| 1 | M | 40.6 | Very low | 43.4 | Very low | 254 Ų | 254 | 151 Ų | 151 | 100% | 1.251 | 87% | 0.874 | S | S | * | * | | | | 0 | 98.2 | 0 | -77.2 | 168.2 | 145.1 | 0 | 0 | 107.6 | | |
| 2 | G | 38.5 | Very low | 43.4 | Very low | 84 Ų | 84 | 146.9 Ų | 146.9 | 87% | 0.866 | 86% | 0.861 | S | S | * | * | | | trans | -125.2 | 118.1 | 176 | 0 | 0 | 0 | 0 | 0 | 108.1 | | |
| 3 | S | 42.6 | Very low | 43.4 | Very low | 113 Ų | 113 | 150.4 Ų | 150.4 | 79% | 0.79 | 86% | 0.863 | S | S | * | * | | | trans | -139.7 | 104.6 | 171.3 | -176.6 | 0 | 0 | 0 | 0 | 106.6 | | |
| 4 | G | 42.5 | Very low | 43 | Very low | 76 Ų | 76 | 147.5 Ų | 147.5 | 78% | 0.784 | 86% | 0.856 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 133.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111 | | |
| 5 | Y | 46.6 | Very low | 43.3 | Very low | 232 Ų | 232 | 146.8 Ų | 146.8 | 91% | 0.91 | 85% | 0.854 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 131.4 | 168.4 | -79.4 | -95.4 | 0 | 0 | 0 | 109.6 | | |
| 6 | L | 50.2 | Low | 43 | Very low | 176 Ų | 176 | 144.3 Ų | 144.3 | 92% | 0.921 | 85% | 0.848 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 133.4 | 170.8 | -71.8 | 161 | 0 | 0 | 0 | 110.4 | | |
| 7 | A | 41.3 | Very low | 43 | Very low | 88 Ų | 88 | 145.1 Ų | 145.1 | 73% | 0.727 | 84% | 0.841 | S | S | * | * | | | trans | -158.9 | 123.5 | 154.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | | |
| 8 | S | 42.3 | Very low | 43.2 | Very low | 105 Ų | 105 | 143.1 Ų | 143.1 | 73% | 0.734 | 84% | 0.844 | S | S | * | * | | | trans | 75.2 | 92.5 | 142.6 | -48.2 | 0 | 0 | 0 | 0 | 119 | | |
| 9 | F | 42.8 | Very low | 43.4 | Very low | 209 Ų | 209 | 143.1 Ų | 143.1 | 92% | 0.917 | 84% | 0.839 | S | S | * | * | | | trans | -107.6 | 109.5 | 145.4 | -87.1 | -83.6 | 0 | 0 | 0 | 109.4 | | |
| 10 | N | 43.7 | Very low | 43.8 | Very low | 153 Ų | 153 | 142.7 Ų | 142.7 | 82% | 0.818 | 84% | 0.839 | S | S | * | * | | | trans | -62.6 | 126.7 | 173.2 | -89.1 | -63.9 | 0 | 0 | 0 | 110.5 | | |
| 11 | L | 46.3 | Very low | 43.5 | Very low | 171 Ų | 171 | 148 Ų | 148 | 90% | 0.895 | 85% | 0.845 | S | S | * | * | | | trans | -80.3 | 112.4 | 162.7 | -84.4 | 89.3 | 0 | 0 | 0 | 109.2 | | |
| 12 | S | 43.4 | Very low | 43.7 | Very low | 102 Ų | 102 | 140.8 Ų | 140.8 | 71% | 0.713 | 82% | 0.82 | S | S | * | * | | | trans | -153.8 | 111.5 | 159.8 | -73.9 | 0 | 0 | 0 | 0 | 109.2 | | |
| 13 | H | 43.2 | Very low | 43.9 | Very low | 192 Ų | 192 | 140.2 Ų | 140.2 | 89% | 0.889 | 81% | 0.814 | S | S | * | * | | | trans | 177 | 89.6 | 147.8 | -93.1 | -67.6 | 0 | 0 | 0 | 106.5 | | |
| 14 | S | 38.3 | Very low | 44.4 | Very low | 110 Ų | 110 | 140.8 Ų | 140.8 | 77% | 0.769 | 81% | 0.814 | S | S | * | * | | | | 73.5 | 98.5 | 92.7 | -89.9 | 0 | 0 | 0 | 0 | 115.5 | | |
| 15 | V | 46.7 | Very low | 44.5 | Very low | 137 Ų | 137 | 143.2 Ų | 143.2 | 83% | 0.83 | 82% | 0.816 | S | S | * | * | | | trans | 18.1 | 125 | 133.7 | -170.4 | 0 | 0 | 0 | 0 | 118.3 | | |
| 16 | S | 39.1 | Very low | 44.3 | Very low | 107 Ų | 107 | 138.6 Ų | 138.6 | 75% | 0.748 | 81% | 0.812 | S | S | * | * | | | trans | 167.1 | 129.8 | 147 | -76.5 | 0 | 0 | 0 | 0 | 105.8 | | |
| 17 | E | 42.8 | Very low | 44.3 | Very low | 158 Ų | 158 | 138.3 Ų | 138.3 | 74% | 0.738 | 81% | 0.811 | S | S | * | * | | | cis | -161.6 | 137 | 20 | -94.2 | 157.1 | 174.2 | 0 | 0 | 106.3 | L19 | E17-L19 HydrophobicContact CB-CD1 4.29Å; E17-L19 PolarHBondContact O-N 3.39Å |
| 18 | A | 46.5 | Very low | 44.5 | Very low | 108 Ų | 108 | 142.9 Ų | 142.9 | 89% | 0.893 | 82% | 0.818 | S | S | * | * | | | trans | -83.6 | 100.5 | 165.5 | 0 | 0 | 0 | 0 | 0 | 107.8 | | |
| 19 | L | 48 | Very low | 45 | Very low | 144 Ų | 144 | 142.9 Ų | 142.9 | 75% | 0.754 | 82% | 0.815 | S | S | * | * | | | trans | -105.4 | 110.9 | 172.9 | -87.7 | 155.9 | 0 | 0 | 0 | 109.2 | E17 | E17-L19 HydrophobicContact CB-CD1 4.29Å; E17-L19 PolarHBondContact O-N 3.39Å |
| 20 | T | 50.4 | Low | 45.2 | Very low | 135 Ų | 135 | 138.9 Ų | 138.9 | 83% | 0.828 | 81% | 0.81 | S | S | * | * | | | trans | -61.1 | 121.3 | 175.1 | 42.9 | 0 | 0 | 0 | 0 | 111.4 | | |
| 21 | W | 38.6 | Very low | 45.4 | Very low | 253 Ų | 253 | 140.7 Ų | 140.7 | 96% | 0.958 | 81% | 0.814 | S | S | * | * | | | trans | -111.6 | 116.5 | 170 | -158.3 | -76.2 | 0 | 0 | 0 | 110.3 | | |
| 22 | S | 43.4 | Very low | 45.4 | Very low | 104 Ų | 104 | 138.6 Ų | 138.6 | 73% | 0.727 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -84.1 | 137.3 | 177.9 | 32.4 | 0 | 0 | 0 | 0 | 111.5 | | |
| 23 | G | 42.5 | Very low | 45.3 | Very low | 72 Ų | 72 | 142.7 Ų | 142.7 | 74% | 0.742 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -83.8 | 166.5 | 178.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | | |
| 24 | P | 53.4 | Low | 45.2 | Very low | 124 Ų | 124 | 145.2 Ų | 145.2 | 81% | 0.805 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -96.9 | 161.9 | 177.8 | 36.3 | -31.2 | 0 | 0 | 0 | 114.4 | | |
| 25 | P | 44.8 | Very low | 45.7 | Very low | 127 Ų | 127 | 151.7 Ų | 151.7 | 83% | 0.825 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -90.8 | 149.2 | -161.1 | 36.1 | -34.2 | 0 | 0 | 0 | 114.1 | | |
| 26 | T | 43.5 | Very low | 45.6 | Very low | 135 Ų | 135 | 157.6 Ų | 157.6 | 83% | 0.828 | 83% | 0.834 | S | S | * | * | | | trans | -113.4 | 132.5 | 175.9 | -58.8 | 0 | 0 | 0 | 0 | 111 | | |
| 27 | L | 49 | Very low | 45.6 | Very low | 170 Ų | 170 | 156.2 Ų | 156.2 | 89% | 0.89 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -63 | 125.8 | 175.3 | -71.3 | 150 | 0 | 0 | 0 | 111.7 | | |
| 28 | E | 46.4 | Very low | 45.5 | Very low | 185 Ų | 185 | 152.9 Ų | 152.9 | 86% | 0.864 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -80.7 | 131.8 | 175.8 | -76 | -81.3 | 139.8 | 0 | 0 | 112.5 | | |
| 29 | P | 52.5 | Low | 45.3 | Very low | 104 Ų | 104 | 151.6 Ų | 151.6 | 68% | 0.675 | 84% | 0.842 | S | S | * | * | P | Polyproline II helix | trans | -95.7 | 157.5 | 163.4 | 34.1 | -28.3 | 0 | 0 | 0 | 112.8 | | |
| 30 | P | 47.8 | Very low | 45.2 | Very low | 126 Ų | 126 | 150.3 Ų | 150.3 | 82% | 0.818 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -74.3 | 145.5 | -164.5 | 29.2 | -35.3 | 0 | 0 | 0 | 115.5 | | |
| 31 | E | 47.8 | Very low | 45.1 | Very low | 191 Ų | 191 | 150.1 Ų | 150.1 | 89% | 0.893 | 85% | 0.847 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 135.4 | 177.8 | -74.8 | -170.8 | 137.5 | 0 | 0 | 114.2 | | |
| 32 | P | 45.4 | Very low | 45.2 | Very low | 126 Ų | 126 | 143.3 Ų | 143.3 | 82% | 0.818 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -88.1 | 122.9 | 163.8 | 30.3 | -27.6 | 0 | 0 | 0 | 111.9 | | |
