| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 38.3 | Very low | 49.2 | Very low | 231 Ų | 231 | 182 Ų | 182 | 100% | 1.138 | 86% | 0.856 | S | S | * | * | 0 | 114.8 | 0 | -78 | -177 | -120.5 | 0 | 0 | 106.2 | |||||
| 2 | E | 47 | Very low | 48.1 | Very low | 153 Ų | 153 | 186.3 Ų | 186.3 | 72% | 0.715 | 86% | 0.859 | S | S | * | * | cis | -152.7 | 140.1 | 7.3 | -56.9 | -170.1 | 156.3 | 0 | 0 | 108.4 | ||||
| 3 | D | 43.9 | Very low | 47.2 | Very low | 145 Ų | 145 | 181.4 Ų | 181.4 | 78% | 0.775 | 86% | 0.858 | S | S | * | * | trans | -69.7 | 141.3 | 164.8 | -61.5 | -81.8 | 0 | 0 | 0 | 111.1 | ||||
| 4 | R | 57.6 | Low | 46.7 | Very low | 229 Ų | 229 | 175.9 Ų | 175.9 | 86% | 0.864 | 86% | 0.858 | S | S | * | * | trans | -140.2 | 105.5 | 151.3 | -73.1 | -165.7 | 179.7 | -174.1 | 0.8 | 112.6 | ||||
| 5 | K | 49.9 | Very low | 46.2 | Very low | 190 Ų | 190 | 173.9 Ų | 173.9 | 83% | 0.826 | 85% | 0.851 | S | S | * | * | trans | -70.6 | 142.3 | 164.1 | -50.2 | -158.1 | 178 | -151 | 0 | 109.8 | ||||
| 6 | L | 64.1 | Low | 46.2 | Very low | 178 Ų | 178 | 172.2 Ų | 172.2 | 93% | 0.932 | 85% | 0.847 | S | S | * | * | trans | -129.7 | 142.3 | 159.2 | -74.4 | 175.4 | 0 | 0 | 0 | 111.3 | ||||
| 7 | K | 52.9 | Low | 46.5 | Very low | 201 Ų | 201 | 169.2 Ų | 169.2 | 87% | 0.874 | 84% | 0.844 | S | S | * | * | trans | -86.1 | 149.9 | -154.7 | -74 | 172.8 | 162.1 | 177 | 0 | 113 | ||||
| 8 | R | 53.9 | Low | 45.6 | Very low | 247 Ų | 247 | 164.2 Ų | 164.2 | 93% | 0.932 | 84% | 0.841 | S | S | * | * | trans | -20.3 | 134.7 | 146.8 | -71.4 | 171.9 | 158.8 | -178.4 | -6.4 | 114.5 | ||||
| 9 | K | 53.3 | Low | 45 | Very low | 197 Ų | 197 | 160.3 Ų | 160.3 | 86% | 0.857 | 84% | 0.836 | S | S | * | * | trans | -138.2 | 110.4 | 144.5 | -164.1 | 140 | 174.9 | -179.9 | 0 | 110.1 | ||||
| 10 | S | 36.5 | Very low | 44.8 | Very low | 104 Ų | 104 | 161.3 Ų | 161.3 | 73% | 0.727 | 84% | 0.837 | S | S | * | * | trans | -83.5 | 135.7 | 166.8 | 173.3 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 11 | T | 43.6 | Very low | 44.4 | Very low | 127 Ų | 127 | 159.9 Ų | 159.9 | 78% | 0.779 | 84% | 0.835 | S | S | * | * | trans | -132.6 | 100.5 | 156.9 | 38.8 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 12 | R | 35.8 | Very low | 44.1 | Very low | 234 Ų | 234 | 153 Ų | 153 | 88% | 0.883 | 82% | 0.824 | S | S | * | * | trans | -82.5 | 124 | 163.4 | -172.8 | -177.7 | -173.7 | -171.2 | 2.4 | 106.6 | ||||
| 13 | S | 37.1 | Very low | 43.4 | Very low | 122 Ų | 122 | 149.4 Ų | 149.4 | 85% | 0.853 | 83% | 0.828 | S | S | * | * | trans | -124.6 | 148.4 | 164 | -80.7 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 14 | A | 40.1 | Very low | 43.3 | Very low | 104 Ų | 104 | 151.2 Ų | 151.2 | 86% | 0.86 | 84% | 0.836 | S | S | * | * | trans | -88.4 | 166.5 | -149.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 15 | I | 38.8 | Very low | 42.4 | Very low | 147 Ų | 147 | 145.8 Ų | 145.8 | 75% | 0.754 | 83% | 0.834 | S | S | * | * | trans | -74.2 | 137.5 | 176.2 | -66.8 | 156.7 | 0 | 0 | 0 | 111 | ||||
| 16 | N | 46 | Very low | 42 | Very low | 146 Ų | 146 | 148.5 Ų | 148.5 | 78% | 0.781 | 84% | 0.839 | S | S | * | * | 163.3 | 165.8 | 117.5 | -107.4 | -12.8 | 0 | 0 | 0 | 114.4 | |||||
| 17 | P | 50.9 | Low | 41 | Very low | 122 Ų | 122 | 149.7 Ų | 149.7 | 79% | 0.792 | 84% | 0.836 | S | S | * | * | trans | -110.7 | 169.2 | -134.9 | 40.8 | -28.1 | 0 | 0 | 0 | 114.1 | ||||
| 18 | G | 31.8 | Very low | 40 | Very low | 78 Ų | 78 | 148 Ų | 148 | 80% | 0.804 | 84% | 0.837 | S | S | * | * | trans | -162.8 | 114.7 | 170.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 19 | A | 34 | Very low | 39.3 | Very low | 90 Ų | 90 | 141.8 Ų | 141.8 | 74% | 0.744 | 83% | 0.831 | S | S | * | * | trans | -75.4 | 148.7 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 20 | Q | 39.9 | Very low | 38.5 | Very low | 181 Ų | 181 | 137.4 Ų | 137.4 | 85% | 0.846 | 83% | 0.826 | S | S | * | * | trans | 169.2 | 107 | 144.5 | -93.2 | 164.2 | 96.7 | 0 | 0 | 108.6 | ||||
| 21 | T | 36 | Very low | 38.6 | Very low | 132 Ų | 132 | 137.6 Ų | 137.6 | 81% | 0.81 | 83% | 0.827 | S | S | * | * | 58.7 | 115.8 | 91.2 | 65.1 | 0 | 0 | 0 | 0 | 115.9 | |||||
| 22 | G | 31.8 | Very low | 38.5 | Very low | 87 Ų | 87 | 136.7 Ų | 136.7 | 90% | 0.897 | 83% | 0.826 | S | S | * | * | trans | 101.9 | 120.5 | 142.4 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 23 | G | 33.1 | Very low | 38.7 | Very low | 77 Ų | 77 | 137.5 Ų | 137.5 | 79% | 0.794 | 83% | 0.829 | S | S | * | * | trans | 144.2 | 76.4 | 156.1 | 0 | 0 | 0 | 0 | 0 | 116.2 | S25 | G23-S25 PolarHBondContact O-N 3.35Š| ||
| 24 | L | 42.3 | Very low | 38.6 | Very low | 183 Ų | 183 | 135.1 Ų | 135.1 | 96% | 0.958 | 82% | 0.823 | S | S | * | * | trans | -63.2 | 116.8 | 161.8 | -70.6 | 162.5 | 0 | 0 | 0 | 109.3 | ||||
| 25 | S | 38.7 | Very low | 38.9 | Very low | 115 Ų | 115 | 142.3 Ų | 142.3 | 80% | 0.804 | 83% | 0.828 | S | S | * | * | trans | -119.4 | 108.7 | 168 | -106.2 | 0 | 0 | 0 | 0 | 110.9 | G23 | G23-S25 PolarHBondContact O-N 3.35Š| ||
| 26 | R | 41.3 | Very low | 39 | Very low | 247 Ų | 247 | 142.8 Ų | 142.8 | 93% | 0.932 | 83% | 0.832 | S | S | * | * | trans | -59.8 | 128.7 | 169.6 | -66.5 | 171.5 | 174.3 | 174.9 | -2.8 | 109.4 | ||||
| 27 | K | 42.9 | Very low | 38.8 | Very low | 202 Ų | 202 | 141.7 Ų | 141.7 | 88% | 0.878 | 83% | 0.831 | S | S | * | * | trans | -115.2 | 111.5 | 161.3 | -72 | -172.7 | 178.2 | 179.6 | 0 | 108.7 | ||||
| 28 | N | 32.4 | Very low | 38 | Very low | 165 Ų | 165 | 138.8 Ų | 138.8 | 88% | 0.882 | 82% | 0.822 | S | S | * | * | trans | -90.2 | 121.6 | 171.3 | -152.2 | 32.6 | 0 | 0 | 0 | 106.9 | ||||
| 29 | S | 39.8 | Very low | 38.4 | Very low | 117 Ų | 117 | 144.8 Ų | 144.8 | 82% | 0.818 | 82% | 0.822 | S | S | * | * | trans | -124.8 | 104.8 | 169.1 | 56.6 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 30 | S | 36.5 | Very low | 38.5 | Very low | 106 Ų | 106 | 148.2 Ų | 148.2 | 74% | 0.741 | 83% | 0.828 | S | S | * | * | trans | -86.8 | 123.9 | 168.9 | 51.9 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 31 | S | 38.3 | Very low | 38.7 | Very low | 107 Ų | 107 | 147.8 Ų | 147.8 | 75% | 0.748 | 83% | 0.826 | S | S | * | * | 172.5 | 102.3 | 129.3 | 59.5 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 32 | S | 39.8 | Very low | 38.9 | Very low | 109 Ų | 109 | 148.6 Ų | 148.6 | 76% | 0.762 | 83% | 0.825 | S | S | * | * | 30.4 | 120.1 | 128.3 | 40.2 | 0 | 0 | 0 | 0 | 121.5 | |||||
| 33 | R | 41.2 | Very low | 39.5 | Very low | 251 Ų | 251 | 151 Ų | 151 | 95% | 0.947 | 82% | 0.823 | S | S | * | * | trans | 160.8 | 112.4 | 132.7 | -87.1 | 158.8 | 177.4 | -178.5 | 0.6 | 106.5 | ||||
| 34 | G | 35.1 | Very low | 39.5 | Very low | 71 Ų | 71 | 150.7 Ų | 150.7 | 73% | 0.732 | 82% | 0.819 | S | S | * | * | cis | 103.7 | 89.9 | 31 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 35 | R | 46.8 | Very low | 39.4 | Very low | 255 Ų | 255 | 147.5 Ų | 147.5 | 96% | 0.962 | 81% | 0.812 | S | S | * | * | trans | -174.7 | 105 | 150 | -99.4 | 167.1 | -155.5 | -153.8 | 5.9 | 109.3 | ||||
| 36 | N | 39.3 | Very low | 39.7 | Very low | 157 Ų | 157 | 150.1 Ų | 150.1 | 84% | 0.84 | 82% | 0.815 | S | S | * | * | trans | -100.3 | 125 | 175 | -171 | 17 | 0 | 0 | 0 | 107.5 | ||||
| 37 | V | 42.1 | Very low | 39.4 | Very low | 124 Ų | 124 | 143.5 Ų | 143.5 | 75% | 0.752 | 81% | 0.807 | S | S | * | * | trans | -115.3 | 102.1 | 167.3 | 175.2 | 0 | 0 | 0 | 0 | 105.7 | Y39 | V37-Y39 HydrophobicContact CG1-CD2 4.34Å; V37-Y39 HydrophobicContact CG1-CE2 4.13Å | ||
| 38 | G | 34.6 | Very low | 39.4 | Very low | 60 Ų | 60 | 139.4 Ų | 139.4 | 62% | 0.619 | 80% | 0.804 | S | S | * | * | trans | -86.6 | 126.3 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 39 | Y | 40.7 | Very low | 40.2 | Very low | 205 Ų | 205 | 141 Ų | 141 | 80% | 0.804 | 81% | 0.806 | S | S | * | * | trans | -116.8 | 98 | 155.8 | -81.6 | -82.4 | 0 | 0 | 0 | 107.5 | V37 | V37-Y39 HydrophobicContact CG1-CD2 4.34Å; V37-Y39 HydrophobicContact CG1-CE2 4.13Å | ||
| 40 | N | 36 | Very low | 40.3 | Very low | 161 Ų | 161 | 147.4 Ų | 147.4 | 86% | 0.861 | 81% | 0.812 | S | S | * | * | trans | -97.6 | 107.3 | 179.7 | -143.7 | 58.6 | 0 | 0 | 0 | 107.8 | ||||
| 41 | H | 44.5 | Very low | 40.4 | Very low | 172 Ų | 172 | 149.8 Ų | 149.8 | 80% | 0.796 | 82% | 0.816 | S | S | * | * | trans | -99.1 | 121.1 | 166.6 | -84.5 | 79.8 | 0 | 0 | 0 | 109.5 | ||||
| 42 | N | 39.4 | Very low | 40.7 | Very low | 150 Ų | 150 | 155.9 Ų | 155.9 | 80% | 0.802 | 82% | 0.823 | S | S | * | * | trans | -82.3 | 112.7 | -175.9 | -179.2 | 57.9 | 0 | 0 | 0 | 109.9 | ||||
| 43 | T | 43.5 | Very low | 40.8 | Very low | 138 Ų | 138 | 158.6 Ų | 158.6 | 85% | 0.847 | 83% | 0.829 | S | S | * | * | trans | -108.4 | 121.8 | 161.3 | 50.3 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 44 | G | 35 | Very low | 41.1 | Very low | 69 Ų | 69 | 158.3 Ų | 158.3 | 71% | 0.711 | 83% | 0.828 | S | S | * | * | trans | -67.1 | 132.7 | -162.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 45 | S | 40 | Very low | 41.4 | Very low | 116 Ų | 116 | 167.1 Ų | 167.1 | 81% | 0.811 | 84% | 0.839 | S | S | * | * | trans | -85.3 | 118.8 | 155.3 | 63.1 | 0 | 0 | 0 | 0 | 109.4 | S47 | S45-S47 PolarHBondContact O-N 3.04Š| ||
| 46 | I | 44.2 | Very low | 40.8 | Very low | 171 Ų | 171 | 158.8 Ų | 158.8 | 88% | 0.877 | 83% | 0.832 | S | S | * | * | trans | -73 | 115.1 | 170.2 | -64.8 | 167 | 0 | 0 | 0 | 108.1 | ||||
| 47 | S | 35.9 | Very low | 40.8 | Very low | 107 Ų | 107 | 156.2 Ų | 156.2 | 75% | 0.748 | 83% | 0.833 | S | S | * | * | trans | -83.5 | 133.3 | 170.4 | 71.1 | 0 | 0 | 0 | 0 | 110.6 | S45 | S45-S47 PolarHBondContact O-N 3.04Š| ||
| 48 | S | 42.9 | Very low | 40.9 | Very low | 117 Ų | 117 | 161 Ų | 161 | 82% | 0.818 | 84% | 0.837 | S | S | * | * | trans | -152.5 | 91.3 | 153.4 | -132.4 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 49 | Q | 49.2 | Very low | 41.1 | Very low | 198 Ų | 198 | 164.7 Ų | 164.7 | 93% | 0.925 | 84% | 0.843 | S | S | * | * | trans | -163.4 | 103 | 145.8 | -108 | 174.2 | -4.9 | 0 | 0 | 109.3 | ||||
