| 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 | 46.3 | Very low | 53 | Low | 241 Ų | 241 | 173.6 Ų | 173.6 | 100% | 1.187 | 88% | 0.881 | S | S | * | * | 0 | 79.1 | 0 | -69.9 | 170 | 166 | 0 | 0 | 105.5 | |||||
| 2 | E | 44.5 | Very low | 53 | Low | 191 Ų | 191 | 167.8 Ų | 167.8 | 89% | 0.893 | 87% | 0.868 | S | S | * | * | 45.2 | 114.4 | 67.5 | -89.9 | -76.4 | 102.4 | 0 | 0 | 111.6 | |||||
| 3 | G | 45.3 | Very low | 53.1 | Low | 76 Ų | 76 | 163.3 Ų | 163.3 | 78% | 0.784 | 86% | 0.856 | S | S | * | * | trans | 169 | 56.6 | 178.9 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 4 | S | 55.7 | Low | 52.4 | Low | 107 Ų | 107 | 160.4 Ų | 160.4 | 75% | 0.748 | 86% | 0.856 | S | S | * | * | trans | -66.7 | 158.9 | 165.8 | -74 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 5 | R | 56.4 | Low | 52.5 | Low | 252 Ų | 252 | 157.8 Ų | 157.8 | 95% | 0.951 | 85% | 0.849 | S | S | * | * | trans | 137.3 | 114 | 151.9 | -75.5 | 160.2 | -168.5 | -162.5 | 5.3 | 108.5 | ||||
| 6 | G | 55.3 | Low | 52.5 | Low | 73 Ų | 73 | 159.2 Ų | 159.2 | 75% | 0.753 | 86% | 0.855 | S | S | * | * | cis | 98.9 | 96.5 | 30.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 7 | Q | 61.9 | Low | 52.4 | Low | 207 Ų | 207 | 163.3 Ų | 163.3 | 97% | 0.967 | 86% | 0.855 | S | S | * | * | trans | -141.5 | 122.8 | 158.6 | -71.6 | -164.4 | 69.1 | 0 | 0 | 111.2 | ||||
| 8 | K | 54 | Low | 52.4 | Low | 202 Ų | 202 | 166.6 Ų | 166.6 | 88% | 0.878 | 85% | 0.854 | S | S | * | * | trans | -75.9 | 145.6 | 173.9 | -75.8 | 165.7 | 166.8 | 170.2 | 0 | 110.5 | ||||
| 9 | T | 62.8 | Low | 52.7 | Low | 131 Ų | 131 | 163.8 Ų | 163.8 | 80% | 0.804 | 85% | 0.848 | S | S | * | * | trans | -154.6 | 111.9 | 142.2 | 31.2 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 10 | K | 54 | Low | 52.8 | Low | 190 Ų | 190 | 161.8 Ų | 161.8 | 83% | 0.826 | 85% | 0.846 | S | S | * | * | trans | 50.2 | 112.3 | 134.7 | -55.9 | -175.1 | -179.9 | -178.8 | 0 | 118.6 | ||||
| 11 | R | 46.8 | Very low | 52.9 | Low | 240 Ų | 240 | 162.3 Ų | 162.3 | 91% | 0.906 | 84% | 0.844 | S | S | * | * | 46 | 124.2 | 86.6 | -75.4 | -168.1 | -174.7 | -154.7 | 2.2 | 112.5 | |||||
| 12 | S | 53.1 | Low | 53.5 | Low | 103 Ų | 103 | 160.4 Ų | 160.4 | 72% | 0.72 | 83% | 0.829 | S | S | * | * | cis | -161.2 | -146.9 | 12.7 | -65.5 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 13 | P | 54.6 | Low | 54.2 | Low | 110 Ų | 110 | 157.4 Ų | 157.4 | 71% | 0.714 | 83% | 0.826 | S | S | * | * | -103.1 | 165.9 | -124.1 | 31.1 | -9.2 | 0 | 0 | 0 | 113.2 | |||||
| 14 | S | 42.4 | Very low | 54.7 | Low | 123 Ų | 123 | 164.3 Ų | 164.3 | 86% | 0.86 | 83% | 0.829 | S | S | * | * | trans | -134.4 | 92.1 | 166.1 | -64.1 | 0 | 0 | 0 | 0 | 109.7 | L16 | S14-L16 PolarHBondContact O-N 3.03Š| ||
| 15 | T | 54.9 | Low | 53.9 | Low | 121 Ų | 121 | 166.4 Ų | 166.4 | 74% | 0.742 | 83% | 0.831 | S | S | * | * | trans | -53.3 | 112.9 | 162.9 | 28.8 | 0 | 0 | 0 | 0 | 109.9 | R17 | T15-R17 PolarHBondContact O-N 3.18Š| ||
| 16 | L | 52.2 | Low | 53.5 | Low | 180 Ų | 180 | 160.6 Ų | 160.6 | 94% | 0.942 | 82% | 0.818 | S | S | * | * | trans | -66.7 | 97 | 167.5 | -168.7 | 73.7 | 0 | 0 | 0 | 108.5 | S14 | S14-L16 PolarHBondContact O-N 3.03Š| ||
| 17 | R | 50.1 | Low | 52.8 | Low | 229 Ų | 229 | 164.2 Ų | 164.2 | 86% | 0.864 | 82% | 0.819 | S | S | * | * | trans | -75.5 | 122.6 | 172.3 | -78.6 | -170 | 170.4 | -136.3 | 0.9 | 110 | T15 | T15-R17 PolarHBondContact O-N 3.18Š| ||
| 18 | R | 53 | Low | 52.3 | Low | 222 Ų | 222 | 159.7 Ų | 159.7 | 84% | 0.838 | 81% | 0.806 | S | S | * | * | trans | -66.7 | 153.3 | 165.3 | -84.9 | 179.1 | 161.9 | -169.4 | -4.3 | 112 | ||||
| 19 | P | 58 | Low | 51.9 | Low | 114 Ų | 114 | 161.2 Ų | 161.2 | 74% | 0.74 | 81% | 0.806 | S | S | * | * | trans | -109.3 | 167.9 | 145.3 | 15.9 | 3.2 | 0 | 0 | 0 | 112.7 | ||||
| 20 | P | 54.1 | Low | 50.8 | Low | 124 Ų | 124 | 162.6 Ų | 162.6 | 81% | 0.805 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -98.7 | 154.4 | -135.9 | 36.8 | -36.3 | 0 | 0 | 0 | 115.6 | ||
| 21 | Q | 55.7 | Low | 50.3 | Low | 172 Ų | 172 | 158 Ų | 158 | 80% | 0.804 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -80.5 | 138.6 | 168.2 | -66.8 | -160.6 | -15.3 | 0 | 0 | 111.1 | ||
| 22 | K | 59.2 | Low | 50 | Low | 202 Ų | 202 | 157 Ų | 157 | 88% | 0.878 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 137.3 | 170.5 | -76.8 | 176.7 | 177 | 177.9 | 0 | 110.2 | ||
| 23 | P | 58.9 | Low | 49.6 | Very low | 127 Ų | 127 | 161 Ų | 161 | 83% | 0.825 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -76.1 | 136.7 | -177 | 28.1 | -32.1 | 0 | 0 | 0 | 112.7 | ||
| 24 | R | 55.5 | Low | 49.1 | Very low | 222 Ų | 222 | 163.4 Ų | 163.4 | 84% | 0.838 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 127.6 | 164 | -70.3 | 164.8 | 74.4 | 161.7 | 1.8 | 108.4 | ||
| 25 | N | 38.2 | Very low | 48.9 | Very low | 150 Ų | 150 | 166 Ų | 166 | 80% | 0.802 | 81% | 0.813 | S | S | * | * | trans | -92.9 | 104.4 | 167.4 | -159.4 | -12.8 | 0 | 0 | 0 | 108.8 | ||||
| 26 | I | 49.3 | Very low | 48.1 | Very low | 131 Ų | 131 | 165.1 Ų | 165.1 | 67% | 0.672 | 82% | 0.818 | S | S | * | * | trans | -109 | 114.1 | 162.9 | -73.9 | 167.1 | 0 | 0 | 0 | 104.8 | ||||
| 27 | L | 41.2 | Very low | 47.2 | Very low | 148 Ų | 148 | 160 Ų | 160 | 78% | 0.775 | 81% | 0.81 | S | S | * | * | trans | -151.8 | 93.7 | 163.1 | -156.5 | 72.2 | 0 | 0 | 0 | 107.6 | ||||
| 28 | T | 49.6 | Very low | 46.8 | Very low | 112 Ų | 112 | 159.3 Ų | 159.3 | 69% | 0.687 | 81% | 0.807 | S | S | * | * | 85.3 | 109.1 | 101.3 | -47.2 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 29 | R | 46.1 | Very low | 46.4 | Very low | 234 Ų | 234 | 156 Ų | 156 | 88% | 0.883 | 81% | 0.811 | S | S | * | * | trans | -62.7 | 130.5 | 158.5 | -70 | 167 | 101.7 | 142.6 | 1 | 107.3 | ||||
| 30 | D | 39.2 | Very low | 45.9 | Very low | 161 Ų | 161 | 156.7 Ų | 156.7 | 86% | 0.861 | 81% | 0.805 | S | S | * | * | trans | 178.7 | 161.2 | 130.4 | -93 | -45.7 | 0 | 0 | 0 | 111.1 | ||||
| 31 | A | 43.9 | Very low | 45.4 | Very low | 94 Ų | 94 | 160.5 Ų | 160.5 | 78% | 0.777 | 81% | 0.808 | S | S | * | * | trans | 92.2 | 81.9 | 168.8 | 0 | 0 | 0 | 0 | 0 | 117.8 | K33 | A31-K33 PolarHBondContact O-N 3.4Š| ||
| 32 | F | 41 | Very low | 44.5 | Very low | 218 Ų | 218 | 156.4 Ų | 156.4 | 96% | 0.956 | 81% | 0.812 | S | S | * | * | trans | -55.1 | 119.4 | 143 | -131.3 | -101 | 0 | 0 | 0 | 109.4 | ||||
| 33 | K | 43.9 | Very low | 43.7 | Very low | 187 Ų | 187 | 158.5 Ų | 158.5 | 81% | 0.813 | 82% | 0.815 | S | S | * | * | trans | -157.7 | 116.3 | 152.3 | -154.6 | 172.2 | 178.9 | -166.5 | 0 | 112.8 | A31 | A31-K33 PolarHBondContact O-N 3.4Š| ||
| 34 | E | 44.1 | Very low | 42.6 | Very low | 161 Ų | 161 | 159.2 Ų | 159.2 | 75% | 0.752 | 82% | 0.817 | S | S | * | * | trans | -22.5 | 133.9 | 152 | -166.8 | -160 | 118.8 | 0 | 0 | 116.3 | ||||
| 35 | Q | 39.2 | Very low | 42.1 | Very low | 176 Ų | 176 | 156.9 Ų | 156.9 | 82% | 0.822 | 82% | 0.815 | S | S | * | * | -167.7 | 141.4 | 127.8 | -108.1 | 161.1 | -13.4 | 0 | 0 | 114.2 | |||||
| 36 | A | 37.2 | Very low | 42.4 | Very low | 103 Ų | 103 | 153.9 Ų | 153.9 | 85% | 0.851 | 80% | 0.804 | S | S | * | * | trans | -74.6 | 165.3 | -173 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 37 | G | 34.9 | Very low | 41.7 | Very low | 74 Ų | 74 | 155.7 Ų | 155.7 | 76% | 0.763 | 81% | 0.809 | S | S | * | * | trans | 148.4 | 104.2 | 143.1 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 38 | R | 40.7 | Very low | 41.5 | Very low | 214 Ų | 214 | 157 Ų | 157 | 81% | 0.808 | 82% | 0.815 | S | S | * | * | trans | 89.8 | 96.9 | 131.7 | -138.8 | 178.7 | -154 | -152.9 | 5.5 | 118.6 | Q40 | R38-Q40 HydrophobicContact CG-CG 4.45Š| ||
| 39 | V | 44.2 | Very low | 40.9 | Very low | 152 Ų | 152 | 154.9 Ų | 154.9 | 92% | 0.921 | 82% | 0.816 | S | S | * | * | trans | -120.5 | 132.9 | 143.3 | 160.3 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 40 | Q | 48.8 | Very low | 40.6 | Very low | 129 Ų | 129 | 153.1 Ų | 153.1 | 60% | 0.603 | 82% | 0.818 | S | S | * | * | trans | -95.4 | 136.3 | -175.6 | -67.4 | -174.5 | 56.2 | 0 | 0 | 112 | R38 | R38-Q40 HydrophobicContact CG-CG 4.45Š| ||
| 41 | K | 43.6 | Very low | 40.7 | Very low | 204 Ų | 204 | 154.7 Ų | 154.7 | 89% | 0.887 | 82% | 0.82 | S | S | * | * | trans | 48.2 | 108.8 | 139.7 | -69.6 | -178.6 | 175.3 | 178 | 0 | 119.9 | ||||
| 42 | G | 36.9 | Very low | 40.5 | Very low | 86 Ų | 86 | 155.4 Ų | 155.4 | 89% | 0.887 | 82% | 0.819 | S | S | * | * | trans | -156.3 | 97.8 | 146.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 43 | R | 41.8 | Very low | 40.4 | Very low | 245 Ų | 245 | 153 Ų | 153 | 93% | 0.925 | 81% | 0.811 | S | S | * | * | trans | -103.2 | 119.5 | 179.7 | 172.9 | -172.9 | -169.3 | 168.6 | 4.3 | 108.3 | ||||
| 44 | V | 34.9 | Very low | 40.2 | Very low | 143 Ų | 143 | 149.9 Ų | 149.9 | 87% | 0.867 | 81% | 0.812 | S | S | * | * | trans | -152.6 | 117.8 | 142.7 | -177.3 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 45 | Q | 44.8 | Very low | 39.7 | Very low | 172 Ų | 172 | 148 Ų | 148 | 80% | 0.804 | 81% | 0.808 | S | S | * | * | trans | -106.3 | 177 | 153.6 | -106.2 | -173.4 | 58 | 0 | 0 | 106.3 | ||||
| 46 | P | 45.3 | Very low | 39.9 | Very low | 87 Ų | 87 | 148.3 Ų | 148.3 | 57% | 0.565 | 81% | 0.814 | S | S | * | * | cis | -121.7 | -173.2 | -5.1 | 11.7 | 17 | 0 | 0 | 0 | 108.9 | ||||
| 47 | Q | 34.5 | Very low | 39.7 | Very low | 169 Ų | 169 | 147.4 Ų | 147.4 | 79% | 0.79 | 82% | 0.815 | S | S | * | * | -172 | 134.5 | 53.3 | -40.1 | -102.1 | -24.9 | 0 | 0 | 105.4 | |||||
| 48 | I | 37.8 | Very low | 39.7 | Very low | 176 Ų | 176 | 149 Ų | 149 | 90% | 0.903 | 82% | 0.82 | S | S | * | * | trans | -132.5 | 120.5 | 158.5 | -61 | 179.5 | 0 | 0 | 0 | 107.1 | ||||
| 49 | G | 35.4 | Very low | 39.7 | Very low | 67 Ų | 67 | 143.1 Ų | 143.1 | 69% | 0.691 | 82% | 0.817 | S | S | * | * | trans | -65.6 | 148 | -173.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | Q51 | G49-Q51 PolarHBondContact O-N 3.13Š| ||