| 33 | Q | 40.6 | Very low | 45.6 | Very low | 188 Ų | 188 | 143.3 Ų | 143.3 | 88% | 0.879 | 84% | 0.844 | S | S | * | * | P | Polyproline II helix | trans | -50.3 | 135.1 | 178.7 | -67.2 | -177.5 | -13.4 | 0 | 0 | 114.7 | R35 | Q33-R35 PolarHBondContact O-N 3.28Š|
| 34 | R | 42 | Very low | 45.6 | Very low | 246 Ų | 246 | 148.2 Ų | 148.2 | 93% | 0.928 | 85% | 0.848 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 122.9 | 168.1 | -69.4 | 177.8 | 169.8 | -103.8 | 0.2 | 111.7 | | |
| 35 | R | 48.6 | Very low | 45.1 | Very low | 246 Ų | 246 | 146.1 Ų | 146.1 | 93% | 0.928 | 84% | 0.84 | S | S | * | * | | | trans | -104.4 | 116.6 | 158.3 | -74.4 | -166.9 | 175.4 | -131.6 | -0.6 | 110.5 | Q33 | Q33-R35 PolarHBondContact O-N 3.28Š|
| 36 | R | 44.9 | Very low | 45.2 | Very low | 260 Ų | 260 | 152.1 Ų | 152.1 | 98% | 0.981 | 85% | 0.847 | S | S | * | * | | | trans | -62.7 | 140.4 | 165.6 | -80.3 | 176 | 167.9 | -130.1 | 0.3 | 110.4 | | |
| 37 | G | 38.6 | Very low | 45.4 | Very low | 78 Ų | 78 | 156.5 Ų | 156.5 | 80% | 0.804 | 85% | 0.848 | S | S | * | * | | | trans | 163 | 109.7 | 163.9 | 0 | 0 | 0 | 0 | 0 | 106.8 | | |
| 38 | G | 41.3 | Very low | 45.2 | Very low | 88 Ų | 88 | 154.7 Ų | 154.7 | 91% | 0.907 | 85% | 0.846 | S | S | * | * | | | cis | 94.3 | 81.8 | 33.3 | 0 | 0 | 0 | 0 | 0 | 108.5 | | |
| 39 | G | 40.9 | Very low | 45.2 | Very low | 81 Ų | 81 | 148.7 Ų | 148.7 | 84% | 0.835 | 83% | 0.834 | S | S | * | * | | | trans | 169.3 | 103.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | | |
| 40 | S | 46.3 | Very low | 45 | Very low | 117 Ų | 117 | 150 Ų | 150 | 82% | 0.818 | 84% | 0.843 | S | S | * | * | | | trans | -65 | 153.9 | 174.9 | -59.8 | 0 | 0 | 0 | 0 | 113 | S42 | S40-S42 PolarHBondContact O-N 3.36Š|
| 41 | P | 48.3 | Very low | 44.8 | Very low | 132 Ų | 132 | 149.5 Ų | 149.5 | 86% | 0.857 | 84% | 0.842 | S | S | * | * | | | trans | -74.1 | 114.3 | 177.2 | 29.2 | -32 | 0 | 0 | 0 | 110.8 | A43 | P41-A43 PolarHBondContact O-N 3.05Š|
| 42 | S | 41.9 | Very low | 45 | Very low | 109 Ų | 109 | 152 Ų | 152 | 76% | 0.762 | 84% | 0.844 | S | S | * | * | | | trans | -70.6 | 122.1 | 171.5 | -148.4 | 0 | 0 | 0 | 0 | 109.5 | S40 E44 | S40-S42 PolarHBondContact O-N 3.36Å; S42-E44 PolarHBondContact O-N 3.15Å; S42-E44 VanDerWaalsContact O-N 3.15Å |
| 43 | A | 50.9 | Low | 44.8 | Very low | 104 Ų | 104 | 150.3 Ų | 150.3 | 86% | 0.86 | 84% | 0.835 | S | S | * | * | | | trans | -69.7 | 101.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 109.7 | P41 | P41-A43 PolarHBondContact O-N 3.05Š|
| 44 | E | 42 | Very low | 45.1 | Very low | 176 Ų | 176 | 153.3 Ų | 153.3 | 82% | 0.822 | 84% | 0.838 | S | S | * | * | | | trans | -111.5 | 104.9 | 171.9 | -155.7 | 137.8 | 159.6 | 0 | 0 | 111.1 | S42 | S42-E44 PolarHBondContact O-N 3.15Å; S42-E44 VanDerWaalsContact O-N 3.15Å |
| 45 | A | 43 | Very low | 45.2 | Very low | 79 Ų | 79 | 149.6 Ų | 149.6 | 65% | 0.653 | 83% | 0.831 | S | S | * | * | | | trans | 21.5 | 105.3 | 151.9 | 0 | 0 | 0 | 0 | 0 | 118.3 | R47 | A45-R47 PolarHBondContact O-N 3.41Š|
| 46 | R | 48.2 | Very low | 45.1 | Very low | 253 Ų | 253 | 149.3 Ų | 149.3 | 96% | 0.955 | 83% | 0.83 | S | S | * | * | | | trans | -58.3 | 106.4 | 157 | -66.6 | 177.5 | 176.2 | -135.6 | -0.9 | 109.7 | | |
| 47 | R | 47.3 | Very low | 45.3 | Very low | 228 Ų | 228 | 142.4 Ų | 142.4 | 86% | 0.86 | 82% | 0.816 | S | S | * | * | | | trans | -102.1 | 120.6 | 158.9 | -69.5 | -174.6 | 179.1 | 175.2 | 1.7 | 108.5 | A45 G49 | A45-R47 PolarHBondContact O-N 3.41Å; R47-G49 PolarHBondContact O-N 3.33Å; R47-G49 VanDerWaalsContact O-N 3.15Å |
| 48 | P | 45 | Very low | 45.7 | Very low | 131 Ų | 131 | 150.3 Ų | 150.3 | 85% | 0.851 | 82% | 0.822 | S | S | * | * | | | trans | -70.8 | 108.8 | 170.7 | 26.1 | -28.5 | 0 | 0 | 0 | 109.1 | | |
| 49 | G | 46.3 | Very low | 46.1 | Very low | 60 Ų | 60 | 150.6 Ų | 150.6 | 62% | 0.619 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 155.3 | 169.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | R47 S51 | R47-G49 PolarHBondContact O-N 3.33Å; R47-G49 VanDerWaalsContact O-N 3.15Å; G49-S51 PolarHBondContact O-N 3.29Å |
| 50 | P | 48.1 | Very low | 46.3 | Very low | 132 Ų | 132 | 153.9 Ų | 153.9 | 86% | 0.857 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 126.6 | -174.5 | 24.7 | -32.4 | 0 | 0 | 0 | 111.6 | R52 | P50-R52 PolarHBondContact O-N 3.3Š|
| 51 | S | 44.5 | Very low | 46.5 | Very low | 115 Ų | 115 | 157 Ų | 157 | 80% | 0.804 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 129.7 | -179.4 | -167.5 | 0 | 0 | 0 | 0 | 112.6 | G49 S53 | G49-S51 PolarHBondContact O-N 3.29Å; S51-S53 PolarHBondContact O-N 3.15Å |
| 52 | R | 50.3 | Low | 46.8 | Very low | 244 Ų | 244 | 158.9 Ų | 158.9 | 92% | 0.921 | 82% | 0.817 | S | S | * | * | | | trans | -76.5 | 104.2 | 171.6 | -73.2 | -179.3 | 171.1 | -158.3 | -0.9 | 109.9 | P50 | P50-R52 PolarHBondContact O-N 3.3Š|
| 53 | S | 42.5 | Very low | 47.2 | Very low | 90 Ų | 90 | 160.6 Ų | 160.6 | 63% | 0.629 | 82% | 0.817 | S | S | * | * | | | trans | -159.6 | 57.4 | 151.2 | 66.3 | 0 | 0 | 0 | 0 | 112.7 | S51 H55 | S51-S53 PolarHBondContact O-N 3.15Å; S53-H55 PolarHBondContact O-N 3.35Å |
| 54 | R | 46 | Very low | 47 | Very low | 250 Ų | 250 | 161.3 Ų | 161.3 | 94% | 0.943 | 81% | 0.813 | S | S | * | * | | | trans | -81 | 95.3 | 160.6 | -69.7 | -170.1 | -178.8 | -153.7 | 1 | 108.2 | R56 | R54-R56 PolarHBondContact O-N 3.2Š|
| 55 | H | 44.3 | Very low | 47.3 | Very low | 168 Ų | 168 | 157 Ų | 157 | 78% | 0.778 | 81% | 0.808 | S | S | * | * | | | trans | -50.3 | 119.6 | 165.5 | -80.4 | -90.2 | 0 | 0 | 0 | 109.2 | S53 V57 | S53-H55 PolarHBondContact O-N 3.35Å; H55-V57 HydrophobicContact CB-CG2 4.48Å; H55-V57 PolarHBondContact O-N 3.5Å; H55-V57 VanDerWaalsContact O-N 3.12Å |
| 56 | R | 46 | Very low | 47.4 | Very low | 241 Ų | 241 | 158.2 Ų | 158.2 | 91% | 0.909 | 81% | 0.809 | S | S | * | * | | | trans | -69.5 | 99.3 | 164.2 | -73.5 | 179.8 | 172.1 | -176.5 | -3.4 | 107.4 | R54 | R54-R56 PolarHBondContact O-N 3.2Š|
| 57 | V | 49.7 | Very low | 47.7 | Very low | 115 Ų | 115 | 158.3 Ų | 158.3 | 70% | 0.697 | 81% | 0.809 | S | S | * | * | | | trans | -102.2 | 92.3 | 161.7 | -176.1 | 0 | 0 | 0 | 0 | 106 | H55 | H55-V57 HydrophobicContact CB-CG2 4.48Å; H55-V57 PolarHBondContact O-N 3.5Å; H55-V57 VanDerWaalsContact O-N 3.12Å |
| 58 | W | 47.3 | Very low | 47.7 | Very low | 243 Ų | 243 | 152.8 Ų | 152.8 | 92% | 0.92 | 80% | 0.801 | S | S | * | * | | | trans | -119.1 | 134.5 | 163 | -79.2 | 63 | 0 | 0 | 0 | 105.9 | | |
| 59 | A | 48.7 | Very low | 48 | Very low | 94 Ų | 94 | 151.2 Ų | 151.2 | 78% | 0.777 | 80% | 0.799 | S | S | * | * | | | trans | 97.3 | 62.7 | -175.6 | 0 | 0 | 0 | 0 | 0 | 116.4 | | |