| 50 | R | 42 | Very low | 40.7 | Very low | 252 Ų | 252 | 160.2 Ų | 160.2 | 95% | 0.951 | 84% | 0.842 | S | S | * | * | trans | -76.8 | 123.8 | 168.2 | -89.2 | 173.8 | 165.4 | 159 | -4.6 | 108.4 | ||||
| 51 | N | 37.3 | Very low | 41 | Very low | 155 Ų | 155 | 162.7 Ų | 162.7 | 83% | 0.829 | 85% | 0.845 | S | S | * | * | trans | -149.5 | 104 | 138.2 | -152.7 | -11.2 | 0 | 0 | 0 | 109.6 | ||||
| 52 | R | 46.1 | Very low | 40.7 | Very low | 235 Ų | 235 | 159 Ų | 159 | 89% | 0.887 | 84% | 0.843 | S | S | * | * | trans | -101.4 | 119.4 | 172.4 | -78.6 | -178.6 | 178.1 | 172 | -0.8 | 106.8 | ||||
| 53 | N | 40 | Very low | 40.6 | Very low | 166 Ų | 166 | 163.6 Ų | 163.6 | 89% | 0.888 | 85% | 0.85 | S | S | * | * | trans | -133.1 | 110.2 | 149.7 | -95.6 | 7.5 | 0 | 0 | 0 | 109.1 | ||||
| 54 | R | 47.4 | Very low | 40.6 | Very low | 245 Ų | 245 | 167.5 Ų | 167.5 | 93% | 0.925 | 85% | 0.85 | S | S | * | * | trans | -130.7 | 104.5 | 166.7 | -117.5 | -165.8 | -176 | -172 | 2.6 | 107.6 | ||||
| 55 | R | 41.8 | Very low | 41.2 | Very low | 257 Ų | 257 | 170.2 Ų | 170.2 | 97% | 0.97 | 86% | 0.856 | S | S | * | * | trans | -161.6 | 139.2 | 158.7 | -71.7 | -171.2 | -178 | 173.6 | 0.1 | 104.1 | ||||
| 56 | G | 34.5 | Very low | 41.2 | Very low | 79 Ų | 79 | 173.2 Ų | 173.2 | 81% | 0.814 | 86% | 0.857 | S | S | * | * | cis | 171.6 | 169.3 | 14.2 | 0 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 57 | A | 39.7 | Very low | 41.1 | Very low | 103 Ų | 103 | 170 Ų | 170 | 85% | 0.851 | 86% | 0.856 | S | S | * | * | trans | -69.3 | 157.9 | -167.8 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 58 | R | 44.4 | Very low | 41.5 | Very low | 226 Ų | 226 | 171.2 Ų | 171.2 | 85% | 0.853 | 86% | 0.858 | S | S | * | * | trans | 7.3 | 122.1 | 150.7 | -103.4 | 177.6 | 178.8 | 165.7 | -1.7 | 118.9 | ||||
| 59 | D | 37.9 | Very low | 41.2 | Very low | 137 Ų | 137 | 169.1 Ų | 169.1 | 73% | 0.733 | 86% | 0.855 | S | S | * | * | 155.2 | 154.6 | 100.8 | -93.6 | -43.6 | 0 | 0 | 0 | 111.9 | |||||
| 60 | S | 33.8 | Very low | 40.8 | Very low | 111 Ų | 111 | 163.6 Ų | 163.6 | 78% | 0.776 | 85% | 0.851 | S | S | * | * | trans | 102.9 | 96.7 | 156.6 | -35 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 61 | K | 41.6 | Very low | 40.6 | Very low | 213 Ų | 213 | 159.1 Ų | 159.1 | 93% | 0.926 | 85% | 0.846 | S | S | * | * | trans | 41.6 | 104.4 | 135.1 | -89.7 | 171.1 | 172.5 | 159.7 | 0 | 119.2 | ||||
| 62 | A | 37.2 | Very low | 41.3 | Very low | 93 Ų | 93 | 160.3 Ų | 160.3 | 77% | 0.769 | 84% | 0.844 | S | S | * | * | trans | -113.8 | 120.7 | 144.4 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 63 | R | 39.2 | Very low | 41.6 | Very low | 248 Ų | 248 | 156.2 Ų | 156.2 | 94% | 0.936 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 127.6 | 179.8 | -82 | 168.5 | 165.1 | 159.4 | -5.6 | 110.8 | ||
| 64 | Y | 43.2 | Very low | 41.8 | Very low | 220 Ų | 220 | 157.3 Ų | 157.3 | 86% | 0.863 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -87.6 | 144.2 | 157.7 | -75.5 | -91.8 | 0 | 0 | 0 | 109.4 | Q66 | Y64-Q66 PolarHBondContact O-N 2.74Š|
| 65 | P | 46.9 | Very low | 41.9 | Very low | 126 Ų | 126 | 149.8 Ų | 149.8 | 82% | 0.818 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -72 | 129 | 175.5 | 29.1 | -30.6 | 0 | 0 | 0 | 109.9 | A67 | P65-A67 PolarHBondContact O-N 3.47Š|
| 66 | Q | 41 | Very low | 42.4 | Very low | 179 Ų | 179 | 146.1 Ų | 146.1 | 84% | 0.836 | 83% | 0.832 | S | S | * | * | trans | -76.8 | 111.8 | 177.1 | -172.7 | 172.3 | -13.1 | 0 | 0 | 109.1 | Y64 V68 | Y64-Q66 PolarHBondContact O-N 2.74Å; Q66-V68 HydrophobicContact CG-CG2 4.23Å | ||
| 67 | A | 41 | Very low | 43.4 | Very low | 103 Ų | 103 | 147 Ų | 147 | 85% | 0.851 | 83% | 0.831 | S | S | * | * | trans | -95 | 106 | 164.5 | 0 | 0 | 0 | 0 | 0 | 108.5 | P65 | P65-A67 PolarHBondContact O-N 3.47Š| ||
| 68 | V | 45.3 | Very low | 44.4 | Very low | 133 Ų | 133 | 146 Ų | 146 | 81% | 0.806 | 82% | 0.823 | S | S | * | * | trans | -81.9 | 134.1 | 165.2 | 172.5 | 0 | 0 | 0 | 0 | 107.7 | Q66 | Q66-V68 HydrophobicContact CG-CG2 4.23Š| ||
| 69 | G | 35.7 | Very low | 45.3 | Very low | 73 Ų | 73 | 141 Ų | 141 | 75% | 0.753 | 82% | 0.82 | S | S | * | * | trans | 142.3 | 102.2 | 166.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 70 | G | 41.4 | Very low | 46.3 | Very low | 82 Ų | 82 | 139.9 Ų | 139.9 | 85% | 0.845 | 82% | 0.818 | S | S | * | * | trans | -71.5 | 162 | -171.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 71 | N | 37.2 | Very low | 47.7 | Very low | 158 Ų | 158 | 141.6 Ų | 141.6 | 85% | 0.845 | 82% | 0.816 | S | S | * | * | trans | -156.8 | 149.6 | 135.9 | -152.2 | -3.1 | 0 | 0 | 0 | 109.3 | ||||
| 72 | K | 53 | Low | 48.7 | Very low | 179 Ų | 179 | 138.9 Ų | 138.9 | 78% | 0.778 | 81% | 0.807 | S | S | * | * | trans | -65.7 | 154.9 | -179.1 | -61 | 167.4 | -177.6 | 176.2 | 0 | 110 | ||||
| 73 | N | 51.7 | Low | 49.9 | Very low | 149 Ų | 149 | 143.2 Ų | 143.2 | 80% | 0.797 | 81% | 0.811 | S | S | * | * | trans | 89.3 | 97.6 | 172 | -51.4 | -21 | 0 | 0 | 0 | 115.9 | ||||
| 74 | Q | 44.7 | Very low | 50.9 | Low | 190 Ų | 190 | 134.9 Ų | 134.9 | 89% | 0.888 | 79% | 0.791 | S | S | * | * | trans | -175.2 | 84.1 | 140.6 | -103.1 | 160.2 | 88 | 0 | 0 | 109.9 | ||||
| 75 | G | 49.4 | Very low | 51.7 | Low | 86 Ų | 86 | 133.8 Ų | 133.8 | 89% | 0.887 | 79% | 0.791 | S | S | * | * | trans | -96.9 | 75.3 | 156.9 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 76 | Q | 51.7 | Low | 52.6 | Low | 181 Ų | 181 | 132.1 Ų | 132.1 | 85% | 0.846 | 78% | 0.775 | S | S | * | * | trans | -113.7 | 91.6 | 164.2 | -75.2 | -171.8 | 17.3 | 0 | 0 | 107.1 | A78 | Q76-A78 PolarHBondContact O-N 3.28Š| ||
| 77 | A | 56.5 | Low | 53.8 | Low | 96 Ų | 96 | 129.2 Ų | 129.2 | 79% | 0.793 | 77% | 0.769 | S | S | * | * | trans | -56 | 133.9 | 162 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 78 | A | 60.6 | Low | 55.8 | Low | 82 Ų | 82 | 128 Ų | 128 | 68% | 0.678 | 75% | 0.749 | S | S | * | * | trans | -50 | 138.7 | 172.4 | 0 | 0 | 0 | 0 | 0 | 109.7 | Q76 V80 | Q76-A78 PolarHBondContact O-N 3.28Å; A78-V80 PolarHBondContact O-N 3.31Å | ||
| 79 | P | 62.4 | Low | 57.6 | Low | 123 Ų | 123 | 126.5 Ų | 126.5 | 80% | 0.799 | 74% | 0.739 | S | S | * | * | trans | -63.9 | 112.7 | -177.6 | 26.3 | -31.5 | 0 | 0 | 0 | 108.2 | I81 | P79-I81 PolarHBondContact O-N 2.85Š| ||
| 80 | V | 58.4 | Low | 60 | Low | 112 Ų | 112 | 126.2 Ų | 126.2 | 68% | 0.679 | 73% | 0.726 | S | S | * | * | trans | -63.1 | 118.8 | 171 | 177.2 | 0 | 0 | 0 | 0 | 106.1 | A78 Q82 | A78-V80 PolarHBondContact O-N 3.31Å; V80-Q82 VanDerWaalsContact C-N 3.29Å; V80-Q82 HydrophobicContact CG1-CG 4.21Å; V80-Q82 PolarHBondContact O-N 2.85Å | ||
| 81 | I | 63.9 | Low | 62.3 | Low | 147 Ų | 147 | 125.5 Ų | 125.5 | 75% | 0.754 | 70% | 0.703 | S | S | * | * | trans | -63.7 | 96.3 | 173.1 | -63.5 | 170.9 | 0 | 0 | 0 | 106.6 | P79 | P79-I81 PolarHBondContact O-N 2.85Š| ||
| 82 | Q | 63.1 | Low | 64.8 | Low | 156 Ų | 156 | 121.4 Ų | 121.4 | 73% | 0.729 | 68% | 0.683 | S | S | * | * | trans | -87.9 | 118.6 | 172.6 | -65.5 | -172.6 | 15.5 | 0 | 0 | 107 | V80 S84 | V80-Q82 VanDerWaalsContact C-N 3.29Å; V80-Q82 HydrophobicContact CG1-CG 4.21Å; V80-Q82 PolarHBondContact O-N 2.85Å; Q82-S84 PolarHBondContact O-N 3.44Å | ||
| 83 | H | 61 | Low | 66.8 | Low | 184 Ų | 184 | 118.4 Ų | 118.4 | 85% | 0.852 | 67% | 0.672 | S | S | * | * | trans | -69.4 | 71.8 | 166.7 | -62.7 | -71.1 | 0 | 0 | 0 | 109 | ||||
| 84 | S | 61.2 | Low | 68.8 | Low | 74 Ų | 74 | 118.2 Ų | 118.2 | 52% | 0.517 | 67% | 0.666 | S | S | . | * | trans | -77.2 | 130.3 | 172.5 | -170.1 | 0 | 0 | 0 | 0 | 108.6 | Q82 T87 | Q82-S84 PolarHBondContact O-N 3.44Å; S84-T87 VanDerWaalsContact OG-CG2 3.27Å; S84-T87 WeakPolarHBondContact OG-CG2 3.36Å | ||
| 85 | F | 59.7 | Low | 71.1 | Confident | 197 Ų | 197 | 113.9 Ų | 113.9 | 86% | 0.864 | 65% | 0.647 | S | S | * | * | trans | -45 | 147.4 | 157.8 | -98.3 | -107.8 | 0 | 0 | 0 | 109.6 | T87 | F85-T87 VanDerWaalsContact C-N 3.35Å; F85-T87 WeakPolarHBondContact O-CG2 3.45Å; F85-T87 PolarHBondContact O-N 3.49Å | ||
| 86 | L | 64.8 | Low | 73.3 | Confident | 90 Ų | 90 | 115.2 Ų | 115.2 | 47% | 0.471 | 63% | 0.631 | S | S | . | * | trans | -44.3 | 93.6 | 176.7 | -63.8 | 156.7 | 0 | 0 | 0 | 110.6 | D91 V92 M95 | L86-D91 HydrophobicContact CD2-CB 3.48Å; L86-D91 VanDerWaalsContact CD2-CB 3.48Å; L86-V92 HydrophobicContact CB-CG2 4.18Å; L86-M95 HydrophobicContact CD1-CE 3.52Å; L86-M95 HydrophobicContact CD1-SD 4.27Å; L86-M95 HydrophobicContact CD2-CE 4.15Å; L86-M95 HydrophobicContact CG-CE 4.43Å | ||
| 87 | T | 68.1 | Low | 75.4 | Confident | 118 Ų | 118 | 114.5 Ų | 114.5 | 72% | 0.724 | 62% | 0.624 | S | S | * | * | trans | -92 | -15.4 | -174.8 | 34.9 | 0 | 0 | 0 | 0 | 112 | S84 F85 | S84-T87 VanDerWaalsContact OG-CG2 3.27Å; S84-T87 WeakPolarHBondContact OG-CG2 3.36Å; F85-T87 VanDerWaalsContact C-N 3.35Å; F85-T87 WeakPolarHBondContact O-CG2 3.45Å; F85-T87 PolarHBondContact O-N 3.49Å | ||
| 88 | D | 82.1 | Confident | 77.4 | Confident | 79 Ų | 79 | 111.7 Ų | 111.7 | 42% | 0.422 | 61% | 0.605 | S | S | . | * | S | Bend | trans | -99.1 | 135.3 | 177.5 | -161.6 | -29.8 | 0 | 0 | 0 | 110.6 | S90 D91 V92 | D88-S90 PolarHBondContact O-N 3.07Å; D88-S90 VanDerWaalsContact OD1-CB 3.32Å; D88-S90 WeakPolarHBondContact OD1-CB 3.34Å; D88-S90 PolarHBondContact OD1-N 2.9Å; D88-S90 PolarHBondContact OD1-OG 3.46Å; D88-D91 PolarHBondContact O-N 2.99Å; D88-V92 PolarHBondContact O-N 3.28Å |
| 89 | V | 82.3 | Confident | 79.1 | Confident | 100 Ų | 100 | 112.9 Ų | 112.9 | 61% | 0.606 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -61.2 | -30.1 | 173 | 179.9 | 0 | 0 | 0 | 0 | 110.6 | V92 Q93 | V89-V92 PolarHBondContact O-N 2.86Å; V89-Q93 HydrophobicContact CG1-CG 4.47Å; V89-Q93 WeakPolarHBondContact O-CG 3.27Å; V89-Q93 PolarHBondContact O-N 3.13Å |
