| 1 | M | 44.8 | Very low | 47.9 | Very low | 239 Ų | 239 | 153 Ų | 153 | 100% | 1.177 | 86% | 0.859 | S | S | * | * | | | | 0 | 117.6 | 0 | -61.5 | -150.4 | 85.9 | 0 | 0 | 106.8 | | |
| 2 | H | 42.6 | Very low | 47.6 | Very low | 195 Ų | 195 | 149.6 Ų | 149.6 | 90% | 0.903 | 85% | 0.853 | S | S | * | * | | | trans | -80.2 | 145.4 | -178.1 | -80.9 | -89.8 | 0 | 0 | 0 | 111.2 | | |
| 3 | P | 64.3 | Low | 47.3 | Very low | 106 Ų | 106 | 146.8 Ų | 146.8 | 69% | 0.688 | 85% | 0.849 | S | S | * | * | | | trans | -101.5 | 151.1 | 168 | 37.4 | -28.5 | 0 | 0 | 0 | 113 | | |
| 4 | D | 47.8 | Very low | 47.1 | Very low | 144 Ų | 144 | 144.4 Ų | 144.4 | 77% | 0.77 | 85% | 0.845 | S | S | * | * | | | trans | 72.7 | 111.8 | 133.5 | -76.8 | -44.7 | 0 | 0 | 0 | 124.1 | | |
| 5 | S | 50.2 | Low | 46.5 | Very low | 110 Ų | 110 | 142.9 Ų | 142.9 | 77% | 0.769 | 84% | 0.843 | S | S | * | * | | | | 86.6 | 140.6 | 108.9 | -67.3 | 0 | 0 | 0 | 0 | 121.8 | | |
| 6 | S | 46.1 | Very low | 46.6 | Very low | 120 Ų | 120 | 141.4 Ų | 141.4 | 84% | 0.839 | 84% | 0.842 | S | S | * | * | | | trans | -72.6 | 155.7 | -165 | -46 | 0 | 0 | 0 | 0 | 116.7 | | |
| 7 | S | 43.9 | Very low | 46.9 | Very low | 120 Ų | 120 | 140.8 Ų | 140.8 | 84% | 0.839 | 84% | 0.843 | S | S | * | * | | | trans | -164.4 | 117.2 | 137.5 | 49.2 | 0 | 0 | 0 | 0 | 111.3 | | |
| 8 | E | 40.1 | Very low | 46.6 | Very low | 189 Ų | 189 | 138.7 Ų | 138.7 | 88% | 0.883 | 84% | 0.843 | S | S | * | * | | | trans | -110.4 | 123.8 | 162.5 | -73.7 | -162.5 | 119 | 0 | 0 | 107.6 | | |
| 9 | L | 49.6 | Very low | 46.7 | Very low | 175 Ų | 175 | 136.6 Ų | 136.6 | 92% | 0.916 | 84% | 0.842 | S | S | * | * | | | trans | -151.5 | 120 | 162.8 | -72.3 | 178.9 | 0 | 0 | 0 | 109.3 | | |
| 10 | D | 43.9 | Very low | 47.4 | Very low | 160 Ų | 160 | 136 Ų | 136 | 86% | 0.856 | 84% | 0.84 | S | S | * | * | | | trans | -63 | 161.5 | 165.4 | -86.1 | -52.6 | 0 | 0 | 0 | 112.7 | | |
| 11 | P | 54 | Low | 47 | Very low | 125 Ų | 125 | 133 Ų | 133 | 81% | 0.812 | 84% | 0.836 | S | S | * | * | | | trans | -131.7 | 139.7 | 134.2 | 35.2 | -23.4 | 0 | 0 | 0 | 114.3 | | |
| 12 | S | 44.4 | Very low | 46.7 | Very low | 112 Ų | 112 | 125.1 Ų | 125.1 | 78% | 0.783 | 82% | 0.816 | S | S | * | * | | | trans | -76.1 | 154.2 | 175.1 | -45.1 | 0 | 0 | 0 | 0 | 114.4 | | |
| 13 | S | 43.4 | Very low | 46.6 | Very low | 114 Ų | 114 | 123.6 Ų | 123.6 | 80% | 0.797 | 81% | 0.814 | S | S | * | * | | | trans | 52.1 | 122 | 133.3 | -166.6 | 0 | 0 | 0 | 0 | 120.9 | | |
| 14 | S | 45.1 | Very low | 45.8 | Very low | 113 Ų | 113 | 125 Ų | 125 | 79% | 0.79 | 82% | 0.821 | S | S | * | * | | | | -179.7 | 129.6 | 112.3 | 43.8 | 0 | 0 | 0 | 0 | 113.3 | | |
| 15 | C | 37.5 | Very low | 45.9 | Very low | 122 Ų | 122 | 124.1 Ų | 124.1 | 82% | 0.824 | 82% | 0.823 | S | S | * | * | | | trans | -81.4 | 146.6 | 166.6 | -58.5 | 0 | 0 | 0 | 0 | 110.4 | | |
| 16 | S | 48.8 | Very low | 45.3 | Very low | 119 Ų | 119 | 122.1 Ų | 122.1 | 83% | 0.832 | 82% | 0.821 | S | S | * | * | | | trans | -156.9 | 117.1 | 156.8 | -79.7 | 0 | 0 | 0 | 0 | 110.7 | | |
| 17 | P | 51 | Low | 44.6 | Very low | 131 Ų | 131 | 122.6 Ų | 122.6 | 85% | 0.851 | 82% | 0.823 | S | S | * | * | | | trans | -96 | 127.7 | 165.4 | 33.4 | -24.8 | 0 | 0 | 0 | 109.8 | | |
| 18 | A | 41.8 | Very low | 44.5 | Very low | 103 Ų | 103 | 122 Ų | 122 | 85% | 0.851 | 82% | 0.818 | S | S | * | * | | | trans | -118.2 | 122 | 172.5 | 0 | 0 | 0 | 0 | 0 | 110 | | |
| 19 | A | 49 | Very low | 44.1 | Very low | 98 Ų | 98 | 121.5 Ų | 121.5 | 81% | 0.81 | 82% | 0.821 | S | S | * | * | | | trans | -90.4 | 158.8 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | | |
| 20 | P | 59 | Low | 43.8 | Very low | 124 Ų | 124 | 124.4 Ų | 124.4 | 81% | 0.805 | 82% | 0.819 | S | S | * | * | | | trans | -128 | 130.4 | 134.6 | 29.8 | -15.3 | 0 | 0 | 0 | 109.3 | | |
| 21 | G | 40.6 | Very low | 43.6 | Very low | 74 Ų | 74 | 122.2 Ų | 122.2 | 76% | 0.763 | 81% | 0.814 | S | S | * | * | | | | 57.6 | 97.1 | 73.3 | 0 | 0 | 0 | 0 | 0 | 108.8 | | |
| 22 | G | 38 | Very low | 43.3 | Very low | 73 Ų | 73 | 121.9 Ų | 121.9 | 75% | 0.753 | 81% | 0.812 | S | S | * | * | | | cis | 95.8 | 68.5 | 39.6 | 0 | 0 | 0 | 0 | 0 | 109.4 | | |
| 23 | D | 40.7 | Very low | 42.9 | Very low | 163 Ų | 163 | 124.1 Ų | 124.1 | 87% | 0.872 | 82% | 0.815 | S | S | * | * | | | trans | -145.1 | 114.6 | 164.1 | -86.4 | -48.1 | 0 | 0 | 0 | 109.9 | | |
| 24 | T | 47.5 | Very low | 42.6 | Very low | 136 Ų | 136 | 124.5 Ų | 124.5 | 83% | 0.834 | 82% | 0.818 | S | S | * | * | | | trans | -96.4 | 145.2 | 162.7 | 46.2 | 0 | 0 | 0 | 0 | 107.7 | | |
| 25 | P | 49.3 | Very low | 42.3 | Very low | 125 Ų | 125 | 126.9 Ų | 126.9 | 81% | 0.812 | 82% | 0.821 | S | S | * | * | | | trans | -130.1 | 116.6 | 137 | 31.5 | -18.8 | 0 | 0 | 0 | 110 | | |
| 26 | G | 36.5 | Very low | 42.2 | Very low | 69 Ų | 69 | 126.8 Ų | 126.8 | 71% | 0.711 | 82% | 0.821 | S | S | * | * | | | trans | -73 | 138.5 | 155.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | | |
| 27 | C | 32.3 | Very low | 41.4 | Very low | 130 Ų | 130 | 126.4 Ų | 126.4 | 88% | 0.878 | 82% | 0.819 | S | S | * | * | | | | -179.3 | 132.3 | 125.6 | -113.9 | 0 | 0 | 0 | 0 | 110.6 | | |
| 28 | S | 40.9 | Very low | 40.7 | Very low | 107 Ų | 107 | 125.3 Ų | 125.3 | 75% | 0.748 | 81% | 0.814 | S | S | * | * | | | trans | -15.8 | 131.2 | 156.5 | -64.3 | 0 | 0 | 0 | 0 | 115.6 | | |
| 29 | L | 33.4 | Very low | 40.4 | Very low | 178 Ų | 178 | 127 Ų | 127 | 93% | 0.932 | 81% | 0.814 | S | S | * | * | | | trans | -151.4 | 121.7 | 132.5 | -77.1 | -173 | 0 | 0 | 0 | 110.5 | | |
| 30 | R | 43.3 | Very low | 40 | Very low | 237 Ų | 237 | 129.6 Ų | 129.6 | 89% | 0.894 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -78.7 | 139.1 | 170.2 | -176.3 | -178.2 | -174.3 | 175.3 | 1.3 | 108.3 | | |
| 31 | P | 39.5 | Very low | 38.9 | Very low | 114 Ų | 114 | 129.4 Ų | 129.4 | 74% | 0.74 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -81.6 | 146 | 171.2 | -7.2 | 24.9 | 0 | 0 | 0 | 111.1 | | |
| 32 | P | 46.2 | Very low | 39 | Very low | 118 Ų | 118 | 130.5 Ų | 130.5 | 77% | 0.766 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -85.3 | 149.5 | 179.2 | 34 | -32.8 | 0 | 0 | 0 | 112.7 | | |
| 33 | D | 35.8 | Very low | 39.1 | Very low | 158 Ų | 158 | 136.8 Ų | 136.8 | 85% | 0.845 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 135.4 | 160.1 | -61.7 | -57.9 | 0 | 0 | 0 | 110.1 | | |
| 34 | S | 37.4 | Very low | 39.1 | Very low | 123 Ų | 123 | 136.9 Ų | 136.9 | 86% | 0.86 | 83% | 0.825 | S | S | * | * | | | trans | -150.4 | 127.4 | 158.1 | -77.7 | 0 | 0 | 0 | 0 | 110.5 | | |
| 35 | L | 39.4 | Very low | 38.5 | Very low | 162 Ų | 162 | 134 Ų | 134 | 85% | 0.848 | 82% | 0.822 | S | S | * | * | | | trans | -91.5 | 153.1 | -174.2 | -65.3 | 161.1 | 0 | 0 | 0 | 111.3 | | |
| 36 | S | 35.7 | Very low | 38.1 | Very low | 120 Ų | 120 | 135.7 Ų | 135.7 | 84% | 0.839 | 82% | 0.824 | S | S | * | * | | | trans | 71.9 | 121.6 | 144.5 | -71.7 | 0 | 0 | 0 | 0 | 122 | | |
| 37 | S | 31.1 | Very low | 38.2 | Very low | 112 Ų | 112 | 138.6 Ų | 138.6 | 78% | 0.783 | 83% | 0.828 | S | S | * | * | | | | -159.2 | 111.4 | 123.8 | 60.3 | 0 | 0 | 0 | 0 | 108.3 | | |
| 38 | S | 37.2 | Very low | 38.6 | Very low | 107 Ų | 107 | 138 Ų | 138 | 75% | 0.748 | 83% | 0.825 | S | S | * | * | | | | 59.2 | 111 | 97 | -162.5 | 0 | 0 | 0 | 0 | 114.1 | | |
| 39 | V | 36.4 | Very low | 38.6 | Very low | 140 Ų | 140 | 136.6 Ų | 136.6 | 85% | 0.848 | 82% | 0.821 | S | S | * | * | | | | -173.2 | 142.6 | 103.8 | -80.7 | 0 | 0 | 0 | 0 | 110.6 | | |
| 40 | D | 40.4 | Very low | 39 | Very low | 151 Ų | 151 | 134.5 Ų | 134.5 | 81% | 0.807 | 82% | 0.817 | S | S | * | * | | | trans | -78.6 | 139.1 | 171.7 | -162.6 | -74.8 | 0 | 0 | 0 | 109.8 | | |
| 41 | S | 35.3 | Very low | 39 | Very low | 120 Ų | 120 | 127.3 Ų | 127.3 | 84% | 0.839 | 81% | 0.809 | S | S | * | * | | | trans | -174 | 118.4 | 148.5 | -82.9 | 0 | 0 | 0 | 0 | 111.6 | | |
| 42 | A | 42.3 | Very low | 39.1 | Very low | 98 Ų | 98 | 126.2 Ų | 126.2 | 81% | 0.81 | 81% | 0.809 | S | S | * | * | | | trans | -70.2 | 137.9 | 166.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | | |
| 43 | K | 40.7 | Very low | 39.1 | Very low | 204 Ų | 204 | 130.4 Ų | 130.4 | 89% | 0.887 | 82% | 0.816 | S | S | * | * | | | trans | -163.1 | 127.4 | 147.5 | -149.5 | 158.8 | 178.9 | 174.8 | 0 | 112.3 | | |
| 44 | D | 40.7 | Very low | 39.8 | Very low | 166 Ų | 166 | 128.2 Ų | 128.2 | 89% | 0.888 | 81% | 0.808 | S | S | * | * | | | trans | -58.4 | 146.8 | 173.1 | -61.1 | -75.8 | 0 | 0 | 0 | 113.4 | | |
| 45 | G | 35.2 | Very low | 39.9 | Very low | 75 Ų | 75 | 127.1 Ų | 127.1 | 77% | 0.773 | 80% | 0.798 | S | S | * | * | | | trans | -177.1 | 93.2 | 174 | 0 | 0 | 0 | 0 | 0 | 111.6 | T47 | G45-T47 PolarHBondContact O-N 3.48Š|
| 46 | D | 40.9 | Very low | 40.5 | Very low | 160 Ų | 160 | 124.3 Ų | 124.3 | 86% | 0.856 | 79% | 0.792 | S | S | * | * | | | trans | -65.8 | 116.5 | 173.9 | -157 | -23 | 0 | 0 | 0 | 110 | | |
| 47 | T | 37.3 | Very low | 41.3 | Very low | 131 Ų | 131 | 125.1 Ų | 125.1 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | | | trans | -156.1 | 106.8 | 161.4 | -65.2 | 0 | 0 | 0 | 0 | 108.7 | G45 A49 | G45-T47 PolarHBondContact O-N 3.48Å; T47-A49 PolarHBondContact O-N 2.88Å |
| 48 | S | 41.7 | Very low | 42.6 | Very low | 117 Ų | 117 | 125.4 Ų | 125.4 | 82% | 0.818 | 79% | 0.788 | S | S | * | * | | | trans | -55.5 | 115.2 | 171.6 | 175.2 | 0 | 0 | 0 | 0 | 112 | | |
| 49 | A | 39.8 | Very low | 43.4 | Very low | 78 Ų | 78 | 125.1 Ų | 125.1 | 65% | 0.645 | 79% | 0.793 | S | S | * | * | | | trans | -132.1 | 139.3 | 155.8 | 0 | 0 | 0 | 0 | 0 | 107.2 | T47 A51 | T47-A49 PolarHBondContact O-N 2.88Å; A49-A51 PolarHBondContact O-N 2.85Å |
| 50 | P | 42.8 | Very low | 44.3 | Very low | 133 Ų | 133 | 124.6 Ų | 124.6 | 86% | 0.864 | 78% | 0.784 | S | S | * | * | | | trans | -65.1 | 114.7 | -174 | 26.4 | -32.7 | 0 | 0 | 0 | 109.3 | A52 | P50-A52 PolarHBondContact O-N 3.24Š|
| 51 | A | 42.7 | Very low | 44.7 | Very low | 87 Ų | 87 | 121 Ų | 121 | 72% | 0.719 | 77% | 0.771 | S | S | * | * | | | trans | -50.8 | 126.7 | 172.2 | 0 | 0 | 0 | 0 | 0 | 109.1 | A49 F53 | A49-A51 PolarHBondContact O-N 2.85Å; A51-F53 PolarHBondContact O-N 3.48Å |
| 52 | A | 41.8 | Very low | 45.7 | Very low | 90 Ų | 90 | 122.1 Ų | 122.1 | 74% | 0.744 | 77% | 0.773 | S | S | * | * | | | trans | -44.9 | 115.2 | 166.4 | 0 | 0 | 0 | 0 | 0 | 108.3 | P50 V54 | P50-A52 PolarHBondContact O-N 3.24Å; A52-V54 PolarHBondContact O-N 3.28Å |
| 53 | F | 46.2 | Very low | 46.4 | Very low | 206 Ų | 206 | 119.6 Ų | 119.6 | 90% | 0.904 | 75% | 0.749 | S | S | * | * | | | trans | -70.1 | 84.3 | -177.6 | -141.6 | -93.1 | 0 | 0 | 0 | 107.8 | A51 P55 | A51-F53 PolarHBondContact O-N 3.48Å; F53-P55 WeakPolarHBondContact O-CD 3.43Å |
| 54 | V | 50.3 | Low | 47.6 | Very low | 112 Ų | 112 | 115.1 Ų | 115.1 | 68% | 0.679 | 74% | 0.74 | S | S | * | * | | | trans | -72.6 | 120.4 | 167.2 | -176.6 | 0 | 0 | 0 | 0 | 105.8 | A52 S56 | A52-V54 PolarHBondContact O-N 3.28Å; V54-S56 PolarHBondContact O-N 3.43Å |
| 55 | P | 41 | Very low | 48.4 | Very low | 101 Ų | 101 | 114.1 Ų | 114.1 | 66% | 0.656 | 73% | 0.731 | S | S | * | * | | | trans | -66.9 | 99.8 | 174.7 | -13.3 | 27.8 | 0 | 0 | 0 | 108.3 | F53 V57 | F53-P55 WeakPolarHBondContact O-CD 3.43Å; P55-V57 WeakPolarHBondContact O-CG2 3.48Å; P55-V57 PolarHBondContact O-N 3.06Å |
| 56 | S | 50.5 | Low | 49.7 | Very low | 103 Ų | 103 | 113.8 Ų | 113.8 | 72% | 0.72 | 71% | 0.711 | S | S | * | * | | | trans | -66.7 | 95.4 | 167.9 | -79.5 | 0 | 0 | 0 | 0 | 108.6 | V54 T58 | V54-S56 PolarHBondContact O-N 3.43Å; S56-T58 PolarHBondContact O-N 3.2Å |
| 57 | V | 52.2 | Low | 50.6 | Low | 137 Ų | 137 | 113.6 Ų | 113.6 | 83% | 0.83 | 70% | 0.702 | S | S | * | * | | | trans | -75.5 | 69.9 | 177.1 | -165.5 | 0 | 0 | 0 | 0 | 110 | P55 | P55-V57 WeakPolarHBondContact O-CG2 3.48Å; P55-V57 PolarHBondContact O-N 3.06Å |
| 58 | T | 59.4 | Low | 52 | Low | 117 Ų | 117 | 115.4 Ų | 115.4 | 72% | 0.718 | 70% | 0.695 | S | S | * | * | | | trans | -138.2 | 32.9 | 166.2 | 37.9 | 0 | 0 | 0 | 0 | 112 | S56 I60 | S56-T58 PolarHBondContact O-N 3.2Å; T58-I60 VanDerWaalsContact C-N 3.35Å; T58-I60 PolarHBondContact O-N 3.48Å |
| 59 | A | 54.1 | Low | 53.2 | Low | 101 Ų | 101 | 115.2 Ų | 115.2 | 84% | 0.835 | 68% | 0.682 | S | S | * | * | | | trans | -87.5 | 80 | 160.5 | 0 | 0 | 0 | 0 | 0 | 108.5 | S61 | A59-S61 PolarHBondContact O-N 2.72Š|
| 60 | I | 54.6 | Low | 54.4 | Low | 129 Ų | 129 | 116 Ų | 116 | 66% | 0.662 | 68% | 0.678 | S | S | * | * | | | trans | -73.7 | 109.5 | 174.5 | -52.4 | 173.5 | 0 | 0 | 0 | 106.8 | T58 T62 | T58-I60 VanDerWaalsContact C-N 3.35Å; T58-I60 PolarHBondContact O-N 3.48Å; I60-T62 PolarHBondContact O-N 3.31Å; I60-T62 VanDerWaalsContact O-N 3.07Å |
| 61 | S | 49.3 | Very low | 54.9 | Low | 77 Ų | 77 | 116.6 Ų | 116.6 | 54% | 0.538 | 67% | 0.67 | S | S | . | * | | | trans | -53.4 | 113.7 | 169.3 | 178.4 | 0 | 0 | 0 | 0 | 108.8 | A59 S63 | A59-S61 PolarHBondContact O-N 2.72Å; S61-S63 PolarHBondContact O-N 2.91Å |
| 62 | T | 57.4 | Low | 55.2 | Low | 143 Ų | 143 | 117.7 Ų | 117.7 | 88% | 0.877 | 67% | 0.669 | S | S | * | * | | | trans | -73.5 | 54.9 | 174.3 | 55 | 0 | 0 | 0 | 0 | 109.9 | I60 | I60-T62 PolarHBondContact O-N 3.31Å; I60-T62 VanDerWaalsContact O-N 3.07Å |
| 63 | S | 56.9 | Low | 55.5 | Low | 45 Ų | 45 | 119.3 Ų | 119.3 | 32% | 0.315 | 67% | 0.67 | S | S | . | * | | | trans | -99.5 | 122.1 | 170.7 | 179.5 | 0 | 0 | 0 | 0 | 109 | S61 E65 L66 | S61-S63 PolarHBondContact O-N 2.91Å; S63-E65 PolarHBondContact O-N 3.4Å; S63-L66 PolarHBondContact O-N 2.9Å |