| 60 | L | 45.5 | Very low | 48.3 | Very low | 150 Ų | 150 | 149.5 Ų | 149.5 | 79% | 0.785 | 78% | 0.781 | S | S | * | * | | | trans | -140.5 | 51.3 | 147.1 | -75.9 | 176.7 | 0 | 0 | 0 | 109.2 | | |
| 61 | E | 50.9 | Low | 49.2 | Very low | 184 Ų | 184 | 145.6 Ų | 145.6 | 86% | 0.86 | 76% | 0.764 | S | S | * | * | | | trans | -89.3 | 137.5 | 151.9 | -77.9 | -164.9 | 153.7 | 0 | 0 | 107.1 | | |
| 62 | L | 54.3 | Low | 49.8 | Very low | 170 Ų | 170 | 148.3 Ų | 148.3 | 89% | 0.89 | 76% | 0.757 | S | S | * | * | S | Bend | trans | 97.9 | 42.6 | -179.3 | -51.2 | 171.6 | 0 | 0 | 0 | 117.7 | | |
| 63 | L | 49.6 | Very low | 50.2 | Low | 145 Ų | 145 | 141.4 Ų | 141.4 | 76% | 0.759 | 74% | 0.735 | S | S | * | * | S | Bend | trans | -129 | 133.8 | 148.3 | -72.2 | 171.5 | 0 | 0 | 0 | 109.7 | A65 | L63-A65 PolarHBondContact O-N 3.12Š|
| 64 | P | 47.7 | Very low | 50.9 | Low | 119 Ų | 119 | 145.1 Ų | 145.1 | 77% | 0.773 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 123.6 | 174.2 | 25.3 | -31 | 0 | 0 | 0 | 108.8 | | |
| 65 | A | 47.4 | Very low | 51.4 | Low | 87 Ų | 87 | 137.2 Ų | 137.2 | 72% | 0.719 | 71% | 0.712 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 128.5 | 179.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | L63 R67 | L63-A65 PolarHBondContact O-N 3.12Å; A65-R67 PolarHBondContact O-N 3.19Å |
| 66 | P | 46.1 | Very low | 51.7 | Low | 104 Ų | 104 | 139.5 Ų | 139.5 | 68% | 0.675 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 124.7 | 167.4 | 26.3 | -30.2 | 0 | 0 | 0 | 107.6 | T68 | P66-T68 PolarHBondContact O-N 2.94Š|
| 67 | R | 54.3 | Low | 52 | Low | 255 Ų | 255 | 131.8 Ų | 131.8 | 96% | 0.962 | 70% | 0.697 | S | S | * | * | | | trans | -68.5 | 73.6 | 171.3 | -66.9 | -178.5 | 179.2 | 174 | -0.8 | 109.3 | A65 | A65-R67 PolarHBondContact O-N 3.19Š|
| 68 | T | 48.3 | Very low | 52.2 | Low | 112 Ų | 112 | 130 Ų | 130 | 69% | 0.687 | 70% | 0.702 | S | S | * | * | | | trans | -102.8 | 84.7 | 170.8 | 43.9 | 0 | 0 | 0 | 0 | 108.6 | P66 G70 | P66-T68 PolarHBondContact O-N 2.94Å; T68-G70 PolarHBondContact O-N 2.94Å |
| 69 | A | 50.7 | Low | 52.7 | Low | 98 Ų | 98 | 122.3 Ų | 122.3 | 81% | 0.81 | 70% | 0.698 | S | S | * | * | | | trans | -71.8 | 77.3 | 159.8 | 0 | 0 | 0 | 0 | 0 | 108.1 | | |
| 70 | G | 52 | Low | 52.4 | Low | 24 Ų | 24 | 126 Ų | 126 | 25% | 0.247 | 70% | 0.697 | C | S | . | * | | | trans | -160.7 | 107.7 | -179.4 | 0 | 0 | 0 | 0 | 0 | 109.3 | T68 R86 | T68-G70 PolarHBondContact O-N 2.94Å; G70-R86 WeakPolarHBondContact CA-O 3.3Å |
| 71 | G | 66.8 | Low | 52.9 | Low | 49 Ų | 49 | 122.6 Ų | 122.6 | 51% | 0.505 | 69% | 0.686 | S | S | . | * | | | trans | -62.8 | 167.9 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113 | R86 | G71-R86 WeakPolarHBondContact O-CB 3.04Å; G71-R86 VanDerWaalsContact O-CG 3.3Å; G71-R86 WeakPolarHBondContact O-CG 3.5Å; G71-R86 PolarHBondContact O-N 3.22Å |
| 72 | W | 57.9 | Low | 53.2 | Low | 173 Ų | 173 | 123.1 Ų | 123.1 | 66% | 0.655 | 68% | 0.68 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -85.2 | 135.1 | 178.3 | -63.1 | 86.5 | 0 | 0 | 0 | 110.6 | A83 P85 | W72-A83 HydrophobicContact CE3-CB 3.96Å; W72-A83 HydrophobicContact CZ3-CB 4.46Å; W72-P85 HydrophobicContact CE3-CB 4.11Å; W72-P85 HydrophobicContact CH2-CB 4.09Å; W72-P85 HydrophobicContact CZ3-CB 3.79Å; W72-P85 HydrophobicContact CZ3-CG 4.12Å |
| 73 | Q | 57.9 | Low | 53.2 | Low | 99 Ų | 99 | 116.7 Ų | 116.7 | 46% | 0.463 | 65% | 0.651 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -109.9 | 135.8 | 171.3 | -176.5 | 171.6 | 7.8 | 0 | 0 | 109.7 | V84 R86 | Q73-V84 PolarHBondContact N-O 2.95Å; Q73-V84 VanDerWaalsContact N-O 3.1Å; Q73-V84 PolarHBondContact O-N 3.38Å; Q73-V84 VanDerWaalsContact O-N 3.07Å; Q73-R86 HydrophobicContact CB-CG 3.49Å; Q73-R86 VanDerWaalsContact CB-CG 3.49Å |
| 74 | W | 56.6 | Low | 53.8 | Low | 167 Ų | 167 | 112.9 Ų | 112.9 | 63% | 0.633 | 63% | 0.634 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -91.9 | 117 | 174 | -66 | 102.5 | 0 | 0 | 0 | 108.9 | A83 | W74-A83 HydrophobicContact CE3-CB 4.06Å; W74-A83 HydrophobicContact CH2-CB 3.61Å; W74-A83 HydrophobicContact CZ2-CB 4.06Å; W74-A83 HydrophobicContact CZ3-CB 3.6Å; W74-A83 VanDerWaalsContact CZ3-N 3.33Å |
| 75 | D | 58.4 | Low | 53.9 | Low | 85 Ų | 85 | 110.7 Ų | 110.7 | 46% | 0.455 | 62% | 0.619 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -92.7 | 130 | 168.7 | -170.8 | -5.5 | 0 | 0 | 0 | 108.6 | S77 R82 | D75-S77 PolarHBondContact OD1-N 3.23Å; D75-S77 PolarHBondContact OD1-OG 3.08Å; D75-R82 PolarHBondContact N-O 2.78Å |
| 76 | R | 49.6 | Very low | 54.1 | Low | 215 Ų | 215 | 113.1 Ų | 113.1 | 81% | 0.811 | 61% | 0.61 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -113.9 | 78.4 | 172.5 | -74.7 | -169 | -168.6 | -179.4 | 5.2 | 108.1 | | |
| 77 | S | 53 | Low | 54.3 | Low | 79 Ų | 79 | 115.7 Ų | 115.7 | 55% | 0.552 | 62% | 0.617 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -112.8 | 123.7 | 171.9 | -66.3 | 0 | 0 | 0 | 0 | 108.6 | D75 G79 | D75-S77 PolarHBondContact OD1-N 3.23Å; D75-S77 PolarHBondContact OD1-OG 3.08Å; S77-G79 PolarHBondContact O-N 3.06Å |
| 78 | G | 53.8 | Low | 53.9 | Low | 78 Ų | 78 | 106.1 Ų | 106.1 | 80% | 0.804 | 59% | 0.592 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 71.5 | 25.3 | 171.4 | 0 | 0 | 0 | 0 | 0 | 116.8 | F80 | G78-F80 VanDerWaalsContact C-N 3.32Å; G78-F80 PolarHBondContact O-N 3.06Å |
| 79 | G | 58.3 | Low | 53.8 | Low | 81 Ų | 81 | 106.3 Ų | 106.3 | 84% | 0.835 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 82 | 2.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 115.5 | S77 | S77-G79 PolarHBondContact O-N 3.06Š|
| 80 | F | 40.9 | Very low | 53.4 | Low | 172 Ų | 172 | 106.7 Ų | 106.7 | 75% | 0.754 | 59% | 0.591 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -112.3 | 134 | 172.4 | -72.9 | -88.8 | 0 | 0 | 0 | 110.5 | G78 | G78-F80 VanDerWaalsContact C-N 3.32Å; G78-F80 PolarHBondContact O-N 3.06Å |
| 81 | S | 57 | Low | 53.1 | Low | 78 Ų | 78 | 115.2 Ų | 115.2 | 55% | 0.545 | 63% | 0.625 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -97.6 | 117.7 | 173.4 | -63.2 | 0 | 0 | 0 | 0 | 109.1 | | |
| 82 | R | 55.8 | Low | 52.1 | Low | 195 Ų | 195 | 116.4 Ų | 116.4 | 74% | 0.736 | 64% | 0.637 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -119.1 | 130.4 | 173.1 | -168.7 | 174.2 | 178.4 | -174.1 | -0.5 | 109.7 | D75 V84 | D75-R82 PolarHBondContact N-O 2.78Å; R82-V84 HydrophobicContact CG-CG2 4.49Å; R82-V84 PolarHBondContact O-N 2.98Å |
