| 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 | 32 | Very low | 34.9 | Very low | 241 Ų | 241 | 151.3 Ų | 151.3 | 100% | 1.187 | 88% | 0.875 | S | S | * | * | 0 | 129.4 | 0 | -67.4 | 171.6 | 103.7 | 0 | 0 | 107.3 | |||||
| 2 | H | 34.2 | Very low | 35.8 | Very low | 175 Ų | 175 | 148.1 Ų | 148.1 | 81% | 0.81 | 87% | 0.868 | S | S | * | * | trans | 26.5 | 143.2 | 165.2 | -72 | 8.4 | 0 | 0 | 0 | 119.9 | ||||
| 3 | R | 34.5 | Very low | 36.6 | Very low | 228 Ų | 228 | 156.1 Ų | 156.1 | 86% | 0.86 | 87% | 0.874 | S | S | * | * | cis | -174.2 | 153.1 | 14.9 | -129.8 | 177.7 | 179.8 | -179 | -0.9 | 106.2 | ||||
| 4 | G | 31.7 | Very low | 37.2 | Very low | 77 Ų | 77 | 156.1 Ų | 156.1 | 79% | 0.794 | 87% | 0.871 | S | S | * | * | trans | 85.8 | 116.6 | 143.2 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 5 | A | 35.2 | Very low | 37.9 | Very low | 107 Ų | 107 | 156.6 Ų | 156.6 | 88% | 0.884 | 87% | 0.869 | S | S | * | * | trans | -167.3 | 120.2 | 132.6 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 6 | Q | 37.5 | Very low | 38.2 | Very low | 178 Ų | 178 | 156.9 Ų | 156.9 | 83% | 0.832 | 86% | 0.862 | S | S | * | * | trans | -81.8 | 162.3 | 165.7 | -149.8 | 168.6 | -14 | 0 | 0 | 107.7 | ||||
| 7 | E | 33.8 | Very low | 38.6 | Very low | 189 Ų | 189 | 161.5 Ų | 161.5 | 88% | 0.883 | 86% | 0.863 | S | S | * | * | trans | 84.7 | 118.1 | 164.9 | -57.4 | 178.9 | 161.1 | 0 | 0 | 118.3 | ||||
| 8 | G | 33.8 | Very low | 38.6 | Very low | 84 Ų | 84 | 160.6 Ų | 160.6 | 87% | 0.866 | 86% | 0.857 | S | S | * | * | trans | 147.8 | 68.1 | 163.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 9 | A | 33.8 | Very low | 39 | Very low | 101 Ų | 101 | 164.6 Ų | 164.6 | 84% | 0.835 | 86% | 0.859 | S | S | * | * | trans | -150.5 | 47.6 | 161.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 10 | M | 39.3 | Very low | 39.3 | Very low | 202 Ų | 202 | 165.1 Ų | 165.1 | 100% | 0.995 | 86% | 0.857 | S | S | * | * | trans | -91.7 | 85.8 | 155.9 | -91.6 | -124.7 | -96.9 | 0 | 0 | 108.3 | ||||
| 11 | A | 38.3 | Very low | 39.3 | Very low | 82 Ų | 82 | 160.9 Ų | 160.9 | 68% | 0.678 | 85% | 0.846 | S | S | * | * | trans | -176.8 | 154.7 | 157.4 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 12 | S | 45.3 | Very low | 39.7 | Very low | 113 Ų | 113 | 158 Ų | 158 | 79% | 0.79 | 84% | 0.835 | S | S | * | * | S | Bend | trans | 94.5 | 46.9 | 165 | -27.6 | 0 | 0 | 0 | 0 | 118.2 | ||
| 13 | R | 46.9 | Very low | 39.9 | Very low | 252 Ų | 252 | 154.5 Ų | 154.5 | 95% | 0.951 | 84% | 0.836 | S | S | * | * | S | Bend | trans | -138.8 | 20.3 | 147.3 | -65.8 | -166.5 | -173.1 | -174.8 | 3.5 | 114.8 | ||
| 14 | L | 44.2 | Very low | 39.7 | Very low | 157 Ų | 157 | 147.5 Ų | 147.5 | 82% | 0.822 | 83% | 0.834 | S | S | * | * | S | Bend | trans | -104.7 | 15.4 | -179 | -144.6 | 84.5 | 0 | 0 | 0 | 115.1 | ||
| 15 | L | 47.7 | Very low | 39.8 | Very low | 163 Ų | 163 | 152.2 Ų | 152.2 | 85% | 0.853 | 84% | 0.841 | S | S | * | * | S | Bend | trans | -129.9 | 20.5 | -179 | -72.4 | 176 | 0 | 0 | 0 | 115.3 | ||
| 16 | H | 42.4 | Very low | 39.6 | Very low | 162 Ų | 162 | 150.6 Ų | 150.6 | 75% | 0.75 | 84% | 0.835 | S | S | * | * | S | Bend | trans | -102.4 | -14.9 | 170.6 | -160.2 | -55.9 | 0 | 0 | 0 | 113.2 | ||
| 17 | R | 44.9 | Very low | 39.8 | Very low | 235 Ų | 235 | 148.8 Ų | 148.8 | 89% | 0.887 | 84% | 0.839 | S | S | * | * | S | Bend | trans | -97.1 | 1 | -176.5 | -79.9 | -175.9 | 176.8 | 175 | -1.4 | 115.7 | ||
| 18 | L | 40.1 | Very low | 39.5 | Very low | 144 Ų | 144 | 143.1 Ų | 143.1 | 75% | 0.754 | 83% | 0.831 | S | S | * | * | S | Bend | trans | -107.2 | 26.1 | -179.3 | -80.1 | 168.8 | 0 | 0 | 0 | 114.5 | ||
| 19 | R | 45.5 | Very low | 39.5 | Very low | 237 Ų | 237 | 148.7 Ų | 148.7 | 89% | 0.894 | 84% | 0.835 | S | S | * | * | S | Bend | trans | -121.8 | -0 | 171 | -153.8 | 176.9 | -109.5 | 163.7 | -4.3 | 114.4 | ||
| 20 | H | 45.4 | Very low | 39.3 | Very low | 175 Ų | 175 | 148.7 Ų | 148.7 | 81% | 0.81 | 84% | 0.835 | S | S | * | * | S | Bend | trans | -112.9 | 6 | 177.6 | -87.4 | -72.4 | 0 | 0 | 0 | 114.5 | ||
| 21 | A | 39.8 | Very low | 38.9 | Very low | 77 Ų | 77 | 143.9 Ų | 143.9 | 64% | 0.636 | 83% | 0.827 | S | S | * | * | S | Bend | trans | -103.9 | 14.7 | -173.9 | 0 | 0 | 0 | 0 | 0 | 115 | ||
| 22 | L | 39.3 | Very low | 38.5 | Very low | 181 Ų | 181 | 144.6 Ų | 144.6 | 95% | 0.948 | 83% | 0.833 | S | S | * | * | S | Bend | trans | -130.8 | 25.2 | -178.5 | -73.6 | 176.3 | 0 | 0 | 0 | 114.7 | ||
| 23 | A | 39.1 | Very low | 37.5 | Very low | 100 Ų | 100 | 145.8 Ų | 145.8 | 83% | 0.826 | 84% | 0.836 | S | S | * | * | S | Bend | trans | -143 | 106.4 | 170.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||
| 24 | G | 30.7 | Very low | 37.3 | Very low | 81 Ų | 81 | 139.6 Ų | 139.6 | 84% | 0.835 | 83% | 0.828 | S | S | * | * | trans | 135.1 | 85.1 | 161.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 25 | D | 33.7 | Very low | 36.7 | Very low | 176 Ų | 176 | 141.3 Ų | 141.3 | 94% | 0.941 | 83% | 0.832 | S | S | * | * | trans | -65.6 | 146 | 163.7 | -83.3 | -40.3 | 0 | 0 | 0 | 112.8 | ||||
| 26 | G | 30.9 | Very low | 36 | Very low | 73 Ų | 73 | 138.2 Ų | 138.2 | 75% | 0.753 | 83% | 0.83 | S | S | * | * | trans | 112 | 148.2 | 145.3 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 27 | P | 40.3 | Very low | 35.5 | Very low | 140 Ų | 140 | 139.3 Ų | 139.3 | 91% | 0.909 | 84% | 0.836 | S | S | * | * | -124.7 | 167.2 | -124.4 | 38.4 | -24.6 | 0 | 0 | 0 | 117 | |||||
| 28 | G | 29 | Very low | 34.9 | Very low | 70 Ų | 70 | 137.1 Ų | 137.1 | 72% | 0.722 | 84% | 0.835 | S | S | * | * | trans | 131.5 | 94.5 | 141.2 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 29 | E | 31.9 | Very low | 34.5 | Very low | 201 Ų | 201 | 140 Ų | 140 | 94% | 0.939 | 84% | 0.842 | S | S | * | * | trans | 61.5 | 137 | 141.1 | -77.8 | 175.7 | 150.5 | 0 | 0 | 121.5 | ||||
| 30 | A | 30.4 | Very low | 34.2 | Very low | 101 Ų | 101 | 134.5 Ų | 134.5 | 84% | 0.835 | 84% | 0.837 | S | S | * | * | cis | -153.6 | 147.3 | 0.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 31 | A | 30.2 | Very low | 33.6 | Very low | 101 Ų | 101 | 135.5 Ų | 135.5 | 84% | 0.835 | 84% | 0.842 | S | S | * | * | trans | -118.5 | 156 | -178.7 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 32 | A | 29.8 | Very low | 33.2 | Very low | 97 Ų | 97 | 137.6 Ų | 137.6 | 80% | 0.802 | 85% | 0.852 | S | S | * | * | trans | -178.7 | 120.4 | 132.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 33 | T | 25.9 | Very low | 33 | Very low | 138 Ų | 138 | 134.6 Ų | 134.6 | 85% | 0.847 | 85% | 0.846 | S | S | * | * | trans | -135.9 | 172.8 | 155.7 | 57.2 | 0 | 0 | 0 | 0 | 107 | ||||
| 34 | P | 42.6 | Very low | 32.9 | Very low | 123 Ų | 123 | 138.7 Ų | 138.7 | 80% | 0.799 | 85% | 0.848 | S | S | * | * | -108.4 | 160.8 | -97 | 21.4 | 0.4 | 0 | 0 | 0 | 113.6 | |||||
| 35 | E | 31.6 | Very low | 33.1 | Very low | 192 Ų | 192 | 142.7 Ų | 142.7 | 90% | 0.897 | 85% | 0.85 | S | S | * | * | P | Polyproline II helix | trans | -77.9 | 139.8 | 174.1 | -69.2 | -178.6 | 141.7 | 0 | 0 | 112 | ||
| 36 | A | 32.5 | Very low | 33.4 | Very low | 98 Ų | 98 | 142.9 Ų | 142.9 | 81% | 0.81 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -89.4 | 117.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||
| 37 | E | 32.9 | Very low | 33.9 | Very low | 186 Ų | 186 | 147.1 Ų | 147.1 | 87% | 0.869 | 85% | 0.85 | S | S | * | * | P | Polyproline II helix | trans | -80.9 | 125.9 | 175.5 | -72.1 | -174 | 150.5 | 0 | 0 | 111.4 | ||
| 38 | Q | 31.1 | Very low | 33.9 | Very low | 189 Ų | 189 | 147.3 Ų | 147.3 | 88% | 0.883 | 84% | 0.844 | S | S | * | * | P | Polyproline II helix | trans | -78.4 | 132 | 169.7 | -70.6 | 166.8 | -2.5 | 0 | 0 | 109.5 | ||
| 39 | F | 32.7 | Very low | 34.4 | Very low | 204 Ų | 204 | 150.8 Ų | 150.8 | 90% | 0.895 | 85% | 0.846 | S | S | * | * | P | Polyproline II helix | trans | -77.6 | 135.1 | 170.3 | -82.7 | -98 | 0 | 0 | 0 | 110.6 | ||
| 40 | P | 39.3 | Very low | 34.9 | Very low | 121 Ų | 121 | 146.2 Ų | 146.2 | 79% | 0.786 | 84% | 0.842 | S | S | * | * | P | Polyproline II helix | trans | -98.6 | 156.1 | 162.2 | 32.5 | -22.4 | 0 | 0 | 0 | 112.7 | ||
| 41 | E | 32.8 | Very low | 35.6 | Very low | 196 Ų | 196 | 150.7 Ų | 150.7 | 92% | 0.916 | 85% | 0.846 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 152.9 | -170.9 | -66.6 | 167 | 133.5 | 0 | 0 | 115.3 | ||
| 42 | S | 29.8 | Very low | 36.5 | Very low | 121 Ų | 121 | 149 Ų | 149 | 85% | 0.846 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -88.4 | 126 | 178 | 9 | 0 | 0 | 0 | 0 | 110 | ||
| 43 | S | 35.5 | Very low | 36.9 | Very low | 118 Ų | 118 | 153.2 Ų | 153.2 | 83% | 0.825 | 85% | 0.847 | S | S | * | * | P | Polyproline II helix | trans | -74.4 | 134.1 | 168.3 | -58.2 | 0 | 0 | 0 | 0 | 111.2 | ||
| 44 | E | 37.3 | Very low | 37.6 | Very low | 187 Ų | 187 | 152.2 Ų | 152.2 | 87% | 0.874 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 131.6 | 166.6 | -63.6 | 179.7 | 130.8 | 0 | 0 | 110.3 | ||
| 45 | L | 34.6 | Very low | 37.6 | Very low | 165 Ų | 165 | 151.8 Ų | 151.8 | 86% | 0.864 | 85% | 0.845 | S | S | * | * | trans | -142.3 | 114.2 | 155.2 | -73 | 177.5 | 0 | 0 | 0 | 107.6 | ||||
| 46 | E | 40 | Very low | 38.4 | Very low | 180 Ų | 180 | 154.2 Ų | 154.2 | 84% | 0.841 | 85% | 0.846 | S | S | * | * | trans | -63.6 | 142.9 | 156.8 | -68.3 | 169.8 | 153 | 0 | 0 | 108.3 | ||||
| 47 | D | 42.4 | Very low | 38.9 | Very low | 162 Ų | 162 | 158.1 Ų | 158.1 | 87% | 0.866 | 85% | 0.852 | S | S | * | * | trans | -156.8 | 129.1 | 152.3 | -90 | -33.5 | 0 | 0 | 0 | 109.9 | ||||
| 48 | D | 38.9 | Very low | 39.4 | Very low | 143 Ų | 143 | 155.5 Ų | 155.5 | 77% | 0.765 | 86% | 0.855 | S | S | * | * | trans | -70.7 | 161.2 | -173.1 | -77.5 | -40.7 | 0 | 0 | 0 | 115.5 | ||||
| 49 | D | 41.1 | Very low | 40.1 | Very low | 143 Ų | 143 | 149.3 Ų | 149.3 | 77% | 0.765 | 84% | 0.842 | S | S | * | * | trans | 48.8 | 110.6 | 141.5 | -58 | -24.3 | 0 | 0 | 0 | 121.1 | ||||
| 50 | A | 41.6 | Very low | 40.7 | Very low | 105 Ų | 105 | 146.5 Ų | 146.5 | 87% | 0.868 | 84% | 0.841 | S | S | * | * | trans | -153.2 | 83 | 138.5 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 51 | E | 45.5 | Very low | 40.8 | Very low | 196 Ų | 196 | 146.7 Ų | 146.7 | 92% | 0.916 | 84% | 0.835 | S | S | * | * | trans | -59 | 148.5 | 157.9 | -72.9 | -174.6 | 146.5 | 0 | 0 | 110.7 | ||||
| 52 | G | 47.6 | Very low | 40.9 | Very low | 66 Ų | 66 | 143 Ų | 143 | 68% | 0.68 | 83% | 0.831 | S | S | * | * | trans | 93.9 | 70.4 | 153.5 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 53 | L | 39.2 | Very low | 41.2 | Very low | 185 Ų | 185 | 144.3 Ų | 144.3 | 97% | 0.969 | 82% | 0.822 | S | S | * | * | trans | -155.7 | 60.2 | 141.4 | -72.8 | -171.7 | 0 | 0 | 0 | 110.1 | ||||
| 54 | S | 40.8 | Very low | 41.3 | Very low | 117 Ų | 117 | 145.7 Ų | 145.7 | 82% | 0.818 | 83% | 0.825 | S | S | * | * | trans | -109.3 | 85.6 | 166.1 | 177.2 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 55 | S | 43 | Very low | 41.3 | Very low | 114 Ų | 114 | 141.9 Ų | 141.9 | 80% | 0.797 | 82% | 0.82 | S | S | * | * | trans | -160.8 | 121.3 | 162.5 | -75.8 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 56 | R | 48.4 | Very low | 41.5 | Very low | 243 Ų | 243 | 138.9 Ų | 138.9 | 92% | 0.917 | 82% | 0.819 | S | S | * | * | trans | 96.4 | 64.8 | 179.8 | -57 | 176.4 | 164.5 | -168 | -5 | 116.3 | ||||
| 57 | L | 43 | Very low | 41.4 | Very low | 179 Ų | 179 | 138.7 Ų | 138.7 | 94% | 0.937 | 82% | 0.818 | S | S | * | * | trans | -121.8 | 90.5 | 146.7 | -68 | 176.3 | 0 | 0 | 0 | 108.1 | ||||
| 58 | S | 42.1 | Very low | 41.1 | Very low | 132 Ų | 132 | 139.1 Ų | 139.1 | 92% | 0.923 | 82% | 0.82 | S | S | * | * | trans | -86.2 | 106.2 | 161 | 178.9 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 59 | G | 46.1 | Very low | 41 | Very low | 59 Ų | 59 | 139.3 Ų | 139.3 | 61% | 0.608 | 82% | 0.821 | S | S | * | * | trans | -162.4 | 115 | 174 | 0 | 0 | 0 | 0 | 0 | 108.1 | L61 | G59-L61 PolarHBondContact O-N 3.4Š| ||
| 60 | T | 46.4 | Very low | 40.9 | Very low | 145 Ų | 145 | 141.9 Ų | 141.9 | 89% | 0.89 | 83% | 0.828 | S | S | * | * | trans | -69.5 | 86.8 | -172.9 | 47.5 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 61 | L | 41 | Very low | 40.6 | Very low | 124 Ų | 124 | 144.1 Ų | 144.1 | 65% | 0.649 | 83% | 0.826 | S | S | * | * | trans | -89.5 | 113 | 162.6 | -64.6 | 177.8 | 0 | 0 | 0 | 107.9 | G59 F63 | G59-L61 PolarHBondContact O-N 3.4Å; L61-F63 HydrophobicContact CB-CD2 4.27Å; L61-F63 HydrophobicContact CB-CE2 3.66Å; L61-F63 HydrophobicContact CB-CZ 4.23Å; L61-F63 HydrophobicContact CD1-CE2 4.3Å; L61-F63 HydrophobicContact CD1-CZ 4.25Å; L61-F63 PolarHBondContact O-N 3.01Å | ||
| 62 | S | 35.4 | Very low | 40.2 | Very low | 120 Ų | 120 | 142.8 Ų | 142.8 | 84% | 0.839 | 83% | 0.825 | S | S | * | * | trans | -76.9 | 117.8 | 170.3 | -69.9 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 63 | F | 34.9 | Very low | 39.6 | Very low | 148 Ų | 148 | 148.1 Ų | 148.1 | 65% | 0.649 | 83% | 0.832 | S | S | * | * | trans | -106.2 | 118 | 168 | -66.5 | -87.1 | 0 | 0 | 0 | 108.1 | L61 | L61-F63 HydrophobicContact CB-CD2 4.27Å; L61-F63 HydrophobicContact CB-CE2 3.66Å; L61-F63 HydrophobicContact CB-CZ 4.23Å; L61-F63 HydrophobicContact CD1-CE2 4.3Å; L61-F63 HydrophobicContact CD1-CZ 4.25Å; L61-F63 PolarHBondContact O-N 3.01Å | ||
| 64 | T | 37.6 | Very low | 39.4 | Very low | 146 Ų | 146 | 147.2 Ų | 147.2 | 90% | 0.896 | 83% | 0.828 | S | S | * | * | trans | -94.7 | 98.1 | 163.8 | 54.1 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 65 | S | 36.8 | Very low | 39.1 | Very low | 108 Ų | 108 | 149.8 Ų | 149.8 | 76% | 0.755 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -98.7 | 125.1 | 165.9 | -58.8 | 0 | 0 | 0 | 0 | 107.2 | ||
| 66 | A | 40.2 | Very low | 38.7 | Very low | 102 Ų | 102 | 152 Ų | 152 | 84% | 0.843 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 139 | 170.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||
| 67 | E | 37 | Very low | 38 | Very low | 176 Ų | 176 | 148.8 Ų | 148.8 | 82% | 0.822 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -61 | 138.8 | -173.2 | -62.2 | 158.5 | -175.3 | 0 | 0 | 112.1 | ||
| 68 | D | 37.3 | Very low | 37.6 | Very low | 171 Ų | 171 | 148 Ų | 148 | 91% | 0.914 | 82% | 0.822 | S | S | * | * | trans | -129.2 | 120.9 | 148.3 | -89.5 | -32.7 | 0 | 0 | 0 | 105.5 | ||||
| 69 | D | 36.9 | Very low | 37.2 | Very low | 147 Ų | 147 | 148.7 Ų | 148.7 | 79% | 0.786 | 82% | 0.816 | S | S | * | * | trans | -66.4 | 131.4 | -179 | -62.3 | -56.7 | 0 | 0 | 0 | 111.8 | ||||
| 70 | E | 37.7 | Very low | 36.7 | Very low | 196 Ų | 196 | 150.4 Ų | 150.4 | 92% | 0.916 | 82% | 0.824 | S | S | * | * | trans | -144.5 | 129.3 | 143.7 | -70.2 | -166.6 | 167 | 0 | 0 | 109 | ||||
| 71 | D | 34.8 | Very low | 36.2 | Very low | 153 Ų | 153 | 151.9 Ų | 151.9 | 82% | 0.818 | 82% | 0.821 | S | S | * | * | trans | -57.3 | 145.9 | 178.2 | -58.6 | -62.8 | 0 | 0 | 0 | 112.6 | ||||
| 72 | D | 37 | Very low | 35.9 | Very low | 168 Ų | 168 | 150.6 Ų | 150.6 | 90% | 0.898 | 83% | 0.829 | S | S | * | * | trans | -165.1 | 124.8 | 134.6 | -93.3 | -30.6 | 0 | 0 | 0 | 109.9 | ||||
| 73 | E | 35.3 | Very low | 35.7 | Very low | 178 Ų | 178 | 147.9 Ų | 147.9 | 83% | 0.832 | 82% | 0.82 | S | S | * | * | trans | -68.8 | 143.1 | 171.1 | -62.2 | 171.3 | 161.7 | 0 | 0 | 109.6 | ||||
| 74 | D | 36.3 | Very low | 36.3 | Very low | 165 Ų | 165 | 146.9 Ų | 146.9 | 88% | 0.882 | 83% | 0.828 | S | S | * | * | trans | -175 | 139.2 | 130 | -88.9 | -28.1 | 0 | 0 | 0 | 111.1 | ||||
| 75 | E | 34.5 | Very low | 36.2 | Very low | 172 Ų | 172 | 147.2 Ų | 147.2 | 80% | 0.804 | 82% | 0.824 | S | S | * | * | trans | -73.2 | 151 | -177.1 | -61.2 | 169.2 | 152.8 | 0 | 0 | 111.6 | ||||
| 76 | D | 34.6 | Very low | 36.7 | Very low | 161 Ų | 161 | 147.7 Ų | 147.7 | 86% | 0.861 | 83% | 0.825 | S | S | * | * | 178 | 136.9 | 116.9 | -87.5 | -28.8 | 0 | 0 | 0 | 112.2 | |||||
| 77 | E | 33.9 | Very low | 36.7 | Very low | 175 Ų | 175 | 150.1 Ų | 150.1 | 82% | 0.818 | 82% | 0.823 | S | S | * | * | trans | -70.9 | 148.2 | 176.5 | -60.4 | 171.5 | 147.2 | 0 | 0 | 111.1 | ||||
| 78 | D | 34.2 | Very low | 37.2 | Very low | 162 Ų | 162 | 148 Ų | 148 | 87% | 0.866 | 82% | 0.824 | S | S | * | * | -175 | 147 | 115.7 | -100.2 | -28.1 | 0 | 0 | 0 | 114.1 | |||||
| 79 | D | 33.8 | Very low | 37.2 | Very low | 147 Ų | 147 | 148 Ų | 148 | 79% | 0.786 | 82% | 0.823 | S | S | * | * | trans | -85 | 163.9 | -166.4 | -160.4 | -0.5 | 0 | 0 | 0 | 113 | ||||
| 80 | A | 35.2 | Very low | 37.1 | Very low | 95 Ų | 95 | 144.2 Ų | 144.2 | 79% | 0.785 | 82% | 0.819 | S | S | * | * | trans | 153.3 | 101.3 | 137.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 81 | E | 36 | Very low | 37 | Very low | 175 Ų | 175 | 143.2 Ų | 143.2 | 82% | 0.818 | 82% | 0.82 | S | S | * | * | trans | -39.4 | 149.5 | 150.2 | -75.6 | -79.6 | 170.3 | 0 | 0 | 117 | ||||
| 82 | A | 35.2 | Very low | 36.8 | Very low | 98 Ų | 98 | 138.6 Ų | 138.6 | 81% | 0.81 | 81% | 0.809 | S | S | * | * | trans | 177.1 | 112.9 | 132.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 83 | G | 30.7 | Very low | 36.6 | Very low | 63 Ų | 63 | 136.9 Ų | 136.9 | 65% | 0.649 | 81% | 0.805 | S | S | * | * | trans | -97 | -165.1 | 144.7 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 84 | P | 47.3 | Very low | 36.6 | Very low | 127 Ų | 127 | 134.3 Ų | 134.3 | 83% | 0.825 | 81% | 0.807 | S | S | * | * | cis | -134.5 | -174.8 | -11.9 | 36.9 | -16 | 0 | 0 | 0 | 114.7 | ||||
| 85 | D | 35.7 | Very low | 36.5 | Very low | 152 Ų | 152 | 130 Ų | 130 | 81% | 0.813 | 80% | 0.801 | S | S | * | * | trans | -6.8 | 172.1 | 155.3 | -85.6 | -23.3 | 0 | 0 | 0 | 121.7 | ||||
| 86 | P | 47 | Very low | 36.5 | Very low | 119 Ų | 119 | 130.6 Ų | 130.6 | 77% | 0.773 | 80% | 0.804 | S | S | * | * | cis | -146 | -175.9 | 19.3 | 28.5 | -0.8 | 0 | 0 | 0 | 118.2 | ||||
| 87 | L | 40.3 | Very low | 36.6 | Very low | 153 Ų | 153 | 130.5 Ų | 130.5 | 80% | 0.801 | 80% | 0.803 | S | S | * | * | trans | -56.2 | 172.3 | 169.4 | -57.9 | 170.4 | 0 | 0 | 0 | 116.3 | ||||
| 88 | P | 47.2 | Very low | 36.9 | Very low | 130 Ų | 130 | 125.9 Ų | 125.9 | 84% | 0.844 | 80% | 0.795 | S | S | * | * | -142.6 | 160.8 | 116.7 | 36.5 | -21.6 | 0 | 0 | 0 | 117.6 | |||||
| 89 | L | 37.8 | Very low | 36.9 | Very low | 171 Ų | 171 | 127.4 Ų | 127.4 | 90% | 0.895 | 80% | 0.797 | S | S | * | * | trans | -73.7 | 160.7 | 171.6 | -89 | 78.9 | 0 | 0 | 0 | 114.6 | ||||
| 90 | G | 34.9 | Very low | 37.4 | Very low | 69 Ų | 69 | 132.3 Ų | 132.3 | 71% | 0.711 | 81% | 0.805 | S | S | * | * | trans | 175 | 101.2 | 150.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 91 | D | 35 | Very low | 37.5 | Very low | 174 Ų | 174 | 133 Ų | 133 | 93% | 0.93 | 80% | 0.804 | S | S | * | * | 64.3 | 134.2 | 80.8 | -158.7 | 24 | 0 | 0 | 0 | 115.1 | |||||
| 92 | G | 31.6 | Very low | 37.7 | Very low | 57 Ų | 57 | 130.7 Ų | 130.7 | 59% | 0.588 | 80% | 0.804 | S | S | * | * | trans | 142.9 | 74 | 168.3 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 93 | T | 31.4 | Very low | 38.2 | Very low | 131 Ų | 131 | 134.4 Ų | 134.4 | 80% | 0.804 | 81% | 0.805 | S | S | * | * | trans | 55.1 | 120.7 | 131.4 | 67.9 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 94 | S | 36.8 | Very low | 38.8 | Very low | 125 Ų | 125 | 135.7 Ų | 135.7 | 87% | 0.874 | 80% | 0.802 | S | S | * | * | 51.8 | 129.2 | 120.2 | -144.7 | 0 | 0 | 0 | 0 | 122.2 | |||||
| 95 | G | 33.2 | Very low | 39 | Very low | 75 Ų | 75 | 137.9 Ų | 137.9 | 77% | 0.773 | 81% | 0.807 | S | S | * | * | trans | 171 | 109.2 | 159.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 96 | E | 35.5 | Very low | 39.6 | Very low | 183 Ų | 183 | 133.3 Ų | 133.3 | 86% | 0.855 | 80% | 0.795 | S | S | * | * | trans | -66.6 | 145.1 | 172.8 | -67.8 | 155.7 | 109.1 | 0 | 0 | 111.8 | ||||
| 97 | D | 36.7 | Very low | 39.6 | Very low | 159 Ų | 159 | 132.9 Ų | 132.9 | 85% | 0.85 | 78% | 0.783 | S | S | * | * | 138.8 | 140.6 | 115.1 | -118 | -24 | 0 | 0 | 0 | 116.2 | |||||
| 98 | A | 39.5 | Very low | 40.1 | Very low | 79 Ų | 79 | 135.4 Ų | 135.4 | 65% | 0.653 | 78% | 0.782 | S | S | * | * | trans | 11.4 | 125.5 | 167.5 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 99 | E | 33.3 | Very low | 40.3 | Very low | 194 Ų | 194 | 131.7 Ų | 131.7 | 91% | 0.907 | 77% | 0.766 | S | S | * | * | -168.2 | 141.6 | 114.2 | -105.2 | 177.7 | 146.4 | 0 | 0 | 114 | |||||
| 100 | R | 45.4 | Very low | 41.1 | Very low | 249 Ų | 249 | 127.3 Ų | 127.3 | 94% | 0.94 | 75% | 0.75 | S | S | * | * | trans | -72.7 | 124.1 | -173.3 | -176.1 | -178.1 | -169.2 | -158.1 | 3.4 | 110.9 | ||||
| 101 | S | 36.4 | Very low | 42.6 | Very low | 111 Ų | 111 | 129.7 Ų | 129.7 | 78% | 0.776 | 74% | 0.743 | S | S | * | * | trans | -119.4 | 144.1 | 168.2 | -70.2 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 102 | P | 41.5 | Very low | 44.3 | Very low | 125 Ų | 125 | 126.7 Ų | 126.7 | 81% | 0.812 | 73% | 0.726 | S | S | * | * | P | Polyproline II helix | trans | -82 | 150.8 | -170.7 | 16.4 | -1.8 | 0 | 0 | 0 | 112.5 | ||
| 103 | Q | 45.1 | Very low | 46.2 | Very low | 176 Ų | 176 | 129 Ų | 129 | 82% | 0.822 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 137.7 | 178.4 | -62 | -168.4 | -66.6 | 0 | 0 | 111.6 | ||
| 104 | P | 44.1 | Very low | 48.3 | Very low | 91 Ų | 91 | 125.3 Ų | 125.3 | 59% | 0.591 | 71% | 0.707 | S | S | * | * | P | Polyproline II helix | trans | -82.9 | 121 | 173.6 | 31 | -28.5 | 0 | 0 | 0 | 110.3 | G106 Q107 | P104-G106 PolarHBondContact O-N 3.39Å; P104-Q107 PolarHBondContact O-N 2.74Å |
| 105 | D | 50.3 | Low | 50.2 | Low | 173 Ų | 173 | 127.2 Ų | 127.2 | 93% | 0.925 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.3 | 18 | 170.1 | -87.5 | -38.7 | 0 | 0 | 0 | 114.4 | ||
| 106 | G | 48 | Very low | 52.3 | Low | 55 Ų | 55 | 129.6 Ų | 129.6 | 57% | 0.567 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.3 | -11.8 | 173.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | P104 R108 | P104-G106 PolarHBondContact O-N 3.39Å; G106-R108 VanDerWaalsContact C-N 3.32Å; G106-R108 PolarHBondContact O-N 3.32Å |
| 107 | Q | 48.1 | Very low | 54 | Low | 111 Ų | 111 | 125.2 Ų | 125.2 | 52% | 0.519 | 67% | 0.668 | S | S | . | * | H | α-helix | trans | -71.8 | -22.6 | -175 | -104.3 | 165 | -35.1 | 0 | 0 | 113.8 | P104 Q111 | P104-Q107 PolarHBondContact O-N 2.74Å; Q107-Q111 WeakPolarHBondContact O-CB 3.24Å; Q107-Q111 WeakPolarHBondContact O-CG 3.34Å; Q107-Q111 PolarHBondContact O-N 3.31Å; Q107-Q111 VanDerWaalsContact O-N 3.08Å |
| 108 | R | 51 | Low | 55.9 | Low | 206 Ų | 206 | 123.1 Ų | 123.1 | 78% | 0.777 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -74 | -37.3 | -175.5 | -132.4 | 175.4 | -166.6 | -179.4 | 3.7 | 113.2 | G106 L112 | G106-R108 VanDerWaalsContact C-N 3.32Å; G106-R108 PolarHBondContact O-N 3.32Å; R108-L112 VanDerWaalsContact O-CG 3.31Å; R108-L112 WeakPolarHBondContact O-CG 3.44Å; R108-L112 PolarHBondContact O-N 2.87Å |
| 109 | G | 50.6 | Low | 57.6 | Low | 51 Ų | 51 | 122.5 Ų | 122.5 | 53% | 0.526 | 64% | 0.639 | S | S | . | * | H | α-helix | trans | -72.2 | -40.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | L112 L113 | G109-L112 PolarHBondContact O-N 3.1Å; G109-L113 PolarHBondContact O-N 3.09Å |
| 110 | S | 55.4 | Low | 59.1 | Low | 80 Ų | 80 | 120.5 Ų | 120.5 | 56% | 0.559 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -65.8 | -39.4 | 176.3 | 178.8 | 0 | 0 | 0 | 0 | 112.2 | L112 L113 A114 | S110-L112 VanDerWaalsContact C-N 3.34Å; S110-L112 PolarHBondContact O-N 3.49Å; S110-L113 PolarHBondContact O-N 2.9Å; S110-A114 WeakPolarHBondContact O-CB 3.42Å; S110-A114 PolarHBondContact O-N 3.21Å |
| 111 | Q | 65.4 | Low | 59.8 | Low | 119 Ų | 119 | 117.1 Ų | 117.1 | 56% | 0.556 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -64.9 | -36 | 174.3 | -74.7 | 171.2 | 19.4 | 0 | 0 | 112.7 | Q107 R115 | Q107-Q111 WeakPolarHBondContact O-CB 3.24Å; Q107-Q111 WeakPolarHBondContact O-CG 3.34Å; Q107-Q111 PolarHBondContact O-N 3.31Å; Q107-Q111 VanDerWaalsContact O-N 3.08Å; Q111-R115 WeakPolarHBondContact O-CB 3.34Å; Q111-R115 PolarHBondContact O-N 3.46Å |
| 112 | L | 71.4 | Confident | 61.2 | Low | 110 Ų | 110 | 117.1 Ų | 117.1 | 58% | 0.576 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -71.1 | -40.7 | 177 | -71.9 | 169.8 | 0 | 0 | 0 | 112 | R108 G109 S110 R115 Q116 | R108-L112 VanDerWaalsContact O-CG 3.31Å; R108-L112 WeakPolarHBondContact O-CG 3.44Å; R108-L112 PolarHBondContact O-N 2.87Å; G109-L112 PolarHBondContact O-N 3.1Å; S110-L112 VanDerWaalsContact C-N 3.34Å; S110-L112 PolarHBondContact O-N 3.49Å; L112-R115 PolarHBondContact O-N 3.49Å; L112-Q116 WeakPolarHBondContact O-CB 3.47Å; L112-Q116 PolarHBondContact O-N 2.98Å |
| 113 | L | 71.7 | Confident | 62.1 | Low | 106 Ų | 106 | 118.5 Ų | 118.5 | 56% | 0.555 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -67.3 | -43.7 | 175 | -169.5 | 76.2 | 0 | 0 | 0 | 111.5 | G109 S110 R115 Q116 L117 | G109-L113 PolarHBondContact O-N 3.09Å; S110-L113 PolarHBondContact O-N 2.9Å; L113-R115 VanDerWaalsContact C-N 3.29Å; L113-R115 PolarHBondContact O-N 3.33Å; L113-Q116 PolarHBondContact O-N 3.18Å; L113-L117 HydrophobicContact CG-CD1 4.32Å; L113-L117 WeakPolarHBondContact O-CB 3.39Å; L113-L117 WeakPolarHBondContact O-CG 3.49Å; L113-L117 PolarHBondContact O-N 2.84Å |
| 114 | A | 74.1 | Confident | 62.2 | Low | 53 Ų | 53 | 112.9 Ų | 112.9 | 44% | 0.438 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -62.4 | -37.9 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | S110 Q118 | S110-A114 WeakPolarHBondContact O-CB 3.42Å; S110-A114 PolarHBondContact O-N 3.21Å; A114-Q118 VanDerWaalsContact O-CB 3.25Å; A114-Q118 WeakPolarHBondContact O-CB 3.29Å; A114-Q118 PolarHBondContact O-N 3.05Å |