| 64 | P | 65.5 | Low | 55.4 | Low | 109 Ų | 109 | 113.6 Ų | 113.6 | 71% | 0.708 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.7 | -17.6 | 179.2 | -23.1 | 32.5 | 0 | 0 | 0 | 114.2 | K67 | P64-K67 WeakPolarHBondContact O-CE 3.37Š|
| 65 | E | 57.7 | Low | 55.2 | Low | 146 Ų | 146 | 116 Ų | 116 | 68% | 0.682 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.8 | -16.6 | -175.9 | -163.2 | 174 | -179.7 | 0 | 0 | 113.2 | S63 W68 | S63-E65 PolarHBondContact O-N 3.4Å; E65-W68 PolarHBondContact O-NE1 2.88Å |
| 66 | L | 62.4 | Low | 54.9 | Low | 67 Ų | 67 | 117.1 Ų | 117.1 | 35% | 0.351 | 67% | 0.674 | S | S | . | * | S | Bend | trans | -99.6 | 2.6 | -174.5 | -55.8 | 178.2 | 0 | 0 | 0 | 114 | S63 W68 M69 | S63-L66 PolarHBondContact O-N 2.9Å; L66-W68 PolarHBondContact O-N 3.3Å; L66-W68 VanDerWaalsContact O-N 3.12Å; L66-M69 HydrophobicContact CB-CE 4.44Å; L66-M69 HydrophobicContact CD2-CE 3.66Å; L66-M69 WeakPolarHBondContact O-CB 3.31Å; L66-M69 PolarHBondContact O-N 2.98Å |
| 67 | K | 60.3 | Low | 54.2 | Low | 156 Ų | 156 | 118 Ų | 118 | 68% | 0.678 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61 | -24.7 | -176.8 | 85.2 | 178.6 | 78.4 | -177.7 | 0 | 114.1 | P64 M69 | P64-K67 WeakPolarHBondContact O-CE 3.37Å; K67-M69 PolarHBondContact O-N 3.45Å |
| 68 | W | 65.5 | Low | 53.4 | Low | 170 Ų | 170 | 114.9 Ų | 114.9 | 64% | 0.644 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.7 | -16.6 | 177.7 | 49.8 | -102.1 | 0 | 0 | 0 | 112.4 | E65 L66 | E65-W68 PolarHBondContact O-NE1 2.88Å; L66-W68 PolarHBondContact O-N 3.3Å; L66-W68 VanDerWaalsContact O-N 3.12Å |
| 69 | M | 66.9 | Low | 52.3 | Low | 113 Ų | 113 | 118.5 Ų | 118.5 | 56% | 0.557 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.5 | -15.9 | -176.2 | -144.2 | -176.7 | -33.3 | 0 | 0 | 113.1 | L66 K67 | L66-M69 HydrophobicContact CB-CE 4.44Å; L66-M69 HydrophobicContact CD2-CE 3.66Å; L66-M69 WeakPolarHBondContact O-CB 3.31Å; L66-M69 PolarHBondContact O-N 2.98Å; K67-M69 PolarHBondContact O-N 3.45Å |
| 70 | V | 64.1 | Low | 51.4 | Low | 93 Ų | 93 | 118.2 Ų | 118.2 | 56% | 0.564 | 68% | 0.679 | S | S | * | * | | | trans | -116.5 | 86.4 | 179 | -171.2 | 0 | 0 | 0 | 0 | 108.7 | | |
| 71 | Q | 54.3 | Low | 50.8 | Low | 146 Ų | 146 | 120.7 Ų | 120.7 | 68% | 0.682 | 69% | 0.685 | S | S | * | * | | | trans | -104.4 | 108.7 | 166.8 | -72.9 | -70.4 | 1.9 | 0 | 0 | 108.7 | T73 | Q71-T73 PolarHBondContact O-N 3.1Š|
| 72 | P | 49.3 | Very low | 50.1 | Low | 110 Ų | 110 | 123.9 Ų | 123.9 | 71% | 0.714 | 70% | 0.701 | S | S | * | * | | | trans | -69.4 | 104.3 | 170.7 | -8.6 | 24.1 | 0 | 0 | 0 | 108.2 | A74 | P72-A74 VanDerWaalsContact C-N 3.33Å; P72-A74 PolarHBondContact O-N 3.13Å; P72-A74 VanDerWaalsContact O-N 3.09Å |
| 73 | T | 47.7 | Very low | 49.3 | Very low | 124 Ų | 124 | 126.6 Ų | 126.6 | 76% | 0.761 | 70% | 0.701 | S | S | * | * | | | trans | -82.7 | 85.3 | 172.3 | -53.8 | 0 | 0 | 0 | 0 | 108.1 | Q71 I75 | Q71-T73 PolarHBondContact O-N 3.1Å; T73-I75 PolarHBondContact O-N 3.02Å |
| 74 | A | 44.5 | Very low | 48.2 | Very low | 86 Ų | 86 | 131 Ų | 131 | 71% | 0.711 | 73% | 0.727 | S | S | * | * | | | trans | -75.5 | 109.2 | 168.3 | 0 | 0 | 0 | 0 | 0 | 109 | P72 T76 | P72-A74 VanDerWaalsContact C-N 3.33Å; P72-A74 PolarHBondContact O-N 3.13Å; P72-A74 VanDerWaalsContact O-N 3.09Å; A74-T76 PolarHBondContact O-N 3.48Å |
| 75 | I | 44.5 | Very low | 47 | Very low | 162 Ų | 162 | 133.9 Ų | 133.9 | 83% | 0.831 | 74% | 0.736 | S | S | * | * | | | trans | -85.2 | 96.9 | 170.7 | -25.1 | 172.7 | 0 | 0 | 0 | 106.6 | T73 | T73-I75 PolarHBondContact O-N 3.02Š|
| 76 | T | 35.8 | Very low | 45.8 | Very low | 126 Ų | 126 | 130.7 Ų | 130.7 | 77% | 0.773 | 74% | 0.742 | S | S | * | * | | | trans | -122.4 | 113.7 | 172.9 | -75 | 0 | 0 | 0 | 0 | 110.2 | A74 | A74-T76 PolarHBondContact O-N 3.48Š|
| 77 | S | 36 | Very low | 44.8 | Very low | 120 Ų | 120 | 132 Ų | 132 | 84% | 0.839 | 76% | 0.762 | S | S | * | * | | | trans | -73.4 | 139.3 | 160.4 | 96.2 | 0 | 0 | 0 | 0 | 108.9 | | |
| 78 | G | 35.2 | Very low | 43.6 | Very low | 73 Ų | 73 | 132.1 Ų | 132.1 | 75% | 0.753 | 77% | 0.771 | S | S | * | * | | | trans | 152.5 | 114.5 | 166.9 | 0 | 0 | 0 | 0 | 0 | 115 | | |
| 79 | F | 35.9 | Very low | 42.7 | Very low | 193 Ų | 193 | 132.3 Ų | 132.3 | 85% | 0.846 | 78% | 0.779 | S | S | * | * | | | trans | -62 | 132.8 | 172.6 | 175.4 | -88.5 | 0 | 0 | 0 | 113.1 | | |
| 80 | A | 35.1 | Very low | 41.3 | Very low | 94 Ų | 94 | 132.6 Ų | 132.6 | 78% | 0.777 | 79% | 0.792 | S | S | * | * | | | trans | -165.3 | 127.6 | 145.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | | |
| 81 | K | 43 | Very low | 40.3 | Very low | 182 Ų | 182 | 133.6 Ų | 133.6 | 79% | 0.791 | 80% | 0.803 | S | S | * | * | | | trans | -75.5 | 135.7 | 167.3 | -78.6 | 172.7 | 171.6 | 169.2 | 0 | 110 | | |
| 82 | T | 33.2 | Very low | 39.9 | Very low | 143 Ų | 143 | 132 Ų | 132 | 88% | 0.877 | 81% | 0.805 | S | S | * | * | | | trans | -146.1 | 129.8 | 140.7 | 45.3 | 0 | 0 | 0 | 0 | 109.6 | | |
| 83 | K | 41.2 | Very low | 39.4 | Very low | 201 Ų | 201 | 133.3 Ų | 133.3 | 87% | 0.874 | 81% | 0.811 | S | S | * | * | | | trans | -82.5 | 136.2 | 166.5 | -84.4 | -172.4 | 167.2 | -169.3 | 0 | 108.1 | | |
| 84 | T | 34.7 | Very low | 38.9 | Very low | 138 Ų | 138 | 131 Ų | 131 | 85% | 0.847 | 81% | 0.812 | S | S | * | * | | | trans | -149.2 | 125.1 | 147.8 | 41 | 0 | 0 | 0 | 0 | 109.2 | | |
| 85 | D | 39 | Very low | 39 | Very low | 168 Ų | 168 | 131.5 Ų | 131.5 | 90% | 0.898 | 82% | 0.816 | S | S | * | * | | | trans | -64.3 | 147.3 | 171.2 | -72.2 | -64.8 | 0 | 0 | 0 | 111.7 | | |
| 86 | G | 32.3 | Very low | 39.2 | Very low | 79 Ų | 79 | 133.3 Ų | 133.3 | 81% | 0.814 | 82% | 0.818 | S | S | * | * | | | trans | -170.5 | 79 | 175.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | | |
| 87 | A | 42.8 | Very low | 39.6 | Very low | 94 Ų | 94 | 137.4 Ų | 137.4 | 78% | 0.777 | 82% | 0.819 | S | S | * | * | | | trans | -72.1 | 128.5 | 170.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | | |
| 88 | N | 34.6 | Very low | 40.4 | Very low | 160 Ų | 160 | 136.6 Ų | 136.6 | 86% | 0.856 | 82% | 0.82 | S | S | * | * | | | trans | -158.4 | 148.4 | 134.1 | -118.1 | -11.5 | 0 | 0 | 0 | 112.7 | | |
| 89 | Q | 46.3 | Very low | 41.1 | Very low | 174 Ų | 174 | 140 Ų | 140 | 81% | 0.813 | 81% | 0.814 | S | S | * | * | | | trans | -95.2 | 142.8 | -157.8 | -55 | 168.8 | 17.9 | 0 | 0 | 111.2 | | |
| 90 | S | 37.3 | Very low | 41.6 | Very low | 119 Ų | 119 | 136.1 Ų | 136.1 | 83% | 0.832 | 81% | 0.806 | S | S | * | * | | | | -179.5 | 118 | 129.7 | 39.7 | 0 | 0 | 0 | 0 | 110.1 | | |
| 91 | S | 43.5 | Very low | 42.5 | Very low | 114 Ų | 114 | 137.7 Ų | 137.7 | 80% | 0.797 | 81% | 0.81 | S | S | * | * | | | trans | -92.6 | 160.8 | 160.9 | -53.1 | 0 | 0 | 0 | 0 | 107.6 | | |
| 92 | P | 46.2 | Very low | 42.9 | Very low | 112 Ų | 112 | 135.5 Ų | 135.5 | 73% | 0.727 | 81% | 0.807 | S | S | * | * | | | | -139.1 | 145.7 | 74.8 | 33.8 | -15.4 | 0 | 0 | 0 | 114.9 | | |
| 93 | T | 37.9 | Very low | 43.7 | Very low | 137 Ų | 137 | 137.3 Ų | 137.3 | 84% | 0.84 | 80% | 0.803 | S | S | * | * | | | trans | 51.8 | 119.7 | 139.7 | 61.6 | 0 | 0 | 0 | 0 | 119.2 | | |
| 94 | G | 38.7 | Very low | 44 | Very low | 75 Ų | 75 | 137 Ų | 137 | 77% | 0.773 | 80% | 0.801 | S | S | * | * | | | cis | -173.3 | 146.7 | 7.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | | |
| 95 | A | 45.1 | Very low | 44.9 | Very low | 97 Ų | 97 | 135.4 Ų | 135.4 | 80% | 0.802 | 80% | 0.802 | S | S | * | * | | | trans | 48.7 | 85.4 | 152.6 | 0 | 0 | 0 | 0 | 0 | 117.9 | | |
| 96 | K | 49 | Very low | 45.2 | Very low | 201 Ų | 201 | 135.2 Ų | 135.2 | 87% | 0.874 | 80% | 0.796 | S | S | * | * | | | | 18.4 | 116.2 | 85.4 | -56.2 | -154.8 | -175.5 | -168.2 | 0 | 115.3 | | |
| 97 | R | 44.3 | Very low | 45.9 | Very low | 211 Ų | 211 | 140.2 Ų | 140.2 | 80% | 0.796 | 80% | 0.795 | S | S | * | * | | | | -162.3 | 95.2 | 119.2 | -105.4 | -176.9 | -162.3 | -150.5 | 9.6 | 111.2 | K99 | R97-K99 HydrophobicContact CB-CG 4.4Å; R97-K99 PolarHBondContact O-N 3.37Å; R97-K99 VanDerWaalsContact O-N 3.1Å |
| 98 | A | 52.4 | Low | 46.7 | Very low | 104 Ų | 104 | 143.9 Ų | 143.9 | 86% | 0.86 | 80% | 0.797 | S | S | * | * | | | trans | -49.5 | 109.4 | 140.2 | 0 | 0 | 0 | 0 | 0 | 107.7 | | |
| 99 | K | 50.9 | Low | 47.8 | Very low | 145 Ų | 145 | 143.3 Ų | 143.3 | 63% | 0.63 | 79% | 0.789 | S | S | * | * | | | trans | -103.3 | 97.8 | 166.5 | -84.4 | 177.5 | 179.6 | 165.9 | 0 | 106.9 | R97 C101 | R97-K99 HydrophobicContact CB-CG 4.4Å; R97-K99 PolarHBondContact O-N 3.37Å; R97-K99 VanDerWaalsContact O-N 3.1Å; K99-C101 PolarHBondContact O-N 2.87Å |
| 100 | T | 47.2 | Very low | 48.5 | Very low | 110 Ų | 110 | 137.4 Ų | 137.4 | 68% | 0.675 | 77% | 0.765 | S | S | * | * | | | trans | 4.3 | 115.7 | 140.9 | 51.2 | 0 | 0 | 0 | 0 | 114.7 | N102 | T100-N102 PolarHBondContact O-N 3.45Š|
| 101 | C | 52.9 | Low | 50.4 | Low | 128 Ų | 128 | 135.2 Ų | 135.2 | 87% | 0.865 | 75% | 0.75 | S | S | * | * | S | Bend | trans | -68 | 37.3 | 166.7 | 62.9 | 0 | 0 | 0 | 0 | 112.7 | K99 | K99-C101 PolarHBondContact O-N 2.87Š|
| 102 | N | 51.9 | Low | 52.2 | Low | 136 Ų | 136 | 138.5 Ų | 138.5 | 73% | 0.727 | 75% | 0.75 | S | S | * | * | | | trans | -124 | 70.8 | 175.5 | -69.7 | 27 | 0 | 0 | 0 | 108.5 | T100 | T100-N102 PolarHBondContact O-N 3.45Š|
| 103 | K | 50.4 | Low | 54 | Low | 180 Ų | 180 | 138.2 Ų | 138.2 | 78% | 0.783 | 74% | 0.739 | S | S | * | * | | | trans | -124.7 | 107.4 | 156.3 | -76.5 | -169 | 174.3 | -172.9 | 0 | 107.6 | A105 | K103-A105 PolarHBondContact O-N 2.83Š|
| 104 | K | 46.7 | Very low | 56.4 | Low | 194 Ų | 194 | 135.8 Ų | 135.8 | 84% | 0.843 | 72% | 0.721 | S | S | * | * | | | trans | -7.5 | 125.6 | 155.2 | -78.8 | 168.9 | 170.6 | 175 | 0 | 111.3 | Q106 | K104-Q106 PolarHBondContact O-N 3.36Š|
| 105 | A | 53.6 | Low | 59 | Low | 105 Ų | 105 | 137 Ų | 137 | 87% | 0.868 | 71% | 0.707 | S | S | * | * | | | trans | -43.8 | 86.3 | 147.4 | 0 | 0 | 0 | 0 | 0 | 108.3 | K103 K107 | K103-A105 PolarHBondContact O-N 2.83Å; A105-K107 PolarHBondContact O-N 2.93Å |
| 106 | Q | 44.3 | Very low | 61.2 | Low | 165 Ų | 165 | 138.2 Ų | 138.2 | 77% | 0.771 | 70% | 0.696 | S | S | * | * | | | trans | -59.3 | 117.7 | 157.5 | -101.9 | -80.9 | 5.3 | 0 | 0 | 102.7 | K104 E108 | K104-Q106 PolarHBondContact O-N 3.36Å; Q106-E108 PolarHBondContact O-N 3.29Å |
| 107 | K | 47.4 | Very low | 63.4 | Low | 183 Ų | 183 | 135 Ų | 135 | 80% | 0.796 | 68% | 0.678 | S | S | * | * | | | trans | -70.4 | 55.4 | -177.9 | -168.1 | -177.3 | -179 | -176.3 | 0 | 108.8 | A105 Q109 | A105-K107 PolarHBondContact O-N 2.93Å; K107-Q109 PolarHBondContact O-N 2.89Å |
| 108 | E | 59.1 | Low | 65.9 | Low | 171 Ų | 171 | 130.1 Ų | 130.1 | 80% | 0.799 | 66% | 0.659 | S | S | * | * | | | trans | -83.6 | 97.6 | 162.5 | -161 | 167.5 | -156.1 | 0 | 0 | 103.5 | Q106 P110 | Q106-E108 PolarHBondContact O-N 3.29Å; E108-P110 VanDerWaalsContact O-N 3.08Å |
| 109 | Q | 59.6 | Low | 68 | Low | 149 Ų | 149 | 133.2 Ų | 133.2 | 70% | 0.696 | 65% | 0.649 | S | S | * | * | P | Polyproline II helix | trans | -49.7 | 121.6 | 174.2 | -70.4 | -74 | 18 | 0 | 0 | 106.3 | K107 S111 | K107-Q109 PolarHBondContact O-N 2.89Å; Q109-S111 PolarHBondContact O-N 3.03Å |
| 110 | P | 61.1 | Low | 70.2 | Confident | 49 Ų | 49 | 129.7 Ų | 129.7 | 32% | 0.318 | 64% | 0.636 | S | S | . | * | P | Polyproline II helix | trans | -51.1 | 132.1 | 177 | 22.1 | -31.9 | 0 | 0 | 0 | 107.3 | E108 K112 D114 | E108-P110 VanDerWaalsContact O-N 3.08Å; P110-K112 PolarHBondContact O-N 2.9Å; P110-D114 HydrophobicContact CB-CB 4.47Å |
| 111 | S | 76.1 | Confident | 72.6 | Confident | 73 Ų | 73 | 132.5 Ų | 132.5 | 51% | 0.51 | 63% | 0.634 | S | S | . | * | P | Polyproline II helix | trans | -50.9 | 139.6 | 172.9 | 179 | 0 | 0 | 0 | 0 | 107.6 | Q109 E113 D114 E115 | Q109-S111 PolarHBondContact O-N 3.03Å; S111-E113 PolarHBondContact O-N 3.32Å; S111-D114 WeakPolarHBondContact O-CA 3.37Å; S111-D114 WeakPolarHBondContact O-CB 3.33Å; S111-D114 PolarHBondContact O-N 2.85Å; S111-E115 PolarHBondContact O-N 3.34Å; S111-E115 VanDerWaalsContact O-N 3.15Å |
| 112 | K | 81.3 | Confident | 74.7 | Confident | 184 Ų | 184 | 134.5 Ų | 134.5 | 80% | 0.8 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -49.6 | -32.8 | -176.9 | -69.3 | -178.3 | 177.7 | -179.6 | 0 | 111.7 | P110 E116 | P110-K112 PolarHBondContact O-N 2.9Å; K112-E116 PolarHBondContact O-N 3.39Å; K112-E116 VanDerWaalsContact O-N 3.1Å |
| 113 | E | 83.4 | Confident | 76.9 | Confident | 106 Ų | 106 | 132.1 Ų | 132.1 | 50% | 0.495 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -65.6 | -41.6 | 174.6 | -165.6 | -172.6 | 157.7 | 0 | 0 | 113.9 | S111 E115 E116 R117 | S111-E113 PolarHBondContact O-N 3.32Å; E113-E115 VanDerWaalsContact C-N 3.35Å; E113-E116 PolarHBondContact O-N 3.14Å; E113-R117 WeakPolarHBondContact O-CG 3.47Å; E113-R117 PolarHBondContact O-N 3.37Å; E113-R117 IonicContact OE1-CZ 2.76Å; E113-R117 IonicContact OE1-NE 3.18Å; E113-R117 PolarHBondContact OE1-NE 2.94Å; E113-R117 IonicContact OE1-NH2 3.33Å; E113-R117 PolarHBondContact OE1-NH2 3.38Å |
| 114 | D | 89.8 | Confident | 79.2 | Confident | 86 Ų | 86 | 131.9 Ų | 131.9 | 46% | 0.46 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -70 | -33.5 | 177.7 | -76.5 | -36.1 | 0 | 0 | 0 | 112.3 | P110 S111 R118 | P110-D114 HydrophobicContact CB-CB 4.47Å; S111-D114 WeakPolarHBondContact O-CA 3.37Å; S111-D114 WeakPolarHBondContact O-CB 3.33Å; S111-D114 PolarHBondContact O-N 2.85Å; D114-R118 WeakPolarHBondContact O-CB 3.34Å; D114-R118 PolarHBondContact O-N 2.76Å |