| 83 | A | 54.8 | Low | 51.5 | Low | 36 Ų | 36 | 113 Ų | 113 | 30% | 0.298 | 64% | 0.64 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -73.6 | 111.4 | 168.6 | 0 | 0 | 0 | 0 | 0 | 107.9 | W72 W74 | W72-A83 HydrophobicContact CE3-CB 3.96Å; W72-A83 HydrophobicContact CZ3-CB 4.46Å; W74-A83 HydrophobicContact CE3-CB 4.06Å; W74-A83 HydrophobicContact CH2-CB 3.61Å; W74-A83 HydrophobicContact CZ2-CB 4.06Å; W74-A83 HydrophobicContact CZ3-CB 3.6Å; W74-A83 VanDerWaalsContact CZ3-N 3.33Å |
| 84 | V | 62.1 | Low | 50.6 | Low | 65 Ų | 65 | 117.2 Ų | 117.2 | 39% | 0.394 | 66% | 0.66 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -103.8 | 128.7 | 173.2 | -175 | 0 | 0 | 0 | 0 | 106.9 | Q73 R82 R86 | Q73-V84 PolarHBondContact N-O 2.95Å; Q73-V84 VanDerWaalsContact N-O 3.1Å; Q73-V84 PolarHBondContact O-N 3.38Å; Q73-V84 VanDerWaalsContact O-N 3.07Å; R82-V84 HydrophobicContact CG-CG2 4.49Å; R82-V84 PolarHBondContact O-N 2.98Å; V84-R86 PolarHBondContact O-N 2.92Å |
| 85 | P | 50.8 | Low | 49.9 | Very low | 72 Ų | 72 | 120 Ų | 120 | 47% | 0.468 | 67% | 0.67 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -62.1 | 125.1 | 174.8 | 23.8 | -28.9 | 0 | 0 | 0 | 108.2 | W72 L87 | W72-P85 HydrophobicContact CE3-CB 4.11Å; W72-P85 HydrophobicContact CH2-CB 4.09Å; W72-P85 HydrophobicContact CZ3-CB 3.79Å; W72-P85 HydrophobicContact CZ3-CG 4.12Å; P85-L87 PolarHBondContact O-N 3.07Å |
| 86 | R | 50.1 | Low | 49.5 | Very low | 139 Ų | 139 | 121.7 Ų | 121.7 | 53% | 0.525 | 69% | 0.686 | S | S | . | * | | | trans | -70.2 | 109.4 | 168.6 | -69.8 | -176.9 | 147.2 | 177.1 | 0.1 | 106.9 | G70 G71 Q73 V84 A88 | G70-R86 WeakPolarHBondContact CA-O 3.3Å; G71-R86 WeakPolarHBondContact O-CB 3.04Å; G71-R86 VanDerWaalsContact O-CG 3.3Å; G71-R86 WeakPolarHBondContact O-CG 3.5Å; G71-R86 PolarHBondContact O-N 3.22Å; Q73-R86 HydrophobicContact CB-CG 3.49Å; Q73-R86 VanDerWaalsContact CB-CG 3.49Å; V84-R86 PolarHBondContact O-N 2.92Å; R86-A88 PolarHBondContact O-N 3.1Å; R86-A88 VanDerWaalsContact O-N 3.15Å |
| 87 | L | 51.8 | Low | 49.2 | Very low | 158 Ų | 158 | 119.1 Ų | 119.1 | 83% | 0.827 | 69% | 0.687 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 118.2 | 153.7 | -60.9 | 174.5 | 0 | 0 | 0 | 105.6 | P85 | P85-L87 PolarHBondContact O-N 3.07Š|
| 88 | A | 46.1 | Very low | 48.8 | Very low | 53 Ų | 53 | 120.5 Ų | 120.5 | 44% | 0.438 | 70% | 0.697 | S | S | . | * | P | Polyproline II helix | trans | -48.7 | 139.9 | 167.1 | 0 | 0 | 0 | 0 | 0 | 107.4 | R86 C90 | R86-A88 PolarHBondContact O-N 3.1Å; R86-A88 VanDerWaalsContact O-N 3.15Å; A88-C90 PolarHBondContact O-N 2.91Å |
| 89 | P | 45.5 | Very low | 48.6 | Very low | 116 Ų | 116 | 128.3 Ų | 128.3 | 75% | 0.753 | 70% | 0.702 | S | S | * | * | P | Polyproline II helix | trans | -53.3 | 116.2 | 164.1 | -13.1 | 25.7 | 0 | 0 | 0 | 105.4 | E91 | P89-E91 PolarHBondContact O-N 3.15Š|
| 90 | C | 41.6 | Very low | 48.1 | Very low | 106 Ų | 106 | 129.1 Ų | 129.1 | 72% | 0.716 | 70% | 0.701 | S | S | * | * | | | trans | -55.7 | 112.1 | 163.6 | -61.3 | 0 | 0 | 0 | 0 | 104.7 | A88 G92 S93 | A88-C90 PolarHBondContact O-N 2.91Å; C90-G92 PolarHBondContact O-N 3.04Å; C90-S93 PolarHBondContact O-N 3.29Å |
| 91 | E | 46.8 | Very low | 48.4 | Very low | 203 Ų | 203 | 124.9 Ų | 124.9 | 95% | 0.949 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -47.7 | 113.8 | 162.8 | -79.9 | -167.9 | 147.7 | 0 | 0 | 106.3 | P89 | P89-E91 PolarHBondContact O-N 3.15Š|
| 92 | G | 46.2 | Very low | 47.7 | Very low | 75 Ų | 75 | 125 Ų | 125 | 77% | 0.773 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 140.6 | -10.8 | -167.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | C90 E94 | C90-G92 PolarHBondContact O-N 3.04Å; G92-E94 VanDerWaalsContact C-N 3.33Å; G92-E94 PolarHBondContact O-N 3.24Å |
| 93 | S | 43.6 | Very low | 47.5 | Very low | 101 Ų | 101 | 126.8 Ų | 126.8 | 71% | 0.706 | 70% | 0.695 | S | S | * | * | | | trans | -92.1 | 58.7 | 169.6 | 170 | 0 | 0 | 0 | 0 | 111.7 | C90 R95 | C90-S93 PolarHBondContact O-N 3.29Å; S93-R95 PolarHBondContact O-N 2.96Å |
| 94 | E | 39.8 | Very low | 47.3 | Very low | 188 Ų | 188 | 131.8 Ų | 131.8 | 88% | 0.879 | 72% | 0.716 | S | S | * | * | | | trans | -75.1 | 116.6 | 159.3 | -69.5 | -166.7 | 161.3 | 0 | 0 | 108.2 | G92 | G92-E94 VanDerWaalsContact C-N 3.33Å; G92-E94 PolarHBondContact O-N 3.24Å |
| 95 | R | 42.9 | Very low | 46.7 | Very low | 224 Ų | 224 | 133.9 Ų | 133.9 | 85% | 0.845 | 72% | 0.724 | S | S | * | * | | | trans | -62.2 | 157.6 | 170 | -90.7 | -177.8 | 178.4 | -178.7 | 0 | 110.5 | S93 L97 | S93-R95 PolarHBondContact O-N 2.96Å; R95-L97 PolarHBondContact O-N 3.3Å; R95-L97 VanDerWaalsContact O-N 3.14Å |
| 96 | P | 49.8 | Very low | 46.6 | Very low | 122 Ų | 122 | 136.1 Ų | 136.1 | 79% | 0.792 | 73% | 0.728 | S | S | * | * | | | trans | -81.1 | 103.7 | -148.6 | 32.8 | -32.6 | 0 | 0 | 0 | 111.2 | | |
| 97 | L | 42.2 | Very low | 46.5 | Very low | 161 Ų | 161 | 137.8 Ų | 137.8 | 84% | 0.843 | 74% | 0.739 | S | S | * | * | | | trans | -102.2 | 101 | 158.6 | -73.1 | 171.3 | 0 | 0 | 0 | 107.4 | R95 | R95-L97 PolarHBondContact O-N 3.3Å; R95-L97 VanDerWaalsContact O-N 3.14Å |
| 98 | S | 45.3 | Very low | 46.3 | Very low | 108 Ų | 108 | 135 Ų | 135 | 76% | 0.755 | 73% | 0.729 | S | S | * | * | | | trans | 55.3 | 120.1 | 143.9 | -57.3 | 0 | 0 | 0 | 0 | 118.7 | | |
| 99 | R | 49.9 | Very low | 46.5 | Very low | 241 Ų | 241 | 141.8 Ų | 141.8 | 91% | 0.909 | 74% | 0.743 | S | S | * | * | | | trans | 78.9 | 77.4 | 131.3 | -159.4 | -178.1 | -170 | 178.1 | 2.3 | 116.2 | | |
| 100 | A | 47 | Very low | 46.8 | Very low | 98 Ų | 98 | 141.7 Ų | 141.7 | 81% | 0.81 | 74% | 0.737 | S | S | * | * | | | trans | -148.3 | 78.4 | 138 | 0 | 0 | 0 | 0 | 0 | 109.4 | | |
| 101 | V | 48.3 | Very low | 47.3 | Very low | 84 Ų | 84 | 142.5 Ų | 142.5 | 51% | 0.509 | 73% | 0.733 | S | S | . | * | | | trans | -62.7 | 129.7 | 164.9 | 178 | 0 | 0 | 0 | 0 | 107.1 | R103 Q106 | V101-R103 PolarHBondContact O-N 3.5Å; V101-R103 VanDerWaalsContact O-N 3.07Å; V101-Q106 HydrophobicContact CG1-CG 4.12Å |
| 102 | P | 42 | Very low | 47.4 | Very low | 80 Ų | 80 | 142.8 Ų | 142.8 | 52% | 0.519 | 73% | 0.725 | S | S | . | * | | | trans | -54.1 | 118.7 | 168.9 | -20.8 | 30.6 | 0 | 0 | 0 | 108.3 | D104 I105 | P102-D104 PolarHBondContact O-N 3.34Å; P102-I105 HydrophobicContact CB-CD1 4.24Å; P102-I105 HydrophobicContact CB-CG1 4.41Å; P102-I105 HydrophobicContact CG-CD1 4.09Å; P102-I105 PolarHBondContact O-N 2.95Å; P102-I105 VanDerWaalsContact O-N 3.13Å |
| 103 | R | 50.7 | Low | 47.5 | Very low | 233 Ų | 233 | 145.1 Ų | 145.1 | 88% | 0.879 | 72% | 0.72 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.5 | -10.2 | -174.1 | -81.4 | -173 | 172.4 | 176.4 | -1 | 113.8 | V101 | V101-R103 PolarHBondContact O-N 3.5Å; V101-R103 VanDerWaalsContact O-N 3.07Å |
| 104 | D | 51.3 | Low | 47.5 | Very low | 141 Ų | 141 | 148.6 Ų | 148.6 | 75% | 0.754 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88 | -17.1 | -178.6 | -61.1 | -34.6 | 0 | 0 | 0 | 114.6 | P102 | P102-D104 PolarHBondContact O-N 3.34Š|