| 50 | Q | 41 | Very low | 39.5 | Very low | 198 Ų | 198 | 142 Ų | 142 | 93% | 0.925 | 81% | 0.811 | S | S | * | * | trans | -61.1 | 124.5 | 165.3 | -61.8 | 176.3 | -42.3 | 0 | 0 | 108.5 | ||||
| 51 | Q | 40 | Very low | 39 | Very low | 193 Ų | 193 | 142.7 Ų | 142.7 | 90% | 0.902 | 82% | 0.824 | S | S | * | * | trans | -108 | 100.5 | 172.4 | -156.3 | 163.2 | -36.8 | 0 | 0 | 109.5 | G49 | G49-Q51 PolarHBondContact O-N 3.13Š| ||
| 52 | S | 39.6 | Very low | 38.7 | Very low | 109 Ų | 109 | 138.2 Ų | 138.2 | 76% | 0.762 | 81% | 0.814 | S | S | * | * | trans | 5.4 | 116.3 | 156 | -55.5 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 53 | Q | 38.9 | Very low | 38.9 | Very low | 168 Ų | 168 | 142.8 Ų | 142.8 | 79% | 0.785 | 81% | 0.81 | S | S | * | * | trans | -48.4 | 126.8 | 147.5 | -169.1 | 173.9 | -2.3 | 0 | 0 | 111 | D55 | Q53-D55 WeakPolarHBondContact CG-OD2 3.17Å; Q53-D55 PolarHBondContact NE2-OD2 2.92Å | ||
| 54 | S | 41.6 | Very low | 38.9 | Very low | 121 Ų | 121 | 138.6 Ų | 138.6 | 85% | 0.846 | 80% | 0.801 | S | S | * | * | trans | -113.7 | 94.8 | 164.7 | 40.5 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 55 | D | 33.1 | Very low | 39.2 | Very low | 123 Ų | 123 | 139.2 Ų | 139.2 | 66% | 0.658 | 79% | 0.794 | S | S | * | * | trans | -79.8 | 117.9 | 165.3 | -99.4 | -84.7 | 0 | 0 | 0 | 108.7 | Q53 | Q53-D55 WeakPolarHBondContact CG-OD2 3.17Å; Q53-D55 PolarHBondContact NE2-OD2 2.92Å | ||
| 56 | L | 42 | Very low | 39.2 | Very low | 182 Ų | 182 | 135.4 Ų | 135.4 | 95% | 0.953 | 79% | 0.792 | S | S | * | * | trans | -157.1 | 105.7 | 160.4 | -112.8 | 123.3 | 0 | 0 | 0 | 109.1 | ||||
| 57 | G | 33.1 | Very low | 39.2 | Very low | 84 Ų | 84 | 138.2 Ų | 138.2 | 87% | 0.866 | 80% | 0.802 | S | S | * | * | trans | 156.7 | 56.5 | 169.9 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 58 | A | 35 | Very low | 39.6 | Very low | 107 Ų | 107 | 138.4 Ų | 138.4 | 88% | 0.884 | 81% | 0.807 | S | S | * | * | trans | -132.2 | 94.5 | 163.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 59 | A | 42.1 | Very low | 40.4 | Very low | 90 Ų | 90 | 140.6 Ų | 140.6 | 74% | 0.744 | 80% | 0.804 | S | S | * | * | trans | -126 | 99.7 | 164.8 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 60 | T | 39.1 | Very low | 40.9 | Very low | 129 Ų | 129 | 146 Ų | 146 | 79% | 0.791 | 81% | 0.814 | S | S | * | * | trans | 49.9 | 99.4 | 138 | 60.8 | 0 | 0 | 0 | 0 | 118.9 | T62 | T60-T62 PolarHBondContact O-N 3.27Š| ||
| 61 | T | 38.3 | Very low | 41.5 | Very low | 143 Ų | 143 | 148 Ų | 148 | 88% | 0.877 | 81% | 0.813 | S | S | * | * | trans | -62.4 | 116.9 | 146.8 | -63.7 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 62 | T | 37.4 | Very low | 41.6 | Very low | 110 Ų | 110 | 146.6 Ų | 146.6 | 68% | 0.675 | 81% | 0.811 | S | S | * | * | trans | -163.4 | 129.5 | 143.8 | -14.4 | 0 | 0 | 0 | 0 | 112.9 | T60 | T60-T62 PolarHBondContact O-N 3.27Š| ||
| 63 | K | 41.6 | Very low | 41.9 | Very low | 183 Ų | 183 | 149.3 Ų | 149.3 | 80% | 0.796 | 82% | 0.816 | S | S | * | * | trans | 78.4 | 115.3 | 147.7 | -76.1 | 168.2 | -176.3 | -174.1 | 0 | 120.8 | ||||
| 64 | E | 42.2 | Very low | 41.9 | Very low | 157 Ų | 157 | 150.4 Ų | 150.4 | 73% | 0.734 | 82% | 0.819 | S | S | * | * | 79.5 | 111.1 | 124 | -66.3 | -91.6 | 102.6 | 0 | 0 | 118.6 | |||||
| 65 | E | 41 | Very low | 42.1 | Very low | 155 Ų | 155 | 151.6 Ų | 151.6 | 72% | 0.724 | 82% | 0.816 | S | S | * | * | 60.6 | 97.9 | 119.8 | -59.2 | -102 | 110.1 | 0 | 0 | 118 | |||||
| 66 | A | 43.4 | Very low | 42.5 | Very low | 93 Ų | 93 | 150.7 Ų | 150.7 | 77% | 0.769 | 82% | 0.816 | S | S | * | * | trans | -148.6 | 69.7 | 146.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | L68 | A66-L68 PolarHBondContact O-N 3.02Š| ||
| 67 | L | 45.1 | Very low | 42.4 | Very low | 146 Ų | 146 | 145.9 Ų | 145.9 | 76% | 0.764 | 80% | 0.798 | S | S | * | * | 32.2 | 91.7 | 122.8 | -126.2 | 154.5 | 0 | 0 | 0 | 117 | R69 | L67-R69 HydrophobicContact CD2-CB 4.19Š| |||
| 68 | L | 43.1 | Very low | 42.6 | Very low | 173 Ų | 173 | 150.8 Ų | 150.8 | 91% | 0.906 | 80% | 0.798 | S | S | * | * | trans | -120.9 | 74.4 | 159.2 | -91.5 | 157.7 | 0 | 0 | 0 | 109.7 | A66 | A66-L68 PolarHBondContact O-N 3.02Š| ||
| 69 | R | 54.8 | Low | 43.1 | Very low | 222 Ų | 222 | 149.9 Ų | 149.9 | 84% | 0.838 | 79% | 0.791 | S | S | * | * | trans | -104.7 | 96.4 | 163.2 | -88.1 | -87.3 | -177.2 | 101.6 | 3.2 | 107.5 | L67 | L67-R69 HydrophobicContact CD2-CB 4.19Š| ||
| 70 | M | 47.5 | Very low | 43 | Very low | 180 Ų | 180 | 153.3 Ų | 153.3 | 89% | 0.887 | 80% | 0.797 | S | S | * | * | trans | -150.3 | 95.7 | 151.7 | -72.7 | -163.9 | -75.3 | 0 | 0 | 109 | ||||
| 71 | R | 52.2 | Low | 43 | Very low | 241 Ų | 241 | 155.1 Ų | 155.1 | 91% | 0.909 | 80% | 0.796 | S | S | * | * | trans | -97.1 | 119.3 | 146.8 | -70.1 | -177.1 | -169.3 | 130.6 | 1.6 | 104.6 | ||||
| 72 | D | 42.7 | Very low | 43.4 | Very low | 163 Ų | 163 | 153.3 Ų | 153.3 | 87% | 0.872 | 79% | 0.787 | S | S | * | * | trans | -152.8 | 135.1 | 152.5 | -91.1 | -52.4 | 0 | 0 | 0 | 110.7 | ||||
| 73 | L | 45.4 | Very low | 42.9 | Very low | 165 Ų | 165 | 157 Ų | 157 | 86% | 0.864 | 79% | 0.79 | S | S | * | * | trans | -59 | 133 | -179.9 | -90.5 | 53.5 | 0 | 0 | 0 | 112.3 | ||||
| 74 | K | 38.9 | Very low | 42.8 | Very low | 192 Ų | 192 | 159.6 Ų | 159.6 | 84% | 0.835 | 80% | 0.795 | S | S | * | * | trans | -161.7 | 106.5 | 130.8 | -148.1 | 65.6 | 160 | -172.5 | 0 | 111.7 | P76 | K74-P76 WeakPolarHBondContact O-CD 3.14Š| ||
| 75 | N | 45.3 | Very low | 42.8 | Very low | 146 Ų | 146 | 156.7 Ų | 156.7 | 78% | 0.781 | 79% | 0.792 | S | S | * | * | trans | -62.6 | 130.5 | 154.6 | -173.2 | 8.6 | 0 | 0 | 0 | 108.1 | S77 | N75-S77 PolarHBondContact OD1-N 3.06Å; N75-S77 VanDerWaalsContact OD1-N 3.13Å | ||
| 76 | P | 42.8 | Very low | 42.8 | Very low | 104 Ų | 104 | 151.8 Ų | 151.8 | 68% | 0.675 | 78% | 0.783 | S | S | * | * | -138.4 | 125.6 | 121 | 31.9 | -16.4 | 0 | 0 | 0 | 112.9 | K74 | K74-P76 WeakPolarHBondContact O-CD 3.14Š| |||
| 77 | S | 39.3 | Very low | 43.4 | Very low | 81 Ų | 81 | 153.6 Ų | 153.6 | 57% | 0.566 | 79% | 0.786 | S | S | * | * | trans | 40.1 | 121.2 | 136.1 | 68.5 | 0 | 0 | 0 | 0 | 119.9 | N75 | N75-S77 PolarHBondContact OD1-N 3.06Å; N75-S77 VanDerWaalsContact OD1-N 3.13Å | ||
| 78 | E | 37.5 | Very low | 43.4 | Very low | 186 Ų | 186 | 154.2 Ų | 154.2 | 87% | 0.869 | 79% | 0.791 | S | S | * | * | trans | 90.5 | 129.1 | 134.3 | -75.6 | 175.1 | 106.3 | 0 | 0 | 120.2 | ||||
| 79 | A | 45.1 | Very low | 43.7 | Very low | 89 Ų | 89 | 152.9 Ų | 152.9 | 74% | 0.736 | 79% | 0.785 | S | S | * | * | trans | 79.1 | 84.7 | 152.9 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 80 | N | 39.7 | Very low | 43.1 | Very low | 162 Ų | 162 | 152.1 Ų | 152.1 | 87% | 0.866 | 78% | 0.781 | S | S | * | * | 158.6 | 103 | 103.1 | -101.3 | -43.7 | 0 | 0 | 0 | 111.7 | |||||
| 81 | Q | 39.2 | Very low | 43.5 | Very low | 167 Ų | 167 | 148.6 Ų | 148.6 | 78% | 0.78 | 78% | 0.775 | S | S | * | * | trans | 179.8 | 140.5 | 147.5 | -93.5 | -78.4 | -34.5 | 0 | 0 | 103.7 | ||||
| 82 | P | 47.1 | Very low | 42.9 | Very low | 104 Ų | 104 | 144.6 Ų | 144.6 | 68% | 0.675 | 77% | 0.766 | S | S | * | * | cis | -142.8 | 151 | 31.4 | 37.7 | -17.7 | 0 | 0 | 0 | 115.3 | ||||
| 83 | Y | 27.5 | Very low | 43.3 | Very low | 189 Ų | 189 | 142.8 Ų | 142.8 | 74% | 0.741 | 77% | 0.767 | S | S | * | * | trans | -145.4 | 98.8 | 156.6 | -166.2 | -109.4 | 0 | 0 | 0 | 109.8 | S85 | Y83-S85 WeakPolarHBondContact CD1-OG 3.28Å; Y83-S85 WeakPolarHBondContact CE1-OG 3.49Å; Y83-S85 PolarHBondContact O-N 3.04Å | ||
| 84 | W | 38.9 | Very low | 43.1 | Very low | 237 Ų | 237 | 139.3 Ų | 139.3 | 90% | 0.898 | 76% | 0.756 | S | S | * | * | trans | -70 | 104.1 | 156.1 | -69.8 | 96.3 | 0 | 0 | 0 | 106.5 | ||||
| 85 | S | 43 | Very low | 43.5 | Very low | 96 Ų | 96 | 135.6 Ų | 135.6 | 67% | 0.671 | 76% | 0.761 | S | S | * | * | trans | -64.2 | 133.2 | 169 | -65.7 | 0 | 0 | 0 | 0 | 109.5 | Y83 | Y83-S85 WeakPolarHBondContact CD1-OG 3.28Å; Y83-S85 WeakPolarHBondContact CE1-OG 3.49Å; Y83-S85 PolarHBondContact O-N 3.04Å | ||
| 86 | G | 40.3 | Very low | 43.6 | Very low | 52 Ų | 52 | 133.4 Ų | 133.4 | 54% | 0.536 | 75% | 0.749 | S | S | . | * | trans | -79.2 | -153.3 | -167.6 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 87 | P | 55.3 | Low | 44.2 | Very low | 130 Ų | 130 | 135.3 Ų | 135.3 | 84% | 0.844 | 75% | 0.754 | S | S | * | * | trans | -93.5 | 135.8 | -139.2 | 35.6 | -34.4 | 0 | 0 | 0 | 113.9 | D89 | P87-D89 PolarHBondContact O-N 3.42Š| ||
| 88 | D | 46.3 | Very low | 45 | Very low | 160 Ų | 160 | 135.2 Ų | 135.2 | 86% | 0.856 | 75% | 0.753 | S | S | * | * | trans | -85.8 | 106.8 | 165.2 | -34.4 | -51.4 | 0 | 0 | 0 | 108.4 | R90 | D88-R90 PolarHBondContact O-N 3.45Š| ||
| 89 | D | 47.8 | Very low | 45.9 | Very low | 145 Ų | 145 | 129.5 Ų | 129.5 | 78% | 0.775 | 73% | 0.728 | S | S | * | * | trans | -63.4 | 102.9 | 164 | -167.1 | -77.4 | 0 | 0 | 0 | 108.7 | P87 | P87-D89 PolarHBondContact O-N 3.42Š| ||
| 90 | R | 43.6 | Very low | 46.7 | Very low | 205 Ų | 205 | 131.6 Ų | 131.6 | 77% | 0.774 | 73% | 0.726 | S | S | * | * | trans | -131.5 | 92.2 | 154.5 | -163.3 | 174.3 | -173 | -177.1 | 1.4 | 108.3 | D88 Q92 | D88-R90 PolarHBondContact O-N 3.45Å; R90-Q92 PolarHBondContact O-N 2.94Å | ||
| 91 | S | 54.6 | Low | 48.2 | Very low | 106 Ų | 106 | 129.9 Ų | 129.9 | 74% | 0.741 | 72% | 0.724 | S | S | * | * | trans | -43.9 | 106.2 | 159 | -71.3 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 92 | Q | 41.2 | Very low | 50.2 | Low | 158 Ų | 158 | 124.3 Ų | 124.3 | 74% | 0.738 | 70% | 0.699 | S | S | * | * | trans | -120.6 | 104.2 | 157.3 | -79.9 | -171.6 | -40.5 | 0 | 0 | 107.6 | R90 S94 | R90-Q92 PolarHBondContact O-N 2.94Å; Q92-S94 PolarHBondContact O-N 3.36Å | ||
| 93 | S | 50.5 | Low | 52.2 | Low | 125 Ų | 125 | 122.6 Ų | 122.6 | 87% | 0.874 | 69% | 0.687 | S | S | * | * | trans | -47 | 126.7 | 154.6 | 167.4 | 0 | 0 | 0 | 0 | 110 | ||||