| 115 | E | 91.7 | Very high | 81.7 | Confident | 101 Ų | 101 | 128 Ų | 128 | 47% | 0.472 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -66.3 | -41.7 | 173.5 | -173.2 | 167.4 | -160.7 | 0 | 0 | 111.5 | S111 E113 R118 R119 | S111-E115 PolarHBondContact O-N 3.34Å; S111-E115 VanDerWaalsContact O-N 3.15Å; E113-E115 VanDerWaalsContact C-N 3.35Å; E115-R118 WeakPolarHBondContact O-CB 3.29Å; E115-R118 PolarHBondContact O-N 3.49Å; E115-R119 PolarHBondContact O-N 2.91Å |
| 116 | E | 93 | Very high | 83.8 | Confident | 122 Ų | 122 | 129.3 Ų | 129.3 | 57% | 0.57 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -64.1 | -46 | 174.9 | -174.2 | 168 | -155.7 | 0 | 0 | 112.1 | K112 E113 R118 R119 I120 | K112-E116 PolarHBondContact O-N 3.39Å; K112-E116 VanDerWaalsContact O-N 3.1Å; E113-E116 PolarHBondContact O-N 3.14Å; E116-R118 PolarHBondContact O-N 3.45Å; E116-R119 WeakPolarHBondContact O-CB 3.32Å; E116-R119 PolarHBondContact O-N 3.39Å; E116-I120 HydrophobicContact CG-CD1 4.22Å; E116-I120 WeakPolarHBondContact O-CG1 3.45Å; E116-I120 PolarHBondContact O-N 2.92Å |
| 117 | R | 94.6 | Very high | 86.4 | Confident | 132 Ų | 132 | 126.4 Ų | 126.4 | 50% | 0.498 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -57.9 | -35 | 173.2 | -72.3 | 177.5 | -172.2 | -87.4 | 1.4 | 112.3 | E113 R121 | E113-R117 WeakPolarHBondContact O-CG 3.47Å; E113-R117 PolarHBondContact O-N 3.37Å; E113-R117 IonicContact OE1-CZ 2.76Å; E113-R117 IonicContact OE1-NE 3.18Å; E113-R117 PolarHBondContact OE1-NE 2.94Å; E113-R117 IonicContact OE1-NH2 3.33Å; E113-R117 PolarHBondContact OE1-NH2 3.38Å; R117-R121 WeakPolarHBondContact O-CG 3.49Å; R117-R121 PolarHBondContact O-N 3.37Å |
| 118 | R | 95.8 | Very high | 88.9 | Confident | 109 Ų | 109 | 120.4 Ų | 120.4 | 41% | 0.411 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -71.9 | -40.2 | 175.3 | -171.3 | 179.5 | -65.4 | 103.9 | 0.9 | 111.7 | D114 E115 E116 R121 R122 | D114-R118 WeakPolarHBondContact O-CB 3.34Å; D114-R118 PolarHBondContact O-N 2.76Å; E115-R118 WeakPolarHBondContact O-CB 3.29Å; E115-R118 PolarHBondContact O-N 3.49Å; E116-R118 PolarHBondContact O-N 3.45Å; R118-R121 PolarHBondContact O-N 2.84Å; R118-R122 WeakPolarHBondContact O-CG 3.5Å; R118-R122 PolarHBondContact O-N 3.48Å |
| 119 | R | 96.3 | Very high | 90.8 | Very high | 170 Ų | 170 | 114 Ų | 114 | 64% | 0.642 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -60.1 | -48.3 | 175.2 | -175.9 | -176.2 | -70.6 | -102.6 | 2.3 | 111.1 | E115 E116 R121 R122 E123 | E115-R119 PolarHBondContact O-N 2.91Å; E116-R119 WeakPolarHBondContact O-CB 3.32Å; E116-R119 PolarHBondContact O-N 3.39Å; R119-R121 VanDerWaalsContact C-N 3.31Å; R119-R121 PolarHBondContact O-N 3.5Å; R119-R122 PolarHBondContact O-N 3.06Å; R119-R122 VanDerWaalsContact O-N 3.12Å; R119-E123 PolarHBondContact O-N 3.32Å |
| 120 | I | 96.9 | Very high | 92.6 | Very high | 71 Ų | 71 | 109.4 Ų | 109.4 | 36% | 0.364 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -58.9 | -42.4 | 178 | -65.2 | 167 | 0 | 0 | 0 | 111.2 | E116 E123 R124 | E116-I120 HydrophobicContact CG-CD1 4.22Å; E116-I120 WeakPolarHBondContact O-CG1 3.45Å; E116-I120 PolarHBondContact O-N 2.92Å; I120-E123 PolarHBondContact O-N 3.24Å; I120-R124 HydrophobicContact CG2-CG 4.48Å; I120-R124 VanDerWaalsContact CG2-CZ 3.5Å; I120-R124 WeakPolarHBondContact O-CB 3.39Å; I120-R124 WeakPolarHBondContact O-CG 2.8Å; I120-R124 PolarHBondContact O-N 3.32Å |
| 121 | R | 98.2 | Very high | 94.4 | Very high | 168 Ų | 168 | 114.6 Ų | 114.6 | 63% | 0.634 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -63.8 | -41.3 | 176.3 | -75.9 | -170.2 | -177 | 93.1 | -7.4 | 112.7 | R117 R118 R119 N125 | R117-R121 WeakPolarHBondContact O-CG 3.49Å; R117-R121 PolarHBondContact O-N 3.37Å; R118-R121 PolarHBondContact O-N 2.84Å; R119-R121 VanDerWaalsContact C-N 3.31Å; R119-R121 PolarHBondContact O-N 3.5Å; R121-N125 WeakPolarHBondContact O-CB 3.41Å; R121-N125 PolarHBondContact O-N 2.65Å |
| 122 | R | 98.4 | Very high | 95.5 | Very high | 170 Ų | 170 | 115.3 Ų | 115.3 | 64% | 0.642 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -65.3 | -41.7 | 176.4 | -73 | 178.7 | -179.2 | 157.8 | -2.5 | 111.6 | R118 R119 N125 K126 | R118-R122 WeakPolarHBondContact O-CG 3.5Å; R118-R122 PolarHBondContact O-N 3.48Å; R119-R122 PolarHBondContact O-N 3.06Å; R119-R122 VanDerWaalsContact O-N 3.12Å; R122-N125 PolarHBondContact O-N 3.03Å; R122-K126 VanDerWaalsContact O-CB 3.27Å; R122-K126 WeakPolarHBondContact O-CB 3.41Å; R122-K126 PolarHBondContact O-N 3.03Å |
| 123 | E | 98.1 | Very high | 96.3 | Very high | 87 Ų | 87 | 115.1 Ų | 115.1 | 41% | 0.407 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -66.4 | -44.4 | 178.4 | -161.1 | 60 | -141.8 | 0 | 0 | 111.1 | R119 I120 N125 K126 I127 | R119-E123 PolarHBondContact O-N 3.32Å; I120-E123 PolarHBondContact O-N 3.24Å; E123-N125 VanDerWaalsContact C-N 3.32Å; E123-N125 PolarHBondContact O-N 3.05Å; E123-K126 WeakPolarHBondContact O-CB 3.44Å; E123-K126 PolarHBondContact O-N 3.43Å; E123-K126 IonicContact OE1-NZ 2.65Å; E123-I127 HydrophobicContact CG-CD1 4.34Å; E123-I127 WeakPolarHBondContact O-CG1 3.4Å; E123-I127 PolarHBondContact O-N 3.47Å |
| 124 | R | 98.6 | Very high | 97.1 | Very high | 174 Ų | 174 | 112.9 Ų | 112.9 | 66% | 0.657 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -58.6 | -43.3 | 172.9 | -73.3 | 178 | -178.5 | 155.9 | 2.3 | 112.2 | I120 I127 A128 | I120-R124 HydrophobicContact CG2-CG 4.48Å; I120-R124 VanDerWaalsContact CG2-CZ 3.5Å; I120-R124 WeakPolarHBondContact O-CB 3.39Å; I120-R124 WeakPolarHBondContact O-CG 2.8Å; I120-R124 PolarHBondContact O-N 3.32Å; R124-I127 PolarHBondContact O-N 2.94Å; R124-A128 WeakPolarHBondContact O-CB 3.28Å; R124-A128 PolarHBondContact O-N 3.4Å |
| 125 | N | 98.4 | Very high | 97.5 | Very high | 114 Ų | 114 | 117.9 Ų | 117.9 | 61% | 0.61 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -67.6 | -37.7 | 177.1 | -178.3 | -103.3 | 0 | 0 | 0 | 112.3 | R121 R122 E123 A128 A129 | R121-N125 WeakPolarHBondContact O-CB 3.41Å; R121-N125 PolarHBondContact O-N 2.65Å; R122-N125 PolarHBondContact O-N 3.03Å; E123-N125 VanDerWaalsContact C-N 3.32Å; E123-N125 PolarHBondContact O-N 3.05Å; N125-A128 PolarHBondContact O-N 2.87Å; N125-A129 VanDerWaalsContact O-CB 3.31Å; N125-A129 WeakPolarHBondContact O-CB 3.45Å; N125-A129 PolarHBondContact O-N 3.21Å |
| 126 | K | 98.7 | Very high | 97.8 | Very high | 131 Ų | 131 | 122 Ų | 122 | 57% | 0.57 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -61.2 | -46.2 | 174.8 | -179.7 | -177.9 | 171.3 | -155.5 | 0 | 111 | R122 E123 A129 A130 | R122-K126 VanDerWaalsContact O-CB 3.27Å; R122-K126 WeakPolarHBondContact O-CB 3.41Å; R122-K126 PolarHBondContact O-N 3.03Å; E123-K126 WeakPolarHBondContact O-CB 3.44Å; E123-K126 PolarHBondContact O-N 3.43Å; E123-K126 IonicContact OE1-NZ 2.65Å; K126-A129 PolarHBondContact O-N 3.48Å; K126-A130 WeakPolarHBondContact O-CB 3.11Å; K126-A130 PolarHBondContact O-N 2.78Å |
| 127 | I | 98.5 | Very high | 98.1 | Very high | 105 Ų | 105 | 123.2 Ų | 123.2 | 54% | 0.538 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -63.3 | -45.4 | 174.9 | -64.2 | 165.1 | 0 | 0 | 0 | 110.5 | E123 R124 A129 A130 K131 | E123-I127 HydrophobicContact CG-CD1 4.34Å; E123-I127 WeakPolarHBondContact O-CG1 3.4Å; E123-I127 PolarHBondContact O-N 3.47Å; R124-I127 PolarHBondContact O-N 2.94Å; I127-A129 PolarHBondContact O-N 3.48Å; I127-A130 PolarHBondContact O-N 2.99Å; I127-K131 WeakPolarHBondContact O-CB 3.43Å; I127-K131 PolarHBondContact O-N 2.93Å |
| 128 | A | 98.7 | Very high | 98.3 | Very high | 56 Ų | 56 | 121.6 Ų | 121.6 | 46% | 0.463 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -62.2 | -41.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | R124 N125 K131 C132 | R124-A128 WeakPolarHBondContact O-CB 3.28Å; R124-A128 PolarHBondContact O-N 3.4Å; N125-A128 PolarHBondContact O-N 2.87Å; A128-K131 PolarHBondContact O-N 2.65Å; A128-C132 WeakPolarHBondContact O-CB 3.35Å; A128-C132 PolarHBondContact O-N 3.41Å |
| 129 | A | 98.7 | Very high | 98.4 | Very high | 36 Ų | 36 | 121.3 Ų | 121.3 | 30% | 0.298 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -66.5 | -42.4 | 176 | 0 | 0 | 0 | 0 | 0 | 111.7 | N125 K126 I127 C132 R133 | N125-A129 VanDerWaalsContact O-CB 3.31Å; N125-A129 WeakPolarHBondContact O-CB 3.45Å; N125-A129 PolarHBondContact O-N 3.21Å; K126-A129 PolarHBondContact O-N 3.48Å; I127-A129 PolarHBondContact O-N 3.48Å; A129-C132 PolarHBondContact O-N 3.25Å; A129-R133 WeakPolarHBondContact O-CG 3.45Å; A129-R133 PolarHBondContact O-N 2.86Å |
| 130 | A | 98.6 | Very high | 98.6 | Very high | 54 Ų | 54 | 117.5 Ų | 117.5 | 45% | 0.446 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -60.8 | -46.5 | 174 | 0 | 0 | 0 | 0 | 0 | 111.3 | K126 I127 C132 R133 N134 | K126-A130 WeakPolarHBondContact O-CB 3.11Å; K126-A130 PolarHBondContact O-N 2.78Å; I127-A130 PolarHBondContact O-N 2.99Å; A130-C132 PolarHBondContact O-N 3.37Å; A130-R133 PolarHBondContact O-N 2.86Å; A130-N134 WeakPolarHBondContact O-CB 3.49Å; A130-N134 PolarHBondContact O-N 3.49Å |
| 131 | K | 98.8 | Very high | 98.6 | Very high | 157 Ų | 157 | 118.9 Ų | 118.9 | 68% | 0.683 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -62.2 | -40.2 | 176.5 | -173.2 | 172.2 | -176.7 | 172.6 | 0 | 112.4 | I127 A128 N134 R135 | I127-K131 WeakPolarHBondContact O-CB 3.43Å; I127-K131 PolarHBondContact O-N 2.93Å; A128-K131 PolarHBondContact O-N 2.65Å; K131-N134 PolarHBondContact O-N 2.93Å; K131-R135 WeakPolarHBondContact O-CB 3.38Å; K131-R135 PolarHBondContact O-N 2.9Å |
| 132 | C | 98.8 | Very high | 98.7 | Very high | 88 Ų | 88 | 114.4 Ų | 114.4 | 60% | 0.595 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -62.9 | -44.8 | 175.7 | 179.5 | 0 | 0 | 0 | 0 | 111.6 | A128 A129 A130 N134 R136 | A128-C132 WeakPolarHBondContact O-CB 3.35Å; A128-C132 PolarHBondContact O-N 3.41Å; A129-C132 PolarHBondContact O-N 3.25Å; A130-C132 PolarHBondContact O-N 3.37Å; C132-N134 VanDerWaalsContact C-N 3.35Å; C132-R136 PolarHBondContact O-N 3.46Å; C132-R136 VanDerWaalsContact O-N 3.12Å |
| 133 | R | 98.8 | Very high | 98.7 | Very high | 180 Ų | 180 | 110.6 Ų | 110.6 | 68% | 0.679 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -63.5 | -40.2 | 173.9 | -69.7 | 172.6 | -178.3 | 165.3 | -0.6 | 111.8 | A129 A130 R136 R137 | A129-R133 WeakPolarHBondContact O-CG 3.45Å; A129-R133 PolarHBondContact O-N 2.86Å; A130-R133 PolarHBondContact O-N 2.86Å; R133-R136 PolarHBondContact O-N 2.75Å; R133-R137 WeakPolarHBondContact O-CG 3.46Å; R133-R137 PolarHBondContact O-N 3.49Å |
| 134 | N | 98.7 | Very high | 98.7 | Very high | 60 Ų | 60 | 111.3 Ų | 111.3 | 32% | 0.321 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -63.5 | -51.5 | 178.5 | -148.7 | 54.9 | 0 | 0 | 0 | 111.6 | A130 K131 C132 R136 R137 E138 | A130-N134 WeakPolarHBondContact O-CB 3.49Å; A130-N134 PolarHBondContact O-N 3.49Å; K131-N134 PolarHBondContact O-N 2.93Å; C132-N134 VanDerWaalsContact C-N 3.35Å; N134-R136 PolarHBondContact O-N 3.22Å; N134-R137 WeakPolarHBondContact O-CA 3.25Å; N134-R137 WeakPolarHBondContact O-CB 3.17Å; N134-R137 PolarHBondContact O-N 2.95Å; N134-R137 PolarHBondContact OD1-NH2 3.4Å; N134-E138 PolarHBondContact ND2-OE1 2.91Å; N134-E138 WeakPolarHBondContact O-CG 3.46Å; N134-E138 PolarHBondContact O-N 3.18Å |
| 135 | R | 98.8 | Very high | 98.7 | Very high | 191 Ų | 191 | 105.8 Ų | 105.8 | 72% | 0.721 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -58.3 | -36.3 | 178.3 | -172.2 | 179 | -177.4 | -173.1 | 1.6 | 112.3 | K131 L139 | K131-R135 WeakPolarHBondContact O-CB 3.38Å; K131-R135 PolarHBondContact O-N 2.9Å; R135-L139 WeakPolarHBondContact O-CB 3.23Å; R135-L139 PolarHBondContact O-N 3.36Å |
| 136 | R | 98.8 | Very high | 98.8 | Very high | 187 Ų | 187 | 105.8 Ų | 105.8 | 71% | 0.706 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -67.5 | -42.3 | 175.3 | -175.6 | 172.9 | -179.2 | 153 | 0.9 | 111.8 | C132 R133 N134 I140 | C132-R136 PolarHBondContact O-N 3.46Å; C132-R136 VanDerWaalsContact O-N 3.12Å; R133-R136 PolarHBondContact O-N 2.75Å; N134-R136 PolarHBondContact O-N 3.22Å; R136-I140 HydrophobicContact CG-CD1 4.1Å; R136-I140 WeakPolarHBondContact O-CD1 3.31Å; R136-I140 VanDerWaalsContact O-CG1 3.28Å; R136-I140 WeakPolarHBondContact O-CG1 3.48Å; R136-I140 PolarHBondContact O-N 2.95Å; R136-I140 VanDerWaalsContact O-N 3.11Å |
| 137 | R | 98.8 | Very high | 98.8 | Very high | 147 Ų | 147 | 102.5 Ų | 102.5 | 56% | 0.555 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -63.3 | -51.9 | 175.1 | -74.2 | -173.7 | -62.7 | 163.9 | 3.6 | 111.1 | R133 N134 L139 I140 D141 | R133-R137 WeakPolarHBondContact O-CG 3.46Å; R133-R137 PolarHBondContact O-N 3.49Å; N134-R137 WeakPolarHBondContact O-CA 3.25Å; N134-R137 WeakPolarHBondContact O-CB 3.17Å; N134-R137 PolarHBondContact O-N 2.95Å; N134-R137 PolarHBondContact OD1-NH2 3.4Å; R137-L139 PolarHBondContact O-N 3.29Å; R137-I140 CarbonylContact O-C 3.57Å; R137-I140 WeakPolarHBondContact O-CA 3.41Å; R137-I140 WeakPolarHBondContact O-CB 3.4Å; R137-I140 PolarHBondContact O-N 3.11Å; R137-D141 PolarHBondContact O-N 2.88Å |
| 138 | E | 98.8 | Very high | 98.8 | Very high | 98 Ų | 98 | 101.2 Ų | 101.2 | 46% | 0.458 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -54.1 | -40.3 | 177 | -70.4 | 166.1 | -176.8 | 0 | 0 | 112.4 | N134 D141 S142 | N134-E138 PolarHBondContact ND2-OE1 2.91Å; N134-E138 WeakPolarHBondContact O-CG 3.46Å; N134-E138 PolarHBondContact O-N 3.18Å; E138-D141 PolarHBondContact O-N 3.46Å; E138-S142 VanDerWaalsContact O-CB 3.31Å; E138-S142 WeakPolarHBondContact O-CB 3.47Å; E138-S142 PolarHBondContact O-N 3.35Å; E138-S142 PolarHBondContact O-OG 2.88Å |