| 105 | I | 49.7 | Very low | 47.8 | Very low | 108 Ų | 108 | 144.8 Ų | 144.8 | 55% | 0.554 | 71% | 0.712 | S | S | * | * | H | α-helix | trans | -85 | -20.5 | -178.4 | -57.4 | 175.5 | 0 | 0 | 0 | 112 | P102 T108 | P102-I105 HydrophobicContact CB-CD1 4.24Å; P102-I105 HydrophobicContact CB-CG1 4.41Å; P102-I105 HydrophobicContact CG-CD1 4.09Å; P102-I105 PolarHBondContact O-N 2.95Å; P102-I105 VanDerWaalsContact O-N 3.13Å; I105-T108 PolarHBondContact O-OG1 3.41Å |
| 106 | Q | 48.2 | Very low | 48.1 | Very low | 120 Ų | 120 | 138.6 Ų | 138.6 | 56% | 0.561 | 71% | 0.708 | S | S | * | * | H | α-helix | trans | -79.5 | -21.3 | 179.8 | -70.2 | -159 | -9.9 | 0 | 0 | 114 | V101 N110 | V101-Q106 HydrophobicContact CG1-CG 4.12Å; Q106-N110 PolarHBondContact O-N 3.41Å; Q106-N110 PolarHBondContact O-ND2 3.35Å |
| 107 | K | 48.5 | Very low | 48.1 | Very low | 173 Ų | 173 | 136.9 Ų | 136.9 | 75% | 0.752 | 71% | 0.705 | S | S | * | * | H | α-helix | trans | -72.4 | -30.9 | -179.2 | -139.1 | 175.1 | -173.6 | 179.8 | 0 | 112.2 | | |
| 108 | T | 48.1 | Very low | 48.5 | Very low | 99 Ų | 99 | 133.8 Ų | 133.8 | 61% | 0.607 | 70% | 0.697 | S | S | * | * | H | α-helix | trans | -83 | -19.8 | 178.5 | 32.4 | 0 | 0 | 0 | 0 | 114 | I105 | I105-T108 PolarHBondContact O-OG1 3.41Å |
| 109 | R | 49.9 | Very low | 48.3 | Very low | 197 Ų | 197 | 135.8 Ų | 135.8 | 74% | 0.743 | 70% | 0.699 | S | S | * | * | H | α-helix | trans | -86 | -27.2 | 177 | -154.5 | 171.6 | 171.6 | 164.2 | -3.4 | 113.4 | L111 R112 | R109-L111 VanDerWaalsContact C-N 3.34Å; R109-L111 PolarHBondContact O-N 3.38Å; R109-R112 PolarHBondContact O-N 2.78Å |
| 110 | N | 50.9 | Low | 48.2 | Very low | 114 Ų | 114 | 136.7 Ų | 136.7 | 61% | 0.61 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -76 | -14.9 | 175.5 | -83.6 | -55.3 | 0 | 0 | 0 | 114.6 | Q106 | Q106-N110 PolarHBondContact O-N 3.41Å; Q106-N110 PolarHBondContact O-ND2 3.35Å |
| 111 | L | 51.6 | Low | 47.8 | Very low | 123 Ų | 123 | 134.8 Ų | 134.8 | 64% | 0.644 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -80.4 | -28.1 | 172.5 | -89.2 | 152.5 | 0 | 0 | 0 | 113 | R109 V115 | R109-L111 VanDerWaalsContact C-N 3.34Å; R109-L111 PolarHBondContact O-N 3.38Å; L111-V115 WeakPolarHBondContact O-CG2 3.2Å |
| 112 | R | 49.7 | Very low | 47.7 | Very low | 209 Ų | 209 | 137.3 Ų | 137.3 | 79% | 0.789 | 71% | 0.71 | S | S | * | * | H | α-helix | trans | -76.1 | -26.5 | 178.3 | -92.3 | -175.8 | -162.9 | -168.1 | 5.1 | 114.1 | R109 | R109-R112 PolarHBondContact O-N 2.78Å |
| 113 | N | 47.4 | Very low | 47.7 | Very low | 123 Ų | 123 | 137.6 Ų | 137.6 | 66% | 0.658 | 73% | 0.727 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.4 | -8.5 | -179.9 | -74.4 | -2.4 | 0 | 0 | 0 | 114 | | |
| 114 | K | 45.3 | Very low | 47 | Very low | 175 Ų | 175 | 130.2 Ų | 130.2 | 76% | 0.761 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.3 | -19.6 | 172.1 | -96.5 | -166.8 | 172.5 | -170.9 | 0 | 114.4 | | |
| 115 | V | 46 | Very low | 46.7 | Very low | 107 Ų | 107 | 135.1 Ų | 135.1 | 65% | 0.648 | 73% | 0.732 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.7 | -15.6 | 179.3 | 179.7 | 0 | 0 | 0 | 0 | 112.5 | L111 | L111-V115 WeakPolarHBondContact O-CG2 3.2Š|
| 116 | A | 48.1 | Very low | 46.3 | Very low | 94 Ų | 94 | 136.3 Ų | 136.3 | 78% | 0.777 | 75% | 0.748 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.4 | 0.5 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | | |
| 117 | A | 50.4 | Low | 46.3 | Very low | 87 Ų | 87 | 139.4 Ų | 139.4 | 72% | 0.719 | 76% | 0.763 | S | S | * | * | S | Bend | trans | -143.7 | 37.2 | -174.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | | |
| 118 | S | 49.3 | Very low | 46 | Very low | 96 Ų | 96 | 143.2 Ų | 143.2 | 67% | 0.671 | 77% | 0.772 | S | S | * | * | | | trans | -167.4 | 87.2 | 162.8 | -154.1 | 0 | 0 | 0 | 0 | 110 | | |
| 119 | D | 41.8 | Very low | 45.9 | Very low | 150 Ų | 150 | 149.8 Ų | 149.8 | 80% | 0.802 | 79% | 0.786 | S | S | * | * | | | trans | -158.4 | 58.3 | 160.2 | -90.5 | -29.6 | 0 | 0 | 0 | 109.8 | | |
| 120 | R | 48.8 | Very low | 45.6 | Very low | 259 Ų | 259 | 144.7 Ų | 144.7 | 98% | 0.977 | 79% | 0.786 | S | S | * | * | | | trans | -106.4 | 91.2 | 139.8 | -88.8 | -170.6 | -175.2 | 166.4 | 2.3 | 106.3 | | |
| 121 | G | 37.3 | Very low | 45.4 | Very low | 58 Ų | 58 | 145.6 Ų | 145.6 | 60% | 0.598 | 80% | 0.798 | S | S | * | * | | | trans | -166.5 | 124.3 | 173.4 | 0 | 0 | 0 | 0 | 0 | 109.9 | | |
| 122 | P | 46.3 | Very low | 44.9 | Very low | 138 Ų | 138 | 143.2 Ų | 143.2 | 90% | 0.896 | 80% | 0.804 | S | S | * | * | | | trans | -89.3 | 141.2 | -171.1 | 34.7 | -31 | 0 | 0 | 0 | 111.4 | | |
| 123 | G | 42.6 | Very low | 44.6 | Very low | 85 Ų | 85 | 145.1 Ų | 145.1 | 88% | 0.876 | 81% | 0.811 | S | S | * | * | | | trans | 121 | 112.3 | 158.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | | |
| 124 | G | 36.5 | Very low | 44.5 | Very low | 78 Ų | 78 | 143.8 Ų | 143.8 | 80% | 0.804 | 82% | 0.816 | S | S | * | * | | | trans | 163.4 | 64.4 | 170.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | C126 | G124-C126 PolarHBondContact O-N 3.44Š|
| 125 | R | 44.8 | Very low | 44.8 | Very low | 245 Ų | 245 | 140.2 Ų | 140.2 | 93% | 0.925 | 82% | 0.82 | S | S | * | * | | | trans | -64.4 | 123.9 | 166.3 | -60.2 | 177.6 | -160.2 | -111.1 | 0.3 | 108.2 | | |
| 126 | C | 40.9 | Very low | 44.7 | Very low | 132 Ų | 132 | 140.1 Ų | 140.1 | 89% | 0.892 | 82% | 0.824 | S | S | * | * | | | trans | -160.2 | 91.5 | 148 | -92.4 | 0 | 0 | 0 | 0 | 108.3 | G124 R128 | G124-C126 PolarHBondContact O-N 3.44Å; C126-R128 PolarHBondContact O-N 3.31Å |
| 127 | Q | 48.2 | Very low | 45 | Very low | 185 Ų | 185 | 140.1 Ų | 140.1 | 86% | 0.864 | 82% | 0.824 | S | S | * | * | | | trans | -66.5 | 125.4 | 159.9 | -64.6 | 179 | 19.5 | 0 | 0 | 108.2 | | |
| 128 | R | 41.6 | Very low | 44.9 | Very low | 253 Ų | 253 | 146.3 Ų | 146.3 | 96% | 0.955 | 83% | 0.829 | S | S | * | * | | | trans | -146.5 | 128 | 146.1 | -104.3 | 178.9 | -165.3 | -115.8 | 2 | 109.1 | C126 | C126-R128 PolarHBondContact O-N 3.31Š|
| 129 | R | 46.8 | Very low | 44.8 | Very low | 237 Ų | 237 | 146.9 Ų | 146.9 | 89% | 0.894 | 83% | 0.83 | S | S | * | * | | | trans | -72.8 | 145.6 | -168.4 | -68.5 | 174.1 | 171.3 | -165 | -3.5 | 112.7 | | |
| 130 | A | 43.9 | Very low | 44.9 | Very low | 91 Ų | 91 | 147.1 Ų | 147.1 | 75% | 0.752 | 83% | 0.83 | S | S | * | * | | | trans | 50.3 | 113.6 | 147.8 | 0 | 0 | 0 | 0 | 0 | 120.1 | | |
| 131 | P | 46.3 | Very low | 45 | Very low | 133 Ų | 133 | 145.2 Ų | 145.2 | 86% | 0.864 | 82% | 0.823 | S | S | * | * | | | trans | -81.3 | 127.8 | 150.4 | 9.8 | 7.5 | 0 | 0 | 0 | 109.9 | | |