| 94 | S | 41.1 | Very low | 55 | Low | 91 Ų | 91 | 119 Ų | 119 | 64% | 0.636 | 69% | 0.687 | S | S | * | * | trans | -178.5 | 122.2 | 141.7 | 174.7 | 0 | 0 | 0 | 0 | 108 | Q92 D96 | Q92-S94 PolarHBondContact O-N 3.36Å; S94-D96 PolarHBondContact O-N 3.1Å | ||
| 95 | A | 46.8 | Very low | 57.3 | Low | 114 Ų | 114 | 118.1 Ų | 118.1 | 94% | 0.942 | 68% | 0.683 | S | S | * | * | S | Bend | trans | -72.1 | 59.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112 | ||
| 96 | D | 47.7 | Very low | 59.5 | Low | 101 Ų | 101 | 118 Ų | 118 | 54% | 0.54 | 67% | 0.672 | S | S | . | * | trans | -139.5 | 43.4 | -175.2 | -147.9 | -97.2 | 0 | 0 | 0 | 111.7 | S94 | S94-D96 PolarHBondContact O-N 3.1Š| ||
| 97 | D | 54.7 | Low | 61.8 | Low | 144 Ų | 144 | 118.4 Ų | 118.4 | 77% | 0.77 | 66% | 0.662 | S | S | * | * | trans | -113 | 15.4 | -179.7 | -150.5 | -101.5 | 0 | 0 | 0 | 113.4 | ||||
| 98 | S | 57 | Low | 63.3 | Low | 78 Ų | 78 | 114.3 Ų | 114.3 | 55% | 0.545 | 64% | 0.639 | S | S | . | * | S | Bend | trans | -96 | -2.1 | 175.1 | -59.2 | 0 | 0 | 0 | 0 | 113.9 | T171 | S98-T171 PolarHBondContact O-OG1 2.49Š|
| 99 | L | 57.1 | Low | 65.4 | Low | 67 Ų | 67 | 109 Ų | 109 | 35% | 0.351 | 62% | 0.617 | S | S | . | * | S | Bend | trans | -113 | 77 | 172.2 | -62.3 | 178.4 | 0 | 0 | 0 | 108.6 | L167 | L99-L167 HydrophobicContact CD2-CB 4.09Å; L99-L167 HydrophobicContact CD2-CD2 4.36Å |
| 100 | L | 60.5 | Low | 67.3 | Low | 132 Ų | 132 | 104.1 Ų | 104.1 | 69% | 0.691 | 59% | 0.589 | S | S | * | * | trans | -42.4 | 136.7 | 160.7 | -62.8 | 176.6 | 0 | 0 | 0 | 108.1 | L102 | L100-L102 VanDerWaalsContact C-N 3.35Å; L100-L102 PolarHBondContact O-N 3.01Å | ||
| 101 | P | 72.9 | Confident | 69.5 | Low | 127 Ų | 127 | 98.4 Ų | 98.4 | 83% | 0.825 | 57% | 0.571 | S | S | * | * | trans | -60.2 | 97.2 | -170.7 | 20.6 | -30.9 | 0 | 0 | 0 | 110.3 | T103 | P101-T103 PolarHBondContact O-N 3.25Š| ||
| 102 | L | 80 | Confident | 71.1 | Confident | 49 Ų | 49 | 97.7 Ų | 97.7 | 26% | 0.257 | 56% | 0.559 | S | S | . | * | trans | -67.9 | 132.2 | 179.5 | -66.7 | -179.8 | 0 | 0 | 0 | 107.9 | L100 Q106 F110 L167 T171 | L100-L102 VanDerWaalsContact C-N 3.35Å; L100-L102 PolarHBondContact O-N 3.01Å; L102-Q106 HydrophobicContact CB-CB 4.45Å; L102-F110 HydrophobicContact CD1-CD2 3.92Å; L102-F110 HydrophobicContact CD1-CE2 3.89Å; L102-F110 HydrophobicContact CD2-CE2 4.11Å; L102-L167 HydrophobicContact CD1-CD2 3.52Å; L102-L167 HydrophobicContact CD1-CG 4.16Å; L102-T171 HydrophobicContact CD1-CG2 4.1Å; L102-T171 HydrophobicContact CD2-CG2 4.21Å | ||
| 103 | T | 89.1 | Confident | 73.3 | Confident | 69 Ų | 69 | 93.3 Ų | 93.3 | 42% | 0.423 | 54% | 0.54 | S | S | . | . | trans | -63.6 | 152.6 | 173.8 | 62.4 | 0 | 0 | 0 | 0 | 110.1 | P101 R105 Q106 L107 | P101-T103 PolarHBondContact O-N 3.25Å; T103-R105 PolarHBondContact O-N 2.79Å; T103-R105 VanDerWaalsContact O-N 3.07Å; T103-Q106 WeakPolarHBondContact O-CB 3.39Å; T103-Q106 PolarHBondContact O-N 2.89Å; T103-Q106 VanDerWaalsContact OG1-CD 3.28Å; T103-Q106 VanDerWaalsContact OG1-CG 3.29Å; T103-Q106 WeakPolarHBondContact OG1-CG 2.84Å; T103-Q106 PolarHBondContact OG1-N 3.24Å; T103-Q106 PolarHBondContact OG1-OE1 3.16Å; T103-L107 PolarHBondContact O-N 3.43Å | ||
| 104 | P | 87.1 | Confident | 75.1 | Confident | 113 Ų | 113 | 88.2 Ų | 88.2 | 73% | 0.734 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -54.2 | -33.4 | 177.6 | -27.8 | 34.8 | 0 | 0 | 0 | 113.3 | L107 A108 | P104-L107 PolarHBondContact O-N 2.96Å; P104-A108 WeakPolarHBondContact O-CB 3.28Å; P104-A108 PolarHBondContact O-N 3.31Å |
| 105 | R | 87.1 | Confident | 77.3 | Confident | 219 Ų | 219 | 89.6 Ų | 89.6 | 83% | 0.826 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -68.2 | -40.2 | 176.7 | -172 | 179.2 | -178.9 | -147.5 | -0.2 | 112.5 | T103 A109 | T103-R105 PolarHBondContact O-N 2.79Å; T103-R105 VanDerWaalsContact O-N 3.07Å; R105-A109 PolarHBondContact O-N 3.19Å; R105-A109 VanDerWaalsContact O-N 3.12Å |
| 106 | Q | 88.8 | Confident | 79 | Confident | 92 Ų | 92 | 89.9 Ų | 89.9 | 43% | 0.43 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -67.3 | -43.5 | 174.9 | -74.5 | 163.8 | -40.2 | 0 | 0 | 110.6 | L102 T103 A108 A109 F110 | L102-Q106 HydrophobicContact CB-CB 4.45Å; T103-Q106 WeakPolarHBondContact O-CB 3.39Å; T103-Q106 PolarHBondContact O-N 2.89Å; T103-Q106 VanDerWaalsContact OG1-CD 3.28Å; T103-Q106 VanDerWaalsContact OG1-CG 3.29Å; T103-Q106 WeakPolarHBondContact OG1-CG 2.84Å; T103-Q106 PolarHBondContact OG1-N 3.24Å; T103-Q106 PolarHBondContact OG1-OE1 3.16Å; Q106-A108 VanDerWaalsContact C-N 3.31Å; Q106-A108 PolarHBondContact O-N 3.41Å; Q106-A109 WeakPolarHBondContact O-CB 3.32Å; Q106-A109 PolarHBondContact O-N 2.97Å; Q106-A109 VanDerWaalsContact O-N 3.11Å; Q106-F110 HydrophobicContact CB-CD2 4.49Å; Q106-F110 HydrophobicContact CB-CE2 4.3Å; Q106-F110 WeakPolarHBondContact O-CD2 3.16Å; Q106-F110 PolarHBondContact O-N 2.91Å |
| 107 | L | 88.2 | Confident | 80.6 | Confident | 62 Ų | 62 | 87.7 Ų | 87.7 | 33% | 0.325 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -58.6 | -43.9 | 177.1 | -171 | 65.5 | 0 | 0 | 0 | 111.7 | T103 P104 A109 F110 Q111 F163 L167 | T103-L107 PolarHBondContact O-N 3.43Å; P104-L107 PolarHBondContact O-N 2.96Å; L107-A109 VanDerWaalsContact C-N 3.35Å; L107-A109 PolarHBondContact O-N 3.29Å; L107-F110 PolarHBondContact O-N 3.37Å; L107-Q111 WeakPolarHBondContact O-CG 3.36Å; L107-Q111 PolarHBondContact O-N 3.35Å; L107-F163 HydrophobicContact CD1-CE1 3.77Å; L107-F163 HydrophobicContact CD1-CZ 3.85Å; L107-L167 HydrophobicContact CD1-CD2 3.8Å |
| 108 | A | 88.3 | Confident | 82 | Confident | 44 Ų | 44 | 81.8 Ų | 81.8 | 36% | 0.364 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -60.3 | -43.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112 | P104 Q106 F110 Q111 D112 | P104-A108 WeakPolarHBondContact O-CB 3.28Å; P104-A108 PolarHBondContact O-N 3.31Å; Q106-A108 VanDerWaalsContact C-N 3.31Å; Q106-A108 PolarHBondContact O-N 3.41Å; A108-F110 PolarHBondContact O-N 3.47Å; A108-Q111 PolarHBondContact O-N 3.44Å; A108-D112 PolarHBondContact O-N 2.98Å |
| 109 | A | 88.8 | Confident | 83 | Confident | 49 Ų | 49 | 81.7 Ų | 81.7 | 41% | 0.405 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -61.5 | -43.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112 | R105 Q106 L107 Q111 D112 I113 | R105-A109 PolarHBondContact O-N 3.19Å; R105-A109 VanDerWaalsContact O-N 3.12Å; Q106-A109 WeakPolarHBondContact O-CB 3.32Å; Q106-A109 PolarHBondContact O-N 2.97Å; Q106-A109 VanDerWaalsContact O-N 3.11Å; L107-A109 VanDerWaalsContact C-N 3.35Å; L107-A109 PolarHBondContact O-N 3.29Å; A109-Q111 VanDerWaalsContact C-N 3.35Å; A109-Q111 PolarHBondContact O-N 3.3Å; A109-D112 PolarHBondContact O-N 3.41Å; A109-I113 VanDerWaalsContact O-CG1 3.25Å; A109-I113 WeakPolarHBondContact O-CG1 3.37Å; A109-I113 PolarHBondContact O-N 2.81Å |
| 110 | F | 89.3 | Confident | 83.8 | Confident | 42 Ų | 42 | 79.7 Ų | 79.7 | 18% | 0.184 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -64.8 | -37.3 | 175.4 | -72.7 | -64.3 | 0 | 0 | 0 | 112.6 | L102 Q106 L107 A108 I113 F114 F163 L167 L170 T171 | L102-F110 HydrophobicContact CD1-CD2 3.92Å; L102-F110 HydrophobicContact CD1-CE2 3.89Å; L102-F110 HydrophobicContact CD2-CE2 4.11Å; Q106-F110 HydrophobicContact CB-CD2 4.49Å; Q106-F110 HydrophobicContact CB-CE2 4.3Å; Q106-F110 WeakPolarHBondContact O-CD2 3.16Å; Q106-F110 PolarHBondContact O-N 2.91Å; L107-F110 PolarHBondContact O-N 3.37Å; A108-F110 PolarHBondContact O-N 3.47Å; F110-I113 PolarHBondContact O-N 2.91Å; F110-F114 WeakPolarHBondContact O-CB 3.5Å; F110-F114 PolarHBondContact O-N 2.98Å; F110-F163 HydrophobicContact CB-CE2 4.28Å; F110-F163 HydrophobicContact CB-CZ 4.29Å; F110-L167 HydrophobicContact CB-CD1 3.89Å; F110-L167 HydrophobicContact CG-CD1 4.36Å; F110-L170 HydrophobicContact CD1-CD1 3.78Å; F110-L170 HydrophobicContact CE1-CB 4.05Å; F110-L170 HydrophobicContact CE1-CD1 3.84Å; F110-T171 HydrophobicContact CZ-CG2 4.46Å |
| 111 | Q | 88.9 | Confident | 84.2 | Confident | 84 Ų | 84 | 79.9 Ų | 79.9 | 39% | 0.393 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -63.8 | -41.4 | 174.1 | -75.7 | -177.2 | 0.2 | 0 | 0 | 112.1 | L107 A108 A109 I113 F114 K115 F163 | L107-Q111 WeakPolarHBondContact O-CG 3.36Å; L107-Q111 PolarHBondContact O-N 3.35Å; A108-Q111 PolarHBondContact O-N 3.44Å; A109-Q111 VanDerWaalsContact C-N 3.35Å; A109-Q111 PolarHBondContact O-N 3.3Å; Q111-I113 VanDerWaalsContact C-N 3.34Å; Q111-F114 PolarHBondContact O-N 3.22Å; Q111-K115 VanDerWaalsContact O-CG 3.31Å; Q111-K115 WeakPolarHBondContact O-CG 3.18Å; Q111-K115 PolarHBondContact O-N 3.04Å; Q111-F163 HydrophobicContact CB-CE2 4.29Å; Q111-F163 HydrophobicContact CB-CZ 4.31Å; Q111-F163 HydrophobicContact CG-CE1 3.99Å; Q111-F163 HydrophobicContact CG-CE2 3.67Å; Q111-F163 HydrophobicContact CG-CZ 3.31Å |
| 112 | D | 89 | Confident | 84.2 | Confident | 91 Ų | 91 | 78.2 Ų | 78.2 | 49% | 0.487 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -67.5 | -38.7 | 178.7 | -71.8 | -20.1 | 0 | 0 | 0 | 111.5 | A108 A109 K115 L116 | A108-D112 PolarHBondContact O-N 2.98Å; A109-D112 PolarHBondContact O-N 3.41Å; D112-K115 PolarHBondContact O-N 3.33Å; D112-K115 IonicContact OD1-NZ 2.85Å; D112-K115 PolarHBondContact OD1-NZ 3.35Å; D112-L116 PolarHBondContact O-N 3.19Å |
| 113 | I | 87.6 | Confident | 84 | Confident | 66 Ų | 66 | 77.9 Ų | 77.9 | 34% | 0.338 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -62.7 | -47.6 | 171.1 | -62.6 | 165.2 | 0 | 0 | 0 | 109.8 | A109 F110 Q111 K115 L116 F117 F166 | A109-I113 VanDerWaalsContact O-CG1 3.25Å; A109-I113 WeakPolarHBondContact O-CG1 3.37Å; A109-I113 PolarHBondContact O-N 2.81Å; F110-I113 PolarHBondContact O-N 2.91Å; Q111-I113 VanDerWaalsContact C-N 3.34Å; I113-K115 VanDerWaalsContact C-N 3.26Å; I113-K115 PolarHBondContact O-N 3.39Å; I113-L116 WeakPolarHBondContact O-CA 3.2Å; I113-L116 VanDerWaalsContact O-CB 3.25Å; I113-L116 WeakPolarHBondContact O-CB 3.29Å; I113-L116 PolarHBondContact O-N 2.85Å; I113-F117 HydrophobicContact CG2-CD2 3.88Å; I113-F117 HydrophobicContact CG2-CE2 3.56Å; I113-F117 VanDerWaalsContact O-CD2 3.26Å; I113-F117 WeakPolarHBondContact O-CD2 3.29Å; I113-F117 PolarHBondContact O-N 3.33Å; I113-F166 HydrophobicContact CB-CZ 4.39Å; I113-F166 HydrophobicContact CG2-CE1 4.34Å; I113-F166 HydrophobicContact CG2-CZ 3.72Å |