| 139 | L | 98.8 | Very high | 98.8 | Very high | 103 Ų | 103 | 101.8 Ų | 101.8 | 54% | 0.539 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.1 | -44.9 | 175.2 | 177 | 62.2 | 0 | 0 | 0 | 111.8 | R135 R137 S142 L143 | R135-L139 WeakPolarHBondContact O-CB 3.23Å; R135-L139 PolarHBondContact O-N 3.36Å; R137-L139 PolarHBondContact O-N 3.29Å; L139-S142 PolarHBondContact O-N 2.96Å; L139-L143 HydrophobicContact CD1-CD1 4.08Å; L139-L143 HydrophobicContact CD1-CG 4.21Å; L139-L143 HydrophobicContact CG-CD1 4.11Å; L139-L143 WeakPolarHBondContact O-CB 3.47Å; L139-L143 VanDerWaalsContact O-CG 3.26Å; L139-L143 WeakPolarHBondContact O-CG 3.37Å; L139-L143 PolarHBondContact O-N 2.91Å |
| 140 | I | 98.8 | Very high | 98.8 | Very high | 90 Ų | 90 | 104.6 Ų | 104.6 | 46% | 0.462 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.3 | -46.4 | 177.4 | -67.9 | 164.3 | 0 | 0 | 0 | 110 | R136 R137 S142 L143 Q144 | R136-I140 HydrophobicContact CG-CD1 4.1Å; R136-I140 WeakPolarHBondContact O-CD1 3.31Å; R136-I140 VanDerWaalsContact O-CG1 3.28Å; R136-I140 WeakPolarHBondContact O-CG1 3.48Å; R136-I140 PolarHBondContact O-N 2.95Å; R136-I140 VanDerWaalsContact O-N 3.11Å; R137-I140 CarbonylContact O-C 3.57Å; R137-I140 WeakPolarHBondContact O-CA 3.41Å; R137-I140 WeakPolarHBondContact O-CB 3.4Å; R137-I140 PolarHBondContact O-N 3.11Å; I140-S142 VanDerWaalsContact C-N 3.3Å; I140-S142 PolarHBondContact O-N 3.34Å; I140-L143 PolarHBondContact O-N 2.94Å; I140-Q144 WeakPolarHBondContact O-CB 3.49Å; I140-Q144 PolarHBondContact O-N 2.8Å |
| 141 | D | 98.8 | Very high | 98.8 | Very high | 101 Ų | 101 | 107.9 Ų | 107.9 | 54% | 0.54 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.4 | -40 | -179.8 | -60 | -20 | 0 | 0 | 0 | 110.8 | R137 E138 Q144 A145 | R137-D141 PolarHBondContact O-N 2.88Å; E138-D141 PolarHBondContact O-N 3.46Å; D141-Q144 PolarHBondContact O-N 3.18Å; D141-A145 WeakPolarHBondContact O-CB 3.37Å; D141-A145 PolarHBondContact O-N 2.95Å |
| 142 | S | 98.8 | Very high | 98.8 | Very high | 74 Ų | 74 | 106.6 Ų | 106.6 | 52% | 0.517 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -65.9 | -45 | 176.4 | -57.7 | 0 | 0 | 0 | 0 | 112 | E138 L139 I140 Q144 A145 E146 | E138-S142 VanDerWaalsContact O-CB 3.31Å; E138-S142 WeakPolarHBondContact O-CB 3.47Å; E138-S142 PolarHBondContact O-N 3.35Å; E138-S142 PolarHBondContact O-OG 2.88Å; L139-S142 PolarHBondContact O-N 2.96Å; I140-S142 VanDerWaalsContact C-N 3.3Å; I140-S142 PolarHBondContact O-N 3.34Å; S142-Q144 VanDerWaalsContact C-N 3.32Å; S142-Q144 PolarHBondContact O-N 3.44Å; S142-A145 PolarHBondContact O-N 2.95Å; S142-E146 WeakPolarHBondContact O-CB 3.41Å; S142-E146 PolarHBondContact O-N 3.44Å |
| 143 | L | 98.9 | Very high | 98.8 | Very high | 89 Ų | 89 | 107.6 Ų | 107.6 | 47% | 0.466 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -66.3 | -35.9 | 177.7 | -70.2 | 172.4 | 0 | 0 | 0 | 111.9 | L139 I140 T147 | L139-L143 HydrophobicContact CD1-CD1 4.08Å; L139-L143 HydrophobicContact CD1-CG 4.21Å; L139-L143 HydrophobicContact CG-CD1 4.11Å; L139-L143 WeakPolarHBondContact O-CB 3.47Å; L139-L143 VanDerWaalsContact O-CG 3.26Å; L139-L143 WeakPolarHBondContact O-CG 3.37Å; L139-L143 PolarHBondContact O-N 2.91Å; I140-L143 PolarHBondContact O-N 2.94Å; L143-T147 WeakPolarHBondContact O-CB 3.41Å; L143-T147 PolarHBondContact O-N 3.2Å; L143-T147 PolarHBondContact O-OG1 3.29Å |
| 144 | Q | 98.9 | Very high | 98.8 | Very high | 102 Ų | 102 | 105 Ų | 105 | 48% | 0.477 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.8 | -48.4 | 174.7 | -172.3 | 61.8 | 53.3 | 0 | 0 | 110.5 | I140 D141 S142 E146 T147 D148 | I140-Q144 WeakPolarHBondContact O-CB 3.49Å; I140-Q144 PolarHBondContact O-N 2.8Å; D141-Q144 PolarHBondContact O-N 3.18Å; S142-Q144 VanDerWaalsContact C-N 3.32Å; S142-Q144 PolarHBondContact O-N 3.44Å; Q144-E146 VanDerWaalsContact C-N 3.3Å; Q144-E146 PolarHBondContact O-N 2.88Å; Q144-T147 WeakPolarHBondContact O-CB 3.28Å; Q144-T147 PolarHBondContact O-N 2.93Å; Q144-T147 VanDerWaalsContact O-N 3.09Å; Q144-D148 PolarHBondContact NE2-OD1 3.49Å; Q144-D148 PolarHBondContact O-N 3.3Å |
| 145 | A | 98.8 | Very high | 98.8 | Very high | 59 Ų | 59 | 104.9 Ų | 104.9 | 49% | 0.488 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.5 | -38.7 | 177 | 0 | 0 | 0 | 0 | 0 | 112.7 | D141 S142 D148 S149 | D141-A145 WeakPolarHBondContact O-CB 3.37Å; D141-A145 PolarHBondContact O-N 2.95Å; S142-A145 PolarHBondContact O-N 2.95Å; A145-D148 PolarHBondContact O-N 3.49Å; A145-S149 WeakPolarHBondContact O-CB 3.37Å; A145-S149 PolarHBondContact O-N 3.3Å |
| 146 | E | 98.8 | Very high | 98.8 | Very high | 114 Ų | 114 | 99.2 Ų | 99.2 | 53% | 0.533 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.8 | -42.2 | 173.6 | -175.5 | 178.9 | 177.9 | 0 | 0 | 111.5 | S142 Q144 S149 L150 | S142-E146 WeakPolarHBondContact O-CB 3.41Å; S142-E146 PolarHBondContact O-N 3.44Å; Q144-E146 VanDerWaalsContact C-N 3.3Å; Q144-E146 PolarHBondContact O-N 2.88Å; E146-S149 PolarHBondContact O-N 2.97Å; E146-L150 HydrophobicContact CG-CD1 4.22Å; E146-L150 WeakPolarHBondContact O-CB 3.49Å; E146-L150 VanDerWaalsContact O-CG 3.28Å; E146-L150 WeakPolarHBondContact O-CG 3.45Å; E146-L150 PolarHBondContact O-N 2.86Å |
| 147 | T | 98.9 | Very high | 98.8 | Very high | 61 Ų | 61 | 94.2 Ų | 94.2 | 37% | 0.374 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61.8 | -49 | 176.1 | -57.1 | 0 | 0 | 0 | 0 | 110.9 | L143 Q144 S149 L150 E151 | L143-T147 WeakPolarHBondContact O-CB 3.41Å; L143-T147 PolarHBondContact O-N 3.2Å; L143-T147 PolarHBondContact O-OG1 3.29Å; Q144-T147 WeakPolarHBondContact O-CB 3.28Å; Q144-T147 PolarHBondContact O-N 2.93Å; Q144-T147 VanDerWaalsContact O-N 3.09Å; T147-S149 VanDerWaalsContact C-N 3.32Å; T147-S149 PolarHBondContact O-N 3.44Å; T147-L150 PolarHBondContact O-N 2.9Å; T147-E151 WeakPolarHBondContact O-CG 3.5Å; T147-E151 PolarHBondContact O-N 3.38Å |
| 148 | D | 98.8 | Very high | 98.8 | Very high | 79 Ų | 79 | 92.6 Ų | 92.6 | 42% | 0.422 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.6 | -42.9 | -179.9 | -61 | -14.6 | 0 | 0 | 0 | 110.9 | Q144 A145 L150 E151 E152 | Q144-D148 PolarHBondContact NE2-OD1 3.49Å; Q144-D148 PolarHBondContact O-N 3.3Å; A145-D148 PolarHBondContact O-N 3.49Å; D148-L150 PolarHBondContact O-N 2.92Å; D148-E151 PolarHBondContact O-N 3.39Å; D148-E152 PolarHBondContact O-N 2.78Å |
| 149 | S | 98.8 | Very high | 98.8 | Very high | 67 Ų | 67 | 91.7 Ų | 91.7 | 47% | 0.469 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.5 | -42.2 | 176.3 | -176.5 | 0 | 0 | 0 | 0 | 112.5 | A145 E146 T147 E151 E152 E153 | A145-S149 WeakPolarHBondContact O-CB 3.37Å; A145-S149 PolarHBondContact O-N 3.3Å; E146-S149 PolarHBondContact O-N 2.97Å; T147-S149 VanDerWaalsContact C-N 3.32Å; T147-S149 PolarHBondContact O-N 3.44Å; S149-E151 VanDerWaalsContact C-N 3.34Å; S149-E152 PolarHBondContact O-N 3.09Å; S149-E153 WeakPolarHBondContact O-CB 3.5Å; S149-E153 PolarHBondContact O-N 3.4Å |
| 150 | L | 98.9 | Very high | 98.8 | Very high | 95 Ų | 95 | 91.8 Ų | 91.8 | 50% | 0.497 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -69 | -34.3 | 178 | -72.4 | 172.2 | 0 | 0 | 0 | 111.8 | E146 T147 D148 K154 | E146-L150 HydrophobicContact CG-CD1 4.22Å; E146-L150 WeakPolarHBondContact O-CB 3.49Å; E146-L150 VanDerWaalsContact O-CG 3.28Å; E146-L150 WeakPolarHBondContact O-CG 3.45Å; E146-L150 PolarHBondContact O-N 2.86Å; T147-L150 PolarHBondContact O-N 2.9Å; D148-L150 PolarHBondContact O-N 2.92Å; L150-K154 WeakPolarHBondContact O-CB 3.28Å; L150-K154 PolarHBondContact O-N 3.5Å |
| 151 | E | 98.8 | Very high | 98.8 | Very high | 123 Ų | 123 | 92.3 Ų | 92.3 | 58% | 0.575 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -67.1 | -41.8 | 174.1 | -73.5 | -177 | -179.7 | 0 | 0 | 111.8 | T147 D148 S149 K154 S155 | T147-E151 WeakPolarHBondContact O-CG 3.5Å; T147-E151 PolarHBondContact O-N 3.38Å; D148-E151 PolarHBondContact O-N 3.39Å; S149-E151 VanDerWaalsContact C-N 3.34Å; E151-K154 PolarHBondContact O-N 3.28Å; E151-S155 WeakPolarHBondContact O-CB 3.45Å; E151-S155 PolarHBondContact O-N 3.41Å |
| 152 | E | 98.8 | Very high | 98.8 | Very high | 131 Ų | 131 | 89.4 Ų | 89.4 | 61% | 0.612 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -61.8 | -49.4 | 173.6 | -175.8 | 175.4 | -165.6 | 0 | 0 | 111.4 | D148 S149 K154 S155 T156 | D148-E152 PolarHBondContact O-N 2.78Å; S149-E152 PolarHBondContact O-N 3.09Å; E152-K154 PolarHBondContact O-N 2.97Å; E152-S155 PolarHBondContact O-N 3.36Å; E152-S155 PolarHBondContact O-OG 3.09Å; E152-T156 PolarHBondContact O-N 3.05Å; E152-T156 PolarHBondContact O-OG1 3.4Å |
| 153 | E | 98.8 | Very high | 98.8 | Very high | 108 Ų | 108 | 90.1 Ų | 90.1 | 51% | 0.505 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -60.7 | -44.9 | 177.9 | -175 | 178.1 | -176.3 | 0 | 0 | 111.3 | S149 S155 T156 L157 | S149-E153 WeakPolarHBondContact O-CB 3.5Å; S149-E153 PolarHBondContact O-N 3.4Å; E153-S155 VanDerWaalsContact C-N 3.33Å; E153-S155 PolarHBondContact O-N 2.92Å; E153-T156 WeakPolarHBondContact O-CB 3.31Å; E153-T156 PolarHBondContact O-N 3.19Å; E153-L157 HydrophobicContact CG-CD1 4.14Å; E153-L157 HydrophobicContact CG-CG 4.45Å; E153-L157 WeakPolarHBondContact O-CG 3.47Å; E153-L157 PolarHBondContact O-N 3.07Å |
| 154 | K | 98.8 | Very high | 98.8 | Very high | 125 Ų | 125 | 91 Ų | 91 | 54% | 0.543 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -57.2 | -47 | 174.8 | 177.2 | -173.5 | 173.1 | -172.7 | 0 | 111.3 | L150 E151 E152 T156 L157 Q158 | L150-K154 WeakPolarHBondContact O-CB 3.28Å; L150-K154 PolarHBondContact O-N 3.5Å; E151-K154 PolarHBondContact O-N 3.28Å; E152-K154 PolarHBondContact O-N 2.97Å; K154-T156 VanDerWaalsContact C-N 3.31Å; K154-T156 PolarHBondContact O-N 3.17Å; K154-L157 PolarHBondContact O-N 3.45Å; K154-Q158 WeakPolarHBondContact O-CB 3.35Å; K154-Q158 VanDerWaalsContact O-CG 3.25Å; K154-Q158 WeakPolarHBondContact O-CG 3.46Å; K154-Q158 PolarHBondContact O-N 2.8Å |
| 155 | S | 98.8 | Very high | 98.8 | Very high | 58 Ų | 58 | 91 Ų | 91 | 41% | 0.406 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -63.7 | -40.2 | 179.8 | 76.2 | 0 | 0 | 0 | 0 | 111.5 | E151 E152 E153 Q158 T159 | E151-S155 WeakPolarHBondContact O-CB 3.45Å; E151-S155 PolarHBondContact O-N 3.41Å; E152-S155 PolarHBondContact O-N 3.36Å; E152-S155 PolarHBondContact O-OG 3.09Å; E153-S155 VanDerWaalsContact C-N 3.33Å; E153-S155 PolarHBondContact O-N 2.92Å; S155-Q158 PolarHBondContact O-N 2.99Å; S155-T159 WeakPolarHBondContact O-CG2 3.42Å; S155-T159 PolarHBondContact O-N 3.34Å; S155-T159 PolarHBondContact O-OG1 3Å |
| 156 | T | 98.8 | Very high | 98.8 | Very high | 72 Ų | 72 | 94 Ų | 94 | 44% | 0.442 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.5 | -51.4 | 176.8 | -58.4 | 0 | 0 | 0 | 0 | 110.9 | E152 E153 K154 Q158 T159 E160 | E152-T156 PolarHBondContact O-N 3.05Å; E152-T156 PolarHBondContact O-OG1 3.4Å; E153-T156 WeakPolarHBondContact O-CB 3.31Å; E153-T156 PolarHBondContact O-N 3.19Å; K154-T156 VanDerWaalsContact C-N 3.31Å; K154-T156 PolarHBondContact O-N 3.17Å; T156-Q158 VanDerWaalsContact C-N 3.29Å; T156-Q158 PolarHBondContact O-N 3.49Å; T156-T159 PolarHBondContact O-N 2.94Å; T156-T159 VanDerWaalsContact O-N 3.11Å; T156-T159 PolarHBondContact O-OG1 3.02Å; T156-E160 PolarHBondContact O-N 3Å |
| 157 | L | 98.8 | Very high | 98.8 | Very high | 83 Ų | 83 | 92.4 Ų | 92.4 | 44% | 0.435 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -61.1 | -38.3 | 177.1 | -69 | 173.8 | 0 | 0 | 0 | 112 | E153 K154 E160 I161 | E153-L157 HydrophobicContact CG-CD1 4.14Å; E153-L157 HydrophobicContact CG-CG 4.45Å; E153-L157 WeakPolarHBondContact O-CG 3.47Å; E153-L157 PolarHBondContact O-N 3.07Å; K154-L157 PolarHBondContact O-N 3.45Å; L157-E160 PolarHBondContact O-N 2.71Å; L157-I161 WeakPolarHBondContact O-CB 3.26Å; L157-I161 WeakPolarHBondContact O-CD1 3.35Å; L157-I161 VanDerWaalsContact O-CG1 3.23Å; L157-I161 WeakPolarHBondContact O-CG1 3.48Å; L157-I161 PolarHBondContact O-N 3.45Å |
| 158 | Q | 98.8 | Very high | 98.8 | Very high | 112 Ų | 112 | 94.7 Ų | 94.7 | 52% | 0.523 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63.4 | -40.1 | 175.1 | -76.4 | -179.7 | -12.1 | 0 | 0 | 112.4 | K154 S155 T156 A162 | K154-Q158 WeakPolarHBondContact O-CB 3.35Å; K154-Q158 VanDerWaalsContact O-CG 3.25Å; K154-Q158 WeakPolarHBondContact O-CG 3.46Å; K154-Q158 PolarHBondContact O-N 2.8Å; S155-Q158 PolarHBondContact O-N 2.99Å; T156-Q158 VanDerWaalsContact C-N 3.29Å; T156-Q158 PolarHBondContact O-N 3.49Å; Q158-A162 WeakPolarHBondContact O-CB 3.17Å; Q158-A162 PolarHBondContact O-N 2.87Å |
| 159 | T | 98.8 | Very high | 98.8 | Very high | 80 Ų | 80 | 97.3 Ų | 97.3 | 49% | 0.491 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -65.6 | -42.6 | 174.7 | 57.4 | 0 | 0 | 0 | 0 | 112 | S155 T156 I161 A162 D163 | S155-T159 WeakPolarHBondContact O-CG2 3.42Å; S155-T159 PolarHBondContact O-N 3.34Å; S155-T159 PolarHBondContact O-OG1 3Å; T156-T159 PolarHBondContact O-N 2.94Å; T156-T159 VanDerWaalsContact O-N 3.11Å; T156-T159 PolarHBondContact O-OG1 3.02Å; T159-I161 PolarHBondContact O-N 3.11Å; T159-A162 PolarHBondContact O-N 3.35Å; T159-D163 PolarHBondContact O-N 3.19Å |