| 132 | G | 41.5 | Very low | 45.6 | Very low | 73 Ų | 73 | 148.3 Ų | 148.3 | 75% | 0.753 | 83% | 0.831 | S | S | * | * | | | trans | -57.8 | 136.8 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | A134 | G132-A134 PolarHBondContact O-N 3.49Š|
| 133 | R | 42.8 | Very low | 45.6 | Very low | 249 Ų | 249 | 150 Ų | 150 | 94% | 0.94 | 83% | 0.827 | S | S | * | * | | | trans | 42.1 | 75.7 | 138.4 | -144.8 | 175.6 | -166 | -153.7 | 3.5 | 115.7 | A135 | R133-A135 PolarHBondContact O-N 3.41Š|
| 134 | A | 45.1 | Very low | 46.3 | Very low | 94 Ų | 94 | 150.5 Ų | 150.5 | 78% | 0.777 | 82% | 0.822 | S | S | * | * | | | trans | -61.1 | 130.9 | 159.2 | 0 | 0 | 0 | 0 | 0 | 109.6 | G132 S136 | G132-A134 PolarHBondContact O-N 3.49Å; A134-S136 PolarHBondContact O-N 3.19Å |
| 135 | A | 52.6 | Low | 47.1 | Very low | 100 Ų | 100 | 155.6 Ų | 155.6 | 83% | 0.826 | 83% | 0.825 | S | S | * | * | | | trans | -55.9 | 121.5 | 172.5 | 0 | 0 | 0 | 0 | 0 | 109.6 | R133 A137 | R133-A135 PolarHBondContact O-N 3.41Å; A135-A137 PolarHBondContact O-N 3.28Å |
| 136 | S | 43.7 | Very low | 47.7 | Very low | 106 Ų | 106 | 148.2 Ų | 148.2 | 74% | 0.741 | 82% | 0.817 | S | S | * | * | | | trans | -67.9 | 94 | 174.4 | 176.4 | 0 | 0 | 0 | 0 | 109 | A134 R138 | A134-S136 PolarHBondContact O-N 3.19Å; S136-R138 VanDerWaalsContact C-N 3.3Å; S136-R138 PolarHBondContact O-N 3.43Å |
| 137 | A | 53.2 | Low | 48.6 | Very low | 93 Ų | 93 | 146.2 Ų | 146.2 | 77% | 0.769 | 80% | 0.797 | S | S | * | * | | | trans | -69.8 | 93.7 | 160.8 | 0 | 0 | 0 | 0 | 0 | 107.1 | A135 P139 | A135-A137 PolarHBondContact O-N 3.28Å; A137-P139 WeakPolarHBondContact O-CD 3.38Å |
| 138 | R | 49.4 | Very low | 49.1 | Very low | 218 Ų | 218 | 142.3 Ų | 142.3 | 82% | 0.823 | 79% | 0.787 | S | S | * | * | | | trans | -62.2 | 118.3 | 166.5 | -82.5 | -179 | 167.6 | -179.6 | -3.5 | 107.9 | S136 L140 | S136-R138 VanDerWaalsContact C-N 3.3Å; S136-R138 PolarHBondContact O-N 3.43Å; R138-L140 PolarHBondContact O-N 3.13Å; R138-L140 VanDerWaalsContact O-N 3.12Å |
| 139 | P | 47 | Very low | 49.9 | Very low | 108 Ų | 108 | 136.9 Ų | 136.9 | 70% | 0.701 | 77% | 0.773 | S | S | * | * | | | trans | -70.7 | 108.5 | 158.6 | 28.6 | -27.7 | 0 | 0 | 0 | 106.6 | A137 R141 | A137-P139 WeakPolarHBondContact O-CD 3.38Å; P139-R141 PolarHBondContact O-N 3.36Å |
| 140 | L | 44.1 | Very low | 50.3 | Low | 155 Ų | 155 | 127 Ų | 127 | 81% | 0.812 | 75% | 0.745 | S | S | * | * | | | trans | -59.7 | 90.3 | 160 | -94.7 | 134.7 | 0 | 0 | 0 | 107.1 | R138 T142 | R138-L140 PolarHBondContact O-N 3.13Å; R138-L140 VanDerWaalsContact O-N 3.12Å; L140-T142 PolarHBondContact O-N 3.14Å |
| 141 | R | 50.3 | Low | 50.9 | Low | 219 Ų | 219 | 129.4 Ų | 129.4 | 83% | 0.826 | 74% | 0.744 | S | S | * | * | | | trans | -71.9 | 87.3 | 159.5 | -77 | -176.2 | 171.6 | 171.7 | -2.5 | 106.4 | P139 Q143 | P139-R141 PolarHBondContact O-N 3.36Å; R141-Q143 PolarHBondContact O-N 3.48Å |
| 142 | T | 49.8 | Very low | 51.3 | Low | 123 Ų | 123 | 129.7 Ų | 129.7 | 76% | 0.755 | 74% | 0.738 | S | S | * | * | | | trans | -70.1 | 82.4 | 157.1 | 33 | 0 | 0 | 0 | 0 | 107.2 | L140 A144 | L140-T142 PolarHBondContact O-N 3.14Å; T142-A144 PolarHBondContact O-N 3.4Å |
| 143 | Q | 47.2 | Very low | 51.9 | Low | 174 Ų | 174 | 129.2 Ų | 129.2 | 81% | 0.813 | 73% | 0.727 | S | S | * | * | | | trans | -72.9 | 88 | 165.1 | -157 | 167.6 | -8.1 | 0 | 0 | 105.5 | R141 Q145 | R141-Q143 PolarHBondContact O-N 3.48Å; Q143-Q145 PolarHBondContact O-N 3.19Å |
| 144 | A | 57.1 | Low | 52.3 | Low | 94 Ų | 94 | 123.8 Ų | 123.8 | 78% | 0.777 | 72% | 0.716 | S | S | * | * | | | trans | -63.6 | 92.9 | 169.7 | 0 | 0 | 0 | 0 | 0 | 106.9 | T142 A146 | T142-A144 PolarHBondContact O-N 3.4Å; A144-A146 VanDerWaalsContact C-N 3.32Å; A144-A146 PolarHBondContact O-N 3.48Å |
| 145 | Q | 53.4 | Low | 52.7 | Low | 185 Ų | 185 | 122.4 Ų | 122.4 | 86% | 0.864 | 71% | 0.705 | S | S | * | * | | | trans | -65.1 | 100.1 | 168.4 | -168.7 | 167.5 | -9 | 0 | 0 | 105.4 | Q143 D147 | Q143-Q145 PolarHBondContact O-N 3.19Å; Q145-D147 VanDerWaalsContact C-N 3.29Å; Q145-D147 PolarHBondContact O-N 3.07Å |
| 146 | A | 57.3 | Low | 52.7 | Low | 91 Ų | 91 | 120.9 Ų | 120.9 | 75% | 0.752 | 69% | 0.692 | S | S | * | * | | | trans | -63 | 97.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 107 | A144 P148 | A144-A146 VanDerWaalsContact C-N 3.32Å; A144-A146 PolarHBondContact O-N 3.48Å; A146-P148 WeakPolarHBondContact O-CD 3.45Å |
| 147 | D | 58.8 | Low | 53.2 | Low | 90 Ų | 90 | 119.1 Ų | 119.1 | 48% | 0.481 | 68% | 0.684 | S | S | . | * | | | trans | -59.1 | 117 | 168.5 | 177 | 6 | 0 | 0 | 0 | 107.5 | Q145 H149 G150 | Q145-D147 VanDerWaalsContact C-N 3.29Å; Q145-D147 PolarHBondContact O-N 3.07Å; D147-H149 PolarHBondContact O-N 3.13Å; D147-H149 WeakPolarHBondContact OD1-CB 3.44Å; D147-H149 IonicContact OD1-CD2 3.49Å; D147-H149 PolarHBondContact OD1-CD2 3.32Å; D147-H149 IonicContact OD1-CG 3.82Å; D147-H149 PolarHBondContact OD1-N 3.2Å; D147-G150 PolarHBondContact O-N 2.86Å |
| 148 | P | 59.3 | Low | 53.1 | Low | 102 Ų | 102 | 118.5 Ų | 118.5 | 66% | 0.662 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.3 | -15.2 | 179.2 | 26.1 | -34.2 | 0 | 0 | 0 | 112.5 | A146 | A146-P148 WeakPolarHBondContact O-CD 3.45Š|
| 149 | H | 58.2 | Low | 53.3 | Low | 139 Ų | 139 | 112.5 Ų | 112.5 | 64% | 0.644 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.7 | -14.5 | 174.9 | -57.3 | -66 | 0 | 0 | 0 | 113.7 | D147 L151 L152 | D147-H149 PolarHBondContact O-N 3.13Å; D147-H149 WeakPolarHBondContact OD1-CB 3.44Å; D147-H149 IonicContact OD1-CD2 3.49Å; D147-H149 PolarHBondContact OD1-CD2 3.32Å; D147-H149 IonicContact OD1-CG 3.82Å; D147-H149 PolarHBondContact OD1-N 3.2Å; H149-L151 VanDerWaalsContact C-N 3.26Å; H149-L151 PolarHBondContact O-N 3.31Å; H149-L152 PolarHBondContact O-N 3.46Å |
| 150 | G | 54.9 | Low | 53.4 | Low | 30 Ų | 30 | 110.2 Ų | 110.2 | 31% | 0.309 | 67% | 0.671 | S | S | . | * | H | α-helix | trans | -67.1 | -24.7 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | D147 L154 | D147-G150 PolarHBondContact O-N 2.86Å; G150-L154 PolarHBondContact O-N 3.28Å |
| 151 | L | 56.3 | Low | 53.8 | Low | 142 Ų | 142 | 106.7 Ų | 106.7 | 74% | 0.743 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -74 | -27.5 | 175.9 | -65.8 | 177.6 | 0 | 0 | 0 | 112.7 | H149 A155 | H149-L151 VanDerWaalsContact C-N 3.26Å; H149-L151 PolarHBondContact O-N 3.31Å; L151-A155 PolarHBondContact O-N 3.04Å |
| 152 | L | 55.6 | Low | 54 | Low | 138 Ų | 138 | 107.3 Ų | 107.3 | 72% | 0.723 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -71.9 | -37.2 | 177.3 | -125.6 | 100.7 | 0 | 0 | 0 | 111.4 | H149 A155 A156 | H149-L152 PolarHBondContact O-N 3.46Å; L152-A155 PolarHBondContact O-N 3.12Å; L152-A156 PolarHBondContact O-N 2.93Å |