| 114 | F | 87.6 | Confident | 83.7 | Confident | 18 Ų | 18 | 76 Ų | 76 | 8% | 0.079 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -56.3 | -40.2 | 179.7 | -175.7 | -99.4 | 0 | 0 | 0 | 112.3 | F110 Q111 L116 F117 S118 G123 V125 F163 F166 | F110-F114 WeakPolarHBondContact O-CB 3.5Å; F110-F114 PolarHBondContact O-N 2.98Å; Q111-F114 PolarHBondContact O-N 3.22Å; F114-L116 PolarHBondContact O-N 3.15Å; F114-F117 CarbonylContact O-C 3.49Å; F114-F117 WeakPolarHBondContact O-CA 3.49Å; F114-F117 PolarHBondContact O-N 2.9Å; F114-S118 WeakPolarHBondContact O-CB 3.37Å; F114-S118 PolarHBondContact O-N 3.38Å; F114-S118 PolarHBondContact O-OG 3.41Å; F114-G123 WeakPolarHBondContact CE1-O 3.5Å; F114-V125 HydrophobicContact CD2-CG2 4.05Å; F114-V125 HydrophobicContact CE2-CG2 3.55Å; F114-V125 HydrophobicContact CZ-CG2 3.99Å; F114-F163 HydrophobicContact CB-CD2 3.79Å; F114-F163 HydrophobicContact CB-CE2 4Å; F114-F163 HydrophobicContact CD1-CD2 4.05Å; F114-F163 AromaticContact CD2-CD2 3.92Å; F114-F163 HydrophobicContact CD2-CD2 3.92Å; F114-F163 HydrophobicContact CE1-CB 4.33Å; F114-F163 HydrophobicContact CE2-CB 4.29Å; F114-F163 HydrophobicContact CE2-CD2 4.49Å; F114-F163 AromaticContact CG-CD2 3.66Å; F114-F163 HydrophobicContact CG-CD2 3.66Å; F114-F163 HydrophobicContact CG-CE2 4.37Å; F114-F163 HydrophobicContact CZ-CB 4.19Å; F114-F166 HydrophobicContact CB-CD1 4.13Å; F114-F166 HydrophobicContact CB-CE1 4.05Å; F114-F166 HydrophobicContact CD2-CB 3.79Å; F114-F166 AromaticContact CD2-CD1 3.79Å; F114-F166 HydrophobicContact CD2-CD1 3.79Å; F114-F166 HydrophobicContact CD2-CD2 4.15Å; F114-F166 HydrophobicContact CD2-CE1 4.37Å; F114-F166 AromaticContact CD2-CG 3.65Å; F114-F166 HydrophobicContact CD2-CG 3.65Å; F114-F166 HydrophobicContact CE2-CB 3.98Å; F114-F166 HydrophobicContact CE2-CG 4.3Å; F114-F166 HydrophobicContact CG-CD1 4.44Å |
| 115 | K | 86.6 | Confident | 83.5 | Confident | 121 Ų | 121 | 71 Ų | 71 | 53% | 0.526 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -60.7 | -30.3 | 174.7 | -69.4 | 167.4 | -162 | 159.3 | 0 | 113.4 | Q111 D112 I113 F117 | Q111-K115 VanDerWaalsContact O-CG 3.31Å; Q111-K115 WeakPolarHBondContact O-CG 3.18Å; Q111-K115 PolarHBondContact O-N 3.04Å; D112-K115 PolarHBondContact O-N 3.33Å; D112-K115 IonicContact OD1-NZ 2.85Å; D112-K115 PolarHBondContact OD1-NZ 3.35Å; I113-K115 VanDerWaalsContact C-N 3.26Å; I113-K115 PolarHBondContact O-N 3.39Å; K115-F117 VanDerWaalsContact C-N 3.28Å |
| 116 | L | 83.3 | Confident | 83.4 | Confident | 119 Ų | 119 | 62.8 Ų | 62.8 | 62% | 0.623 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -69 | -31.1 | 173.5 | -59.9 | 173.4 | 0 | 0 | 0 | 111.6 | D112 I113 F114 | D112-L116 PolarHBondContact O-N 3.19Å; I113-L116 WeakPolarHBondContact O-CA 3.2Å; I113-L116 VanDerWaalsContact O-CB 3.25Å; I113-L116 WeakPolarHBondContact O-CB 3.29Å; I113-L116 PolarHBondContact O-N 2.85Å; F114-L116 PolarHBondContact O-N 3.15Å |
| 117 | F | 81.8 | Confident | 83.2 | Confident | 56 Ų | 56 | 62.4 Ų | 62.4 | 25% | 0.246 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -87.7 | -23.9 | 178.6 | -72 | -85.3 | 0 | 0 | 0 | 113.7 | I113 F114 K115 V125 S129 A133 F166 | I113-F117 HydrophobicContact CG2-CD2 3.88Å; I113-F117 HydrophobicContact CG2-CE2 3.56Å; I113-F117 VanDerWaalsContact O-CD2 3.26Å; I113-F117 WeakPolarHBondContact O-CD2 3.29Å; I113-F117 PolarHBondContact O-N 3.33Å; F114-F117 CarbonylContact O-C 3.49Å; F114-F117 WeakPolarHBondContact O-CA 3.49Å; F114-F117 PolarHBondContact O-N 2.9Å; K115-F117 VanDerWaalsContact C-N 3.28Å; F117-V125 HydrophobicContact CB-CG2 3.81Å; F117-S129 CarbonylContact O-C 3.15Å; F117-S129 WeakPolarHBondContact O-CB 3.3Å; F117-A133 HydrophobicContact CB-CB 4.4Å; F117-A133 HydrophobicContact CD1-CB 3.24Å; F117-A133 HydrophobicContact CE1-CB 3.61Å; F117-A133 HydrophobicContact CG-CB 3.98Å; F117-F166 HydrophobicContact CD2-CE2 4.08Å; F117-F166 HydrophobicContact CD2-CZ 4.17Å; F117-F166 HydrophobicContact CE2-CE2 4.44Å; F117-F166 HydrophobicContact CE2-CZ 4.44Å |
| 118 | S | 83.4 | Confident | 83.1 | Confident | 19 Ų | 19 | 64.4 Ų | 64.4 | 13% | 0.133 | 37% | 0.368 | C | S | . | . | trans | -102.4 | 62 | -174.9 | 72.7 | 0 | 0 | 0 | 0 | 112.7 | F114 S120 | F114-S118 WeakPolarHBondContact O-CB 3.37Å; F114-S118 PolarHBondContact O-N 3.38Å; F114-S118 PolarHBondContact O-OG 3.41Å; S118-S120 PolarHBondContact O-N 2.72Å | ||
| 119 | C | 78 | Confident | 83 | Confident | 76 Ų | 76 | 62.5 Ų | 62.5 | 51% | 0.514 | 35% | 0.352 | S | S | . | . | trans | -72.3 | -10.7 | 177.9 | -70.4 | 0 | 0 | 0 | 0 | 114.1 | S129 | C119-S129 PolarHBondContact N-OG 2.9Š| ||
| 120 | S | 74.3 | Confident | 82.8 | Confident | 26 Ų | 26 | 61.2 Ų | 61.2 | 18% | 0.182 | 34% | 0.338 | C | S | . | . | S | Bend | trans | -70.2 | 145.5 | 177.1 | 175.9 | 0 | 0 | 0 | 0 | 112.2 | S118 T122 G123 S129 | S118-S120 PolarHBondContact O-N 2.72Å; S120-T122 PolarHBondContact O-N 3.28Å; S120-T122 PolarHBondContact OG-N 3.06Å; S120-T122 PolarHBondContact OG-OG1 3.44Å; S120-G123 PolarHBondContact O-N 2.93Å; S120-S129 WeakPolarHBondContact CB-OG 3.18Å; S120-S129 PolarHBondContact N-OG 3.43Å |
| 121 | P | 68.1 | Low | 82.6 | Confident | 135 Ų | 135 | 65 Ų | 65 | 88% | 0.877 | 35% | 0.354 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.3 | -14.5 | 174.4 | 26.8 | -37.2 | 0 | 0 | 0 | 114.2 | G123 | P121-G123 VanDerWaalsContact C-N 3.26Š|
| 122 | T | 72.9 | Confident | 82.5 | Confident | 92 Ų | 92 | 64.6 Ų | 64.6 | 56% | 0.564 | 35% | 0.354 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.8 | -13.8 | 176 | 51.7 | 0 | 0 | 0 | 0 | 113.2 | S120 T124 | S120-T122 PolarHBondContact O-N 3.28Å; S120-T122 PolarHBondContact OG-N 3.06Å; S120-T122 PolarHBondContact OG-OG1 3.44Å; T122-T124 WeakPolarHBondContact CB-OG1 3.32Å; T122-T124 PolarHBondContact O-N 3.41Å; T122-T124 PolarHBondContact OG1-OG1 2.82Å |
| 123 | G | 76 | Confident | 82.3 | Confident | 42 Ų | 42 | 60.7 Ų | 60.7 | 43% | 0.433 | 33% | 0.334 | S | S | . | . | S | Bend | trans | 67.7 | 21.2 | -175.2 | 0 | 0 | 0 | 0 | 0 | 113 | F114 S120 P121 | F114-G123 WeakPolarHBondContact CE1-O 3.5Å; S120-G123 PolarHBondContact O-N 2.93Å; P121-G123 VanDerWaalsContact C-N 3.26Å |
| 124 | T | 81.8 | Confident | 82.2 | Confident | 31 Ų | 31 | 58.4 Ų | 58.4 | 19% | 0.19 | 32% | 0.323 | C | S | . | . | S | Bend | trans | -120.2 | 158.8 | 178.9 | 58.8 | 0 | 0 | 0 | 0 | 110.6 | T122 D126 I160 | T122-T124 WeakPolarHBondContact CB-OG1 3.32Å; T122-T124 PolarHBondContact O-N 3.41Å; T122-T124 PolarHBondContact OG1-OG1 2.82Å; T124-D126 PolarHBondContact O-N 2.76Å; T124-I160 HydrophobicContact CG2-CG2 3.6Å; T124-I160 WeakPolarHBondContact OG1-CG2 3.44Å |
| 125 | V | 84.9 | Confident | 82 | Confident | 6 Ų | 6 | 66.7 Ų | 66.7 | 4% | 0.036 | 35% | 0.354 | C | S | . | . | B | Isolated β-bridge | trans | -89.7 | 101.3 | 176.3 | 177.2 | 0 | 0 | 0 | 0 | 108.3 | F114 F117 M130 V161 | F114-V125 HydrophobicContact CD2-CG2 4.05Å; F114-V125 HydrophobicContact CE2-CG2 3.55Å; F114-V125 HydrophobicContact CZ-CG2 3.99Å; F117-V125 HydrophobicContact CB-CG2 3.81Å; V125-M130 HydrophobicContact CG1-CB 4.1Å; V125-V161 HydrophobicContact CB-CB 3.97Å; V125-V161 HydrophobicContact CB-CG1 4.32Å; V125-V161 HydrophobicContact CG1-CB 4.43Å; V125-V161 PolarHBondContact N-O 3.01Å; V125-V161 VanDerWaalsContact N-O 3.13Å; V125-V161 PolarHBondContact O-N 3.34Å |
| 126 | D | 84.4 | Confident | 81.9 | Confident | 48 Ų | 48 | 67 Ų | 67 | 26% | 0.257 | 36% | 0.361 | S | S | . | . | trans | -99 | 173.8 | 174 | 78.2 | -48.4 | 0 | 0 | 0 | 111.1 | T124 Q128 S129 M130 | T124-D126 PolarHBondContact O-N 2.76Å; D126-Q128 PolarHBondContact O-N 3.46Å; D126-Q128 WeakPolarHBondContact OD2-CB 3.38Å; D126-Q128 PolarHBondContact OD2-N 2.81Å; D126-S129 PolarHBondContact O-N 3.19Å; D126-S129 WeakPolarHBondContact OD1-CB 3.48Å; D126-S129 PolarHBondContact OD1-N 2.91Å; D126-S129 PolarHBondContact OD1-OG 3.03Å; D126-M130 WeakPolarHBondContact O-CB 3.36Å; D126-M130 PolarHBondContact O-N 3.01Å | ||
| 127 | M | 84.9 | Confident | 81.8 | Confident | 83 Ų | 83 | 64.6 Ų | 64.6 | 41% | 0.409 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -57 | -35.4 | 179.7 | -174.6 | 164.2 | 54.6 | 0 | 0 | 113.5 | K131 M146 L150 | M127-K131 WeakPolarHBondContact O-CB 3.24Å; M127-K131 PolarHBondContact O-N 3.42Å; M127-K131 VanDerWaalsContact O-N 3.14Å; M127-M146 HydrophobicContact CG-CG 3.84Å; M127-M146 HydrophobicContact SD-CG 4.46Å; M127-L150 HydrophobicContact CB-CD1 3.7Å; M127-L150 HydrophobicContact CG-CD1 4.2Å |
| 128 | Q | 85 | Confident | 81.9 | Confident | 104 Ų | 104 | 64.9 Ų | 64.9 | 49% | 0.486 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -72.8 | -44.6 | 178.1 | -60.7 | -55.9 | -42 | 0 | 0 | 111.6 | D126 M130 K131 I132 | D126-Q128 PolarHBondContact O-N 3.46Å; D126-Q128 WeakPolarHBondContact OD2-CB 3.38Å; D126-Q128 PolarHBondContact OD2-N 2.81Å; Q128-M130 PolarHBondContact O-N 2.94Å; Q128-K131 WeakPolarHBondContact O-CB 3.11Å; Q128-K131 PolarHBondContact O-N 3.44Å; Q128-I132 WeakPolarHBondContact O-CG1 3.31Å; Q128-I132 PolarHBondContact O-N 3.39Å |
| 129 | S | 86.9 | Confident | 81.8 | Confident | 4 Ų | 4 | 67.3 Ų | 67.3 | 3% | 0.028 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -66.6 | -39.7 | -179.6 | -52.4 | 0 | 0 | 0 | 0 | 111.6 | F117 C119 S120 D126 K131 I132 A133 | F117-S129 CarbonylContact O-C 3.15Å; F117-S129 WeakPolarHBondContact O-CB 3.3Å; C119-S129 PolarHBondContact N-OG 2.9Å; S120-S129 WeakPolarHBondContact CB-OG 3.18Å; S120-S129 PolarHBondContact N-OG 3.43Å; D126-S129 PolarHBondContact O-N 3.19Å; D126-S129 WeakPolarHBondContact OD1-CB 3.48Å; D126-S129 PolarHBondContact OD1-N 2.91Å; D126-S129 PolarHBondContact OD1-OG 3.03Å; S129-K131 VanDerWaalsContact C-N 3.34Å; S129-K131 PolarHBondContact O-N 2.86Å; S129-I132 PolarHBondContact O-N 3.22Å; S129-A133 WeakPolarHBondContact O-CB 3.27Å; S129-A133 PolarHBondContact O-N 2.86Å |