| 160 | E | 98.8 | Very high | 98.8 | Very high | 104 Ų | 104 | 99.7 Ų | 99.7 | 49% | 0.486 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62 | -45 | 177.1 | -175.2 | 177.4 | -175.9 | 0 | 0 | 111.6 | T156 L157 A162 D163 L164 | T156-E160 PolarHBondContact O-N 3Å; L157-E160 PolarHBondContact O-N 2.71Å; E160-A162 VanDerWaalsContact C-N 3.33Å; E160-A162 PolarHBondContact O-N 3.44Å; E160-D163 PolarHBondContact O-N 2.96Å; E160-L164 HydrophobicContact CG-CD1 4.11Å; E160-L164 HydrophobicContact CG-CG 4.44Å; E160-L164 WeakPolarHBondContact O-CB 3.27Å; E160-L164 VanDerWaalsContact O-CG 3.31Å; E160-L164 WeakPolarHBondContact O-CG 3.36Å; E160-L164 PolarHBondContact O-N 2.67Å |
| 161 | I | 98.8 | Very high | 98.8 | Very high | 101 Ų | 101 | 98.9 Ų | 98.9 | 52% | 0.518 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -58.4 | -46.7 | 174.6 | -70.2 | 164.7 | 0 | 0 | 0 | 110.5 | L157 T159 D163 L164 L165 | L157-I161 WeakPolarHBondContact O-CB 3.26Å; L157-I161 WeakPolarHBondContact O-CD1 3.35Å; L157-I161 VanDerWaalsContact O-CG1 3.23Å; L157-I161 WeakPolarHBondContact O-CG1 3.48Å; L157-I161 PolarHBondContact O-N 3.45Å; T159-I161 PolarHBondContact O-N 3.11Å; I161-D163 VanDerWaalsContact C-N 3.3Å; I161-D163 PolarHBondContact O-N 3.12Å; I161-L164 PolarHBondContact O-N 3.31Å; I161-L165 HydrophobicContact CG2-CD1 3.97Å; I161-L165 HydrophobicContact CG2-CG 4.39Å; I161-L165 WeakPolarHBondContact O-CB 3.4Å; I161-L165 VanDerWaalsContact O-CG 3.28Å; I161-L165 WeakPolarHBondContact O-CG 3.34Å; I161-L165 PolarHBondContact O-N 2.82Å |
| 162 | A | 98.8 | Very high | 98.7 | Very high | 41 Ų | 41 | 97.8 Ų | 97.8 | 34% | 0.339 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61.3 | -40.4 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q158 T159 E160 L165 K166 | Q158-A162 WeakPolarHBondContact O-CB 3.17Å; Q158-A162 PolarHBondContact O-N 2.87Å; T159-A162 PolarHBondContact O-N 3.35Å; E160-A162 VanDerWaalsContact C-N 3.33Å; E160-A162 PolarHBondContact O-N 3.44Å; A162-L165 PolarHBondContact O-N 3.41Å; A162-K166 WeakPolarHBondContact O-CG 3.31Å; A162-K166 PolarHBondContact O-N 2.84Å |
| 163 | D | 98.8 | Very high | 98.7 | Very high | 88 Ų | 88 | 97.9 Ų | 97.9 | 47% | 0.471 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -72.7 | -38.9 | 179.8 | -70.9 | -16.7 | 0 | 0 | 0 | 112.3 | T159 E160 I161 L165 K166 E167 | T159-D163 PolarHBondContact O-N 3.19Å; E160-D163 PolarHBondContact O-N 2.96Å; I161-D163 VanDerWaalsContact C-N 3.3Å; I161-D163 PolarHBondContact O-N 3.12Å; D163-L165 VanDerWaalsContact C-N 3.33Å; D163-L165 PolarHBondContact O-N 2.81Å; D163-K166 PolarHBondContact O-N 2.75Å; D163-K166 IonicContact OD1-NZ 2.85Å; D163-K166 PolarHBondContact OD1-NZ 3.22Å; D163-E167 WeakPolarHBondContact O-CB 3.44Å; D163-E167 PolarHBondContact O-N 3.37Å |
| 164 | L | 98.9 | Very high | 98.6 | Very high | 107 Ų | 107 | 96.4 Ų | 96.4 | 56% | 0.56 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -63 | -38.7 | 172.3 | -72 | 174.3 | 0 | 0 | 0 | 112.1 | E160 I161 E167 K168 | E160-L164 HydrophobicContact CG-CD1 4.11Å; E160-L164 HydrophobicContact CG-CG 4.44Å; E160-L164 WeakPolarHBondContact O-CB 3.27Å; E160-L164 VanDerWaalsContact O-CG 3.31Å; E160-L164 WeakPolarHBondContact O-CG 3.36Å; E160-L164 PolarHBondContact O-N 2.67Å; I161-L164 PolarHBondContact O-N 3.31Å; L164-E167 PolarHBondContact O-N 2.98Å; L164-K168 WeakPolarHBondContact O-CB 3.33Å; L164-K168 PolarHBondContact O-N 3.19Å |
| 165 | L | 98.8 | Very high | 98.5 | Very high | 103 Ų | 103 | 95.7 Ų | 95.7 | 54% | 0.539 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -65.8 | -42.3 | 175.3 | -73.8 | 174.8 | 0 | 0 | 0 | 111.9 | I161 A162 D163 E167 K168 E169 | I161-L165 HydrophobicContact CG2-CD1 3.97Å; I161-L165 HydrophobicContact CG2-CG 4.39Å; I161-L165 WeakPolarHBondContact O-CB 3.4Å; I161-L165 VanDerWaalsContact O-CG 3.28Å; I161-L165 WeakPolarHBondContact O-CG 3.34Å; I161-L165 PolarHBondContact O-N 2.82Å; A162-L165 PolarHBondContact O-N 3.41Å; D163-L165 VanDerWaalsContact C-N 3.33Å; D163-L165 PolarHBondContact O-N 2.81Å; L165-E167 VanDerWaalsContact C-N 3.32Å; L165-E167 PolarHBondContact O-N 3.12Å; L165-K168 WeakPolarHBondContact O-CB 3.42Å; L165-K168 PolarHBondContact O-N 3.03Å; L165-E169 WeakPolarHBondContact O-CB 3.34Å; L165-E169 PolarHBondContact O-N 2.99Å |
| 166 | K | 98.8 | Very high | 98.3 | Very high | 123 Ų | 123 | 95.4 Ų | 95.4 | 54% | 0.535 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61.4 | -42.2 | 173.5 | -70.4 | 170.9 | -158.6 | 153.6 | 0 | 111.6 | A162 D163 E169 R170 | A162-K166 WeakPolarHBondContact O-CG 3.31Å; A162-K166 PolarHBondContact O-N 2.84Å; D163-K166 PolarHBondContact O-N 2.75Å; D163-K166 IonicContact OD1-NZ 2.85Å; D163-K166 PolarHBondContact OD1-NZ 3.22Å; K166-E169 PolarHBondContact O-N 2.89Å; K166-R170 WeakPolarHBondContact O-CB 3.35Å; K166-R170 PolarHBondContact O-N 3.31Å |
| 167 | E | 98.8 | Very high | 98.1 | Very high | 79 Ų | 79 | 95.2 Ų | 95.2 | 37% | 0.369 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -66.4 | -41.6 | 178.9 | -180 | 57.9 | -165.1 | 0 | 0 | 111.4 | D163 L164 L165 R170 L171 | D163-E167 WeakPolarHBondContact O-CB 3.44Å; D163-E167 PolarHBondContact O-N 3.37Å; L164-E167 PolarHBondContact O-N 2.98Å; L165-E167 VanDerWaalsContact C-N 3.32Å; L165-E167 PolarHBondContact O-N 3.12Å; E167-R170 WeakPolarHBondContact O-CB 3.42Å; E167-R170 PolarHBondContact O-N 3.04Å; E167-R170 IonicContact OE1-CZ 3.42Å; E167-R170 IonicContact OE1-NE 3.39Å; E167-R170 PolarHBondContact OE1-NE 3.44Å; E167-R170 IonicContact OE1-NH2 3.58Å; E167-R170 PolarHBondContact OE1-NH2 3.44Å; E167-R170 IonicContact OE2-CZ 3.58Å; E167-R170 IonicContact OE2-NE 2.76Å; E167-R170 PolarHBondContact OE2-NE 2.84Å; E167-R170 IonicContact OE2-NH2 3.49Å; E167-L171 HydrophobicContact CG-CD1 4.28Å; E167-L171 VanDerWaalsContact O-CG 3.29Å; E167-L171 WeakPolarHBondContact O-CG 3.35Å; E167-L171 PolarHBondContact O-N 2.62Å |
| 168 | K | 98.6 | Very high | 97.9 | Very high | 110 Ų | 110 | 96 Ų | 96 | 48% | 0.478 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -57 | -52.3 | 171.8 | 179.3 | -168.1 | 163.4 | -172.6 | 0 | 110.9 | L164 L165 R170 L171 E172 | L164-K168 WeakPolarHBondContact O-CB 3.33Å; L164-K168 PolarHBondContact O-N 3.19Å; L165-K168 WeakPolarHBondContact O-CB 3.42Å; L165-K168 PolarHBondContact O-N 3.03Å; K168-R170 VanDerWaalsContact C-N 3.29Å; K168-R170 PolarHBondContact O-N 3.3Å; K168-L171 PolarHBondContact O-N 3.44Å; K168-L171 VanDerWaalsContact O-N 3.14Å; K168-E172 VanDerWaalsContact CE-CD 3.45Å; K168-E172 WeakPolarHBondContact CE-OE1 3.45Å; K168-E172 HydrophobicContact CG-CG 4.4Å; K168-E172 IonicContact NZ-OE1 3.54Å; K168-E172 WeakPolarHBondContact O-CG 3.47Å; K168-E172 PolarHBondContact O-N 3.26Å |
| 169 | E | 98.7 | Very high | 97.4 | Very high | 133 Ų | 133 | 97.5 Ų | 97.5 | 62% | 0.621 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -58.9 | -42 | 179.4 | -176.7 | -177.4 | -173.5 | 0 | 0 | 111.4 | L165 K166 L171 E172 H173 | L165-E169 WeakPolarHBondContact O-CB 3.34Å; L165-E169 PolarHBondContact O-N 2.99Å; K166-E169 PolarHBondContact O-N 2.89Å; E169-L171 VanDerWaalsContact C-N 3.35Å; E169-L171 PolarHBondContact O-N 3.44Å; E169-E172 PolarHBondContact O-N 3.18Å; E169-H173 WeakPolarHBondContact O-CB 3.43Å; E169-H173 PolarHBondContact O-N 3.5Å |
| 170 | R | 98.5 | Very high | 96.7 | Very high | 117 Ų | 117 | 99.1 Ų | 99.1 | 44% | 0.442 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -59.5 | -45.1 | 175.7 | -170.9 | -167.3 | 73 | 77.4 | 2.8 | 111.6 | K166 E167 K168 H173 I174 | K166-R170 WeakPolarHBondContact O-CB 3.35Å; K166-R170 PolarHBondContact O-N 3.31Å; E167-R170 WeakPolarHBondContact O-CB 3.42Å; E167-R170 PolarHBondContact O-N 3.04Å; E167-R170 IonicContact OE1-CZ 3.42Å; E167-R170 IonicContact OE1-NE 3.39Å; E167-R170 PolarHBondContact OE1-NE 3.44Å; E167-R170 IonicContact OE1-NH2 3.58Å; E167-R170 PolarHBondContact OE1-NH2 3.44Å; E167-R170 IonicContact OE2-CZ 3.58Å; E167-R170 IonicContact OE2-NE 2.76Å; E167-R170 PolarHBondContact OE2-NE 2.84Å; E167-R170 IonicContact OE2-NH2 3.49Å; K168-R170 VanDerWaalsContact C-N 3.29Å; K168-R170 PolarHBondContact O-N 3.3Å; R170-H173 PolarHBondContact O-N 2.92Å; R170-I174 HydrophobicContact CG-CD1 4.46Å; R170-I174 WeakPolarHBondContact O-CG1 3.48Å; R170-I174 PolarHBondContact O-N 2.9Å |
| 171 | L | 98.4 | Very high | 96 | Very high | 79 Ų | 79 | 97.9 Ų | 97.9 | 41% | 0.414 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -68.1 | -42.7 | 178.2 | -70.3 | 172.5 | 0 | 0 | 0 | 111.8 | E167 K168 E169 H173 I174 L175 | E167-L171 HydrophobicContact CG-CD1 4.28Å; E167-L171 VanDerWaalsContact O-CG 3.29Å; E167-L171 WeakPolarHBondContact O-CG 3.35Å; E167-L171 PolarHBondContact O-N 2.62Å; K168-L171 PolarHBondContact O-N 3.44Å; K168-L171 VanDerWaalsContact O-N 3.14Å; E169-L171 VanDerWaalsContact C-N 3.35Å; E169-L171 PolarHBondContact O-N 3.44Å; L171-H173 VanDerWaalsContact C-N 3.32Å; L171-H173 PolarHBondContact O-N 3.19Å; L171-I174 PolarHBondContact O-N 3.13Å; L171-L175 WeakPolarHBondContact O-CG 3.45Å; L171-L175 PolarHBondContact O-N 3.16Å |
| 172 | E | 97.6 | Very high | 95.5 | Very high | 100 Ų | 100 | 95.3 Ų | 95.3 | 47% | 0.467 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -59.2 | -43.4 | 174.5 | -74.9 | 178.3 | 159.3 | 0 | 0 | 111.2 | K168 E169 I174 L175 A176 | K168-E172 VanDerWaalsContact CE-CD 3.45Å; K168-E172 WeakPolarHBondContact CE-OE1 3.45Å; K168-E172 HydrophobicContact CG-CG 4.4Å; K168-E172 IonicContact NZ-OE1 3.54Å; K168-E172 WeakPolarHBondContact O-CG 3.47Å; K168-E172 PolarHBondContact O-N 3.26Å; E169-E172 PolarHBondContact O-N 3.18Å; E172-I174 PolarHBondContact O-N 2.83Å; E172-L175 PolarHBondContact O-N 3.21Å; E172-A176 VanDerWaalsContact O-CB 3.31Å; E172-A176 WeakPolarHBondContact O-CB 3.41Å; E172-A176 PolarHBondContact O-N 3.47Å |
| 173 | H | 98.1 | Very high | 94.8 | Very high | 133 Ų | 133 | 103.2 Ų | 103.2 | 62% | 0.616 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -62.3 | -42.4 | 175.2 | 179.3 | -103.9 | 0 | 0 | 0 | 112.2 | E169 R170 L171 A176 S177 | E169-H173 WeakPolarHBondContact O-CB 3.43Å; E169-H173 PolarHBondContact O-N 3.5Å; R170-H173 PolarHBondContact O-N 2.92Å; L171-H173 VanDerWaalsContact C-N 3.32Å; L171-H173 PolarHBondContact O-N 3.19Å; H173-A176 PolarHBondContact O-N 2.82Å; H173-S177 WeakPolarHBondContact O-CB 3.5Å; H173-S177 PolarHBondContact O-N 2.79Å |
| 174 | I | 97.3 | Very high | 93.9 | Very high | 76 Ų | 76 | 105.8 Ų | 105.8 | 39% | 0.39 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -61.4 | -47.3 | 175.3 | -71.6 | 166.7 | 0 | 0 | 0 | 110.6 | R170 L171 E172 S177 H178 | R170-I174 HydrophobicContact CG-CD1 4.46Å; R170-I174 WeakPolarHBondContact O-CG1 3.48Å; R170-I174 PolarHBondContact O-N 2.9Å; L171-I174 PolarHBondContact O-N 3.13Å; E172-I174 PolarHBondContact O-N 2.83Å; I174-S177 PolarHBondContact O-N 2.94Å; I174-S177 PolarHBondContact O-OG 2.91Å; I174-H178 PolarHBondContact O-N 3.5Å |
| 175 | L | 96.1 | Very high | 92.4 | Very high | 110 Ų | 110 | 106.1 Ų | 106.1 | 58% | 0.576 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -62 | -46.3 | 178.5 | -70.9 | 175.4 | 0 | 0 | 0 | 111.5 | L171 E172 S177 H178 Q179 | L171-L175 WeakPolarHBondContact O-CG 3.45Å; L171-L175 PolarHBondContact O-N 3.16Å; E172-L175 PolarHBondContact O-N 3.21Å; L175-S177 VanDerWaalsContact C-N 3.32Å; L175-S177 PolarHBondContact O-N 3.38Å; L175-H178 PolarHBondContact O-N 3.4Å; L175-H178 VanDerWaalsContact O-N 3.13Å; L175-Q179 WeakPolarHBondContact O-CG 3.34Å; L175-Q179 PolarHBondContact O-N 3.07Å |
| 176 | A | 94.7 | Very high | 90.7 | Very high | 53 Ų | 53 | 104.7 Ų | 104.7 | 44% | 0.438 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -59.3 | -41.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | E172 H173 H178 Q179 | E172-A176 VanDerWaalsContact O-CB 3.31Å; E172-A176 WeakPolarHBondContact O-CB 3.41Å; E172-A176 PolarHBondContact O-N 3.47Å; H173-A176 PolarHBondContact O-N 2.82Å; A176-H178 VanDerWaalsContact C-N 3.35Å; A176-H178 PolarHBondContact O-N 2.88Å; A176-Q179 PolarHBondContact O-N 3.19Å |
| 177 | S | 94.5 | Very high | 88.9 | Confident | 68 Ų | 68 | 107.3 Ų | 107.3 | 48% | 0.476 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -63.7 | -40.6 | 175.4 | 77.4 | 0 | 0 | 0 | 0 | 112 | H173 I174 L175 S180 | H173-S177 WeakPolarHBondContact O-CB 3.5Å; H173-S177 PolarHBondContact O-N 2.79Å; I174-S177 PolarHBondContact O-N 2.94Å; I174-S177 PolarHBondContact O-OG 2.91Å; L175-S177 VanDerWaalsContact C-N 3.32Å; L175-S177 PolarHBondContact O-N 3.38Å; S177-S180 PolarHBondContact O-OG 3.3Å |
| 178 | H | 94.5 | Very high | 87 | Confident | 99 Ų | 99 | 109.8 Ų | 109.8 | 46% | 0.458 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -70.2 | -34.8 | -179.5 | 179 | -97.7 | 0 | 0 | 0 | 112.8 | I174 L175 A176 S180 S181 C182 | I174-H178 PolarHBondContact O-N 3.5Å; L175-H178 PolarHBondContact O-N 3.4Å; L175-H178 VanDerWaalsContact O-N 3.13Å; A176-H178 VanDerWaalsContact C-N 3.35Å; A176-H178 PolarHBondContact O-N 2.88Å; H178-S180 PolarHBondContact O-N 3.31Å; H178-S180 VanDerWaalsContact O-N 3.1Å; H178-S181 CarbonylContact O-C 3.56Å; H178-S181 WeakPolarHBondContact O-CA 3.5Å; H178-S181 PolarHBondContact O-N 3.47Å; H178-S181 PolarHBondContact O-OG 2.94Å; H178-C182 PolarHBondContact O-N 2.9Å |
| 179 | Q | 89.5 | Confident | 84.8 | Confident | 143 Ų | 143 | 112.5 Ų | 112.5 | 67% | 0.668 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -49 | -40.5 | 180 | -78.8 | 172.4 | 0.6 | 0 | 0 | 112.5 | L175 A176 S181 C182 | L175-Q179 WeakPolarHBondContact O-CG 3.34Å; L175-Q179 PolarHBondContact O-N 3.07Å; A176-Q179 PolarHBondContact O-N 3.19Å; Q179-S181 PolarHBondContact O-N 3.03Å; Q179-C182 PolarHBondContact O-N 3.23Å |
| 180 | S | 84.6 | Confident | 82.3 | Confident | 115 Ų | 115 | 111.6 Ų | 111.6 | 80% | 0.804 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.9 | -21.7 | 178.7 | 69.8 | 0 | 0 | 0 | 0 | 114.8 | S177 H178 | S177-S180 PolarHBondContact O-OG 3.3Å; H178-S180 PolarHBondContact O-N 3.31Å; H178-S180 VanDerWaalsContact O-N 3.1Å |