| 153 | A | 54.8 | Low | 54.3 | Low | 64 Ų | 64 | 109.6 Ų | 109.6 | 53% | 0.529 | 67% | 0.674 | S | S | . | * | H | α-helix | trans | -67.6 | -36.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | A156 A157 | A153-A156 PolarHBondContact O-N 2.97Å; A153-A157 PolarHBondContact O-N 2.85Å; A153-A157 VanDerWaalsContact O-N 3.13Å |
| 154 | L | 50.8 | Low | 54.8 | Low | 135 Ų | 135 | 112.8 Ų | 112.8 | 71% | 0.707 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -68.3 | -37 | 175.8 | -117.3 | 94.1 | 0 | 0 | 0 | 112.5 | G150 A157 A158 | G150-L154 PolarHBondContact O-N 3.28Å; L154-A157 PolarHBondContact O-N 2.95Å; L154-A158 PolarHBondContact O-N 3.46Å |
| 155 | A | 52.3 | Low | 55 | Low | 65 Ų | 65 | 117 Ų | 117 | 54% | 0.537 | 68% | 0.682 | S | S | . | * | H | α-helix | trans | -67.2 | -36.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | L151 L152 A158 A159 | L151-A155 PolarHBondContact O-N 3.04Å; L152-A155 PolarHBondContact O-N 3.12Å; A155-A158 PolarHBondContact O-N 2.83Å; A155-A159 PolarHBondContact O-N 3.04Å |
| 156 | A | 53.8 | Low | 55 | Low | 68 Ų | 68 | 116.1 Ų | 116.1 | 56% | 0.562 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -68.5 | -38.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | L152 A153 A158 A159 G160 | L152-A156 PolarHBondContact O-N 2.93Å; A153-A156 PolarHBondContact O-N 2.97Å; A156-A158 VanDerWaalsContact C-N 3.31Å; A156-A158 PolarHBondContact O-N 2.97Å; A156-A159 PolarHBondContact O-N 2.86Å; A156-G160 PolarHBondContact O-N 3.05Å |
| 157 | A | 53.9 | Low | 55.1 | Low | 69 Ų | 69 | 117.5 Ų | 117.5 | 57% | 0.57 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -66.3 | -31.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | A153 L154 | A153-A157 PolarHBondContact O-N 2.85Å; A153-A157 VanDerWaalsContact O-N 3.13Å; L154-A157 PolarHBondContact O-N 2.95Å |
| 158 | A | 51.6 | Low | 55.1 | Low | 80 Ų | 80 | 121.5 Ų | 121.5 | 66% | 0.661 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -75.2 | -28.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | L154 A155 A156 | L154-A158 PolarHBondContact O-N 3.46Å; A155-A158 PolarHBondContact O-N 2.83Å; A156-A158 VanDerWaalsContact C-N 3.31Å; A156-A158 PolarHBondContact O-N 2.97Å |
| 159 | A | 53.5 | Low | 55 | Low | 91 Ų | 91 | 128.4 Ų | 128.4 | 75% | 0.752 | 71% | 0.713 | S | S | * | * | H | α-helix | trans | -78.8 | -17.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | A155 A156 | A155-A159 PolarHBondContact O-N 3.04Å; A156-A159 PolarHBondContact O-N 2.86Å |
| 160 | G | 49.4 | Very low | 55.1 | Low | 60 Ų | 60 | 125.6 Ų | 125.6 | 62% | 0.619 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -96.5 | -3.7 | -178.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | A156 R162 | A156-G160 PolarHBondContact O-N 3.05Å; G160-R162 PolarHBondContact O-N 2.95Å |
| 161 | A | 52.1 | Low | 54.8 | Low | 82 Ų | 82 | 127.7 Ų | 127.7 | 68% | 0.678 | 74% | 0.743 | S | S | * | * | | | trans | -82.6 | 39.9 | -170.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | | |
| 162 | R | 54.7 | Low | 54.8 | Low | 232 Ų | 232 | 132.5 Ų | 132.5 | 88% | 0.875 | 75% | 0.751 | S | S | * | * | | | trans | -140.8 | 57 | 176.4 | -70.2 | -165.7 | 175.4 | -130.9 | 0.4 | 113.8 | G160 | G160-R162 PolarHBondContact O-N 2.95Š|
| 163 | L | 56.1 | Low | 54.8 | Low | 170 Ų | 170 | 137.7 Ų | 137.7 | 89% | 0.89 | 76% | 0.761 | S | S | * | * | | | trans | -147.6 | 71.4 | 155.1 | -70.8 | -179.8 | 0 | 0 | 0 | 109.2 | | |
| 164 | R | 57.5 | Low | 54.6 | Low | 241 Ų | 241 | 139.1 Ų | 139.1 | 91% | 0.909 | 77% | 0.773 | S | S | * | * | | | trans | -86.9 | 99.7 | 157.3 | -156.6 | -177.6 | -165.7 | -118.8 | 3.6 | 105.4 | E166 | R164-E166 PolarHBondContact O-N 2.97Å; R164-E166 VanDerWaalsContact O-N 3.08Å |
| 165 | E | 60.9 | Low | 54.6 | Low | 183 Ų | 183 | 142 Ų | 142 | 86% | 0.855 | 78% | 0.783 | S | S | * | * | | | trans | -59.1 | 111.7 | 167.3 | -84.3 | -177.8 | 154.4 | 0 | 0 | 108.1 | | |
| 166 | E | 53.6 | Low | 54.3 | Low | 166 Ų | 166 | 143.5 Ų | 143.5 | 78% | 0.776 | 80% | 0.796 | S | S | * | * | | | trans | -74.2 | 127.3 | 163.2 | -113 | -173.9 | 160.1 | 0 | 0 | 107.9 | R164 L168 | R164-E166 PolarHBondContact O-N 2.97Å; R164-E166 VanDerWaalsContact O-N 3.08Å; E166-L168 PolarHBondContact O-N 3.49Å |
| 167 | P | 59.1 | Low | 54.3 | Low | 121 Ų | 121 | 145 Ų | 145 | 79% | 0.786 | 81% | 0.808 | S | S | * | * | | | trans | -65.4 | 113.6 | 169.8 | 23.5 | -28.5 | 0 | 0 | 0 | 108.6 | R169 | P167-R169 PolarHBondContact O-N 3.49Š|
| 168 | L | 59.4 | Low | 54.2 | Low | 174 Ų | 174 | 145 Ų | 145 | 91% | 0.911 | 81% | 0.814 | S | S | * | * | | | trans | -52 | 107.1 | 176 | -70.3 | 166.8 | 0 | 0 | 0 | 109.4 | E166 G170 | E166-L168 PolarHBondContact O-N 3.49Å; L168-G170 PolarHBondContact O-N 3.49Å |
| 169 | R | 56.7 | Low | 54 | Low | 246 Ų | 246 | 153.2 Ų | 153.2 | 93% | 0.928 | 83% | 0.828 | S | S | * | * | | | trans | -66.7 | 100 | 173.4 | -151 | -179.8 | -168 | -165.2 | 3.6 | 107.3 | P167 G171 | P167-R169 PolarHBondContact O-N 3.49Å; R169-G171 PolarHBondContact O-N 3.42Å |
| 170 | G | 59.2 | Low | 54 | Low | 81 Ų | 81 | 158.1 Ų | 158.1 | 84% | 0.835 | 84% | 0.836 | S | S | * | * | | | trans | -55.2 | 102.7 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | L168 | L168-G170 PolarHBondContact O-N 3.49Š|
| 171 | G | 48.8 | Very low | 54.2 | Low | 73 Ų | 73 | 160.9 Ų | 160.9 | 75% | 0.753 | 85% | 0.845 | S | S | * | * | | | trans | -94 | 103.9 | 168.7 | 0 | 0 | 0 | 0 | 0 | 109.5 | R169 R173 | R169-G171 PolarHBondContact O-N 3.42Å; G171-R173 PolarHBondContact O-N 3.22Å |
| 172 | R | 56.9 | Low | 54.3 | Low | 244 Ų | 244 | 165.9 Ų | 165.9 | 92% | 0.921 | 86% | 0.855 | S | S | * | * | | | trans | -56.8 | 121.8 | 164.2 | -73.7 | -176.2 | 179.4 | -163.2 | -0.1 | 109.3 | | |
| 173 | R | 54.8 | Low | 54.4 | Low | 246 Ų | 246 | 160.1 Ų | 160.1 | 93% | 0.928 | 85% | 0.847 | S | S | * | * | | | trans | -143.2 | 114.6 | 151.6 | -80.1 | -161.4 | 177.7 | -144.9 | -1.8 | 111.6 | G171 | G171-R173 PolarHBondContact O-N 3.22Š|
| 174 | A | 51.9 | Low | 54.3 | Low | 95 Ų | 95 | 160.7 Ų | 160.7 | 79% | 0.785 | 85% | 0.85 | S | S | * | * | | | trans | 24.5 | 111.1 | 148.9 | 0 | 0 | 0 | 0 | 0 | 118.9 | A176 | A174-A176 PolarHBondContact O-N 3.5Š|
| 175 | E | 50.8 | Low | 53.8 | Low | 194 Ų | 194 | 160.3 Ų | 160.3 | 91% | 0.907 | 85% | 0.849 | S | S | * | * | | | trans | -37 | 117.5 | 143.9 | -170.6 | 177.1 | 177.1 | 0 | 0 | 111.9 | | |