| 90 | S | 87.4 | Confident | 80.8 | Confident | 67 Ų | 67 | 111.9 Ų | 111.9 | 47% | 0.469 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -62.2 | -43.5 | 177.5 | -47.5 | 0 | 0 | 0 | 0 | 111.8 | D88 V92 Q93 E94 | D88-S90 PolarHBondContact O-N 3.07Å; D88-S90 VanDerWaalsContact OD1-CB 3.32Å; D88-S90 WeakPolarHBondContact OD1-CB 3.34Å; D88-S90 PolarHBondContact OD1-N 2.9Å; D88-S90 PolarHBondContact OD1-OG 3.46Å; S90-V92 VanDerWaalsContact C-N 3.32Å; S90-V92 PolarHBondContact O-N 2.96Å; S90-Q93 PolarHBondContact O-N 3.43Å; S90-E94 PolarHBondContact O-N 3.36Å |
| 91 | D | 88.8 | Confident | 82.6 | Confident | 68 Ų | 68 | 108.1 Ų | 108.1 | 36% | 0.364 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -67.1 | -35.8 | 179.3 | -57.9 | -24.1 | 0 | 0 | 0 | 111.5 | L86 D88 E94 M95 | L86-D91 HydrophobicContact CD2-CB 3.48Å; L86-D91 VanDerWaalsContact CD2-CB 3.48Å; D88-D91 PolarHBondContact O-N 2.99Å; D91-E94 PolarHBondContact O-N 2.92Å; D91-M95 PolarHBondContact O-N 3.38Å; D91-M95 VanDerWaalsContact O-N 3.07Å |
| 92 | V | 91.1 | Very high | 84.2 | Confident | 71 Ų | 71 | 105.5 Ų | 105.5 | 43% | 0.43 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -65.8 | -42.8 | 176 | 178.4 | 0 | 0 | 0 | 0 | 110.8 | L86 D88 V89 S90 M95 E96 | L86-V92 HydrophobicContact CB-CG2 4.18Å; D88-V92 PolarHBondContact O-N 3.28Å; V89-V92 PolarHBondContact O-N 2.86Å; S90-V92 VanDerWaalsContact C-N 3.32Å; S90-V92 PolarHBondContact O-N 2.96Å; V92-M95 PolarHBondContact O-N 2.91Å; V92-E96 WeakPolarHBondContact O-CB 3.35Å; V92-E96 PolarHBondContact O-N 3.23Å |
| 93 | Q | 93.1 | Very high | 85.8 | Confident | 117 Ų | 117 | 102.4 Ų | 102.4 | 55% | 0.547 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -67.1 | -37.5 | 177.9 | -72.7 | 176.5 | 1.2 | 0 | 0 | 112.4 | V89 S90 E96 K97 | V89-Q93 HydrophobicContact CG1-CG 4.47Å; V89-Q93 WeakPolarHBondContact O-CG 3.27Å; V89-Q93 PolarHBondContact O-N 3.13Å; S90-Q93 PolarHBondContact O-N 3.43Å; Q93-E96 PolarHBondContact O-N 2.98Å; Q93-K97 WeakPolarHBondContact O-CB 3.32Å; Q93-K97 PolarHBondContact O-N 2.89Å |
| 94 | E | 94.4 | Very high | 87.5 | Confident | 145 Ų | 145 | 98.6 Ų | 98.6 | 68% | 0.678 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -63.1 | -44 | 174.4 | -174.3 | 176.1 | 168.4 | 0 | 0 | 111.3 | S90 D91 K97 G98 | S90-E94 PolarHBondContact O-N 3.36Å; D91-E94 PolarHBondContact O-N 2.92Å; E94-K97 PolarHBondContact O-N 3.32Å; E94-G98 PolarHBondContact O-N 3.48Å |
| 95 | M | 94.1 | Very high | 89.1 | Confident | 98 Ų | 98 | 97.1 Ų | 97.1 | 48% | 0.483 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.1 | -44.4 | 175.8 | -172.9 | 177.7 | -59.1 | 0 | 0 | 112.2 | L86 D91 V92 K97 G98 L99 | L86-M95 HydrophobicContact CD1-CE 3.52Å; L86-M95 HydrophobicContact CD1-SD 4.27Å; L86-M95 HydrophobicContact CD2-CE 4.15Å; L86-M95 HydrophobicContact CG-CE 4.43Å; D91-M95 PolarHBondContact O-N 3.38Å; D91-M95 VanDerWaalsContact O-N 3.07Å; V92-M95 PolarHBondContact O-N 2.91Å; M95-K97 VanDerWaalsContact C-N 3.31Å; M95-K97 PolarHBondContact O-N 3.29Å; M95-G98 PolarHBondContact O-N 3.42Å; M95-G98 VanDerWaalsContact O-N 3.13Å; M95-L99 HydrophobicContact CG-CD1 4.18Å; M95-L99 HydrophobicContact CG-CG 4.4Å; M95-L99 WeakPolarHBondContact O-CG 3.46Å; M95-L99 PolarHBondContact O-N 3.01Å |
| 96 | E | 94.7 | Very high | 90.7 | Very high | 115 Ų | 115 | 94 Ų | 94 | 54% | 0.537 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -56.9 | -47.2 | 175.7 | -179.5 | -179.3 | -173.2 | 0 | 0 | 110.8 | V92 Q93 G98 L99 L100 | V92-E96 WeakPolarHBondContact O-CB 3.35Å; V92-E96 PolarHBondContact O-N 3.23Å; Q93-E96 PolarHBondContact O-N 2.98Å; E96-G98 VanDerWaalsContact C-N 3.32Å; E96-G98 PolarHBondContact O-N 3.38Å; E96-L99 PolarHBondContact O-N 3.22Å; E96-L100 HydrophobicContact CG-CD1 3.92Å; E96-L100 WeakPolarHBondContact O-CB 3.45Å; E96-L100 PolarHBondContact O-N 3.28Å |
| 97 | K | 96.7 | Very high | 92.1 | Very high | 165 Ų | 165 | 96.8 Ų | 96.8 | 72% | 0.717 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -60.8 | -41.1 | 175.8 | -173.5 | -176.3 | 176.5 | -170.9 | 0 | 111.9 | Q93 E94 M95 G101 | Q93-K97 WeakPolarHBondContact O-CB 3.32Å; Q93-K97 PolarHBondContact O-N 2.89Å; E94-K97 PolarHBondContact O-N 3.32Å; M95-K97 VanDerWaalsContact C-N 3.31Å; M95-K97 PolarHBondContact O-N 3.29Å; K97-G101 PolarHBondContact O-N 3.44Å |
| 98 | G | 96.7 | Very high | 93.3 | Very high | 38 Ų | 38 | 94.9 Ų | 94.9 | 39% | 0.392 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.4 | -45.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | E94 M95 E96 G101 L102 | E94-G98 PolarHBondContact O-N 3.48Å; M95-G98 PolarHBondContact O-N 3.42Å; M95-G98 VanDerWaalsContact O-N 3.13Å; E96-G98 VanDerWaalsContact C-N 3.32Å; E96-G98 PolarHBondContact O-N 3.38Å; G98-G101 PolarHBondContact O-N 2.97Å; G98-L102 PolarHBondContact O-N 3.28Å |
| 99 | L | 97.4 | Very high | 93.6 | Very high | 106 Ų | 106 | 93.1 Ų | 93.1 | 56% | 0.555 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -67 | -40.9 | 178.6 | -68.5 | 174.9 | 0 | 0 | 0 | 112.4 | M95 E96 G101 L102 L103 | M95-L99 HydrophobicContact CG-CD1 4.18Å; M95-L99 HydrophobicContact CG-CG 4.4Å; M95-L99 WeakPolarHBondContact O-CG 3.46Å; M95-L99 PolarHBondContact O-N 3.01Å; E96-L99 PolarHBondContact O-N 3.22Å; L99-G101 VanDerWaalsContact C-N 3.3Å; L99-G101 PolarHBondContact O-N 3.5Å; L99-L102 HydrophobicContact CD2-CD1 4.37Å; L99-L102 PolarHBondContact O-N 2.81Å; L99-L103 WeakPolarHBondContact O-CB 3.35Å; L99-L103 PolarHBondContact O-N 2.95Å |
| 100 | L | 97.4 | Very high | 94 | Very high | 103 Ų | 103 | 95.5 Ų | 95.5 | 54% | 0.539 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.1 | -40.4 | 172.4 | -85.2 | 155.6 | 0 | 0 | 0 | 111.6 | E96 L103 N104 | E96-L100 HydrophobicContact CG-CD1 3.92Å; E96-L100 WeakPolarHBondContact O-CB 3.45Å; E96-L100 PolarHBondContact O-N 3.28Å; L100-L103 PolarHBondContact O-N 2.93Å; L100-N104 WeakPolarHBondContact O-CB 3.48Å; L100-N104 PolarHBondContact O-N 3.24Å |
| 101 | G | 97.2 | Very high | 94 | Very high | 33 Ų | 33 | 96 Ų | 96 | 34% | 0.34 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.3 | -47.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | K97 G98 L99 L103 N104 D105 | K97-G101 PolarHBondContact O-N 3.44Å; G98-G101 PolarHBondContact O-N 2.97Å; L99-G101 VanDerWaalsContact C-N 3.3Å; L99-G101 PolarHBondContact O-N 3.5Å; G101-L103 VanDerWaalsContact C-N 3.33Å; G101-L103 PolarHBondContact O-N 3.16Å; G101-N104 PolarHBondContact O-N 2.79Å; G101-D105 PolarHBondContact O-N 2.98Å |
| 102 | L | 96.6 | Very high | 93.7 | Very high | 91 Ų | 91 | 97.8 Ų | 97.8 | 48% | 0.476 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -59.2 | -42 | 174.6 | -82 | 153.5 | 0 | 0 | 0 | 112.3 | G98 L99 N104 D105 F106 L111 | G98-L102 PolarHBondContact O-N 3.28Å; L99-L102 HydrophobicContact CD2-CD1 4.37Å; L99-L102 PolarHBondContact O-N 2.81Å; L102-N104 VanDerWaalsContact C-N 3.34Å; L102-D105 PolarHBondContact O-N 3.34Å; L102-F106 PolarHBondContact O-N 2.79Å; L102-L111 HydrophobicContact CD2-CD2 4.14Å |
| 103 | L | 96.4 | Very high | 93 | Very high | 91 Ų | 91 | 98.6 Ų | 98.6 | 48% | 0.476 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -64.1 | -40.4 | 177.3 | -172.8 | 68.8 | 0 | 0 | 0 | 111.6 | L99 L100 G101 F106 H107 | L99-L103 WeakPolarHBondContact O-CB 3.35Å; L99-L103 PolarHBondContact O-N 2.95Å; L100-L103 PolarHBondContact O-N 2.93Å; G101-L103 VanDerWaalsContact C-N 3.33Å; G101-L103 PolarHBondContact O-N 3.16Å; L103-F106 VanDerWaalsContact O-CB 3.28Å; L103-F106 WeakPolarHBondContact O-CB 3.28Å; L103-F106 PolarHBondContact O-N 3.41Å; L103-H107 PolarHBondContact O-N 3.23Å |
| 104 | N | 96.4 | Very high | 91.9 | Very high | 104 Ų | 104 | 97.3 Ų | 97.3 | 56% | 0.556 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -66.1 | -41.3 | 176.1 | -169.1 | 29.1 | 0 | 0 | 0 | 111.8 | L100 G101 L102 F106 H107 S108 | L100-N104 WeakPolarHBondContact O-CB 3.48Å; L100-N104 PolarHBondContact O-N 3.24Å; G101-N104 PolarHBondContact O-N 2.79Å; L102-N104 VanDerWaalsContact C-N 3.34Å; N104-F106 PolarHBondContact O-N 3.33Å; N104-H107 PolarHBondContact O-N 3.43Å; N104-S108 WeakPolarHBondContact O-CB 3.41Å; N104-S108 PolarHBondContact O-N 3.35Å; N104-S108 PolarHBondContact O-OG 2.76Å |
| 105 | D | 95.6 | Very high | 90.8 | Very high | 43 Ų | 43 | 92.2 Ų | 92.2 | 23% | 0.23 | 51% | 0.506 | C | S | . | . | H | α-helix | trans | -61.6 | -32.8 | 173.4 | -77.7 | -3.2 | 0 | 0 | 0 | 111.4 | G101 L102 S108 G109 K110 L111 | G101-D105 PolarHBondContact O-N 2.98Å; L102-D105 PolarHBondContact O-N 3.34Å; D105-S108 WeakPolarHBondContact CA-OG 3.35Å; D105-S108 PolarHBondContact O-OG 2.97Å; D105-G109 PolarHBondContact O-N 2.96Å; D105-K110 HydrophobicContact CB-CB 4.39Å; D105-K110 VanDerWaalsContact CG-NZ 3.29Å; D105-K110 PolarHBondContact O-N 3.02Å; D105-K110 IonicContact OD1-NZ 2.99Å; D105-K110 PolarHBondContact OD1-NZ 2.92Å; D105-K110 VanDerWaalsContact OD1-NZ 3.12Å; D105-K110 IonicContact OD2-NZ 3.25Å; D105-K110 PolarHBondContact OD2-NZ 3.12Å; D105-L111 HydrophobicContact CB-CB 4.13Å; D105-L111 PolarHBondContact O-N 3.36Å |
| 106 | F | 93.8 | Very high | 89.4 | Confident | 132 Ų | 132 | 93.3 Ų | 93.3 | 58% | 0.579 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -66.6 | -51.5 | 171.8 | -119.1 | -84.5 | 0 | 0 | 0 | 112.5 | L102 L103 N104 S108 G109 L111 | L102-F106 PolarHBondContact O-N 2.79Å; L103-F106 VanDerWaalsContact O-CB 3.28Å; L103-F106 WeakPolarHBondContact O-CB 3.28Å; L103-F106 PolarHBondContact O-N 3.41Å; N104-F106 PolarHBondContact O-N 3.33Å; F106-S108 VanDerWaalsContact C-N 3.31Å; F106-S108 PolarHBondContact O-N 3.31Å; F106-G109 PolarHBondContact O-N 2.83Å; F106-G109 VanDerWaalsContact O-N 3.16Å; F106-L111 HydrophobicContact CD2-CB 4.38Å; F106-L111 HydrophobicContact CD2-CD2 3.73Å; F106-L111 HydrophobicContact CD2-CG 4.45Å; F106-L111 HydrophobicContact CE2-CD2 3.75Å; F106-L111 HydrophobicContact CE2-CG 4.43Å |