| 181 | S | 84.2 | Confident | 79.8 | Confident | 77 Ų | 77 | 113 Ų | 113 | 54% | 0.538 | 63% | 0.632 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -110.8 | -4.9 | -177.7 | 67.1 | 0 | 0 | 0 | 0 | 113.7 | H178 Q179 | H178-S181 CarbonylContact O-C 3.56Å; H178-S181 WeakPolarHBondContact O-CA 3.5Å; H178-S181 PolarHBondContact O-N 3.47Å; H178-S181 PolarHBondContact O-OG 2.94Å; Q179-S181 PolarHBondContact O-N 3.03Å |
| 182 | C | 86.7 | Confident | 77.6 | Confident | 48 Ų | 48 | 115.1 Ų | 115.1 | 32% | 0.324 | 65% | 0.65 | S | S | . | * | | | trans | -76.5 | 130.4 | -175.4 | -168.5 | 0 | 0 | 0 | 0 | 110.9 | H178 Q179 | H178-C182 PolarHBondContact O-N 2.9Å; Q179-C182 PolarHBondContact O-N 3.23Å |
| 183 | K | 84.8 | Confident | 75.1 | Confident | 207 Ų | 207 | 115.6 Ų | 115.6 | 90% | 0.9 | 66% | 0.662 | S | S | * | * | | | trans | -99.9 | 6.5 | 177.6 | -61.9 | -178.4 | -177.3 | 179.9 | 0 | 113.5 | | |
| 184 | L | 80.5 | Confident | 73.1 | Confident | 142 Ų | 142 | 114.1 Ų | 114.1 | 74% | 0.743 | 67% | 0.673 | S | S | * | * | S | Bend | trans | -80.8 | 135 | 177.1 | -65.5 | 172.6 | 0 | 0 | 0 | 109.2 | A186 | L184-A186 PolarHBondContact O-N 3.49Š|
| 185 | P | 65.9 | Low | 70.7 | Confident | 113 Ų | 113 | 115.7 Ų | 115.7 | 73% | 0.734 | 69% | 0.69 | S | S | * | * | | | trans | -62.1 | 126.6 | 174.8 | 25.4 | -31.1 | 0 | 0 | 0 | 108.7 | L187 | P185-L187 PolarHBondContact O-N 3.1Š|
| 186 | A | 62.9 | Low | 68.6 | Low | 74 Ų | 74 | 115.9 Ų | 115.9 | 61% | 0.612 | 70% | 0.698 | S | S | * | * | | | trans | -59.6 | 110.7 | 167.8 | 0 | 0 | 0 | 0 | 0 | 107.1 | L184 D188 | L184-A186 PolarHBondContact O-N 3.49Å; A186-D188 PolarHBondContact O-N 2.65Å |
| 187 | L | 62.4 | Low | 66.5 | Low | 178 Ų | 178 | 117.3 Ų | 117.3 | 93% | 0.932 | 70% | 0.703 | S | S | * | * | | | trans | -72 | 77.1 | 163.2 | -80.4 | 159.2 | 0 | 0 | 0 | 105.8 | P185 | P185-L187 PolarHBondContact O-N 3.1Š|
| 188 | D | 57.5 | Low | 64.4 | Low | 131 Ų | 131 | 121.6 Ų | 121.6 | 70% | 0.701 | 72% | 0.72 | S | S | * | * | | | trans | -66.6 | 135.1 | 170.4 | -72.7 | -34.6 | 0 | 0 | 0 | 108.9 | A186 S190 | A186-D188 PolarHBondContact O-N 2.65Å; D188-S190 PolarHBondContact O-N 3.27Å |
| 189 | D | 53.5 | Low | 62.4 | Low | 167 Ų | 167 | 123.7 Ų | 123.7 | 89% | 0.893 | 73% | 0.733 | S | S | * | * | | | trans | 16.9 | 93.8 | 149.9 | -103.2 | -88.5 | 0 | 0 | 0 | 116.5 | | |
| 190 | S | 45.7 | Very low | 60.5 | Low | 113 Ų | 113 | 120.1 Ų | 120.1 | 79% | 0.79 | 72% | 0.724 | S | S | * | * | | | trans | -139.1 | 125.1 | 154.9 | -71.3 | 0 | 0 | 0 | 0 | 107.9 | D188 | D188-S190 PolarHBondContact O-N 3.27Š|
| 191 | D | 47.4 | Very low | 59 | Low | 148 Ų | 148 | 121.6 Ų | 121.6 | 79% | 0.791 | 72% | 0.722 | S | S | * | * | | | trans | -29.8 | 146.3 | 176.4 | -68 | -62.2 | 0 | 0 | 0 | 115.1 | P193 | D191-P193 WeakPolarHBondContact O-CD 3.39Å; D191-P193 VanDerWaalsContact O-N 3.14Å |
| 192 | P | 50.8 | Low | 57.5 | Low | 123 Ų | 123 | 125.3 Ų | 125.3 | 80% | 0.799 | 74% | 0.735 | S | S | * | * | | | trans | -66.4 | 112.9 | -172.8 | 28.3 | -34.4 | 0 | 0 | 0 | 111.4 | A194 | P192-A194 PolarHBondContact O-N 3.34Š|
| 193 | P | 45.4 | Very low | 55.6 | Low | 110 Ų | 110 | 131 Ų | 131 | 71% | 0.714 | 76% | 0.756 | S | S | * | * | | | trans | -83.3 | 112 | 164.7 | 28.5 | -16.3 | 0 | 0 | 0 | 107.4 | D191 S195 | D191-P193 WeakPolarHBondContact O-CD 3.39Å; D191-P193 VanDerWaalsContact O-N 3.14Å; P193-S195 PolarHBondContact O-N 2.91Å |
| 194 | A | 55.8 | Low | 53.8 | Low | 102 Ų | 102 | 127.9 Ų | 127.9 | 84% | 0.843 | 75% | 0.75 | S | S | * | * | | | trans | -37.6 | 119.8 | 168.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | P192 | P192-A194 PolarHBondContact O-N 3.34Š|
| 195 | S | 46.3 | Very low | 51.9 | Low | 108 Ų | 108 | 127.2 Ų | 127.2 | 76% | 0.755 | 75% | 0.751 | S | S | * | * | | | trans | -160.4 | 105.8 | 154.7 | 35.8 | 0 | 0 | 0 | 0 | 112.1 | P193 | P193-S195 PolarHBondContact O-N 2.91Š|
| 196 | P | 53.5 | Low | 50.4 | Low | 115 Ų | 115 | 130.5 Ų | 130.5 | 75% | 0.747 | 75% | 0.754 | S | S | * | * | | | trans | -81.1 | 169.8 | 149.9 | 35.9 | -28.4 | 0 | 0 | 0 | 109.1 | | |
| 197 | P | 50.4 | Low | 48.9 | Very low | 83 Ų | 83 | 132.5 Ų | 132.5 | 54% | 0.539 | 76% | 0.759 | S | S | . | * | | | cis | -140.6 | 122.8 | 22.1 | 35.5 | -13.2 | 0 | 0 | 0 | 115.1 | L199 | P197-L199 VanDerWaalsContact C-N 3.28Š|
| 198 | L | 49.3 | Very low | 47.7 | Very low | 158 Ų | 158 | 129.3 Ų | 129.3 | 83% | 0.827 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -89.4 | 8 | 160.3 | -64.2 | -165.4 | 0 | 0 | 0 | 113.1 | | |
| 199 | L | 52.3 | Low | 46.7 | Very low | 142 Ų | 142 | 131.4 Ų | 131.4 | 74% | 0.743 | 75% | 0.754 | S | S | * | * | | | trans | -88.3 | -7.3 | 175.8 | -65.8 | -171.3 | 0 | 0 | 0 | 114.2 | P197 I201 | P197-L199 VanDerWaalsContact C-N 3.28Å; L199-I201 PolarHBondContact O-N 3.12Å |
| 200 | S | 49.8 | Very low | 45.7 | Very low | 69 Ų | 69 | 129.1 Ų | 129.1 | 48% | 0.483 | 75% | 0.751 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -75.8 | -9.8 | 177.4 | -59.9 | 0 | 0 | 0 | 0 | 114.1 | | |
| 201 | I | 54.6 | Low | 45.3 | Very low | 146 Ų | 146 | 130.7 Ų | 130.7 | 75% | 0.749 | 75% | 0.751 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.7 | -18.1 | -179.2 | -60.7 | 173.4 | 0 | 0 | 0 | 111.7 | L199 | L199-I201 PolarHBondContact O-N 3.12Š|
| 202 | L | 51.9 | Low | 44.5 | Very low | 154 Ų | 154 | 130.8 Ų | 130.8 | 81% | 0.806 | 76% | 0.757 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.3 | -10.4 | -179.3 | -155.6 | 65.9 | 0 | 0 | 0 | 114.1 | | |
| 203 | E | 45.8 | Very low | 43.7 | Very low | 167 Ų | 167 | 129.1 Ų | 129.1 | 78% | 0.78 | 75% | 0.753 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.3 | 3.3 | -174.4 | -153.5 | 174.4 | 176.7 | 0 | 0 | 114.5 | V205 | E203-V205 PolarHBondContact O-N 3.22Š|
| 204 | N | 47 | Very low | 43 | Very low | 142 Ų | 142 | 128.9 Ų | 128.9 | 76% | 0.759 | 76% | 0.76 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.6 | 10.6 | -178.9 | -88 | 98.8 | 0 | 0 | 0 | 116 | K206 | N204-K206 PolarHBondContact O-N 2.88Š|
| 205 | V | 42.2 | Very low | 41.8 | Very low | 129 Ų | 129 | 127.4 Ų | 127.4 | 78% | 0.782 | 76% | 0.755 | S | S | * | * | | | trans | -87.2 | 85.4 | 164.8 | 179.8 | 0 | 0 | 0 | 0 | 109.3 | E203 T207 | E203-V205 PolarHBondContact O-N 3.22Å; V205-T207 PolarHBondContact O-N 3.35Å; V205-T207 VanDerWaalsContact O-N 3.13Å |
| 206 | K | 34.5 | Very low | 41 | Very low | 181 Ų | 181 | 131.9 Ų | 131.9 | 79% | 0.787 | 76% | 0.764 | S | S | * | * | | | trans | -57.8 | 102 | 169.7 | -177.7 | 81.9 | 171.8 | -178.3 | 0 | 110.8 | N204 | N204-K206 PolarHBondContact O-N 2.88Š|
| 207 | T | 31.4 | Very low | 40 | Very low | 117 Ų | 117 | 132.4 Ų | 132.4 | 72% | 0.718 | 77% | 0.765 | S | S | * | * | | | trans | -82.5 | 122.5 | 151.8 | 48.4 | 0 | 0 | 0 | 0 | 108.7 | V205 | V205-T207 PolarHBondContact O-N 3.35Å; V205-T207 VanDerWaalsContact O-N 3.13Å |
| 208 | P | 37.3 | Very low | 39.6 | Very low | 111 Ų | 111 | 134.1 Ų | 134.1 | 72% | 0.721 | 78% | 0.776 | S | S | * | * | | | trans | -88.4 | 113.7 | 163.5 | 31.1 | -24.6 | 0 | 0 | 0 | 109.4 | | |
| 209 | E | 34.8 | Very low | 38.7 | Very low | 174 Ų | 174 | 130.5 Ų | 130.5 | 81% | 0.813 | 77% | 0.769 | S | S | * | * | | | trans | -70.6 | 137.8 | 158.5 | -69.5 | -164 | 131.1 | 0 | 0 | 110 | | |
| 210 | S | 33.4 | Very low | 37.8 | Very low | 119 Ų | 119 | 128.5 Ų | 128.5 | 83% | 0.832 | 77% | 0.767 | S | S | * | * | | | trans | -150.3 | 113.5 | 150.7 | 67.3 | 0 | 0 | 0 | 0 | 110.2 | | |
| 211 | N | 37.1 | Very low | 37 | Very low | 147 Ų | 147 | 133.3 Ų | 133.3 | 79% | 0.786 | 78% | 0.781 | S | S | * | * | | | trans | -81.4 | 126.7 | 166.7 | -66 | -59.4 | 0 | 0 | 0 | 109.6 | | |
| 212 | V | 31.7 | Very low | 35.8 | Very low | 150 Ų | 150 | 133 Ų | 133 | 91% | 0.909 | 78% | 0.781 | S | S | * | * | | | trans | -151.3 | 139.3 | 147.1 | 177.3 | 0 | 0 | 0 | 0 | 109.3 | | |
| 213 | A | 32.5 | Very low | 35 | Very low | 88 Ų | 88 | 129.6 Ų | 129.6 | 73% | 0.727 | 78% | 0.776 | S | S | * | * | | | trans | -75 | 166.2 | -175.4 | 0 | 0 | 0 | 0 | 0 | 116.1 | | |
| 214 | A | 32.4 | Very low | 34.3 | Very low | 104 Ų | 104 | 128.2 Ų | 128.2 | 86% | 0.86 | 77% | 0.774 | S | S | * | * | | | trans | 77.4 | 128.2 | 149.8 | 0 | 0 | 0 | 0 | 0 | 119.8 | | |
| 215 | G | 29.6 | Very low | 33.7 | Very low | 71 Ų | 71 | 129 Ų | 129 | 73% | 0.732 | 78% | 0.777 | S | S | * | * | | | trans | 112.5 | 109.9 | 136.1 | 0 | 0 | 0 | 0 | 0 | 118.1 | | |
| 216 | E | 28.6 | Very low | 33.2 | Very low | 202 Ų | 202 | 128.3 Ų | 128.3 | 94% | 0.944 | 78% | 0.778 | S | S | * | * | | | trans | 77.1 | 139.4 | 142.7 | -71.1 | -164.6 | 120.8 | 0 | 0 | 123.7 | | |
| 217 | V | 34.2 | Very low | 32.9 | Very low | 126 Ų | 126 | 125 Ų | 125 | 76% | 0.764 | 78% | 0.777 | S | S | * | * | | | trans | -78 | 144.7 | 172.8 | 166.9 | 0 | 0 | 0 | 0 | 109.5 | A219 | V217-A219 HydrophobicContact CG1-CB 4.45Š|
| 218 | P | 40.9 | Very low | 33 | Very low | 120 Ų | 120 | 124.9 Ų | 124.9 | 78% | 0.779 | 78% | 0.775 | S | S | * | * | | | | -145 | 137.7 | 92.3 | 27.7 | -5.3 | 0 | 0 | 0 | 113.6 | | |
| 219 | A | 30.8 | Very low | 32.9 | Very low | 81 Ų | 81 | 125.9 Ų | 125.9 | 67% | 0.669 | 78% | 0.781 | S | S | * | * | | | | 60.9 | 105.3 | 73.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | V217 | V217-A219 HydrophobicContact CG1-CB 4.45Š|
| 220 | S | 32.7 | Very low | 32.9 | Very low | 100 Ų | 100 | 121.3 Ų | 121.3 | 70% | 0.699 | 77% | 0.774 | S | S | * | * | | | trans | 149.7 | 116.4 | 138.9 | 53.2 | 0 | 0 | 0 | 0 | 111.5 | | |
| 221 | Q | 34.1 | Very low | 33.2 | Very low | 170 Ų | 170 | 121.6 Ų | 121.6 | 79% | 0.794 | 78% | 0.776 | S | S | * | * | | | | 81.9 | 133.4 | 104.4 | -72.4 | 173.7 | 17 | 0 | 0 | 112.3 | | |
| 222 | D | 29.1 | Very low | 33.4 | Very low | 140 Ų | 140 | 119.1 Ų | 119.1 | 75% | 0.749 | 78% | 0.775 | S | S | * | * | | | cis | -162.7 | 156.5 | 18.9 | -89.3 | -39.1 | 0 | 0 | 0 | 111.5 | | |
| 223 | A | 36 | Very low | 33.9 | Very low | 83 Ų | 83 | 116.8 Ų | 116.8 | 69% | 0.686 | 77% | 0.772 | S | S | * | * | | | trans | 49 | 120.7 | 140.7 | 0 | 0 | 0 | 0 | 0 | 124.8 | | |
| 224 | D | 29.5 | Very low | 34.4 | Very low | 138 Ų | 138 | 120.2 Ų | 120.2 | 74% | 0.738 | 78% | 0.776 | S | S | * | * | | | | 84.6 | 111.7 | 126.6 | -70.3 | -15.9 | 0 | 0 | 0 | 124.8 | | |
| 225 | L | 35.8 | Very low | 35.1 | Very low | 158 Ų | 158 | 123.8 Ų | 123.8 | 83% | 0.827 | 78% | 0.78 | S | S | * | * | | | trans | 70 | 111.1 | 131 | -57.4 | 170.6 | 0 | 0 | 0 | 120.6 | | |
| 226 | S | 30.9 | Very low | 35.5 | Very low | 114 Ų | 114 | 122.7 Ų | 122.7 | 80% | 0.797 | 77% | 0.769 | S | S | * | * | | | | 160 | 122.2 | 111.6 | -175.1 | 0 | 0 | 0 | 0 | 113.6 | | |
| 227 | C | 28.3 | Very low | 36.8 | Very low | 113 Ų | 113 | 120.7 Ų | 120.7 | 76% | 0.764 | 77% | 0.765 | S | S | * | * | | | trans | 55.7 | 128.8 | 139.2 | -150.1 | 0 | 0 | 0 | 0 | 122.6 | | |
| 228 | V | 34.2 | Very low | 37.3 | Very low | 114 Ų | 114 | 119.5 Ų | 119.5 | 69% | 0.691 | 76% | 0.762 | S | S | * | * | | | trans | 110.3 | 107.6 | 150.5 | -168.4 | 0 | 0 | 0 | 0 | 114.8 | | |
| 229 | P | 35.2 | Very low | 37.6 | Very low | 131 Ų | 131 | 121.9 Ų | 121.9 | 85% | 0.851 | 77% | 0.768 | S | S | * | * | | | trans | -91.6 | 105.3 | 157.7 | 32.5 | -21.7 | 0 | 0 | 0 | 108.9 | | |
| 230 | A | 33 | Very low | 38.6 | Very low | 79 Ų | 79 | 125.3 Ų | 125.3 | 65% | 0.653 | 77% | 0.774 | S | S | * | * | | | trans | -88.9 | 122.5 | 159.6 | 0 | 0 | 0 | 0 | 0 | 108.5 | | |
| 231 | S | 40.5 | Very low | 39.4 | Very low | 124 Ų | 124 | 127.8 Ų | 127.8 | 87% | 0.867 | 78% | 0.778 | S | S | * | * | | | trans | 43.6 | 85.6 | 139.4 | -39.7 | 0 | 0 | 0 | 0 | 117.3 | | |
| 232 | A | 40.8 | Very low | 39.7 | Very low | 95 Ų | 95 | 126.8 Ų | 126.8 | 79% | 0.785 | 78% | 0.777 | S | S | * | * | | | trans | -104.1 | 106.2 | 155.4 | 0 | 0 | 0 | 0 | 0 | 108.7 | I234 | A232-I234 PolarHBondContact O-N 3.28Š|
| 233 | A | 42 | Very low | 39.9 | Very low | 101 Ų | 101 | 125.4 Ų | 125.4 | 84% | 0.835 | 78% | 0.778 | S | S | * | * | | | trans | -59.5 | 115.7 | 167.4 | 0 | 0 | 0 | 0 | 0 | 109.4 | L235 | A233-L235 PolarHBondContact O-N 3.05Š|
| 234 | I | 44.8 | Very low | 39.9 | Very low | 160 Ų | 160 | 126.3 Ų | 126.3 | 82% | 0.821 | 78% | 0.779 | S | S | * | * | | | trans | -92.4 | 94.3 | 161 | -59.4 | -179.9 | 0 | 0 | 0 | 106.1 | A232 G236 | A232-I234 PolarHBondContact O-N 3.28Å; I234-G236 PolarHBondContact O-N 2.75Å |
| 235 | L | 46.3 | Very low | 40.2 | Very low | 180 Ų | 180 | 125.3 Ų | 125.3 | 94% | 0.942 | 78% | 0.783 | S | S | * | * | | | trans | -68.2 | 107.9 | 162.7 | -173.6 | 75.2 | 0 | 0 | 0 | 107.2 | A233 | A233-L235 PolarHBondContact O-N 3.05Š|
| 236 | G | 37.2 | Very low | 40.5 | Very low | 48 Ų | 48 | 123 Ų | 123 | 50% | 0.495 | 79% | 0.786 | S | S | . | * | | | trans | 178.8 | 83.6 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | I234 S238 | I234-G236 PolarHBondContact O-N 2.75Å; G236-S238 PolarHBondContact O-N 3.1Å |
| 237 | N | 56 | Low | 41 | Very low | 159 Ų | 159 | 126.4 Ų | 126.4 | 85% | 0.85 | 79% | 0.789 | S | S | * | * | | | trans | -13.2 | 93.3 | 161 | 54.9 | 2 | 0 | 0 | 0 | 117.1 | | |
| 238 | S | 44.5 | Very low | 41.8 | Very low | 101 Ų | 101 | 129.9 Ų | 129.9 | 71% | 0.706 | 80% | 0.795 | S | S | * | * | | | trans | -159.7 | 117.3 | 156 | -79 | 0 | 0 | 0 | 0 | 110.3 | G236 I240 | G236-S238 PolarHBondContact O-N 3.1Å; S238-I240 PolarHBondContact O-N 3.37Å |
| 239 | N | 48.8 | Very low | 41.9 | Very low | 171 Ų | 171 | 133.3 Ų | 133.3 | 91% | 0.914 | 80% | 0.803 | S | S | * | * | | | trans | -78.2 | 92.7 | 170.8 | -73.8 | -28.7 | 0 | 0 | 0 | 109.1 | | |
| 240 | I | 51.8 | Low | 41.9 | Very low | 152 Ų | 152 | 131.7 Ų | 131.7 | 78% | 0.779 | 80% | 0.801 | S | S | * | * | | | trans | -96.9 | 94.6 | 160.4 | -57.4 | 179.1 | 0 | 0 | 0 | 106.2 | S238 L242 | S238-I240 PolarHBondContact O-N 3.37Å; I240-L242 PolarHBondContact O-N 3.06Å |
| 241 | L | 47.8 | Very low | 42 | Very low | 152 Ų | 152 | 135.5 Ų | 135.5 | 80% | 0.796 | 81% | 0.809 | S | S | * | * | | | trans | -76 | 93.5 | 170.1 | -107.2 | 164.4 | 0 | 0 | 0 | 108.4 | C243 | L241-C243 PolarHBondContact O-N 3.23Š|
| 242 | L | 42.2 | Very low | 41.9 | Very low | 149 Ų | 149 | 139 Ų | 139 | 78% | 0.78 | 81% | 0.812 | S | S | * | * | | | trans | -74.9 | 91.2 | 164.6 | -175 | 71.6 | 0 | 0 | 0 | 108.1 | I240 S244 | I240-L242 PolarHBondContact O-N 3.06Å; L242-S244 PolarHBondContact O-N 3.18Å; L242-S244 VanDerWaalsContact O-N 3.16Å |
| 243 | C | 31.3 | Very low | 41.6 | Very low | 112 Ų | 112 | 140.7 Ų | 140.7 | 76% | 0.757 | 81% | 0.808 | S | S | * | * | | | trans | -81.4 | 89.8 | 173.5 | -68.8 | 0 | 0 | 0 | 0 | 110.4 | L241 | L241-C243 PolarHBondContact O-N 3.23Š|
| 244 | S | 37.7 | Very low | 41.7 | Very low | 102 Ų | 102 | 144.5 Ų | 144.5 | 71% | 0.713 | 81% | 0.813 | S | S | * | * | | | trans | -100.6 | 111.7 | 151.6 | -70.1 | 0 | 0 | 0 | 0 | 107.6 | L242 | L242-S244 PolarHBondContact O-N 3.18Å; L242-S244 VanDerWaalsContact O-N 3.16Å |
| 245 | S | 36.1 | Very low | 41.4 | Very low | 117 Ų | 117 | 144 Ų | 144 | 82% | 0.818 | 81% | 0.813 | S | S | * | * | | | trans | -143.6 | 111.2 | 157.7 | -78.7 | 0 | 0 | 0 | 0 | 108.6 | | |
| 246 | A | 40.8 | Very low | 41 | Very low | 108 Ų | 108 | 138.7 Ų | 138.7 | 89% | 0.893 | 80% | 0.801 | S | S | * | * | | | trans | -80.4 | 122.8 | 159.4 | 0 | 0 | 0 | 0 | 0 | 106.7 | | |
| 247 | E | 41.6 | Very low | 41.4 | Very low | 186 Ų | 186 | 143.6 Ų | 143.6 | 87% | 0.869 | 82% | 0.816 | S | S | * | * | | | trans | -135.6 | 115.5 | 155.2 | 60.5 | -167.4 | 152.2 | 0 | 0 | 108.2 | | |
| 248 | E | 44.7 | Very low | 41.1 | Very low | 186 Ų | 186 | 143.4 Ų | 143.4 | 87% | 0.869 | 81% | 0.814 | S | S | * | * | | | trans | -84.4 | 125.4 | 168.7 | -179.8 | -162.1 | -166.8 | 0 | 0 | 106.6 | | |
| 249 | E | 35.8 | Very low | 41.6 | Very low | 186 Ų | 186 | 146.7 Ų | 146.7 | 87% | 0.869 | 82% | 0.823 | S | S | * | * | | | trans | -175.3 | 147.7 | 134.6 | -108.6 | -166.3 | 160.5 | 0 | 0 | 114 | | |
| 250 | A | 36.3 | Very low | 41.4 | Very low | 97 Ų | 97 | 146.7 Ų | 146.7 | 80% | 0.802 | 82% | 0.823 | S | S | * | * | | | trans | 77.5 | 87.2 | 154.4 | 0 | 0 | 0 | 0 | 0 | 119.9 | | |
| 251 | L | 35 | Very low | 41.2 | Very low | 160 Ų | 160 | 146.7 Ų | 146.7 | 84% | 0.838 | 83% | 0.825 | S | S | * | * | | | trans | -57.7 | 133.7 | 150.7 | -69.1 | 159.2 | 0 | 0 | 0 | 113 | | |
| 252 | Q | 38.6 | Very low | 41.4 | Very low | 196 Ų | 196 | 147.3 Ų | 147.3 | 92% | 0.916 | 83% | 0.828 | S | S | * | * | | | trans | 167.8 | 135 | 146.6 | -92.6 | 138.6 | 36.9 | 0 | 0 | 106 | | |
| 253 | D | 33.4 | Very low | 41.4 | Very low | 132 Ų | 132 | 146.7 Ų | 146.7 | 71% | 0.706 | 83% | 0.83 | S | S | * | * | | | cis | -171.8 | 115.5 | 12.8 | 178.6 | 20.3 | 0 | 0 | 0 | 104.5 | | |
| 254 | L | 45.2 | Very low | 42.1 | Very low | 181 Ų | 181 | 147.2 Ų | 147.2 | 95% | 0.948 | 83% | 0.832 | S | S | * | * | | | trans | -143.2 | 74.2 | 159.2 | -77.9 | -172 | 0 | 0 | 0 | 107.2 | | |
| 255 | N | 37.6 | Very low | 42.2 | Very low | 150 Ų | 150 | 147.5 Ų | 147.5 | 80% | 0.802 | 83% | 0.834 | S | S | * | * | | | trans | -66 | 127.1 | 160.3 | -155.7 | 34.4 | 0 | 0 | 0 | 108.7 | | |
| 256 | G | 39.4 | Very low | 42.4 | Very low | 67 Ų | 67 | 149.3 Ų | 149.3 | 69% | 0.691 | 83% | 0.834 | S | S | * | * | | | trans | -178.4 | 74.4 | -179.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | | |
| 257 | D | 44.5 | Very low | 42.6 | Very low | 152 Ų | 152 | 152.6 Ų | 152.6 | 81% | 0.813 | 83% | 0.831 | S | S | * | * | | | trans | 0.3 | 140 | 156.7 | -87.7 | -118.6 | 0 | 0 | 0 | 119 | | |
| 258 | D | 50 | Low | 42.6 | Very low | 154 Ų | 154 | 151.5 Ų | 151.5 | 82% | 0.824 | 83% | 0.828 | S | S | * | * | | | trans | 111.4 | 61.6 | 149.7 | -151.9 | 48.1 | 0 | 0 | 0 | 117.2 | | |
| 259 | L | 53.9 | Low | 42.8 | Very low | 170 Ų | 170 | 147.6 Ų | 147.6 | 89% | 0.89 | 83% | 0.827 | S | S | * | * | | | trans | -154.9 | 35.4 | 157.3 | -148.9 | 62.6 | 0 | 0 | 0 | 117.1 | | |
| 260 | D | 45 | Very low | 42.9 | Very low | 171 Ų | 171 | 143 Ų | 143 | 91% | 0.914 | 82% | 0.821 | S | S | * | * | | | trans | -102.2 | 6.4 | 179.6 | -93.4 | -48.6 | 0 | 0 | 0 | 115.8 | | |
| 261 | D | 49.3 | Very low | 43.1 | Very low | 153 Ų | 153 | 144.2 Ų | 144.2 | 82% | 0.818 | 82% | 0.824 | S | S | * | * | S | Bend | trans | -104.2 | 18.8 | -170.6 | -150.1 | 27.3 | 0 | 0 | 0 | 116.5 | | |
| 262 | L | 51.1 | Low | 43.9 | Very low | 165 Ų | 165 | 142.7 Ų | 142.7 | 86% | 0.864 | 82% | 0.821 | S | S | * | * | | | trans | -143.5 | 59 | 177.2 | -68.3 | 176.9 | 0 | 0 | 0 | 114.8 | | |
| 263 | V | 42.3 | Very low | 44.6 | Very low | 135 Ų | 135 | 138.3 Ų | 138.3 | 82% | 0.818 | 81% | 0.809 | S | S | * | * | | | trans | -138.5 | 104.1 | 154.9 | -173.4 | 0 | 0 | 0 | 0 | 110.8 | S265 | V263-S265 PolarHBondContact O-N 3.36Š|
| 264 | P | 46 | Very low | 45.2 | Very low | 123 Ų | 123 | 139.7 Ų | 139.7 | 80% | 0.799 | 82% | 0.817 | S | S | * | * | | | trans | -64.7 | 119.9 | 165.9 | -22.5 | 34.5 | 0 | 0 | 0 | 110.9 | L266 | P264-L266 PolarHBondContact O-N 3.34Š|
| 265 | S | 39.5 | Very low | 46.1 | Very low | 109 Ų | 109 | 137.6 Ų | 137.6 | 76% | 0.762 | 81% | 0.805 | S | S | * | * | | | trans | -47.9 | 120.3 | 168.6 | -175 | 0 | 0 | 0 | 0 | 111.6 | V263 | V263-S265 PolarHBondContact O-N 3.36Š|
| 266 | L | 40.6 | Very low | 46.6 | Very low | 155 Ų | 155 | 136.8 Ų | 136.8 | 81% | 0.812 | 80% | 0.801 | S | S | * | * | | | trans | -130.9 | 92.5 | 159.3 | -174.3 | 63 | 0 | 0 | 0 | 108.2 | P264 M268 | P264-L266 PolarHBondContact O-N 3.34Å; L266-M268 PolarHBondContact O-N 3.15Å |
| 267 | E | 44 | Very low | 47.4 | Very low | 176 Ų | 176 | 141.3 Ų | 141.3 | 82% | 0.822 | 81% | 0.808 | S | S | * | * | | | trans | -54 | 115.6 | 155 | -71.7 | 179.9 | 133.6 | 0 | 0 | 108.8 | | |
| 268 | M | 41.6 | Very low | 47.9 | Very low | 163 Ų | 163 | 138.6 Ų | 138.6 | 80% | 0.803 | 80% | 0.801 | S | S | * | * | | | trans | -136.3 | 95.6 | 159.1 | -159.3 | 65.9 | 140.1 | 0 | 0 | 108.1 | L266 A270 | L266-M268 PolarHBondContact O-N 3.15Å; M268-A270 PolarHBondContact O-N 2.79Å |
| 269 | A | 48.8 | Very low | 47.7 | Very low | 105 Ų | 105 | 134.2 Ų | 134.2 | 87% | 0.868 | 79% | 0.792 | S | S | * | * | | | trans | -56.5 | 116.7 | 165.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | | |
| 270 | A | 39.8 | Very low | 47.9 | Very low | 89 Ų | 89 | 132 Ų | 132 | 74% | 0.736 | 79% | 0.788 | S | S | * | * | | | trans | -128.7 | 112.9 | 165.6 | 0 | 0 | 0 | 0 | 0 | 107.7 | M268 V272 | M268-A270 PolarHBondContact O-N 2.79Å; A270-V272 PolarHBondContact O-N 2.94Å |
| 271 | S | 38.7 | Very low | 48.2 | Very low | 123 Ų | 123 | 133.3 Ų | 133.3 | 86% | 0.86 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 126 | -174.7 | -43 | 0 | 0 | 0 | 0 | 112.4 | | |
| 272 | V | 52.2 | Low | 47.9 | Very low | 128 Ų | 128 | 132.4 Ų | 132.4 | 78% | 0.776 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -80.8 | 124.2 | 162.5 | -179.8 | 0 | 0 | 0 | 0 | 106.8 | A270 D274 | A270-V272 PolarHBondContact O-N 2.94Å; V272-D274 PolarHBondContact O-N 2.96Å |
| 273 | P | 53.1 | Low | 47.8 | Very low | 103 Ų | 103 | 132.2 Ų | 132.2 | 67% | 0.669 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -74.2 | 127.3 | 170.9 | 29 | -29.3 | 0 | 0 | 0 | 109 | I275 | P273-I275 PolarHBondContact O-N 3.26Š|
| 274 | D | 46.1 | Very low | 48.5 | Very low | 161 Ų | 161 | 130.6 Ų | 130.6 | 86% | 0.861 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 117.2 | 169 | -75.6 | -40.3 | 0 | 0 | 0 | 109.3 | V272 | V272-D274 PolarHBondContact O-N 2.96Š|
| 275 | I | 64.1 | Low | 48.5 | Very low | 138 Ų | 138 | 131.6 Ų | 131.6 | 71% | 0.708 | 78% | 0.78 | S | S | * | * | | | trans | -84.6 | 110.3 | 168.5 | -121 | 81 | 0 | 0 | 0 | 106.5 | P273 L277 | P273-I275 PolarHBondContact O-N 3.26Å; I275-L277 HydrophobicContact CG2-CD1 4.5Å; I275-L277 HydrophobicContact CG2-CD2 3.97Å; I275-L277 HydrophobicContact CG2-CG 3.9Å |
| 276 | D | 48.3 | Very low | 49 | Very low | 133 Ų | 133 | 136.7 Ų | 136.7 | 71% | 0.711 | 78% | 0.783 | S | S | * | * | | | trans | -83.8 | 113.9 | 174.6 | -165.3 | -7.9 | 0 | 0 | 0 | 108.8 | S278 | D276-S278 VanDerWaalsContact C-N 3.27Å; D276-S278 VanDerWaalsContact CG-OG 3.24Å; D276-S278 PolarHBondContact O-N 3.32Å; D276-S278 WeakPolarHBondContact OD1-CB 3.45Å; D276-S278 PolarHBondContact OD1-OG 2.76Å; D276-S278 PolarHBondContact OD2-OG 3.33Å |
| 277 | L | 56.8 | Low | 49.3 | Very low | 162 Ų | 162 | 136.1 Ų | 136.1 | 85% | 0.848 | 78% | 0.776 | S | S | * | * | | | trans | -91 | 30.6 | -177.4 | -69.7 | 174 | 0 | 0 | 0 | 112.8 | I275 | I275-L277 HydrophobicContact CG2-CD1 4.5Å; I275-L277 HydrophobicContact CG2-CD2 3.97Å; I275-L277 HydrophobicContact CG2-CG 3.9Å |
| 278 | S | 55.7 | Low | 49.6 | Very low | 95 Ų | 95 | 132.1 Ų | 132.1 | 66% | 0.664 | 76% | 0.764 | S | S | * | * | | | trans | -105.9 | 40.3 | -175 | 63.5 | 0 | 0 | 0 | 0 | 114.9 | D276 | D276-S278 VanDerWaalsContact C-N 3.27Å; D276-S278 VanDerWaalsContact CG-OG 3.24Å; D276-S278 PolarHBondContact O-N 3.32Å; D276-S278 WeakPolarHBondContact OD1-CB 3.45Å; D276-S278 PolarHBondContact OD1-OG 2.76Å; D276-S278 PolarHBondContact OD2-OG 3.33Å |
| 279 | G | 44.8 | Very low | 49.9 | Very low | 62 Ų | 62 | 131.2 Ų | 131.2 | 64% | 0.639 | 76% | 0.761 | S | S | * | * | | | trans | -139 | 127.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 114 | F281 | G279-F281 PolarHBondContact O-N 3.24Š|
| 280 | P | 59.1 | Low | 49.9 | Very low | 124 Ų | 124 | 136.7 Ų | 136.7 | 81% | 0.805 | 76% | 0.761 | S | S | * | * | | | trans | -92.5 | 70.9 | -171.6 | 36.7 | -33.7 | 0 | 0 | 0 | 112.2 | | |
| 281 | F | 49.6 | Very low | 50.4 | Low | 197 Ų | 197 | 139 Ų | 139 | 86% | 0.864 | 76% | 0.755 | S | S | * | * | | | trans | -163.1 | 100.1 | 162.4 | -89.7 | -74.1 | 0 | 0 | 0 | 110.1 | G279 | G279-F281 PolarHBondContact O-N 3.24Š|
| 282 | C | 44.4 | Very low | 50.8 | Low | 134 Ų | 134 | 138.4 Ų | 138.4 | 91% | 0.905 | 75% | 0.751 | S | S | * | * | | | trans | -167.8 | 98.9 | 145.9 | -108.3 | 0 | 0 | 0 | 0 | 109.3 | | |
| 283 | L | 49.5 | Very low | 50.5 | Low | 161 Ų | 161 | 138.8 Ų | 138.8 | 84% | 0.843 | 75% | 0.753 | S | S | * | * | | | trans | -60.8 | 143.3 | 168.7 | -71.7 | 158.1 | 0 | 0 | 0 | 109.7 | D285 | L283-D285 PolarHBondContact O-N 3.49Š|
| 284 | P | 55.6 | Low | 50.2 | Low | 101 Ų | 101 | 138 Ų | 138 | 66% | 0.656 | 76% | 0.755 | S | S | * | * | | | trans | -69 | 127.4 | 178.3 | -16.1 | 29.5 | 0 | 0 | 0 | 112.2 | W286 | P284-W286 PolarHBondContact O-N 3.18Š|
| 285 | D | 47 | Very low | 50.1 | Low | 145 Ų | 145 | 135.7 Ų | 135.7 | 78% | 0.775 | 75% | 0.751 | S | S | * | * | G | 310 helix | trans | -67.5 | 18.3 | -179 | -109.8 | -11.3 | 0 | 0 | 0 | 115.5 | L283 E287 | L283-D285 PolarHBondContact O-N 3.49Å; D285-E287 VanDerWaalsContact C-N 3.35Å; D285-E287 PolarHBondContact O-N 2.87Å |
| 286 | W | 48.4 | Very low | 49 | Very low | 216 Ų | 216 | 136.4 Ų | 136.4 | 82% | 0.818 | 76% | 0.757 | S | S | * | * | G | 310 helix | trans | -83.6 | -6.9 | -176.3 | -65.8 | 101.2 | 0 | 0 | 0 | 114 | P284 | P284-W286 PolarHBondContact O-N 3.18Š|
| 287 | E | 47.3 | Very low | 49.1 | Very low | 142 Ų | 142 | 138.1 Ų | 138.1 | 66% | 0.664 | 77% | 0.765 | S | S | * | * | G | 310 helix | trans | -88 | -1.7 | -176.1 | -134.7 | -162.2 | 132.6 | 0 | 0 | 115.2 | D285 K291 | D285-E287 VanDerWaalsContact C-N 3.35Å; D285-E287 PolarHBondContact O-N 2.87Å; E287-K291 IonicContact OE1-NZ 3.51Å; E287-K291 PolarHBondContact OE1-NZ 3.23Å |
| 288 | T | 51.3 | Low | 48.6 | Very low | 93 Ų | 93 | 139.1 Ų | 139.1 | 57% | 0.571 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -95.9 | -10.9 | -171.2 | -37 | 0 | 0 | 0 | 0 | 113.7 | | |
| 289 | L | 48 | Very low | 48.1 | Very low | 143 Ų | 143 | 139 Ų | 139 | 75% | 0.749 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -86.8 | -8.2 | -177.9 | -74.9 | 171.3 | 0 | 0 | 0 | 114.7 | | |
| 290 | Y | 48.6 | Very low | 47.7 | Very low | 221 Ų | 221 | 145 Ų | 145 | 87% | 0.867 | 78% | 0.781 | S | S | * | * | S | Bend | trans | -100.4 | -6.1 | -179.2 | -114.4 | -92.7 | 0 | 0 | 0 | 115 | | |
| 291 | K | 50.3 | Low | 47 | Very low | 137 Ų | 137 | 144.8 Ų | 144.8 | 60% | 0.596 | 78% | 0.778 | S | S | * | * | S | Bend | trans | -99 | -10.1 | -177.9 | -103.9 | 100.3 | 90.1 | -173.9 | 0 | 115.5 | E287 | E287-K291 IonicContact OE1-NZ 3.51Å; E287-K291 PolarHBondContact OE1-NZ 3.23Å |
| 292 | S | 47.2 | Very low | 46.4 | Very low | 111 Ų | 111 | 141.5 Ų | 141.5 | 78% | 0.776 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -93.9 | -2.6 | -173.4 | -87.1 | 0 | 0 | 0 | 0 | 116.9 | | |
| 293 | V | 45.1 | Very low | 46.6 | Very low | 135 Ų | 135 | 141 Ų | 141 | 82% | 0.818 | 77% | 0.769 | S | S | * | * | S | Bend | trans | -102.3 | -2.5 | 178.2 | -164.2 | 0 | 0 | 0 | 0 | 112.5 | | |
| 294 | A | 46.4 | Very low | 46.4 | Very low | 87 Ų | 87 | 139.1 Ų | 139.1 | 72% | 0.719 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -93.8 | 9.7 | -174 | 0 | 0 | 0 | 0 | 0 | 115 | | |