| 176 | A | 45.7 | Very low | 53.5 | Low | 98 Ų | 98 | 159.8 Ų | 159.8 | 81% | 0.81 | 85% | 0.852 | S | S | * | * | | | trans | -130.9 | 103.4 | 161.3 | 0 | 0 | 0 | 0 | 0 | 107.1 | A174 | A174-A176 PolarHBondContact O-N 3.5Š|
| 177 | A | 53.4 | Low | 53.4 | Low | 98 Ų | 98 | 156.5 Ų | 156.5 | 81% | 0.81 | 85% | 0.853 | S | S | * | * | | | trans | -61.9 | 141 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | | |
| 178 | G | 52.6 | Low | 52.9 | Low | 69 Ų | 69 | 154.6 Ų | 154.6 | 71% | 0.711 | 86% | 0.855 | S | S | * | * | | | trans | 81.6 | 90.5 | 143.1 | 0 | 0 | 0 | 0 | 0 | 117.6 | | |
| 179 | R | 47.4 | Very low | 52.4 | Low | 253 Ų | 253 | 156.2 Ų | 156.2 | 96% | 0.955 | 86% | 0.858 | S | S | * | * | | | trans | -147 | 96 | 137.2 | -69.9 | -156.1 | 179.6 | -151.7 | -1 | 109.8 | | |
| 180 | Q | 52.3 | Low | 51.9 | Low | 195 Ų | 195 | 148.2 Ų | 148.2 | 91% | 0.911 | 85% | 0.853 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 127.7 | 164.9 | -72.5 | -178.6 | -29.1 | 0 | 0 | 108.8 | | |
| 181 | S | 53.8 | Low | 51.6 | Low | 117 Ų | 117 | 151.2 Ų | 151.2 | 82% | 0.818 | 86% | 0.855 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 122.4 | 168 | 45.6 | 0 | 0 | 0 | 0 | 109.7 | | |
| 182 | Q | 55.4 | Low | 52.1 | Low | 188 Ų | 188 | 154 Ų | 154 | 88% | 0.879 | 86% | 0.856 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 143.8 | 174.4 | -74.8 | -168.9 | -22.5 | 0 | 0 | 111.5 | | |
| 183 | P | 56.7 | Low | 52.1 | Low | 110 Ų | 110 | 147.7 Ų | 147.7 | 71% | 0.714 | 85% | 0.847 | S | S | * | * | P | Polyproline II helix | trans | -77.5 | 135.3 | 173 | 29.8 | -31.5 | 0 | 0 | 0 | 111.9 | R185 | P183-R185 PolarHBondContact O-N 3.37Š|
| 184 | L | 54 | Low | 52 | Low | 182 Ų | 182 | 144.9 Ų | 144.9 | 95% | 0.953 | 84% | 0.844 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 116.4 | 172.2 | -167.6 | 74.7 | 0 | 0 | 0 | 110.4 | | |
| 185 | R | 46.8 | Very low | 52.1 | Low | 233 Ų | 233 | 146.1 Ų | 146.1 | 88% | 0.879 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -103.9 | 122.8 | 172.6 | -72.7 | -165.2 | 175.6 | -166.2 | -0.9 | 110.5 | P183 | P183-R185 PolarHBondContact O-N 3.37Š|
| 186 | D | 53.5 | Low | 51.9 | Low | 172 Ų | 172 | 145.2 Ų | 145.2 | 92% | 0.92 | 84% | 0.841 | S | S | * | * | P | Polyproline II helix | trans | -72.5 | 129.8 | 170.9 | -155.1 | 9 | 0 | 0 | 0 | 109 | | |
| 187 | A | 51.2 | Low | 52.3 | Low | 98 Ų | 98 | 148.4 Ų | 148.4 | 81% | 0.81 | 84% | 0.844 | S | S | * | * | | | trans | -107.4 | 121.3 | -170.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | | |
| 188 | G | 49.1 | Very low | 52.1 | Low | 80 Ų | 80 | 152.6 Ų | 152.6 | 83% | 0.825 | 84% | 0.844 | S | S | * | * | | | trans | -77.7 | 159.7 | -166.6 | 0 | 0 | 0 | 0 | 0 | 117.4 | | |
| 189 | E | 49.4 | Very low | 52.1 | Low | 208 Ų | 208 | 155 Ų | 155 | 97% | 0.972 | 85% | 0.845 | S | S | * | * | | | trans | -65 | 135.7 | 169.3 | -77.5 | 175.9 | 132.9 | 0 | 0 | 112.2 | | |
| 190 | G | 47.2 | Very low | 52.3 | Low | 79 Ų | 79 | 152.5 Ų | 152.5 | 81% | 0.814 | 84% | 0.844 | S | S | * | * | | | trans | -119.8 | 124.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | | |
| 191 | V | 52.8 | Low | 52 | Low | 144 Ų | 144 | 149 Ų | 149 | 87% | 0.873 | 84% | 0.836 | S | S | * | * | | | trans | -82.2 | 141.8 | -178.4 | 171.9 | 0 | 0 | 0 | 0 | 111.7 | | |
| 192 | V | 59 | Low | 52.2 | Low | 130 Ų | 130 | 148.4 Ų | 148.4 | 79% | 0.788 | 84% | 0.838 | S | S | * | * | | | trans | -74.9 | 132.5 | 177.9 | 176.3 | 0 | 0 | 0 | 0 | 111.9 | | |
| 193 | P | 55.8 | Low | 52.1 | Low | 112 Ų | 112 | 148.1 Ų | 148.1 | 73% | 0.727 | 84% | 0.837 | S | S | * | * | | | trans | -108.1 | 140.3 | 160.4 | 31.8 | -19.8 | 0 | 0 | 0 | 112.9 | | |
| 194 | E | 53.2 | Low | 51.7 | Low | 187 Ų | 187 | 147.8 Ų | 147.8 | 87% | 0.874 | 84% | 0.843 | S | S | * | * | | | trans | -73.9 | 151.3 | 169.4 | -79.3 | -156.9 | 149.4 | 0 | 0 | 112.1 | | |
| 195 | P | 54 | Low | 51.3 | Low | 121 Ų | 121 | 142.9 Ų | 142.9 | 79% | 0.786 | 84% | 0.837 | S | S | * | * | | | trans | -91.3 | 134.2 | 177.4 | 34.1 | -30.6 | 0 | 0 | 0 | 113.2 | | |
| 196 | E | 47.6 | Very low | 51.3 | Low | 176 Ų | 176 | 136 Ų | 136 | 82% | 0.822 | 84% | 0.838 | S | S | * | * | | | trans | -105.2 | 117.5 | 165.8 | -68.2 | 179.5 | 169.9 | 0 | 0 | 109.9 | | |
| 197 | D | 54 | Low | 50.8 | Low | 165 Ų | 165 | 131.8 Ų | 131.8 | 88% | 0.882 | 84% | 0.835 | S | S | * | * | | | trans | -90.8 | 122.4 | 170.8 | -84.7 | -30.3 | 0 | 0 | 0 | 110.7 | | |
| 198 | K | 48.6 | Very low | 50.6 | Low | 185 Ų | 185 | 139.2 Ų | 139.2 | 80% | 0.804 | 84% | 0.842 | S | S | * | * | | | trans | -121.6 | 106.3 | 163.3 | -76.1 | -173 | -178.8 | 175.1 | 0 | 111.2 | | |
| 199 | V | 51.8 | Low | 50.8 | Low | 121 Ų | 121 | 143.8 Ų | 143.8 | 73% | 0.733 | 87% | 0.872 | S | S | * | * | | | trans | 27.2 | 119.2 | 134.4 | -159.8 | 0 | 0 | 0 | 0 | 117.4 | | |
| 200 | Q | 51.8 | Low | 50.8 | Low | 199 Ų | 199 | 140.6 Ų | 140.6 | 93% | 0.93 | 87% | 0.867 | S | S | * | * | | | trans | -117.3 | 114.6 | 149.6 | -74.8 | -168.8 | -7.9 | 0 | 0 | 110.7 | | |
| 201 | T | 46.7 | Very low | 51 | Low | 123 Ų | 123 | 143.8 Ų | 143.8 | 76% | 0.755 | 87% | 0.87 | S | S | * | * | | | trans | -69.4 | 127.7 | 168.6 | -39 | 0 | 0 | 0 | 0 | 109.3 | | |
| 202 | A | 57.7 | Low | 50.9 | Low | 103 Ų | 103 | 143.8 Ų | 143.8 | 85% | 0.851 | 87% | 0.87 | S | S | * | * | | | trans | -121 | 102 | 161 | 0 | 0 | 0 | 0 | 0 | 107.9 | | |
| 203 | E | 52.8 | Low | 50.5 | Low | 183 Ų | 183 | 144.6 Ų | 144.6 | 86% | 0.855 | 87% | 0.874 | S | S | * | * | | | trans | -84.5 | 132.6 | 159.7 | -83.3 | -155.9 | 139.4 | 0 | 0 | 109 | | |
| 204 | A | 48.1 | Very low | 50.1 | Low | 103 Ų | 103 | 146.6 Ų | 146.6 | 85% | 0.851 | 88% | 0.884 | S | S | * | * | | | | 161.5 | 131.1 | 109 | 0 | 0 | 0 | 0 | 0 | 111.8 | | |
| 205 | G | 46.5 | Very low | 49.9 | Very low | 79 Ų | 79 | 143.9 Ų | 143.9 | 81% | 0.814 | 88% | 0.884 | S | S | * | * | | | trans | 113.5 | 88.9 | 138.8 | 0 | 0 | 0 | 0 | 0 | 118.7 | | |
| 206 | G | 46 | Very low | 49.6 | Very low | 89 Ų | 89 | 145.6 Ų | 145.6 | 92% | 0.918 | 89% | 0.891 | S | S | * | * | | | | 68.5 | 121.7 | 117.4 | 0 | 0 | 0 | 0 | 0 | 121.1 | | |
| 207 | G | 43.7 | Very low | 49.8 | Very low | 83 Ų | 83 | 143.2 Ų | 143.2 | 86% | 0.856 | 90% | 0.897 | S | S | * | * | | | trans | 136.2 | 87.9 | 149.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | | |
| 208 | R | 47.4 | Very low | 49.5 | Very low | 254 Ų | 254 | 141.4 Ų | 141.4 | 96% | 0.958 | 90% | 0.898 | S | S | * | * | | | trans | -112.3 | 125 | 154.3 | -92.5 | -172.9 | 172.8 | -162.1 | -1.7 | 108.5 | | |
| 209 | A | 52.3 | Low | 49.5 | Very low | 175 Ų | 175 | 137.5 Ų | 137.5 | 100% | 1.446 | 91% | 0.906 | S | S | * | * | | | trans | -76.1 | 0 | 160.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | | |