CD2-CD1 3.57Å; L216-I219 PolarHBondContact O-N 3.19Å; L216-I219 VanDerWaalsContact O-N 3.15Å; I219-E221 WeakPolarHBondContact CG2-O 3.49Å |
| 220 | Q | 79.4 | Confident | 78.7 | Confident | 200 Ų | 200 | 124.7 Ų | 124.7 | 94% | 0.935 | 63% | 0.627 | S | S | * | * | S | Bend | trans | -84.9 | -21.9 | -178.5 | -70.9 | 175.9 | 84.7 | 0 | 0 | 113.1 | R218 | R218-Q220 PolarHBondContact O-N 2.92Š|
| 221 | E | 77.1 | Confident | 77 | Confident | 171 Ų | 171 | 128.8 Ų | 128.8 | 80% | 0.799 | 65% | 0.645 | S | S | * | * | S | Bend | trans | -139.9 | 125.6 | -179 | -170.1 | 175.1 | 166.1 | 0 | 0 | 109.6 | I219 | I219-E221 WeakPolarHBondContact CG2-O 3.49Š|
| 222 | L | 79.7 | Confident | 75 | Confident | 147 Ų | 147 | 133.8 Ų | 133.8 | 77% | 0.77 | 66% | 0.663 | S | S | * | * | P | Polyproline II helix | trans | -79.6 | 127.5 | 179.6 | -160.5 | 89.8 | 0 | 0 | 0 | 108.9 | | |
| 223 | P | 76.4 | Confident | 73.3 | Confident | 83 Ų | 83 | 133.2 Ų | 133.2 | 54% | 0.539 | 66% | 0.662 | S | S | . | * | P | Polyproline II helix | trans | -62.4 | 141.1 | 176.8 | 24.7 | -33.4 | 0 | 0 | 0 | 111.2 | L225 | P223-L225 PolarHBondContact O-N 3.36Š|
| 224 | E | 78.1 | Confident | 71.4 | Confident | 166 Ų | 166 | 135.7 Ų | 135.7 | 78% | 0.776 | 67% | 0.671 | S | S | * | * | P | Polyproline II helix | trans | -66.3 | 116.2 | 172.1 | -69.3 | -174.2 | -178.6 | 0 | 0 | 109.9 | F226 | E224-F226 HydrophobicContact CB-CE2 4.34Š|
| 225 | L | 74.4 | Confident | 69.6 | Low | 135 Ų | 135 | 134.5 Ų | 134.5 | 71% | 0.707 | 66% | 0.664 | S | S | * | * | | | trans | -100.3 | 112.1 | 176.6 | -61.8 | 178.4 | 0 | 0 | 0 | 109.6 | P223 L227 | P223-L225 PolarHBondContact O-N 3.36Å; L225-L227 PolarHBondContact O-N 2.91Å |
| 226 | F | 69.6 | Low | 67.9 | Low | 182 Ų | 182 | 136.3 Ų | 136.3 | 80% | 0.798 | 68% | 0.675 | S | S | * | * | | | trans | -83.9 | 95.5 | 168.2 | -64 | -82.3 | 0 | 0 | 0 | 109 | E224 G228 | E224-F226 HydrophobicContact CB-CE2 4.34Å; F226-G228 PolarHBondContact O-N 3.42Å |
| 227 | L | 64.8 | Low | 66.3 | Low | 123 Ų | 123 | 136.7 Ų | 136.7 | 64% | 0.644 | 68% | 0.678 | S | S | * | * | | | trans | -73.7 | 79.8 | 169.1 | -74.2 | 148.7 | 0 | 0 | 0 | 108.4 | L192 L225 | L192-L227 HydrophobicContact CD2-CD1 4.13Å; L225-L227 PolarHBondContact O-N 2.91Å |
| 228 | G | 59.3 | Low | 64.5 | Low | 47 Ų | 47 | 138.9 Ų | 138.9 | 49% | 0.485 | 68% | 0.681 | S | S | . | * | | | trans | -60.9 | 138.8 | 168.3 | 0 | 0 | 0 | 0 | 0 | 109.2 | F226 N230 | F226-G228 PolarHBondContact O-N 3.42Å; G228-N230 CarbonylContact O-C 3.21Å; G228-N230 PolarHBondContact O-N 3.16Å |
| 229 | Q | 57 | Low | 62.8 | Low | 193 Ų | 193 | 134.1 Ų | 134.1 | 90% | 0.902 | 67% | 0.674 | S | S | * | * | S | Bend | trans | -53.8 | 1.8 | 176.9 | -70.7 | -93.4 | 12.1 | 0 | 0 | 115.3 | | |
| 230 | N | 52.9 | Low | 61.2 | Low | 132 Ų | 132 | 133.6 Ų | 133.6 | 71% | 0.706 | 68% | 0.678 | S | S | * | * | | | trans | -101.9 | 84.7 | 160.7 | -62.8 | -64.9 | 0 | 0 | 0 | 107.3 | G228 F232 | G228-N230 CarbonylContact O-C 3.21Å; G228-N230 PolarHBondContact O-N 3.16Å; N230-F232 PolarHBondContact O-N 3.03Å |
| 231 | E | 53.9 | Low | 59.9 | Low | 167 Ų | 167 | 131.4 Ų | 131.4 | 78% | 0.78 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.7 | 32.9 | 178.1 | -70.1 | -179.4 | 107.7 | 0 | 0 | 113.7 | | |
| 232 | F | 50.6 | Low | 58.6 | Low | 151 Ų | 151 | 131 Ų | 131 | 66% | 0.662 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -146.3 | 13.7 | -177.4 | -101.9 | -88.6 | 0 | 0 | 0 | 115.5 | N230 F234 I235 | N230-F232 PolarHBondContact O-N 3.03Å; F232-F234 PolarHBondContact O-N 3.43Å; F232-F234 VanDerWaalsContact O-N 3.1Å; F232-I235 HydrophobicContact CD1-CB 4.43Å; F232-I235 HydrophobicContact CD1-CD1 3.43Å; F232-I235 VanDerWaalsContact CD1-CD1 3.43Å; F232-I235 HydrophobicContact CD1-CG1 3.72Å; F232-I235 HydrophobicContact CE1-CD1 3.34Å; F232-I235 HydrophobicContact CE1-CG1 4.1Å; F232-I235 PolarHBondContact O-N 3.27Å |
| 233 | D | 52.3 | Low | 57 | Low | 114 Ų | 114 | 130.7 Ų | 130.7 | 61% | 0.61 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -74.1 | 2.8 | 178.8 | -118.5 | 9.9 | 0 | 0 | 0 | 114.6 | I235 S236 | D233-I235 VanDerWaalsContact C-N 3.3Å; D233-S236 WeakPolarHBondContact OD1-CB 3.48Å; D233-S236 PolarHBondContact OD1-OG 3.39Å |
| 234 | F | 51.4 | Low | 55.3 | Low | 208 Ų | 208 | 132.2 Ų | 132.2 | 91% | 0.912 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -70.5 | -24.1 | 163.1 | -98.2 | -83.6 | 0 | 0 | 0 | 113 | F232 | F232-F234 PolarHBondContact O-N 3.43Å; F232-F234 VanDerWaalsContact O-N 3.1Å |
| 235 | I | 52.3 | Low | 53.8 | Low | 97 Ų | 97 | 129.1 Ų | 129.1 | 50% | 0.497 | 67% | 0.668 | S | S | . | * | H | α-helix | trans | -88.8 | -25.1 | 178.6 | -52.1 | -160 | 0 | 0 | 0 | 111.3 | F232 D233 D237 F238 | F232-I235 HydrophobicContact CD1-CB 4.43Å; F232-I235 HydrophobicContact CD1-CD1 3.43Å; F232-I235 VanDerWaalsContact CD1-CD1 3.43Å; F232-I235 HydrophobicContact CD1-CG1 3.72Å; F232-I235 HydrophobicContact CE1-CD1 3.34Å; F232-I235 HydrophobicContact CE1-CG1 4.1Å; F232-I235 PolarHBondContact O-N 3.27Å; D233-I235 VanDerWaalsContact C-N 3.3Å; I235-D237 PolarHBondContact O-N 3.46Å; I235-F238 PolarHBondContact O-N 3.35Å |
| 236 | S | 51.1 | Low | 52.6 | Low | 46 Ų | 46 | 129.1 Ų | 129.1 | 32% | 0.322 | 67% | 0.674 | S | S | . | * | H | α-helix | trans | -65.7 | -38.2 | -177 | -63.2 | 0 | 0 | 0 | 0 | 113.3 | D233 F238 V239 S240 | D233-S236 WeakPolarHBondContact OD1-CB 3.48Å; D233-S236 PolarHBondContact OD1-OG 3.39Å; S236-F238 PolarHBondContact O-N 3.48Å; S236-F238 VanDerWaalsContact O-N 3.07Å; S236-V239 CarbonylContact O-C 3.59Å; S236-V239 PolarHBondContact O-N 3.42Å; S236-S240 WeakPolarHBondContact O-CB 3.39Å; S236-S240 PolarHBondContact O-N 3.37Å; S236-S240 PolarHBondContact O-OG 3.46Å |
| 237 | D | 52.5 | Low | 51.4 | Low | 94 Ų | 94 | 126.2 Ų | 126.2 | 50% | 0.503 | 67% | 0.671 | S | S | . | * | H | α-helix | trans | -61.2 | -24.6 | 179.7 | -169.8 | 59.9 | 0 | 0 | 0 | 113 | I235 K241 | I235-D237 PolarHBondContact O-N 3.46Å; D237-K241 IonicContact OD1-NZ 3.56Å; D237-K241 IonicContact OD2-NZ 2.76Å; D237-K241 PolarHBondContact OD2-NZ 3.27Å |
| 238 | F | 49 | Very low | 50.2 | Low | 180 Ų | 180 | 126 Ų | 126 | 79% | 0.789 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -77.5 | -30.8 | 175 | -157.9 | -96.9 | 0 | 0 | 0 | 112.7 | I235 S236 | I235-F238 PolarHBondContact O-N 3.35Å; S236-F238 PolarHBondContact O-N 3.48Å; S236-F238 VanDerWaalsContact O-N 3.07Å |
| 239 | V | 51 | Low | 49.5 | Very low | 93 Ų | 93 | 132.8 Ų | 132.8 | 56% | 0.564 | 72% | 0.718 | S | S | * | * | H | α-helix | trans | -91.4 | -30.9 | -179.8 | -179.8 | 0 | 0 | 0 | 0 | 112.1 | S236 K241 Q242 | S236-V239 CarbonylContact O-C 3.59Å; S236-V239 PolarHBondContact O-N 3.42Å; V239-K241 PolarHBondContact O-N 3.18Å; V239-Q242 PolarHBondContact O-N 3.24Å |
| 240 | S | 52.9 | Low | 49.2 | Very low | 76 Ų | 76 | 129.8 Ų | 129.8 | 53% | 0.531 | 71% | 0.709 | S | S | . | * | H | α-helix | trans | -62 | -23.4 | 176.8 | -54.6 | 0 | 0 | 0 | 0 | 112.9 | S236 Q242 | S236-S240 WeakPolarHBondContact O-CB 3.39Å; S236-S240 PolarHBondContact O-N 3.37Å; S236-S240 PolarHBondContact O-OG 3.46Å; S240-Q242 VanDerWaalsContact C-N 3.33Å |
| 241 | K | 51.6 | Low | 49 | Very low | 155 Ų | 155 | 129.7 Ų | 129.7 | 67% | 0.674 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.1 | -4.1 | 174.7 | -70.8 | 172.5 | 178.2 | 145.7 | 0 | 113.9 | D237 V239 L243 | D237-K241 IonicContact OD1-NZ 3.56Å; D237-K241 IonicContact OD2-NZ 2.76Å; D237-K241 PolarHBondContact OD2-NZ 3.27Å; V239-K241 PolarHBondContact O-N 3.18Å; K241-L243 VanDerWaalsContact C-N 3.33Å; K241-L243 PolarHBondContact O-N 3.42Å |
| 242 | Q | 49.7 | Very low | 48.7 | Very low | 161 Ų | 161 | 127.6 Ų | 127.6 | 75% | 0.752 | 71% | 0.705 | S | S | * | * | | | trans | -97.6 | 42.3 | 173.1 | -156.6 | 179.4 | 74.2 | 0 | 0 | 112 | V239 S240 P244 | V239-Q242 PolarHBondContact O-N 3.24Å; S240-Q242 VanDerWaalsContact C-N 3.33Å; Q242-P244 WeakPolarHBondContact O-CD 3.28Å |
| 243 | L | 45.2 | Very low | 48.6 | Very low | 141 Ų | 141 | 126.2 Ų | 126.2 | 74% | 0.738 | 71% | 0.707 | S | S | * | * | | | trans | -69.5 | 116.5 | 152.2 | -79.8 | 158.8 | 0 | 0 | 0 | 106.6 | K241 S245 | K241-L243 VanDerWaalsContact C-N 3.33Å; K241-L243 PolarHBondContact O-N 3.42Å; L243-S245 PolarHBondContact O-N 2.84Å |
| 244 | P | 41.8 | Very low | 48.4 | Very low | 115 Ų | 115 | 127 Ų | 127 | 75% | 0.747 | 71% | 0.713 | S | S | * | * | | | trans | -65.3 | 89.8 | 160.9 | 27.7 | -29.9 | 0 | 0 | 0 | 106.6 | Q242 T246 | Q242-P244 WeakPolarHBondContact O-CD 3.28Å; P244-T246 VanDerWaalsContact C-N 3.32Å; P244-T246 PolarHBondContact O-N 3.33Å |
| 245 | S | 46.3 | Very low | 48.2 | Very low | 101 Ų | 101 | 121.6 Ų | 121.6 | 71% | 0.706 | 70% | 0.7 | S | S | * | * | | | trans | -58.4 | 107.1 | 156.7 | -94.8 | 0 | 0 | 0 | 0 | 105.7 | L243 V247 | L243-S245 PolarHBondContact O-N 2.84Å; S245-V247 VanDerWaalsContact C-N 3.32Å; S245-V247 PolarHBondContact O-N 3.07Å |
| 246 | T | 50.2 | Low | 47.9 | Very low | 135 Ų | 135 | 123.4 Ų | 123.4 | 83% | 0.828 | 72% | 0.715 | S | S | * | * | | | trans | -55.8 | 97.8 | 165.5 | 50 | 0 | 0 | 0 | 0 | 107.9 | P244 S248 | P244-T246 VanDerWaalsContact C-N 3.32Å; P244-T246 PolarHBondContact O-N 3.33Å; T246-S248 PolarHBondContact O-N 3.46Å |
| 247 | V | 44 | Very low | 47.6 | Very low | 121 Ų | 121 | 129.3 Ų | 129.3 | 73% | 0.733 | 75% | 0.745 | S | S | * | * | | | trans | -83.5 | 98.3 | 165.5 | 179.5 | 0 | 0 | 0 | 0 | 106.3 | S245 C249 | S245-V247 VanDerWaalsContact C-N 3.32Å; S245-V247 PolarHBondContact O-N 3.07Å; V247-C249 PolarHBondContact O-N 3.48Å |
| 248 | S | 39.1 | Very low | 47.2 | Very low | 118 Ų | 118 | 132.3 Ų | 132.3 | 83% | 0.825 | 77% | 0.765 | S | S | * | * | | | trans | -61.9 | 123.4 | 157.3 | -96.8 | 0 | 0 | 0 | 0 | 108.6 | T246 | T246-S248 PolarHBondContact O-N 3.46Š|
| 249 | C | 45.6 | Very low | 47 | Very low | 191 Ų | 191 | 127.9 Ų | 127.9 | 100% | 1.291 | 76% | 0.763 | S | S | * | * | | | trans | -138.3 | 0 | 154.4 | -75.7 | 0 | 0 | 0 | 0 | 107.3 | V247 | V247-C249 PolarHBondContact O-N 3.48Š|