| 115 | R | 76.7 | Confident | 62.6 | Low | 165 Ų | 165 | 116.6 Ų | 116.6 | 62% | 0.623 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -73.3 | -38.7 | 176.9 | -162.7 | 171.9 | 179.9 | 177.2 | 0.4 | 112.1 | Q111 L112 L113 Q118 D119 | Q111-R115 WeakPolarHBondContact O-CB 3.34Å; Q111-R115 PolarHBondContact O-N 3.46Å; L112-R115 PolarHBondContact O-N 3.49Å; L113-R115 VanDerWaalsContact C-N 3.29Å; L113-R115 PolarHBondContact O-N 3.33Å; R115-Q118 PolarHBondContact O-N 2.82Å; R115-D119 VanDerWaalsContact O-CB 3.3Å; R115-D119 WeakPolarHBondContact O-CB 3.38Å; R115-D119 PolarHBondContact O-N 2.72Å |
| 116 | Q | 78.4 | Confident | 62.2 | Low | 126 Ų | 126 | 115.6 Ų | 115.6 | 59% | 0.589 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -63.4 | -42.3 | 171.1 | -90 | -176.8 | -51.9 | 0 | 0 | 112.3 | L112 L113 D119 F120 | L112-Q116 WeakPolarHBondContact O-CB 3.47Å; L112-Q116 PolarHBondContact O-N 2.98Å; L113-Q116 PolarHBondContact O-N 3.18Å; Q116-D119 PolarHBondContact O-N 2.76Å; Q116-F120 WeakPolarHBondContact O-CB 3.5Å; Q116-F120 PolarHBondContact O-N 3.27Å |
| 117 | L | 71.6 | Confident | 62 | Low | 91 Ų | 91 | 117.9 Ų | 117.9 | 48% | 0.476 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -61.5 | -50.6 | 171.9 | -77.4 | 165.1 | 0 | 0 | 0 | 109.2 | L113 D119 F120 W121 | L113-L117 HydrophobicContact CG-CD1 4.32Å; L113-L117 WeakPolarHBondContact O-CB 3.39Å; L113-L117 WeakPolarHBondContact O-CG 3.49Å; L113-L117 PolarHBondContact O-N 2.84Å; L117-D119 VanDerWaalsContact C-N 3.26Å; L117-D119 PolarHBondContact O-N 3.07Å; L117-F120 CarbonylContact O-C 3.53Å; L117-F120 WeakPolarHBondContact O-CA 3.33Å; L117-F120 WeakPolarHBondContact O-CB 3.42Å; L117-F120 PolarHBondContact O-N 3.42Å; L117-W121 WeakPolarHBondContact O-CB 3.26Å; L117-W121 PolarHBondContact O-N 3.15Å |
| 118 | Q | 75.6 | Confident | 61.8 | Low | 115 Ų | 115 | 118.2 Ų | 118.2 | 54% | 0.537 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -60.7 | -34.6 | 179.5 | -154.2 | 175.3 | 49.5 | 0 | 0 | 113 | A114 R115 W121 K122 | A114-Q118 VanDerWaalsContact O-CB 3.25Å; A114-Q118 WeakPolarHBondContact O-CB 3.29Å; A114-Q118 PolarHBondContact O-N 3.05Å; R115-Q118 PolarHBondContact O-N 2.82Å; Q118-W121 PolarHBondContact O-N 3.2Å; Q118-K122 WeakPolarHBondContact O-CB 3.43Å; Q118-K122 WeakPolarHBondContact O-CG 3.45Å; Q118-K122 PolarHBondContact O-N 3.34Å |
| 119 | D | 76.4 | Confident | 61.8 | Low | 65 Ų | 65 | 112.8 Ų | 112.8 | 35% | 0.348 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -74.3 | -34.1 | 174.3 | -70.1 | -21.6 | 0 | 0 | 0 | 112 | R115 Q116 L117 K122 K123 | R115-D119 VanDerWaalsContact O-CB 3.3Å; R115-D119 WeakPolarHBondContact O-CB 3.38Å; R115-D119 PolarHBondContact O-N 2.72Å; Q116-D119 PolarHBondContact O-N 2.76Å; L117-D119 VanDerWaalsContact C-N 3.26Å; L117-D119 PolarHBondContact O-N 3.07Å; D119-K122 PolarHBondContact O-N 3.45Å; D119-K123 VanDerWaalsContact O-CB 3.24Å; D119-K123 WeakPolarHBondContact O-CB 3.43Å; D119-K123 WeakPolarHBondContact O-CG 3.25Å; D119-K123 PolarHBondContact O-N 3.23Å |
| 120 | F | 64.9 | Low | 61.8 | Low | 153 Ų | 153 | 114.9 Ų | 114.9 | 67% | 0.671 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -63.4 | -45 | 168.7 | -113.8 | -92.9 | 0 | 0 | 0 | 111 | Q116 L117 K123 S124 | Q116-F120 WeakPolarHBondContact O-CB 3.5Å; Q116-F120 PolarHBondContact O-N 3.27Å; L117-F120 CarbonylContact O-C 3.53Å; L117-F120 WeakPolarHBondContact O-CA 3.33Å; L117-F120 WeakPolarHBondContact O-CB 3.42Å; L117-F120 PolarHBondContact O-N 3.42Å; F120-K123 PolarHBondContact O-N 3.48Å; F120-S124 WeakPolarHBondContact O-CB 3.39Å; F120-S124 PolarHBondContact O-N 2.78Å; F120-S124 PolarHBondContact O-OG 3.08Å |
| 121 | W | 58.5 | Low | 61.7 | Low | 177 Ų | 177 | 118.4 Ų | 118.4 | 67% | 0.67 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -68.3 | -32.9 | 177.3 | -75.3 | 62.2 | 0 | 0 | 0 | 112 | L117 Q118 S124 R125 | L117-W121 WeakPolarHBondContact O-CB 3.26Å; L117-W121 PolarHBondContact O-N 3.15Å; Q118-W121 PolarHBondContact O-N 3.2Å; W121-S124 VanDerWaalsContact CA-OG 3.26Å; W121-S124 WeakPolarHBondContact CA-OG 3.35Å; W121-S124 PolarHBondContact O-OG 3.17Å; W121-R125 VanDerWaalsContact O-CB 3.27Å; W121-R125 WeakPolarHBondContact O-CB 3.31Å; W121-R125 WeakPolarHBondContact O-CG 3.08Å; W121-R125 PolarHBondContact O-N 2.97Å |
| 122 | K | 66.8 | Low | 62.2 | Low | 112 Ų | 112 | 117.4 Ų | 117.4 | 49% | 0.487 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -72.2 | -40.7 | 171.3 | -77.9 | 170.4 | -178.3 | 172 | 0 | 112 | Q118 D119 R125 N126 | Q118-K122 WeakPolarHBondContact O-CB 3.43Å; Q118-K122 WeakPolarHBondContact O-CG 3.45Å; Q118-K122 PolarHBondContact O-N 3.34Å; D119-K122 PolarHBondContact O-N 3.45Å; K122-R125 PolarHBondContact O-N 3.44Å; K122-N126 PolarHBondContact O-N 3Å |
| 123 | K | 59.4 | Low | 62.9 | Low | 154 Ų | 154 | 112.7 Ų | 112.7 | 67% | 0.67 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -66.8 | -37.1 | 174.7 | -76.4 | 171.6 | -179.3 | 179.3 | 0 | 111.8 | D119 F120 N126 T127 | D119-K123 VanDerWaalsContact O-CB 3.24Å; D119-K123 WeakPolarHBondContact O-CB 3.43Å; D119-K123 WeakPolarHBondContact O-CG 3.25Å; D119-K123 PolarHBondContact O-N 3.23Å; F120-K123 PolarHBondContact O-N 3.48Å; K123-N126 PolarHBondContact O-N 3.46Å; K123-T127 PolarHBondContact O-N 3.02Å |
| 124 | S | 48.2 | Very low | 63.8 | Low | 57 Ų | 57 | 113 Ų | 113 | 40% | 0.399 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -79 | -20.5 | 173.3 | 58.8 | 0 | 0 | 0 | 0 | 113.3 | F120 W121 N126 T127 L128 | F120-S124 WeakPolarHBondContact O-CB 3.39Å; F120-S124 PolarHBondContact O-N 2.78Å; F120-S124 PolarHBondContact O-OG 3.08Å; W121-S124 VanDerWaalsContact CA-OG 3.26Å; W121-S124 WeakPolarHBondContact CA-OG 3.35Å; W121-S124 PolarHBondContact O-OG 3.17Å; S124-N126 VanDerWaalsContact C-N 3.31Å; S124-T127 VanDerWaalsContact CA-OG1 3.25Å; S124-T127 WeakPolarHBondContact CA-OG1 3.44Å; S124-T127 CarbonylContact O-C 3.24Å; S124-T127 VanDerWaalsContact O-C 3.24Å; S124-T127 WeakPolarHBondContact O-CA 2.76Å; S124-T127 PolarHBondContact O-N 2.88Å; S124-T127 VanDerWaalsContact O-N 3.13Å; S124-T127 PolarHBondContact O-OG1 3.41Å; S124-L128 PolarHBondContact O-N 3.49Å |
| 125 | R | 51.4 | Low | 64.8 | Low | 170 Ų | 170 | 111.3 Ų | 111.3 | 64% | 0.642 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -70.4 | -26.8 | 163.7 | -80.9 | 172.8 | 83.5 | 167.1 | 6 | 112.6 | W121 K122 T127 L128 | W121-R125 VanDerWaalsContact O-CB 3.27Å; W121-R125 WeakPolarHBondContact O-CB 3.31Å; W121-R125 WeakPolarHBondContact O-CG 3.08Å; W121-R125 PolarHBondContact O-N 2.97Å; K122-R125 PolarHBondContact O-N 3.44Å; R125-T127 PolarHBondContact O-N 3.14Å; R125-L128 HydrophobicContact CB-CD1 4.01Å; R125-L128 HydrophobicContact CB-CG 4.34Å; R125-L128 HydrophobicContact CG-CD1 4.14Å; R125-L128 HydrophobicContact CG-CG 4.44Å; R125-L128 WeakPolarHBondContact O-CB 3.3Å; R125-L128 WeakPolarHBondContact O-CD1 3.36Å; R125-L128 WeakPolarHBondContact O-CG 3.43Å; R125-L128 PolarHBondContact O-N 2.9Å; R125-L128 VanDerWaalsContact O-N 3.08Å |
| 126 | N | 43.1 | Very low | 65.7 | Low | 151 Ų | 151 | 108.3 Ų | 108.3 | 81% | 0.807 | 53% | 0.525 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.8 | -5.9 | 168.3 | -70.6 | -5.9 | 0 | 0 | 0 | 112.9 | K122 K123 S124 | K122-N126 PolarHBondContact O-N 3Å; K123-N126 PolarHBondContact O-N 3.46Å; S124-N126 VanDerWaalsContact C-N 3.31Å |
| 127 | T | 43.1 | Very low | 66.6 | Low | 103 Ų | 103 | 103.2 Ų | 103.2 | 63% | 0.632 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -102.4 | 23.8 | 160.5 | 66.9 | 0 | 0 | 0 | 0 | 111.5 | K123 S124 R125 T129 | K123-T127 PolarHBondContact O-N 3.02Å; S124-T127 VanDerWaalsContact CA-OG1 3.25Å; S124-T127 WeakPolarHBondContact CA-OG1 3.44Å; S124-T127 CarbonylContact O-C 3.24Å; S124-T127 VanDerWaalsContact O-C 3.24Å; S124-T127 WeakPolarHBondContact O-CA 2.76Å; S124-T127 PolarHBondContact O-N 2.88Å; S124-T127 VanDerWaalsContact O-N 3.13Å; S124-T127 PolarHBondContact O-OG1 3.41Å; R125-T127 PolarHBondContact O-N 3.14Å; T127-T129 VanDerWaalsContact C-N 3.33Å; T127-T129 PolarHBondContact O-N 3.1Å |
| 128 | L | 44.9 | Very low | 67.8 | Low | 119 Ų | 119 | 102 Ų | 102 | 62% | 0.623 | 50% | 0.498 | S | S | * | . | trans | -58.5 | 105.7 | 164.1 | -79.7 | 163.2 | 0 | 0 | 0 | 106.1 | S124 R125 | S124-L128 PolarHBondContact O-N 3.49Å; R125-L128 HydrophobicContact CB-CD1 4.01Å; R125-L128 HydrophobicContact CB-CG 4.34Å; R125-L128 HydrophobicContact CG-CD1 4.14Å; R125-L128 HydrophobicContact CG-CG 4.44Å; R125-L128 WeakPolarHBondContact O-CB 3.3Å; R125-L128 WeakPolarHBondContact O-CD1 3.36Å; R125-L128 WeakPolarHBondContact O-CG 3.43Å; R125-L128 PolarHBondContact O-N 2.9Å; R125-L128 VanDerWaalsContact O-N 3.08Å | ||
| 129 | T | 49.9 | Very low | 68.7 | Low | 92 Ų | 92 | 98.4 Ų | 98.4 | 56% | 0.564 | 49% | 0.486 | S | S | * | . | trans | -38.9 | 125.2 | 167.7 | 26.7 | 0 | 0 | 0 | 0 | 108.2 | T127 Q131 | T127-T129 VanDerWaalsContact C-N 3.33Å; T127-T129 PolarHBondContact O-N 3.1Å; T129-Q131 PolarHBondContact O-N 3.16Å | ||
| 130 | P | 50.5 | Low | 69.7 | Low | 94 Ų | 94 | 96.8 Ų | 96.8 | 61% | 0.61 | 48% | 0.482 | S | S | * | . | trans | -55.7 | 118.3 | 173.8 | 21.7 | -29 | 0 | 0 | 0 | 105.8 | R132 | P130-R132 WeakPolarHBondContact O-CG 3.45Å; P130-R132 PolarHBondContact O-N 3.48Å | ||
| 131 | Q | 54.4 | Low | 71.1 | Confident | 155 Ų | 155 | 93.9 Ų | 93.9 | 72% | 0.724 | 47% | 0.473 | S | S | * | . | trans | -41.8 | 110.8 | -173.1 | -79.7 | 174.7 | 1.6 | 0 | 0 | 109.3 | T129 P160 | T129-Q131 PolarHBondContact O-N 3.16Å; Q131-P160 HydrophobicContact CB-CB 3.85Å; Q131-P160 WeakPolarHBondContact O-CB 3.37Å; Q131-P160 WeakPolarHBondContact O-CG 3.38Å | ||
| 132 | R | 74.5 | Confident | 72.8 | Confident | 97 Ų | 97 | 88.4 Ų | 88.4 | 37% | 0.366 | 46% | 0.459 | S | S | . | . | P | Polyproline II helix | trans | -87.1 | 153 | -166.8 | -57.4 | 170.8 | 78.6 | -162.1 | -82.4 | 107.9 | P130 L134 G223 Q226 A227 | P130-R132 WeakPolarHBondContact O-CG 3.45Å; P130-R132 PolarHBondContact O-N 3.48Å; R132-L134 PolarHBondContact O-N 3.42Å; R132-G223 PolarHBondContact NH2-O 2.87Å; R132-Q226 PolarHBondContact NE-O 2.84Å; R132-A227 PolarHBondContact NH1-O 3.27Å |
| 133 | L | 87.4 | Confident | 74.1 | Confident | 12 Ų | 12 | 85 Ų | 85 | 6% | 0.063 | 45% | 0.448 | C | S | . | . | P | Polyproline II helix | trans | -51.2 | 131.5 | 172 | -70.4 | 163.9 | 0 | 0 | 0 | 110.4 | F135 V157 I158 G159 Q226 Q274 L275 | L133-F135 HydrophobicContact CB-CE1 4.31Å; L133-F135 HydrophobicContact CB-CE2 3.97Å; L133-F135 HydrophobicContact CB-CZ 3.68Å; L133-F135 HydrophobicContact CD1-CZ 4.23Å; L133-V157 HydrophobicContact CD2-CG1 3.91Å; L133-I158 WeakPolarHBondContact CA-O 3.46Å; L133-G159 VanDerWaalsContact CD2-CA 3.49Å; L133-Q226 HydrophobicContact CB-CG 4.39Å; L133-Q226 HydrophobicContact CD1-CG 4.27Å; L133-Q274 HydrophobicContact CD2-CB 3.78Å; L133-L275 HydrophobicContact CD1-CD2 3.54Å; L133-L275 HydrophobicContact CD1-CG 4.29Å |
| 134 | L | 90.8 | Very high | 75.7 | Confident | 112 Ų | 112 | 85.2 Ų | 85.2 | 59% | 0.586 | 45% | 0.449 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -98.8 | 142.3 | 169.8 | -56.5 | 174.3 | 0 | 0 | 0 | 108.7 | R132 I158 | R132-L134 PolarHBondContact O-N 3.42Å; L134-I158 HydrophobicContact CB-CB 4.16Å; L134-I158 PolarHBondContact N-O 2.92Å; L134-I158 PolarHBondContact O-N 3.46Å |
| 135 | F | 94.3 | Very high | 77.5 | Confident | 17 Ų | 17 | 87 Ų | 87 | 8% | 0.075 | 45% | 0.454 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.2 | 128.5 | -179.9 | -56.5 | -77.1 | 0 | 0 | 0 | 108.5 | L133 A156 V157 E219 L222 Q226 F241 | L133-F135 HydrophobicContact CB-CE1 4.31Å; L133-F135 HydrophobicContact CB-CE2 3.97Å; L133-F135 HydrophobicContact CB-CZ 3.68Å; L133-F135 HydrophobicContact CD1-CZ 4.23Å; F135-A156 WeakPolarHBondContact CA-O 3.26Å; F135-V157 HydrophobicContact CD1-CG1 4.29Å; F135-V157 HydrophobicContact CD1-CG2 4.12Å; F135-V157 HydrophobicContact CE1-CG1 3.85Å; F135-V157 HydrophobicContact CE1-CG2 4.17Å; F135-E219 WeakPolarHBondContact O-CG 3.34Å; F135-L222 HydrophobicContact CB-CB 4.31Å; F135-L222 HydrophobicContact CB-CD1 4.33Å; F135-L222 HydrophobicContact CD1-CB 4.12Å; F135-L222 HydrophobicContact CD1-CD1 3.83Å; F135-L222 HydrophobicContact CD2-CB 3.46Å; F135-L222 VanDerWaalsContact CD2-CB 3.46Å; F135-L222 HydrophobicContact CE1-CB 4.32Å; F135-L222 HydrophobicContact CE1-CD1 4.3Å; F135-L222 HydrophobicContact CE2-CB 3.69Å; F135-L222 HydrophobicContact CG-CB 3.68Å; F135-L222 HydrophobicContact CG-CD1 4Å; F135-L222 HydrophobicContact CZ-CB 4.12Å; F135-Q226 HydrophobicContact CE2-CB 4.29Å; F135-Q226 HydrophobicContact CE2-CG 3.57Å; F135-Q226 HydrophobicContact CZ-CG 3.59Å; F135-F241 HydrophobicContact CD1-CE1 4.1Å; F135-F241 HydrophobicContact CD1-CZ 4.25Å; F135-F241 AromaticContact CE1-CE1 3.49Å; F135-F241 HydrophobicContact CE1-CE1 3.49Å; F135-F241 VanDerWaalsContact CE1-CE1 3.49Å; F135-F241 HydrophobicContact CE1-CE2 4.43Å; F135-F241 AromaticContact CE1-CZ 3.38Å; F135-F241 HydrophobicContact CE1-CZ 3.38Å; F135-F241 HydrophobicContact CZ-CE1 4.34Å; F135-F241 AromaticContact CZ-CZ 3.77Å; F135-F241 HydrophobicContact CZ-CZ 3.77Å |
| 136 | E | 95.6 | Very high | 79.1 | Confident | 102 Ų | 102 | 84.4 Ų | 84.4 | 48% | 0.477 | 46% | 0.459 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.7 | 132.5 | 177.7 | -178.2 | 178.2 | 179.5 | 0 | 0 | 109.2 | T138 L155 A156 | E136-T138 HydrophobicContact CG-CG2 4.42Å; E136-T138 PolarHBondContact O-N 3.18Å; E136-L155 CarbonylContact O-C 3.56Å; E136-L155 WeakPolarHBondContact O-CA 3.34Å; E136-A156 HydrophobicContact CB-CB 4.45Å; E136-A156 PolarHBondContact N-O 3.32Å; E136-A156 VanDerWaalsContact N-O 3.09Å; E136-A156 PolarHBondContact O-N 3.34Å |
| 137 | V | 96.9 | Very high | 81 | Confident | 20 Ų | 20 | 83.9 Ų | 83.9 | 12% | 0.121 | 46% | 0.464 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.3 | 101.6 | 171.6 | 177.1 | 0 | 0 | 0 | 0 | 108.2 | S139 Y153 T154 L155 E219 | V137-S139 WeakPolarHBondContact CG1-O 3.41Å; V137-Y153 HydrophobicContact CG1-CD1 4.13Å; V137-T154 CarbonylContact C-O 3.54Å; V137-T154 WeakPolarHBondContact CA-O 3.45Å; V137-L155 HydrophobicContact CG2-CD2 3.54Å; V137-E219 HydrophobicContact CG2-CG 3.97Å; V137-E219 PolarHBondContact N-OE1 2.87Å |
| 138 | T | 96.2 | Very high | 83.1 | Confident | 64 Ų | 64 | 82 Ų | 82 | 39% | 0.393 | 46% | 0.455 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79 | -26.5 | -176.1 | 58.1 | 0 | 0 | 0 | 0 | 112.9 | E136 T154 A156 | E136-T138 HydrophobicContact CG-CG2 4.42Å; E136-T138 PolarHBondContact O-N 3.18Å; T138-T154 PolarHBondContact N-O 3.45Å; T138-T154 PolarHBondContact OG1-O 3.49Å; T138-A156 HydrophobicContact CG2-CB 3.67Å |
| 139 | S | 95.9 | Very high | 85.4 | Confident | 41 Ų | 41 | 81.5 Ų | 81.5 | 29% | 0.287 | 45% | 0.448 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -155.2 | 155.6 | 175 | 55.2 | 0 | 0 | 0 | 0 | 112 | V137 T154 | V137-S139 WeakPolarHBondContact CG1-O 3.41Å; S139-T154 PolarHBondContact O-N 3.09Å; S139-T154 WeakPolarHBondContact OG-CB 3.3Å; S139-T154 PolarHBondContact OG-OG1 3.5Å |
| 140 | A | 96.6 | Very high | 87.4 | Confident | 31 Ų | 31 | 79.1 Ų | 79.1 | 26% | 0.256 | 43% | 0.429 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.9 | 105.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | V151 L152 Y153 I211 | A140-V151 HydrophobicContact CB-CG1 4.14Å; A140-L152 CarbonylContact C-O 3.54Å; A140-L152 WeakPolarHBondContact CA-O 3.41Å; A140-Y153 HydrophobicContact CB-CD1 3.74Å; A140-Y153 HydrophobicContact CB-CE1 3.97Å; A140-I211 HydrophobicContact CB-CG2 3.36Å |
| 141 | N | 95.3 | Very high | 89.6 | Confident | 91 Ų | 91 | 75.2 Ų | 75.2 | 49% | 0.487 | 40% | 0.403 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.8 | 131.1 | -170.9 | -63.9 | -44.5 | 0 | 0 | 0 | 111 | V143 V151 L152 | N141-V143 PolarHBondContact O-N 3.06Å; N141-V151 CarbonylContact O-C 3.3Å; N141-V151 WeakPolarHBondContact O-CA 3.4Å; N141-L152 PolarHBondContact N-O 3.08Å; N141-L152 PolarHBondContact O-N 3.45Å |
| 142 | V | 94.6 | Very high | 91.6 | Very high | 62 Ų | 62 | 69.9 Ų | 69.9 | 38% | 0.376 | 38% | 0.379 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.9 | 105.8 | 173.5 | -176.6 | 0 | 0 | 0 | 0 | 108.8 | K149 Y150 V151 F206 I211 | V142-K149 HydrophobicContact CG1-CG 4.2Å; V142-Y150 CarbonylContact C-O 3.58Å; V142-V151 HydrophobicContact CG2-CG2 4.33Å; V142-F206 HydrophobicContact CG1-CD1 3.79Å; V142-F206 HydrophobicContact CG1-CE1 4.18Å; V142-F206 HydrophobicContact CG2-CD1 4.29Å; V142-I211 HydrophobicContact CG2-CD1 4.03Å |
| 143 | V | 93.9 | Very high | 92.7 | Very high | 41 Ų | 41 | 65.3 Ų | 65.3 | 25% | 0.248 | 36% | 0.362 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.4 | 129.3 | 176.6 | -174 | 0 | 0 | 0 | 0 | 109.6 | N141 D145 K149 Y150 L152 | N141-V143 PolarHBondContact O-N 3.06Å; V143-D145 HydrophobicContact CG1-CB 4.35Å; V143-K149 WeakPolarHBondContact O-CA 3.47Å; V143-Y150 HydrophobicContact CB-CD2 4Å; V143-Y150 HydrophobicContact CB-CE1 4.1Å; V143-Y150 HydrophobicContact CB-CE2 3.54Å; V143-Y150 HydrophobicContact CB-CG 4.47Å; V143-Y150 HydrophobicContact CG1-CE1 4.01Å; V143-Y150 HydrophobicContact CG1-CE2 4.02Å; V143-Y150 WeakPolarHBondContact CG1-OH 3.32Å; V143-Y150 HydrophobicContact CG2-CD2 4.28Å; V143-Y150 HydrophobicContact CG2-CE2 3.67Å; V143-Y150 PolarHBondContact N-O 3.2Å; V143-Y150 PolarHBondContact O-N 2.99Å; V143-L152 HydrophobicContact CG2-CB 3.99Å |
| 144 | K | 91.6 | Very high | 93.2 | Very high | 159 Ų | 159 | 65.6 Ų | 65.6 | 69% | 0.691 | 36% | 0.364 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -111.5 | 101.3 | 172.6 | -62.7 | 175.9 | -174.7 | 173 | 0 | 107.2 | K149 | K144-K149 HydrophobicContact CG-CG 4.29Å |
| 145 | D | 87.5 | Confident | 93.4 | Very high | 95 Ų | 95 | 60.2 Ų | 60.2 | 51% | 0.508 | 34% | 0.336 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.9 | 86.7 | 178.3 | -177.3 | 20.5 | 0 | 0 | 0 | 108.2 | V143 S148 Y150 | V143-D145 HydrophobicContact CG1-CB 4.35Å; D145-S148 CarbonylContact C-O 3.57Å; D145-S148 VanDerWaalsContact C-O 3.3Å; D145-S148 PolarHBondContact N-O 3.38Å; D145-S148 CarbonylContact O-C 3.18Å; D145-S148 VanDerWaalsContact O-CA 3.31Å; D145-S148 WeakPolarHBondContact O-CA 3.43Å; D145-S148 WeakPolarHBondContact O-CB 3.46Å; D145-S148 PolarHBondContact O-N 2.89Å; D145-Y150 HydrophobicContact CB-CE1 4.45Å |
| 146 | P | 83.8 | Confident | 93.5 | Very high | 114 Ų | 114 | 59.6 Ų | 59.6 | 74% | 0.74 | 33% | 0.334 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52 | 131.3 | -169.9 | -27.4 | 35.1 | 0 | 0 | 0 | 112.6 | ||
| 147 | P | 83.3 | Confident | 93.4 | Very high | 140 Ų | 140 | 54.7 Ų | 54.7 | 91% | 0.909 | 31% | 0.311 | S | S | * | . | T | Hydrogen-bonded Turn | cis | -87.9 | 5.8 | 11.4 | 35.5 | -36.9 | 0 | 0 | 0 | 115 | ||
| 148 | S | 88.1 | Confident | 93.1 | Very high | 64 Ų | 64 | 56.3 Ų | 56.3 | 45% | 0.448 | 32% | 0.319 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.3 | 141.8 | -171.9 | -62.3 | 0 | 0 | 0 | 0 | 113.5 | D145 | D145-S148 CarbonylContact C-O 3.57Å; D145-S148 VanDerWaalsContact C-O 3.3Å; D145-S148 PolarHBondContact N-O 3.38Å; D145-S148 CarbonylContact O-C 3.18Å; D145-S148 VanDerWaalsContact O-CA 3.31Å; D145-S148 WeakPolarHBondContact O-CA 3.43Å; D145-S148 WeakPolarHBondContact O-CB 3.46Å; D145-S148 PolarHBondContact O-N 2.89Å |
| 149 | K | 91.8 | Very high | 92.5 | Very high | 108 Ų | 108 | 54.2 Ų | 54.2 | 47% | 0.47 | 31% | 0.309 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.1 | 125.4 | 167 | -171.4 | -175.7 | 176.8 | 179 | 0 | 108.5 | V142 V143 K144 F206 | V142-K149 HydrophobicContact CG1-CG 4.2Å; V143-K149 WeakPolarHBondContact O-CA 3.47Å; K144-K149 HydrophobicContact CG-CG 4.29Å; K149-F206 HydrophobicContact CB-CE1 4.47Å; K149-F206 HydrophobicContact CB-CZ 4.01Å; K149-F206 HydrophobicContact CD-CD1 4.35Å; K149-F206 HydrophobicContact CD-CD2 4.23Å; K149-F206 HydrophobicContact CD-CE1 4Å; K149-F206 HydrophobicContact CD-CE2 3.87Å; K149-F206 HydrophobicContact CD-CG 4.46Å; K149-F206 HydrophobicContact CD-CZ 3.75Å; K149-F206 HydrophobicContact CG-CD1 4.38Å; K149-F206 HydrophobicContact CG-CE1 3.67Å; K149-F206 HydrophobicContact CG-CE2 4.24Å; K149-F206 HydrophobicContact CG-CZ 3.59Å; K149-F206 WeakPolarHBondContact O-CZ 3.33Å |
| 150 | Y | 93.2 | Very high | 91.4 | Very high | 43 Ų | 43 | 56 Ų | 56 | 17% | 0.169 | 32% | 0.32 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -147.4 | 163.9 | -178.6 | 59.7 | -92.9 | 0 | 0 | 0 | 111.7 | V142 V143 D145 L152 R173 | V142-Y150 CarbonylContact C-O 3.58Å; V143-Y150 HydrophobicContact CB-CD2 4Å; V143-Y150 HydrophobicContact CB-CE1 4.1Å; V143-Y150 HydrophobicContact CB-CE2 3.54Å; V143-Y150 HydrophobicContact CB-CG 4.47Å; V143-Y150 HydrophobicContact CG1-CE1 4.01Å; V143-Y150 HydrophobicContact CG1-CE2 4.02Å; V143-Y150 WeakPolarHBondContact CG1-OH 3.32Å; V143-Y150 HydrophobicContact CG2-CD2 4.28Å; V143-Y150 HydrophobicContact CG2-CE2 3.67Å; V143-Y150 PolarHBondContact N-O 3.2Å; V143-Y150 PolarHBondContact O-N 2.99Å; D145-Y150 HydrophobicContact CB-CE1 4.45Å; Y150-L152 HydrophobicContact CD2-CB 4.46Å; Y150-L152 HydrophobicContact CE2-CB 4.22Å; Y150-L152 HydrophobicContact CE2-CD1 4.37Å; Y150-R173 VanDerWaalsContact CD2-CD 3.42Å; Y150-R173 HydrophobicContact CD2-CG 3.75Å; Y150-R173 VanDerWaalsContact CE1-CZ 3.48Å; Y150-R173 VanDerWaalsContact CE1-NH1 3.35Å; Y150-R173 HydrophobicContact CE2-CG 4.12Å; Y150-R173 VanDerWaalsContact CE2-CZ 3.46Å; Y150-R173 HydrophobicContact CG-CG 4.5Å; Y150-R173 VanDerWaalsContact CZ-NH2 3.25Å; Y150-R173 PolarHBondContact OH-NH2 3.1Å |
| 151 | V | 95.4 | Very high | 90 | Very high | 12 Ų | 12 | 56.6 Ų | 56.6 | 7% | 0.073 | 33% | 0.329 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.4 | 128.7 | 171.9 | -173.8 | 0 | 0 | 0 | 0 | 108 | A140 N141 V142 Y153 F206 I211 | A140-V151 HydrophobicContact CB-CG1 4.14Å; N141-V151 CarbonylContact O-C 3.3Å; N141-V151 WeakPolarHBondContact O-CA 3.4Å; V142-V151 HydrophobicContact CG2-CG2 4.33Å; V151-Y153 HydrophobicContact CB-CE2 3.88Å; V151-Y153 HydrophobicContact CG1-CD1 4.41Å; V151-Y153 HydrophobicContact CG1-CD2 4.26Å; V151-Y153 HydrophobicContact CG1-CE1 3.94Å; V151-Y153 HydrophobicContact CG1-CE2 3.75Å; V151-F206 HydrophobicContact CG2-CD1 3.7Å; V151-F206 HydrophobicContact CG2-CE1 3.91Å; V151-I211 HydrophobicContact CG1-CD1 4.35Å; V151-I211 HydrophobicContact CG1-CG1 4.36Å; V151-I211 HydrophobicContact CG1-CG2 4.33Å; V151-I211 HydrophobicContact CG2-CD1 4.04Å; V151-I211 HydrophobicContact CG2-CG1 4.17Å |
| 152 | L | 96.4 | Very high | 88.4 | Confident | 42 Ų | 42 | 56.7 Ų | 56.7 | 22% | 0.22 | 34% | 0.335 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.2 | 119.1 | 174.5 | -167.5 | 68.4 | 0 | 0 | 0 | 108.5 | A140 N141 V143 Y150 R173 | A140-L152 CarbonylContact C-O 3.54Å; A140-L152 WeakPolarHBondContact CA-O 3.41Å; N141-L152 PolarHBondContact N-O 3.08Å; N141-L152 PolarHBondContact O-N 3.45Å; V143-L152 HydrophobicContact CG2-CB 3.99Å; Y150-L152 HydrophobicContact CD2-CB 4.46Å; Y150-L152 HydrophobicContact CE2-CB 4.22Å; Y150-L152 HydrophobicContact CE2-CD1 4.37Å; L152-R173 HydrophobicContact CD1-CG 3.77Å |
| 153 | Y | 97.8 | Very high | 86.8 | Confident | 1 Ų | 1 | 59.9 Ų | 59.9 | 0% | 0.004 | 36% | 0.357 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.4 | 123.4 | -180 | -58.9 | -91.1 | 0 | 0 | 0 | 108.9 | V137 A140 V151 S171 R172 I211 R214 F218 | V137-Y153 HydrophobicContact CG1-CD1 4.13Å; A140-Y153 HydrophobicContact CB-CD1 3.74Å; A140-Y153 HydrophobicContact CB-CE1 3.97Å; V151-Y153 HydrophobicContact CB-CE2 3.88Å; V151-Y153 HydrophobicContact CG1-CD1 4.41Å; V151-Y153 HydrophobicContact CG1-CD2 4.26Å; V151-Y153 HydrophobicContact CG1-CE1 3.94Å; V151-Y153 HydrophobicContact CG1-CE2 3.75Å; Y153-S171 CarbonylContact O-C 3.52Å; Y153-S171 WeakPolarHBondContact O-CA 3.41Å; Y153-R172 WeakPolarHBondContact CB-O 3.18Å; Y153-R172 WeakPolarHBondContact CD2-O 3.29Å; Y153-R172 PolarHBondContact N-O 2.97Å; Y153-R172 PolarHBondContact O-N 3.25Å; Y153-I211 HydrophobicContact CE1-CG2 4.1Å; Y153-R214 HydrophobicContact CE1-CB 4.44Å; Y153-F218 HydrophobicContact CD1-CD2 4.27Å; Y153-F218 HydrophobicContact CD1-CE2 4.23Å; Y153-F218 HydrophobicContact CD2-CD2 4.43Å; Y153-F218 AromaticContact CD2-CE2 3.84Å; Y153-F218 HydrophobicContact CD2-CE2 3.84Å; Y153-F218 HydrophobicContact CE1-CD2 4.37Å; Y153-F218 HydrophobicContact CE1-CE2 4.04Å; Y153-F218 AromaticContact CE2-CE2 3.65Å; Y153-F218 HydrophobicContact CE2-CE2 3.65Å; Y153-F218 HydrophobicContact CE2-CZ 4.46Å; Y153-F218 HydrophobicContact CG-CD2 4.3Å; Y153-F218 HydrophobicContact CG-CE2 4.13Å; Y153-F218 AromaticContact CZ-CE2 3.75Å |
| 154 | T | 97.6 | Very high | 85.4 | Confident | 18 Ų | 18 | 64.8 Ų | 64.8 | 11% | 0.11 | 38% | 0.381 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.2 | 117.5 | 172.3 | -50.3 | 0 | 0 | 0 | 0 | 108.3 | V137 T138 S139 Q169 I170 | V137-T154 CarbonylContact C-O 3.54Å; V137-T154 WeakPolarHBondContact CA-O 3.45Å; T138-T154 PolarHBondContact N-O 3.45Å; T138-T154 PolarHBondContact OG1-O 3.49Å; S139-T154 PolarHBondContact O-N 3.09Å; S139-T154 WeakPolarHBondContact OG-CB 3.3Å; S139-T154 PolarHBondContact OG-OG1 3.5Å; T154-Q169 HydrophobicContact CG2-CB 4.46Å; T154-I170 CarbonylContact C-O 3.54Å; T154-I170 WeakPolarHBondContact CA-O 3.41Å |
| 155 | L | 96.6 | Very high | 84.3 | Confident | 0 Ų | 0 | 60.5 Ų | 60.5 | 0% | 0 | 37% | 0.371 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.7 | 125.3 | 178.2 | -70.3 | 164.8 | 0 | 0 | 0 | 109.6 | E136 V137 Q169 I170 R172 F177 L222 F240 | E136-L155 CarbonylContact O-C 3.56Å; E136-L155 WeakPolarHBondContact O-CA 3.34Å; V137-L155 HydrophobicContact CG2-CD2 3.54Å; L155-Q169 WeakPolarHBondContact O-CA 3.27Å; L155-I170 HydrophobicContact CB-CG1 3.84Å; L155-I170 HydrophobicContact CD1-CD1 4.07Å; L155-I170 HydrophobicContact CD1-CG1 4.1Å; L155-I170 PolarHBondContact N-O 2.99Å; L155-I170 PolarHBondContact O-N 3.24Å; L155-R172 HydrophobicContact CD1-CB 4.5Å; L155-R172 HydrophobicContact CD1-CG 4.27Å; L155-F177 HydrophobicContact CD1-CE1 4.01Å; L155-F177 HydrophobicContact CD1-CE2 4.45Å; L155-F177 HydrophobicContact CD1-CZ 3.48Å; L155-F177 VanDerWaalsContact CD1-CZ 3.48Å; L155-F177 HydrophobicContact CD2-CZ 4.21Å; L155-F177 HydrophobicContact CG-CZ 4.15Å; L155-L222 HydrophobicContact CD1-CD1 3.96Å; L155-L222 HydrophobicContact CD2-CD1 4.24Å; L155-F240 HydrophobicContact CD1-CE1 4.3Å; L155-F240 HydrophobicContact CD1-CZ 4.38Å |