| 295 | S | 43.6 | Very low | 45.5 | Very low | 112 Ų | 112 | 142.3 Ų | 142.3 | 78% | 0.783 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -128.9 | 14.4 | -172 | -57.8 | 0 | 0 | 0 | 0 | 116.4 | | |
| 296 | D | 41.1 | Very low | 45.6 | Very low | 154 Ų | 154 | 140.1 Ų | 140.1 | 82% | 0.824 | 77% | 0.77 | S | S | * | * | | | trans | -123.1 | 42.5 | 179.9 | -157.5 | 25 | 0 | 0 | 0 | 114.2 | | |
| 297 | L | 50.4 | Low | 45 | Very low | 168 Ų | 168 | 134.8 Ų | 134.8 | 88% | 0.88 | 77% | 0.766 | S | S | * | * | | | trans | -129.4 | 87.5 | 167.6 | -84.3 | 167.5 | 0 | 0 | 0 | 109.5 | | |
| 298 | E | 46.3 | Very low | 44.8 | Very low | 183 Ų | 183 | 133.4 Ų | 133.4 | 86% | 0.855 | 77% | 0.772 | S | S | * | * | | | trans | -163.9 | 131.3 | 142.7 | -156.6 | 88 | -130.7 | 0 | 0 | 112 | | |
| 299 | S | 45.6 | Very low | 44.7 | Very low | 93 Ų | 93 | 135 Ų | 135 | 65% | 0.65 | 78% | 0.783 | S | S | * | * | | | trans | 79.5 | 83 | 155 | -62.8 | 0 | 0 | 0 | 0 | 120.7 | | |
| 300 | L | 36.5 | Very low | 44.7 | Very low | 187 Ų | 187 | 134.5 Ų | 134.5 | 98% | 0.979 | 79% | 0.787 | S | S | * | * | | | trans | -129.8 | 115.7 | 136 | -78.3 | 173.5 | 0 | 0 | 0 | 110.4 | | |
| 301 | T | 43.6 | Very low | 44.1 | Very low | 121 Ų | 121 | 129.9 Ų | 129.9 | 74% | 0.742 | 79% | 0.785 | S | S | * | * | | | trans | -86.9 | 138.7 | -174.2 | 23.6 | 0 | 0 | 0 | 0 | 113.2 | | |
| 302 | T | 37.9 | Very low | 43.5 | Very low | 128 Ų | 128 | 127.5 Ų | 127.5 | 79% | 0.785 | 79% | 0.786 | S | S | * | * | | | trans | 66 | 150.6 | 148.7 | 55.5 | 0 | 0 | 0 | 0 | 121 | | |
| 303 | P | 47.8 | Very low | 43.5 | Very low | 122 Ų | 122 | 127 Ų | 127 | 79% | 0.792 | 78% | 0.782 | S | S | * | * | | | cis | -131.8 | 165.4 | 25.8 | 39.6 | -20.3 | 0 | 0 | 0 | 119.3 | | |
| 304 | V | 45.5 | Very low | 43.4 | Very low | 122 Ų | 122 | 129.1 Ų | 129.1 | 74% | 0.739 | 78% | 0.781 | S | S | * | * | | | trans | -49.4 | 134.4 | 177.9 | 172.2 | 0 | 0 | 0 | 0 | 114.4 | | |
| 305 | I | 37.3 | Very low | 43.4 | Very low | 168 Ų | 168 | 136 Ų | 136 | 86% | 0.862 | 79% | 0.788 | S | S | * | * | | | trans | -130.4 | 105.5 | 145.4 | -43.2 | 175.9 | 0 | 0 | 0 | 107.3 | | |
| 306 | S | 49.5 | Very low | 43.2 | Very low | 100 Ų | 100 | 136.1 Ų | 136.1 | 70% | 0.699 | 78% | 0.784 | S | S | * | * | | | trans | -71.2 | 124.2 | 169.1 | 169.4 | 0 | 0 | 0 | 0 | 108.9 | | |
| 307 | S | 35.1 | Very low | 43.5 | Very low | 104 Ų | 104 | 134.8 Ų | 134.8 | 73% | 0.727 | 78% | 0.781 | S | S | * | * | | | | 176.8 | 111.6 | 125.1 | 28.5 | 0 | 0 | 0 | 0 | 110.8 | | |
| 308 | S | 43.8 | Very low | 43 | Very low | 113 Ų | 113 | 135.7 Ų | 135.7 | 79% | 0.79 | 78% | 0.778 | S | S | * | * | | | trans | -74.6 | 154.8 | 151.1 | -54.3 | 0 | 0 | 0 | 0 | 108.7 | | |
| 309 | P | 49.8 | Very low | 43.1 | Very low | 125 Ų | 125 | 132.2 Ų | 132.2 | 81% | 0.812 | 78% | 0.775 | S | S | * | * | | | | -132.3 | 162.9 | 108.9 | 36.6 | -26.9 | 0 | 0 | 0 | 113.5 | | |
| 310 | T | 46.7 | Very low | 42.6 | Very low | 134 Ų | 134 | 135.7 Ų | 135.7 | 82% | 0.822 | 78% | 0.778 | S | S | * | * | | | trans | -74.2 | 143.6 | -167.2 | 55.4 | 0 | 0 | 0 | 0 | 114.1 | | |
| 311 | C | 35.6 | Very low | 43.1 | Very low | 123 Ų | 123 | 131.6 Ų | 131.6 | 83% | 0.831 | 77% | 0.765 | S | S | * | * | | | trans | -148.5 | 94.3 | 148.4 | -164.6 | 0 | 0 | 0 | 0 | 107.3 | | |
| 312 | S | 38.7 | Very low | 43.2 | Very low | 88 Ų | 88 | 130.1 Ų | 130.1 | 62% | 0.615 | 76% | 0.759 | S | S | * | * | | | | 55.9 | 110.3 | 107.1 | -163.5 | 0 | 0 | 0 | 0 | 114.2 | | |
| 313 | S | 47.7 | Very low | 43.7 | Very low | 100 Ų | 100 | 129.3 Ų | 129.3 | 70% | 0.699 | 76% | 0.759 | S | S | * | * | | | trans | -49.1 | 131.2 | 170.5 | -175 | 0 | 0 | 0 | 0 | 113 | | |
| 314 | F | 41.7 | Very low | 43.5 | Very low | 179 Ų | 179 | 132.1 Ų | 132.1 | 79% | 0.785 | 76% | 0.761 | S | S | * | * | | | trans | -137.2 | 90.6 | 149.7 | -69.9 | -75.5 | 0 | 0 | 0 | 108.7 | T316 | F314-T316 PolarHBondContact O-N 3.47Š|
| 315 | R | 46.9 | Very low | 43.5 | Very low | 231 Ų | 231 | 131.6 Ų | 131.6 | 87% | 0.872 | 75% | 0.753 | S | S | * | * | | | trans | -78.8 | 99.7 | 155.3 | -97.8 | -172.6 | 160.9 | -157.6 | -4.1 | 106.8 | V317 | R315-V317 PolarHBondContact O-N 3.45Å; R315-V317 VanDerWaalsContact O-N 3.17Å |
| 316 | T | 39.8 | Very low | 43.7 | Very low | 116 Ų | 116 | 131.6 Ų | 131.6 | 71% | 0.712 | 75% | 0.749 | S | S | * | * | | | trans | -74.2 | 102.2 | 171.9 | -44.4 | 0 | 0 | 0 | 0 | 108.5 | F314 F318 | F314-T316 PolarHBondContact O-N 3.47Å; T316-F318 HydrophobicContact CG2-CD2 4.33Å |
| 317 | V | 46.5 | Very low | 43.5 | Very low | 125 Ų | 125 | 132.2 Ų | 132.2 | 76% | 0.758 | 75% | 0.754 | S | S | * | * | | | trans | -90.9 | 112.8 | 164.3 | 179.1 | 0 | 0 | 0 | 0 | 106.2 | R315 S319 | R315-V317 PolarHBondContact O-N 3.45Å; R315-V317 VanDerWaalsContact O-N 3.17Å; V317-S319 PolarHBondContact O-N 3.48Å |
| 318 | F | 40.9 | Very low | 43.7 | Very low | 187 Ų | 187 | 134.3 Ų | 134.3 | 82% | 0.82 | 75% | 0.754 | S | S | * | * | | | trans | -72.4 | 112 | 168.2 | -111.6 | -94.2 | 0 | 0 | 0 | 107.9 | T316 | T316-F318 HydrophobicContact CG2-CD2 4.33Š|
| 319 | S | 47.5 | Very low | 43.8 | Very low | 111 Ų | 111 | 133 Ų | 133 | 78% | 0.776 | 75% | 0.749 | S | S | * | * | | | trans | -103.8 | 120.7 | 165.8 | -175.2 | 0 | 0 | 0 | 0 | 107.1 | V317 | V317-S319 PolarHBondContact O-N 3.48Š|
| 320 | F | 35.3 | Very low | 43.4 | Very low | 166 Ų | 166 | 135.5 Ų | 135.5 | 73% | 0.728 | 75% | 0.75 | S | S | * | * | | | trans | -90 | 117.7 | 176.1 | -153.4 | -93.7 | 0 | 0 | 0 | 107.8 | C322 | F320-C322 PolarHBondContact O-N 3.2Š|
| 321 | S | 47.3 | Very low | 43.1 | Very low | 101 Ų | 101 | 136.5 Ų | 136.5 | 71% | 0.706 | 75% | 0.751 | S | S | * | * | | | trans | -83.2 | 103.3 | 170.2 | 65 | 0 | 0 | 0 | 0 | 109 | S323 | S321-S323 VanDerWaalsContact C-N 3.34Å; S321-S323 PolarHBondContact O-N 3.34Å |
| 322 | C | 45.7 | Very low | 43.2 | Very low | 89 Ų | 89 | 137 Ų | 137 | 60% | 0.601 | 75% | 0.754 | S | S | * | * | | | trans | -73.1 | 88.1 | 165.7 | -70.6 | 0 | 0 | 0 | 0 | 109.2 | F320 | F320-C322 PolarHBondContact O-N 3.2Š|
| 323 | S | 47.6 | Very low | 43.2 | Very low | 112 Ų | 112 | 142.6 Ų | 142.6 | 78% | 0.783 | 77% | 0.77 | S | S | * | * | | | trans | -142.3 | 12.3 | 167 | -58.5 | 0 | 0 | 0 | 0 | 113.7 | S321 | S321-S323 VanDerWaalsContact C-N 3.34Å; S321-S323 PolarHBondContact O-N 3.34Å |
| 324 | E | 44.7 | Very low | 42.8 | Very low | 181 Ų | 181 | 140.9 Ų | 140.9 | 85% | 0.846 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -119.9 | 6.2 | -178.2 | -157.7 | 161.4 | -177.4 | 0 | 0 | 113.8 | | |
| 325 | I | 46.2 | Very low | 42.5 | Very low | 111 Ų | 111 | 141 Ų | 141 | 57% | 0.569 | 78% | 0.777 | S | S | * | * | S | Bend | trans | -102.3 | -6.7 | -178.6 | 7.9 | 171.3 | 0 | 0 | 0 | 114.3 | M328 | I325-M328 HydrophobicContact CG2-CE 4Š|
| 326 | E | 41.8 | Very low | 42.1 | Very low | 167 Ų | 167 | 140.3 Ų | 140.3 | 78% | 0.78 | 78% | 0.78 | S | S | * | * | S | Bend | trans | -98.4 | -17.1 | -176.9 | -163.2 | 138.4 | -141 | 0 | 0 | 113.5 | M328 | E326-M328 VanDerWaalsContact C-N 3.3Å; E326-M328 PolarHBondContact O-N 2.74Å |
| 327 | S | 43.5 | Very low | 41.7 | Very low | 113 Ų | 113 | 138.4 Ų | 138.4 | 79% | 0.79 | 78% | 0.784 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.2 | 1.2 | -176.7 | -170.1 | 0 | 0 | 0 | 0 | 115.2 | | |
| 328 | M | 41 | Very low | 41.1 | Very low | 149 Ų | 149 | 137.9 Ų | 137.9 | 73% | 0.734 | 79% | 0.785 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.9 | 6.7 | 179 | 67.1 | -178.7 | 176 | 0 | 0 | 114.1 | I325 E326 | I325-M328 HydrophobicContact CG2-CE 4Å; E326-M328 VanDerWaalsContact C-N 3.3Å; E326-M328 PolarHBondContact O-N 2.74Å |
| 329 | A | 44.3 | Very low | 40.8 | Very low | 84 Ų | 84 | 137.1 Ų | 137.1 | 69% | 0.694 | 78% | 0.784 | S | S | * | * | S | Bend | trans | -99.9 | -5.9 | -178.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | | |
| 330 | E | 42.9 | Very low | 40.1 | Very low | 178 Ų | 178 | 136.1 Ų | 136.1 | 83% | 0.832 | 78% | 0.782 | S | S | * | * | S | Bend | trans | -100.1 | 10.7 | -173.6 | -82 | 179.5 | 140 | 0 | 0 | 115.5 | | |
| 331 | D | 39 | Very low | 39.9 | Very low | 155 Ų | 155 | 131.4 Ų | 131.4 | 83% | 0.829 | 78% | 0.78 | S | S | * | * | S | Bend | trans | -127 | 59 | -175.3 | -142.2 | 19.8 | 0 | 0 | 0 | 112.1 | | |
| 332 | C | 38 | Very low | 39.4 | Very low | 133 Ų | 133 | 131.9 Ų | 131.9 | 90% | 0.899 | 78% | 0.784 | S | S | * | * | | | trans | -164.4 | 50 | 162.7 | -98.2 | 0 | 0 | 0 | 0 | 112.3 | | |
| 333 | E | 39.4 | Very low | 39.3 | Very low | 206 Ų | 206 | 136.7 Ų | 136.7 | 96% | 0.963 | 80% | 0.798 | S | S | * | * | | | trans | -95.3 | 104 | 162.1 | -91.6 | -106 | 137.7 | 0 | 0 | 109 | | |
| 334 | G | 39.4 | Very low | 38.8 | Very low | 64 Ų | 64 | 139.1 Ų | 139.1 | 66% | 0.66 | 80% | 0.801 | S | S | * | * | | | trans | 147.3 | 96.7 | 165.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | | |
| 335 | L | 35.3 | Very low | 39 | Very low | 183 Ų | 183 | 139.2 Ų | 139.2 | 96% | 0.958 | 80% | 0.804 | S | S | * | * | | | | -177.6 | 118.8 | 120.8 | -90.7 | 164.5 | 0 | 0 | 0 | 110.6 | | |
| 336 | K | 37.5 | Very low | 39 | Very low | 215 Ų | 215 | 142.2 Ų | 142.2 | 94% | 0.935 | 81% | 0.813 | S | S | * | * | | | trans | -71.9 | 131.7 | 174.8 | 176 | 171.8 | 178.4 | 173.7 | 0 | 110.5 | | |
| 337 | G | 31.2 | Very low | 39 | Very low | 77 Ų | 77 | 141.2 Ų | 141.2 | 79% | 0.794 | 81% | 0.813 | S | S | * | * | | | trans | -177 | 113.1 | 172.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | | |
| 338 | S | 35 | Very low | 38.8 | Very low | 114 Ų | 114 | 141.7 Ų | 141.7 | 80% | 0.797 | 82% | 0.816 | S | S | * | * | | | trans | -61.5 | 160.7 | -177.5 | -161.5 | 0 | 0 | 0 | 0 | 115.9 | | |
| 339 | H | 34.4 | Very low | 39.1 | Very low | 171 Ų | 171 | 143.2 Ų | 143.2 | 79% | 0.792 | 83% | 0.826 | S | S | * | * | | | trans | 122.1 | 108.3 | 133.6 | -126 | -89.6 | 0 | 0 | 0 | 118.3 | | |
| 340 | A | 32.5 | Very low | 39 | Very low | 89 Ų | 89 | 146.1 Ų | 146.1 | 74% | 0.736 | 83% | 0.83 | S | S | * | * | | | trans | 54.4 | 135.4 | 134.1 | 0 | 0 | 0 | 0 | 0 | 123.1 | | |
| 341 | G | 31.9 | Very low | 38.7 | Very low | 67 Ų | 67 | 143.5 Ų | 143.5 | 69% | 0.691 | 83% | 0.831 | S | S | * | * | | | | 121.1 | 102.3 | 128.9 | 0 | 0 | 0 | 0 | 0 | 117.6 | | |
| 342 | S | 37 | Very low | 39.3 | Very low | 112 Ų | 112 | 141.2 Ų | 141.2 | 78% | 0.783 | 83% | 0.825 | S | S | * | * | | | trans | 50.1 | 125.6 | 134.4 | 58.6 | 0 | 0 | 0 | 0 | 122.1 | | |
| 343 | E | 43 | Very low | 39.7 | Very low | 190 Ų | 190 | 140.9 Ų | 140.9 | 89% | 0.888 | 82% | 0.819 | S | S | * | * | | | trans | 33 | 116.4 | 137.4 | -74.7 | -168.8 | 126.2 | 0 | 0 | 119.3 | | |
| 344 | L | 37.5 | Very low | 39.9 | Very low | 162 Ų | 162 | 139.5 Ų | 139.5 | 85% | 0.848 | 82% | 0.817 | S | S | * | * | | | | -162.3 | 107.3 | 126.4 | -163.7 | 63.9 | 0 | 0 | 0 | 110.4 | K346 | L344-K346 PolarHBondContact O-N 3.37Š|
| 345 | M | 47.6 | Very low | 40.1 | Very low | 184 Ų | 184 | 144.8 Ų | 144.8 | 91% | 0.906 | 83% | 0.829 | S | S | * | * | | | trans | -73.6 | 118.3 | 162.6 | -62.9 | -152.9 | -76.5 | 0 | 0 | 108.7 | | |
| 346 | K | 47.6 | Very low | 40.7 | Very low | 174 Ų | 174 | 140.8 Ų | 140.8 | 76% | 0.757 | 82% | 0.823 | S | S | * | * | | | trans | -171.6 | 147.1 | 152.7 | -112.3 | 155.9 | -178.8 | 176.9 | 0 | 112.7 | L344 | L344-K346 PolarHBondContact O-N 3.37Š|
| 347 | D | 41.7 | Very low | 40.9 | Very low | 146 Ų | 146 | 142.4 Ų | 142.4 | 78% | 0.781 | 84% | 0.84 | S | S | * | * | | | trans | 92.1 | 79.1 | 158.6 | -50.8 | -24.5 | 0 | 0 | 0 | 117.3 | | |
| 348 | S | 38.6 | Very low | 41.3 | Very low | 123 Ų | 123 | 145.7 Ų | 145.7 | 86% | 0.86 | 84% | 0.842 | S | S | * | * | | | trans | -145 | 65.9 | 151.3 | -67.9 | 0 | 0 | 0 | 0 | 110.1 | | |
| 349 | L | 46.9 | Very low | 41.7 | Very low | 180 Ų | 180 | 147.3 Ų | 147.3 | 94% | 0.942 | 85% | 0.845 | S | S | * | * | | | trans | -123.9 | 87.9 | 158.7 | -70.5 | -180 | 0 | 0 | 0 | 107.9 | | |
| 350 | N | 43.2 | Very low | 42.1 | Very low | 146 Ų | 146 | 146 Ų | 146 | 78% | 0.781 | 85% | 0.848 | S | S | * | * | | | trans | -137.8 | 82.2 | 163.2 | -165.5 | 18 | 0 | 0 | 0 | 109.6 | | |
| 351 | S | 36.4 | Very low | 42.7 | Very low | 122 Ų | 122 | 149.4 Ų | 149.4 | 85% | 0.853 | 85% | 0.854 | S | S | * | * | | | trans | -115.5 | 110.5 | 164.4 | -72.9 | 0 | 0 | 0 | 0 | 108 | T353 | S351-T353 PolarHBondContact O-N 3.2Š|
| 352 | P | 51.4 | Low | 43.3 | Very low | 107 Ų | 107 | 154.5 Ų | 154.5 | 70% | 0.695 | 87% | 0.865 | S | S | * | * | | | trans | -101 | 67.8 | -178 | 37.2 | -30.4 | 0 | 0 | 0 | 110.5 | | |
| 353 | T | 45.4 | Very low | 43.7 | Very low | 127 Ų | 127 | 157.3 Ų | 157.3 | 78% | 0.779 | 87% | 0.87 | S | S | * | * | | | trans | -159 | 76.4 | 168.1 | -39.8 | 0 | 0 | 0 | 0 | 112.9 | S351 | S351-T353 PolarHBondContact O-N 3.2Š|
| 354 | L | 44.7 | Very low | 43.8 | Very low | 177 Ų | 177 | 155 Ų | 155 | 93% | 0.927 | 87% | 0.869 | S | S | * | * | | | trans | -152.8 | 86.3 | 152 | -78.1 | -170.4 | 0 | 0 | 0 | 109.7 | | |
| 355 | L | 44.2 | Very low | 44.3 | Very low | 174 Ų | 174 | 154.5 Ų | 154.5 | 91% | 0.911 | 87% | 0.87 | S | S | * | * | | | trans | -152.3 | 92.2 | 160.7 | -109.4 | 169.8 | 0 | 0 | 0 | 108 | | |
| 356 | A | 46.4 | Very low | 44 | Very low | 99 Ų | 99 | 152 Ų | 152 | 82% | 0.818 | 87% | 0.867 | S | S | * | * | | | trans | -166.2 | 114.7 | 146.8 | 0 | 0 | 0 | 0 | 0 | 108.9 | | |
| 357 | L | 41.6 | Very low | 43.7 | Very low | 249 Ų | 249 | 150 Ų | 150 | 100% | 1.304 | 88% | 0.877 | S | S | * | * | | | trans | -48.1 | 0 | 159.3 | -73 | 154.6 | 0 | 0 | 0 | 112.8 | | |