| 130 | M | 84.4 | Confident | 81.9 | Confident | 22 Ų | 22 | 71.8 Ų | 71.8 | 11% | 0.108 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -62.1 | -41.3 | 174.2 | -166.4 | 164.3 | 86.4 | 0 | 0 | 111.9 | V125 D126 Q128 I132 A133 L134 M146 A149 L150 | V125-M130 HydrophobicContact CG1-CB 4.1Å; D126-M130 WeakPolarHBondContact O-CB 3.36Å; D126-M130 PolarHBondContact O-N 3.01Å; Q128-M130 PolarHBondContact O-N 2.94Å; M130-I132 PolarHBondContact O-N 2.89Å; M130-A133 PolarHBondContact O-N 3.37Å; M130-L134 HydrophobicContact CG-CD1 3.83Å; M130-L134 HydrophobicContact CG-CG 4.29Å; M130-L134 WeakPolarHBondContact O-CB 3.28Å; M130-L134 VanDerWaalsContact O-CG 3.25Å; M130-L134 WeakPolarHBondContact O-CG 3.45Å; M130-L134 PolarHBondContact O-N 3.35Å; M130-M146 HydrophobicContact CB-SD 4.06Å; M130-M146 HydrophobicContact CE-CG 3.77Å; M130-M146 VanDerWaalsContact CE-O 3.29Å; M130-M146 WeakPolarHBondContact CE-O 3.25Å; M130-M146 HydrophobicContact CE-SD 3.19Å; M130-M146 WeakPolarHBondContact CE-SD 3.23Å; M130-M146 HydrophobicContact CG-SD 3.88Å; M130-M146 HydrophobicContact SD-SD 4.39Å; M130-A149 HydrophobicContact CE-CB 3.76Å; M130-L150 HydrophobicContact CE-CB 4.35Å; M130-L150 HydrophobicContact CE-CD1 4.41Å; M130-L150 HydrophobicContact CE-CD2 3.91Å; M130-L150 HydrophobicContact CE-CG 3.5Å; M130-L150 HydrophobicContact SD-CD2 3.74Å; M130-L150 HydrophobicContact SD-CG 4.05Å |
| 131 | K | 84.8 | Confident | 82.2 | Confident | 121 Ų | 121 | 71.9 Ų | 71.9 | 53% | 0.526 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -59.8 | -43.6 | 174.6 | -176.4 | 179.3 | 178.9 | 177.7 | 0 | 112.6 | M127 Q128 S129 R135 M146 | M127-K131 WeakPolarHBondContact O-CB 3.24Å; M127-K131 PolarHBondContact O-N 3.42Å; M127-K131 VanDerWaalsContact O-N 3.14Å; Q128-K131 WeakPolarHBondContact O-CB 3.11Å; Q128-K131 PolarHBondContact O-N 3.44Å; S129-K131 VanDerWaalsContact C-N 3.34Å; S129-K131 PolarHBondContact O-N 2.86Å; K131-R135 VanDerWaalsContact O-CB 3.27Å; K131-R135 WeakPolarHBondContact O-CB 3.1Å; K131-R135 PolarHBondContact O-N 3.46Å; K131-M146 HydrophobicContact CB-CE 3.72Å; K131-M146 HydrophobicContact CG-CE 4.05Å |
| 132 | I | 86.4 | Confident | 83 | Confident | 76 Ų | 76 | 66.9 Ų | 66.9 | 39% | 0.39 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -66.2 | -47.2 | 178.8 | -67 | 164.7 | 0 | 0 | 0 | 110.1 | Q128 S129 M130 L134 R135 N136 | Q128-I132 WeakPolarHBondContact O-CG1 3.31Å; Q128-I132 PolarHBondContact O-N 3.39Å; S129-I132 PolarHBondContact O-N 3.22Å; M130-I132 PolarHBondContact O-N 2.89Å; I132-L134 PolarHBondContact O-N 3.34Å; I132-R135 PolarHBondContact O-N 3.32Å; I132-N136 PolarHBondContact O-N 2.99Å; I132-N136 PolarHBondContact O-ND2 3.12Å; I132-N136 PolarHBondContact O-OD1 2.92Å |
| 133 | A | 85.6 | Confident | 83.6 | Confident | 9 Ų | 9 | 67.7 Ų | 67.7 | 7% | 0.074 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -62.6 | -44.7 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | F117 S129 M130 R135 N136 A137 | F117-A133 HydrophobicContact CB-CB 4.4Å; F117-A133 HydrophobicContact CD1-CB 3.24Å; F117-A133 HydrophobicContact CE1-CB 3.61Å; F117-A133 HydrophobicContact CG-CB 3.98Å; S129-A133 WeakPolarHBondContact O-CB 3.27Å; S129-A133 PolarHBondContact O-N 2.86Å; M130-A133 PolarHBondContact O-N 3.37Å; A133-R135 PolarHBondContact O-N 2.55Å; A133-N136 WeakPolarHBondContact O-CB 3.34Å; A133-N136 PolarHBondContact O-N 3.17Å; A133-A137 PolarHBondContact O-N 2.79Å |
| 134 | L | 84.3 | Confident | 84 | Confident | 18 Ų | 18 | 73.4 Ų | 73.4 | 9% | 0.094 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -64.1 | -40.6 | 175.9 | -70.2 | 170 | 0 | 0 | 0 | 111.8 | M130 I132 N136 A137 G138 I139 L141 M146 | M130-L134 HydrophobicContact CG-CD1 3.83Å; M130-L134 HydrophobicContact CG-CG 4.29Å; M130-L134 WeakPolarHBondContact O-CB 3.28Å; M130-L134 VanDerWaalsContact O-CG 3.25Å; M130-L134 WeakPolarHBondContact O-CG 3.45Å; M130-L134 PolarHBondContact O-N 3.35Å; I132-L134 PolarHBondContact O-N 3.34Å; L134-N136 VanDerWaalsContact C-N 3.32Å; L134-N136 PolarHBondContact O-N 2.75Å; L134-A137 CarbonylContact O-C 3.58Å; L134-A137 WeakPolarHBondContact O-CA 3.46Å; L134-A137 WeakPolarHBondContact O-CB 3.33Å; L134-A137 PolarHBondContact O-N 3.05Å; L134-A137 VanDerWaalsContact O-N 3.12Å; L134-G138 PolarHBondContact O-N 3.22Å; L134-G138 VanDerWaalsContact O-N 3.12Å; L134-I139 CarbonylContact C-O 3.55Å; L134-I139 HydrophobicContact CB-CB 4.41Å; L134-I139 HydrophobicContact CD2-CB 4.4Å; L134-I139 HydrophobicContact CD2-CD1 4.36Å; L134-I139 HydrophobicContact CD2-CG2 4.44Å; L134-I139 PolarHBondContact O-N 3.49Å; L134-L141 HydrophobicContact CD1-CD1 3.4Å; L134-L141 HydrophobicContact CD1-CG 3.96Å; L134-M146 HydrophobicContact CD1-CE 3.94Å; L134-M146 HydrophobicContact CD1-SD 3.81Å |
| 135 | R | 84.4 | Confident | 84.2 | Confident | 193 Ų | 193 | 73.2 Ų | 73.2 | 73% | 0.728 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -62 | -40.3 | 174.3 | -172.2 | -176.2 | -176.5 | -162.1 | 1.1 | 111.8 | K131 I132 A133 A137 G138 I139 | K131-R135 VanDerWaalsContact O-CB 3.27Å; K131-R135 WeakPolarHBondContact O-CB 3.1Å; K131-R135 PolarHBondContact O-N 3.46Å; I132-R135 PolarHBondContact O-N 3.32Å; A133-R135 PolarHBondContact O-N 2.55Å; R135-A137 VanDerWaalsContact C-N 3.27Å; R135-A137 PolarHBondContact O-N 3.06Å; R135-G138 PolarHBondContact O-N 3.28Å; R135-I139 PolarHBondContact N-O 3.14Å |
| 136 | N | 84.1 | Confident | 84.3 | Confident | 126 Ų | 126 | 73.3 Ų | 73.3 | 67% | 0.674 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -65.8 | -31.6 | 175.8 | -67.4 | -14.7 | 0 | 0 | 0 | 111.9 | I132 A133 L134 G138 | I132-N136 PolarHBondContact O-N 2.99Å; I132-N136 PolarHBondContact O-ND2 3.12Å; I132-N136 PolarHBondContact O-OD1 2.92Å; A133-N136 WeakPolarHBondContact O-CB 3.34Å; A133-N136 PolarHBondContact O-N 3.17Å; L134-N136 VanDerWaalsContact C-N 3.32Å; L134-N136 PolarHBondContact O-N 2.75Å; N136-G138 PolarHBondContact O-N 2.92Å |
| 137 | A | 81.3 | Confident | 84.4 | Confident | 70 Ų | 70 | 74.2 Ų | 74.2 | 58% | 0.579 | 40% | 0.401 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.3 | -2.6 | 172 | 0 | 0 | 0 | 0 | 0 | 113.8 | A133 L134 R135 I139 | A133-A137 PolarHBondContact O-N 2.79Å; L134-A137 CarbonylContact O-C 3.58Å; L134-A137 WeakPolarHBondContact O-CA 3.46Å; L134-A137 WeakPolarHBondContact O-CB 3.33Å; L134-A137 PolarHBondContact O-N 3.05Å; L134-A137 VanDerWaalsContact O-N 3.12Å; R135-A137 VanDerWaalsContact C-N 3.27Å; R135-A137 PolarHBondContact O-N 3.06Å; A137-I139 VanDerWaalsContact C-N 3.35Å |
| 138 | G | 83.6 | Confident | 84.6 | Confident | 61 Ų | 61 | 74.8 Ų | 74.8 | 63% | 0.629 | 40% | 0.403 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 82.3 | 7.8 | -178.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | L134 R135 N136 | L134-G138 PolarHBondContact O-N 3.22Å; L134-G138 VanDerWaalsContact O-N 3.12Å; R135-G138 PolarHBondContact O-N 3.28Å; N136-G138 PolarHBondContact O-N 2.92Å |
| 139 | I | 82.2 | Confident | 84.6 | Confident | 70 Ų | 70 | 70.1 Ų | 70.1 | 36% | 0.359 | 38% | 0.381 | S | S | . | . | trans | -97.4 | 127.3 | -180 | -58.1 | 170.8 | 0 | 0 | 0 | 108.8 | L134 R135 A137 L141 I183 | L134-I139 CarbonylContact C-O 3.55Å; L134-I139 HydrophobicContact CB-CB 4.41Å; L134-I139 HydrophobicContact CD2-CB 4.4Å; L134-I139 HydrophobicContact CD2-CD1 4.36Å; L134-I139 HydrophobicContact CD2-CG2 4.44Å; L134-I139 PolarHBondContact O-N 3.49Å; R135-I139 PolarHBondContact N-O 3.14Å; A137-I139 VanDerWaalsContact C-N 3.35Å; I139-L141 HydrophobicContact CG2-CD2 3.73Å; I139-L141 HydrophobicContact CG2-CG 4.15Å; I139-I183 HydrophobicContact CG2-CG2 4.36Å | ||
| 140 | Q | 80.5 | Confident | 84.6 | Confident | 171 Ų | 171 | 71.1 Ų | 71.1 | 80% | 0.799 | 39% | 0.387 | S | S | * | . | trans | -111.2 | 116.9 | 174.4 | -79.7 | 165.6 | 92.6 | 0 | 0 | 109 | ||||
| 141 | L | 79.8 | Confident | 84.9 | Confident | 28 Ų | 28 | 79 Ų | 79 | 15% | 0.147 | 42% | 0.415 | C | S | . | . | trans | -107.4 | 144.3 | 173.7 | -55.1 | -173.8 | 0 | 0 | 0 | 110.6 | L134 I139 E145 M146 I183 | L134-L141 HydrophobicContact CD1-CD1 3.4Å; L134-L141 HydrophobicContact CD1-CG 3.96Å; I139-L141 HydrophobicContact CG2-CD2 3.73Å; I139-L141 HydrophobicContact CG2-CG 4.15Å; L141-E145 WeakPolarHBondContact CA-OE2 3.19Å; L141-E145 HydrophobicContact CB-CB 4.2Å; L141-E145 WeakPolarHBondContact CB-OE2 3.25Å; L141-M146 HydrophobicContact CB-CE 4.02Å; L141-I183 HydrophobicContact CD1-CD1 4.18Å; L141-I183 HydrophobicContact CD1-CG1 3.81Å; L141-I183 HydrophobicContact CD2-CB 4.25Å; L141-I183 HydrophobicContact CD2-CG1 4.17Å; L141-I183 HydrophobicContact CD2-CG2 3.52Å | ||
| 142 | G | 84.9 | Confident | 85 | Confident | 30 Ų | 30 | 75 Ų | 75 | 31% | 0.309 | 40% | 0.399 | S | S | . | . | trans | -67.7 | 161.9 | 166.2 | 0 | 0 | 0 | 0 | 0 | 112 | Q144 E145 M146 | G142-Q144 VanDerWaalsContact C-N 3.28Å; G142-Q144 PolarHBondContact O-N 3.19Å; G142-E145 PolarHBondContact N-OE2 3.19Å; G142-E145 PolarHBondContact O-N 3.21Å; G142-M146 PolarHBondContact O-N 3.5Å | ||
| 143 | P | 84.8 | Confident | 85.1 | Confident | 108 Ų | 108 | 72 Ų | 72 | 70% | 0.701 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -58.2 | -37.7 | -179.7 | -23 | 32.6 | 0 | 0 | 0 | 113.6 | C147 | P143-C147 PolarHBondContact O-N 3.37Å; P143-C147 VanDerWaalsContact O-N 3.15Å; P143-C147 PolarHBondContact O-SG 3.02Å; P143-C147 VanDerWaalsContact O-SG 3.35Å |
| 144 | Q | 85.8 | Confident | 85.4 | Confident | 162 Ų | 162 | 72.9 Ų | 72.9 | 76% | 0.757 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -68.5 | -45.7 | -179.7 | -67.9 | -177.4 | -8.3 | 0 | 0 | 111.7 | G142 M146 C147 E148 | G142-Q144 VanDerWaalsContact C-N 3.28Å; G142-Q144 PolarHBondContact O-N 3.19Å; Q144-M146 VanDerWaalsContact C-N 3.3Å; Q144-M146 PolarHBondContact O-N 2.92Å; Q144-C147 PolarHBondContact O-N 2.91Å; Q144-E148 PolarHBondContact O-N 3.23Å |
| 145 | E | 85.9 | Confident | 85.6 | Confident | 28 Ų | 28 | 76 Ų | 76 | 13% | 0.131 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -62.6 | -38.7 | 177.8 | -55.4 | 170.9 | 150.2 | 0 | 0 | 111.4 | L141 G142 E148 A149 S186 | L141-E145 WeakPolarHBondContact CA-OE2 3.19Å; L141-E145 HydrophobicContact CB-CB 4.2Å; L141-E145 WeakPolarHBondContact CB-OE2 3.25Å; G142-E145 PolarHBondContact N-OE2 3.19Å; G142-E145 PolarHBondContact O-N 3.21Å; E145-E148 PolarHBondContact O-N 3.05Å; E145-A149 VanDerWaalsContact O-CB 3.31Å; E145-A149 WeakPolarHBondContact O-CB 3.29Å; E145-A149 PolarHBondContact O-N 3.43Å; E145-S186 WeakPolarHBondContact CG-OG 3.46Å; E145-S186 WeakPolarHBondContact OE1-CB 3.31Å; E145-S186 PolarHBondContact OE1-OG 2.85Å |
| 146 | M | 86.2 | Confident | 85.8 | Confident | 8 Ų | 8 | 71.5 Ų | 71.5 | 4% | 0.039 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -61 | -46 | 175.5 | -167.5 | 74.3 | 66.6 | 0 | 0 | 111.4 | M127 M130 K131 L134 L141 G142 Q144 A149 L150 | M127-M146 HydrophobicContact CG-CG 3.84Å; M127-M146 HydrophobicContact SD-CG 4.46Å; M130-M146 HydrophobicContact CB-SD 4.06Å; M130-M146 HydrophobicContact CE-CG 3.77Å; M130-M146 VanDerWaalsContact CE-O 3.29Å; M130-M146 WeakPolarHBondContact CE-O 3.25Å; M130-M146 HydrophobicContact CE-SD 3.19Å; M130-M146 WeakPolarHBondContact CE-SD 3.23Å; M130-M146 HydrophobicContact CG-SD 3.88Å; M130-M146 HydrophobicContact SD-SD 4.39Å; K131-M146 HydrophobicContact CB-CE 3.72Å; K131-M146 HydrophobicContact CG-CE 4.05Å; L134-M146 HydrophobicContact CD1-CE 3.94Å; L134-M146 HydrophobicContact CD1-SD 3.81Å; L141-M146 HydrophobicContact CB-CE 4.02Å; G142-M146 PolarHBondContact O-N 3.5Å; Q144-M146 VanDerWaalsContact C-N 3.3Å; Q144-M146 PolarHBondContact O-N 2.92Å; M146-A149 PolarHBondContact O-N 3.46Å; M146-L150 PolarHBondContact O-N 3.05Å |
| 147 | C | 87.3 | Confident | 85.9 | Confident | 67 Ų | 67 | 68.3 Ų | 68.3 | 45% | 0.453 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -63.5 | -40.9 | 176.7 | -72.1 | 0 | 0 | 0 | 0 | 111.9 | P143 Q144 R151 | P143-C147 PolarHBondContact O-N 3.37Å; P143-C147 VanDerWaalsContact O-N 3.15Å; P143-C147 PolarHBondContact O-SG 3.02Å; P143-C147 VanDerWaalsContact O-SG 3.35Å; Q144-C147 PolarHBondContact O-N 2.91Å; C147-R151 WeakPolarHBondContact O-CB 3.18Å; C147-R151 PolarHBondContact O-N 3.44Å |
| 148 | E | 87.8 | Confident | 86.1 | Confident | 95 Ų | 95 | 69.3 Ų | 69.3 | 44% | 0.444 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -66.4 | -42.3 | 176.2 | -71.5 | -171.2 | 169.3 | 0 | 0 | 112.2 | Q144 E145 R151 L152 T182 | Q144-E148 PolarHBondContact O-N 3.23Å; E145-E148 PolarHBondContact O-N 3.05Å; E148-R151 PolarHBondContact O-N 3.26Å; E148-L152 WeakPolarHBondContact O-CB 3.4Å; E148-L152 VanDerWaalsContact O-CG 3.29Å; E148-L152 WeakPolarHBondContact O-CG 3.34Å; E148-L152 PolarHBondContact O-N 3.12Å; E148-T182 HydrophobicContact CB-CG2 3.91Å; E148-T182 VanDerWaalsContact OE2-CG2 3.28Å; E148-T182 WeakPolarHBondContact OE2-CG2 3.44Å |
| 149 | A | 85.8 | Confident | 86.1 | Confident | 5 Ų | 5 | 69.3 Ų | 69.3 | 4% | 0.041 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -62.8 | -43.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | M130 E145 M146 L152 A153 I183 | M130-A149 HydrophobicContact CE-CB 3.76Å; E145-A149 VanDerWaalsContact O-CB 3.31Å; E145-A149 WeakPolarHBondContact O-CB 3.29Å; E145-A149 PolarHBondContact O-N 3.43Å; M146-A149 PolarHBondContact O-N 3.46Å; A149-L152 PolarHBondContact O-N 3.46Å; A149-A153 WeakPolarHBondContact O-CB 3.45Å; A149-A153 PolarHBondContact O-N 2.97Å; A149-I183 HydrophobicContact CB-CD1 4.44Å; A149-I183 HydrophobicContact CB-CG1 4.47Å |
| 150 | L | 87.8 | Confident | 86.2 | Confident | 26 Ų | 26 | 69.4 Ų | 69.4 | 14% | 0.136 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -60.7 | -47.4 | 173.7 | -82.5 | 173.4 | 0 | 0 | 0 | 111.3 | M127 M130 M146 L152 A153 D154 V161 | M127-L150 HydrophobicContact CB-CD1 3.7Å; M127-L150 HydrophobicContact CG-CD1 4.2Å; M130-L150 HydrophobicContact CE-CB 4.35Å; M130-L150 HydrophobicContact CE-CD1 4.41Å; M130-L150 HydrophobicContact CE-CD2 3.91Å; M130-L150 HydrophobicContact CE-CG 3.5Å; M130-L150 HydrophobicContact SD-CD2 3.74Å; M130-L150 HydrophobicContact SD-CG 4.05Å; M146-L150 PolarHBondContact O-N 3.05Å; L150-L152 PolarHBondContact O-N 3.12Å; L150-A153 CarbonylContact O-C 3.47Å; L150-A153 PolarHBondContact O-N 3.43Å; L150-D154 VanDerWaalsContact O-CB 3.27Å; L150-D154 WeakPolarHBondContact O-CB 3.37Å; L150-D154 PolarHBondContact O-N 3.23Å; L150-V161 HydrophobicContact CD2-CG2 3.89Å |
| 151 | R | 89.2 | Confident | 86.6 | Confident | 187 Ų | 187 | 61.5 Ų | 61.5 | 71% | 0.706 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -64.6 | -29 | -178.7 | -173.3 | 166 | 68.2 | 111.1 | -2.3 | 113.3 | C147 E148 | C147-R151 WeakPolarHBondContact O-CB 3.18Å; C147-R151 PolarHBondContact O-N 3.44Å; E148-R151 PolarHBondContact O-N 3.26Å |
| 152 | L | 87.9 | Confident | 87.1 | Confident | 37 Ų | 37 | 61.8 Ų | 61.8 | 19% | 0.194 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -78.9 | -27.7 | 173.9 | -70.9 | 170.4 | 0 | 0 | 0 | 112.4 | E148 A149 L150 Q178 C179 T182 | E148-L152 WeakPolarHBondContact O-CB 3.4Å; E148-L152 VanDerWaalsContact O-CG 3.29Å; E148-L152 WeakPolarHBondContact O-CG 3.34Å; E148-L152 PolarHBondContact O-N 3.12Å; A149-L152 PolarHBondContact O-N 3.46Å; L150-L152 PolarHBondContact O-N 3.12Å; L152-Q178 HydrophobicContact CD2-CG 4.48Å; L152-C179 VanDerWaalsContact CB-SG 3.5Å; L152-T182 HydrophobicContact CD1-CG2 4.29Å; L152-T182 VanDerWaalsContact CD1-OG1 3.3Å; L152-T182 WeakPolarHBondContact CD1-OG1 3.4Å |
| 153 | A | 88.4 | Confident | 87.3 | Confident | 14 Ų | 14 | 62.9 Ų | 62.9 | 12% | 0.116 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -84.9 | -25.4 | 179 | 0 | 0 | 0 | 0 | 0 | 113.4 | A149 L150 L155 V161 D165 V169 | A149-A153 WeakPolarHBondContact O-CB 3.45Å; A149-A153 PolarHBondContact O-N 2.97Å; L150-A153 CarbonylContact O-C 3.47Å; L150-A153 PolarHBondContact O-N 3.43Å; A153-L155 PolarHBondContact O-N 3.49Å; A153-V161 HydrophobicContact CB-CG1 4.47Å; A153-V161 HydrophobicContact CB-CG2 3.87Å; A153-D165 WeakPolarHBondContact O-CB 3.45Å; A153-V169 HydrophobicContact CB-CG2 4.13Å |
| 154 | D | 91 | Very high | 87.4 | Confident | 26 Ų | 26 | 64.1 Ų | 64.1 | 14% | 0.139 | 35% | 0.348 | C | S | . | . | trans | -78.5 | 103.8 | 174.2 | 177.6 | 8.2 | 0 | 0 | 0 | 109.8 | L150 G157 D158 G159 V161 | L150-D154 VanDerWaalsContact O-CB 3.27Å; L150-D154 WeakPolarHBondContact O-CB 3.37Å; L150-D154 PolarHBondContact O-N 3.23Å; D154-G157 VanDerWaalsContact OD1-CA 3.23Å; D154-G157 WeakPolarHBondContact OD1-CA 3.33Å; D154-G157 PolarHBondContact OD1-N 3.41Å; D154-G157 WeakPolarHBondContact OD2-CA 3.39Å; D154-D158 PolarHBondContact OD1-N 3.46Å; D154-G159 VanDerWaalsContact OD2-CA 3.28Å; D154-G159 WeakPolarHBondContact OD2-CA 3.48Å; D154-G159 PolarHBondContact OD2-N 2.89Å; D154-V161 HydrophobicContact CB-CG2 4.34Å | ||
| 155 | L | 89.1 | Confident | 87.7 | Confident | 83 Ų | 83 | 56.7 Ų | 56.7 | 44% | 0.435 | 31% | 0.313 | S | S | . | . | S | Bend | trans | -91.3 | -27.5 | -173.6 | -58.3 | -179.4 | 0 | 0 | 0 | 112.8 | A153 D165 V169 | A153-L155 PolarHBondContact O-N 3.49Å; L155-D165 HydrophobicContact CB-CB 4.44Å; L155-D165 HydrophobicContact CD1-CB 4.44Å; L155-D165 HydrophobicContact CG-CB 4.18Å; L155-V169 HydrophobicContact CD2-CG2 4.38Å; L155-V169 HydrophobicContact CG-CG2 4.5Å |
| 156 | D | 88.7 | Confident | 87.8 | Confident | 99 Ų | 99 | 56.4 Ų | 56.4 | 53% | 0.529 | 31% | 0.312 | S | S | . | . | S | Bend | trans | -96 | -13 | 179.2 | 65.3 | -3.1 | 0 | 0 | 0 | 113.1 | D158 | D156-D158 PolarHBondContact OD1-N 3.27Š|
| 157 | G | 86.1 | Confident | 87.9 | Confident | 59 Ų | 59 | 56.6 Ų | 56.6 | 61% | 0.608 | 31% | 0.313 | S | S | * | . | trans | 79.9 | 21.4 | 171.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | D154 G159 | D154-G157 VanDerWaalsContact OD1-CA 3.23Å; D154-G157 WeakPolarHBondContact OD1-CA 3.33Å; D154-G157 PolarHBondContact OD1-N 3.41Å; D154-G157 WeakPolarHBondContact OD2-CA 3.39Å; G157-G159 PolarHBondContact O-N 3.45Å | ||
| 158 | D | 85.4 | Confident | 88 | Confident | 91 Ų | 91 | 53.8 Ų | 53.8 | 49% | 0.487 | 30% | 0.295 | S | S | . | . | S | Bend | trans | -80.7 | -4.8 | -179.8 | 83.4 | -11.9 | 0 | 0 | 0 | 112.9 | D154 D156 I160 | D154-D158 PolarHBondContact OD1-N 3.46Å; D156-D158 PolarHBondContact OD1-N 3.27Å; D158-I160 VanDerWaalsContact C-N 3.34Å; D158-I160 WeakPolarHBondContact OD1-CA 3.36Å; D158-I160 WeakPolarHBondContact OD1-CB 3.27Å; D158-I160 PolarHBondContact OD1-N 2.7Å |
| 159 | G | 82.9 | Confident | 88 | Confident | 62 Ų | 62 | 49.9 Ų | 49.9 | 64% | 0.639 | 28% | 0.278 | S | S | * | . | S | Bend | trans | 83.2 | 7 | -178.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | D154 G157 | D154-G159 VanDerWaalsContact OD2-CA 3.28Å; D154-G159 WeakPolarHBondContact OD2-CA 3.48Å; D154-G159 PolarHBondContact OD2-N 2.89Å; G157-G159 PolarHBondContact O-N 3.45Å |
| 160 | I | 85 | Confident | 88 | Confident | 71 Ų | 71 | 52 Ų | 52 | 36% | 0.364 | 29% | 0.289 | S | S | . | . | S | Bend | trans | -134.1 | 128.2 | -176 | -55.8 | 177.9 | 0 | 0 | 0 | 108.9 | T124 D158 S162 | T124-I160 HydrophobicContact CG2-CG2 3.6Å; T124-I160 WeakPolarHBondContact OG1-CG2 3.44Å; D158-I160 VanDerWaalsContact C-N 3.34Å; D158-I160 WeakPolarHBondContact OD1-CA 3.36Å; D158-I160 WeakPolarHBondContact OD1-CB 3.27Å; D158-I160 PolarHBondContact OD1-N 2.7Å; I160-S162 PolarHBondContact O-N 3.22Å |
| 161 | V | 89.3 | Confident | 88 | Confident | 6 Ų | 6 | 52.7 Ų | 52.7 | 4% | 0.036 | 29% | 0.293 | C | S | . | . | B | Isolated β-bridge | trans | -82.5 | 109.1 | 177.3 | 176.7 | 0 | 0 | 0 | 0 | 109.4 | V125 L150 A153 D154 D165 F166 | V125-V161 HydrophobicContact CB-CB 3.97Å; V125-V161 HydrophobicContact CB-CG1 4.32Å; V125-V161 HydrophobicContact CG1-CB 4.43Å; V125-V161 PolarHBondContact N-O 3.01Å; V125-V161 VanDerWaalsContact N-O 3.13Å; V125-V161 PolarHBondContact O-N 3.34Å; L150-V161 HydrophobicContact CD2-CG2 3.89Å; A153-V161 HydrophobicContact CB-CG1 4.47Å; A153-V161 HydrophobicContact CB-CG2 3.87Å; D154-V161 HydrophobicContact CB-CG2 4.34Å; V161-D165 HydrophobicContact CG1-CB 4.22Å; V161-F166 HydrophobicContact CG1-CB 4.36Å |
| 162 | S | 89.6 | Confident | 87.9 | Confident | 33 Ų | 33 | 46.1 Ų | 46.1 | 23% | 0.231 | 27% | 0.272 | C | S | . | . | trans | -79.2 | 170.4 | 174.9 | 83.7 | 0 | 0 | 0 | 0 | 111.5 | I160 K164 D165 F166 | I160-S162 PolarHBondContact O-N 3.22Å; S162-K164 PolarHBondContact O-N 3.13Å; S162-K164 PolarHBondContact OG-N 3.38Å; S162-D165 WeakPolarHBondContact CB-OD2 3.48Å; S162-D165 PolarHBondContact N-OD2 3.34Å; S162-D165 PolarHBondContact O-N 2.83Å; S162-D165 PolarHBondContact OG-N 3.28Å; S162-D165 PolarHBondContact OG-OD2 3.43Å; S162-F166 WeakPolarHBondContact O-CB 3.35Å; S162-F166 PolarHBondContact O-N 3Å | ||
| 163 | F | 88.4 | Confident | 87.8 | Confident | 54 Ų | 54 | 50.7 Ų | 50.7 | 24% | 0.237 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -62.1 | -31.9 | 173.9 | -178.2 | -113.1 | 0 | 0 | 0 | 112.3 | L107 F110 Q111 F114 F166 L167 | L107-F163 HydrophobicContact CD1-CE1 3.77Å; L107-F163 HydrophobicContact CD1-CZ 3.85Å; F110-F163 HydrophobicContact CB-CE2 4.28Å; F110-F163 HydrophobicContact CB-CZ 4.29Å; Q111-F163 HydrophobicContact CB-CE2 4.29Å; Q111-F163 HydrophobicContact CB-CZ 4.31Å; Q111-F163 HydrophobicContact CG-CE1 3.99Å; Q111-F163 HydrophobicContact CG-CE2 3.67Å; Q111-F163 HydrophobicContact CG-CZ 3.31Å; F114-F163 HydrophobicContact CB-CD2 3.79Å; F114-F163 HydrophobicContact CB-CE2 4Å; F114-F163 HydrophobicContact CD1-CD2 4.05Å; F114-F163 AromaticContact CD2-CD2 3.92Å; F114-F163 HydrophobicContact CD2-CD2 3.92Å; F114-F163 HydrophobicContact CE1-CB 4.33Å; F114-F163 HydrophobicContact CE2-CB 4.29Å; F114-F163 HydrophobicContact CE2-CD2 4.49Å; F114-F163 AromaticContact CG-CD2 3.66Å; F114-F163 HydrophobicContact CG-CD2 3.66Å; F114-F163 HydrophobicContact CG-CE2 4.37Å; F114-F163 HydrophobicContact CZ-CB 4.19Å; F163-F166 HydrophobicContact CD2-CD1 4.48Å; F163-L167 HydrophobicContact CD1-CD1 4.09Å; F163-L167 HydrophobicContact CD2-CD1 3.85Å; F163-L167 HydrophobicContact CE1-CD1 3.59Å; F163-L167 HydrophobicContact CE1-CD2 4.27Å; F163-L167 HydrophobicContact CE2-CD1 3.31Å; F163-L167 HydrophobicContact CG-CD1 4.22Å; F163-L167 HydrophobicContact CZ-CD1 3.16Å; F163-L167 HydrophobicContact CZ-CD2 4.4Å; F163-L167 HydrophobicContact CZ-CG 4.41Å; F163-L167 WeakPolarHBondContact O-CD1 3.48Å; F163-L167 PolarHBondContact O-N 2.85Å |
| 164 | K | 88.8 | Confident | 87.7 | Confident | 133 Ų | 133 | 56.3 Ų | 56.3 | 58% | 0.578 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -67.9 | -43.4 | 178.6 | -173.1 | -179.5 | 178.8 | -176.4 | 0 | 110.7 | S162 L167 G168 | S162-K164 PolarHBondContact O-N 3.13Å; S162-K164 PolarHBondContact OG-N 3.38Å; K164-L167 PolarHBondContact O-N 2.81Å; K164-G168 PolarHBondContact O-N 2.93Å |
| 165 | D | 90.3 | Very high | 87.5 | Confident | 7 Ų | 7 | 59.5 Ų | 59.5 | 4% | 0.037 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -67.1 | -42.5 | 178.8 | -48.5 | -51.9 | 0 | 0 | 0 | 110.7 | A153 L155 V161 S162 L167 G168 V169 | A153-D165 WeakPolarHBondContact O-CB 3.45Å; L155-D165 HydrophobicContact CB-CB 4.44Å; L155-D165 HydrophobicContact CD1-CB 4.44Å; L155-D165 HydrophobicContact CG-CB 4.18Å; V161-D165 HydrophobicContact CG1-CB 4.22Å; S162-D165 WeakPolarHBondContact CB-OD2 3.48Å; S162-D165 PolarHBondContact N-OD2 3.34Å; S162-D165 PolarHBondContact O-N 2.83Å; S162-D165 PolarHBondContact OG-N 3.28Å; S162-D165 PolarHBondContact OG-OD2 3.43Å; D165-L167 VanDerWaalsContact C-N 3.32Å; D165-L167 PolarHBondContact O-N 3.25Å; D165-G168 PolarHBondContact O-N 3.23Å; D165-G168 VanDerWaalsContact O-N 3.12Å; D165-V169 VanDerWaalsContact O-CG2 3.25Å; D165-V169 WeakPolarHBondContact O-CG2 3.48Å; D165-V169 PolarHBondContact O-N 2.91Å |
| 166 | F | 88.4 | Confident | 87.4 | Confident | 22 Ų | 22 | 58.1 Ų | 58.1 | 10% | 0.096 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -56 | -45.1 | 173.7 | -178.9 | -102.7 | 0 | 0 | 0 | 112.5 | I113 F114 F117 V161 S162 F163 L170 | I113-F166 HydrophobicContact CB-CZ 4.39Å; I113-F166 HydrophobicContact CG2-CE1 4.34Å; I113-F166 HydrophobicContact CG2-CZ 3.72Å; F114-F166 HydrophobicContact CB-CD1 4.13Å; F114-F166 HydrophobicContact CB-CE1 4.05Å; F114-F166 HydrophobicContact CD2-CB 3.79Å; F114-F166 AromaticContact CD2-CD1 3.79Å; F114-F166 HydrophobicContact CD2-CD1 3.79Å; F114-F166 HydrophobicContact CD2-CD2 4.15Å; F114-F166 HydrophobicContact CD2-CE1 4.37Å; F114-F166 AromaticContact CD2-CG 3.65Å; F114-F166 HydrophobicContact CD2-CG 3.65Å; F114-F166 HydrophobicContact CE2-CB 3.98Å; F114-F166 HydrophobicContact CE2-CG 4.3Å; F114-F166 HydrophobicContact CG-CD1 4.44Å; F117-F166 HydrophobicContact CD2-CE2 4.08Å; F117-F166 HydrophobicContact CD2-CZ 4.17Å; F117-F166 HydrophobicContact CE2-CE2 4.44Å; F117-F166 HydrophobicContact CE2-CZ 4.44Å; V161-F166 HydrophobicContact CG1-CB 4.36Å; S162-F166 WeakPolarHBondContact O-CB 3.35Å; S162-F166 PolarHBondContact O-N 3Å; F163-F166 HydrophobicContact CD2-CD1 4.48Å; F166-L170 HydrophobicContact CD1-CD1 3.98Å; F166-L170 HydrophobicContact CD2-CD1 4.43Å; F166-L170 HydrophobicContact CE1-CD1 3.32Å; F166-L170 HydrophobicContact CE1-CG 4.33Å; F166-L170 HydrophobicContact CE2-CD1 3.83Å; F166-L170 HydrophobicContact CE2-CG 4.3Å; F166-L170 HydrophobicContact CG-CD1 4.5Å; F166-L170 HydrophobicContact CZ-CD1 3.23Å; F166-L170 HydrophobicContact CZ-CG 4.16Å; F166-L170 WeakPolarHBondContact O-CB 3.39Å; F166-L170 WeakPolarHBondContact O-CG 3.39Å; F166-L170 PolarHBondContact O-N 2.52Å |
| 167 | L | 89.1 | Confident | 87.3 | Confident | 11 Ų | 11 | 56.1 Ų | 56.1 | 6% | 0.058 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -61.6 | -51.1 | 173.2 | -103.3 | 71.6 | 0 | 0 | 0 | 110.9 | L99 L102 L107 F110 F163 K164 D165 V169 L170 T171 | L99-L167 HydrophobicContact CD2-CB 4.09Å; L99-L167 HydrophobicContact CD2-CD2 4.36Å; L102-L167 HydrophobicContact CD1-CD2 3.52Å; L102-L167 HydrophobicContact CD1-CG 4.16Å; L107-L167 HydrophobicContact CD1-CD2 3.8Å; F110-L167 HydrophobicContact CB-CD1 3.89Å; F110-L167 HydrophobicContact CG-CD1 4.36Å; F163-L167 HydrophobicContact CD1-CD1 4.09Å; F163-L167 HydrophobicContact CD2-CD1 3.85Å; F163-L167 HydrophobicContact CE1-CD1 3.59Å; F163-L167 HydrophobicContact CE1-CD2 4.27Å; F163-L167 HydrophobicContact CE2-CD1 3.31Å; F163-L167 HydrophobicContact CG-CD1 4.22Å; F163-L167 HydrophobicContact CZ-CD1 3.16Å; F163-L167 HydrophobicContact CZ-CD2 4.4Å; F163-L167 HydrophobicContact CZ-CG 4.41Å; F163-L167 WeakPolarHBondContact O-CD1 3.48Å; F163-L167 PolarHBondContact O-N 2.85Å; K164-L167 PolarHBondContact O-N 2.81Å; D165-L167 VanDerWaalsContact C-N 3.32Å; D165-L167 PolarHBondContact O-N 3.25Å; L167-V169 PolarHBondContact O-N 2.85Å; L167-L170 PolarHBondContact O-N 3.01Å; L167-T171 WeakPolarHBondContact O-CB 3.29Å; L167-T171 WeakPolarHBondContact O-CG2 3.07Å; L167-T171 PolarHBondContact O-N 3.44Å; L167-T171 PolarHBondContact O-OG1 2.93Å |
| 168 | G | 88.1 | Confident | 87.3 | Confident | 9 Ų | 9 | 56.6 Ų | 56.6 | 9% | 0.093 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -55.8 | -38.6 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | K164 D165 D172 | K164-G168 PolarHBondContact O-N 2.93Å; D165-G168 PolarHBondContact O-N 3.23Å; D165-G168 VanDerWaalsContact O-N 3.12Å; G168-D172 WeakPolarHBondContact O-CB 3.49Å; G168-D172 PolarHBondContact O-N 3.27Å |
| 169 | V | 88.6 | Confident | 87.2 | Confident | 13 Ų | 13 | 52.8 Ų | 52.8 | 8% | 0.079 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -71.3 | -41.1 | 176.5 | 176.2 | 0 | 0 | 0 | 0 | 112 | A153 L155 D165 L167 D172 L176 | A153-V169 HydrophobicContact CB-CG2 4.13Å; L155-V169 HydrophobicContact CD2-CG2 4.38Å; L155-V169 HydrophobicContact CG-CG2 4.5Å; D165-V169 VanDerWaalsContact O-CG2 3.25Å; D165-V169 WeakPolarHBondContact O-CG2 3.48Å; D165-V169 PolarHBondContact O-N 2.91Å; L167-V169 PolarHBondContact O-N 2.85Å; V169-D172 VanDerWaalsContact O-O 3.12Å; V169-L176 WeakPolarHBondContact O-CB 3.4Å; V169-L176 PolarHBondContact O-N 2.9Å |
| 170 | L | 86.1 | Confident | 87.2 | Confident | 50 Ų | 50 | 54 Ų | 54 | 26% | 0.262 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -79.2 | -29.9 | -177.2 | -72.2 | -171 | 0 | 0 | 0 | 114 | F110 F166 L167 L176 | F110-L170 HydrophobicContact CD1-CD1 3.78Å; F110-L170 HydrophobicContact CE1-CB 4.05Å; F110-L170 HydrophobicContact CE1-CD1 3.84Å; F166-L170 HydrophobicContact CD1-CD1 3.98Å; F166-L170 HydrophobicContact CD2-CD1 4.43Å; F166-L170 HydrophobicContact CE1-CD1 3.32Å; F166-L170 HydrophobicContact CE1-CG 4.33Å; F166-L170 HydrophobicContact CE2-CD1 3.83Å; F166-L170 HydrophobicContact CE2-CG 4.3Å; F166-L170 HydrophobicContact CG-CD1 4.5Å; F166-L170 HydrophobicContact CZ-CD1 3.23Å; F166-L170 HydrophobicContact CZ-CG 4.16Å; F166-L170 WeakPolarHBondContact O-CB 3.39Å; F166-L170 WeakPolarHBondContact O-CG 3.39Å; F166-L170 PolarHBondContact O-N 2.52Å; L167-L170 PolarHBondContact O-N 3.01Å; L170-L176 HydrophobicContact CD2-CD1 4Å |
| 171 | T | 87.1 | Confident | 87.1 | Confident | 39 Ų | 39 | 52.1 Ų | 52.1 | 24% | 0.239 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -84.5 | -23.8 | 178.3 | 59.3 | 0 | 0 | 0 | 0 | 112 | S98 L102 F110 L167 | S98-T171 PolarHBondContact O-OG1 2.49Å; L102-T171 HydrophobicContact CD1-CG2 4.1Å; L102-T171 HydrophobicContact CD2-CG2 4.21Å; F110-T171 HydrophobicContact CZ-CG2 4.46Å; L167-T171 WeakPolarHBondContact O-CB 3.29Å; L167-T171 WeakPolarHBondContact O-CG2 3.07Å; L167-T171 PolarHBondContact O-N 3.44Å; L167-T171 PolarHBondContact O-OG1 2.93Å |
| 172 | D | 88.1 | Confident | 86.7 | Confident | 49 Ų | 49 | 52.5 Ų | 52.5 | 26% | 0.262 | 28% | 0.275 | S | S | . | . | trans | -89.5 | 104.4 | 172.5 | -175.9 | -25.6 | 0 | 0 | 0 | 110.6 | G168 V169 H174 R175 L176 | G168-D172 WeakPolarHBondContact O-CB 3.49Å; G168-D172 PolarHBondContact O-N 3.27Å; V169-D172 VanDerWaalsContact O-O 3.12Å; D172-H174 PolarHBondContact O-N 2.96Å; D172-H174 WeakPolarHBondContact OD1-CA 3.26Å; D172-H174 VanDerWaalsContact OD1-CB 3.29Å; D172-H174 WeakPolarHBondContact OD1-CB 3.33Å; D172-H174 PolarHBondContact OD1-N 3.5Å; D172-R175 HydrophobicContact CB-CB 3.83Å; D172-R175 HydrophobicContact CB-CG 3.72Å; D172-R175 PolarHBondContact O-N 3.11Å; D172-R175 PolarHBondContact OD1-N 3.31Å; D172-R175 WeakPolarHBondContact OD2-CG 2.96Å; D172-L176 WeakPolarHBondContact O-CB 3.25Å; D172-L176 PolarHBondContact O-N 3.49Å | ||
| 173 | N | 85.6 | Confident | 86.1 | Confident | 133 Ų | 133 | 52 Ų | 52 | 71% | 0.711 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -56.1 | -35.3 | 176.9 | -79 | -47.2 | 0 | 0 | 0 | 113.4 | A177 | N173-A177 WeakPolarHBondContact O-CB 3.25Å; N173-A177 PolarHBondContact O-N 3.33Å |
| 174 | H | 86.8 | Confident | 85.3 | Confident | 132 Ų | 132 | 53.2 Ų | 53.2 | 61% | 0.611 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -71 | -43.3 | 179.4 | 176.4 | -85.7 | 0 | 0 | 0 | 110.6 | D172 A177 Q178 | D172-H174 PolarHBondContact O-N 2.96Å; D172-H174 WeakPolarHBondContact OD1-CA 3.26Å; D172-H174 VanDerWaalsContact OD1-CB 3.29Å; D172-H174 WeakPolarHBondContact OD1-CB 3.33Å; D172-H174 PolarHBondContact OD1-N 3.5Å; H174-A177 PolarHBondContact O-N 3.49Å; H174-Q178 WeakPolarHBondContact O-CB 3.46Å; H174-Q178 PolarHBondContact O-N 2.91Å |
| 175 | R | 86.5 | Confident | 84.2 | Confident | 94 Ų | 94 | 54.4 Ų | 54.4 | 36% | 0.355 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -63 | -48 | 175.7 | -69.1 | -84.3 | 159.4 | -165.4 | -4.3 | 111.5 | D172 A177 Q178 C179 | D172-R175 HydrophobicContact CB-CB 3.83Å; D172-R175 HydrophobicContact CB-CG 3.72Å; D172-R175 PolarHBondContact O-N 3.11Å; D172-R175 PolarHBondContact OD1-N 3.31Å; D172-R175 WeakPolarHBondContact OD2-CG 2.96Å; R175-A177 VanDerWaalsContact C-N 3.33Å; R175-A177 PolarHBondContact O-N 3.39Å; R175-Q178 WeakPolarHBondContact O-CB 3.48Å; R175-Q178 PolarHBondContact O-N 2.95Å; R175-Q178 VanDerWaalsContact O-N 3.16Å; R175-C179 PolarHBondContact O-N 3.07Å |
| 176 | L | 86 | Confident | 82.7 | Confident | 53 Ų | 53 | 56.5 Ų | 56.5 | 28% | 0.277 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -57.5 | -48.1 | 176.4 | -178.8 | 58.6 | 0 | 0 | 0 | 111 | V169 L170 D172 Q178 C179 M180 | V169-L176 WeakPolarHBondContact O-CB 3.4Å; V169-L176 PolarHBondContact O-N 2.9Å; L170-L176 HydrophobicContact CD2-CD1 4Å; D172-L176 WeakPolarHBondContact O-CB 3.25Å; D172-L176 PolarHBondContact O-N 3.49Å; L176-Q178 VanDerWaalsContact C-N 3.31Å; L176-Q178 PolarHBondContact O-N 3.36Å; L176-C179 PolarHBondContact O-N 3.24Å; L176-M180 HydrophobicContact CD1-CG 4.11Å; L176-M180 HydrophobicContact CG-CG 4.43Å; L176-M180 WeakPolarHBondContact O-CB 3.42Å; L176-M180 VanDerWaalsContact O-CG 3.24Å; L176-M180 WeakPolarHBondContact O-CG 3.4Å; L176-M180 PolarHBondContact O-N 2.99Å |
| 177 | A | 86.6 | Confident | 81.2 | Confident | 58 Ų | 58 | 59.8 Ų | 59.8 | 48% | 0.479 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -60.8 | -40.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | N173 H174 R175 M180 A181 | N173-A177 WeakPolarHBondContact O-CB 3.25Å; N173-A177 PolarHBondContact O-N 3.33Å; H174-A177 PolarHBondContact O-N 3.49Å; R175-A177 VanDerWaalsContact C-N 3.33Å; R175-A177 PolarHBondContact O-N 3.39Å; A177-M180 PolarHBondContact O-N 3.27Å; A177-A181 WeakPolarHBondContact O-CB 3.09Å; A177-A181 PolarHBondContact O-N 3.48Å |
| 178 | Q | 86 | Confident | 79.5 | Confident | 69 Ų | 69 | 68.7 Ų | 68.7 | 32% | 0.322 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -63.7 | -47.9 | 177.3 | -172.9 | 177.4 | 4.8 | 0 | 0 | 111.8 | L152 H174 R175 L176 A181 T182 | L152-Q178 HydrophobicContact CD2-CG 4.48Å; H174-Q178 WeakPolarHBondContact O-CB 3.46Å; H174-Q178 PolarHBondContact O-N 2.91Å; R175-Q178 WeakPolarHBondContact O-CB 3.48Å; R175-Q178 PolarHBondContact O-N 2.95Å; R175-Q178 VanDerWaalsContact O-N 3.16Å; L176-Q178 VanDerWaalsContact C-N 3.31Å; L176-Q178 PolarHBondContact O-N 3.36Å; Q178-A181 PolarHBondContact O-N 3.36Å; Q178-T182 PolarHBondContact O-N 3.12Å; Q178-T182 PolarHBondContact O-OG1 2.99Å; Q178-T182 VanDerWaalsContact O-OG1 3.06Å |
| 179 | C | 84.1 | Confident | 77.5 | Confident | 10 Ų | 10 | 74 Ų | 74 | 7% | 0.068 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -58.3 | -48.4 | 175.3 | -77.4 | 0 | 0 | 0 | 0 | 111.6 | L152 R175 L176 A181 T182 I183 | L152-C179 VanDerWaalsContact CB-SG 3.5Å; R175-C179 PolarHBondContact O-N 3.07Å; L176-C179 PolarHBondContact O-N 3.24Å; C179-A181 VanDerWaalsContact C-N 3.33Å; C179-A181 PolarHBondContact O-N 3.07Å; C179-T182 WeakPolarHBondContact O-CB 3.4Å; C179-T182 PolarHBondContact O-N 3.47Å; C179-I183 PolarHBondContact O-N 3.07Å |
| 180 | M | 82.6 | Confident | 75.7 | Confident | 87 Ų | 87 | 79.8 Ų | 79.8 | 43% | 0.429 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -65.7 | -35 | 179 | -69.3 | -63.5 | 103.1 | 0 | 0 | 112.6 | L176 A177 I183 S184 | L176-M180 HydrophobicContact CD1-CG 4.11Å; L176-M180 HydrophobicContact CG-CG 4.43Å; L176-M180 WeakPolarHBondContact O-CB 3.42Å; L176-M180 VanDerWaalsContact O-CG 3.24Å; L176-M180 WeakPolarHBondContact O-CG 3.4Å; L176-M180 PolarHBondContact O-N 2.99Å; A177-M180 PolarHBondContact O-N 3.27Å; M180-I183 HydrophobicContact CE-CD1 3.49Å; M180-I183 VanDerWaalsContact CE-CD1 3.49Å; M180-I183 PolarHBondContact O-N 2.78Å; M180-S184 WeakPolarHBondContact O-CB 3.48Å; M180-S184 PolarHBondContact O-N 3.3Å; M180-S184 PolarHBondContact O-OG 2.98Å |
| 181 | A | 83.9 | Confident | 73.7 | Confident | 33 Ų | 33 | 84.5 Ų | 84.5 | 27% | 0.273 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -68.3 | -35.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | A177 Q178 C179 S184 R185 | A177-A181 WeakPolarHBondContact O-CB 3.09Å; A177-A181 PolarHBondContact O-N 3.48Å; Q178-A181 PolarHBondContact O-N 3.36Å; C179-A181 VanDerWaalsContact C-N 3.33Å; C179-A181 PolarHBondContact O-N 3.07Å; A181-S184 PolarHBondContact O-N 2.95Å; A181-R185 VanDerWaalsContact O-CB 3.28Å; A181-R185 WeakPolarHBondContact O-CB 3.41Å; A181-R185 WeakPolarHBondContact O-CG 3.37Å; A181-R185 PolarHBondContact O-N 3.43Å; A181-R185 PolarHBondContact O-NE 2.98Å |
| 182 | T | 79 | Confident | 73 | Confident | 14 Ų | 14 | 86.8 Ų | 86.8 | 9% | 0.086 | 51% | 0.506 | C | S | . | . | H | α-helix | trans | -62 | -47.7 | 173 | -57.9 | 0 | 0 | 0 | 0 | 110.5 | E148 L152 Q178 C179 S184 R185 S186 | E148-T182 HydrophobicContact CB-CG2 3.91Å; E148-T182 VanDerWaalsContact OE2-CG2 3.28Å; E148-T182 WeakPolarHBondContact OE2-CG2 3.44Å; L152-T182 HydrophobicContact CD1-CG2 4.29Å; L152-T182 VanDerWaalsContact CD1-OG1 3.3Å; L152-T182 WeakPolarHBondContact CD1-OG1 3.4Å; Q178-T182 PolarHBondContact O-N 3.12Å; Q178-T182 PolarHBondContact O-OG1 2.99Å; Q178-T182 VanDerWaalsContact O-OG1 3.06Å; C179-T182 WeakPolarHBondContact O-CB 3.4Å; C179-T182 PolarHBondContact O-N 3.47Å; T182-S184 VanDerWaalsContact C-N 3.32Å; T182-S184 PolarHBondContact O-N 3.44Å; T182-R185 PolarHBondContact O-N 3.33Å; T182-S186 PolarHBondContact O-OG 3.46Å; T182-S186 VanDerWaalsContact O-OG 3.1Å |
| 183 | I | 77.1 | Confident | 72.2 | Confident | 21 Ų | 21 | 88.8 Ų | 88.8 | 11% | 0.108 | 52% | 0.519 | C | S | . | . | H | α-helix | trans | -61.3 | -37.6 | 177.4 | -70.4 | 163.2 | 0 | 0 | 0 | 112.6 | I139 L141 A149 C179 M180 | I139-I183 HydrophobicContact CG2-CG2 4.36Å; L141-I183 HydrophobicContact CD1-CD1 4.18Å; L141-I183 HydrophobicContact CD1-CG1 3.81Å; L141-I183 HydrophobicContact CD2-CB 4.25Å; L141-I183 HydrophobicContact CD2-CG1 4.17Å; L141-I183 HydrophobicContact CD2-CG2 3.52Å; A149-I183 HydrophobicContact CB-CD1 4.44Å; A149-I183 HydrophobicContact CB-CG1 4.47Å; C179-I183 PolarHBondContact O-N 3.07Å; M180-I183 HydrophobicContact CE-CD1 3.49Å; M180-I183 VanDerWaalsContact CE-CD1 3.49Å; M180-I183 PolarHBondContact O-N 2.78Å |
| 184 | S | 73.1 | Confident | 71.5 | Confident | 81 Ų | 81 | 86.3 Ų | 86.3 | 57% | 0.566 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -83.5 | -23.3 | -176.4 | -58.4 | 0 | 0 | 0 | 0 | 114.2 | M180 A181 T182 | M180-S184 WeakPolarHBondContact O-CB 3.48Å; M180-S184 PolarHBondContact O-N 3.3Å; M180-S184 PolarHBondContact O-OG 2.98Å; A181-S184 PolarHBondContact O-N 2.95Å; T182-S184 VanDerWaalsContact C-N 3.32Å; T182-S184 PolarHBondContact O-N 3.44Å |
| 185 | R | 65.4 | Low | 70.6 | Confident | 157 Ų | 157 | 83.6 Ų | 83.6 | 59% | 0.592 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -77.4 | -27.5 | -175.5 | -83.5 | 178.9 | -77.5 | -166.1 | -0.3 | 113.3 | A181 T182 | A181-R185 VanDerWaalsContact O-CB 3.28Å; A181-R185 WeakPolarHBondContact O-CB 3.41Å; A181-R185 WeakPolarHBondContact O-CG 3.37Å; A181-R185 PolarHBondContact O-N 3.43Å; A181-R185 PolarHBondContact O-NE 2.98Å; T182-R185 PolarHBondContact O-N 3.33Å |
| 186 | S | 59.2 | Low | 69.6 | Low | 51 Ų | 51 | 83 Ų | 83 | 36% | 0.357 | 51% | 0.511 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.6 | -8.1 | -171.5 | 50.5 | 0 | 0 | 0 | 0 | 113.8 | E145 T182 R188 | E145-S186 WeakPolarHBondContact CG-OG 3.46Å; E145-S186 WeakPolarHBondContact OE1-CB 3.31Å; E145-S186 PolarHBondContact OE1-OG 2.85Å; T182-S186 PolarHBondContact O-OG 3.46Å; T182-S186 VanDerWaalsContact O-OG 3.1Å; S186-R188 PolarHBondContact O-N 2.82Å |
| 187 | S | 55.3 | Low | 68.5 | Low | 92 Ų | 92 | 85 Ų | 85 | 64% | 0.643 | 53% | 0.527 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.6 | -1.4 | 165.5 | -102.1 | 0 | 0 | 0 | 0 | 114.7 | P189 | S187-P189 WeakPolarHBondContact O-CD 3.44Š|
| 188 | R | 55.3 | Low | 67.2 | Low | 198 Ų | 198 | 86.9 Ų | 86.9 | 75% | 0.747 | 53% | 0.53 | S | S | * | . | S | Bend | trans | -77.9 | 116.9 | 172 | -65.7 | -175.3 | -173.1 | -121.8 | 0.6 | 108 | S186 C190 | S186-R188 PolarHBondContact O-N 2.82Å; R188-C190 PolarHBondContact O-N 3.5Å |
| 189 | P | 45.9 | Very low | 65.8 | Low | 120 Ų | 120 | 88.3 Ų | 88.3 | 78% | 0.779 | 55% | 0.546 | S | S | * | . | trans | -62.5 | 124.5 | 173.5 | 24.5 | -27.2 | 0 | 0 | 0 | 107.4 | S187 G191 | S187-P189 WeakPolarHBondContact O-CD 3.44Å; P189-G191 PolarHBondContact O-N 3.47Å | ||
| 190 | C | 50.5 | Low | 64.2 | Low | 135 Ų | 135 | 94.8 Ų | 94.8 | 91% | 0.912 | 59% | 0.586 | S | S | * | * | trans | -53.1 | 114.1 | 166.8 | -58.7 | 0 | 0 | 0 | 0 | 107.3 | R188 | R188-C190 PolarHBondContact O-N 3.5Š| ||
| 191 | G | 43.5 | Very low | 62.6 | Low | 149 Ų | 149 | 95.5 Ų | 95.5 | 100% | 1.536 | 60% | 0.6 | S | S | * | * | trans | -80.2 | 0 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | P189 | P189-G191 PolarHBondContact O-N 3.47Š|
Retrieved 191 of 191 residues in 287.9 ms
(Link to these results)