| 107 | H | 93.8 | Very high | 87.9 | Confident | 149 Ų | 149 | 92 Ų | 92 | 69% | 0.69 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -66.9 | -32.1 | -178.1 | -70.3 | 169.4 | 0 | 0 | 0 | 113.3 | L103 N104 G109 | L103-H107 PolarHBondContact O-N 3.23Å; N104-H107 PolarHBondContact O-N 3.43Å; H107-G109 VanDerWaalsContact C-N 3.25Å; H107-G109 PolarHBondContact O-N 3.11Å |
| 108 | S | 93.3 | Very high | 86.6 | Confident | 77 Ų | 77 | 84.8 Ų | 84.8 | 54% | 0.538 | 48% | 0.478 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.1 | -7.2 | 176.4 | 58.9 | 0 | 0 | 0 | 0 | 113.5 | N104 D105 F106 K110 | N104-S108 WeakPolarHBondContact O-CB 3.41Å; N104-S108 PolarHBondContact O-N 3.35Å; N104-S108 PolarHBondContact O-OG 2.76Å; D105-S108 WeakPolarHBondContact CA-OG 3.35Å; D105-S108 PolarHBondContact O-OG 2.97Å; F106-S108 VanDerWaalsContact C-N 3.31Å; F106-S108 PolarHBondContact O-N 3.31Å; S108-K110 PolarHBondContact O-N 3.05Å |
| 109 | G | 87.8 | Confident | 85.9 | Confident | 42 Ų | 42 | 84.7 Ų | 84.7 | 43% | 0.433 | 47% | 0.471 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 74.2 | 4.3 | -177 | 0 | 0 | 0 | 0 | 0 | 114.3 | D105 F106 H107 L111 | D105-G109 PolarHBondContact O-N 2.96Å; F106-G109 PolarHBondContact O-N 2.83Å; F106-G109 VanDerWaalsContact O-N 3.16Å; H107-G109 VanDerWaalsContact C-N 3.25Å; H107-G109 PolarHBondContact O-N 3.11Å; G109-L111 VanDerWaalsContact C-N 3.26Å; G109-L111 PolarHBondContact O-N 3.48Å |
| 110 | K | 91.1 | Very high | 85.3 | Confident | 150 Ų | 150 | 83.9 Ų | 83.9 | 65% | 0.652 | 47% | 0.466 | S | S | * | . | trans | -64.3 | -33.9 | 175.3 | 176.5 | 175.2 | 162.1 | -130.3 | 0 | 111.8 | D105 S108 | D105-K110 HydrophobicContact CB-CB 4.39Å; D105-K110 VanDerWaalsContact CG-NZ 3.29Å; D105-K110 PolarHBondContact O-N 3.02Å; D105-K110 IonicContact OD1-NZ 2.99Å; D105-K110 PolarHBondContact OD1-NZ 2.92Å; D105-K110 VanDerWaalsContact OD1-NZ 3.12Å; D105-K110 IonicContact OD2-NZ 3.25Å; D105-K110 PolarHBondContact OD2-NZ 3.12Å; S108-K110 PolarHBondContact O-N 3.05Å | ||
| 111 | L | 88.1 | Confident | 84.9 | Confident | 78 Ų | 78 | 84 Ų | 84 | 41% | 0.408 | 47% | 0.468 | S | S | . | . | S | Bend | trans | -97.5 | 95.3 | 172.5 | -161.3 | 67.8 | 0 | 0 | 0 | 109.6 | L102 D105 F106 G109 | L102-L111 HydrophobicContact CD2-CD2 4.14Å; D105-L111 HydrophobicContact CB-CB 4.13Å; D105-L111 PolarHBondContact O-N 3.36Å; F106-L111 HydrophobicContact CD2-CB 4.38Å; F106-L111 HydrophobicContact CD2-CD2 3.73Å; F106-L111 HydrophobicContact CD2-CG 4.45Å; F106-L111 HydrophobicContact CE2-CD2 3.75Å; F106-L111 HydrophobicContact CE2-CG 4.43Å; G109-L111 VanDerWaalsContact C-N 3.26Å; G109-L111 PolarHBondContact O-N 3.48Å |
| 112 | Q | 81.6 | Confident | 84.6 | Confident | 105 Ų | 105 | 86.5 Ų | 86.5 | 49% | 0.491 | 47% | 0.47 | S | S | . | . | trans | -116.2 | 118.7 | 176.3 | 179.7 | 171.9 | 9.9 | 0 | 0 | 108.5 | F114 N116 | Q112-F114 WeakPolarHBondContact CG-O 2.96Å; Q112-F114 PolarHBondContact NE2-O 2.89Å; Q112-N116 PolarHBondContact NE2-OD1 3.45Å | ||
| 113 | A | 76.3 | Confident | 84.4 | Confident | 89 Ų | 89 | 85.5 Ų | 85.5 | 74% | 0.736 | 46% | 0.464 | S | S | * | . | S | Bend | trans | -77.2 | -26 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||
| 114 | F | 71.6 | Confident | 84.2 | Confident | 89 Ų | 89 | 85.5 Ų | 85.5 | 39% | 0.39 | 46% | 0.462 | S | S | . | . | S | Bend | trans | -132.2 | 116.4 | -176.3 | -56.9 | -51.6 | 0 | 0 | 0 | 108.2 | Q112 C118 I120 M123 | Q112-F114 WeakPolarHBondContact CG-O 2.96Å; Q112-F114 PolarHBondContact NE2-O 2.89Å; F114-C118 WeakPolarHBondContact CB-O 3.42Å; F114-I120 HydrophobicContact CD2-CB 3.97Å; F114-I120 HydrophobicContact CE2-CB 4.04Å; F114-I120 HydrophobicContact CE2-CD1 3.99Å; F114-I120 HydrophobicContact CE2-CG1 4.23Å; F114-I120 HydrophobicContact CG-CB 4.47Å; F114-M123 HydrophobicContact CD1-CE 3.38Å; F114-M123 HydrophobicContact CE1-CE 3.13Å; F114-M123 HydrophobicContact CE1-SD 4.48Å; F114-M123 HydrophobicContact CG-CE 4.32Å; F114-M123 HydrophobicContact CZ-CE 3.86Å |
| 115 | G | 69.4 | Low | 84.2 | Confident | 39 Ų | 39 | 84.7 Ų | 84.7 | 40% | 0.402 | 45% | 0.454 | S | S | . | . | trans | -62.2 | 170.9 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | E117 C118 | G115-E117 PolarHBondContact O-N 3.12Å; G115-E117 VanDerWaalsContact O-N 3.14Å; G115-C118 PolarHBondContact O-N 3.22Å | ||
| 116 | N | 65 | Low | 84.2 | Confident | 120 Ų | 120 | 83.3 Ų | 83.3 | 64% | 0.642 | 45% | 0.448 | S | S | * | . | S | Bend | trans | -61.4 | -25.4 | -178.4 | -60.2 | -23.2 | 0 | 0 | 0 | 112.9 | Q112 | Q112-N116 PolarHBondContact NE2-OD1 3.45Š|
| 117 | E | 63.6 | Low | 84.4 | Confident | 87 Ų | 87 | 85 Ų | 85 | 41% | 0.407 | 45% | 0.45 | S | S | . | . | S | Bend | trans | -110.4 | -8.1 | -176.1 | -58.1 | -159.7 | 166.3 | 0 | 0 | 114.5 | G115 Q122 A180 | G115-E117 PolarHBondContact O-N 3.12Å; G115-E117 VanDerWaalsContact O-N 3.14Å; E117-Q122 PolarHBondContact O-NE2 3.33Å; E117-Q122 PolarHBondContact O-OE1 3.23Å; E117-A180 HydrophobicContact CB-CB 3.5Å; E117-A180 VanDerWaalsContact O-CB 3.23Å; E117-A180 WeakPolarHBondContact O-CB 3.29Å |
| 118 | C | 69.2 | Low | 84.5 | Confident | 15 Ų | 15 | 82.9 Ų | 82.9 | 10% | 0.101 | 44% | 0.44 | C | S | . | . | S | Bend | trans | -117 | 76.3 | 174.4 | -173.6 | 0 | 0 | 0 | 0 | 108.7 | F114 G115 Q122 | F114-C118 WeakPolarHBondContact CB-O 3.42Å; G115-C118 PolarHBondContact O-N 3.22Å; C118-Q122 VanDerWaalsContact CA-OE1 3.29Å |
| 119 | S | 81.8 | Confident | 84.8 | Confident | 36 Ų | 36 | 80.1 Ų | 80.1 | 25% | 0.252 | 42% | 0.419 | S | S | . | . | trans | -72.6 | 147.2 | -178.8 | 179.5 | 0 | 0 | 0 | 0 | 110.7 | D121 Q122 M123 | S119-D121 PolarHBondContact O-N 3.14Å; S119-D121 VanDerWaalsContact O-N 3.12Å; S119-D121 PolarHBondContact OG-N 3.34Å; S119-D121 PolarHBondContact OG-OD2 2.78Å; S119-D121 VanDerWaalsContact OG-OD2 3.11Å; S119-Q122 WeakPolarHBondContact O-CB 3.4Å; S119-Q122 PolarHBondContact O-N 2.87Å; S119-M123 PolarHBondContact O-N 3.42Å | ||
| 120 | I | 86.4 | Confident | 85.3 | Confident | 89 Ų | 89 | 82.8 Ų | 82.8 | 46% | 0.456 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -47 | -38 | 166.5 | -172.3 | 169.9 | 0 | 0 | 0 | 111.9 | F114 Q122 M123 E124 | F114-I120 HydrophobicContact CD2-CB 3.97Å; F114-I120 HydrophobicContact CE2-CB 4.04Å; F114-I120 HydrophobicContact CE2-CD1 3.99Å; F114-I120 HydrophobicContact CE2-CG1 4.23Å; F114-I120 HydrophobicContact CG-CB 4.47Å; I120-Q122 VanDerWaalsContact C-N 3.33Å; I120-Q122 PolarHBondContact O-N 3.23Å; I120-M123 PolarHBondContact O-N 2.96Å; I120-E124 WeakPolarHBondContact O-CB 3.36Å; I120-E124 PolarHBondContact O-N 3.39Å |
| 121 | D | 89 | Confident | 85.6 | Confident | 105 Ų | 105 | 80.1 Ų | 80.1 | 56% | 0.561 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -64.9 | -36.8 | 180 | -53.1 | -42.8 | 0 | 0 | 0 | 112.1 | S119 E124 H125 | S119-D121 PolarHBondContact O-N 3.14Å; S119-D121 VanDerWaalsContact O-N 3.12Å; S119-D121 PolarHBondContact OG-N 3.34Å; S119-D121 PolarHBondContact OG-OD2 2.78Å; S119-D121 VanDerWaalsContact OG-OD2 3.11Å; D121-E124 PolarHBondContact O-N 2.66Å; D121-H125 WeakPolarHBondContact O-CB 3.49Å; D121-H125 PolarHBondContact O-N 3.17Å |
| 122 | Q | 90.2 | Very high | 86.1 | Confident | 86 Ų | 86 | 82.2 Ų | 82.2 | 40% | 0.402 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -73.1 | -37.1 | 179.8 | -64.2 | 168.6 | -30.1 | 0 | 0 | 111.1 | E117 C118 S119 I120 H125 V126 L177 | E117-Q122 PolarHBondContact O-NE2 3.33Å; E117-Q122 PolarHBondContact O-OE1 3.23Å; C118-Q122 VanDerWaalsContact CA-OE1 3.29Å; S119-Q122 WeakPolarHBondContact O-CB 3.4Å; S119-Q122 PolarHBondContact O-N 2.87Å; I120-Q122 VanDerWaalsContact C-N 3.33Å; I120-Q122 PolarHBondContact O-N 3.23Å; Q122-H125 WeakPolarHBondContact O-CB 3.42Å; Q122-H125 PolarHBondContact O-N 3.46Å; Q122-V126 PolarHBondContact O-N 3.23Å; Q122-L177 HydrophobicContact CB-CD2 3.5Å; Q122-L177 VanDerWaalsContact CB-CD2 3.5Å; Q122-L177 HydrophobicContact CG-CD2 4.47Å |
| 123 | M | 92 | Very high | 86.9 | Confident | 69 Ų | 69 | 78.5 Ų | 78.5 | 34% | 0.34 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -67.7 | -39.6 | 172.4 | -66.6 | -165.9 | -65 | 0 | 0 | 111.9 | F114 S119 I120 H125 V126 R127 L177 | F114-M123 HydrophobicContact CD1-CE 3.38Å; F114-M123 HydrophobicContact CE1-CE 3.13Å; F114-M123 HydrophobicContact CE1-SD 4.48Å; F114-M123 HydrophobicContact CG-CE 4.32Å; F114-M123 HydrophobicContact CZ-CE 3.86Å; S119-M123 PolarHBondContact O-N 3.42Å; I120-M123 PolarHBondContact O-N 2.96Å; M123-H125 VanDerWaalsContact C-N 3.31Å; M123-V126 PolarHBondContact O-N 2.85Å; M123-R127 PolarHBondContact O-N 3.34Å; M123-L177 HydrophobicContact CG-CD1 4.37Å |
| 124 | E | 93.2 | Very high | 87.9 | Confident | 92 Ų | 92 | 76.6 Ų | 76.6 | 43% | 0.43 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -60.8 | -43.2 | 173.5 | -176.1 | 162.4 | -143.3 | 0 | 0 | 110.7 | I120 D121 V126 R127 E128 | I120-E124 WeakPolarHBondContact O-CB 3.36Å; I120-E124 PolarHBondContact O-N 3.39Å; D121-E124 PolarHBondContact O-N 2.66Å; E124-V126 PolarHBondContact O-N 3.01Å; E124-R127 CarbonylContact O-C 3.6Å; E124-R127 WeakPolarHBondContact O-CA 3.33Å; E124-R127 WeakPolarHBondContact O-CB 3.49Å; E124-R127 PolarHBondContact O-N 3.11Å; E124-R127 VanDerWaalsContact O-N 3.11Å; E124-E128 WeakPolarHBondContact O-CG 3.5Å; E124-E128 PolarHBondContact O-N 3.41Å |
| 125 | H | 94.9 | Very high | 89.2 | Confident | 87 Ų | 87 | 78.4 Ų | 78.4 | 40% | 0.403 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -58.6 | -44.8 | 174.3 | -177.1 | 58.1 | 0 | 0 | 0 | 112.7 | D121 Q122 M123 R127 E128 M129 | D121-H125 WeakPolarHBondContact O-CB 3.49Å; D121-H125 PolarHBondContact O-N 3.17Å; Q122-H125 WeakPolarHBondContact O-CB 3.42Å; Q122-H125 PolarHBondContact O-N 3.46Å; M123-H125 VanDerWaalsContact C-N 3.31Å; H125-R127 VanDerWaalsContact C-N 3.31Å; H125-R127 PolarHBondContact O-N 2.95Å; H125-E128 WeakPolarHBondContact O-CB 3.49Å; H125-E128 PolarHBondContact O-N 3.28Å; H125-M129 WeakPolarHBondContact O-CG 3.5Å; H125-M129 PolarHBondContact O-N 2.84Å |
| 126 | V | 96 | Very high | 90.6 | Very high | 14 Ų | 14 | 78.4 Ų | 78.4 | 9% | 0.085 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -61 | -41.5 | 174.7 | 165.4 | 0 | 0 | 0 | 0 | 111.6 | Q122 M123 E124 M129 Q130 L170 I174 L177 | Q122-V126 PolarHBondContact O-N 3.23Å; M123-V126 PolarHBondContact O-N 2.85Å; E124-V126 PolarHBondContact O-N 3.01Å; V126-M129 PolarHBondContact O-N 3.39Å; V126-Q130 WeakPolarHBondContact O-CG 3.45Å; V126-Q130 PolarHBondContact O-N 3.29Å; V126-L170 HydrophobicContact CG1-CD1 3.97Å; V126-I174 HydrophobicContact CG1-CD1 4.17Å; V126-I174 HydrophobicContact CG1-CG1 3.69Å; V126-I174 HydrophobicContact CG2-CG1 4.18Å; V126-L177 HydrophobicContact CB-CD1 4.24Å; V126-L177 HydrophobicContact CG2-CD1 3.55Å; V126-L177 HydrophobicContact CG2-CG 4.44Å |
| 127 | R | 97.3 | Very high | 92.1 | Very high | 167 Ų | 167 | 77.4 Ų | 77.4 | 63% | 0.63 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -60.8 | -44.1 | 175.2 | 179.5 | -171.3 | 174.9 | -147 | -3.2 | 111.5 | M123 E124 H125 Q130 E131 | M123-R127 PolarHBondContact O-N 3.34Å; E124-R127 CarbonylContact O-C 3.6Å; E124-R127 WeakPolarHBondContact O-CA 3.33Å; E124-R127 WeakPolarHBondContact O-CB 3.49Å; E124-R127 PolarHBondContact O-N 3.11Å; E124-R127 VanDerWaalsContact O-N 3.11Å; H125-R127 VanDerWaalsContact C-N 3.31Å; H125-R127 PolarHBondContact O-N 2.95Å; R127-Q130 WeakPolarHBondContact O-CB 3.42Å; R127-Q130 PolarHBondContact O-N 3.42Å; R127-E131 PolarHBondContact O-N 2.93Å |
| 128 | E | 97.9 | Very high | 93.7 | Very high | 104 Ų | 104 | 80 Ų | 80 | 49% | 0.486 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -62.1 | -42.9 | 176.3 | -71.8 | 178.8 | 168.7 | 0 | 0 | 111.9 | E124 H125 Q130 E131 K132 | E124-E128 WeakPolarHBondContact O-CG 3.5Å; E124-E128 PolarHBondContact O-N 3.41Å; H125-E128 WeakPolarHBondContact O-CB 3.49Å; H125-E128 PolarHBondContact O-N 3.28Å; E128-Q130 VanDerWaalsContact C-N 3.34Å; E128-Q130 PolarHBondContact O-N 3.06Å; E128-E131 PolarHBondContact O-N 3.42Å; E128-K132 WeakPolarHBondContact O-CB 3.35Å; E128-K132 PolarHBondContact O-N 2.83Å |
| 129 | M | 98.1 | Very high | 95.1 | Very high | 20 Ų | 20 | 84.3 Ų | 84.3 | 10% | 0.099 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -60.6 | -42.7 | 176.3 | -72 | -171.6 | 79.7 | 0 | 0 | 111.9 | H125 V126 L133 E169 L170 | H125-M129 WeakPolarHBondContact O-CG 3.5Å; H125-M129 PolarHBondContact O-N 2.84Å; V126-M129 PolarHBondContact O-N 3.39Å; M129-L133 WeakPolarHBondContact O-CB 3.23Å; M129-L133 PolarHBondContact O-N 2.9Å; M129-E169 HydrophobicContact CE-CB 3.69Å; M129-E169 HydrophobicContact CE-CG 3.53Å; M129-L170 HydrophobicContact CB-CD1 3.75Å; M129-L170 HydrophobicContact CE-CB 4.08Å; M129-L170 VanDerWaalsContact CE-N 3.34Å; M129-L170 HydrophobicContact SD-CD1 4.48Å |
| 130 | Q | 98.3 | Very high | 95.8 | Very high | 98 Ų | 98 | 83.1 Ų | 83.1 | 46% | 0.458 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -61.1 | -44.8 | 174.3 | -72.1 | 172.4 | -9.2 | 0 | 0 | 111.9 | V126 R127 E128 L133 A134 L170 | V126-Q130 WeakPolarHBondContact O-CG 3.45Å; V126-Q130 PolarHBondContact O-N 3.29Å; R127-Q130 WeakPolarHBondContact O-CB 3.42Å; R127-Q130 PolarHBondContact O-N 3.42Å; E128-Q130 VanDerWaalsContact C-N 3.34Å; E128-Q130 PolarHBondContact O-N 3.06Å; Q130-L133 PolarHBondContact O-N 2.9Å; Q130-A134 PolarHBondContact O-N 2.79Å; Q130-L170 HydrophobicContact CG-CD1 3.86Å; Q130-L170 HydrophobicContact CG-CD2 3.74Å; Q130-L170 HydrophobicContact CG-CG 4.47Å |
| 131 | E | 98.3 | Very high | 96.2 | Very high | 93 Ų | 93 | 86.3 Ų | 86.3 | 44% | 0.435 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -66.7 | -42.8 | -179.5 | -161 | -170.1 | -160.5 | 0 | 0 | 111.8 | R127 E128 L133 A134 R135 | R127-E131 PolarHBondContact O-N 2.93Å; E128-E131 PolarHBondContact O-N 3.42Å; E131-L133 VanDerWaalsContact C-N 3.34Å; E131-L133 PolarHBondContact O-N 3.03Å; E131-A134 PolarHBondContact O-N 3.13Å; E131-R135 VanDerWaalsContact CG-NH1 3.28Å; E131-R135 WeakPolarHBondContact O-CG 3.31Å; E131-R135 PolarHBondContact O-N 3.41Å; E131-R135 IonicContact OE1-CZ 2.8Å; E131-R135 IonicContact OE1-NH1 3.9Å; E131-R135 IonicContact OE1-NH2 2.79Å; E131-R135 PolarHBondContact OE1-NH2 2.95Å; E131-R135 IonicContact OE2-CZ 2.66Å; E131-R135 IonicContact OE2-NH1 3.17Å; E131-R135 PolarHBondContact OE2-NH1 3.36Å; E131-R135 IonicContact OE2-NH2 3.12Å; E131-R135 PolarHBondContact OE2-NH2 3.34Å |
| 132 | K | 97.9 | Very high | 96.5 | Very high | 122 Ų | 122 | 83.4 Ų | 83.4 | 53% | 0.53 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -60.7 | -43.3 | 174.3 | -176.6 | -174 | 173.3 | -164.5 | 0 | 111.1 | E128 R135 L136 | E128-K132 WeakPolarHBondContact O-CB 3.35Å; E128-K132 PolarHBondContact O-N 2.83Å; K132-R135 PolarHBondContact O-N 2.96Å; K132-L136 VanDerWaalsContact O-CB 3.31Å; K132-L136 WeakPolarHBondContact O-CB 3.41Å; K132-L136 PolarHBondContact O-N 2.97Å |
| 133 | L | 98.3 | Very high | 96.7 | Very high | 28 Ų | 28 | 84 Ų | 84 | 15% | 0.147 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -63.8 | -42.5 | 177.8 | -179 | 59.8 | 0 | 0 | 0 | 111.8 | M129 Q130 E131 L136 H137 L163 N166 L167 L170 | M129-L133 WeakPolarHBondContact O-CB 3.23Å; M129-L133 PolarHBondContact O-N 2.9Å; Q130-L133 PolarHBondContact O-N 2.9Å; E131-L133 VanDerWaalsContact C-N 3.34Å; E131-L133 PolarHBondContact O-N 3.03Å; L133-L136 PolarHBondContact O-N 3Å; L133-H137 PolarHBondContact O-N 3.32Å; L133-L163 HydrophobicContact CD1-CD2 3.79Å; L133-N166 HydrophobicContact CD1-CB 3.87Å; L133-L167 HydrophobicContact CD2-CB 4.36Å; L133-L167 HydrophobicContact CD2-CD1 3.8Å; L133-L170 HydrophobicContact CD2-CD2 4.14Å |
| 134 | A | 98.1 | Very high | 96.9 | Very high | 48 Ų | 48 | 82 Ų | 82 | 40% | 0.397 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -62.5 | -45.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q130 E131 H137 F138 | Q130-A134 PolarHBondContact O-N 2.79Å; E131-A134 PolarHBondContact O-N 3.13Å; A134-H137 PolarHBondContact O-N 3.29Å; A134-F138 WeakPolarHBondContact O-CD2 3.4Å; A134-F138 PolarHBondContact O-N 3.44Å |
| 135 | R | 98.1 | Very high | 96.9 | Very high | 128 Ų | 128 | 83.9 Ų | 83.9 | 48% | 0.483 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -59.1 | -49.3 | 174.5 | -72.8 | -178.5 | -176.7 | 111.8 | 0.6 | 111.5 | E131 K132 H137 F138 D139 | E131-R135 VanDerWaalsContact CG-NH1 3.28Å; E131-R135 WeakPolarHBondContact O-CG 3.31Å; E131-R135 PolarHBondContact O-N 3.41Å; E131-R135 IonicContact OE1-CZ 2.8Å; E131-R135 IonicContact OE1-NH1 3.9Å; E131-R135 IonicContact OE1-NH2 2.79Å; E131-R135 PolarHBondContact OE1-NH2 2.95Å; E131-R135 IonicContact OE2-CZ 2.66Å; E131-R135 IonicContact OE2-NH1 3.17Å; E131-R135 PolarHBondContact OE2-NH1 3.36Å; E131-R135 IonicContact OE2-NH2 3.12Å; E131-R135 PolarHBondContact OE2-NH2 3.34Å; K132-R135 PolarHBondContact O-N 2.96Å; R135-H137 VanDerWaalsContact C-N 3.27Å; R135-H137 PolarHBondContact O-N 3.39Å; R135-F138 PolarHBondContact O-N 2.88Å; R135-D139 PolarHBondContact O-N 3.49Å |
| 136 | L | 98.1 | Very high | 96.8 | Very high | 39 Ų | 39 | 88.1 Ų | 88.1 | 20% | 0.204 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -57 | -42 | 179 | -178.1 | 65.6 | 0 | 0 | 0 | 111.5 | K132 L133 F138 D139 L140 L163 | K132-L136 VanDerWaalsContact O-CB 3.31Å; K132-L136 WeakPolarHBondContact O-CB 3.41Å; K132-L136 PolarHBondContact O-N 2.97Å; L133-L136 PolarHBondContact O-N 3Å; L136-F138 VanDerWaalsContact C-N 3.33Å; L136-F138 PolarHBondContact O-N 3.27Å; L136-D139 PolarHBondContact O-N 3.41Å; L136-L140 HydrophobicContact CD1-CD1 3.87Å; L136-L140 HydrophobicContact CD1-CD2 4.18Å; L136-L140 HydrophobicContact CD1-CG 3.81Å; L136-L140 HydrophobicContact CD2-CD1 4.33Å; L136-L140 HydrophobicContact CG-CD1 3.75Å; L136-L140 HydrophobicContact CG-CG 4.07Å; L136-L140 VanDerWaalsContact O-CB 3.32Å; L136-L140 WeakPolarHBondContact O-CB 3.34Å; L136-L140 WeakPolarHBondContact O-CG 3.44Å; L136-L140 PolarHBondContact O-N 3.39Å; L136-L163 HydrophobicContact CD2-CD2 4.33Å; L136-L163 HydrophobicContact CG-CD2 4.37Å |
| 137 | H | 97.5 | Very high | 96.6 | Very high | 98 Ų | 98 | 89.7 Ų | 89.7 | 45% | 0.454 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -59.4 | -43 | 176.2 | 177.7 | -86.8 | 0 | 0 | 0 | 112.2 | L133 A134 R135 Y141 L163 | L133-H137 PolarHBondContact O-N 3.32Å; A134-H137 PolarHBondContact O-N 3.29Å; R135-H137 VanDerWaalsContact C-N 3.27Å; R135-H137 PolarHBondContact O-N 3.39Å; H137-Y141 VanDerWaalsContact O-CB 3.22Å; H137-Y141 WeakPolarHBondContact O-CB 3.37Å; H137-Y141 PolarHBondContact O-N 3.33Å; H137-L163 HydrophobicContact CB-CD2 4.11Å |
| 138 | F | 97.8 | Very high | 96.4 | Very high | 142 Ų | 142 | 84.8 Ų | 84.8 | 62% | 0.623 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -67.1 | -44.3 | 175.9 | -70.3 | -62.7 | 0 | 0 | 0 | 112.6 | A134 R135 L136 Y141 A142 | A134-F138 WeakPolarHBondContact O-CD2 3.4Å; A134-F138 PolarHBondContact O-N 3.44Å; R135-F138 PolarHBondContact O-N 2.88Å; L136-F138 VanDerWaalsContact C-N 3.33Å; L136-F138 PolarHBondContact O-N 3.27Å; F138-Y141 PolarHBondContact O-N 3.15Å; F138-A142 WeakPolarHBondContact O-CB 3.08Å; F138-A142 PolarHBondContact O-N 3.37Å |
| 139 | D | 97.6 | Very high | 96.2 | Very high | 105 Ų | 105 | 86.8 Ų | 86.8 | 56% | 0.561 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -62.3 | -46.9 | -179.5 | -65.3 | -22.4 | 0 | 0 | 0 | 111.1 | R135 L136 Y141 A142 E143 | R135-D139 PolarHBondContact O-N 3.49Å; L136-D139 PolarHBondContact O-N 3.41Å; D139-Y141 VanDerWaalsContact C-N 3.32Å; D139-Y141 PolarHBondContact O-N 3.21Å; D139-A142 PolarHBondContact O-N 3.04Å; D139-E143 WeakPolarHBondContact O-CB 3.45Å; D139-E143 PolarHBondContact O-N 3.1Å |
| 140 | L | 96.5 | Very high | 96 | Very high | 12 Ų | 12 | 91.8 Ų | 91.8 | 6% | 0.063 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -66.8 | -33.5 | 178.1 | -66.8 | -178.8 | 0 | 0 | 0 | 112.3 | L136 V144 N159 K162 L163 | L136-L140 HydrophobicContact CD1-CD1 3.87Å; L136-L140 HydrophobicContact CD1-CD2 4.18Å; L136-L140 HydrophobicContact CD1-CG 3.81Å; L136-L140 HydrophobicContact CD2-CD1 4.33Å; L136-L140 HydrophobicContact CG-CD1 3.75Å; L136-L140 HydrophobicContact CG-CG 4.07Å; L136-L140 VanDerWaalsContact O-CB 3.32Å; L136-L140 WeakPolarHBondContact O-CB 3.34Å; L136-L140 WeakPolarHBondContact O-CG 3.44Å; L136-L140 PolarHBondContact O-N 3.39Å; L140-V144 WeakPolarHBondContact O-CG2 3.47Å; L140-V144 PolarHBondContact O-N 3.48Å; L140-V144 VanDerWaalsContact O-N 3.16Å; L140-N159 HydrophobicContact CB-CB 4.26Å; L140-N159 HydrophobicContact CD1-CB 3.94Å; L140-N159 WeakPolarHBondContact CD2-OD1 3.22Å; L140-N159 HydrophobicContact CG-CB 4.47Å; L140-N159 PolarHBondContact O-ND2 3.48Å; L140-K162 HydrophobicContact CD1-CB 4.35Å; L140-K162 HydrophobicContact CD1-CD 4.26Å; L140-K162 HydrophobicContact CD2-CD 4.27Å; L140-L163 HydrophobicContact CD1-CD2 4.3Å; L140-L163 HydrophobicContact CD1-CG 4.12Å |
| 141 | Y | 95.1 | Very high | 95.8 | Very high | 156 Ų | 156 | 91.5 Ų | 91.5 | 61% | 0.612 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -67.4 | -46.8 | 175.4 | -176.4 | -91.8 | 0 | 0 | 0 | 111.3 | H137 F138 D139 E143 V144 E145 | H137-Y141 VanDerWaalsContact O-CB 3.22Å; H137-Y141 WeakPolarHBondContact O-CB 3.37Å; H137-Y141 PolarHBondContact O-N 3.33Å; F138-Y141 PolarHBondContact O-N 3.15Å; D139-Y141 VanDerWaalsContact C-N 3.32Å; D139-Y141 PolarHBondContact O-N 3.21Å; Y141-E143 VanDerWaalsContact C-N 3.34Å; Y141-E143 PolarHBondContact O-N 3.42Å; Y141-V144 PolarHBondContact O-N 3.43Å; Y141-E145 PolarHBondContact O-N 2.88Å |
| 142 | A | 95.6 | Very high | 95.7 | Very high | 43 Ų | 43 | 90.9 Ų | 90.9 | 36% | 0.355 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -61.7 | -41.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | F138 D139 V144 E145 E146 | F138-A142 WeakPolarHBondContact O-CB 3.08Å; F138-A142 PolarHBondContact O-N 3.37Å; D139-A142 PolarHBondContact O-N 3.04Å; A142-V144 PolarHBondContact O-N 3.02Å; A142-E145 WeakPolarHBondContact O-CB 3.48Å; A142-E145 PolarHBondContact O-N 3.16Å; A142-E146 PolarHBondContact O-N 3.39Å |
| 143 | E | 94.8 | Very high | 95.5 | Very high | 100 Ų | 100 | 91.8 Ų | 91.8 | 47% | 0.467 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -57.7 | -47.7 | 175.8 | -175.2 | -179.5 | -175.5 | 0 | 0 | 111.5 | D139 Y141 E145 E146 M147 | D139-E143 WeakPolarHBondContact O-CB 3.45Å; D139-E143 PolarHBondContact O-N 3.1Å; Y141-E143 VanDerWaalsContact C-N 3.34Å; Y141-E143 PolarHBondContact O-N 3.42Å; E143-E145 VanDerWaalsContact C-N 3.35Å; E143-E145 PolarHBondContact O-N 3.43Å; E143-E146 PolarHBondContact O-N 3.2Å; E143-M147 WeakPolarHBondContact O-CG 3.19Å; E143-M147 PolarHBondContact O-N 3.07Å |
| 144 | V | 94.7 | Very high | 95.4 | Very high | 26 Ų | 26 | 94.9 Ų | 94.9 | 16% | 0.158 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -67.2 | -34.5 | 179.3 | 172.7 | 0 | 0 | 0 | 0 | 112.1 | L140 Y141 A142 E146 M147 R152 A155 N159 | L140-V144 WeakPolarHBondContact O-CG2 3.47Å; L140-V144 PolarHBondContact O-N 3.48Å; L140-V144 VanDerWaalsContact O-N 3.16Å; Y141-V144 PolarHBondContact O-N 3.43Å; A142-V144 PolarHBondContact O-N 3.02Å; V144-E146 VanDerWaalsContact C-N 3.32Å; V144-E146 PolarHBondContact O-N 3.48Å; V144-M147 PolarHBondContact O-N 3.42Å; V144-R152 HydrophobicContact CG1-CB 4.03Å; V144-R152 HydrophobicContact CG1-CG 4.07Å; V144-R152 VanDerWaalsContact O-CD 3.26Å; V144-R152 WeakPolarHBondContact O-CD 3.49Å; V144-R152 WeakPolarHBondContact O-CG 3.4Å; V144-R152 PolarHBondContact O-NE 3.43Å; V144-A155 HydrophobicContact CG2-CB 4.14Å; V144-N159 VanDerWaalsContact CG2-ND2 3.29Å; V144-N159 WeakPolarHBondContact CG2-ND2 3.36Å |
| 145 | E | 93.3 | Very high | 95.2 | Very high | 132 Ų | 132 | 93.3 Ų | 93.3 | 62% | 0.617 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -61 | -40.7 | 176.4 | -170.5 | -176.3 | 178 | 0 | 0 | 111.8 | Y141 A142 E143 | Y141-E145 PolarHBondContact O-N 2.88Å; A142-E145 WeakPolarHBondContact O-CB 3.48Å; A142-E145 PolarHBondContact O-N 3.16Å; E143-E145 VanDerWaalsContact C-N 3.35Å; E143-E145 PolarHBondContact O-N 3.43Å |
| 146 | E | 92.9 | Very high | 95.1 | Very high | 176 Ų | 176 | 89.7 Ų | 89.7 | 82% | 0.822 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -78.7 | -15.9 | -179.3 | -65.9 | -170.8 | 171 | 0 | 0 | 113.8 | A142 E143 V144 | A142-E146 PolarHBondContact O-N 3.39Å; E143-E146 PolarHBondContact O-N 3.2Å; V144-E146 VanDerWaalsContact C-N 3.32Å; V144-E146 PolarHBondContact O-N 3.48Å |
| 147 | M | 93.1 | Very high | 95 | Very high | 47 Ų | 47 | 91.5 Ų | 91.5 | 23% | 0.232 | 45% | 0.454 | C | S | . | . | S | Bend | trans | -75 | 152 | -178.2 | -70.3 | -140.5 | 71.7 | 0 | 0 | 113.6 | E143 V144 Q151 R152 A155 | E143-M147 WeakPolarHBondContact O-CG 3.19Å; E143-M147 PolarHBondContact O-N 3.07Å; V144-M147 PolarHBondContact O-N 3.42Å; M147-Q151 HydrophobicContact CE-CB 3.97Å; M147-R152 HydrophobicContact CB-CG 4.13Å; M147-R152 PolarHBondContact O-NE 3.24Å; M147-R152 PolarHBondContact O-NH2 3.34Å; M147-A155 HydrophobicContact SD-CB 4.01Å |
| 148 | P | 93.3 | Very high | 95 | Very high | 64 Ų | 64 | 89.9 Ų | 89.9 | 42% | 0.416 | 45% | 0.451 | S | S | . | . | trans | -55.8 | 140.4 | 167.5 | -26 | 36.5 | 0 | 0 | 0 | 112.8 | D150 Q151 R152 | P148-D150 WeakPolarHBondContact CB-OD1 3.32Å; P148-D150 PolarHBondContact O-N 3.46Å; P148-D150 VanDerWaalsContact O-N 3.15Å; P148-Q151 PolarHBondContact O-N 2.94Å; P148-R152 WeakPolarHBondContact O-CG 3.35Å; P148-R152 PolarHBondContact O-N 3.49Å; P148-R152 VanDerWaalsContact O-N 3.14Å | ||
| 149 | E | 92.8 | Very high | 95 | Very high | 145 Ų | 145 | 83.6 Ų | 83.6 | 68% | 0.678 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -54.4 | -36 | -174.5 | -112.7 | 117.8 | -141.6 | 0 | 0 | 114.1 | Q151 R152 | E149-Q151 PolarHBondContact O-N 3.37Å; E149-R152 PolarHBondContact O-N 2.94Å; E149-R152 IonicContact OE1-CZ 3.37Å; E149-R152 VanDerWaalsContact OE1-CZ 3.25Å; E149-R152 IonicContact OE1-NH1 3.38Å; E149-R152 PolarHBondContact OE1-NH1 3.05Å; E149-R152 IonicContact OE1-NH2 3.57Å; E149-R152 PolarHBondContact OE1-NH2 2.9Å |
| 150 | D | 94.6 | Very high | 95 | Very high | 126 Ų | 126 | 83 Ų | 83 | 67% | 0.674 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -66.1 | -24.9 | 178.8 | 58 | -50.3 | 0 | 0 | 0 | 113 | P148 | P148-D150 WeakPolarHBondContact CB-OD1 3.32Å; P148-D150 PolarHBondContact O-N 3.46Å; P148-D150 VanDerWaalsContact O-N 3.15Å |
| 151 | Q | 94 | Very high | 95 | Very high | 91 Ų | 91 | 87.7 Ų | 87.7 | 43% | 0.425 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -100.4 | -21.2 | -178.5 | -64.7 | 171.9 | 38.3 | 0 | 0 | 112.8 | M147 P148 E149 K153 T154 A155 | M147-Q151 HydrophobicContact CE-CB 3.97Å; P148-Q151 PolarHBondContact O-N 2.94Å; E149-Q151 PolarHBondContact O-N 3.37Å; Q151-K153 VanDerWaalsContact C-N 3.27Å; Q151-K153 PolarHBondContact O-N 3.45Å; Q151-T154 PolarHBondContact O-N 3.33Å; Q151-A155 PolarHBondContact O-N 3.29Å |
| 152 | R | 95.1 | Very high | 95.2 | Very high | 81 Ų | 81 | 84.5 Ų | 84.5 | 31% | 0.306 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -55.7 | -38.7 | -176.9 | -69.7 | -166.8 | -160.9 | 143 | 16.9 | 113.4 | V144 M147 P148 E149 S156 | V144-R152 HydrophobicContact CG1-CB 4.03Å; V144-R152 HydrophobicContact CG1-CG 4.07Å; V144-R152 VanDerWaalsContact O-CD 3.26Å; V144-R152 WeakPolarHBondContact O-CD 3.49Å; V144-R152 WeakPolarHBondContact O-CG 3.4Å; V144-R152 PolarHBondContact O-NE 3.43Å; M147-R152 HydrophobicContact CB-CG 4.13Å; M147-R152 PolarHBondContact O-NE 3.24Å; M147-R152 PolarHBondContact O-NH2 3.34Å; P148-R152 WeakPolarHBondContact O-CG 3.35Å; P148-R152 PolarHBondContact O-N 3.49Å; P148-R152 VanDerWaalsContact O-N 3.14Å; E149-R152 PolarHBondContact O-N 2.94Å; E149-R152 IonicContact OE1-CZ 3.37Å; E149-R152 VanDerWaalsContact OE1-CZ 3.25Å; E149-R152 IonicContact OE1-NH1 3.38Å; E149-R152 PolarHBondContact OE1-NH1 3.05Å; E149-R152 IonicContact OE1-NH2 3.57Å; E149-R152 PolarHBondContact OE1-NH2 2.9Å; R152-S156 WeakPolarHBondContact O-CB 3.35Å; R152-S156 PolarHBondContact O-N 2.87Å |
| 153 | K | 94.8 | Very high | 95.3 | Very high | 140 Ų | 140 | 83.7 Ų | 83.7 | 61% | 0.609 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -63.1 | -51.6 | -179.4 | -173.6 | -175.2 | 178.4 | -60.7 | 0 | 111.1 | Q151 A155 S156 D157 | Q151-K153 VanDerWaalsContact C-N 3.27Å; Q151-K153 PolarHBondContact O-N 3.45Å; K153-A155 VanDerWaalsContact C-N 3.34Å; K153-A155 PolarHBondContact O-N 2.83Å; K153-S156 PolarHBondContact O-N 3.3Å; K153-D157 IonicContact NZ-OD1 2.74Å; K153-D157 IonicContact NZ-OD2 2.78Å; K153-D157 PolarHBondContact NZ-OD2 2.96Å; K153-D157 VanDerWaalsContact O-CG 3.31Å; K153-D157 PolarHBondContact O-N 3Å |
| 154 | T | 94.9 | Very high | 95.4 | Very high | 94 Ų | 94 | 83.5 Ų | 83.5 | 58% | 0.577 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -64.3 | -41.4 | -179.4 | -55.1 | 0 | 0 | 0 | 0 | 111.1 | Q151 D157 T158 | Q151-T154 PolarHBondContact O-N 3.33Å; T154-D157 PolarHBondContact O-N 3.46Å; T154-T158 WeakPolarHBondContact O-CG2 3.43Å; T154-T158 PolarHBondContact O-N 3.23Å; T154-T158 VanDerWaalsContact O-N 3.1Å; T154-T158 PolarHBondContact O-OG1 2.97Å |
| 155 | A | 95.7 | Very high | 95.6 | Very high | 15 Ų | 15 | 88.5 Ų | 88.5 | 12% | 0.124 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -60.9 | -45.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | V144 M147 Q151 K153 D157 T158 N159 | V144-A155 HydrophobicContact CG2-CB 4.14Å; M147-A155 HydrophobicContact SD-CB 4.01Å; Q151-A155 PolarHBondContact O-N 3.29Å; K153-A155 VanDerWaalsContact C-N 3.34Å; K153-A155 PolarHBondContact O-N 2.83Å; A155-D157 PolarHBondContact O-N 3.34Å; A155-T158 PolarHBondContact O-N 3.4Å; A155-T158 PolarHBondContact O-OG1 3.14Å; A155-N159 WeakPolarHBondContact O-CB 3.29Å; A155-N159 PolarHBondContact O-N 3.42Å; A155-N159 PolarHBondContact O-OD1 2.91Å |
| 156 | S | 95.4 | Very high | 95.8 | Very high | 52 Ų | 52 | 83.5 Ų | 83.5 | 36% | 0.364 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -60.1 | -43.3 | 176.8 | -175.1 | 0 | 0 | 0 | 0 | 112.3 | R152 K153 N159 M160 | R152-S156 WeakPolarHBondContact O-CB 3.35Å; R152-S156 PolarHBondContact O-N 2.87Å; K153-S156 PolarHBondContact O-N 3.3Å; S156-N159 PolarHBondContact O-N 3.38Å; S156-M160 WeakPolarHBondContact O-CG 3.45Å; S156-M160 PolarHBondContact O-N 2.93Å |
| 157 | D | 96.5 | Very high | 96.1 | Very high | 76 Ų | 76 | 79.3 Ų | 79.3 | 41% | 0.406 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -60.1 | -48.2 | 177.5 | -69 | -20.1 | 0 | 0 | 0 | 109.8 | K153 T154 A155 N159 M160 D161 | K153-D157 IonicContact NZ-OD1 2.74Å; K153-D157 IonicContact NZ-OD2 2.78Å; K153-D157 PolarHBondContact NZ-OD2 2.96Å; K153-D157 VanDerWaalsContact O-CG 3.31Å; K153-D157 PolarHBondContact O-N 3Å; T154-D157 PolarHBondContact O-N 3.46Å; A155-D157 PolarHBondContact O-N 3.34Å; D157-N159 VanDerWaalsContact C-N 3.29Å; D157-N159 PolarHBondContact O-N 2.85Å; D157-M160 PolarHBondContact O-N 3Å; D157-D161 PolarHBondContact O-N 3.38Å |
| 158 | T | 96.8 | Very high | 96.3 | Very high | 64 Ų | 64 | 83.3 Ų | 83.3 | 39% | 0.393 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -65.6 | -30.3 | 176.7 | 62.9 | 0 | 0 | 0 | 0 | 113.8 | T154 A155 D161 K162 | T154-T158 WeakPolarHBondContact O-CG2 3.43Å; T154-T158 PolarHBondContact O-N 3.23Å; T154-T158 VanDerWaalsContact O-N 3.1Å; T154-T158 PolarHBondContact O-OG1 2.97Å; A155-T158 PolarHBondContact O-N 3.4Å; A155-T158 PolarHBondContact O-OG1 3.14Å; T158-D161 PolarHBondContact O-N 3.41Å; T158-K162 WeakPolarHBondContact O-CG 3.2Å; T158-K162 PolarHBondContact O-N 2.9Å |
| 159 | N | 97.3 | Very high | 96.5 | Very high | 10 Ų | 10 | 84.5 Ų | 84.5 | 5% | 0.053 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -73.4 | -36.6 | 179 | -74.9 | -6.4 | 0 | 0 | 0 | 111.4 | L140 V144 A155 S156 D157 D161 K162 L163 | L140-N159 HydrophobicContact CB-CB 4.26Å; L140-N159 HydrophobicContact CD1-CB 3.94Å; L140-N159 WeakPolarHBondContact CD2-OD1 3.22Å; L140-N159 HydrophobicContact CG-CB 4.47Å; L140-N159 PolarHBondContact O-ND2 3.48Å; V144-N159 VanDerWaalsContact CG2-ND2 3.29Å; V144-N159 WeakPolarHBondContact CG2-ND2 3.36Å; A155-N159 WeakPolarHBondContact O-CB 3.29Å; A155-N159 PolarHBondContact O-N 3.42Å; A155-N159 PolarHBondContact O-OD1 2.91Å; S156-N159 PolarHBondContact O-N 3.38Å; D157-N159 VanDerWaalsContact C-N 3.29Å; D157-N159 PolarHBondContact O-N 2.85Å; N159-D161 VanDerWaalsContact C-N 3.31Å; N159-D161 PolarHBondContact O-N 3.07Å; N159-K162 PolarHBondContact O-N 3.31Å; N159-K162 PolarHBondContact OD1-NZ 3.49Å; N159-L163 WeakPolarHBondContact O-CG 3.29Å; N159-L163 PolarHBondContact O-N 2.94Å |
| 160 | M | 97.5 | Very high | 96.7 | Very high | 94 Ų | 94 | 78.2 Ų | 78.2 | 46% | 0.463 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -60.5 | -41.4 | 171.7 | -73.5 | -56.9 | -57.3 | 0 | 0 | 111.7 | S156 D157 K162 L163 L164 | S156-M160 WeakPolarHBondContact O-CG 3.45Å; S156-M160 PolarHBondContact O-N 2.93Å; D157-M160 PolarHBondContact O-N 3Å; M160-K162 PolarHBondContact O-N 3.34Å; M160-L163 PolarHBondContact O-N 3.35Å; M160-L163 HydrophobicContact SD-CD1 4.27Å; M160-L164 WeakPolarHBondContact O-CB 3.33Å; M160-L164 VanDerWaalsContact O-CG 3.29Å; M160-L164 WeakPolarHBondContact O-CG 3.45Å; M160-L164 PolarHBondContact O-N 3.47Å |
| 161 | D | 97.8 | Very high | 96.8 | Very high | 110 Ų | 110 | 74.7 Ų | 74.7 | 59% | 0.588 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -60.5 | -44.3 | 176.6 | -65.9 | -29.6 | 0 | 0 | 0 | 111.9 | D157 T158 N159 L163 L164 F165 | D157-D161 PolarHBondContact O-N 3.38Å; T158-D161 PolarHBondContact O-N 3.41Å; N159-D161 VanDerWaalsContact C-N 3.31Å; N159-D161 PolarHBondContact O-N 3.07Å; D161-L163 VanDerWaalsContact C-N 3.33Å; D161-L163 PolarHBondContact O-N 3.48Å; D161-L164 PolarHBondContact O-N 3.25Å; D161-F165 WeakPolarHBondContact O-CB 3.49Å; D161-F165 PolarHBondContact O-N 3.19Å |
| 162 | K | 97.6 | Very high | 96.9 | Very high | 88 Ų | 88 | 72.7 Ų | 72.7 | 38% | 0.383 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -60.7 | -42.8 | 176 | -65.4 | 169.8 | -168.7 | 161.6 | 0 | 111.8 | L140 T158 N159 M160 N166 | L140-K162 HydrophobicContact CD1-CB 4.35Å; L140-K162 HydrophobicContact CD1-CD 4.26Å; L140-K162 HydrophobicContact CD2-CD 4.27Å; T158-K162 WeakPolarHBondContact O-CG 3.2Å; T158-K162 PolarHBondContact O-N 2.9Å; N159-K162 PolarHBondContact O-N 3.31Å; N159-K162 PolarHBondContact OD1-NZ 3.49Å; M160-K162 PolarHBondContact O-N 3.34Å; K162-N166 PolarHBondContact O-N 3.01Å; K162-N166 VanDerWaalsContact O-N 3.14Å; K162-N166 PolarHBondContact O-ND2 3.16Å |
| 163 | L | 98.1 | Very high | 96.8 | Very high | 26 Ų | 26 | 69.8 Ų | 69.8 | 14% | 0.136 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -66.9 | -44.9 | 179.8 | -71.6 | 170.7 | 0 | 0 | 0 | 111.4 | L133 L136 H137 L140 N159 M160 D161 F165 N166 L167 | L133-L163 HydrophobicContact CD1-CD2 3.79Å; L136-L163 HydrophobicContact CD2-CD2 4.33Å; L136-L163 HydrophobicContact CG-CD2 4.37Å; H137-L163 HydrophobicContact CB-CD2 4.11Å; L140-L163 HydrophobicContact CD1-CD2 4.3Å; L140-L163 HydrophobicContact CD1-CG 4.12Å; N159-L163 WeakPolarHBondContact O-CG 3.29Å; N159-L163 PolarHBondContact O-N 2.94Å; M160-L163 PolarHBondContact O-N 3.35Å; M160-L163 HydrophobicContact SD-CD1 4.27Å; D161-L163 VanDerWaalsContact C-N 3.33Å; D161-L163 PolarHBondContact O-N 3.48Å; L163-F165 VanDerWaalsContact C-N 3.33Å; L163-F165 PolarHBondContact O-N 3.2Å; L163-N166 PolarHBondContact O-N 3.44Å; L163-L167 VanDerWaalsContact O-CB 3.26Å; L163-L167 WeakPolarHBondContact O-CB 3.33Å; L163-L167 PolarHBondContact O-N 3.44Å |
| 164 | L | 98.1 | Very high | 96.7 | Very high | 96 Ų | 96 | 65.9 Ų | 65.9 | 50% | 0.503 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -61.7 | -42.3 | 177.4 | -71.9 | 172.8 | 0 | 0 | 0 | 111.5 | M160 D161 L167 E168 | M160-L164 WeakPolarHBondContact O-CB 3.33Å; M160-L164 VanDerWaalsContact O-CG 3.29Å; M160-L164 WeakPolarHBondContact O-CG 3.45Å; M160-L164 PolarHBondContact O-N 3.47Å; D161-L164 PolarHBondContact O-N 3.25Å; L164-L167 PolarHBondContact O-N 3.42Å; L164-E168 WeakPolarHBondContact O-CB 3.34Å; L164-E168 PolarHBondContact O-N 3.44Å |
| 165 | F | 98 | Very high | 96.5 | Very high | 132 Ų | 132 | 66.6 Ų | 66.6 | 58% | 0.579 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -60.2 | -50.2 | 176.2 | 178.3 | -94.4 | 0 | 0 | 0 | 112.6 | D161 L163 L167 E168 E169 | D161-F165 WeakPolarHBondContact O-CB 3.49Å; D161-F165 PolarHBondContact O-N 3.19Å; L163-F165 VanDerWaalsContact C-N 3.33Å; L163-F165 PolarHBondContact O-N 3.2Å; F165-L167 VanDerWaalsContact C-N 3.27Å; F165-L167 PolarHBondContact O-N 3.05Å; F165-E168 PolarHBondContact O-N 3.47Å; F165-E169 PolarHBondContact O-N 3.41Å |
| 166 | N | 98.1 | Very high | 96.2 | Very high | 27 Ų | 27 | 72.8 Ų | 72.8 | 14% | 0.144 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -66.1 | -32.7 | 179 | -77.8 | -99.8 | 0 | 0 | 0 | 111.6 | L133 K162 L163 L170 | L133-N166 HydrophobicContact CD1-CB 3.87Å; K162-N166 PolarHBondContact O-N 3.01Å; K162-N166 VanDerWaalsContact O-N 3.14Å; K162-N166 PolarHBondContact O-ND2 3.16Å; L163-N166 PolarHBondContact O-N 3.44Å; N166-L170 WeakPolarHBondContact O-CB 3.47Å; N166-L170 PolarHBondContact O-N 3.32Å |
| 167 | L | 98.3 | Very high | 95.7 | Very high | 88 Ų | 88 | 71.5 Ų | 71.5 | 46% | 0.461 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -68.3 | -39.6 | 176.1 | -172.9 | 69 | 0 | 0 | 0 | 111.9 | L133 L163 L164 F165 L170 S171 | L133-L167 HydrophobicContact CD2-CB 4.36Å; L133-L167 HydrophobicContact CD2-CD1 3.8Å; L163-L167 VanDerWaalsContact O-CB 3.26Å; L163-L167 WeakPolarHBondContact O-CB 3.33Å; L163-L167 PolarHBondContact O-N 3.44Å; L164-L167 PolarHBondContact O-N 3.42Å; F165-L167 VanDerWaalsContact C-N 3.27Å; F165-L167 PolarHBondContact O-N 3.05Å; L167-L170 PolarHBondContact O-N 3.31Å; L167-S171 WeakPolarHBondContact O-CB 3.26Å; L167-S171 PolarHBondContact O-N 3.28Å |
| 168 | E | 97.9 | Very high | 94.7 | Very high | 131 Ų | 131 | 72.2 Ų | 72.2 | 61% | 0.612 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -63.5 | -43 | 174.7 | -176.9 | 177.4 | -170 | 0 | 0 | 111.6 | L164 F165 S171 S172 | L164-E168 WeakPolarHBondContact O-CB 3.34Å; L164-E168 PolarHBondContact O-N 3.44Å; F165-E168 PolarHBondContact O-N 3.47Å; E168-S171 PolarHBondContact O-N 3.22Å; E168-S172 WeakPolarHBondContact O-CB 3.4Å; E168-S172 PolarHBondContact O-N 3.03Å; E168-S172 PolarHBondContact O-OG 3.46Å |
| 169 | E | 97.4 | Very high | 93.5 | Very high | 89 Ų | 89 | 74.1 Ų | 74.1 | 42% | 0.416 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -60.3 | -48.1 | 175.2 | -160.5 | -170.4 | -179.8 | 0 | 0 | 110.8 | M129 F165 S171 S172 S173 | M129-E169 HydrophobicContact CE-CB 3.69Å; M129-E169 HydrophobicContact CE-CG 3.53Å; F165-E169 PolarHBondContact O-N 3.41Å; E169-S171 PolarHBondContact O-N 2.97Å; E169-S172 WeakPolarHBondContact O-CB 3.26Å; E169-S172 PolarHBondContact O-N 3.28Å; E169-S173 PolarHBondContact O-N 3.24Å; E169-S173 PolarHBondContact O-OG 2.85Å |
| 170 | L | 97.6 | Very high | 91.7 | Very high | 13 Ų | 13 | 74.3 Ų | 74.3 | 7% | 0.068 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -59.9 | -45.5 | 177 | 171.6 | 62.5 | 0 | 0 | 0 | 111.5 | V126 M129 Q130 L133 N166 L167 S172 S173 I174 | V126-L170 HydrophobicContact CG1-CD1 3.97Å; M129-L170 HydrophobicContact CB-CD1 3.75Å; M129-L170 HydrophobicContact CE-CB 4.08Å; M129-L170 VanDerWaalsContact CE-N 3.34Å; M129-L170 HydrophobicContact SD-CD1 4.48Å; Q130-L170 HydrophobicContact CG-CD1 3.86Å; Q130-L170 HydrophobicContact CG-CD2 3.74Å; Q130-L170 HydrophobicContact CG-CG 4.47Å; L133-L170 HydrophobicContact CD2-CD2 4.14Å; N166-L170 WeakPolarHBondContact O-CB 3.47Å; N166-L170 PolarHBondContact O-N 3.32Å; L167-L170 PolarHBondContact O-N 3.31Å; L170-S172 VanDerWaalsContact C-N 3.29Å; L170-S172 PolarHBondContact O-N 2.87Å; L170-S173 PolarHBondContact O-N 3.47Å; L170-I174 HydrophobicContact CD1-CD1 3.9Å; L170-I174 HydrophobicContact CD1-CG1 4.24Å; L170-I174 HydrophobicContact CG-CD1 3.98Å; L170-I174 WeakPolarHBondContact O-CG1 3.37Å; L170-I174 PolarHBondContact O-N 3.44Å |
| 171 | S | 96.8 | Very high | 89.8 | Confident | 52 Ų | 52 | 75 Ų | 75 | 36% | 0.364 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -58.7 | -42.9 | 176.4 | 174.7 | 0 | 0 | 0 | 0 | 111.2 | L167 E168 E169 S173 I174 Q175 | L167-S171 WeakPolarHBondContact O-CB 3.26Å; L167-S171 PolarHBondContact O-N 3.28Å; E168-S171 PolarHBondContact O-N 3.22Å; E169-S171 PolarHBondContact O-N 2.97Å; S171-S173 PolarHBondContact O-N 2.8Å; S171-I174 PolarHBondContact O-N 3.37Å; S171-Q175 VanDerWaalsContact O-CG 3.29Å; S171-Q175 WeakPolarHBondContact O-CG 3.06Å; S171-Q175 PolarHBondContact O-N 2.9Å; S171-Q175 PolarHBondContact OG-NE2 3.28Å |
| 172 | S | 95.4 | Very high | 87.8 | Confident | 48 Ų | 48 | 74.9 Ų | 74.9 | 34% | 0.336 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -63.1 | -41.6 | 177.4 | -61.3 | 0 | 0 | 0 | 0 | 112.1 | E168 E169 L170 Q175 K176 | E168-S172 WeakPolarHBondContact O-CB 3.4Å; E168-S172 PolarHBondContact O-N 3.03Å; E168-S172 PolarHBondContact O-OG 3.46Å; E169-S172 WeakPolarHBondContact O-CB 3.26Å; E169-S172 PolarHBondContact O-N 3.28Å; L170-S172 VanDerWaalsContact C-N 3.29Å; L170-S172 PolarHBondContact O-N 2.87Å; S172-Q175 PolarHBondContact O-N 2.99Å; S172-K176 WeakPolarHBondContact O-CG 3.43Å; S172-K176 PolarHBondContact O-N 3.14Å |
| 173 | S | 93.9 | Very high | 85.6 | Confident | 20 Ų | 20 | 77.6 Ų | 77.6 | 14% | 0.14 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -64.6 | -40.8 | 175.7 | -67.9 | 0 | 0 | 0 | 0 | 112.5 | E169 L170 S171 K176 L177 | E169-S173 PolarHBondContact O-N 3.24Å; E169-S173 PolarHBondContact O-OG 2.85Å; L170-S173 PolarHBondContact O-N 3.47Å; S171-S173 PolarHBondContact O-N 2.8Å; S173-K176 PolarHBondContact O-N 3.15Å; S173-L177 PolarHBondContact O-N 3.44Å; S173-L177 VanDerWaalsContact O-N 3.15Å |
| 174 | I | 92.8 | Very high | 83.2 | Confident | 59 Ų | 59 | 82.2 Ų | 82.2 | 30% | 0.303 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -66.1 | -40.4 | 175.1 | -67.7 | 167.6 | 0 | 0 | 0 | 111.3 | V126 L170 S171 K176 L177 N178 | V126-I174 HydrophobicContact CG1-CD1 4.17Å; V126-I174 HydrophobicContact CG1-CG1 3.69Å; V126-I174 HydrophobicContact CG2-CG1 4.18Å; L170-I174 HydrophobicContact CD1-CD1 3.9Å; L170-I174 HydrophobicContact CD1-CG1 4.24Å; L170-I174 HydrophobicContact CG-CD1 3.98Å; L170-I174 WeakPolarHBondContact O-CG1 3.37Å; L170-I174 PolarHBondContact O-N 3.44Å; S171-I174 PolarHBondContact O-N 3.37Å; I174-K176 VanDerWaalsContact C-N 3.33Å; I174-K176 PolarHBondContact O-N 3.22Å; I174-L177 WeakPolarHBondContact O-CB 3.45Å; I174-L177 PolarHBondContact O-N 2.93Å; I174-N178 PolarHBondContact O-N 2.95Å; I174-N178 VanDerWaalsContact O-N 3.1Å; I174-N178 PolarHBondContact O-ND2 3.26Å |
| 175 | Q | 90.6 | Very high | 80.7 | Confident | 109 Ų | 109 | 84.8 Ų | 84.8 | 51% | 0.509 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -61.7 | -43 | 176.3 | -74.4 | 174 | 21.9 | 0 | 0 | 111.4 | S171 S172 L177 N178 L179 | S171-Q175 VanDerWaalsContact O-CG 3.29Å; S171-Q175 WeakPolarHBondContact O-CG 3.06Å; S171-Q175 PolarHBondContact O-N 2.9Å; S171-Q175 PolarHBondContact OG-NE2 3.28Å; S172-Q175 PolarHBondContact O-N 2.99Å; Q175-L177 VanDerWaalsContact C-N 3.31Å; Q175-L177 PolarHBondContact O-N 3.37Å; Q175-N178 PolarHBondContact O-N 3.27Å; Q175-N178 VanDerWaalsContact O-N 3.16Å; Q175-L179 WeakPolarHBondContact O-CD1 3.42Å; Q175-L179 WeakPolarHBondContact O-CG 3.18Å; Q175-L179 PolarHBondContact O-N 2.86Å |
| 176 | K | 88.1 | Confident | 78.2 | Confident | 145 Ų | 145 | 83.1 Ų | 83.1 | 63% | 0.63 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -58.2 | -41.6 | 175 | -72.6 | 172.2 | -175.7 | 175.2 | 0 | 112.3 | S172 S173 I174 L179 A180 | S172-K176 WeakPolarHBondContact O-CG 3.43Å; S172-K176 PolarHBondContact O-N 3.14Å; S173-K176 PolarHBondContact O-N 3.15Å; I174-K176 VanDerWaalsContact C-N 3.33Å; I174-K176 PolarHBondContact O-N 3.22Å; K176-L179 PolarHBondContact O-N 3.2Å; K176-A180 PolarHBondContact O-N 3Å |
| 177 | L | 84.8 | Confident | 75.8 | Confident | 25 Ų | 25 | 93.2 Ų | 93.2 | 13% | 0.131 | 47% | 0.472 | C | S | . | . | H | α-helix | trans | -60.1 | -45.2 | 174 | -75.5 | 178.9 | 0 | 0 | 0 | 112.3 | Q122 M123 V126 S173 I174 Q175 L179 A180 D181 | Q122-L177 HydrophobicContact CB-CD2 3.5Å; Q122-L177 VanDerWaalsContact CB-CD2 3.5Å; Q122-L177 HydrophobicContact CG-CD2 4.47Å; M123-L177 HydrophobicContact CG-CD1 4.37Å; V126-L177 HydrophobicContact CB-CD1 4.24Å; V126-L177 HydrophobicContact CG2-CD1 3.55Å; V126-L177 HydrophobicContact CG2-CG 4.44Å; S173-L177 PolarHBondContact O-N 3.44Å; S173-L177 VanDerWaalsContact O-N 3.15Å; I174-L177 WeakPolarHBondContact O-CB 3.45Å; I174-L177 PolarHBondContact O-N 2.93Å; Q175-L177 VanDerWaalsContact C-N 3.31Å; Q175-L177 PolarHBondContact O-N 3.37Å; L177-L179 VanDerWaalsContact C-N 3.34Å; L177-L179 PolarHBondContact O-N 3.48Å; L177-A180 WeakPolarHBondContact O-CB 3.44Å; L177-A180 PolarHBondContact O-N 2.82Å; L177-D181 PolarHBondContact O-N 3.46Å |
| 178 | N | 76 | Confident | 73 | Confident | 91 Ų | 91 | 97.2 Ų | 97.2 | 49% | 0.487 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -67.7 | -32.6 | -179.9 | -69.7 | -64.5 | 0 | 0 | 0 | 113 | I174 Q175 D181 T182 | I174-N178 PolarHBondContact O-N 2.95Å; I174-N178 VanDerWaalsContact O-N 3.1Å; I174-N178 PolarHBondContact O-ND2 3.26Å; Q175-N178 PolarHBondContact O-N 3.27Å; Q175-N178 VanDerWaalsContact O-N 3.16Å; N178-D181 PolarHBondContact O-N 3.1Å; N178-T182 PolarHBondContact O-OG1 2.76Å |
| 179 | L | 71.4 | Confident | 70.5 | Confident | 103 Ų | 103 | 95.2 Ų | 95.2 | 54% | 0.539 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -69.6 | -36.1 | 178 | -76.9 | 152.1 | 0 | 0 | 0 | 112.1 | Q175 K176 L177 D181 T182 Q183 | Q175-L179 WeakPolarHBondContact O-CD1 3.42Å; Q175-L179 WeakPolarHBondContact O-CG 3.18Å; Q175-L179 PolarHBondContact O-N 2.86Å; K176-L179 PolarHBondContact O-N 3.2Å; L177-L179 VanDerWaalsContact C-N 3.34Å; L177-L179 PolarHBondContact O-N 3.48Å; L179-D181 VanDerWaalsContact C-N 3.3Å; L179-D181 PolarHBondContact O-N 3.28Å; L179-T182 PolarHBondContact O-N 3.3Å; L179-Q183 PolarHBondContact O-N 2.95Å |
| 180 | A | 59.8 | Low | 67.9 | Low | 14 Ų | 14 | 97.6 Ų | 97.6 | 12% | 0.116 | 52% | 0.517 | C | S | . | . | H | α-helix | trans | -60.3 | -38.3 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | E117 K176 L177 T182 | E117-A180 HydrophobicContact CB-CB 3.5Å; E117-A180 VanDerWaalsContact O-CB 3.23Å; E117-A180 WeakPolarHBondContact O-CB 3.29Å; K176-A180 PolarHBondContact O-N 3Å; L177-A180 WeakPolarHBondContact O-CB 3.44Å; L177-A180 PolarHBondContact O-N 2.82Å; A180-T182 PolarHBondContact O-N 3.22Å |
| 181 | D | 57.8 | Low | 65.4 | Low | 109 Ų | 109 | 106.8 Ų | 106.8 | 58% | 0.583 | 57% | 0.573 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.2 | -17.4 | 177.8 | -73.7 | -20.1 | 0 | 0 | 0 | 113.5 | L177 N178 L179 | L177-D181 PolarHBondContact O-N 3.46Å; N178-D181 PolarHBondContact O-N 3.1Å; L179-D181 VanDerWaalsContact C-N 3.3Å; L179-D181 PolarHBondContact O-N 3.28Å |
| 182 | T | 55.2 | Low | 63.8 | Low | 108 Ų | 108 | 109.5 Ų | 109.5 | 66% | 0.663 | 58% | 0.583 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102 | -14.1 | -171.8 | -37.2 | 0 | 0 | 0 | 0 | 113.8 | N178 L179 A180 | N178-T182 PolarHBondContact O-OG1 2.76Å; L179-T182 PolarHBondContact O-N 3.3Å; A180-T182 PolarHBondContact O-N 3.22Å |
| 183 | Q | 52 | Low | 62.2 | Low | 145 Ų | 145 | 112.7 Ų | 112.7 | 68% | 0.678 | 60% | 0.596 | S | S | * | * | S | Bend | trans | -83.4 | -12 | -175.8 | -79.7 | -166.9 | 60.8 | 0 | 0 | 115.5 | L179 | L179-Q183 PolarHBondContact O-N 2.95Š|
| 184 | E | 48.2 | Very low | 60.4 | Low | 123 Ų | 123 | 117.9 Ų | 117.9 | 58% | 0.575 | 62% | 0.622 | S | S | * | * | trans | -106.5 | 61.3 | -179.8 | -71.1 | -150.6 | 165.8 | 0 | 0 | 114.8 | P186 | E184-P186 VanDerWaalsContact C-CD 3.41Š| ||
| 185 | I | 45.8 | Very low | 58.5 | Low | 149 Ų | 149 | 121.4 Ų | 121.4 | 76% | 0.764 | 64% | 0.641 | S | S | * | * | trans | -116.1 | 80.5 | 147.3 | -48.9 | 174.3 | 0 | 0 | 0 | 108.7 | R187 | I185-R187 PolarHBondContact O-N 3.37Š| ||
| 186 | P | 45.7 | Very low | 56.5 | Low | 97 Ų | 97 | 122.1 Ų | 122.1 | 63% | 0.63 | 65% | 0.649 | S | S | * | * | trans | -63.2 | 111.7 | 157.3 | -9.2 | 25.3 | 0 | 0 | 0 | 106.7 | E184 M188 | E184-P186 VanDerWaalsContact C-CD 3.41Å; P186-M188 PolarHBondContact O-N 3.33Å | ||
| 187 | R | 46.3 | Very low | 54.4 | Low | 239 Ų | 239 | 120.6 Ų | 120.6 | 90% | 0.902 | 65% | 0.65 | S | S | * | * | trans | -56.6 | 94.3 | 159.2 | -73.9 | -174.3 | 178.2 | 166 | 0.3 | 106.9 | I185 A189 | I185-R187 PolarHBondContact O-N 3.37Å; R187-A189 VanDerWaalsContact C-N 3.26Å; R187-A189 PolarHBondContact O-N 3.49Å | ||
| 188 | M | 39.7 | Very low | 52.2 | Low | 172 Ų | 172 | 127.4 Ų | 127.4 | 85% | 0.847 | 69% | 0.687 | S | S | * | * | trans | -65.5 | 98.3 | 163.1 | -68.9 | -171.8 | 67.6 | 0 | 0 | 106.2 | P186 T190 | P186-M188 PolarHBondContact O-N 3.33Å; M188-T190 PolarHBondContact O-N 3.34Å; M188-T190 VanDerWaalsContact O-N 3.13Å | ||
| 189 | A | 46.3 | Very low | 50.4 | Low | 89 Ų | 89 | 130.2 Ų | 130.2 | 74% | 0.736 | 70% | 0.703 | S | S | * | * | trans | -58.4 | 113.7 | 168.2 | 0 | 0 | 0 | 0 | 0 | 107.5 | R187 V191 | R187-A189 VanDerWaalsContact C-N 3.26Å; R187-A189 PolarHBondContact O-N 3.49Å; A189-V191 PolarHBondContact O-N 2.74Å | ||
| 190 | T | 42.2 | Very low | 48.7 | Very low | 140 Ų | 140 | 132.5 Ų | 132.5 | 86% | 0.859 | 72% | 0.716 | S | S | * | * | trans | -56.6 | 123.3 | 168.5 | -38.8 | 0 | 0 | 0 | 0 | 108.5 | M188 | M188-T190 PolarHBondContact O-N 3.34Å; M188-T190 VanDerWaalsContact O-N 3.13Å | ||
| 191 | V | 44.9 | Very low | 47.6 | Very low | 205 Ų | 205 | 143.3 Ų | 143.3 | 100% | 1.242 | 77% | 0.771 | S | S | * | * | trans | -79.3 | 0 | 164.4 | 177.5 | 0 | 0 | 0 | 0 | 108.9 | A189 | A189-V191 PolarHBondContact O-N 2.74Š|
Retrieved 191 of 191 residues in 58.6 ms
(Link to these results)