| 156 | A | 95.2 | Very high | 84 | Confident | 3 Ų | 3 | 63.2 Ų | 63.2 | 3% | 0.025 | 38% | 0.381 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.7 | 126.4 | 160.7 | 0 | 0 | 0 | 0 | 0 | 109.5 | F135 E136 T138 P167 A168 | F135-A156 WeakPolarHBondContact CA-O 3.26Å; E136-A156 HydrophobicContact CB-CB 4.45Å; E136-A156 PolarHBondContact N-O 3.32Å; E136-A156 VanDerWaalsContact N-O 3.09Å; E136-A156 PolarHBondContact O-N 3.34Å; T138-A156 HydrophobicContact CG2-CB 3.67Å; A156-P167 HydrophobicContact CB-CB 3.9Å; A156-A168 CarbonylContact C-O 3.55Å; A156-A168 WeakPolarHBondContact CA-O 3.4Å |
| 157 | V | 93.8 | Very high | 84.2 | Confident | 0 Ų | 0 | 59.9 Ų | 59.9 | 0% | 0 | 36% | 0.359 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.7 | 113.5 | 174.5 | -173.9 | 0 | 0 | 0 | 0 | 108 | L133 F135 A168 F241 L271 Q274 | L133-V157 HydrophobicContact CD2-CG1 3.91Å; F135-V157 HydrophobicContact CD1-CG1 4.29Å; F135-V157 HydrophobicContact CD1-CG2 4.12Å; F135-V157 HydrophobicContact CE1-CG1 3.85Å; F135-V157 HydrophobicContact CE1-CG2 4.17Å; V157-A168 HydrophobicContact CB-CB 4.38Å; V157-A168 PolarHBondContact N-O 2.99Å; V157-A168 PolarHBondContact O-N 3.33Å; V157-F241 HydrophobicContact CG2-CD1 4.07Å; V157-F241 HydrophobicContact CG2-CE1 4.04Å; V157-L271 HydrophobicContact CB-CD2 3.85Å; V157-L271 HydrophobicContact CG1-CD2 4.04Å; V157-L271 HydrophobicContact CG2-CD2 3.85Å; V157-Q274 PolarHBondContact O-NE2 2.89Å; V157-Q274 PolarHBondContact O-OE1 3.18Å |
| 158 | I | 90.8 | Very high | 84.7 | Confident | 54 Ų | 54 | 53.2 Ų | 53.2 | 28% | 0.277 | 32% | 0.316 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.7 | 108.8 | -173 | -54.4 | 165.3 | 0 | 0 | 0 | 107.5 | L133 L134 P167 | L133-I158 WeakPolarHBondContact CA-O 3.46Å; L134-I158 HydrophobicContact CB-CB 4.16Å; L134-I158 PolarHBondContact N-O 2.92Å; L134-I158 PolarHBondContact O-N 3.46Å; I158-P167 HydrophobicContact CD1-CG 4.44Å; I158-P167 HydrophobicContact CG1-CB 3.79Å; I158-P167 HydrophobicContact CG1-CG 3.87Å |
| 159 | G | 84.1 | Confident | 85 | Confident | 19 Ų | 19 | 55.7 Ų | 55.7 | 20% | 0.196 | 32% | 0.32 | C | S | . | . | trans | -87.1 | 165.7 | 179 | 0 | 0 | 0 | 0 | 0 | 114 | L133 G161 | L133-G159 VanDerWaalsContact CD2-CA 3.49Å; G159-G161 PolarHBondContact O-N 2.86Å | ||
| 160 | P | 72.3 | Confident | 85.2 | Confident | 78 Ų | 78 | 50.6 Ų | 50.6 | 51% | 0.506 | 30% | 0.298 | S | S | . | . | S | Bend | trans | -66 | 102.1 | 169.3 | 29 | -33.4 | 0 | 0 | 0 | 108.7 | Q131 | Q131-P160 HydrophobicContact CB-CB 3.85Å; Q131-P160 WeakPolarHBondContact O-CB 3.37Å; Q131-P160 WeakPolarHBondContact O-CG 3.38Å |
| 161 | G | 66.9 | Low | 85.3 | Confident | 44 Ų | 44 | 51.1 Ų | 51.1 | 45% | 0.454 | 31% | 0.308 | S | S | . | . | S | Bend | trans | -156.9 | 173.7 | -178.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | G159 | G159-G161 PolarHBondContact O-N 2.86Š|
| 162 | P | 62.7 | Low | 85.4 | Confident | 94 Ų | 94 | 51 Ų | 51 | 61% | 0.61 | 31% | 0.306 | S | S | * | . | trans | -55.9 | 144.8 | 172.4 | 15.1 | -18.3 | 0 | 0 | 0 | 109.9 | D164 C165 | P162-D164 PolarHBondContact O-N 3.35Å; P162-C165 WeakPolarHBondContact O-CB 3.29Å; P162-C165 PolarHBondContact O-N 3.26Å | ||
| 163 | P | 60.1 | Low | 85.4 | Confident | 128 Ų | 128 | 53.4 Ų | 53.4 | 83% | 0.831 | 31% | 0.312 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.2 | -19.1 | -173.6 | 23.5 | -33.8 | 0 | 0 | 0 | 113.7 | C165 | P163-C165 VanDerWaalsContact C-N 3.28Å; P163-C165 PolarHBondContact O-N 2.96Å |
| 164 | D | 64.9 | Low | 85.3 | Confident | 144 Ų | 144 | 54.6 Ų | 54.6 | 77% | 0.77 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.7 | -5.9 | 179.2 | -53.8 | -34.8 | 0 | 0 | 0 | 113.6 | P162 Q166 | P162-D164 PolarHBondContact O-N 3.35Å; D164-Q166 PolarHBondContact O-N 3.5Å |
| 165 | C | 68.7 | Low | 85.2 | Confident | 69 Ų | 69 | 56.4 Ų | 56.4 | 47% | 0.466 | 33% | 0.33 | S | S | . | . | S | Bend | trans | -74.3 | 113.5 | 179.2 | -164.2 | 0 | 0 | 0 | 0 | 110.1 | P162 P163 | P162-C165 WeakPolarHBondContact O-CB 3.29Å; P162-C165 PolarHBondContact O-N 3.26Å; P163-C165 VanDerWaalsContact C-N 3.28Å; P163-C165 PolarHBondContact O-N 2.96Å |
| 166 | Q | 80.8 | Confident | 85.2 | Confident | 153 Ų | 153 | 57.8 Ų | 57.8 | 72% | 0.715 | 34% | 0.338 | S | S | * | . | P | Polyproline II helix | trans | -56.8 | 134.1 | 177.5 | -73.5 | -66 | -38.8 | 0 | 0 | 110.8 | D164 Q270 | D164-Q166 PolarHBondContact O-N 3.5Å; Q166-Q270 PolarHBondContact O-NE2 3.49Å |
| 167 | P | 88.9 | Confident | 85.4 | Confident | 43 Ų | 43 | 57.6 Ų | 57.6 | 28% | 0.279 | 34% | 0.336 | S | S | . | . | P | Polyproline II helix | trans | -62.1 | 142.8 | 177.2 | -22.6 | 33.6 | 0 | 0 | 0 | 112.3 | A156 I158 | A156-P167 HydrophobicContact CB-CB 3.9Å; I158-P167 HydrophobicContact CD1-CG 4.44Å; I158-P167 HydrophobicContact CG1-CB 3.79Å; I158-P167 HydrophobicContact CG1-CG 3.87Å |
| 168 | A | 92.4 | Very high | 85.5 | Confident | 1 Ų | 1 | 60.1 Ų | 60.1 | 1% | 0.008 | 35% | 0.348 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -73 | 132.6 | 170.7 | 0 | 0 | 0 | 0 | 0 | 108.7 | A156 V157 T267 Q270 L271 | A156-A168 CarbonylContact C-O 3.55Å; A156-A168 WeakPolarHBondContact CA-O 3.4Å; V157-A168 HydrophobicContact CB-CB 4.38Å; V157-A168 PolarHBondContact N-O 2.99Å; V157-A168 PolarHBondContact O-N 3.33Å; A168-T267 HydrophobicContact CB-CG2 4.43Å; A168-Q270 HydrophobicContact CB-CG 4.15Å; A168-L271 HydrophobicContact CB-CD2 3.59Å; A168-L271 HydrophobicContact CB-CG 3.8Å |
| 169 | Q | 94.1 | Very high | 85.8 | Confident | 115 Ų | 115 | 63 Ų | 63 | 54% | 0.537 | 36% | 0.355 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.4 | 125.4 | -178.8 | -67.5 | -171.3 | -13.9 | 0 | 0 | 111.3 | T154 L155 T267 | T154-Q169 HydrophobicContact CG2-CB 4.46Å; L155-Q169 WeakPolarHBondContact O-CA 3.27Å; Q169-T267 WeakPolarHBondContact O-CG2 3.47Å |
| 170 | I | 96.1 | Very high | 86.5 | Confident | 2 Ų | 2 | 62.3 Ų | 62.3 | 1% | 0.01 | 35% | 0.348 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.6 | 154.5 | 174.6 | 65.1 | 167.6 | 0 | 0 | 0 | 111.1 | T154 L155 R172 F240 F241 E245 T267 L271 | T154-I170 CarbonylContact C-O 3.54Å; T154-I170 WeakPolarHBondContact CA-O 3.41Å; L155-I170 HydrophobicContact CB-CG1 3.84Å; L155-I170 HydrophobicContact CD1-CD1 4.07Å; L155-I170 HydrophobicContact CD1-CG1 4.1Å; L155-I170 PolarHBondContact N-O 2.99Å; L155-I170 PolarHBondContact O-N 3.24Å; I170-R172 HydrophobicContact CD1-CG 4.23Å; I170-F240 HydrophobicContact CD1-CE1 4.45Å; I170-F241 HydrophobicContact CD1-CD1 3.53Å; I170-F241 HydrophobicContact CD1-CE1 4.16Å; I170-F241 HydrophobicContact CD1-CG 4.46Å; I170-E245 WeakPolarHBondContact CB-OE1 3.22Å; I170-E245 HydrophobicContact CG2-CG 4.16Å; I170-E245 VanDerWaalsContact CG2-OE1 3.32Å; I170-E245 WeakPolarHBondContact CG2-OE1 3.32Å; I170-T267 HydrophobicContact CG2-CG2 4.28Å; I170-L271 HydrophobicContact CG2-CD1 3.51Å |
| 171 | S | 96.5 | Very high | 87.7 | Confident | 53 Ų | 53 | 59.7 Ų | 59.7 | 37% | 0.371 | 33% | 0.328 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.5 | 127.6 | 179.1 | -73.5 | 0 | 0 | 0 | 0 | 111.5 | Y153 | Y153-S171 CarbonylContact O-C 3.52Å; Y153-S171 WeakPolarHBondContact O-CA 3.41Å |
| 172 | R | 97.6 | Very high | 89.1 | Confident | 10 Ų | 10 | 63.9 Ų | 63.9 | 4% | 0.038 | 33% | 0.331 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.1 | 147.3 | -177.7 | -65.6 | -66.9 | 179.3 | -86.3 | -2.2 | 111.7 | Y153 L155 I170 D176 F177 F240 F241 E245 | Y153-R172 WeakPolarHBondContact CB-O 3.18Å; Y153-R172 WeakPolarHBondContact CD2-O 3.29Å; Y153-R172 PolarHBondContact N-O 2.97Å; Y153-R172 PolarHBondContact O-N 3.25Å; L155-R172 HydrophobicContact CD1-CB 4.5Å; L155-R172 HydrophobicContact CD1-CG 4.27Å; I170-R172 HydrophobicContact CD1-CG 4.23Å; R172-D176 HydrophobicContact CB-CB 4.36Å; R172-F177 HydrophobicContact CB-CD2 4.16Å; R172-F177 HydrophobicContact CB-CE2 3.54Å; R172-F177 HydrophobicContact CB-CZ 4.12Å; R172-F240 HydrophobicContact CB-CE2 4.46Å; R172-F240 HydrophobicContact CB-CZ 4.18Å; R172-F240 HydrophobicContact CG-CE1 4.28Å; R172-F240 HydrophobicContact CG-CE2 3.98Å; R172-F240 HydrophobicContact CG-CZ 3.63Å; R172-F240 PolarHBondContact NE-O 3.44Å; R172-F240 PolarHBondContact NH2-O 3.05Å; R172-F241 PolarHBondContact NH2-O 3.35Å; R172-E245 IonicContact CZ-OE1 3.1Å; R172-E245 IonicContact CZ-OE2 3.21Å; R172-E245 IonicContact NH1-OE1 3.47Å; R172-E245 PolarHBondContact NH1-OE1 3.21Å; R172-E245 IonicContact NH1-OE2 2.7Å; R172-E245 IonicContact NH2-OE1 3.61Å; R172-E245 PolarHBondContact NH2-OE1 2.93Å; R172-E245 IonicContact NH2-OE2 2.84Å; R172-E245 PolarHBondContact NH2-OE2 3.24Å |
| 173 | R | 95.9 | Very high | 90.7 | Very high | 92 Ų | 92 | 60.6 Ų | 60.6 | 35% | 0.347 | 31% | 0.308 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97 | 162.4 | 172.8 | -53.9 | 178.4 | -162.6 | -174.9 | 2.3 | 109.6 | Y150 L152 S175 D176 F177 | Y150-R173 VanDerWaalsContact CD2-CD 3.42Å; Y150-R173 HydrophobicContact CD2-CG 3.75Å; Y150-R173 VanDerWaalsContact CE1-CZ 3.48Å; Y150-R173 VanDerWaalsContact CE1-NH1 3.35Å; Y150-R173 HydrophobicContact CE2-CG 4.12Å; Y150-R173 VanDerWaalsContact CE2-CZ 3.46Å; Y150-R173 HydrophobicContact CG-CG 4.5Å; Y150-R173 VanDerWaalsContact CZ-NH2 3.25Å; Y150-R173 PolarHBondContact OH-NH2 3.1Å; L152-R173 HydrophobicContact CD1-CG 3.77Å; R173-S175 PolarHBondContact O-N 2.91Å; R173-S175 VanDerWaalsContact O-N 3.12Å; R173-D176 PolarHBondContact N-OD2 2.9Å; R173-D176 WeakPolarHBondContact O-CB 3.49Å; R173-D176 PolarHBondContact O-N 3.46Å; R173-F177 WeakPolarHBondContact O-CD2 3.42Å |
| 174 | Y | 96 | Very high | 92.4 | Very high | 26 Ų | 26 | 54.5 Ų | 54.5 | 10% | 0.102 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -48.4 | -43.2 | 174.9 | 177.6 | -85.2 | 0 | 0 | 0 | 112.8 | D176 F177 E178 F197 P198 K200 F218 | Y174-D176 PolarHBondContact O-N 3.34Å; Y174-F177 PolarHBondContact O-N 3.43Å; Y174-E178 HydrophobicContact CD1-CB 4.37Å; Y174-E178 HydrophobicContact CE1-CB 4.02Å; Y174-E178 HydrophobicContact CE1-CG 4.34Å; Y174-E178 PolarHBondContact O-N 3.36Å; Y174-F197 HydrophobicContact CE2-CE1 4.28Å; Y174-F197 AromaticContact CZ-CE1 3.95Å; Y174-P198 HydrophobicContact CE2-CG 4.45Å; Y174-P198 PolarHBondContact OH-O 2.95Å; Y174-K200 HydrophobicContact CE1-CB 4.28Å; Y174-K200 HydrophobicContact CE1-CD 4.38Å; Y174-K200 HydrophobicContact CE1-CG 4.16Å; Y174-K200 WeakPolarHBondContact OH-CA 3.35Å; Y174-K200 PolarHBondContact OH-N 3.34Å; Y174-K200 VanDerWaalsContact OH-N 3.11Å; Y174-F218 HydrophobicContact CD2-CE1 4.25Å; Y174-F218 AromaticContact CD2-CZ 3.62Å; Y174-F218 HydrophobicContact CD2-CZ 3.62Å; Y174-F218 HydrophobicContact CE2-CZ 4.3Å; Y174-F218 HydrophobicContact CG-CZ 4.35Å |
| 175 | S | 95.1 | Very high | 93.8 | Very high | 56 Ų | 56 | 51.5 Ų | 51.5 | 39% | 0.392 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -62.5 | -27.5 | -179.8 | 50.5 | 0 | 0 | 0 | 0 | 113.8 | R173 R179 | R173-S175 PolarHBondContact O-N 2.91Å; R173-S175 VanDerWaalsContact O-N 3.12Å; S175-R179 VanDerWaalsContact O-CB 3.31Å; S175-R179 WeakPolarHBondContact O-CB 3.2Å; S175-R179 PolarHBondContact O-N 2.91Å |
| 176 | D | 97.3 | Very high | 95.1 | Very high | 29 Ų | 29 | 55.8 Ų | 55.8 | 16% | 0.155 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -71.9 | -43.9 | 177.8 | -58.4 | -46.8 | 0 | 0 | 0 | 110.6 | R172 R173 Y174 R179 L180 F240 | R172-D176 HydrophobicContact CB-CB 4.36Å; R173-D176 PolarHBondContact N-OD2 2.9Å; R173-D176 WeakPolarHBondContact O-CB 3.49Å; R173-D176 PolarHBondContact O-N 3.46Å; Y174-D176 PolarHBondContact O-N 3.34Å; D176-R179 PolarHBondContact O-N 3.35Å; D176-R179 IonicContact OD1-CZ 2.87Å; D176-R179 IonicContact OD1-NH1 3.68Å; D176-R179 PolarHBondContact OD1-NH1 3.04Å; D176-R179 IonicContact OD1-NH2 2.61Å; D176-R179 PolarHBondContact OD1-NH2 3.43Å; D176-L180 PolarHBondContact O-N 3.23Å; D176-F240 HydrophobicContact CB-CE2 4.13Å |
| 177 | F | 97.9 | Very high | 95.7 | Very high | 0 Ų | 0 | 53.5 Ų | 53.5 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -64.5 | -41.9 | 173.4 | -68.6 | -90.6 | 0 | 0 | 0 | 112 | L155 R172 R173 Y174 R179 L180 H181 F197 F218 F221 L222 F240 | L155-F177 HydrophobicContact CD1-CE1 4.01Å; L155-F177 HydrophobicContact CD1-CE2 4.45Å; L155-F177 HydrophobicContact CD1-CZ 3.48Å; L155-F177 VanDerWaalsContact CD1-CZ 3.48Å; L155-F177 HydrophobicContact CD2-CZ 4.21Å; L155-F177 HydrophobicContact CG-CZ 4.15Å; R172-F177 HydrophobicContact CB-CD2 4.16Å; R172-F177 HydrophobicContact CB-CE2 3.54Å; R172-F177 HydrophobicContact CB-CZ 4.12Å; R173-F177 WeakPolarHBondContact O-CD2 3.42Å; Y174-F177 PolarHBondContact O-N 3.43Å; F177-R179 VanDerWaalsContact C-N 3.33Å; F177-R179 PolarHBondContact O-N 2.87Å; F177-L180 PolarHBondContact O-N 3.33Å; F177-H181 WeakPolarHBondContact O-CB 3.42Å; F177-H181 PolarHBondContact O-N 2.88Å; F177-F197 HydrophobicContact CB-CE2 3.81Å; F177-F197 HydrophobicContact CB-CZ 3.85Å; F177-F218 HydrophobicContact CB-CD1 4.08Å; F177-F218 HydrophobicContact CB-CE1 3.69Å; F177-F218 HydrophobicContact CB-CZ 4.3Å; F177-F218 HydrophobicContact CD1-CB 4.29Å; F177-F218 AromaticContact CD1-CD1 3.7Å; F177-F218 HydrophobicContact CD1-CD1 3.7Å; F177-F218 HydrophobicContact CD1-CE1 4.16Å; F177-F218 HydrophobicContact CD1-CG 4.04Å; F177-F218 HydrophobicContact CD2-CD1 4.08Å; F177-F218 HydrophobicContact CD2-CD2 4.23Å; F177-F218 AromaticContact CD2-CE1 3.89Å; F177-F218 HydrophobicContact CD2-CE1 3.89Å; F177-F218 HydrophobicContact CD2-CE2 4.04Å; F177-F218 HydrophobicContact CD2-CG 4.25Å; F177-F218 AromaticContact CD2-CZ 3.84Å; F177-F218 HydrophobicContact CD2-CZ 3.84Å; F177-F218 HydrophobicContact CE1-CB 3.72Å; F177-F218 AromaticContact CE1-CD1 3.98Å; F177-F218 HydrophobicContact CE1-CD1 3.98Å; F177-F218 HydrophobicContact CE1-CD2 4.43Å; F177-F218 AromaticContact CE1-CG 3.82Å; F177-F218 HydrophobicContact CE1-CG 3.82Å; F177-F218 HydrophobicContact CE2-CD1 4.37Å; F177-F218 AromaticContact CE2-CD2 3.89Å; F177-F218 HydrophobicContact CE2-CD2 3.89Å; F177-F218 HydrophobicContact CE2-CE1 4.48Å; F177-F218 HydrophobicContact CE2-CE2 4.01Å; F177-F218 HydrophobicContact CE2-CG 4.07Å; F177-F218 HydrophobicContact CE2-CZ 4.29Å; F177-F218 AromaticContact CG-CD1 3.72Å; F177-F218 HydrophobicContact CG-CD1 3.72Å; F177-F218 AromaticContact CG-CE1 3.69Å; F177-F218 HydrophobicContact CG-CE1 3.69Å; F177-F218 HydrophobicContact CG-CG 4.22Å; F177-F218 HydrophobicContact CG-CZ 4.13Å; F177-F218 HydrophobicContact CZ-CB 3.89Å; F177-F218 HydrophobicContact CZ-CD1 4.29Å; F177-F218 AromaticContact CZ-CD2 3.97Å; F177-F218 HydrophobicContact CZ-CD2 3.97Å; F177-F218 AromaticContact CZ-CG 3.82Å; F177-F218 HydrophobicContact CZ-CG 3.82Å; F177-F221 HydrophobicContact CD1-CD1 4.28Å; F177-L222 HydrophobicContact CE1-CD1 3.95Å; F177-L222 HydrophobicContact CE1-CD2 4.37Å; F177-L222 HydrophobicContact CE1-CG 4.17Å; F177-F240 HydrophobicContact CD1-CE2 4.07Å; F177-F240 AromaticContact CD1-CZ 3.61Å; F177-F240 HydrophobicContact CD1-CZ 3.61Å; F177-F240 HydrophobicContact CD2-CE2 4.49Å; F177-F240 HydrophobicContact CD2-CZ 4.33Å; F177-F240 HydrophobicContact CE1-CE1 4.23Å; F177-F240 HydrophobicContact CE1-CE2 4.42Å; F177-F240 AromaticContact CE1-CZ 3.54Å; F177-F240 HydrophobicContact CE1-CZ 3.54Å; F177-F240 HydrophobicContact CE2-CZ 4.26Å; F177-F240 HydrophobicContact CG-CE2 4.14Å; F177-F240 HydrophobicContact CG-CZ 4.04Å; F177-F240 AromaticContact CZ-CZ 3.9Å; F177-F240 HydrophobicContact CZ-CZ 3.9Å |
| 178 | E | 97 | Very high | 95.9 | Very high | 53 Ų | 53 | 53.9 Ų | 53.9 | 25% | 0.248 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -61.8 | -42.2 | 177.7 | -178.4 | 179.1 | -136.4 | 0 | 0 | 111.1 | Y174 H181 R182 F197 K200 | Y174-E178 HydrophobicContact CD1-CB 4.37Å; Y174-E178 HydrophobicContact CE1-CB 4.02Å; Y174-E178 HydrophobicContact CE1-CG 4.34Å; Y174-E178 PolarHBondContact O-N 3.36Å; E178-H181 PolarHBondContact O-N 3.01Å; E178-R182 WeakPolarHBondContact O-CB 3.29Å; E178-R182 PolarHBondContact O-N 3.49Å; E178-F197 HydrophobicContact CB-CE1 4.15Å; E178-F197 HydrophobicContact CB-CZ 4.12Å; E178-K200 IonicContact OE2-NZ 3.25Å |
| 179 | R | 97.4 | Very high | 95.9 | Very high | 113 Ų | 113 | 63.3 Ų | 63.3 | 43% | 0.426 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -63 | -47.4 | 175.4 | -179.7 | 175.8 | 60.9 | -114.7 | -6.9 | 111.5 | S175 D176 F177 R182 N183 | S175-R179 VanDerWaalsContact O-CB 3.31Å; S175-R179 WeakPolarHBondContact O-CB 3.2Å; S175-R179 PolarHBondContact O-N 2.91Å; D176-R179 PolarHBondContact O-N 3.35Å; D176-R179 IonicContact OD1-CZ 2.87Å; D176-R179 IonicContact OD1-NH1 3.68Å; D176-R179 PolarHBondContact OD1-NH1 3.04Å; D176-R179 IonicContact OD1-NH2 2.61Å; D176-R179 PolarHBondContact OD1-NH2 3.43Å; F177-R179 VanDerWaalsContact C-N 3.33Å; F177-R179 PolarHBondContact O-N 2.87Å; R179-R182 PolarHBondContact O-N 2.98Å; R179-N183 VanDerWaalsContact O-CG 3.26Å; R179-N183 PolarHBondContact O-N 2.72Å; R179-N183 PolarHBondContact O-OD1 3.23Å |
| 180 | L | 97.4 | Very high | 95.8 | Very high | 6 Ų | 6 | 60.5 Ų | 60.5 | 3% | 0.031 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -56.1 | -53 | 175.4 | 170.1 | 63.3 | 0 | 0 | 0 | 110.8 | D176 F177 R182 N183 L184 F221 L222 L225 D236 L237 F240 | D176-L180 PolarHBondContact O-N 3.23Å; F177-L180 PolarHBondContact O-N 3.33Å; L180-R182 VanDerWaalsContact C-N 3.34Å; L180-R182 PolarHBondContact O-N 2.86Å; L180-N183 PolarHBondContact O-N 3.23Å; L180-N183 VanDerWaalsContact O-N 3.13Å; L180-L184 HydrophobicContact CD1-CD1 3.67Å; L180-L184 HydrophobicContact CD1-CG 3.88Å; L180-L184 HydrophobicContact CG-CD1 4.01Å; L180-L184 HydrophobicContact CG-CG 4.49Å; L180-L184 WeakPolarHBondContact O-CG 3.18Å; L180-L184 PolarHBondContact O-N 3.16Å; L180-F221 HydrophobicContact CD2-CE1 4.01Å; L180-F221 HydrophobicContact CG-CE1 4.49Å; L180-L222 HydrophobicContact CD2-CD2 4.25Å; L180-L225 HydrophobicContact CD2-CD1 4.03Å; L180-D236 HydrophobicContact CD1-CB 4.13Å; L180-D236 WeakPolarHBondContact CD1-O 3.24Å; L180-L237 HydrophobicContact CD1-CB 4.44Å; L180-L237 HydrophobicContact CD1-CD1 4.38Å; L180-L237 HydrophobicContact CD2-CD1 3.85Å; L180-F240 HydrophobicContact CB-CD2 3.95Å; L180-F240 HydrophobicContact CB-CG 4.48Å; L180-F240 HydrophobicContact CD1-CB 4.12Å; L180-F240 HydrophobicContact CD2-CB 3.88Å; L180-F240 HydrophobicContact CD2-CD1 3.98Å; L180-F240 HydrophobicContact CD2-CD2 3.73Å; L180-F240 HydrophobicContact CD2-CE1 4.47Å; L180-F240 HydrophobicContact CD2-CE2 4.24Å; L180-F240 HydrophobicContact CD2-CG 3.58Å; L180-F240 HydrophobicContact CG-CB 4.42Å; L180-F240 HydrophobicContact CG-CD2 4.37Å; L180-F240 HydrophobicContact CG-CG 4.44Å |
| 181 | H | 97.1 | Very high | 95.5 | Very high | 22 Ų | 22 | 62.7 Ų | 62.7 | 10% | 0.102 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -55.5 | -48 | 179.9 | 173.7 | -109.3 | 0 | 0 | 0 | 111.6 | F177 E178 N183 L184 Q185 M192 F197 F221 | F177-H181 WeakPolarHBondContact O-CB 3.42Å; F177-H181 PolarHBondContact O-N 2.88Å; E178-H181 PolarHBondContact O-N 3.01Å; H181-N183 PolarHBondContact O-N 3.36Å; H181-L184 PolarHBondContact O-N 3.3Å; H181-Q185 PolarHBondContact CE1-NE2 2.84Å; H181-Q185 PolarHBondContact CE1-OE1 2.86Å; H181-Q185 PolarHBondContact NE2-NE2 3.42Å; H181-Q185 WeakPolarHBondContact O-CB 3.12Å; H181-Q185 VanDerWaalsContact O-CG 3.27Å; H181-Q185 WeakPolarHBondContact O-CG 3.38Å; H181-Q185 PolarHBondContact O-N 2.76Å; H181-M192 VanDerWaalsContact CD2-CE 3.45Å; H181-M192 WeakPolarHBondContact CD2-CE 3.3Å; H181-F197 HydrophobicContact CB-CD2 3.75Å; H181-F197 HydrophobicContact CB-CE2 3.92Å; H181-F197 HydrophobicContact CB-CG 4.12Å; H181-F197 HydrophobicContact CB-CZ 4.41Å; H181-F197 AromaticContact CD2-CD2 3.97Å; H181-F197 AromaticContact CD2-CG 3.88Å; H181-F197 AromaticContact CE1-CG 3.97Å; H181-F197 AromaticContact CG-CD2 3.76Å; H181-F197 AromaticContact CG-CG 3.68Å; H181-F197 AromaticContact ND1-CD1 3.95Å; H181-F197 AromaticContact ND1-CG 3.77Å; H181-F197 WeakPolarHBondContact NE2-CB 3.21Å; H181-F221 HydrophobicContact CB-CE2 4.3Å; H181-F221 HydrophobicContact CB-CZ 3.76Å; H181-F221 AromaticContact CD2-CE2 3.73Å |
| 182 | R | 96.6 | Very high | 95.4 | Very high | 133 Ų | 133 | 60.4 Ų | 60.4 | 50% | 0.502 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -63.2 | -38.8 | 177.6 | -175.8 | 179.8 | 63.2 | -153.4 | -1.2 | 112.7 | E178 R179 L180 R186 | E178-R182 WeakPolarHBondContact O-CB 3.29Å; E178-R182 PolarHBondContact O-N 3.49Å; R179-R182 PolarHBondContact O-N 2.98Å; L180-R182 VanDerWaalsContact C-N 3.34Å; L180-R182 PolarHBondContact O-N 2.86Å; R182-R186 VanDerWaalsContact O-CG 3.31Å; R182-R186 WeakPolarHBondContact O-CG 3.35Å; R182-R186 PolarHBondContact O-N 2.93Å; R182-R186 VanDerWaalsContact O-N 3.16Å; R182-R186 PolarHBondContact O-NE 3.09Å |
| 183 | N | 96.4 | Very high | 95.1 | Very high | 24 Ų | 24 | 64.2 Ų | 64.2 | 13% | 0.128 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -64.5 | -49.4 | 177.5 | -72 | 2.6 | 0 | 0 | 0 | 110.9 | R179 L180 H181 Q185 R186 Q187 D236 | R179-N183 VanDerWaalsContact O-CG 3.26Å; R179-N183 PolarHBondContact O-N 2.72Å; R179-N183 PolarHBondContact O-OD1 3.23Å; L180-N183 PolarHBondContact O-N 3.23Å; L180-N183 VanDerWaalsContact O-N 3.13Å; H181-N183 PolarHBondContact O-N 3.36Å; N183-Q185 PolarHBondContact O-N 2.94Å; N183-R186 PolarHBondContact O-N 3.09Å; N183-R186 VanDerWaalsContact O-N 3.17Å; N183-R186 PolarHBondContact OD1-NH2 2.89Å; N183-Q187 PolarHBondContact O-N 2.93Å; N183-D236 HydrophobicContact CB-CB 4.32Å; N183-D236 PolarHBondContact ND2-OD1 3.04Å |
| 184 | L | 96.3 | Very high | 94.8 | Very high | 0 Ų | 0 | 64.5 Ų | 64.5 | 0% | 0 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -64.1 | -39.9 | 178.1 | -65.4 | 178.9 | 0 | 0 | 0 | 112.1 | L180 H181 R186 Q187 F188 M192 L225 A234 D236 | L180-L184 HydrophobicContact CD1-CD1 3.67Å; L180-L184 HydrophobicContact CD1-CG 3.88Å; L180-L184 HydrophobicContact CG-CD1 4.01Å; L180-L184 HydrophobicContact CG-CG 4.49Å; L180-L184 WeakPolarHBondContact O-CG 3.18Å; L180-L184 PolarHBondContact O-N 3.16Å; H181-L184 PolarHBondContact O-N 3.3Å; L184-R186 VanDerWaalsContact C-N 3.27Å; L184-R186 PolarHBondContact O-N 3.14Å; L184-Q187 PolarHBondContact O-N 3.07Å; L184-F188 HydrophobicContact CD2-CD2 4.03Å; L184-F188 HydrophobicContact CD2-CE2 4.12Å; L184-F188 WeakPolarHBondContact O-CA 3.5Å; L184-F188 WeakPolarHBondContact O-CB 3.22Å; L184-F188 PolarHBondContact O-N 3.19Å; L184-M192 HydrophobicContact CB-CE 3.92Å; L184-M192 HydrophobicContact CB-CG 4.12Å; L184-M192 HydrophobicContact CB-SD 3.74Å; L184-M192 HydrophobicContact CD1-SD 4.35Å; L184-L225 HydrophobicContact CD1-CD1 3.71Å; L184-L225 HydrophobicContact CD1-CD2 3.68Å; L184-L225 HydrophobicContact CD1-CG 4.35Å; L184-A234 HydrophobicContact CD2-CB 3.59Å; L184-D236 HydrophobicContact CD2-CB 4.06Å |
| 185 | Q | 95.4 | Very high | 94.7 | Very high | 81 Ų | 81 | 64 Ų | 64 | 38% | 0.379 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -59.8 | -37.3 | 174.8 | -80 | -171.5 | -30.5 | 0 | 0 | 112.7 | H181 N183 R189 M192 | H181-Q185 PolarHBondContact CE1-NE2 2.84Å; H181-Q185 PolarHBondContact CE1-OE1 2.86Å; H181-Q185 PolarHBondContact NE2-NE2 3.42Å; H181-Q185 WeakPolarHBondContact O-CB 3.12Å; H181-Q185 VanDerWaalsContact O-CG 3.27Å; H181-Q185 WeakPolarHBondContact O-CG 3.38Å; H181-Q185 PolarHBondContact O-N 2.76Å; N183-Q185 PolarHBondContact O-N 2.94Å; Q185-R189 WeakPolarHBondContact O-CG 3.37Å; Q185-M192 HydrophobicContact CG-CB 4.16Å; Q185-M192 HydrophobicContact CG-CE 3.85Å; Q185-M192 HydrophobicContact CG-CG 4.49Å |
| 186 | R | 95.1 | Very high | 94.5 | Very high | 159 Ų | 159 | 65.1 Ų | 65.1 | 60% | 0.6 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -68.6 | -39.7 | 178 | -73.1 | -177.5 | -62.6 | 162.7 | 3.4 | 112 | R182 N183 L184 | R182-R186 VanDerWaalsContact O-CG 3.31Å; R182-R186 WeakPolarHBondContact O-CG 3.35Å; R182-R186 PolarHBondContact O-N 2.93Å; R182-R186 VanDerWaalsContact O-N 3.16Å; R182-R186 PolarHBondContact O-NE 3.09Å; N183-R186 PolarHBondContact O-N 3.09Å; N183-R186 VanDerWaalsContact O-N 3.17Å; N183-R186 PolarHBondContact OD1-NH2 2.89Å; L184-R186 VanDerWaalsContact C-N 3.27Å; L184-R186 PolarHBondContact O-N 3.14Å |
| 187 | Q | 93.9 | Very high | 94.4 | Very high | 105 Ų | 105 | 65.3 Ų | 65.3 | 49% | 0.491 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -87 | -35 | -174.8 | -66.5 | 172 | 12.5 | 0 | 0 | 113.4 | N183 L184 D236 | N183-Q187 PolarHBondContact O-N 2.93Å; L184-Q187 PolarHBondContact O-N 3.07Å; Q187-D236 VanDerWaalsContact CD-OD2 3.31Å; Q187-D236 PolarHBondContact NE2-OD2 3.22Å; Q187-D236 PolarHBondContact OE1-OD2 3.38Å |
| 188 | F | 92.8 | Very high | 94.1 | Very high | 51 Ų | 51 | 66.4 Ų | 66.4 | 22% | 0.224 | 35% | 0.346 | C | S | . | . | trans | -127.4 | 55 | -170.6 | -57.9 | -84.6 | 0 | 0 | 0 | 111.6 | L184 G190 P191 M192 E230 L231 A234 | L184-F188 HydrophobicContact CD2-CD2 4.03Å; L184-F188 HydrophobicContact CD2-CE2 4.12Å; L184-F188 WeakPolarHBondContact O-CA 3.5Å; L184-F188 WeakPolarHBondContact O-CB 3.22Å; L184-F188 PolarHBondContact O-N 3.19Å; F188-G190 VanDerWaalsContact C-N 3.29Å; F188-G190 PolarHBondContact O-N 2.68Å; F188-P191 HydrophobicContact CB-CB 4.45Å; F188-P191 HydrophobicContact CB-CG 4.35Å; F188-P191 WeakPolarHBondContact O-CD 3.22Å; F188-M192 HydrophobicContact CB-CG 4.17Å; F188-M192 VanDerWaalsContact O-CB 3.25Å; F188-M192 WeakPolarHBondContact O-CB 3.38Å; F188-M192 VanDerWaalsContact O-CG 3.25Å; F188-M192 WeakPolarHBondContact O-CG 3.5Å; F188-M192 PolarHBondContact O-N 2.74Å; F188-E230 HydrophobicContact CD1-CB 4.47Å; F188-L231 HydrophobicContact CB-CD2 3.46Å; F188-L231 VanDerWaalsContact CB-CD2 3.46Å; F188-L231 HydrophobicContact CD1-CD2 4.17Å; F188-L231 HydrophobicContact CD2-CD2 3.72Å; F188-L231 HydrophobicContact CG-CD2 3.53Å; F188-A234 HydrophobicContact CE2-CB 3.63Å; F188-A234 HydrophobicContact CZ-CB 3.94Å | ||
| 189 | R | 91.1 | Very high | 93.7 | Very high | 200 Ų | 200 | 74.6 Ų | 74.6 | 76% | 0.755 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -51.9 | -42.7 | -175 | -72.7 | -173 | -178.6 | -173.9 | 1.6 | 114.3 | Q185 A193 | Q185-R189 WeakPolarHBondContact O-CG 3.37Å; R189-A193 PolarHBondContact O-N 3.33Å |
| 190 | G | 92 | Very high | 93.2 | Very high | 56 Ų | 56 | 75.6 Ų | 75.6 | 58% | 0.577 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -65.8 | -62.9 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | F188 M192 A193 | F188-G190 VanDerWaalsContact C-N 3.29Å; F188-G190 PolarHBondContact O-N 2.68Å; G190-M192 PolarHBondContact O-N 2.94Å; G190-A193 VanDerWaalsContact O-CB 3.32Å; G190-A193 WeakPolarHBondContact O-CB 3.31Å; G190-A193 PolarHBondContact O-N 3.33Å |
| 191 | P | 91.4 | Very high | 92.5 | Very high | 47 Ų | 47 | 80.5 Ų | 80.5 | 31% | 0.305 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -55.9 | -33.7 | 178.8 | -28.1 | 35.5 | 0 | 0 | 0 | 114.4 | F188 V228 E230 L231 | F188-P191 HydrophobicContact CB-CB 4.45Å; F188-P191 HydrophobicContact CB-CG 4.35Å; F188-P191 WeakPolarHBondContact O-CD 3.22Å; P191-V228 HydrophobicContact CB-CG1 3.96Å; P191-E230 HydrophobicContact CG-CB 4.46Å; P191-L231 HydrophobicContact CB-CD1 4.05Å; P191-L231 HydrophobicContact CB-CD2 4.29Å; P191-L231 HydrophobicContact CB-CG 4.05Å |
| 192 | M | 94.7 | Very high | 91.5 | Very high | 5 Ų | 5 | 87.5 Ų | 87.5 | 3% | 0.025 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -77.4 | -14.1 | 179.1 | -70.5 | -66.5 | -64.3 | 0 | 0 | 114.4 | H181 L184 Q185 F188 G190 A194 I195 F221 L225 L231 | H181-M192 VanDerWaalsContact CD2-CE 3.45Å; H181-M192 WeakPolarHBondContact CD2-CE 3.3Å; L184-M192 HydrophobicContact CB-CE 3.92Å; L184-M192 HydrophobicContact CB-CG 4.12Å; L184-M192 HydrophobicContact CB-SD 3.74Å; L184-M192 HydrophobicContact CD1-SD 4.35Å; Q185-M192 HydrophobicContact CG-CB 4.16Å; Q185-M192 HydrophobicContact CG-CE 3.85Å; Q185-M192 HydrophobicContact CG-CG 4.49Å; F188-M192 HydrophobicContact CB-CG 4.17Å; F188-M192 VanDerWaalsContact O-CB 3.25Å; F188-M192 WeakPolarHBondContact O-CB 3.38Å; F188-M192 VanDerWaalsContact O-CG 3.25Å; F188-M192 WeakPolarHBondContact O-CG 3.5Å; F188-M192 PolarHBondContact O-N 2.74Å; G190-M192 PolarHBondContact O-N 2.94Å; M192-A194 VanDerWaalsContact C-N 3.26Å; M192-A194 PolarHBondContact O-N 3.05Å; M192-I195 PolarHBondContact O-N 2.72Å; M192-I195 VanDerWaalsContact O-N 3.12Å; M192-I195 HydrophobicContact SD-CD1 4.01Å; M192-F221 HydrophobicContact CE-CE2 4.3Å; M192-L225 HydrophobicContact CE-CD2 4.34Å; M192-L225 HydrophobicContact SD-CD2 3.7Å; M192-L231 HydrophobicContact CG-CD1 4.36Å; M192-L231 HydrophobicContact CG-CD2 4.11Å; M192-L231 HydrophobicContact SD-CD1 3.67Å; M192-L231 HydrophobicContact SD-CD2 4Å |
| 193 | A | 91.3 | Very high | 90.8 | Very high | 90 Ų | 90 | 91.3 Ų | 91.3 | 74% | 0.744 | 45% | 0.452 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.5 | -31.1 | -173.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | R189 G190 | R189-A193 PolarHBondContact O-N 3.33Å; G190-A193 VanDerWaalsContact O-CB 3.32Å; G190-A193 WeakPolarHBondContact O-CB 3.31Å; G190-A193 PolarHBondContact O-N 3.33Å |
| 194 | A | 88.8 | Confident | 90.2 | Very high | 98 Ų | 98 | 99 Ų | 99 | 81% | 0.81 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.5 | -4.4 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | M192 | M192-A194 VanDerWaalsContact C-N 3.26Å; M192-A194 PolarHBondContact O-N 3.05Å |
| 195 | I | 92.8 | Very high | 89.6 | Confident | 16 Ų | 16 | 100.9 Ų | 100.9 | 8% | 0.082 | 49% | 0.489 | C | S | . | . | trans | -95.4 | 116.9 | -174.2 | -58.1 | -175.2 | 0 | 0 | 0 | 109.3 | M192 F221 H224 L225 L231 | M192-I195 PolarHBondContact O-N 2.72Å; M192-I195 VanDerWaalsContact O-N 3.12Å; M192-I195 HydrophobicContact SD-CD1 4.01Å; I195-F221 HydrophobicContact CG2-CD2 3.66Å; I195-F221 HydrophobicContact CG2-CE2 3.85Å; I195-H224 HydrophobicContact CD1-CB 4.44Å; I195-H224 HydrophobicContact CG1-CB 4.41Å; I195-H224 HydrophobicContact CG2-CB 4.19Å; I195-L225 HydrophobicContact CD1-CD2 3.82Å; I195-L231 HydrophobicContact CD1-CD1 3.39Å | ||
| 196 | S | 91.4 | Very high | 89.4 | Confident | 80 Ų | 80 | 100.6 Ų | 100.6 | 56% | 0.559 | 49% | 0.487 | S | S | * | . | trans | -80.5 | 148.3 | 177.6 | 60.1 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 197 | F | 95.3 | Very high | 89.2 | Confident | 33 Ų | 33 | 95.4 Ų | 95.4 | 15% | 0.145 | 47% | 0.473 | C | S | . | . | trans | -135.5 | 136.3 | 176.6 | -172.3 | -96.7 | 0 | 0 | 0 | 110.8 | Y174 F177 E178 H181 R199 F218 F221 | Y174-F197 HydrophobicContact CE2-CE1 4.28Å; Y174-F197 AromaticContact CZ-CE1 3.95Å; F177-F197 HydrophobicContact CB-CE2 3.81Å; F177-F197 HydrophobicContact CB-CZ 3.85Å; E178-F197 HydrophobicContact CB-CE1 4.15Å; E178-F197 HydrophobicContact CB-CZ 4.12Å; H181-F197 HydrophobicContact CB-CD2 3.75Å; H181-F197 HydrophobicContact CB-CE2 3.92Å; H181-F197 HydrophobicContact CB-CG 4.12Å; H181-F197 HydrophobicContact CB-CZ 4.41Å; H181-F197 AromaticContact CD2-CD2 3.97Å; H181-F197 AromaticContact CD2-CG 3.88Å; H181-F197 AromaticContact CE1-CG 3.97Å; H181-F197 AromaticContact CG-CD2 3.76Å; H181-F197 AromaticContact CG-CG 3.68Å; H181-F197 AromaticContact ND1-CD1 3.95Å; H181-F197 AromaticContact ND1-CG 3.77Å; H181-F197 WeakPolarHBondContact NE2-CB 3.21Å; F197-R199 PolarHBondContact O-N 2.98Å; F197-F218 HydrophobicContact CE2-CE1 4.24Å; F197-F218 HydrophobicContact CZ-CE1 4.15Å; F197-F221 HydrophobicContact CD2-CD1 4.16Å; F197-F221 AromaticContact CD2-CD2 3.98Å; F197-F221 HydrophobicContact CD2-CD2 3.98Å; F197-F221 HydrophobicContact CD2-CE1 4.14Å; F197-F221 AromaticContact CD2-CE2 3.99Å; F197-F221 HydrophobicContact CD2-CE2 3.99Å; F197-F221 HydrophobicContact CD2-CG 4.07Å; F197-F221 HydrophobicContact CD2-CZ 4.04Å; F197-F221 HydrophobicContact CE2-CD1 4.18Å; F197-F221 HydrophobicContact CE2-CE1 4.08Å; F197-F221 HydrophobicContact CE2-CZ 4.35Å | ||
| 198 | P | 92.8 | Very high | 89.2 | Confident | 22 Ų | 22 | 93.5 Ų | 93.5 | 14% | 0.143 | 48% | 0.475 | C | S | . | . | P | Polyproline II helix | trans | -64.7 | 124.6 | -178.4 | 25.3 | -33.9 | 0 | 0 | 0 | 111.7 | Y174 R214 A217 F218 | Y174-P198 HydrophobicContact CE2-CG 4.45Å; Y174-P198 PolarHBondContact OH-O 2.95Å; P198-R214 HydrophobicContact CB-CG 4.32Å; P198-A217 HydrophobicContact CB-CB 3.91Å; P198-A217 HydrophobicContact CG-CB 3.84Å; P198-F218 HydrophobicContact CG-CD1 4.01Å; P198-F218 HydrophobicContact CG-CE1 3.68Å; P198-F218 HydrophobicContact CG-CZ 4.47Å |
| 199 | R | 88.1 | Confident | 89.2 | Confident | 226 Ų | 226 | 96.4 Ų | 96.4 | 85% | 0.853 | 49% | 0.49 | S | S | * | . | P | Polyproline II helix | trans | -67 | 151 | -177.9 | -65 | -175.6 | -179.3 | 175.2 | 0.6 | 112.8 | F197 | F197-R199 PolarHBondContact O-N 2.98Š|
| 200 | K | 85.6 | Confident | 89.3 | Confident | 134 Ų | 134 | 87.1 Ų | 87.1 | 58% | 0.583 | 46% | 0.455 | S | S | * | . | P | Polyproline II helix | trans | -72.1 | 133.2 | 173.9 | -161.6 | 168.9 | -172.4 | 165 | 0 | 109.2 | Y174 E178 | Y174-K200 HydrophobicContact CE1-CB 4.28Å; Y174-K200 HydrophobicContact CE1-CD 4.38Å; Y174-K200 HydrophobicContact CE1-CG 4.16Å; Y174-K200 WeakPolarHBondContact OH-CA 3.35Å; Y174-K200 PolarHBondContact OH-N 3.34Å; Y174-K200 VanDerWaalsContact OH-N 3.11Å; E178-K200 IonicContact OE2-NZ 3.25Å |
| 201 | R | 83 | Confident | 89.5 | Confident | 108 Ų | 108 | 85.4 Ų | 85.4 | 41% | 0.408 | 43% | 0.432 | S | S | . | . | P | Polyproline II helix | trans | -102.9 | 140.1 | 175.8 | -59 | -173.7 | 77.4 | -179.1 | 8.5 | 108.7 | R203 N205 T210 | R201-R203 WeakPolarHBondContact CB-O 3.02Å; R201-N205 PolarHBondContact O-ND2 3.47Å; R201-N205 PolarHBondContact O-OD1 3.32Å; R201-T210 PolarHBondContact NH1-OG1 2.86Å |
| 202 | L | 77.5 | Confident | 89.6 | Confident | 170 Ų | 170 | 85.4 Ų | 85.4 | 89% | 0.89 | 44% | 0.436 | S | S | * | . | S | Bend | trans | -77.2 | -29.9 | 176.2 | -79.2 | 76.1 | 0 | 0 | 0 | 111.9 | ||
| 203 | R | 80.8 | Confident | 89.6 | Confident | 212 Ų | 212 | 93.3 Ų | 93.3 | 80% | 0.8 | 47% | 0.466 | S | S | * | . | S | Bend | trans | -130.9 | 165.3 | -180 | -60.5 | -177.8 | -176 | -126.9 | 2.6 | 110.9 | R201 N205 | R201-R203 WeakPolarHBondContact CB-O 3.02Å; R203-N205 VanDerWaalsContact C-N 3.28Å; R203-N205 PolarHBondContact O-N 3.25Å |
| 204 | R | 83.7 | Confident | 89.9 | Confident | 187 Ų | 187 | 89.8 Ų | 89.8 | 71% | 0.706 | 43% | 0.433 | S | S | * | . | trans | 59.2 | 28 | 176.1 | -60.5 | -175.8 | -178.3 | 176.9 | 2.7 | 115.4 | F206 T207 T210 | R204-F206 PolarHBondContact O-N 3.2Å; R204-F206 VanDerWaalsContact O-N 3.15Å; R204-T207 HydrophobicContact CB-CG2 3.81Å; R204-T207 HydrophobicContact CG-CG2 4.26Å; R204-T207 PolarHBondContact O-N 2.85Å; R204-T207 PolarHBondContact O-OG1 3.2Å; R204-T210 PolarHBondContact O-OG1 3.35Å | ||
| 205 | N | 85 | Confident | 90.3 | Very high | 38 Ų | 38 | 85.8 Ų | 85.8 | 20% | 0.203 | 40% | 0.4 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -63.3 | -19.2 | 178.8 | -75.2 | -71.3 | 0 | 0 | 0 | 114.8 | R201 R203 R214 | R201-N205 PolarHBondContact O-ND2 3.47Å; R201-N205 PolarHBondContact O-OD1 3.32Å; R203-N205 VanDerWaalsContact C-N 3.28Å; R203-N205 PolarHBondContact O-N 3.25Å; N205-R214 PolarHBondContact OD1-NH1 3.14Å; N205-R214 PolarHBondContact OD1-NH2 3.25Å |
| 206 | F | 89.9 | Confident | 90.4 | Very high | 76 Ų | 76 | 92.1 Ų | 92.1 | 33% | 0.333 | 42% | 0.422 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -108.5 | 8.5 | -174.4 | -56.6 | -78.3 | 0 | 0 | 0 | 113.4 | V142 K149 V151 R204 | V142-F206 HydrophobicContact CG1-CD1 3.79Å; V142-F206 HydrophobicContact CG1-CE1 4.18Å; V142-F206 HydrophobicContact CG2-CD1 4.29Å; K149-F206 HydrophobicContact CB-CE1 4.47Å; K149-F206 HydrophobicContact CB-CZ 4.01Å; K149-F206 HydrophobicContact CD-CD1 4.35Å; K149-F206 HydrophobicContact CD-CD2 4.23Å; K149-F206 HydrophobicContact CD-CE1 4Å; K149-F206 HydrophobicContact CD-CE2 3.87Å; K149-F206 HydrophobicContact CD-CG 4.46Å; K149-F206 HydrophobicContact CD-CZ 3.75Å; K149-F206 HydrophobicContact CG-CD1 4.38Å; K149-F206 HydrophobicContact CG-CE1 3.67Å; K149-F206 HydrophobicContact CG-CE2 4.24Å; K149-F206 HydrophobicContact CG-CZ 3.59Å; K149-F206 WeakPolarHBondContact O-CZ 3.33Å; V151-F206 HydrophobicContact CG2-CD1 3.7Å; V151-F206 HydrophobicContact CG2-CE1 3.91Å; R204-F206 PolarHBondContact O-N 3.2Å; R204-F206 VanDerWaalsContact O-N 3.15Å |
| 207 | T | 92 | Very high | 90.7 | Very high | 50 Ų | 50 | 89.3 Ų | 89.3 | 31% | 0.307 | 40% | 0.404 | S | S | . | . | S | Bend | trans | -71.7 | 142.6 | 173.3 | 64.3 | 0 | 0 | 0 | 0 | 109.5 | R204 E209 T210 I211 | R204-T207 HydrophobicContact CB-CG2 3.81Å; R204-T207 HydrophobicContact CG-CG2 4.26Å; R204-T207 PolarHBondContact O-N 2.85Å; R204-T207 PolarHBondContact O-OG1 3.2Å; T207-E209 PolarHBondContact O-N 3.44Å; T207-T210 PolarHBondContact O-N 2.89Å; T207-T210 WeakPolarHBondContact OG1-CB 3.21Å; T207-T210 PolarHBondContact OG1-N 2.96Å; T207-T210 PolarHBondContact OG1-OG1 3.17Å; T207-I211 WeakPolarHBondContact O-CG1 3.32Å; T207-I211 PolarHBondContact O-N 3.49Å |
| 208 | A | 92.9 | Very high | 90.8 | Very high | 64 Ų | 64 | 87.8 Ų | 87.8 | 53% | 0.529 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -53 | -41 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | T210 I211 A212 | A208-T210 PolarHBondContact O-N 3.29Å; A208-I211 PolarHBondContact O-N 3.1Å; A208-A212 WeakPolarHBondContact O-CB 3.43Å; A208-A212 PolarHBondContact O-N 3.47Å |
| 209 | E | 93.6 | Very high | 91 | Very high | 113 Ų | 113 | 88.1 Ų | 88.1 | 53% | 0.528 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -58.9 | -46.7 | 175.8 | -165.6 | -147.9 | 153 | 0 | 0 | 113 | T207 I211 A212 R213 | T207-E209 PolarHBondContact O-N 3.44Å; E209-I211 VanDerWaalsContact C-N 3.32Å; E209-I211 PolarHBondContact O-N 2.97Å; E209-A212 PolarHBondContact O-N 3.23Å; E209-R213 WeakPolarHBondContact O-CB 3.48Å; E209-R213 PolarHBondContact O-N 2.91Å; E209-R213 IonicContact OE1-CZ 2.74Å; E209-R213 IonicContact OE1-NH2 3.97Å; E209-R213 PolarHBondContact OE1-NH2 2.96Å |
| 210 | T | 93.7 | Very high | 91.3 | Very high | 5 Ų | 5 | 81.6 Ų | 81.6 | 3% | 0.031 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -66.3 | -39.3 | 178.7 | -59.2 | 0 | 0 | 0 | 0 | 110.9 | R201 R204 T207 A208 R214 | R201-T210 PolarHBondContact NH1-OG1 2.86Å; R204-T210 PolarHBondContact O-OG1 3.35Å; T207-T210 PolarHBondContact O-N 2.89Å; T207-T210 WeakPolarHBondContact OG1-CB 3.21Å; T207-T210 PolarHBondContact OG1-N 2.96Å; T207-T210 PolarHBondContact OG1-OG1 3.17Å; A208-T210 PolarHBondContact O-N 3.29Å; T210-R214 WeakPolarHBondContact O-CB 3.19Å; T210-R214 WeakPolarHBondContact O-CG 3.24Å; T210-R214 PolarHBondContact O-N 3.44Å |
| 211 | I | 94.7 | Very high | 91.8 | Very high | 19 Ų | 19 | 75.2 Ų | 75.2 | 10% | 0.097 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -63.7 | -51.1 | 178.5 | -67.5 | 172.5 | 0 | 0 | 0 | 109.5 | A140 V142 V151 Y153 T207 A208 E209 R213 R214 S215 | A140-I211 HydrophobicContact CB-CG2 3.36Å; V142-I211 HydrophobicContact CG2-CD1 4.03Å; V151-I211 HydrophobicContact CG1-CD1 4.35Å; V151-I211 HydrophobicContact CG1-CG1 4.36Å; V151-I211 HydrophobicContact CG1-CG2 4.33Å; V151-I211 HydrophobicContact CG2-CD1 4.04Å; V151-I211 HydrophobicContact CG2-CG1 4.17Å; Y153-I211 HydrophobicContact CE1-CG2 4.1Å; T207-I211 WeakPolarHBondContact O-CG1 3.32Å; T207-I211 PolarHBondContact O-N 3.49Å; A208-I211 PolarHBondContact O-N 3.1Å; E209-I211 VanDerWaalsContact C-N 3.32Å; E209-I211 PolarHBondContact O-N 2.97Å; I211-R213 PolarHBondContact O-N 3.49Å; I211-R214 PolarHBondContact O-N 2.84Å; I211-S215 PolarHBondContact O-N 3.34Å; I211-S215 PolarHBondContact O-OG 2.81Å |
| 212 | A | 94.6 | Very high | 92.4 | Very high | 47 Ų | 47 | 70.1 Ų | 70.1 | 39% | 0.388 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -59.8 | -45.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | A208 E209 R214 S215 R216 | A208-A212 WeakPolarHBondContact O-CB 3.43Å; A208-A212 PolarHBondContact O-N 3.47Å; E209-A212 PolarHBondContact O-N 3.23Å; A212-R214 VanDerWaalsContact C-N 3.31Å; A212-R214 PolarHBondContact O-N 2.93Å; A212-S215 WeakPolarHBondContact O-CB 3.49Å; A212-S215 PolarHBondContact O-N 2.9Å; A212-R216 PolarHBondContact O-N 3.16Å; A212-R216 VanDerWaalsContact O-N 3.1Å |
| 213 | R | 94.9 | Very high | 93.2 | Very high | 171 Ų | 171 | 63 Ų | 63 | 65% | 0.645 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -61.4 | -40.4 | 177.5 | -166.7 | -177.2 | -62.3 | -154.7 | 3.4 | 111.8 | E209 I211 A217 | E209-R213 WeakPolarHBondContact O-CB 3.48Å; E209-R213 PolarHBondContact O-N 2.91Å; E209-R213 IonicContact OE1-CZ 2.74Å; E209-R213 IonicContact OE1-NH2 3.97Å; E209-R213 PolarHBondContact OE1-NH2 2.96Å; I211-R213 PolarHBondContact O-N 3.49Å; R213-A217 WeakPolarHBondContact O-CB 3.31Å; R213-A217 PolarHBondContact O-N 3.23Å; R213-A217 VanDerWaalsContact O-N 3.1Å |
| 214 | R | 96 | Very high | 93.8 | Very high | 16 Ų | 16 | 57 Ų | 57 | 6% | 0.06 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -68.2 | -42.3 | 175.5 | -79 | 178.8 | 171.9 | 162.2 | 3.7 | 112.2 | Y153 P198 N205 T210 I211 A212 R216 A217 F218 | Y153-R214 HydrophobicContact CE1-CB 4.44Å; P198-R214 HydrophobicContact CB-CG 4.32Å; N205-R214 PolarHBondContact OD1-NH1 3.14Å; N205-R214 PolarHBondContact OD1-NH2 3.25Å; T210-R214 WeakPolarHBondContact O-CB 3.19Å; T210-R214 WeakPolarHBondContact O-CG 3.24Å; T210-R214 PolarHBondContact O-N 3.44Å; I211-R214 PolarHBondContact O-N 2.84Å; A212-R214 VanDerWaalsContact C-N 3.31Å; A212-R214 PolarHBondContact O-N 2.93Å; R214-R216 VanDerWaalsContact C-N 3.34Å; R214-R216 PolarHBondContact O-N 3.4Å; R214-A217 PolarHBondContact O-N 3.39Å; R214-F218 HydrophobicContact CB-CD2 4.5Å; R214-F218 HydrophobicContact CB-CE2 4.04Å; R214-F218 HydrophobicContact CB-CZ 4.4Å; R214-F218 WeakPolarHBondContact O-CD2 3.49Å; R214-F218 VanDerWaalsContact O-CG 3.23Å; R214-F218 WeakPolarHBondContact O-CG 3.36Å; R214-F218 PolarHBondContact O-N 3.24Å |
| 215 | S | 97.1 | Very high | 94.3 | Very high | 15 Ų | 15 | 48.1 Ų | 48.1 | 11% | 0.105 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -53.4 | -52.9 | 176.5 | -62.3 | 0 | 0 | 0 | 0 | 110.6 | I211 A212 A217 F218 E219 | I211-S215 PolarHBondContact O-N 3.34Å; I211-S215 PolarHBondContact O-OG 2.81Å; A212-S215 WeakPolarHBondContact O-CB 3.49Å; A212-S215 PolarHBondContact O-N 2.9Å; S215-A217 PolarHBondContact O-N 3.46Å; S215-F218 PolarHBondContact O-N 3.48Å; S215-E219 WeakPolarHBondContact O-CG 3.41Å; S215-E219 PolarHBondContact O-N 2.99Å |
| 216 | R | 96.4 | Very high | 94.6 | Very high | 148 Ų | 148 | 46.6 Ų | 46.6 | 56% | 0.558 | 24% | 0.237 | S | C | * | . | H | α-helix | trans | -62.4 | -41.1 | 178.1 | -174.1 | 54 | 169.1 | -177.8 | -3.2 | 113 | A212 R214 F218 E219 Q220 | A212-R216 PolarHBondContact O-N 3.16Å; A212-R216 VanDerWaalsContact O-N 3.1Å; R214-R216 VanDerWaalsContact C-N 3.34Å; R214-R216 PolarHBondContact O-N 3.4Å; R216-F218 VanDerWaalsContact C-N 3.29Å; R216-F218 PolarHBondContact O-N 2.67Å; R216-E219 VanDerWaalsContact CD-OE2 3.25Å; R216-E219 WeakPolarHBondContact CD-OE2 3.39Å; R216-E219 IonicContact CZ-OE2 3.78Å; R216-E219 IonicContact NE-OE2 2.75Å; R216-E219 IonicContact NH1-OE2 2.81Å; R216-E219 PolarHBondContact NH1-OE2 3.39Å; R216-E219 PolarHBondContact O-N 3.3Å; R216-Q220 WeakPolarHBondContact O-CG 3.45Å; R216-Q220 PolarHBondContact O-N 2.98Å; R216-Q220 VanDerWaalsContact O-N 3.13Å |
| 217 | A | 97 | Very high | 94.5 | Very high | 22 Ų | 22 | 44.4 Ų | 44.4 | 18% | 0.182 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -64.5 | -33.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | P198 R213 R214 S215 F221 | P198-A217 HydrophobicContact CB-CB 3.91Å; P198-A217 HydrophobicContact CG-CB 3.84Å; R213-A217 WeakPolarHBondContact O-CB 3.31Å; R213-A217 PolarHBondContact O-N 3.23Å; R213-A217 VanDerWaalsContact O-N 3.1Å; R214-A217 PolarHBondContact O-N 3.39Å; S215-A217 PolarHBondContact O-N 3.46Å; A217-F221 WeakPolarHBondContact O-CB 3.49Å; A217-F221 PolarHBondContact O-N 3.09Å |
| 218 | F | 97.8 | Very high | 94.5 | Very high | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -69.9 | -41.9 | 176.2 | -66.9 | -37.1 | 0 | 0 | 0 | 112.9 | Y153 Y174 F177 F197 P198 R214 S215 R216 Q220 F221 L222 | Y153-F218 HydrophobicContact CD1-CD2 4.27Å; Y153-F218 HydrophobicContact CD1-CE2 4.23Å; Y153-F218 HydrophobicContact CD2-CD2 4.43Å; Y153-F218 AromaticContact CD2-CE2 3.84Å; Y153-F218 HydrophobicContact CD2-CE2 3.84Å; Y153-F218 HydrophobicContact CE1-CD2 4.37Å; Y153-F218 HydrophobicContact CE1-CE2 4.04Å; Y153-F218 AromaticContact CE2-CE2 3.65Å; Y153-F218 HydrophobicContact CE2-CE2 3.65Å; Y153-F218 HydrophobicContact CE2-CZ 4.46Å; Y153-F218 HydrophobicContact CG-CD2 4.3Å; Y153-F218 HydrophobicContact CG-CE2 4.13Å; Y153-F218 AromaticContact CZ-CE2 3.75Å; Y174-F218 HydrophobicContact CD2-CE1 4.25Å; Y174-F218 AromaticContact CD2-CZ 3.62Å; Y174-F218 HydrophobicContact CD2-CZ 3.62Å; Y174-F218 HydrophobicContact CE2-CZ 4.3Å; Y174-F218 HydrophobicContact CG-CZ 4.35Å; F177-F218 HydrophobicContact CB-CD1 4.08Å; F177-F218 HydrophobicContact CB-CE1 3.69Å; F177-F218 HydrophobicContact CB-CZ 4.3Å; F177-F218 HydrophobicContact CD1-CB 4.29Å; F177-F218 AromaticContact CD1-CD1 3.7Å; F177-F218 HydrophobicContact CD1-CD1 3.7Å; F177-F218 HydrophobicContact CD1-CE1 4.16Å; F177-F218 HydrophobicContact CD1-CG 4.04Å; F177-F218 HydrophobicContact CD2-CD1 4.08Å; F177-F218 HydrophobicContact CD2-CD2 4.23Å; F177-F218 AromaticContact CD2-CE1 3.89Å; F177-F218 HydrophobicContact CD2-CE1 3.89Å; F177-F218 HydrophobicContact CD2-CE2 4.04Å; F177-F218 HydrophobicContact CD2-CG 4.25Å; F177-F218 AromaticContact CD2-CZ 3.84Å; F177-F218 HydrophobicContact CD2-CZ 3.84Å; F177-F218 HydrophobicContact CE1-CB 3.72Å; F177-F218 AromaticContact CE1-CD1 3.98Å; F177-F218 HydrophobicContact CE1-CD1 3.98Å; F177-F218 HydrophobicContact CE1-CD2 4.43Å; F177-F218 AromaticContact CE1-CG 3.82Å; F177-F218 HydrophobicContact CE1-CG 3.82Å; F177-F218 HydrophobicContact CE2-CD1 4.37Å; F177-F218 AromaticContact CE2-CD2 3.89Å; F177-F218 HydrophobicContact CE2-CD2 3.89Å; F177-F218 HydrophobicContact CE2-CE1 4.48Å; F177-F218 HydrophobicContact CE2-CE2 4.01Å; F177-F218 HydrophobicContact CE2-CG 4.07Å; F177-F218 HydrophobicContact CE2-CZ 4.29Å; F177-F218 AromaticContact CG-CD1 3.72Å; F177-F218 HydrophobicContact CG-CD1 3.72Å; F177-F218 AromaticContact CG-CE1 3.69Å; F177-F218 HydrophobicContact CG-CE1 3.69Å; F177-F218 HydrophobicContact CG-CG 4.22Å; F177-F218 HydrophobicContact CG-CZ 4.13Å; F177-F218 HydrophobicContact CZ-CB 3.89Å; F177-F218 HydrophobicContact CZ-CD1 4.29Å; F177-F218 AromaticContact CZ-CD2 3.97Å; F177-F218 HydrophobicContact CZ-CD2 3.97Å; F177-F218 AromaticContact CZ-CG 3.82Å; F177-F218 HydrophobicContact CZ-CG 3.82Å; F197-F218 HydrophobicContact CE2-CE1 4.24Å; F197-F218 HydrophobicContact CZ-CE1 4.15Å; P198-F218 HydrophobicContact CG-CD1 4.01Å; P198-F218 HydrophobicContact CG-CE1 3.68Å; P198-F218 HydrophobicContact CG-CZ 4.47Å; R214-F218 HydrophobicContact CB-CD2 4.5Å; R214-F218 HydrophobicContact CB-CE2 4.04Å; R214-F218 HydrophobicContact CB-CZ 4.4Å; R214-F218 WeakPolarHBondContact O-CD2 3.49Å; R214-F218 VanDerWaalsContact O-CG 3.23Å; R214-F218 WeakPolarHBondContact O-CG 3.36Å; R214-F218 PolarHBondContact O-N 3.24Å; S215-F218 PolarHBondContact O-N 3.48Å; R216-F218 VanDerWaalsContact C-N 3.29Å; R216-F218 PolarHBondContact O-N 2.67Å; F218-Q220 VanDerWaalsContact C-N 3.33Å; F218-Q220 PolarHBondContact O-N 3.17Å; F218-F221 PolarHBondContact O-N 3.45Å; F218-L222 WeakPolarHBondContact O-CG 3.48Å; F218-L222 PolarHBondContact O-N 3.44Å |
| 219 | E | 96.1 | Very high | 94.2 | Very high | 29 Ų | 29 | 44.4 Ų | 44.4 | 14% | 0.136 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -56.8 | -49.8 | 173.5 | -63.3 | 169.7 | 177.8 | 0 | 0 | 110.8 | F135 V137 S215 R216 L222 G223 | F135-E219 WeakPolarHBondContact O-CG 3.34Å; V137-E219 HydrophobicContact CG2-CG 3.97Å; V137-E219 PolarHBondContact N-OE1 2.87Å; S215-E219 WeakPolarHBondContact O-CG 3.41Å; S215-E219 PolarHBondContact O-N 2.99Å; R216-E219 VanDerWaalsContact CD-OE2 3.25Å; R216-E219 WeakPolarHBondContact CD-OE2 3.39Å; R216-E219 IonicContact CZ-OE2 3.78Å; R216-E219 IonicContact NE-OE2 2.75Å; R216-E219 IonicContact NH1-OE2 2.81Å; R216-E219 PolarHBondContact NH1-OE2 3.39Å; R216-E219 PolarHBondContact O-N 3.3Å; E219-L222 PolarHBondContact O-N 3Å; E219-G223 PolarHBondContact O-N 3.43Å |
| 220 | Q | 95.5 | Very high | 93.9 | Very high | 89 Ų | 89 | 44.2 Ų | 44.2 | 42% | 0.416 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -62.7 | -44.1 | 178.1 | -70.3 | 175 | -16.3 | 0 | 0 | 111.7 | R216 F218 G223 H224 | R216-Q220 WeakPolarHBondContact O-CG 3.45Å; R216-Q220 PolarHBondContact O-N 2.98Å; R216-Q220 VanDerWaalsContact O-N 3.13Å; F218-Q220 VanDerWaalsContact C-N 3.33Å; F218-Q220 PolarHBondContact O-N 3.17Å; Q220-G223 PolarHBondContact O-N 2.89Å; Q220-H224 WeakPolarHBondContact O-CB 3.27Å; Q220-H224 PolarHBondContact O-N 3.43Å; Q220-H224 PolarHBondContact O-ND1 2.85Å |
| 221 | F | 96.6 | Very high | 93.8 | Very high | 1 Ų | 1 | 44 Ų | 44 | 0% | 0.004 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -57.1 | -53.3 | 177.8 | 172.3 | -115.4 | 0 | 0 | 0 | 111.4 | F177 L180 H181 M192 I195 F197 A217 F218 G223 H224 L225 | F177-F221 HydrophobicContact CD1-CD1 4.28Å; L180-F221 HydrophobicContact CD2-CE1 4.01Å; L180-F221 HydrophobicContact CG-CE1 4.49Å; H181-F221 HydrophobicContact CB-CE2 4.3Å; H181-F221 HydrophobicContact CB-CZ 3.76Å; H181-F221 AromaticContact CD2-CE2 3.73Å; M192-F221 HydrophobicContact CE-CE2 4.3Å; I195-F221 HydrophobicContact CG2-CD2 3.66Å; I195-F221 HydrophobicContact CG2-CE2 3.85Å; F197-F221 HydrophobicContact CD2-CD1 4.16Å; F197-F221 AromaticContact CD2-CD2 3.98Å; F197-F221 HydrophobicContact CD2-CD2 3.98Å; F197-F221 HydrophobicContact CD2-CE1 4.14Å; F197-F221 AromaticContact CD2-CE2 3.99Å; F197-F221 HydrophobicContact CD2-CE2 3.99Å; F197-F221 HydrophobicContact CD2-CG 4.07Å; F197-F221 HydrophobicContact CD2-CZ 4.04Å; F197-F221 HydrophobicContact CE2-CD1 4.18Å; F197-F221 HydrophobicContact CE2-CE1 4.08Å; F197-F221 HydrophobicContact CE2-CZ 4.35Å; A217-F221 WeakPolarHBondContact O-CB 3.49Å; A217-F221 PolarHBondContact O-N 3.09Å; F218-F221 PolarHBondContact O-N 3.45Å; F221-G223 VanDerWaalsContact C-N 3.33Å; F221-G223 PolarHBondContact O-N 3Å; F221-H224 PolarHBondContact O-N 3.46Å; F221-L225 HydrophobicContact CD1-CD1 4.32Å; F221-L225 HydrophobicContact CD2-CG 4.46Å; F221-L225 HydrophobicContact CE1-CD1 3.74Å; F221-L225 HydrophobicContact CE2-CD1 4.03Å; F221-L225 HydrophobicContact CE2-CD2 4.09Å; F221-L225 HydrophobicContact CE2-CG 4.08Å; F221-L225 HydrophobicContact CZ-CD1 3.57Å; F221-L225 HydrophobicContact CZ-CD2 4.32Å; F221-L225 HydrophobicContact CZ-CG 4.16Å; F221-L225 WeakPolarHBondContact O-CG 3.33Å; F221-L225 PolarHBondContact O-N 3.47Å |
| 222 | L | 95.5 | Very high | 93.5 | Very high | 1 Ų | 1 | 46.8 Ų | 46.8 | 1% | 0.005 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -64.3 | -38.8 | 178.6 | -64.8 | 179.8 | 0 | 0 | 0 | 112 | F135 L155 F177 L180 F218 E219 H224 L225 Q226 L237 F240 F241 | F135-L222 HydrophobicContact CB-CB 4.31Å; F135-L222 HydrophobicContact CB-CD1 4.33Å; F135-L222 HydrophobicContact CD1-CB 4.12Å; F135-L222 HydrophobicContact CD1-CD1 3.83Å; F135-L222 HydrophobicContact CD2-CB 3.46Å; F135-L222 VanDerWaalsContact CD2-CB 3.46Å; F135-L222 HydrophobicContact CE1-CB 4.32Å; F135-L222 HydrophobicContact CE1-CD1 4.3Å; F135-L222 HydrophobicContact CE2-CB 3.69Å; F135-L222 HydrophobicContact CG-CB 3.68Å; F135-L222 HydrophobicContact CG-CD1 4Å; F135-L222 HydrophobicContact CZ-CB 4.12Å; L155-L222 HydrophobicContact CD1-CD1 3.96Å; L155-L222 HydrophobicContact CD2-CD1 4.24Å; F177-L222 HydrophobicContact CE1-CD1 3.95Å; F177-L222 HydrophobicContact CE1-CD2 4.37Å; F177-L222 HydrophobicContact CE1-CG 4.17Å; L180-L222 HydrophobicContact CD2-CD2 4.25Å; F218-L222 WeakPolarHBondContact O-CG 3.48Å; F218-L222 PolarHBondContact O-N 3.44Å; E219-L222 PolarHBondContact O-N 3Å; L222-H224 VanDerWaalsContact C-N 3.33Å; L222-H224 PolarHBondContact O-N 2.92Å; L222-L225 HydrophobicContact CD2-CD1 4.3Å; L222-L225 PolarHBondContact O-N 2.85Å; L222-Q226 PolarHBondContact O-N 3.49Å; L222-L237 HydrophobicContact CD2-CD1 4.45Å; L222-F240 HydrophobicContact CD1-CE1 4.25Å; L222-F240 HydrophobicContact CD2-CD1 4.39Å; L222-F240 HydrophobicContact CD2-CE1 3.97Å; L222-F241 HydrophobicContact CD1-CE1 4.1Å; L222-F241 HydrophobicContact CD1-CZ 4.06Å; L222-F241 HydrophobicContact CD2-CZ 3.97Å; L222-F241 HydrophobicContact CG-CZ 4.48Å |
| 223 | G | 93.3 | Very high | 93 | Very high | 21 Ų | 21 | 49.2 Ų | 49.2 | 22% | 0.216 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -60.1 | -40.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | R132 E219 Q220 F221 A227 | R132-G223 PolarHBondContact NH2-O 2.87Å; E219-G223 PolarHBondContact O-N 3.43Å; Q220-G223 PolarHBondContact O-N 2.89Å; F221-G223 VanDerWaalsContact C-N 3.33Å; F221-G223 PolarHBondContact O-N 3Å; G223-A227 WeakPolarHBondContact O-CB 3.35Å; G223-A227 PolarHBondContact O-N 3.36Å |
| 224 | H | 93.8 | Very high | 92.8 | Very high | 86 Ų | 86 | 41.1 Ų | 41.1 | 40% | 0.398 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -72.1 | -26.9 | 175.1 | -67.2 | 149.6 | 0 | 0 | 0 | 113.7 | I195 Q220 F221 L222 A227 V228 | I195-H224 HydrophobicContact CD1-CB 4.44Å; I195-H224 HydrophobicContact CG1-CB 4.41Å; I195-H224 HydrophobicContact CG2-CB 4.19Å; Q220-H224 WeakPolarHBondContact O-CB 3.27Å; Q220-H224 PolarHBondContact O-N 3.43Å; Q220-H224 PolarHBondContact O-ND1 2.85Å; F221-H224 PolarHBondContact O-N 3.46Å; L222-H224 VanDerWaalsContact C-N 3.33Å; L222-H224 PolarHBondContact O-N 2.92Å; H224-A227 WeakPolarHBondContact O-CA 3.44Å; H224-A227 WeakPolarHBondContact O-CB 3.39Å; H224-V228 WeakPolarHBondContact O-CG2 3.47Å |
| 225 | L | 93.9 | Very high | 92.6 | Very high | 0 Ų | 0 | 43.3 Ų | 43.3 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -71.2 | -47.1 | 171.5 | -67 | -178.8 | 0 | 0 | 0 | 111 | L180 L184 M192 I195 F221 L222 A227 V228 L231 L237 | L180-L225 HydrophobicContact CD2-CD1 4.03Å; L184-L225 HydrophobicContact CD1-CD1 3.71Å; L184-L225 HydrophobicContact CD1-CD2 3.68Å; L184-L225 HydrophobicContact CD1-CG 4.35Å; M192-L225 HydrophobicContact CE-CD2 4.34Å; M192-L225 HydrophobicContact SD-CD2 3.7Å; I195-L225 HydrophobicContact CD1-CD2 3.82Å; F221-L225 HydrophobicContact CD1-CD1 4.32Å; F221-L225 HydrophobicContact CD2-CG 4.46Å; F221-L225 HydrophobicContact CE1-CD1 3.74Å; F221-L225 HydrophobicContact CE2-CD1 4.03Å; F221-L225 HydrophobicContact CE2-CD2 4.09Å; F221-L225 HydrophobicContact CE2-CG 4.08Å; F221-L225 HydrophobicContact CZ-CD1 3.57Å; F221-L225 HydrophobicContact CZ-CD2 4.32Å; F221-L225 HydrophobicContact CZ-CG 4.16Å; F221-L225 WeakPolarHBondContact O-CG 3.33Å; F221-L225 PolarHBondContact O-N 3.47Å; L222-L225 HydrophobicContact CD2-CD1 4.3Å; L222-L225 PolarHBondContact O-N 2.85Å; L225-A227 VanDerWaalsContact C-N 3.3Å; L225-A227 PolarHBondContact O-N 3.1Å; L225-V228 PolarHBondContact O-N 3.3Å; L225-V228 VanDerWaalsContact O-N 3.1Å; L225-L231 HydrophobicContact CD2-CB 4.49Å; L225-L231 HydrophobicContact CD2-CD1 3.79Å; L225-L237 HydrophobicContact CB-CD1 4.44Å; L225-L237 HydrophobicContact CB-CD2 3.92Å; L225-L237 HydrophobicContact CD1-CD1 3.66Å; L225-L237 HydrophobicContact CD1-CD2 4.45Å |
| 226 | Q | 90.8 | Very high | 92.4 | Very high | 6 Ų | 6 | 44.3 Ų | 44.3 | 3% | 0.028 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -67.3 | -30.9 | 176.3 | -69.1 | -63.7 | -21.4 | 0 | 0 | 112.7 | R132 L133 F135 L222 V228 | R132-Q226 PolarHBondContact NE-O 2.84Å; L133-Q226 HydrophobicContact CB-CG 4.39Å; L133-Q226 HydrophobicContact CD1-CG 4.27Å; F135-Q226 HydrophobicContact CE2-CB 4.29Å; F135-Q226 HydrophobicContact CE2-CG 3.57Å; F135-Q226 HydrophobicContact CZ-CG 3.59Å; L222-Q226 PolarHBondContact O-N 3.49Å; Q226-V228 VanDerWaalsContact C-N 3.28Å; Q226-V228 PolarHBondContact O-N 3.41Å |
| 227 | A | 89.6 | Confident | 92.2 | Very high | 30 Ų | 30 | 37.2 Ų | 37.2 | 25% | 0.248 | 20% | 0.201 | C | C | . | . | T | Hydrogen-bonded Turn | 24.8 | -86.5 | 124.2 | 0 | 0 | 0 | 0 | 0 | 119.5 | R132 G223 H224 L225 | R132-A227 PolarHBondContact NH1-O 3.27Å; G223-A227 WeakPolarHBondContact O-CB 3.35Å; G223-A227 PolarHBondContact O-N 3.36Å; H224-A227 WeakPolarHBondContact O-CA 3.44Å; H224-A227 WeakPolarHBondContact O-CB 3.39Å; L225-A227 VanDerWaalsContact C-N 3.3Å; L225-A227 PolarHBondContact O-N 3.1Å | |
| 228 | V | 90.3 | Very high | 91.9 | Very high | 32 Ų | 32 | 36.8 Ų | 36.8 | 19% | 0.194 | 20% | 0.195 | C | C | . | . | S | Bend | trans | -125.6 | 115.7 | -139 | 171.1 | 0 | 0 | 0 | 0 | 104.6 | P191 H224 L225 Q226 E230 L231 R232 | P191-V228 HydrophobicContact CB-CG1 3.96Å; H224-V228 WeakPolarHBondContact O-CG2 3.47Å; L225-V228 PolarHBondContact O-N 3.3Å; L225-V228 VanDerWaalsContact O-N 3.1Å; Q226-V228 VanDerWaalsContact C-N 3.28Å; Q226-V228 PolarHBondContact O-N 3.41Å; V228-E230 HydrophobicContact CG1-CB 4.5Å; V228-E230 WeakPolarHBondContact CG1-OE2 3.18Å; V228-E230 PolarHBondContact O-N 3.24Å; V228-E230 VanDerWaalsContact O-N 3.07Å; V228-L231 HydrophobicContact CB-CB 4.13Å; V228-L231 HydrophobicContact CB-CD1 3.95Å; V228-L231 HydrophobicContact CB-CG 4.12Å; V228-L231 HydrophobicContact CG1-CB 4.22Å; V228-L231 HydrophobicContact CG1-CD1 3.9Å; V228-L231 HydrophobicContact CG1-CG 3.82Å; V228-L231 HydrophobicContact CG2-CD1 4.31Å; V228-L231 PolarHBondContact O-N 3.42Å; V228-R232 PolarHBondContact O-N 3.27Å |
| 229 | P | 87.2 | Confident | 91.7 | Very high | 82 Ų | 82 | 38.2 Ų | 38.2 | 53% | 0.532 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -53 | -30.9 | -173.2 | -30 | 36.6 | 0 | 0 | 0 | 115.2 | R232 H233 | P229-R232 VanDerWaalsContact O-CG 3.31Å; P229-R232 WeakPolarHBondContact O-CG 3.42Å; P229-H233 PolarHBondContact O-ND1 3.24Å |
| 230 | E | 88.3 | Confident | 91.7 | Very high | 108 Ų | 108 | 37.5 Ų | 37.5 | 51% | 0.505 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -74.3 | -39.2 | 178.2 | -58.1 | 82.3 | 177.5 | 0 | 0 | 111.9 | F188 P191 V228 | F188-E230 HydrophobicContact CD1-CB 4.47Å; P191-E230 HydrophobicContact CG-CB 4.46Å; V228-E230 HydrophobicContact CG1-CB 4.5Å; V228-E230 WeakPolarHBondContact CG1-OE2 3.18Å; V228-E230 PolarHBondContact O-N 3.24Å; V228-E230 VanDerWaalsContact O-N 3.07Å |
| 231 | L | 90.6 | Very high | 91.6 | Very high | 0 Ų | 0 | 33.3 Ų | 33.3 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -82.1 | -35 | -176.4 | -63.5 | 177 | 0 | 0 | 0 | 112.5 | F188 P191 M192 I195 L225 V228 H233 A234 L237 | F188-L231 HydrophobicContact CB-CD2 3.46Å; F188-L231 VanDerWaalsContact CB-CD2 3.46Å; F188-L231 HydrophobicContact CD1-CD2 4.17Å; F188-L231 HydrophobicContact CD2-CD2 3.72Å; F188-L231 HydrophobicContact CG-CD2 3.53Å; P191-L231 HydrophobicContact CB-CD1 4.05Å; P191-L231 HydrophobicContact CB-CD2 4.29Å; P191-L231 HydrophobicContact CB-CG 4.05Å; M192-L231 HydrophobicContact CG-CD1 4.36Å; M192-L231 HydrophobicContact CG-CD2 4.11Å; M192-L231 HydrophobicContact SD-CD1 3.67Å; M192-L231 HydrophobicContact SD-CD2 4Å; I195-L231 HydrophobicContact CD1-CD1 3.39Å; L225-L231 HydrophobicContact CD2-CB 4.49Å; L225-L231 HydrophobicContact CD2-CD1 3.79Å; V228-L231 HydrophobicContact CB-CB 4.13Å; V228-L231 HydrophobicContact CB-CD1 3.95Å; V228-L231 HydrophobicContact CB-CG 4.12Å; V228-L231 HydrophobicContact CG1-CB 4.22Å; V228-L231 HydrophobicContact CG1-CD1 3.9Å; V228-L231 HydrophobicContact CG1-CG 3.82Å; V228-L231 HydrophobicContact CG2-CD1 4.31Å; V228-L231 PolarHBondContact O-N 3.42Å; L231-H233 PolarHBondContact O-N 2.9Å; L231-H233 VanDerWaalsContact O-N 3.15Å; L231-A234 WeakPolarHBondContact O-CB 3.45Å; L231-A234 PolarHBondContact O-N 2.93Å; L231-L237 WeakPolarHBondContact O-CD2 3.47Å |
| 232 | R | 87.9 | Confident | 91.4 | Very high | 79 Ų | 79 | 33.5 Ų | 33.5 | 30% | 0.298 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -59.7 | -26.7 | -179 | 71.3 | -179.6 | -65.6 | -177.6 | 4.5 | 113.5 | V228 P229 | V228-R232 PolarHBondContact O-N 3.27Å; P229-R232 VanDerWaalsContact O-CG 3.31Å; P229-R232 WeakPolarHBondContact O-CG 3.42Å |
| 233 | H | 85.7 | Confident | 91.4 | Very high | 97 Ų | 97 | 34 Ų | 34 | 45% | 0.449 | 18% | 0.183 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -100.7 | 3.9 | 179 | -55.5 | 110.6 | 0 | 0 | 0 | 112.5 | P229 L231 T277 | P229-H233 PolarHBondContact O-ND1 3.24Å; L231-H233 PolarHBondContact O-N 2.9Å; L231-H233 VanDerWaalsContact O-N 3.15Å; H233-T277 PolarHBondContact CD2-OG1 3.33Å |
| 234 | A | 90.4 | Very high | 91.4 | Very high | 1 Ų | 1 | 35.4 Ų | 35.4 | 1% | 0.008 | 19% | 0.188 | C | C | . | . | trans | -65.2 | 131.5 | 179.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | L184 F188 L231 D236 L237 Q238 | L184-A234 HydrophobicContact CD2-CB 3.59Å; F188-A234 HydrophobicContact CE2-CB 3.63Å; F188-A234 HydrophobicContact CZ-CB 3.94Å; L231-A234 WeakPolarHBondContact O-CB 3.45Å; L231-A234 PolarHBondContact O-N 2.93Å; A234-D236 VanDerWaalsContact C-N 3.29Å; A234-D236 PolarHBondContact O-N 3.27Å; A234-L237 HydrophobicContact CB-CB 4.36Å; A234-L237 WeakPolarHBondContact O-CB 3.35Å; A234-L237 PolarHBondContact O-N 3.47Å; A234-Q238 PolarHBondContact O-N 3.31Å | ||
| 235 | P | 90.4 | Very high | 91.5 | Very high | 62 Ų | 62 | 31.9 Ų | 31.9 | 40% | 0.403 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -60.2 | -40.3 | -178.8 | 23.6 | -33 | 0 | 0 | 0 | 111.4 | L237 Q238 D239 | P235-L237 PolarHBondContact O-N 3.48Å; P235-Q238 PolarHBondContact O-N 3.21Å; P235-Q238 VanDerWaalsContact O-N 3.1Å; P235-D239 WeakPolarHBondContact O-CB 3.24Å; P235-D239 PolarHBondContact O-N 3.4Å |
| 236 | D | 92.8 | Very high | 91.6 | Very high | 36 Ų | 36 | 31.9 Ų | 31.9 | 19% | 0.193 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -55.5 | -35.8 | 175.5 | -80.1 | -70.3 | 0 | 0 | 0 | 113.1 | L180 N183 L184 Q187 A234 F240 | L180-D236 HydrophobicContact CD1-CB 4.13Å; L180-D236 WeakPolarHBondContact CD1-O 3.24Å; N183-D236 HydrophobicContact CB-CB 4.32Å; N183-D236 PolarHBondContact ND2-OD1 3.04Å; L184-D236 HydrophobicContact CD2-CB 4.06Å; Q187-D236 VanDerWaalsContact CD-OD2 3.31Å; Q187-D236 PolarHBondContact NE2-OD2 3.22Å; Q187-D236 PolarHBondContact OE1-OD2 3.38Å; A234-D236 VanDerWaalsContact C-N 3.29Å; A234-D236 PolarHBondContact O-N 3.27Å; D236-F240 WeakPolarHBondContact O-CB 3.46Å; D236-F240 PolarHBondContact O-N 2.95Å |
| 237 | L | 93.4 | Very high | 91.8 | Very high | 0 Ų | 0 | 36.5 Ų | 36.5 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -72.9 | -43.7 | 177.4 | -177.6 | 58.5 | 0 | 0 | 0 | 111.4 | L180 L222 L225 L231 A234 P235 D239 F240 F241 | L180-L237 HydrophobicContact CD1-CB 4.44Å; L180-L237 HydrophobicContact CD1-CD1 4.38Å; L180-L237 HydrophobicContact CD2-CD1 3.85Å; L222-L237 HydrophobicContact CD2-CD1 4.45Å; L225-L237 HydrophobicContact CB-CD1 4.44Å; L225-L237 HydrophobicContact CB-CD2 3.92Å; L225-L237 HydrophobicContact CD1-CD1 3.66Å; L225-L237 HydrophobicContact CD1-CD2 4.45Å; L231-L237 WeakPolarHBondContact O-CD2 3.47Å; A234-L237 HydrophobicContact CB-CB 4.36Å; A234-L237 WeakPolarHBondContact O-CB 3.35Å; A234-L237 PolarHBondContact O-N 3.47Å; P235-L237 PolarHBondContact O-N 3.48Å; L237-D239 VanDerWaalsContact C-N 3.31Å; L237-D239 PolarHBondContact O-N 3.43Å; L237-F240 WeakPolarHBondContact O-CB 3.4Å; L237-F240 PolarHBondContact O-N 3.35Å; L237-F241 HydrophobicContact CD1-CD2 4.39Å; L237-F241 HydrophobicContact CD1-CE2 3.59Å; L237-F241 HydrophobicContact CD1-CZ 4.35Å; L237-F241 HydrophobicContact CG-CE2 4.01Å; L237-F241 WeakPolarHBondContact O-CD2 3.49Å |
| 238 | Q | 91.3 | Very high | 92.1 | Very high | 13 Ų | 13 | 41.9 Ų | 41.9 | 6% | 0.061 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -61.9 | -42.8 | 176 | -59 | -65.5 | 59 | 0 | 0 | 111.1 | A234 P235 F240 F241 V242 G276 T277 | A234-Q238 PolarHBondContact O-N 3.31Å; P235-Q238 PolarHBondContact O-N 3.21Å; P235-Q238 VanDerWaalsContact O-N 3.1Å; Q238-F240 VanDerWaalsContact C-N 3.31Å; Q238-F240 PolarHBondContact O-N 3.01Å; Q238-F241 PolarHBondContact O-N 3.38Å; Q238-F241 VanDerWaalsContact O-N 3.12Å; Q238-V242 PolarHBondContact O-N 2.9Å; Q238-G276 PolarHBondContact NE2-O 2.88Å; Q238-T277 PolarHBondContact NE2-O 3.07Å; Q238-T277 VanDerWaalsContact NE2-O 3.12Å |
| 239 | D | 92.4 | Very high | 92.4 | Very high | 30 Ų | 30 | 40.4 Ų | 40.4 | 16% | 0.16 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -66.8 | -35.9 | -179.5 | -70.6 | 22.2 | 0 | 0 | 0 | 111.3 | P235 L237 F241 V242 L243 P244 R283 | P235-D239 WeakPolarHBondContact O-CB 3.24Å; P235-D239 PolarHBondContact O-N 3.4Å; L237-D239 VanDerWaalsContact C-N 3.31Å; L237-D239 PolarHBondContact O-N 3.43Å; D239-F241 PolarHBondContact O-N 3.39Å; D239-V242 PolarHBondContact O-N 3.43Å; D239-L243 HydrophobicContact CB-CB 4.04Å; D239-L243 HydrophobicContact CB-CD2 4.14Å; D239-L243 VanDerWaalsContact O-CB 3.32Å; D239-L243 WeakPolarHBondContact O-CB 3.41Å; D239-L243 PolarHBondContact O-N 3.16Å; D239-P244 VanDerWaalsContact O-CD 3.22Å; D239-P244 WeakPolarHBondContact O-CD 3.39Å; D239-R283 VanDerWaalsContact CG-NH2 3.29Å; D239-R283 IonicContact OD1-CZ 3.75Å; D239-R283 VanDerWaalsContact OD1-CZ 3.25Å; D239-R283 IonicContact OD1-NH1 2.85Å; D239-R283 PolarHBondContact OD1-NH1 3.47Å; D239-R283 IonicContact OD1-NH2 3.75Å; D239-R283 PolarHBondContact OD1-NH2 3.37Å; D239-R283 VanDerWaalsContact OD1-NH2 3.1Å; D239-R283 IonicContact OD2-CZ 3.69Å; D239-R283 IonicContact OD2-NH1 3.31Å; D239-R283 IonicContact OD2-NH2 2.7Å; D239-R283 PolarHBondContact OD2-NH2 3.35Å |
| 240 | F | 95.6 | Very high | 92.8 | Very high | 14 Ų | 14 | 37.9 Ų | 37.9 | 6% | 0.061 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -55 | -33.7 | 173.1 | 172.5 | -92.4 | 0 | 0 | 0 | 112.3 | L155 I170 R172 D176 F177 L180 L222 D236 L237 Q238 | L155-F240 HydrophobicContact CD1-CE1 4.3Å; L155-F240 HydrophobicContact CD1-CZ 4.38Å; I170-F240 HydrophobicContact CD1-CE1 4.45Å; R172-F240 HydrophobicContact CB-CE2 4.46Å; R172-F240 HydrophobicContact CB-CZ 4.18Å; R172-F240 HydrophobicContact CG-CE1 4.28Å; R172-F240 HydrophobicContact CG-CE2 3.98Å; R172-F240 HydrophobicContact CG-CZ 3.63Å; R172-F240 PolarHBondContact NE-O 3.44Å; R172-F240 PolarHBondContact NH2-O 3.05Å; D176-F240 HydrophobicContact CB-CE2 4.13Å; F177-F240 HydrophobicContact CD1-CE2 4.07Å; F177-F240 AromaticContact CD1-CZ 3.61Å; F177-F240 HydrophobicContact CD1-CZ 3.61Å; F177-F240 HydrophobicContact CD2-CE2 4.49Å; F177-F240 HydrophobicContact CD2-CZ 4.33Å; F177-F240 HydrophobicContact CE1-CE1 4.23Å; F177-F240 HydrophobicContact CE1-CE2 4.42Å; F177-F240 AromaticContact CE1-CZ 3.54Å; F177-F240 HydrophobicContact CE1-CZ 3.54Å; F177-F240 HydrophobicContact CE2-CZ 4.26Å; F177-F240 HydrophobicContact CG-CE2 4.14Å; F177-F240 HydrophobicContact CG-CZ 4.04Å; F177-F240 AromaticContact CZ-CZ 3.9Å; F177-F240 HydrophobicContact CZ-CZ 3.9Å; L180-F240 HydrophobicContact CB-CD2 3.95Å; L180-F240 HydrophobicContact CB-CG 4.48Å; L180-F240 HydrophobicContact CD1-CB 4.12Å; L180-F240 HydrophobicContact CD2-CB 3.88Å; L180-F240 HydrophobicContact CD2-CD1 3.98Å; L180-F240 HydrophobicContact CD2-CD2 3.73Å; L180-F240 HydrophobicContact CD2-CE1 4.47Å; L180-F240 HydrophobicContact CD2-CE2 4.24Å; L180-F240 HydrophobicContact CD2-CG 3.58Å; L180-F240 HydrophobicContact CG-CB 4.42Å; L180-F240 HydrophobicContact CG-CD2 4.37Å; L180-F240 HydrophobicContact CG-CG 4.44Å; L222-F240 HydrophobicContact CD1-CE1 4.25Å; L222-F240 HydrophobicContact CD2-CD1 4.39Å; L222-F240 HydrophobicContact CD2-CE1 3.97Å; D236-F240 WeakPolarHBondContact O-CB 3.46Å; D236-F240 PolarHBondContact O-N 2.95Å; L237-F240 WeakPolarHBondContact O-CB 3.4Å; L237-F240 PolarHBondContact O-N 3.35Å; Q238-F240 VanDerWaalsContact C-N 3.31Å; Q238-F240 PolarHBondContact O-N 3.01Å |
| 241 | F | 94.1 | Very high | 93.2 | Very high | 0 Ų | 0 | 35.4 Ų | 35.4 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -89.5 | -36.9 | 179.3 | -67.8 | -74.5 | 0 | 0 | 0 | 114 | F135 V157 I170 R172 L222 L237 Q238 D239 E245 L271 L275 | F135-F241 HydrophobicContact CD1-CE1 4.1Å; F135-F241 HydrophobicContact CD1-CZ 4.25Å; F135-F241 AromaticContact CE1-CE1 3.49Å; F135-F241 HydrophobicContact CE1-CE1 3.49Å; F135-F241 VanDerWaalsContact CE1-CE1 3.49Å; F135-F241 HydrophobicContact CE1-CE2 4.43Å; F135-F241 AromaticContact CE1-CZ 3.38Å; F135-F241 HydrophobicContact CE1-CZ 3.38Å; F135-F241 HydrophobicContact CZ-CE1 4.34Å; F135-F241 AromaticContact CZ-CZ 3.77Å; F135-F241 HydrophobicContact CZ-CZ 3.77Å; V157-F241 HydrophobicContact CG2-CD1 4.07Å; V157-F241 HydrophobicContact CG2-CE1 4.04Å; I170-F241 HydrophobicContact CD1-CD1 3.53Å; I170-F241 HydrophobicContact CD1-CE1 4.16Å; I170-F241 HydrophobicContact CD1-CG 4.46Å; R172-F241 PolarHBondContact NH2-O 3.35Å; L222-F241 HydrophobicContact CD1-CE1 4.1Å; L222-F241 HydrophobicContact CD1-CZ 4.06Å; L222-F241 HydrophobicContact CD2-CZ 3.97Å; L222-F241 HydrophobicContact CG-CZ 4.48Å; L237-F241 HydrophobicContact CD1-CD2 4.39Å; L237-F241 HydrophobicContact CD1-CE2 3.59Å; L237-F241 HydrophobicContact CD1-CZ 4.35Å; L237-F241 HydrophobicContact CG-CE2 4.01Å; L237-F241 WeakPolarHBondContact O-CD2 3.49Å; Q238-F241 PolarHBondContact O-N 3.38Å; Q238-F241 VanDerWaalsContact O-N 3.12Å; D239-F241 PolarHBondContact O-N 3.39Å; F241-E245 VanDerWaalsContact O-CD 3.23Å; F241-L271 WeakPolarHBondContact O-CD1 3.33Å; F241-L275 HydrophobicContact CB-CD1 3.58Å; F241-L275 HydrophobicContact CD2-CD1 3.91Å; F241-L275 HydrophobicContact CD2-CD2 3.54Å; F241-L275 HydrophobicContact CD2-CG 4.41Å; F241-L275 HydrophobicContact CE2-CD2 3.82Å; F241-L275 HydrophobicContact CG-CD1 3.94Å; F241-L275 HydrophobicContact CG-CD2 4.1Å |
| 242 | V | 93.2 | Very high | 93.5 | Very high | 6 Ų | 6 | 35.7 Ų | 35.7 | 4% | 0.036 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -109.1 | -37.2 | -163.9 | 179.8 | 0 | 0 | 0 | 0 | 112.9 | Q238 D239 E245 L246 A268 L271 Q272 L275 | Q238-V242 PolarHBondContact O-N 2.9Å; D239-V242 PolarHBondContact O-N 3.43Å; V242-E245 WeakPolarHBondContact O-CB 3.31Å; V242-E245 PolarHBondContact O-N 3.37Å; V242-L246 HydrophobicContact CG1-CD1 3.61Å; V242-L246 HydrophobicContact CG1-CD2 4.24Å; V242-L246 HydrophobicContact CG1-CG 3.74Å; V242-L246 WeakPolarHBondContact O-CG 3.35Å; V242-L246 PolarHBondContact O-N 2.83Å; V242-A268 HydrophobicContact CG1-CB 4.33Å; V242-L271 HydrophobicContact CG2-CB 3.95Å; V242-Q272 HydrophobicContact CG1-CG 3.94Å; V242-Q272 HydrophobicContact CG2-CG 4.17Å; V242-L275 HydrophobicContact CG2-CD1 3.84Å |
| 243 | L | 93.8 | Very high | 94 | Very high | 10 Ų | 10 | 32.1 Ų | 32.1 | 5% | 0.052 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -66.8 | -43.3 | -167.3 | -179.8 | 63.5 | 0 | 0 | 0 | 113.8 | D239 E245 L246 R247 L374 D375 | D239-L243 HydrophobicContact CB-CB 4.04Å; D239-L243 HydrophobicContact CB-CD2 4.14Å; D239-L243 VanDerWaalsContact O-CB 3.32Å; D239-L243 WeakPolarHBondContact O-CB 3.41Å; D239-L243 PolarHBondContact O-N 3.16Å; L243-E245 VanDerWaalsContact C-N 3.26Å; L243-E245 PolarHBondContact O-N 2.88Å; L243-L246 PolarHBondContact O-N 2.75Å; L243-R247 HydrophobicContact CD1-CG 4.25Å; L243-R247 VanDerWaalsContact CD2-NH1 3.35Å; L243-R247 WeakPolarHBondContact O-CB 3.34Å; L243-R247 WeakPolarHBondContact O-CG 3.34Å; L243-R247 PolarHBondContact O-N 3.31Å; L243-L374 HydrophobicContact CD1-CB 4.14Å; L243-D375 WeakPolarHBondContact CD2-OXT 3.41Å |
| 244 | P | 95.1 | Very high | 94.3 | Very high | 51 Ų | 51 | 30.6 Ų | 30.6 | 33% | 0.331 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -58.6 | -37.4 | 174.6 | -26.7 | 37.1 | 0 | 0 | 0 | 113.5 | D239 R248 | D239-P244 VanDerWaalsContact O-CD 3.22Å; D239-P244 WeakPolarHBondContact O-CD 3.39Å; P244-R248 WeakPolarHBondContact O-CB 3.43Å; P244-R248 PolarHBondContact O-N 3.36Å |
| 245 | E | 95.4 | Very high | 94.6 | Very high | 13 Ų | 13 | 35 Ų | 35 | 6% | 0.061 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -67.9 | -48.9 | 180 | -71.1 | 61 | -152.6 | 0 | 0 | 109.4 | I170 R172 F241 V242 L243 R247 R248 A249 A268 | I170-E245 WeakPolarHBondContact CB-OE1 3.22Å; I170-E245 HydrophobicContact CG2-CG 4.16Å; I170-E245 VanDerWaalsContact CG2-OE1 3.32Å; I170-E245 WeakPolarHBondContact CG2-OE1 3.32Å; R172-E245 IonicContact CZ-OE1 3.1Å; R172-E245 IonicContact CZ-OE2 3.21Å; R172-E245 IonicContact NH1-OE1 3.47Å; R172-E245 PolarHBondContact NH1-OE1 3.21Å; R172-E245 IonicContact NH1-OE2 2.7Å; R172-E245 IonicContact NH2-OE1 3.61Å; R172-E245 PolarHBondContact NH2-OE1 2.93Å; R172-E245 IonicContact NH2-OE2 2.84Å; R172-E245 PolarHBondContact NH2-OE2 3.24Å; F241-E245 VanDerWaalsContact O-CD 3.23Å; V242-E245 WeakPolarHBondContact O-CB 3.31Å; V242-E245 PolarHBondContact O-N 3.37Å; L243-E245 VanDerWaalsContact C-N 3.26Å; L243-E245 PolarHBondContact O-N 2.88Å; E245-R247 PolarHBondContact O-N 2.7Å; E245-R248 PolarHBondContact O-N 2.89Å; E245-A249 WeakPolarHBondContact O-CB 3.31Å; E245-A249 PolarHBondContact O-N 3.48Å; E245-A268 HydrophobicContact CB-CB 4.18Å |
| 246 | L | 94.8 | Very high | 94.9 | Very high | 0 Ų | 0 | 33.5 Ų | 33.5 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -60.1 | -46.7 | 175.9 | -62.2 | 175.3 | 0 | 0 | 0 | 111.5 | V242 L243 R248 A249 Q250 W265 A268 T287 L374 | V242-L246 HydrophobicContact CG1-CD1 3.61Å; V242-L246 HydrophobicContact CG1-CD2 4.24Å; V242-L246 HydrophobicContact CG1-CG 3.74Å; V242-L246 WeakPolarHBondContact O-CG 3.35Å; V242-L246 PolarHBondContact O-N 2.83Å; L243-L246 PolarHBondContact O-N 2.75Å; L246-R248 VanDerWaalsContact C-N 3.34Å; L246-R248 PolarHBondContact O-N 3.38Å; L246-A249 PolarHBondContact O-N 3.01Å; L246-Q250 VanDerWaalsContact O-CB 3.29Å; L246-Q250 WeakPolarHBondContact O-CB 3.47Å; L246-Q250 PolarHBondContact O-N 3.38Å; L246-W265 HydrophobicContact CB-CZ3 4.19Å; L246-W265 HydrophobicContact CD2-CE3 3.78Å; L246-W265 HydrophobicContact CD2-CZ3 3.42Å; L246-W265 VanDerWaalsContact CD2-CZ3 3.42Å; L246-W265 HydrophobicContact CG-CZ3 4.38Å; L246-A268 HydrophobicContact CD2-CB 3.59Å; L246-A268 HydrophobicContact CG-CB 4.24Å; L246-T287 HydrophobicContact CD2-CG2 4.49Å; L246-T287 WeakPolarHBondContact CD2-OG1 3.34Å; L246-L374 HydrophobicContact CB-CD1 3.65Å; L246-L374 HydrophobicContact CD1-CD2 4.39Å |
| 247 | R | 95.4 | Very high | 95.1 | Very high | 103 Ų | 103 | 35.6 Ų | 35.6 | 39% | 0.389 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -60.7 | -43.8 | 178.9 | -77.6 | 176.7 | 170.8 | 148.5 | -1.6 | 111.8 | L243 E245 S251 L374 D375 | L243-R247 HydrophobicContact CD1-CG 4.25Å; L243-R247 VanDerWaalsContact CD2-NH1 3.35Å; L243-R247 WeakPolarHBondContact O-CB 3.34Å; L243-R247 WeakPolarHBondContact O-CG 3.34Å; L243-R247 PolarHBondContact O-N 3.31Å; E245-R247 PolarHBondContact O-N 2.7Å; R247-S251 WeakPolarHBondContact O-CB 3.46Å; R247-S251 PolarHBondContact O-N 3.38Å; R247-L374 HydrophobicContact CG-CB 3.84Å; R247-L374 HydrophobicContact CG-CD1 4.17Å; R247-L374 PolarHBondContact NE-O 3.38Å; R247-L374 PolarHBondContact NH2-O 2.83Å; R247-D375 PolarHBondContact NH2-OXT 3.28Å |
| 248 | R | 96.3 | Very high | 95.3 | Very high | 143 Ų | 143 | 37.5 Ų | 37.5 | 54% | 0.54 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -70.1 | -42 | 178.9 | -175.1 | 62 | 179.6 | 179.5 | 1.8 | 111.4 | P244 E245 L246 S251 L252 L264 | P244-R248 WeakPolarHBondContact O-CB 3.43Å; P244-R248 PolarHBondContact O-N 3.36Å; E245-R248 PolarHBondContact O-N 2.89Å; L246-R248 VanDerWaalsContact C-N 3.34Å; L246-R248 PolarHBondContact O-N 3.38Å; R248-S251 PolarHBondContact O-N 3.22Å; R248-L252 HydrophobicContact CG-CD1 4.21Å; R248-L252 VanDerWaalsContact O-CG 3.32Å; R248-L252 WeakPolarHBondContact O-CG 3.45Å; R248-L252 PolarHBondContact O-N 3.24Å; R248-L264 HydrophobicContact CB-CD1 3.76Å; R248-L264 HydrophobicContact CG-CD1 3.36Å |
| 249 | A | 97 | Very high | 95.6 | Very high | 0 Ų | 0 | 46.4 Ų | 46.4 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -60 | -47.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | E245 L246 S251 L252 T253 L264 W265 | E245-A249 WeakPolarHBondContact O-CB 3.31Å; E245-A249 PolarHBondContact O-N 3.48Å; L246-A249 PolarHBondContact O-N 3.01Å; A249-S251 PolarHBondContact O-N 2.94Å; A249-L252 PolarHBondContact O-N 3Å; A249-T253 PolarHBondContact O-N 3.18Å; A249-T253 PolarHBondContact O-OG1 3.37Å; A249-L264 HydrophobicContact CB-CB 3.66Å; A249-L264 HydrophobicContact CB-CD1 4.49Å; A249-W265 HydrophobicContact CB-CD2 3.41Å; A249-W265 VanDerWaalsContact CB-CD2 3.41Å; A249-W265 HydrophobicContact CB-CE3 3.89Å; A249-W265 HydrophobicContact CB-CG 3.77Å; A249-W265 HydrophobicContact CB-CH2 4.19Å; A249-W265 HydrophobicContact CB-CZ2 3.75Å; A249-W265 HydrophobicContact CB-CZ3 4.26Å |
| 250 | Q | 95.8 | Very high | 95.9 | Very high | 29 Ų | 29 | 50.1 Ų | 50.1 | 14% | 0.136 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -58 | -49.7 | 174.7 | -174.9 | -171.2 | 47.2 | 0 | 0 | 111.6 | L246 L252 T253 C254 W265 L369 E372 L374 | L246-Q250 VanDerWaalsContact O-CB 3.29Å; L246-Q250 WeakPolarHBondContact O-CB 3.47Å; L246-Q250 PolarHBondContact O-N 3.38Å; Q250-L252 VanDerWaalsContact C-N 3.31Å; Q250-L252 PolarHBondContact O-N 3Å; Q250-T253 PolarHBondContact O-N 3.02Å; Q250-C254 PolarHBondContact O-N 2.8Å; Q250-C254 PolarHBondContact O-SG 2.9Å; Q250-W265 HydrophobicContact CB-CH2 4.05Å; Q250-W265 HydrophobicContact CB-CZ2 3.98Å; Q250-W265 VanDerWaalsContact N-CZ2 3.31Å; Q250-L369 HydrophobicContact CG-CG 4.44Å; Q250-L369 PolarHBondContact NE2-O 3.43Å; Q250-E372 PolarHBondContact NE2-O 3.46Å; Q250-L374 HydrophobicContact CB-CD1 4.27Å |
| 251 | S | 96.1 | Very high | 96 | Very high | 56 Ų | 56 | 49.4 Ų | 49.4 | 39% | 0.392 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -56.1 | -45.2 | 177.1 | 174.5 | 0 | 0 | 0 | 0 | 112 | R247 R248 A249 C254 T255 | R247-S251 WeakPolarHBondContact O-CB 3.46Å; R247-S251 PolarHBondContact O-N 3.38Å; R248-S251 PolarHBondContact O-N 3.22Å; A249-S251 PolarHBondContact O-N 2.94Å; S251-C254 WeakPolarHBondContact O-CB 3.34Å; S251-C254 PolarHBondContact O-N 2.96Å; S251-T255 WeakPolarHBondContact O-CG2 3.5Å; S251-T255 PolarHBondContact O-N 3.01Å; S251-T255 VanDerWaalsContact O-N 3.09Å; S251-T255 PolarHBondContact O-OG1 2.72Å |
| 252 | L | 97.4 | Very high | 96.2 | Very high | 7 Ų | 7 | 51.1 Ų | 51.1 | 4% | 0.037 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -67.4 | -38.5 | 178.1 | -69.3 | 172.1 | 0 | 0 | 0 | 112.4 | R248 A249 Q250 C254 T255 G256 L257 E260 A261 L264 | R248-L252 HydrophobicContact CG-CD1 4.21Å; R248-L252 VanDerWaalsContact O-CG 3.32Å; R248-L252 WeakPolarHBondContact O-CG 3.45Å; R248-L252 PolarHBondContact O-N 3.24Å; A249-L252 PolarHBondContact O-N 3Å; Q250-L252 VanDerWaalsContact C-N 3.31Å; Q250-L252 PolarHBondContact O-N 3Å; L252-C254 VanDerWaalsContact C-N 3.32Å; L252-C254 PolarHBondContact O-N 3.02Å; L252-T255 WeakPolarHBondContact CA-OG1 3.4Å; L252-T255 PolarHBondContact O-N 2.87Å; L252-T255 PolarHBondContact O-OG1 2.96Å; L252-T255 VanDerWaalsContact O-OG1 3.06Å; L252-G256 PolarHBondContact O-N 3.44Å; L252-G256 VanDerWaalsContact O-N 3.1Å; L252-L257 HydrophobicContact CB-CB 4.25Å; L252-L257 HydrophobicContact CD2-CB 4.03Å; L252-L257 HydrophobicContact CD2-CD1 3.59Å; L252-L257 HydrophobicContact CD2-CG 4.44Å; L252-L257 PolarHBondContact O-N 2.82Å; L252-E260 HydrophobicContact CD1-CB 3.87Å; L252-A261 HydrophobicContact CB-CB 3.73Å; L252-L264 HydrophobicContact CD1-CD1 3.7Å |
| 253 | T | 96.9 | Very high | 96.3 | Very high | 3 Ų | 3 | 53.6 Ų | 53.6 | 2% | 0.018 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -62.4 | -40.8 | 173.9 | -55.6 | 0 | 0 | 0 | 0 | 111 | A249 Q250 T255 G256 Y258 A261 W265 V293 L369 | A249-T253 PolarHBondContact O-N 3.18Å; A249-T253 PolarHBondContact O-OG1 3.37Å; Q250-T253 PolarHBondContact O-N 3.02Å; T253-T255 VanDerWaalsContact C-N 3.31Å; T253-T255 PolarHBondContact O-N 3.29Å; T253-G256 PolarHBondContact O-N 3.13Å; T253-Y258 HydrophobicContact CG2-CD1 4.18Å; T253-Y258 HydrophobicContact CG2-CE1 3.93Å; T253-Y258 WeakPolarHBondContact O-CE1 3.28Å; T253-A261 WeakPolarHBondContact OG1-CB 3.46Å; T253-W265 PolarHBondContact OG1-NE1 3.06Å; T253-V293 HydrophobicContact CG2-CG1 3.95Å; T253-L369 HydrophobicContact CG2-CD2 3.51Å |
| 254 | C | 93.8 | Very high | 96.5 | Very high | 66 Ų | 66 | 55.4 Ų | 55.4 | 45% | 0.446 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -65 | -32.4 | 176.1 | -67.8 | 0 | 0 | 0 | 0 | 112.8 | Q250 S251 L252 G256 | Q250-C254 PolarHBondContact O-N 2.8Å; Q250-C254 PolarHBondContact O-SG 2.9Å; S251-C254 WeakPolarHBondContact O-CB 3.34Å; S251-C254 PolarHBondContact O-N 2.96Å; L252-C254 VanDerWaalsContact C-N 3.32Å; L252-C254 PolarHBondContact O-N 3.02Å; C254-G256 VanDerWaalsContact C-N 3.34Å |
| 255 | T | 95.5 | Very high | 96.6 | Very high | 93 Ų | 93 | 53 Ų | 53 | 57% | 0.571 | 27% | 0.269 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.3 | -0 | 176.1 | 60.4 | 0 | 0 | 0 | 0 | 113.9 | S251 L252 T253 | S251-T255 WeakPolarHBondContact O-CG2 3.5Å; S251-T255 PolarHBondContact O-N 3.01Å; S251-T255 VanDerWaalsContact O-N 3.09Å; S251-T255 PolarHBondContact O-OG1 2.72Å; L252-T255 WeakPolarHBondContact CA-OG1 3.4Å; L252-T255 PolarHBondContact O-N 2.87Å; L252-T255 PolarHBondContact O-OG1 2.96Å; L252-T255 VanDerWaalsContact O-OG1 3.06Å; T253-T255 VanDerWaalsContact C-N 3.31Å; T253-T255 PolarHBondContact O-N 3.29Å |
| 256 | G | 96 | Very high | 96.6 | Very high | 31 Ų | 31 | 54.4 Ų | 54.4 | 32% | 0.32 | 28% | 0.284 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 81.5 | 10 | 179 | 0 | 0 | 0 | 0 | 0 | 115.4 | L252 T253 C254 Y258 | L252-G256 PolarHBondContact O-N 3.44Å; L252-G256 VanDerWaalsContact O-N 3.1Å; T253-G256 PolarHBondContact O-N 3.13Å; C254-G256 VanDerWaalsContact C-N 3.34Å; G256-Y258 WeakPolarHBondContact O-CD2 3.33Å; G256-Y258 PolarHBondContact O-N 3.38Å |
| 257 | L | 97.9 | Very high | 96.6 | Very high | 79 Ų | 79 | 55.9 Ų | 55.9 | 41% | 0.414 | 29% | 0.292 | S | S | . | . | trans | -84.1 | 62.7 | 177.6 | -65.6 | 174.6 | 0 | 0 | 0 | 110.4 | L252 R259 E260 A261 | L252-L257 HydrophobicContact CB-CB 4.25Å; L252-L257 HydrophobicContact CD2-CB 4.03Å; L252-L257 HydrophobicContact CD2-CD1 3.59Å; L252-L257 HydrophobicContact CD2-CG 4.44Å; L252-L257 PolarHBondContact O-N 2.82Å; L257-R259 PolarHBondContact O-N 3.46Å; L257-E260 PolarHBondContact O-N 3.1Å; L257-A261 WeakPolarHBondContact O-CB 3.32Å; L257-A261 PolarHBondContact O-N 3.35Å | ||
| 258 | Y | 98 | Very high | 96.6 | Very high | 41 Ų | 41 | 51 Ų | 51 | 16% | 0.161 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -63.3 | -35.3 | -168.3 | -59 | -58.5 | 0 | 0 | 0 | 114.3 | T253 G256 L262 E297 K366 | T253-Y258 HydrophobicContact CG2-CD1 4.18Å; T253-Y258 HydrophobicContact CG2-CE1 3.93Å; T253-Y258 WeakPolarHBondContact O-CE1 3.28Å; G256-Y258 WeakPolarHBondContact O-CD2 3.33Å; G256-Y258 PolarHBondContact O-N 3.38Å; Y258-L262 WeakPolarHBondContact O-CB 3.43Å; Y258-L262 PolarHBondContact O-N 3.47Å; Y258-E297 HydrophobicContact CD1-CB 4.05Å; Y258-E297 HydrophobicContact CD1-CG 4.05Å; Y258-E297 HydrophobicContact CD2-CB 3.39Å; Y258-E297 HydrophobicContact CD2-CG 3.98Å; Y258-E297 HydrophobicContact CE1-CB 4.27Å; Y258-E297 HydrophobicContact CE1-CG 3.83Å; Y258-E297 HydrophobicContact CE2-CB 3.61Å; Y258-E297 HydrophobicContact CE2-CG 3.72Å; Y258-E297 HydrophobicContact CG-CB 3.64Å; Y258-E297 HydrophobicContact CG-CG 4.15Å; Y258-K366 WeakPolarHBondContact OH-CE 3.44Å; Y258-K366 PolarHBondContact OH-NZ 3.01Å |
| 259 | R | 97.9 | Very high | 96.4 | Very high | 199 Ų | 199 | 47.7 Ų | 47.7 | 75% | 0.751 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -66.6 | -43.1 | 178.9 | -175.7 | 175.4 | -72.6 | 156 | -1.7 | 112.2 | L257 A263 L298 | L257-R259 PolarHBondContact O-N 3.46Å; R259-A263 PolarHBondContact O-N 3.18Å; R259-L298 HydrophobicContact CB-CD2 4.41Å |
| 260 | E | 97.8 | Very high | 96.2 | Very high | 108 Ų | 108 | 50 Ų | 50 | 51% | 0.505 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -71 | -41.4 | 176.7 | -65.7 | 175.2 | -146.1 | 0 | 0 | 111.2 | L252 L257 L262 A263 L264 | L252-E260 HydrophobicContact CD1-CB 3.87Å; L257-E260 PolarHBondContact O-N 3.1Å; E260-L262 VanDerWaalsContact C-N 3.31Å; E260-L262 PolarHBondContact O-N 3.06Å; E260-A263 PolarHBondContact O-N 2.83Å; E260-L264 PolarHBondContact O-N 3.22Å |
| 261 | A | 97.9 | Very high | 96 | Very high | 0 Ų | 0 | 48.7 Ų | 48.7 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -59.7 | -43 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | L252 T253 L257 A263 L264 W265 | L252-A261 HydrophobicContact CB-CB 3.73Å; T253-A261 WeakPolarHBondContact OG1-CB 3.46Å; L257-A261 WeakPolarHBondContact O-CB 3.32Å; L257-A261 PolarHBondContact O-N 3.35Å; A261-A263 VanDerWaalsContact C-N 3.31Å; A261-A263 PolarHBondContact O-N 3.47Å; A261-L264 PolarHBondContact O-N 2.71Å; A261-L264 VanDerWaalsContact O-N 3.16Å; A261-W265 PolarHBondContact O-N 2.61Å |
| 262 | L | 97.8 | Very high | 95.7 | Very high | 35 Ų | 35 | 47.1 Ų | 47.1 | 18% | 0.183 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -57.4 | -44 | 179.7 | -179 | 65.3 | 0 | 0 | 0 | 111.7 | Y258 E260 L264 W265 A266 L291 C294 H295 L298 | Y258-L262 WeakPolarHBondContact O-CB 3.43Å; Y258-L262 PolarHBondContact O-N 3.47Å; E260-L262 VanDerWaalsContact C-N 3.31Å; E260-L262 PolarHBondContact O-N 3.06Å; L262-L264 VanDerWaalsContact C-N 3.33Å; L262-L264 PolarHBondContact O-N 3.33Å; L262-W265 PolarHBondContact O-N 3.32Å; L262-A266 WeakPolarHBondContact O-CB 3.34Å; L262-A266 PolarHBondContact O-N 2.98Å; L262-L291 HydrophobicContact CD1-CD2 3.71Å; L262-C294 HydrophobicContact CB-CB 3.96Å; L262-C294 HydrophobicContact CD1-CB 3.93Å; L262-C294 HydrophobicContact CG-CB 4.49Å; L262-H295 WeakPolarHBondContact CD1-NE2 3.49Å; L262-L298 HydrophobicContact CB-CD1 4.41Å; L262-L298 HydrophobicContact CD2-CD1 3.78Å |
| 263 | A | 96.4 | Very high | 95.2 | Very high | 59 Ų | 59 | 50.3 Ų | 50.3 | 49% | 0.488 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -59 | -45 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | R259 E260 A261 A266 T267 | R259-A263 PolarHBondContact O-N 3.18Å; E260-A263 PolarHBondContact O-N 2.83Å; A261-A263 VanDerWaalsContact C-N 3.31Å; A261-A263 PolarHBondContact O-N 3.47Å; A263-A266 PolarHBondContact O-N 3.17Å; A263-T267 PolarHBondContact O-N 3.46Å; A263-T267 PolarHBondContact O-OG1 3.18Å |
| 264 | L | 96.9 | Very high | 94.7 | Very high | 47 Ų | 47 | 51.7 Ų | 51.7 | 25% | 0.246 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -70.1 | -39.2 | 179.3 | -63.6 | -178.5 | 0 | 0 | 0 | 113.1 | R248 A249 L252 E260 A261 L262 A266 T267 A268 | R248-L264 HydrophobicContact CB-CD1 3.76Å; R248-L264 HydrophobicContact CG-CD1 3.36Å; A249-L264 HydrophobicContact CB-CB 3.66Å; A249-L264 HydrophobicContact CB-CD1 4.49Å; L252-L264 HydrophobicContact CD1-CD1 3.7Å; E260-L264 PolarHBondContact O-N 3.22Å; A261-L264 PolarHBondContact O-N 2.71Å; A261-L264 VanDerWaalsContact O-N 3.16Å; L262-L264 VanDerWaalsContact C-N 3.33Å; L262-L264 PolarHBondContact O-N 3.33Å; L264-A266 VanDerWaalsContact C-N 3.3Å; L264-A266 PolarHBondContact O-N 2.88Å; L264-T267 PolarHBondContact O-N 2.79Å; L264-A268 WeakPolarHBondContact O-CB 3.41Å; L264-A268 PolarHBondContact O-N 3Å |
| 265 | W | 97.3 | Very high | 94.2 | Very high | 0 Ų | 0 | 48.8 Ų | 48.8 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -61.2 | -41 | 172.8 | -72.1 | 125.1 | 0 | 0 | 0 | 111.4 | L246 A249 Q250 T253 A261 L262 A268 W269 T287 L291 L369 | L246-W265 HydrophobicContact CB-CZ3 4.19Å; L246-W265 HydrophobicContact CD2-CE3 3.78Å; L246-W265 HydrophobicContact CD2-CZ3 3.42Å; L246-W265 VanDerWaalsContact CD2-CZ3 3.42Å; L246-W265 HydrophobicContact CG-CZ3 4.38Å; A249-W265 HydrophobicContact CB-CD2 3.41Å; A249-W265 VanDerWaalsContact CB-CD2 3.41Å; A249-W265 HydrophobicContact CB-CE3 3.89Å; A249-W265 HydrophobicContact CB-CG 3.77Å; A249-W265 HydrophobicContact CB-CH2 4.19Å; A249-W265 HydrophobicContact CB-CZ2 3.75Å; A249-W265 HydrophobicContact CB-CZ3 4.26Å; Q250-W265 HydrophobicContact CB-CH2 4.05Å; Q250-W265 HydrophobicContact CB-CZ2 3.98Å; Q250-W265 VanDerWaalsContact N-CZ2 3.31Å; T253-W265 PolarHBondContact OG1-NE1 3.06Å; A261-W265 PolarHBondContact O-N 2.61Å; L262-W265 PolarHBondContact O-N 3.32Å; W265-A268 PolarHBondContact O-N 3.3Å; W265-W269 WeakPolarHBondContact O-CB 3.4Å; W265-W269 PolarHBondContact O-N 2.82Å; W265-T287 HydrophobicContact CE3-CG2 4.19Å; W265-T287 WeakPolarHBondContact O-CG2 3.35Å; W265-L291 HydrophobicContact CB-CD2 3.53Å; W265-L291 HydrophobicContact CB-CG 3.88Å; W265-L369 HydrophobicContact CH2-CD1 3.87Å; W265-L369 HydrophobicContact CZ2-CD1 3.84Å; W265-L369 HydrophobicContact CZ2-CD2 4.02Å; W265-L369 HydrophobicContact CZ2-CG 4.34Å |
| 266 | A | 95.5 | Very high | 93.1 | Very high | 44 Ų | 44 | 45.7 Ų | 45.7 | 36% | 0.364 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -65.8 | -43.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | L262 A263 L264 A268 W269 Q270 L291 | L262-A266 WeakPolarHBondContact O-CB 3.34Å; L262-A266 PolarHBondContact O-N 2.98Å; A263-A266 PolarHBondContact O-N 3.17Å; L264-A266 VanDerWaalsContact C-N 3.3Å; L264-A266 PolarHBondContact O-N 2.88Å; A266-A268 PolarHBondContact O-N 2.68Å; A266-W269 PolarHBondContact O-N 3.12Å; A266-Q270 WeakPolarHBondContact O-CB 3.23Å; A266-Q270 PolarHBondContact O-N 2.95Å; A266-L291 HydrophobicContact CB-CD2 4.34Å |
| 267 | T | 95.1 | Very high | 91.4 | Very high | 30 Ų | 30 | 48.5 Ų | 48.5 | 18% | 0.184 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -59.4 | -46.1 | 173.3 | -57.5 | 0 | 0 | 0 | 0 | 111.4 | A168 Q169 I170 A263 L264 W269 Q270 L271 | A168-T267 HydrophobicContact CB-CG2 4.43Å; Q169-T267 WeakPolarHBondContact O-CG2 3.47Å; I170-T267 HydrophobicContact CG2-CG2 4.28Å; A263-T267 PolarHBondContact O-N 3.46Å; A263-T267 PolarHBondContact O-OG1 3.18Å; L264-T267 PolarHBondContact O-N 2.79Å; T267-W269 PolarHBondContact O-N 3.25Å; T267-Q270 PolarHBondContact O-N 3.27Å; T267-L271 HydrophobicContact CG2-CD1 3.92Å; T267-L271 HydrophobicContact CG2-CG 4.47Å; T267-L271 VanDerWaalsContact O-CG 3.28Å; T267-L271 WeakPolarHBondContact O-CG 3.46Å; T267-L271 PolarHBondContact O-N 2.92Å |
| 268 | A | 94.4 | Very high | 89.4 | Confident | 0 Ų | 0 | 48.1 Ų | 48.1 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -62.8 | -41.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | V242 E245 L246 L264 W265 A266 Q270 L271 Q272 T287 | V242-A268 HydrophobicContact CG1-CB 4.33Å; E245-A268 HydrophobicContact CB-CB 4.18Å; L246-A268 HydrophobicContact CD2-CB 3.59Å; L246-A268 HydrophobicContact CG-CB 4.24Å; L264-A268 WeakPolarHBondContact O-CB 3.41Å; L264-A268 PolarHBondContact O-N 3Å; W265-A268 PolarHBondContact O-N 3.3Å; A266-A268 PolarHBondContact O-N 2.68Å; A268-Q270 PolarHBondContact O-N 3.3Å; A268-L271 PolarHBondContact O-N 2.94Å; A268-Q272 WeakPolarHBondContact O-CB 3.39Å; A268-Q272 VanDerWaalsContact O-CG 3.23Å; A268-Q272 WeakPolarHBondContact O-CG 3.27Å; A268-Q272 PolarHBondContact O-N 3.33Å; A268-T287 HydrophobicContact CB-CG2 4.39Å |
| 269 | W | 93.6 | Very high | 87.3 | Confident | 74 Ų | 74 | 48.4 Ų | 48.4 | 28% | 0.28 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -59.8 | -45.8 | 175.2 | 178.2 | -109.7 | 0 | 0 | 0 | 111.7 | W265 A266 T267 Q272 A273 P284 T287 L288 L291 L314 | W265-W269 WeakPolarHBondContact O-CB 3.4Å; W265-W269 PolarHBondContact O-N 2.82Å; A266-W269 PolarHBondContact O-N 3.12Å; T267-W269 PolarHBondContact O-N 3.25Å; W269-Q272 PolarHBondContact O-N 3.47Å; W269-A273 PolarHBondContact O-N 2.84Å; W269-A273 VanDerWaalsContact O-N 3.12Å; W269-P284 HydrophobicContact CZ3-CB 3.99Å; W269-T287 HydrophobicContact CB-CG2 3.68Å; W269-T287 HydrophobicContact CE3-CG2 4.2Å; W269-L288 HydrophobicContact CD2-CD2 4.44Å; W269-L288 HydrophobicContact CE3-CD2 4.17Å; W269-L288 HydrophobicContact CE3-CG 4.09Å; W269-L288 HydrophobicContact CH2-CD1 3.86Å; W269-L288 HydrophobicContact CH2-CD2 4.01Å; W269-L288 HydrophobicContact CH2-CG 4.05Å; W269-L288 HydrophobicContact CZ2-CD2 4.28Å; W269-L288 HydrophobicContact CZ3-CD1 3.78Å; W269-L288 HydrophobicContact CZ3-CD2 3.95Å; W269-L288 HydrophobicContact CZ3-CG 3.65Å; W269-L291 HydrophobicContact CB-CD1 4.15Å; W269-L291 HydrophobicContact CG-CD1 4.23Å; W269-L314 HydrophobicContact CH2-CD1 4.28Å |
| 270 | Q | 91.6 | Very high | 85.5 | Confident | 50 Ų | 50 | 40.8 Ų | 40.8 | 23% | 0.234 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -62.8 | -45 | 177.9 | -176.9 | -179.2 | -14 | 0 | 0 | 111.8 | Q166 A168 A266 T267 A268 Q272 A273 Q274 | Q166-Q270 PolarHBondContact O-NE2 3.49Å; A168-Q270 HydrophobicContact CB-CG 4.15Å; A266-Q270 WeakPolarHBondContact O-CB 3.23Å; A266-Q270 PolarHBondContact O-N 2.95Å; T267-Q270 PolarHBondContact O-N 3.27Å; A268-Q270 PolarHBondContact O-N 3.3Å; Q270-Q272 VanDerWaalsContact C-N 3.34Å; Q270-Q272 PolarHBondContact O-N 3.43Å; Q270-A273 WeakPolarHBondContact O-CB 3.35Å; Q270-A273 PolarHBondContact O-N 2.7Å; Q270-Q274 HydrophobicContact CG-CG 4.47Å; Q270-Q274 WeakPolarHBondContact O-CG 3.44Å; Q270-Q274 PolarHBondContact O-N 2.87Å |
| 271 | L | 91.6 | Very high | 83.8 | Confident | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -61.4 | -42.9 | 177.1 | -71.5 | 164.8 | 0 | 0 | 0 | 111.7 | V157 A168 I170 F241 V242 T267 A268 A273 Q274 L275 | V157-L271 HydrophobicContact CB-CD2 3.85Å; V157-L271 HydrophobicContact CG1-CD2 4.04Å; V157-L271 HydrophobicContact CG2-CD2 3.85Å; A168-L271 HydrophobicContact CB-CD2 3.59Å; A168-L271 HydrophobicContact CB-CG 3.8Å; I170-L271 HydrophobicContact CG2-CD1 3.51Å; F241-L271 WeakPolarHBondContact O-CD1 3.33Å; V242-L271 HydrophobicContact CG2-CB 3.95Å; T267-L271 HydrophobicContact CG2-CD1 3.92Å; T267-L271 HydrophobicContact CG2-CG 4.47Å; T267-L271 VanDerWaalsContact O-CG 3.28Å; T267-L271 WeakPolarHBondContact O-CG 3.46Å; T267-L271 PolarHBondContact O-N 2.92Å; A268-L271 PolarHBondContact O-N 2.94Å; L271-A273 VanDerWaalsContact C-N 3.25Å; L271-A273 PolarHBondContact O-N 3.3Å; L271-Q274 PolarHBondContact O-N 3.47Å; L271-Q274 VanDerWaalsContact O-N 3.16Å; L271-L275 HydrophobicContact CB-CD1 4.23Å; L271-L275 WeakPolarHBondContact O-CB 3.08Å; L271-L275 WeakPolarHBondContact O-CD1 3.46Å; L271-L275 VanDerWaalsContact O-CG 3.26Å; L271-L275 WeakPolarHBondContact O-CG 3.37Å; L271-L275 PolarHBondContact O-N 2.95Å |
| 272 | Q | 90.1 | Very high | 83 | Confident | 23 Ų | 23 | 43 Ų | 43 | 11% | 0.107 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -58.8 | -37.5 | 176.1 | -74.6 | 169.8 | -23.2 | 0 | 0 | 112 | V242 A268 W269 Q270 R283 T287 | V242-Q272 HydrophobicContact CG1-CG 3.94Å; V242-Q272 HydrophobicContact CG2-CG 4.17Å; A268-Q272 WeakPolarHBondContact O-CB 3.39Å; A268-Q272 VanDerWaalsContact O-CG 3.23Å; A268-Q272 WeakPolarHBondContact O-CG 3.27Å; A268-Q272 PolarHBondContact O-N 3.33Å; W269-Q272 PolarHBondContact O-N 3.47Å; Q270-Q272 VanDerWaalsContact C-N 3.34Å; Q270-Q272 PolarHBondContact O-N 3.43Å; Q272-R283 PolarHBondContact NE2-O 2.94Å; Q272-T287 VanDerWaalsContact CD-OG1 3.3Å; Q272-T287 PolarHBondContact NE2-OG1 3.04Å; Q272-T287 PolarHBondContact OE1-OG1 3.19Å |
| 273 | A | 87.1 | Confident | 82.5 | Confident | 75 Ų | 75 | 43.3 Ų | 43.3 | 62% | 0.62 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -70.9 | -39.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | W269 Q270 L271 | W269-A273 PolarHBondContact O-N 2.84Å; W269-A273 VanDerWaalsContact O-N 3.12Å; Q270-A273 WeakPolarHBondContact O-CB 3.35Å; Q270-A273 PolarHBondContact O-N 2.7Å; L271-A273 VanDerWaalsContact C-N 3.25Å; L271-A273 PolarHBondContact O-N 3.3Å |
| 274 | Q | 87 | Confident | 82.3 | Confident | 32 Ų | 32 | 41.1 Ų | 41.1 | 15% | 0.15 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -73.8 | -38.2 | -177.4 | -74.8 | -179.3 | -17.9 | 0 | 0 | 113.8 | L133 V157 Q270 L271 G276 | L133-Q274 HydrophobicContact CD2-CB 3.78Å; V157-Q274 PolarHBondContact O-NE2 2.89Å; V157-Q274 PolarHBondContact O-OE1 3.18Å; Q270-Q274 HydrophobicContact CG-CG 4.47Å; Q270-Q274 WeakPolarHBondContact O-CG 3.44Å; Q270-Q274 PolarHBondContact O-N 2.87Å; L271-Q274 PolarHBondContact O-N 3.47Å; L271-Q274 VanDerWaalsContact O-N 3.16Å; Q274-G276 VanDerWaalsContact C-N 3.31Å; Q274-G276 PolarHBondContact O-N 2.88Å |
| 275 | L | 83.7 | Confident | 82.1 | Confident | 5 Ų | 5 | 38.9 Ų | 38.9 | 3% | 0.026 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -72.2 | -24.5 | -175.2 | -71 | 161.8 | 0 | 0 | 0 | 113.3 | L133 F241 V242 L271 | L133-L275 HydrophobicContact CD1-CD2 3.54Å; L133-L275 HydrophobicContact CD1-CG 4.29Å; F241-L275 HydrophobicContact CB-CD1 3.58Å; F241-L275 HydrophobicContact CD2-CD1 3.91Å; F241-L275 HydrophobicContact CD2-CD2 3.54Å; F241-L275 HydrophobicContact CD2-CG 4.41Å; F241-L275 HydrophobicContact CE2-CD2 3.82Å; F241-L275 HydrophobicContact CG-CD1 3.94Å; F241-L275 HydrophobicContact CG-CD2 4.1Å; V242-L275 HydrophobicContact CG2-CD1 3.84Å; L271-L275 HydrophobicContact CB-CD1 4.23Å; L271-L275 WeakPolarHBondContact O-CB 3.08Å; L271-L275 WeakPolarHBondContact O-CD1 3.46Å; L271-L275 VanDerWaalsContact O-CG 3.26Å; L271-L275 WeakPolarHBondContact O-CG 3.37Å; L271-L275 PolarHBondContact O-N 2.95Å |
| 276 | G | 70.9 | Confident | 81.9 | Confident | 28 Ų | 28 | 39.2 Ų | 39.2 | 29% | 0.289 | 25% | 0.247 | S | C | . | . | trans | 68.7 | 139.5 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q238 Q274 | Q238-G276 PolarHBondContact NE2-O 2.88Å; Q274-G276 VanDerWaalsContact C-N 3.31Å; Q274-G276 PolarHBondContact O-N 2.88Å | ||
| 277 | T | 60 | Low | 81.9 | Confident | 90 Ų | 90 | 37.1 Ų | 37.1 | 55% | 0.552 | 23% | 0.229 | S | C | * | . | S | Bend | trans | 54.2 | 98.7 | -175.2 | 26.6 | 0 | 0 | 0 | 0 | 114.1 | H233 Q238 | H233-T277 PolarHBondContact CD2-OG1 3.33Å; Q238-T277 PolarHBondContact NE2-O 3.07Å; Q238-T277 VanDerWaalsContact NE2-O 3.12Å |
| 278 | P | 55.9 | Low | 81.9 | Confident | 70 Ų | 70 | 35.8 Ų | 35.8 | 46% | 0.455 | 22% | 0.221 | S | C | . | . | trans | -65 | 141.9 | 176.6 | 28.6 | -33.8 | 0 | 0 | 0 | 110.4 | G280 P284 | P278-G280 WeakPolarHBondContact CB-O 3.4Å; P278-G280 PolarHBondContact O-N 3.02Å; P278-P284 HydrophobicContact CB-CG 3.59Å; P278-P284 HydrophobicContact CG-CG 4.01Å | ||
| 279 | S | 54.2 | Low | 82 | Confident | 48 Ų | 48 | 35.8 Ų | 35.8 | 34% | 0.336 | 22% | 0.221 | S | C | . | . | S | Bend | trans | -64.7 | 91.6 | 161.3 | -164.5 | 0 | 0 | 0 | 0 | 107.1 | ||
| 280 | G | 60.4 | Low | 82.2 | Confident | 38 Ų | 38 | 32.3 Ų | 32.3 | 39% | 0.392 | 21% | 0.208 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 75.6 | 154.2 | -178.4 | 0 | 0 | 0 | 0 | 0 | 115.6 | P278 D282 | P278-G280 WeakPolarHBondContact CB-O 3.4Å; P278-G280 PolarHBondContact O-N 3.02Å; G280-D282 PolarHBondContact O-N 3.12Å |
| 281 | P | 62.8 | Low | 82.6 | Confident | 70 Ų | 70 | 30.4 Ų | 30.4 | 46% | 0.455 | 20% | 0.199 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -66.6 | -16.8 | 175.8 | 26.5 | -31.7 | 0 | 0 | 0 | 113.5 | L285 | P281-L285 WeakPolarHBondContact O-CD1 3.36Å; P281-L285 WeakPolarHBondContact O-CG 3.44Å |
| 282 | D | 81.3 | Confident | 82.9 | Confident | 85 Ų | 85 | 30.4 Ų | 30.4 | 46% | 0.455 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -81.6 | -33.7 | -166.3 | -56.3 | -14.3 | 0 | 0 | 0 | 112.5 | G280 L285 L286 H321 | G280-D282 PolarHBondContact O-N 3.12Å; D282-L285 WeakPolarHBondContact O-CB 3.26Å; D282-L285 PolarHBondContact O-N 3.36Å; D282-L286 WeakPolarHBondContact O-CB 3.19Å; D282-L286 PolarHBondContact O-N 2.96Å; D282-H321 IonicContact OD1-NE2 3.09Å; D282-H321 PolarHBondContact OD1-NE2 3.17Å; D282-H321 VanDerWaalsContact OD1-NE2 3.09Å |
| 283 | R | 86.9 | Confident | 83.3 | Confident | 41 Ų | 41 | 29.5 Ų | 29.5 | 16% | 0.155 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -65.8 | -45.6 | -177.7 | -69 | -174.5 | 174.1 | -168.9 | 1 | 113.6 | D239 Q272 L285 L286 T287 | D239-R283 VanDerWaalsContact CG-NH2 3.29Å; D239-R283 IonicContact OD1-CZ 3.75Å; D239-R283 VanDerWaalsContact OD1-CZ 3.25Å; D239-R283 IonicContact OD1-NH1 2.85Å; D239-R283 PolarHBondContact OD1-NH1 3.47Å; D239-R283 IonicContact OD1-NH2 3.75Å; D239-R283 PolarHBondContact OD1-NH2 3.37Å; D239-R283 VanDerWaalsContact OD1-NH2 3.1Å; D239-R283 IonicContact OD2-CZ 3.69Å; D239-R283 IonicContact OD2-NH1 3.31Å; D239-R283 IonicContact OD2-NH2 2.7Å; D239-R283 PolarHBondContact OD2-NH2 3.35Å; Q272-R283 PolarHBondContact NE2-O 2.94Å; R283-L285 VanDerWaalsContact C-N 3.27Å; R283-L285 PolarHBondContact O-N 3.5Å; R283-L286 PolarHBondContact O-N 3.36Å; R283-T287 PolarHBondContact O-N 3.4Å; R283-T287 PolarHBondContact O-OG1 2.89Å |
| 284 | P | 91.3 | Very high | 83.8 | Confident | 13 Ų | 13 | 26 Ų | 26 | 8% | 0.084 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -60.4 | -37.6 | 172.7 | -24.9 | 35.3 | 0 | 0 | 0 | 112.7 | W269 P278 T287 L288 L314 | W269-P284 HydrophobicContact CZ3-CB 3.99Å; P278-P284 HydrophobicContact CB-CG 3.59Å; P278-P284 HydrophobicContact CG-CG 4.01Å; P284-T287 PolarHBondContact O-N 3.48Å; P284-L288 WeakPolarHBondContact O-CG 3.12Å; P284-L288 PolarHBondContact O-N 3.16Å; P284-L314 HydrophobicContact CB-CD1 4.17Å |
| 285 | L | 92.9 | Very high | 84.3 | Confident | 1 Ų | 1 | 25.6 Ų | 25.6 | 1% | 0.005 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -66.3 | -41.4 | 177.1 | -66.3 | 172.5 | 0 | 0 | 0 | 111.4 | P281 D282 R283 L288 A289 A311 L314 L315 H321 L323 F327 | P281-L285 WeakPolarHBondContact O-CD1 3.36Å; P281-L285 WeakPolarHBondContact O-CG 3.44Å; D282-L285 WeakPolarHBondContact O-CB 3.26Å; D282-L285 PolarHBondContact O-N 3.36Å; R283-L285 VanDerWaalsContact C-N 3.27Å; R283-L285 PolarHBondContact O-N 3.5Å; L285-L288 PolarHBondContact O-N 3.33Å; L285-A289 PolarHBondContact O-N 3.12Å; L285-A311 HydrophobicContact CD2-CB 4.02Å; L285-L314 HydrophobicContact CD2-CB 4Å; L285-L314 HydrophobicContact CD2-CD1 4.36Å; L285-L315 HydrophobicContact CD1-CD2 3.59Å; L285-L315 HydrophobicContact CD1-CG 4.04Å; L285-L315 HydrophobicContact CD2-CD1 4.23Å; L285-L315 HydrophobicContact CD2-CD2 4.34Å; L285-L315 HydrophobicContact CD2-CG 3.84Å; L285-H321 WeakPolarHBondContact CD1-NE2 3.48Å; L285-L323 HydrophobicContact CB-CD1 3.62Å; L285-F327 HydrophobicContact CB-CE2 4.37Å; L285-F327 HydrophobicContact CD2-CE2 4.39Å; L285-F327 WeakPolarHBondContact O-CZ 3.46Å |
| 286 | L | 92.8 | Very high | 85 | Confident | 7 Ų | 7 | 27.3 Ų | 27.3 | 4% | 0.037 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -62.7 | -43.2 | 174.7 | -171.3 | 71.1 | 0 | 0 | 0 | 111.7 | D282 R283 L288 A289 G290 L369 E372 L374 | D282-L286 WeakPolarHBondContact O-CB 3.19Å; D282-L286 PolarHBondContact O-N 2.96Å; R283-L286 PolarHBondContact O-N 3.36Å; L286-L288 VanDerWaalsContact C-N 3.33Å; L286-L288 PolarHBondContact O-N 3.16Å; L286-A289 WeakPolarHBondContact O-CB 3.4Å; L286-A289 PolarHBondContact O-N 2.85Å; L286-G290 PolarHBondContact O-N 2.76Å; L286-L369 HydrophobicContact CD1-CD1 3.69Å; L286-L369 HydrophobicContact CG-CD1 4.14Å; L286-E372 HydrophobicContact CD1-CB 4.06Å; L286-E372 HydrophobicContact CD1-CG 3.8Å; L286-E372 HydrophobicContact CD2-CG 3.97Å; L286-L374 HydrophobicContact CD2-CD1 4.22Å; L286-L374 HydrophobicContact CD2-CD2 3.33Å; L286-L374 HydrophobicContact CD2-CG 3.97Å |
| 287 | T | 95.4 | Very high | 86.2 | Confident | 0 Ų | 0 | 30 Ų | 30 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -57.9 | -46.3 | 174.6 | -51.2 | 0 | 0 | 0 | 0 | 111.1 | L246 W265 A268 W269 Q272 R283 P284 A289 G290 L291 | L246-T287 HydrophobicContact CD2-CG2 4.49Å; L246-T287 WeakPolarHBondContact CD2-OG1 3.34Å; W265-T287 HydrophobicContact CE3-CG2 4.19Å; W265-T287 WeakPolarHBondContact O-CG2 3.35Å; A268-T287 HydrophobicContact CB-CG2 4.39Å; W269-T287 HydrophobicContact CB-CG2 3.68Å; W269-T287 HydrophobicContact CE3-CG2 4.2Å; Q272-T287 VanDerWaalsContact CD-OG1 3.3Å; Q272-T287 PolarHBondContact NE2-OG1 3.04Å; Q272-T287 PolarHBondContact OE1-OG1 3.19Å; R283-T287 PolarHBondContact O-N 3.4Å; R283-T287 PolarHBondContact O-OG1 2.89Å; P284-T287 PolarHBondContact O-N 3.48Å; T287-A289 VanDerWaalsContact C-N 3.31Å; T287-A289 PolarHBondContact O-N 2.95Å; T287-G290 PolarHBondContact O-N 3.26Å; T287-L291 HydrophobicContact CG2-CD1 4.39Å; T287-L291 WeakPolarHBondContact O-CG 3.38Å; T287-L291 PolarHBondContact O-N 2.97Å |
| 288 | L | 96.7 | Very high | 88 | Confident | 1 Ų | 1 | 28.7 Ų | 28.7 | 1% | 0.005 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -65.2 | -33.7 | 177.6 | -71.5 | 168 | 0 | 0 | 0 | 112.5 | W269 P284 L285 L286 L291 A292 C307 K310 A311 L314 F327 | W269-L288 HydrophobicContact CD2-CD2 4.44Å; W269-L288 HydrophobicContact CE3-CD2 4.17Å; W269-L288 HydrophobicContact CE3-CG 4.09Å; W269-L288 HydrophobicContact CH2-CD1 3.86Å; W269-L288 HydrophobicContact CH2-CD2 4.01Å; W269-L288 HydrophobicContact CH2-CG 4.05Å; W269-L288 HydrophobicContact CZ2-CD2 4.28Å; W269-L288 HydrophobicContact CZ3-CD1 3.78Å; W269-L288 HydrophobicContact CZ3-CD2 3.95Å; W269-L288 HydrophobicContact CZ3-CG 3.65Å; P284-L288 WeakPolarHBondContact O-CG 3.12Å; P284-L288 PolarHBondContact O-N 3.16Å; L285-L288 PolarHBondContact O-N 3.33Å; L286-L288 VanDerWaalsContact C-N 3.33Å; L286-L288 PolarHBondContact O-N 3.16Å; L288-L291 HydrophobicContact CD2-CD1 4.3Å; L288-A292 VanDerWaalsContact O-CB 3.24Å; L288-A292 WeakPolarHBondContact O-CB 3.16Å; L288-A292 PolarHBondContact O-N 3.05Å; L288-C307 HydrophobicContact CD2-CB 4.33Å; L288-K310 HydrophobicContact CD1-CB 4.14Å; L288-K310 HydrophobicContact CD2-CB 4.12Å; L288-K310 HydrophobicContact CD2-CD 4.38Å; L288-A311 HydrophobicContact CB-CB 4.12Å; L288-A311 HydrophobicContact CD1-CB 3.81Å; L288-L314 HydrophobicContact CD1-CD1 3.75Å; L288-F327 HydrophobicContact CB-CE1 4.48Å; L288-F327 HydrophobicContact CB-CZ 4.21Å |
| 289 | A | 96.9 | Very high | 90 | Very high | 1 Ų | 1 | 32.8 Ų | 32.8 | 1% | 0.008 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -64.3 | -46.5 | 173.1 | 0 | 0 | 0 | 0 | 0 | 110.6 | L285 L286 T287 A292 V293 F327 L365 | L285-A289 PolarHBondContact O-N 3.12Å; L286-A289 WeakPolarHBondContact O-CB 3.4Å; L286-A289 PolarHBondContact O-N 2.85Å; T287-A289 VanDerWaalsContact C-N 3.31Å; T287-A289 PolarHBondContact O-N 2.95Å; A289-A292 PolarHBondContact O-N 3.34Å; A289-V293 WeakPolarHBondContact O-CB 3.45Å; A289-V293 VanDerWaalsContact O-CG2 3.27Å; A289-V293 WeakPolarHBondContact O-CG2 3.39Å; A289-V293 PolarHBondContact O-N 3.21Å; A289-F327 HydrophobicContact CB-CE1 4.25Å; A289-F327 HydrophobicContact CB-CZ 3.71Å; A289-L365 HydrophobicContact CB-CD2 4.01Å |
| 290 | G | 97.5 | Very high | 92.1 | Very high | 0 Ų | 0 | 33.4 Ų | 33.4 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -58.9 | -47.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | L286 T287 V293 C294 | L286-G290 PolarHBondContact O-N 2.76Å; T287-G290 PolarHBondContact O-N 3.26Å; G290-V293 PolarHBondContact O-N 3.15Å; G290-C294 PolarHBondContact O-N 3.26Å; G290-C294 PolarHBondContact O-SG 2.82Å |
| 291 | L | 98.3 | Very high | 93.8 | Very high | 11 Ų | 11 | 32.6 Ų | 32.6 | 6% | 0.058 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -58.6 | -51.8 | 174.1 | -71.4 | 172.4 | 0 | 0 | 0 | 111.5 | L262 W265 A266 W269 T287 L288 V293 C294 H295 C307 | L262-L291 HydrophobicContact CD1-CD2 3.71Å; W265-L291 HydrophobicContact CB-CD2 3.53Å; W265-L291 HydrophobicContact CB-CG 3.88Å; A266-L291 HydrophobicContact CB-CD2 4.34Å; W269-L291 HydrophobicContact CB-CD1 4.15Å; W269-L291 HydrophobicContact CG-CD1 4.23Å; T287-L291 HydrophobicContact CG2-CD1 4.39Å; T287-L291 WeakPolarHBondContact O-CG 3.38Å; T287-L291 PolarHBondContact O-N 2.97Å; L288-L291 HydrophobicContact CD2-CD1 4.3Å; L291-V293 VanDerWaalsContact C-N 3.3Å; L291-V293 PolarHBondContact O-N 2.84Å; L291-C294 PolarHBondContact O-N 2.78Å; L291-H295 PolarHBondContact O-CD2 3.12Å; L291-H295 PolarHBondContact O-N 2.94Å; L291-C307 HydrophobicContact CB-CB 4.42Å |
| 292 | A | 98.2 | Very high | 95.5 | Very high | 0 Ų | 0 | 30.9 Ų | 30.9 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -61.3 | -37.5 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | L288 A289 Q296 C307 L365 | L288-A292 VanDerWaalsContact O-CB 3.24Å; L288-A292 WeakPolarHBondContact O-CB 3.16Å; L288-A292 PolarHBondContact O-N 3.05Å; A289-A292 PolarHBondContact O-N 3.34Å; A292-Q296 WeakPolarHBondContact O-CB 3.19Å; A292-Q296 WeakPolarHBondContact O-CG 3.23Å; A292-Q296 PolarHBondContact O-N 3.43Å; A292-Q296 VanDerWaalsContact O-N 3.1Å; A292-Q296 PolarHBondContact O-NE2 2.85Å; A292-C307 HydrophobicContact CB-CB 3.86Å; A292-L365 HydrophobicContact CB-CD1 4.11Å |
| 293 | V | 98.1 | Very high | 96.3 | Very high | 4 Ų | 4 | 31.2 Ų | 31.2 | 2% | 0.024 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -66.6 | -49.4 | 174.5 | 169.7 | 0 | 0 | 0 | 0 | 110.3 | T253 A289 G290 L291 H295 Q296 E297 L365 K366 | T253-V293 HydrophobicContact CG2-CG1 3.95Å; A289-V293 WeakPolarHBondContact O-CB 3.45Å; A289-V293 VanDerWaalsContact O-CG2 3.27Å; A289-V293 WeakPolarHBondContact O-CG2 3.39Å; A289-V293 PolarHBondContact O-N 3.21Å; G290-V293 PolarHBondContact O-N 3.15Å; L291-V293 VanDerWaalsContact C-N 3.3Å; L291-V293 PolarHBondContact O-N 2.84Å; V293-H295 PolarHBondContact O-N 2.86Å; V293-Q296 WeakPolarHBondContact O-CB 3.34Å; V293-Q296 PolarHBondContact O-N 2.87Å; V293-E297 HydrophobicContact CG1-CG 4.37Å; V293-E297 VanDerWaalsContact O-CG 3.26Å; V293-E297 WeakPolarHBondContact O-CG 3.38Å; V293-E297 PolarHBondContact O-N 3.25Å; V293-L365 HydrophobicContact CG2-CB 3.72Å; V293-K366 HydrophobicContact CG1-CB 4.14Å; V293-K366 HydrophobicContact CG1-CD 4.33Å; V293-K366 HydrophobicContact CG1-CG 4.09Å; V293-K366 HydrophobicContact CG2-CB 4.08Å |
| 294 | C | 98.4 | Very high | 96.8 | Very high | 0 Ų | 0 | 29.2 Ų | 29.2 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -62.8 | -42.7 | -179.1 | -64.7 | 0 | 0 | 0 | 0 | 112.1 | L262 G290 L291 Q296 E297 L298 | L262-C294 HydrophobicContact CB-CB 3.96Å; L262-C294 HydrophobicContact CD1-CB 3.93Å; L262-C294 HydrophobicContact CG-CB 4.49Å; G290-C294 PolarHBondContact O-N 3.26Å; G290-C294 PolarHBondContact O-SG 2.82Å; L291-C294 PolarHBondContact O-N 2.78Å; C294-Q296 PolarHBondContact O-N 2.94Å; C294-E297 PolarHBondContact O-N 2.87Å; C294-L298 WeakPolarHBondContact O-CB 3.33Å; C294-L298 WeakPolarHBondContact O-CD1 3.43Å; C294-L298 WeakPolarHBondContact O-CG 3.42Å; C294-L298 PolarHBondContact O-N 2.77Å |
| 295 | H | 98.4 | Very high | 97.1 | Very high | 25 Ų | 25 | 30.5 Ų | 30.5 | 12% | 0.116 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -63.4 | -39 | 175.1 | -77.4 | -68.7 | 0 | 0 | 0 | 112.5 | L262 L291 V293 L298 E299 D300 E303 A304 | L262-H295 WeakPolarHBondContact CD1-NE2 3.49Å; L291-H295 PolarHBondContact O-CD2 3.12Å; L291-H295 PolarHBondContact O-N 2.94Å; V293-H295 PolarHBondContact O-N 2.86Å; H295-L298 CarbonylContact O-C 3.6Å; H295-L298 PolarHBondContact O-N 2.92Å; H295-E299 PolarHBondContact O-N 3.05Å; H295-D300 HydrophobicContact CB-CB 4.35Å; H295-D300 IonicContact ND1-OD2 3.79Å; H295-D300 PolarHBondContact O-N 3.11Å; H295-E303 HydrophobicContact CB-CB 4.35Å; H295-E303 VanDerWaalsContact CE1-CB 3.47Å; H295-E303 WeakPolarHBondContact CE1-CB 3.49Å; H295-E303 WeakPolarHBondContact ND1-CB 3.44Å; H295-A304 HydrophobicContact CB-CB 3.73Å |
| 296 | Q | 96.9 | Very high | 97.4 | Very high | 40 Ų | 40 | 31.8 Ų | 31.8 | 19% | 0.187 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -59.9 | -46.4 | 174.5 | -89 | 169.8 | 98.3 | 0 | 0 | 112.5 | A292 V293 C294 L298 E299 A304 L334 | A292-Q296 WeakPolarHBondContact O-CB 3.19Å; A292-Q296 WeakPolarHBondContact O-CG 3.23Å; A292-Q296 PolarHBondContact O-N 3.43Å; A292-Q296 VanDerWaalsContact O-N 3.1Å; A292-Q296 PolarHBondContact O-NE2 2.85Å; V293-Q296 WeakPolarHBondContact O-CB 3.34Å; V293-Q296 PolarHBondContact O-N 2.87Å; C294-Q296 PolarHBondContact O-N 2.94Å; Q296-L298 VanDerWaalsContact C-N 3.28Å; Q296-L298 PolarHBondContact O-N 2.77Å; Q296-E299 PolarHBondContact O-N 2.68Å; Q296-A304 HydrophobicContact CG-CB 3.82Å; Q296-L334 HydrophobicContact CG-CD1 4.37Å; Q296-L334 HydrophobicContact CG-CD2 3.89Å |
| 297 | E | 97.4 | Very high | 97.6 | Very high | 85 Ų | 85 | 31.7 Ų | 31.7 | 40% | 0.397 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -72.2 | -23.6 | -178.6 | -61.2 | -75.8 | 178.3 | 0 | 0 | 112.3 | Y258 V293 C294 E299 K366 | Y258-E297 HydrophobicContact CD1-CB 4.05Å; Y258-E297 HydrophobicContact CD1-CG 4.05Å; Y258-E297 HydrophobicContact CD2-CB 3.39Å; Y258-E297 HydrophobicContact CD2-CG 3.98Å; Y258-E297 HydrophobicContact CE1-CB 4.27Å; Y258-E297 HydrophobicContact CE1-CG 3.83Å; Y258-E297 HydrophobicContact CE2-CB 3.61Å; Y258-E297 HydrophobicContact CE2-CG 3.72Å; Y258-E297 HydrophobicContact CG-CB 3.64Å; Y258-E297 HydrophobicContact CG-CG 4.15Å; V293-E297 HydrophobicContact CG1-CG 4.37Å; V293-E297 VanDerWaalsContact O-CG 3.26Å; V293-E297 WeakPolarHBondContact O-CG 3.38Å; V293-E297 PolarHBondContact O-N 3.25Å; C294-E297 PolarHBondContact O-N 2.87Å; E297-E299 VanDerWaalsContact C-N 3.31Å; E297-K366 IonicContact OE1-NZ 2.72Å; E297-K366 PolarHBondContact OE1-NZ 3.42Å |
| 298 | L | 97.8 | Very high | 97.7 | Very high | 63 Ų | 63 | 31.7 Ų | 31.7 | 33% | 0.33 | 17% | 0.167 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -92 | 13.1 | 174.2 | -65.6 | 170.3 | 0 | 0 | 0 | 113.2 | R259 L262 C294 H295 Q296 D300 | R259-L298 HydrophobicContact CB-CD2 4.41Å; L262-L298 HydrophobicContact CB-CD1 4.41Å; L262-L298 HydrophobicContact CD2-CD1 3.78Å; C294-L298 WeakPolarHBondContact O-CB 3.33Å; C294-L298 WeakPolarHBondContact O-CD1 3.43Å; C294-L298 WeakPolarHBondContact O-CG 3.42Å; C294-L298 PolarHBondContact O-N 2.77Å; H295-L298 CarbonylContact O-C 3.6Å; H295-L298 PolarHBondContact O-N 2.92Å; Q296-L298 VanDerWaalsContact C-N 3.28Å; Q296-L298 PolarHBondContact O-N 2.77Å; L298-D300 VanDerWaalsContact C-N 3.28Å; L298-D300 PolarHBondContact O-N 2.68Å |
| 299 | E | 97.1 | Very high | 97.7 | Very high | 155 Ų | 155 | 35.3 Ų | 35.3 | 72% | 0.724 | 18% | 0.183 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 59.8 | 31.4 | 177.8 | -54.1 | -170.7 | 157.4 | 0 | 0 | 115.2 | H295 Q296 E297 P301 | H295-E299 PolarHBondContact O-N 3.05Å; Q296-E299 PolarHBondContact O-N 2.68Å; E297-E299 VanDerWaalsContact C-N 3.31Å; E299-P301 WeakPolarHBondContact O-CD 3.36Å |
| 300 | D | 97.6 | Very high | 97.6 | Very high | 62 Ų | 62 | 39.4 Ų | 39.4 | 33% | 0.332 | 20% | 0.201 | S | C | . | . | trans | -109.2 | 76.5 | 173.9 | -169.7 | -9.3 | 0 | 0 | 0 | 111.1 | H295 L298 G302 E303 A304 | H295-D300 HydrophobicContact CB-CB 4.35Å; H295-D300 IonicContact ND1-OD2 3.79Å; H295-D300 PolarHBondContact O-N 3.11Å; L298-D300 VanDerWaalsContact C-N 3.28Å; L298-D300 PolarHBondContact O-N 2.68Å; D300-G302 PolarHBondContact O-N 2.98Å; D300-G302 PolarHBondContact OD1-N 2.92Å; D300-E303 PolarHBondContact OD1-N 3.02Å; D300-E303 VanDerWaalsContact OD2-CG 3.24Å; D300-E303 WeakPolarHBondContact OD2-CG 3.45Å; D300-A304 WeakPolarHBondContact O-CB 3.49Å; D300-A304 PolarHBondContact O-N 3.19Å | ||
| 301 | P | 96.9 | Very high | 97.5 | Very high | 21 Ų | 21 | 39.4 Ų | 39.4 | 14% | 0.136 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -66.9 | -23.1 | -177.4 | 26.8 | -34.6 | 0 | 0 | 0 | 113.1 | E299 R305 L334 L338 | E299-P301 WeakPolarHBondContact O-CD 3.36Å; P301-R305 VanDerWaalsContact O-CB 3.31Å; P301-R305 WeakPolarHBondContact O-CB 3.39Å; P301-R305 PolarHBondContact O-N 3.1Å; P301-L334 HydrophobicContact CB-CD2 3.91Å; P301-L338 HydrophobicContact CB-CD1 4.43Å; P301-L338 HydrophobicContact CB-CD2 4.16Å; P301-L338 HydrophobicContact CB-CG 4.24Å; P301-L338 HydrophobicContact CG-CD2 3.91Å |
| 302 | G | 97.9 | Very high | 97.4 | Very high | 33 Ų | 33 | 39.9 Ų | 39.9 | 34% | 0.34 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -66.3 | -56 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | D300 A304 R305 A306 | D300-G302 PolarHBondContact O-N 2.98Å; D300-G302 PolarHBondContact OD1-N 2.92Å; G302-A304 VanDerWaalsContact C-N 3.34Å; G302-A304 PolarHBondContact O-N 3.12Å; G302-R305 PolarHBondContact O-N 3.44Å; G302-A306 PolarHBondContact O-N 3.19Å |
| 303 | E | 98 | Very high | 97.1 | Very high | 92 Ų | 92 | 46.2 Ų | 46.2 | 43% | 0.43 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -66.4 | -36.7 | 177.7 | -70.2 | -57.4 | 134.2 | 0 | 0 | 112.1 | H295 D300 R305 A306 C307 | H295-E303 HydrophobicContact CB-CB 4.35Å; H295-E303 VanDerWaalsContact CE1-CB 3.47Å; H295-E303 WeakPolarHBondContact CE1-CB 3.49Å; H295-E303 WeakPolarHBondContact ND1-CB 3.44Å; D300-E303 PolarHBondContact OD1-N 3.02Å; D300-E303 VanDerWaalsContact OD2-CG 3.24Å; D300-E303 WeakPolarHBondContact OD2-CG 3.45Å; E303-R305 VanDerWaalsContact C-N 3.31Å; E303-R305 PolarHBondContact O-N 3.05Å; E303-A306 PolarHBondContact O-N 3.39Å; E303-C307 PolarHBondContact O-N 3.45Å; E303-C307 PolarHBondContact O-SG 3.07Å |
| 304 | A | 98.1 | Very high | 96.8 | Very high | 0 Ų | 0 | 50.1 Ų | 50.1 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -59.8 | -42.3 | 174 | 0 | 0 | 0 | 0 | 0 | 112.2 | H295 Q296 D300 G302 C307 C308 L334 | H295-A304 HydrophobicContact CB-CB 3.73Å; Q296-A304 HydrophobicContact CG-CB 3.82Å; D300-A304 WeakPolarHBondContact O-CB 3.49Å; D300-A304 PolarHBondContact O-N 3.19Å; G302-A304 VanDerWaalsContact C-N 3.34Å; G302-A304 PolarHBondContact O-N 3.12Å; A304-C307 PolarHBondContact O-N 3.27Å; A304-C308 PolarHBondContact O-N 2.94Å; A304-C308 VanDerWaalsContact O-N 3.14Å; A304-C308 PolarHBondContact O-SG 3.15Å; A304-L334 HydrophobicContact CB-CD1 3.77Å; A304-L334 HydrophobicContact CB-CD2 4.16Å |
| 305 | R | 98 | Very high | 96.5 | Very high | 40 Ų | 40 | 50.1 Ų | 50.1 | 15% | 0.151 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -65.8 | -43.7 | 176.8 | -175.1 | -175.2 | 171 | -75.9 | -1.3 | 110.5 | P301 G302 E303 C307 C308 E309 H331 L334 S335 L338 | P301-R305 VanDerWaalsContact O-CB 3.31Å; P301-R305 WeakPolarHBondContact O-CB 3.39Å; P301-R305 PolarHBondContact O-N 3.1Å; G302-R305 PolarHBondContact O-N 3.44Å; E303-R305 VanDerWaalsContact C-N 3.31Å; E303-R305 PolarHBondContact O-N 3.05Å; R305-C307 VanDerWaalsContact C-N 3.27Å; R305-C307 PolarHBondContact O-N 3.31Å; R305-C308 WeakPolarHBondContact O-CB 3.25Å; R305-C308 PolarHBondContact O-N 2.8Å; R305-C308 VanDerWaalsContact O-N 3.09Å; R305-E309 IonicContact CZ-OE2 3.8Å; R305-E309 IonicContact NH1-OE2 3.7Å; R305-E309 PolarHBondContact NH1-OE2 3.03Å; R305-E309 PolarHBondContact O-N 2.83Å; R305-H331 PolarHBondContact NH2-NE2 3.31Å; R305-L334 HydrophobicContact CB-CB 4.08Å; R305-L334 HydrophobicContact CB-CD1 4.42Å; R305-L334 HydrophobicContact CG-CB 4.42Å; R305-S335 PolarHBondContact NE-OG 2.85Å; R305-L338 HydrophobicContact CB-CD1 4.07Å |
| 306 | A | 97.9 | Very high | 96 | Very high | 28 Ų | 28 | 50.4 Ų | 50.4 | 23% | 0.231 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -59.8 | -37.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | G302 E303 E309 K310 | G302-A306 PolarHBondContact O-N 3.19Å; E303-A306 PolarHBondContact O-N 3.39Å; A306-E309 PolarHBondContact O-N 3.31Å; A306-K310 WeakPolarHBondContact O-CG 3.31Å; A306-K310 PolarHBondContact O-N 2.99Å |
| 307 | C | 97.8 | Very high | 95.3 | Very high | 5 Ų | 5 | 56.1 Ų | 56.1 | 3% | 0.034 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -63.2 | -44.5 | 172.8 | -66.8 | 0 | 0 | 0 | 0 | 112 | L288 L291 A292 E303 A304 R305 E309 K310 A311 | L288-C307 HydrophobicContact CD2-CB 4.33Å; L291-C307 HydrophobicContact CB-CB 4.42Å; A292-C307 HydrophobicContact CB-CB 3.86Å; E303-C307 PolarHBondContact O-N 3.45Å; E303-C307 PolarHBondContact O-SG 3.07Å; A304-C307 PolarHBondContact O-N 3.27Å; R305-C307 VanDerWaalsContact C-N 3.27Å; R305-C307 PolarHBondContact O-N 3.31Å; C307-E309 VanDerWaalsContact C-N 3.35Å; C307-K310 PolarHBondContact O-N 3.19Å; C307-A311 WeakPolarHBondContact O-CB 3.34Å; C307-A311 PolarHBondContact O-N 2.99Å |
| 308 | C | 97.4 | Very high | 94.4 | Very high | 0 Ų | 0 | 57 Ų | 57 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -63.5 | -41.5 | 176.3 | -61.6 | 0 | 0 | 0 | 0 | 111.6 | A304 R305 A311 L312 F327 H331 | A304-C308 PolarHBondContact O-N 2.94Å; A304-C308 VanDerWaalsContact O-N 3.14Å; A304-C308 PolarHBondContact O-SG 3.15Å; R305-C308 WeakPolarHBondContact O-CB 3.25Å; R305-C308 PolarHBondContact O-N 2.8Å; R305-C308 VanDerWaalsContact O-N 3.09Å; C308-A311 PolarHBondContact O-N 3.37Å; C308-L312 VanDerWaalsContact O-CG 3.27Å; C308-L312 WeakPolarHBondContact O-CG 3.14Å; C308-L312 PolarHBondContact O-N 3.21Å; C308-F327 HydrophobicContact CB-CD1 4.3Å; C308-H331 HydrophobicContact CB-CB 3.93Å |
| 309 | E | 96.8 | Very high | 93.2 | Very high | 76 Ų | 76 | 56.9 Ų | 56.9 | 36% | 0.355 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -61.7 | -46.8 | 178.1 | -175.1 | 167.4 | -176 | 0 | 0 | 111.5 | R305 A306 C307 A311 L312 Q313 | R305-E309 IonicContact CZ-OE2 3.8Å; R305-E309 IonicContact NH1-OE2 3.7Å; R305-E309 PolarHBondContact NH1-OE2 3.03Å; R305-E309 PolarHBondContact O-N 2.83Å; A306-E309 PolarHBondContact O-N 3.31Å; C307-E309 VanDerWaalsContact C-N 3.35Å; E309-A311 VanDerWaalsContact C-N 3.31Å; E309-A311 PolarHBondContact O-N 2.81Å; E309-L312 PolarHBondContact O-N 2.85Å; E309-Q313 WeakPolarHBondContact O-CG 3.42Å; E309-Q313 PolarHBondContact O-N 3.28Å |
| 310 | K | 95.7 | Very high | 92.6 | Very high | 88 Ų | 88 | 56.1 Ų | 56.1 | 38% | 0.383 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -58 | -42.9 | 172.7 | -71.7 | 168.6 | -174.5 | 168.3 | 0 | 111.7 | L288 A306 C307 Q313 L314 | L288-K310 HydrophobicContact CD1-CB 4.14Å; L288-K310 HydrophobicContact CD2-CB 4.12Å; L288-K310 HydrophobicContact CD2-CD 4.38Å; A306-K310 WeakPolarHBondContact O-CG 3.31Å; A306-K310 PolarHBondContact O-N 2.99Å; C307-K310 PolarHBondContact O-N 3.19Å; K310-Q313 PolarHBondContact O-N 3.21Å; K310-L314 WeakPolarHBondContact O-CG 3.25Å; K310-L314 PolarHBondContact O-N 2.98Å |
| 311 | A | 95.1 | Very high | 92.1 | Very high | 0 Ų | 0 | 54.6 Ų | 54.6 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -64.7 | -42 | 179.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | L285 L288 C307 C308 E309 Q313 L314 L315 F327 | L285-A311 HydrophobicContact CD2-CB 4.02Å; L288-A311 HydrophobicContact CB-CB 4.12Å; L288-A311 HydrophobicContact CD1-CB 3.81Å; C307-A311 WeakPolarHBondContact O-CB 3.34Å; C307-A311 PolarHBondContact O-N 2.99Å; C308-A311 PolarHBondContact O-N 3.37Å; E309-A311 VanDerWaalsContact C-N 3.31Å; E309-A311 PolarHBondContact O-N 2.81Å; A311-Q313 VanDerWaalsContact C-N 3.33Å; A311-Q313 PolarHBondContact O-N 3.02Å; A311-L314 PolarHBondContact O-N 3.48Å; A311-L315 WeakPolarHBondContact O-CB 3.32Å; A311-L315 WeakPolarHBondContact O-CG 3.4Å; A311-L315 PolarHBondContact O-N 3.46Å; A311-F327 HydrophobicContact CB-CD1 3.67Å; A311-F327 HydrophobicContact CB-CD2 3.81Å; A311-F327 HydrophobicContact CB-CE1 3.51Å; A311-F327 HydrophobicContact CB-CE2 3.67Å; A311-F327 HydrophobicContact CB-CG 3.83Å; A311-F327 HydrophobicContact CB-CZ 3.51Å |
| 312 | L | 95 | Very high | 91.7 | Very high | 21 Ų | 21 | 58.5 Ų | 58.5 | 11% | 0.11 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -65.4 | -35.6 | 176.6 | -68.3 | 174.3 | 0 | 0 | 0 | 112.2 | C308 E309 L315 G316 L324 F327 L328 H331 | C308-L312 VanDerWaalsContact O-CG 3.27Å; C308-L312 WeakPolarHBondContact O-CG 3.14Å; C308-L312 PolarHBondContact O-N 3.21Å; E309-L312 PolarHBondContact O-N 2.85Å; L312-L315 HydrophobicContact CD2-CD1 4.46Å; L312-L315 PolarHBondContact O-N 3Å; L312-G316 PolarHBondContact O-N 3.02Å; L312-L324 HydrophobicContact CD2-CD1 3.76Å; L312-F327 HydrophobicContact CD2-CB 3.91Å; L312-F327 HydrophobicContact CG-CB 4.33Å; L312-L328 HydrophobicContact CD1-CD2 3.96Å; L312-L328 HydrophobicContact CD2-CD2 3.58Å; L312-L328 HydrophobicContact CD2-CG 3.77Å; L312-L328 HydrophobicContact CG-CD2 4.44Å; L312-H331 HydrophobicContact CD1-CB 3.93Å |
| 313 | Q | 93.4 | Very high | 91.4 | Very high | 133 Ų | 133 | 57.8 Ų | 57.8 | 62% | 0.621 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -63.4 | -43.5 | 172.2 | -70.1 | 171.2 | 7.8 | 0 | 0 | 111.7 | E309 K310 A311 L315 G316 | E309-Q313 WeakPolarHBondContact O-CG 3.42Å; E309-Q313 PolarHBondContact O-N 3.28Å; K310-Q313 PolarHBondContact O-N 3.21Å; A311-Q313 VanDerWaalsContact C-N 3.33Å; A311-Q313 PolarHBondContact O-N 3.02Å; Q313-L315 VanDerWaalsContact C-N 3.32Å; Q313-L315 PolarHBondContact O-N 3.48Å; Q313-G316 PolarHBondContact O-N 3.39Å |
| 314 | L | 91.3 | Very high | 91.3 | Very high | 86 Ų | 86 | 53.4 Ų | 53.4 | 45% | 0.45 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -66.4 | -33 | 176.1 | -68.5 | 179.1 | 0 | 0 | 0 | 113 | W269 P284 L285 L288 K310 A311 G316 | W269-L314 HydrophobicContact CH2-CD1 4.28Å; P284-L314 HydrophobicContact CB-CD1 4.17Å; L285-L314 HydrophobicContact CD2-CB 4Å; L285-L314 HydrophobicContact CD2-CD1 4.36Å; L288-L314 HydrophobicContact CD1-CD1 3.75Å; K310-L314 WeakPolarHBondContact O-CG 3.25Å; K310-L314 PolarHBondContact O-N 2.98Å; A311-L314 PolarHBondContact O-N 3.48Å; L314-G316 VanDerWaalsContact C-N 3.32Å |
| 315 | L | 91.4 | Very high | 91.1 | Very high | 0 Ų | 0 | 53.7 Ų | 53.7 | 0% | 0 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -72.2 | -26.4 | 175.3 | -75.7 | 165.4 | 0 | 0 | 0 | 112.2 | L285 A311 L312 Q313 D317 K318 H321 L324 F327 | L285-L315 HydrophobicContact CD1-CD2 3.59Å; L285-L315 HydrophobicContact CD1-CG 4.04Å; L285-L315 HydrophobicContact CD2-CD1 4.23Å; L285-L315 HydrophobicContact CD2-CD2 4.34Å; L285-L315 HydrophobicContact CD2-CG 3.84Å; A311-L315 WeakPolarHBondContact O-CB 3.32Å; A311-L315 WeakPolarHBondContact O-CG 3.4Å; A311-L315 PolarHBondContact O-N 3.46Å; L312-L315 HydrophobicContact CD2-CD1 4.46Å; L312-L315 PolarHBondContact O-N 3Å; Q313-L315 VanDerWaalsContact C-N 3.32Å; Q313-L315 PolarHBondContact O-N 3.48Å; L315-D317 PolarHBondContact O-N 3.39Å; L315-K318 VanDerWaalsContact O-CB 3.22Å; L315-K318 WeakPolarHBondContact O-CB 3.4Å; L315-K318 WeakPolarHBondContact O-CD 3.36Å; L315-K318 WeakPolarHBondContact O-CG 3.35Å; L315-K318 PolarHBondContact O-N 3.18Å; L315-H321 HydrophobicContact CD2-CB 3.58Å; L315-L324 HydrophobicContact CB-CD1 4.35Å; L315-L324 HydrophobicContact CD1-CB 4.21Å; L315-L324 HydrophobicContact CD1-CD1 3.92Å; L315-F327 HydrophobicContact CD1-CD2 4Å |
| 316 | G | 88.4 | Confident | 91 | Very high | 31 Ų | 31 | 52 Ų | 52 | 32% | 0.32 | 28% | 0.283 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 51.4 | -130 | 178.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | L312 Q313 L314 R348 | L312-G316 PolarHBondContact O-N 3.02Å; Q313-G316 PolarHBondContact O-N 3.39Å; L314-G316 VanDerWaalsContact C-N 3.32Å; G316-R348 PolarHBondContact O-NH1 2.77Å; G316-R348 PolarHBondContact O-NH2 2.89Å |
| 317 | D | 82 | Confident | 90.9 | Very high | 159 Ų | 159 | 50.6 Ų | 50.6 | 85% | 0.85 | 27% | 0.272 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.8 | 10.2 | 179.8 | -61 | -37.2 | 0 | 0 | 0 | 114.7 | L315 S319 | L315-D317 PolarHBondContact O-N 3.39Å; D317-S319 PolarHBondContact O-N 3.1Å |
| 318 | K | 78.8 | Confident | 90.9 | Very high | 103 Ų | 103 | 50.5 Ų | 50.5 | 45% | 0.448 | 27% | 0.27 | S | S | . | . | trans | -68.9 | 97 | -175.7 | -62.9 | 169.6 | -174.7 | 167.8 | 0 | 111.6 | L315 L320 L324 | L315-K318 VanDerWaalsContact O-CB 3.22Å; L315-K318 WeakPolarHBondContact O-CB 3.4Å; L315-K318 WeakPolarHBondContact O-CD 3.36Å; L315-K318 WeakPolarHBondContact O-CG 3.35Å; L315-K318 PolarHBondContact O-N 3.18Å; K318-L320 PolarHBondContact O-N 3.19Å; K318-L324 WeakPolarHBondContact O-CD2 3.46Å | ||
| 319 | S | 72.9 | Confident | 90.8 | Very high | 61 Ų | 61 | 53.2 Ų | 53.2 | 43% | 0.427 | 28% | 0.283 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.2 | -20.7 | -177.2 | 56 | 0 | 0 | 0 | 0 | 115.1 | D317 L352 | D317-S319 PolarHBondContact O-N 3.1Å; S319-L352 WeakPolarHBondContact O-CD2 3.35Å |
| 320 | L | 82.9 | Confident | 90.8 | Very high | 140 Ų | 140 | 49.6 Ų | 49.6 | 73% | 0.733 | 27% | 0.267 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.3 | 3.2 | -171.9 | -62.1 | 174.7 | 0 | 0 | 0 | 114.6 | K318 L357 | K318-L320 PolarHBondContact O-N 3.19Å; L320-L357 HydrophobicContact CD2-CD1 4.39Å; L320-L357 HydrophobicContact CD2-CD2 3.93Å |
| 321 | H | 88.4 | Confident | 91 | Very high | 30 Ų | 30 | 45.9 Ų | 45.9 | 14% | 0.139 | 25% | 0.251 | C | S | . | . | trans | -77 | 128.7 | -174.6 | -167 | -75.7 | 0 | 0 | 0 | 111.6 | D282 L285 L315 L323 L324 | D282-H321 IonicContact OD1-NE2 3.09Å; D282-H321 PolarHBondContact OD1-NE2 3.17Å; D282-H321 VanDerWaalsContact OD1-NE2 3.09Å; L285-H321 WeakPolarHBondContact CD1-NE2 3.48Å; L315-H321 HydrophobicContact CD2-CB 3.58Å; H321-L323 VanDerWaalsContact C-N 3.27Å; H321-L323 PolarHBondContact ND1-N 2.85Å; H321-L323 VanDerWaalsContact ND1-N 3.1Å; H321-L323 PolarHBondContact O-N 2.88Å; H321-L323 VanDerWaalsContact O-N 3.16Å; H321-L324 HydrophobicContact CB-CB 4.36Å; H321-L324 VanDerWaalsContact O-CB 3.3Å; H321-L324 WeakPolarHBondContact O-CB 3.47Å; H321-L324 PolarHBondContact O-N 3.09Å | ||
| 322 | P | 89.1 | Confident | 91.1 | Very high | 103 Ų | 103 | 46.8 Ų | 46.8 | 67% | 0.669 | 26% | 0.256 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.5 | -35.8 | -176.1 | -26.8 | 34.2 | 0 | 0 | 0 | 114.6 | L324 P326 | P322-L324 VanDerWaalsContact C-N 3.33Å; P322-L324 PolarHBondContact O-N 3.43Å; P322-P326 VanDerWaalsContact O-CD 3.3Å; P322-P326 WeakPolarHBondContact O-CD 3.17Å |
| 323 | L | 91.5 | Very high | 91.1 | Very high | 17 Ų | 17 | 50.9 Ų | 50.9 | 9% | 0.089 | 27% | 0.27 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -76.7 | -10.7 | 177.8 | -62.6 | 174.5 | 0 | 0 | 0 | 114.6 | L285 H321 P326 F327 L368 | L285-L323 HydrophobicContact CB-CD1 3.62Å; H321-L323 VanDerWaalsContact C-N 3.27Å; H321-L323 PolarHBondContact ND1-N 2.85Å; H321-L323 VanDerWaalsContact ND1-N 3.1Å; H321-L323 PolarHBondContact O-N 2.88Å; H321-L323 VanDerWaalsContact O-N 3.16Å; L323-P326 WeakPolarHBondContact O-CD 3.39Å; L323-F327 HydrophobicContact CB-CD2 3.87Å; L323-F327 HydrophobicContact CB-CE2 3.83Å; L323-F327 HydrophobicContact CD1-CE2 4.28Å; L323-F327 WeakPolarHBondContact O-CD2 3.48Å; L323-F327 PolarHBondContact O-N 2.78Å; L323-F327 VanDerWaalsContact O-N 3.09Å; L323-L368 HydrophobicContact CD2-CB 4.28Å; L323-L368 HydrophobicContact CD2-CD1 3.67Å |
| 324 | L | 94.1 | Very high | 91.3 | Very high | 1 Ų | 1 | 44.8 Ų | 44.8 | 1% | 0.005 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -64.2 | -55.8 | -173.7 | 175 | 62.8 | 0 | 0 | 0 | 112.8 | L312 L315 K318 H321 P322 F327 L328 L352 | L312-L324 HydrophobicContact CD2-CD1 3.76Å; L315-L324 HydrophobicContact CB-CD1 4.35Å; L315-L324 HydrophobicContact CD1-CB 4.21Å; L315-L324 HydrophobicContact CD1-CD1 3.92Å; K318-L324 WeakPolarHBondContact O-CD2 3.46Å; H321-L324 HydrophobicContact CB-CB 4.36Å; H321-L324 VanDerWaalsContact O-CB 3.3Å; H321-L324 WeakPolarHBondContact O-CB 3.47Å; H321-L324 PolarHBondContact O-N 3.09Å; P322-L324 VanDerWaalsContact C-N 3.33Å; P322-L324 PolarHBondContact O-N 3.43Å; L324-F327 PolarHBondContact O-N 3.25Å; L324-L328 HydrophobicContact CD1-CD1 3.83Å; L324-L328 HydrophobicContact CD1-CG 3.96Å; L324-L328 HydrophobicContact CD2-CD1 4.45Å; L324-L328 HydrophobicContact CG-CD1 3.83Å; L324-L328 HydrophobicContact CG-CG 4.37Å; L324-L328 WeakPolarHBondContact O-CG 3.4Å; L324-L328 PolarHBondContact O-N 2.98Å; L324-L352 HydrophobicContact CD2-CD1 3.69Å; L324-L352 HydrophobicContact CD2-CD2 4.32Å; L324-L352 HydrophobicContact CG-CD1 3.91Å |
| 325 | A | 94.8 | Very high | 91.6 | Very high | 6 Ų | 6 | 40.7 Ų | 40.7 | 5% | 0.05 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -59.8 | -44 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | F327 L328 E329 L349 L352 T358 P362 | A325-F327 PolarHBondContact O-N 3.25Å; A325-L328 PolarHBondContact O-N 3.35Å; A325-E329 WeakPolarHBondContact O-CB 3.46Å; A325-E329 PolarHBondContact O-N 3.31Å; A325-L349 HydrophobicContact CB-CD1 4Å; A325-L352 HydrophobicContact CB-CD1 4.25Å; A325-T358 HydrophobicContact CB-CG2 3.87Å; A325-T358 VanDerWaalsContact CB-OG1 3.29Å; A325-T358 WeakPolarHBondContact CB-OG1 3.3Å; A325-P362 HydrophobicContact CB-CB 4.03Å |
| 326 | P | 95.6 | Very high | 91.9 | Very high | 3 Ų | 3 | 49.5 Ų | 49.5 | 2% | 0.019 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -55.4 | -43.6 | 171.7 | -25.5 | 29.1 | 0 | 0 | 0 | 114.6 | P322 L323 A330 P363 L365 L368 | P322-P326 VanDerWaalsContact O-CD 3.3Å; P322-P326 WeakPolarHBondContact O-CD 3.17Å; L323-P326 WeakPolarHBondContact O-CD 3.39Å; P326-A330 WeakPolarHBondContact O-CB 3.33Å; P326-A330 PolarHBondContact O-N 3.13Å; P326-P363 WeakPolarHBondContact CB-O 3.39Å; P326-P363 HydrophobicContact CG-CG 4.24Å; P326-L365 HydrophobicContact CB-CD2 3.69Å; P326-L365 HydrophobicContact CB-CG 4.21Å; P326-L368 HydrophobicContact CB-CD1 3.95Å; P326-L368 HydrophobicContact CG-CD1 3.28Å; P326-L368 HydrophobicContact CG-CG 4.47Å |
| 327 | F | 96.7 | Very high | 92.3 | Very high | 0 Ų | 0 | 55.1 Ų | 55.1 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -68.8 | -39.8 | 177.3 | -84.4 | -59.9 | 0 | 0 | 0 | 112.3 | L285 L288 A289 C308 A311 L312 L315 L323 L324 A325 H331 L365 | L285-F327 HydrophobicContact CB-CE2 4.37Å; L285-F327 HydrophobicContact CD2-CE2 4.39Å; L285-F327 WeakPolarHBondContact O-CZ 3.46Å; L288-F327 HydrophobicContact CB-CE1 4.48Å; L288-F327 HydrophobicContact CB-CZ 4.21Å; A289-F327 HydrophobicContact CB-CE1 4.25Å; A289-F327 HydrophobicContact CB-CZ 3.71Å; C308-F327 HydrophobicContact CB-CD1 4.3Å; A311-F327 HydrophobicContact CB-CD1 3.67Å; A311-F327 HydrophobicContact CB-CD2 3.81Å; A311-F327 HydrophobicContact CB-CE1 3.51Å; A311-F327 HydrophobicContact CB-CE2 3.67Å; A311-F327 HydrophobicContact CB-CG 3.83Å; A311-F327 HydrophobicContact CB-CZ 3.51Å; L312-F327 HydrophobicContact CD2-CB 3.91Å; L312-F327 HydrophobicContact CG-CB 4.33Å; L315-F327 HydrophobicContact CD1-CD2 4Å; L323-F327 HydrophobicContact CB-CD2 3.87Å; L323-F327 HydrophobicContact CB-CE2 3.83Å; L323-F327 HydrophobicContact CD1-CE2 4.28Å; L323-F327 WeakPolarHBondContact O-CD2 3.48Å; L323-F327 PolarHBondContact O-N 2.78Å; L323-F327 VanDerWaalsContact O-N 3.09Å; L324-F327 PolarHBondContact O-N 3.25Å; A325-F327 PolarHBondContact O-N 3.25Å; F327-H331 WeakPolarHBondContact O-CB 3.4Å; F327-H331 PolarHBondContact O-N 3.46Å; F327-L365 HydrophobicContact CD1-CD1 3.86Å; F327-L365 HydrophobicContact CD1-CD2 3.74Å; F327-L365 HydrophobicContact CD1-CG 4.44Å; F327-L365 HydrophobicContact CD2-CD2 4.2Å; F327-L365 HydrophobicContact CE1-CD1 3.92Å; F327-L365 HydrophobicContact CE1-CD2 3.75Å; F327-L365 HydrophobicContact CE2-CD2 4.2Å; F327-L365 HydrophobicContact CG-CD2 3.96Å; F327-L365 HydrophobicContact CZ-CD2 3.98Å |
| 328 | L | 96.6 | Very high | 93 | Very high | 2 Ų | 2 | 50.6 Ų | 50.6 | 1% | 0.01 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -62.1 | -48.7 | 175.4 | -71.7 | 169.7 | 0 | 0 | 0 | 111 | L312 L324 A325 A330 H331 V332 R348 L349 L352 | L312-L328 HydrophobicContact CD1-CD2 3.96Å; L312-L328 HydrophobicContact CD2-CD2 3.58Å; L312-L328 HydrophobicContact CD2-CG 3.77Å; L312-L328 HydrophobicContact CG-CD2 4.44Å; L324-L328 HydrophobicContact CD1-CD1 3.83Å; L324-L328 HydrophobicContact CD1-CG 3.96Å; L324-L328 HydrophobicContact CD2-CD1 4.45Å; L324-L328 HydrophobicContact CG-CD1 3.83Å; L324-L328 HydrophobicContact CG-CG 4.37Å; L324-L328 WeakPolarHBondContact O-CG 3.4Å; L324-L328 PolarHBondContact O-N 2.98Å; A325-L328 PolarHBondContact O-N 3.35Å; L328-A330 PolarHBondContact O-N 3.41Å; L328-H331 PolarHBondContact O-N 2.97Å; L328-V332 WeakPolarHBondContact O-CB 3.49Å; L328-V332 VanDerWaalsContact O-CG2 3.24Å; L328-V332 WeakPolarHBondContact O-CG2 3.38Å; L328-V332 PolarHBondContact O-N 2.88Å; L328-R348 HydrophobicContact CD1-CB 4.2Å; L328-R348 HydrophobicContact CD1-CG 3.88Å; L328-R348 HydrophobicContact CD2-CB 4.32Å; L328-R348 HydrophobicContact CD2-CG 4.47Å; L328-L349 HydrophobicContact CB-CB 4.07Å; L328-L349 HydrophobicContact CB-CD1 4.22Å; L328-L349 HydrophobicContact CD1-CB 4.25Å; L328-L352 HydrophobicContact CD1-CD1 3.72Å |
| 329 | E | 96.8 | Very high | 93.8 | Very high | 57 Ų | 57 | 49.1 Ų | 49.1 | 27% | 0.266 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -57.7 | -48.4 | 177.2 | 176.1 | 60.8 | -147.9 | 0 | 0 | 111.7 | A325 H331 V332 R333 L349 P362 | A325-E329 WeakPolarHBondContact O-CB 3.46Å; A325-E329 PolarHBondContact O-N 3.31Å; E329-H331 PolarHBondContact O-N 3.31Å; E329-V332 PolarHBondContact O-N 2.87Å; E329-R333 WeakPolarHBondContact O-CB 3.38Å; E329-R333 PolarHBondContact O-N 3.48Å; E329-R333 IonicContact OE1-NH1 3.85Å; E329-L349 HydrophobicContact CB-CD2 4.16Å; E329-L349 VanDerWaalsContact OE2-CD2 3.31Å; E329-L349 WeakPolarHBondContact OE2-CD2 3.18Å; E329-P362 HydrophobicContact CB-CG 3.6Å; E329-P362 HydrophobicContact CG-CG 3.78Å |
| 330 | A | 97.3 | Very high | 95 | Very high | 1 Ų | 1 | 50 Ų | 50 | 1% | 0.008 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -61.5 | -44.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | P326 L328 V332 R333 L334 L365 | P326-A330 WeakPolarHBondContact O-CB 3.33Å; P326-A330 PolarHBondContact O-N 3.13Å; L328-A330 PolarHBondContact O-N 3.41Å; A330-V332 PolarHBondContact O-N 2.99Å; A330-R333 PolarHBondContact O-N 2.98Å; A330-L334 VanDerWaalsContact O-CB 3.29Å; A330-L334 WeakPolarHBondContact O-CB 3.36Å; A330-L334 WeakPolarHBondContact O-CD1 3.02Å; A330-L334 WeakPolarHBondContact O-CG 3.36Å; A330-L334 PolarHBondContact O-N 3.21Å; A330-L365 HydrophobicContact CB-CD1 3.65Å; A330-L365 HydrophobicContact CB-CG 4.31Å |
| 331 | H | 97.9 | Very high | 95.5 | Very high | 10 Ų | 10 | 48.5 Ų | 48.5 | 5% | 0.046 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -62.7 | -42.1 | 178.8 | -174.8 | -97.8 | 0 | 0 | 0 | 112.4 | R305 C308 L312 F327 L328 E329 S335 S345 | R305-H331 PolarHBondContact NH2-NE2 3.31Å; C308-H331 HydrophobicContact CB-CB 3.93Å; L312-H331 HydrophobicContact CD1-CB 3.93Å; F327-H331 WeakPolarHBondContact O-CB 3.4Å; F327-H331 PolarHBondContact O-N 3.46Å; L328-H331 PolarHBondContact O-N 2.97Å; E329-H331 PolarHBondContact O-N 3.31Å; H331-S335 PolarHBondContact CE1-OG 3.48Å; H331-S335 WeakPolarHBondContact O-CB 3.16Å; H331-S335 PolarHBondContact O-N 2.83Å; H331-S335 PolarHBondContact O-OG 3.42Å; H331-S345 PolarHBondContact CE1-OG 2.91Å; H331-S345 PolarHBondContact ND1-OG 2.92Å |
| 332 | V | 97.2 | Very high | 95.9 | Very high | 18 Ų | 18 | 48.8 Ų | 48.8 | 11% | 0.109 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -61.3 | -51.3 | 176.1 | 166 | 0 | 0 | 0 | 0 | 110.7 | L328 E329 A330 L334 S335 W336 K342 E346 | L328-V332 WeakPolarHBondContact O-CB 3.49Å; L328-V332 VanDerWaalsContact O-CG2 3.24Å; L328-V332 WeakPolarHBondContact O-CG2 3.38Å; L328-V332 PolarHBondContact O-N 2.88Å; E329-V332 PolarHBondContact O-N 2.87Å; A330-V332 PolarHBondContact O-N 2.99Å; V332-L334 PolarHBondContact O-N 3.44Å; V332-S335 PolarHBondContact O-N 3.32Å; V332-W336 PolarHBondContact O-N 3.01Å; V332-K342 HydrophobicContact CG1-CD 4.23Å; V332-E346 HydrophobicContact CB-CG 4.21Å; V332-E346 HydrophobicContact CG1-CG 3.58Å; V332-E346 HydrophobicContact CG2-CB 4.35Å; V332-E346 HydrophobicContact CG2-CG 3.52Å |
| 333 | R | 96.9 | Very high | 96.1 | Very high | 108 Ų | 108 | 53 Ų | 53 | 41% | 0.408 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -60.4 | -45.1 | 179.1 | -177.8 | 177.9 | 62.1 | -106.3 | 0.9 | 112.2 | E329 A330 W336 R337 | E329-R333 WeakPolarHBondContact O-CB 3.38Å; E329-R333 PolarHBondContact O-N 3.48Å; E329-R333 IonicContact OE1-NH1 3.85Å; A330-R333 PolarHBondContact O-N 2.98Å; R333-W336 PolarHBondContact O-N 3.21Å; R333-R337 PolarHBondContact O-N 2.84Å |
| 334 | L | 97.5 | Very high | 96.3 | Very high | 4 Ų | 4 | 60.1 Ų | 60.1 | 2% | 0.021 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -67.8 | -40.5 | 179.3 | -72.1 | 166.9 | 0 | 0 | 0 | 112 | Q296 P301 A304 R305 A330 V332 W336 R337 L338 | Q296-L334 HydrophobicContact CG-CD1 4.37Å; Q296-L334 HydrophobicContact CG-CD2 3.89Å; P301-L334 HydrophobicContact CB-CD2 3.91Å; A304-L334 HydrophobicContact CB-CD1 3.77Å; A304-L334 HydrophobicContact CB-CD2 4.16Å; R305-L334 HydrophobicContact CB-CB 4.08Å; R305-L334 HydrophobicContact CB-CD1 4.42Å; R305-L334 HydrophobicContact CG-CB 4.42Å; A330-L334 VanDerWaalsContact O-CB 3.29Å; A330-L334 WeakPolarHBondContact O-CB 3.36Å; A330-L334 WeakPolarHBondContact O-CD1 3.02Å; A330-L334 WeakPolarHBondContact O-CG 3.36Å; A330-L334 PolarHBondContact O-N 3.21Å; V332-L334 PolarHBondContact O-N 3.44Å; L334-W336 VanDerWaalsContact C-N 3.35Å; L334-R337 PolarHBondContact O-N 3.26Å; L334-L338 WeakPolarHBondContact O-CB 3.35Å; L334-L338 WeakPolarHBondContact O-CG 3.25Å; L334-L338 PolarHBondContact O-N 3.18Å |
| 335 | S | 97.5 | Very high | 96.3 | Very high | 0 Ų | 0 | 60.7 Ų | 60.7 | 0% | 0 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -64.7 | -39.5 | 175.7 | -61.7 | 0 | 0 | 0 | 0 | 111.6 | R305 H331 V332 L338 G339 L340 | R305-S335 PolarHBondContact NE-OG 2.85Å; H331-S335 PolarHBondContact CE1-OG 3.48Å; H331-S335 WeakPolarHBondContact O-CB 3.16Å; H331-S335 PolarHBondContact O-N 2.83Å; H331-S335 PolarHBondContact O-OG 3.42Å; V332-S335 PolarHBondContact O-N 3.32Å; S335-L338 PolarHBondContact O-N 3.21Å; S335-G339 PolarHBondContact O-N 3.45Å; S335-L340 PolarHBondContact O-N 3.18Å |
| 336 | W | 97 | Very high | 96.3 | Very high | 186 Ų | 186 | 63.9 Ų | 63.9 | 71% | 0.705 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -58.2 | -49.1 | 170.9 | -179.3 | -85.1 | 0 | 0 | 0 | 111.4 | V332 R333 L334 L338 G339 K342 | V332-W336 PolarHBondContact O-N 3.01Å; R333-W336 PolarHBondContact O-N 3.21Å; L334-W336 VanDerWaalsContact C-N 3.35Å; W336-L338 VanDerWaalsContact C-N 3.25Å; W336-L338 PolarHBondContact O-N 3.37Å; W336-G339 PolarHBondContact O-N 3.46Å; W336-G339 VanDerWaalsContact O-N 3.16Å; W336-K342 HydrophobicContact CB-CD 4.33Å; W336-K342 HydrophobicContact CE3-CD 4.32Å; W336-K342 VanDerWaalsContact CE3-CE 3.41Å; W336-K342 VanDerWaalsContact CZ3-NZ 3.34Å |
| 337 | R | 96.5 | Very high | 96.3 | Very high | 148 Ų | 148 | 66.5 Ų | 66.5 | 56% | 0.558 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -59.8 | -34.2 | 179.4 | -176.3 | 174.9 | 178.9 | 177.7 | -0.3 | 112.8 | R333 L334 | R333-R337 PolarHBondContact O-N 2.84Å; L334-R337 PolarHBondContact O-N 3.26Å |
| 338 | L | 97.1 | Very high | 96.2 | Very high | 65 Ų | 65 | 69.7 Ų | 69.7 | 34% | 0.34 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -90 | -4.7 | -179.9 | -69.5 | 170.1 | 0 | 0 | 0 | 114.1 | P301 R305 L334 S335 W336 L340 | P301-L338 HydrophobicContact CB-CD1 4.43Å; P301-L338 HydrophobicContact CB-CD2 4.16Å; P301-L338 HydrophobicContact CB-CG 4.24Å; P301-L338 HydrophobicContact CG-CD2 3.91Å; R305-L338 HydrophobicContact CB-CD1 4.07Å; L334-L338 WeakPolarHBondContact O-CB 3.35Å; L334-L338 WeakPolarHBondContact O-CG 3.25Å; L334-L338 PolarHBondContact O-N 3.18Å; S335-L338 PolarHBondContact O-N 3.21Å; W336-L338 VanDerWaalsContact C-N 3.25Å; W336-L338 PolarHBondContact O-N 3.37Å; L338-L340 VanDerWaalsContact C-N 3.29Å; L338-L340 HydrophobicContact CB-CD1 3.85Å; L338-L340 HydrophobicContact CB-CG 3.88Å; L338-L340 HydrophobicContact CD1-CD1 3.99Å; L338-L340 PolarHBondContact O-N 3.47Å |
| 339 | G | 96.4 | Very high | 96.1 | Very high | 71 Ų | 71 | 70.1 Ų | 70.1 | 73% | 0.732 | 34% | 0.337 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68.2 | 25.5 | -174.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | S335 W336 | S335-G339 PolarHBondContact O-N 3.45Å; W336-G339 PolarHBondContact O-N 3.46Å; W336-G339 VanDerWaalsContact O-N 3.16Å |
| 340 | L | 96.9 | Very high | 96 | Very high | 80 Ų | 80 | 72.4 Ų | 72.4 | 42% | 0.419 | 35% | 0.348 | S | S | . | . | trans | -96.8 | 162.5 | -179 | -63.5 | 174.8 | 0 | 0 | 0 | 112 | S335 L338 | S335-L340 PolarHBondContact O-N 3.18Å; L338-L340 VanDerWaalsContact C-N 3.29Å; L338-L340 HydrophobicContact CB-CD1 3.85Å; L338-L340 HydrophobicContact CB-CG 3.88Å; L338-L340 HydrophobicContact CD1-CD1 3.99Å; L338-L340 PolarHBondContact O-N 3.47Å | ||
| 341 | D | 94.6 | Very high | 95.8 | Very high | 109 Ų | 109 | 74.9 Ų | 74.9 | 58% | 0.583 | 37% | 0.368 | S | S | * | . | trans | -66.6 | 140.7 | 175.5 | -171.4 | 27.1 | 0 | 0 | 0 | 111.6 | R343 | D341-R343 VanDerWaalsContact OD1-CG 3.29Å; D341-R343 WeakPolarHBondContact OD1-CG 3.25Å; D341-R343 PolarHBondContact OD1-N 2.74Å; D341-R343 VanDerWaalsContact OD1-N 3.14Å | ||
| 342 | K | 95.4 | Very high | 95.5 | Very high | 35 Ų | 35 | 75 Ų | 75 | 15% | 0.152 | 37% | 0.369 | C | S | . | . | trans | -140.9 | -2.5 | -173.9 | 59 | 179 | -171.9 | -81.7 | 0 | 113.3 | V332 W336 Q344 S345 E346 | V332-K342 HydrophobicContact CG1-CD 4.23Å; W336-K342 HydrophobicContact CB-CD 4.33Å; W336-K342 HydrophobicContact CE3-CD 4.32Å; W336-K342 VanDerWaalsContact CE3-CE 3.41Å; W336-K342 VanDerWaalsContact CZ3-NZ 3.34Å; K342-Q344 VanDerWaalsContact C-N 3.28Å; K342-Q344 PolarHBondContact O-N 3.39Å; K342-S345 PolarHBondContact O-N 3.1Å; K342-E346 HydrophobicContact CB-CG 4.36Å; K342-E346 HydrophobicContact CD-CG 4.28Å; K342-E346 WeakPolarHBondContact CD-OE1 3.44Å; K342-E346 WeakPolarHBondContact CE-OE1 3.26Å; K342-E346 HydrophobicContact CG-CG 4.16Å; K342-E346 WeakPolarHBondContact O-CG 3.17Å; K342-E346 PolarHBondContact O-N 2.99Å | ||
| 343 | R | 95.2 | Very high | 95.3 | Very high | 193 Ų | 193 | 77 Ų | 77 | 73% | 0.728 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -54.3 | -42.7 | -171.8 | -71.8 | 170.8 | 177.4 | -175.1 | 1.2 | 112.9 | D341 A347 | D341-R343 VanDerWaalsContact OD1-CG 3.29Å; D341-R343 WeakPolarHBondContact OD1-CG 3.25Å; D341-R343 PolarHBondContact OD1-N 2.74Å; D341-R343 VanDerWaalsContact OD1-N 3.14Å; R343-A347 VanDerWaalsContact O-CB 3.3Å; R343-A347 WeakPolarHBondContact O-CB 3.12Å; R343-A347 PolarHBondContact O-N 2.97Å |
| 344 | Q | 93.7 | Very high | 95.1 | Very high | 165 Ų | 165 | 78.8 Ų | 78.8 | 77% | 0.771 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -66 | -43.9 | -179.7 | -171 | -179.3 | 16.6 | 0 | 0 | 112 | K342 R348 | K342-Q344 VanDerWaalsContact C-N 3.28Å; K342-Q344 PolarHBondContact O-N 3.39Å; Q344-R348 WeakPolarHBondContact O-CB 3.2Å; Q344-R348 PolarHBondContact O-N 2.91Å; Q344-R348 VanDerWaalsContact O-N 3.08Å |
| 345 | S | 94.4 | Very high | 94.8 | Very high | 13 Ų | 13 | 81.7 Ų | 81.7 | 9% | 0.091 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -68.5 | -40 | 177.9 | -56.5 | 0 | 0 | 0 | 0 | 111.9 | H331 K342 R348 L349 | H331-S345 PolarHBondContact CE1-OG 2.91Å; H331-S345 PolarHBondContact ND1-OG 2.92Å; K342-S345 PolarHBondContact O-N 3.1Å; S345-R348 PolarHBondContact O-N 3.25Å; S345-L349 WeakPolarHBondContact O-CB 3.27Å; S345-L349 PolarHBondContact O-N 2.81Å |
| 346 | E | 96.1 | Very high | 94.3 | Very high | 73 Ų | 73 | 84.8 Ų | 84.8 | 34% | 0.341 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -61.6 | -51.1 | 175.4 | -73.7 | -178.1 | 151 | 0 | 0 | 111.5 | V332 K342 R348 L349 Q350 | V332-E346 HydrophobicContact CB-CG 4.21Å; V332-E346 HydrophobicContact CG1-CG 3.58Å; V332-E346 HydrophobicContact CG2-CB 4.35Å; V332-E346 HydrophobicContact CG2-CG 3.52Å; K342-E346 HydrophobicContact CB-CG 4.36Å; K342-E346 HydrophobicContact CD-CG 4.28Å; K342-E346 WeakPolarHBondContact CD-OE1 3.44Å; K342-E346 WeakPolarHBondContact CE-OE1 3.26Å; K342-E346 HydrophobicContact CG-CG 4.16Å; K342-E346 WeakPolarHBondContact O-CG 3.17Å; K342-E346 PolarHBondContact O-N 2.99Å; E346-R348 VanDerWaalsContact C-N 3.28Å; E346-R348 PolarHBondContact O-N 2.89Å; E346-L349 PolarHBondContact O-N 3.01Å; E346-Q350 WeakPolarHBondContact O-CB 3.02Å; E346-Q350 PolarHBondContact O-N 2.95Å |
| 347 | A | 95.1 | Very high | 93.9 | Very high | 59 Ų | 59 | 80.1 Ų | 80.1 | 49% | 0.488 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -60 | -40.6 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | R343 Q350 A351 | R343-A347 VanDerWaalsContact O-CB 3.3Å; R343-A347 WeakPolarHBondContact O-CB 3.12Å; R343-A347 PolarHBondContact O-N 2.97Å; A347-Q350 PolarHBondContact O-N 3.29Å; A347-A351 WeakPolarHBondContact O-CB 3.37Å; A347-A351 PolarHBondContact O-N 3.08Å |
| 348 | R | 94.3 | Very high | 93.5 | Very high | 67 Ų | 67 | 74 Ų | 74 | 25% | 0.253 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -67.8 | -39.8 | 177.4 | -170.5 | 174.9 | 175.4 | 179.9 | -0 | 112.2 | G316 L328 Q344 S345 E346 A351 L352 | G316-R348 PolarHBondContact O-NH1 2.77Å; G316-R348 PolarHBondContact O-NH2 2.89Å; L328-R348 HydrophobicContact CD1-CB 4.2Å; L328-R348 HydrophobicContact CD1-CG 3.88Å; L328-R348 HydrophobicContact CD2-CB 4.32Å; L328-R348 HydrophobicContact CD2-CG 4.47Å; Q344-R348 WeakPolarHBondContact O-CB 3.2Å; Q344-R348 PolarHBondContact O-N 2.91Å; Q344-R348 VanDerWaalsContact O-N 3.08Å; S345-R348 PolarHBondContact O-N 3.25Å; E346-R348 VanDerWaalsContact C-N 3.28Å; E346-R348 PolarHBondContact O-N 2.89Å; R348-A351 PolarHBondContact O-N 3.48Å; R348-L352 WeakPolarHBondContact O-CG 3.35Å; R348-L352 PolarHBondContact O-N 2.85Å |
| 349 | L | 94.3 | Very high | 93.1 | Very high | 10 Ų | 10 | 74.9 Ų | 74.9 | 5% | 0.052 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -65.4 | -44.5 | 176.1 | -179.5 | 59.4 | 0 | 0 | 0 | 111.1 | A325 L328 E329 S345 E346 A351 L352 Q353 P362 | A325-L349 HydrophobicContact CB-CD1 4Å; L328-L349 HydrophobicContact CB-CB 4.07Å; L328-L349 HydrophobicContact CB-CD1 4.22Å; L328-L349 HydrophobicContact CD1-CB 4.25Å; E329-L349 HydrophobicContact CB-CD2 4.16Å; E329-L349 VanDerWaalsContact OE2-CD2 3.31Å; E329-L349 WeakPolarHBondContact OE2-CD2 3.18Å; S345-L349 WeakPolarHBondContact O-CB 3.27Å; S345-L349 PolarHBondContact O-N 2.81Å; E346-L349 PolarHBondContact O-N 3.01Å; L349-A351 VanDerWaalsContact C-N 3.34Å; L349-A351 PolarHBondContact O-N 3.33Å; L349-L352 WeakPolarHBondContact O-CB 3.24Å; L349-L352 PolarHBondContact O-N 3.29Å; L349-Q353 WeakPolarHBondContact O-CG 3.19Å; L349-Q353 PolarHBondContact O-N 3.25Å; L349-Q353 VanDerWaalsContact O-N 3.09Å; L349-P362 HydrophobicContact CD1-CG 4.4Å |
| 350 | Q | 94.1 | Very high | 92.7 | Very high | 106 Ų | 106 | 76.5 Ų | 76.5 | 50% | 0.495 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -60.4 | -43.6 | 177 | -174.5 | 176.8 | -11.7 | 0 | 0 | 111.3 | E346 A347 L352 Q353 E354 | E346-Q350 WeakPolarHBondContact O-CB 3.02Å; E346-Q350 PolarHBondContact O-N 2.95Å; A347-Q350 PolarHBondContact O-N 3.29Å; Q350-L352 VanDerWaalsContact C-N 3.3Å; Q350-L352 PolarHBondContact O-N 3.26Å; Q350-Q353 WeakPolarHBondContact O-CB 3.43Å; Q350-Q353 PolarHBondContact O-N 3.05Å; Q350-Q353 VanDerWaalsContact O-N 3.1Å; Q350-E354 HydrophobicContact CG-CG 4.34Å; Q350-E354 WeakPolarHBondContact CG-OE1 3.22Å; Q350-E354 PolarHBondContact NE2-OE1 3.48Å; Q350-E354 WeakPolarHBondContact O-CG 3.47Å; Q350-E354 PolarHBondContact O-N 2.83Å |
| 351 | A | 93.3 | Very high | 92.2 | Very high | 53 Ų | 53 | 77.8 Ų | 77.8 | 44% | 0.438 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -60.3 | -37 | 176 | 0 | 0 | 0 | 0 | 0 | 113 | A347 R348 L349 A355 | A347-A351 WeakPolarHBondContact O-CB 3.37Å; A347-A351 PolarHBondContact O-N 3.08Å; R348-A351 PolarHBondContact O-N 3.48Å; L349-A351 VanDerWaalsContact C-N 3.34Å; L349-A351 PolarHBondContact O-N 3.33Å; A351-A355 VanDerWaalsContact O-CB 3.25Å; A351-A355 WeakPolarHBondContact O-CB 3.33Å; A351-A355 PolarHBondContact O-N 2.83Å |
| 352 | L | 92.3 | Very high | 92 | Very high | 12 Ų | 12 | 73.2 Ų | 73.2 | 6% | 0.063 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -67.2 | -37.8 | 174.9 | -66.8 | 172.1 | 0 | 0 | 0 | 112.1 | S319 L324 A325 L328 R348 L349 Q350 G356 L357 T358 | S319-L352 WeakPolarHBondContact O-CD2 3.35Å; L324-L352 HydrophobicContact CD2-CD1 3.69Å; L324-L352 HydrophobicContact CD2-CD2 4.32Å; L324-L352 HydrophobicContact CG-CD1 3.91Å; A325-L352 HydrophobicContact CB-CD1 4.25Å; L328-L352 HydrophobicContact CD1-CD1 3.72Å; R348-L352 WeakPolarHBondContact O-CG 3.35Å; R348-L352 PolarHBondContact O-N 2.85Å; L349-L352 WeakPolarHBondContact O-CB 3.24Å; L349-L352 PolarHBondContact O-N 3.29Å; Q350-L352 VanDerWaalsContact C-N 3.3Å; Q350-L352 PolarHBondContact O-N 3.26Å; L352-G356 PolarHBondContact O-N 2.86Å; L352-L357 HydrophobicContact CD2-CB 4.28Å; L352-L357 HydrophobicContact CD2-CD1 3.86Å; L352-L357 PolarHBondContact O-N 3.13Å; L352-T358 HydrophobicContact CB-CG2 3.79Å |
| 353 | Q | 92.3 | Very high | 91.8 | Very high | 60 Ų | 60 | 73.1 Ų | 73.1 | 28% | 0.28 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -69.5 | -44.9 | 178.4 | -67 | 169.2 | -8.3 | 0 | 0 | 111.2 | L349 Q350 A355 G356 T358 T360 | L349-Q353 WeakPolarHBondContact O-CG 3.19Å; L349-Q353 PolarHBondContact O-N 3.25Å; L349-Q353 VanDerWaalsContact O-N 3.09Å; Q350-Q353 WeakPolarHBondContact O-CB 3.43Å; Q350-Q353 PolarHBondContact O-N 3.05Å; Q350-Q353 VanDerWaalsContact O-N 3.1Å; Q353-A355 VanDerWaalsContact C-N 3.27Å; Q353-A355 PolarHBondContact O-N 2.79Å; Q353-G356 PolarHBondContact O-N 3.33Å; Q353-T358 HydrophobicContact CB-CG2 4.48Å; Q353-T358 HydrophobicContact CG-CG2 3.66Å; Q353-T360 HydrophobicContact CB-CG2 3.79Å; Q353-T360 VanDerWaalsContact CD-CG2 3.43Å; Q353-T360 HydrophobicContact CG-CG2 3.46Å; Q353-T360 VanDerWaalsContact CG-CG2 3.46Å |
| 354 | E | 93.1 | Very high | 91.8 | Very high | 146 Ų | 146 | 66 Ų | 66 | 68% | 0.682 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -62.5 | -35.1 | 176 | -72.1 | 174.8 | -176.5 | 0 | 0 | 112 | Q350 G356 | Q350-E354 HydrophobicContact CG-CG 4.34Å; Q350-E354 WeakPolarHBondContact CG-OE1 3.22Å; Q350-E354 PolarHBondContact NE2-OE1 3.48Å; Q350-E354 WeakPolarHBondContact O-CG 3.47Å; Q350-E354 PolarHBondContact O-N 2.83Å; E354-G356 PolarHBondContact O-N 3.49Å |
| 355 | A | 90.9 | Very high | 91.8 | Very high | 65 Ų | 65 | 58.4 Ų | 58.4 | 54% | 0.537 | 36% | 0.356 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.2 | -2.9 | 174.3 | 0 | 0 | 0 | 0 | 0 | 114 | A351 Q353 L357 | A351-A355 VanDerWaalsContact O-CB 3.25Å; A351-A355 WeakPolarHBondContact O-CB 3.33Å; A351-A355 PolarHBondContact O-N 2.83Å; Q353-A355 VanDerWaalsContact C-N 3.27Å; Q353-A355 PolarHBondContact O-N 2.79Å; A355-L357 HydrophobicContact CB-CD1 3.94Å; A355-L357 HydrophobicContact CB-CG 3.85Å; A355-L357 PolarHBondContact O-N 2.77Å |
| 356 | G | 88.4 | Confident | 91.7 | Very high | 64 Ų | 64 | 60.8 Ų | 60.8 | 66% | 0.66 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 67.4 | 19.8 | -177.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | L352 Q353 E354 | L352-G356 PolarHBondContact O-N 2.86Å; Q353-G356 PolarHBondContact O-N 3.33Å; E354-G356 PolarHBondContact O-N 3.49Å |
| 357 | L | 88.3 | Confident | 91.6 | Very high | 88 Ų | 88 | 61.5 Ų | 61.5 | 46% | 0.461 | 37% | 0.368 | S | S | . | . | S | Bend | trans | -85.2 | -10.7 | -177.5 | -62.9 | 177 | 0 | 0 | 0 | 113.1 | L320 L352 A355 | L320-L357 HydrophobicContact CD2-CD1 4.39Å; L320-L357 HydrophobicContact CD2-CD2 3.93Å; L352-L357 HydrophobicContact CD2-CB 4.28Å; L352-L357 HydrophobicContact CD2-CD1 3.86Å; L352-L357 PolarHBondContact O-N 3.13Å; A355-L357 HydrophobicContact CB-CD1 3.94Å; A355-L357 HydrophobicContact CB-CG 3.85Å; A355-L357 PolarHBondContact O-N 2.77Å |
| 358 | T | 88.1 | Confident | 91.4 | Very high | 20 Ų | 20 | 60.4 Ų | 60.4 | 12% | 0.123 | 35% | 0.354 | C | S | . | . | S | Bend | trans | -147.9 | 146 | 177.3 | -179 | 0 | 0 | 0 | 0 | 110.8 | A325 L352 Q353 | A325-T358 HydrophobicContact CB-CG2 3.87Å; A325-T358 VanDerWaalsContact CB-OG1 3.29Å; A325-T358 WeakPolarHBondContact CB-OG1 3.3Å; L352-T358 HydrophobicContact CB-CG2 3.79Å; Q353-T358 HydrophobicContact CB-CG2 4.48Å; Q353-T358 HydrophobicContact CG-CG2 3.66Å |
| 359 | P | 88.2 | Confident | 91.2 | Very high | 84 Ų | 84 | 57.2 Ų | 57.2 | 55% | 0.545 | 34% | 0.342 | S | S | . | . | trans | -66.2 | 159.9 | 170.9 | 28 | -34.7 | 0 | 0 | 0 | 112.1 | P361 P362 | P359-P361 CarbonylContact C-O 3.49Å; P359-P361 CarbonylContact O-C 3.58Å; P359-P362 WeakPolarHBondContact O-CA 3.39Å; P359-P362 VanDerWaalsContact O-N 3.09Å | ||
| 360 | T | 88.6 | Confident | 90.9 | Very high | 104 Ų | 104 | 61.4 Ų | 61.4 | 64% | 0.638 | 36% | 0.363 | S | S | * | . | S | Bend | trans | -117.5 | 110.2 | 175.6 | 45 | 0 | 0 | 0 | 0 | 110.4 | Q353 | Q353-T360 HydrophobicContact CB-CG2 3.79Å; Q353-T360 VanDerWaalsContact CD-CG2 3.43Å; Q353-T360 HydrophobicContact CG-CG2 3.46Å; Q353-T360 VanDerWaalsContact CG-CG2 3.46Å |
| 361 | P | 85.8 | Confident | 90.6 | Very high | 108 Ų | 108 | 63.3 Ų | 63.3 | 70% | 0.701 | 37% | 0.37 | S | S | * | . | S | Bend | cis | -72.7 | 156.8 | -3.8 | 31.8 | -35.1 | 0 | 0 | 0 | 113 | P359 | P359-P361 CarbonylContact C-O 3.49Å; P359-P361 CarbonylContact O-C 3.58Å |
| 362 | P | 89.8 | Confident | 90.4 | Very high | 12 Ų | 12 | 65.2 Ų | 65.2 | 8% | 0.078 | 37% | 0.37 | C | S | . | . | P | Polyproline II helix | trans | -68.4 | 156.7 | 172.7 | 29.4 | -34.2 | 0 | 0 | 0 | 111.1 | A325 E329 L349 P359 | A325-P362 HydrophobicContact CB-CB 4.03Å; E329-P362 HydrophobicContact CB-CG 3.6Å; E329-P362 HydrophobicContact CG-CG 3.78Å; L349-P362 HydrophobicContact CD1-CG 4.4Å; P359-P362 WeakPolarHBondContact O-CA 3.39Å; P359-P362 VanDerWaalsContact O-N 3.09Å |
| 363 | P | 92.3 | Very high | 90.1 | Very high | 34 Ų | 34 | 69.5 Ų | 69.5 | 22% | 0.221 | 40% | 0.396 | C | S | . | . | P | Polyproline II helix | trans | -63 | 145.7 | 176.3 | 26.3 | -32.4 | 0 | 0 | 0 | 110.8 | P326 L368 | P326-P363 WeakPolarHBondContact CB-O 3.39Å; P326-P363 HydrophobicContact CG-CG 4.24Å; P363-L368 HydrophobicContact CB-CD2 4.17Å; P363-L368 HydrophobicContact CB-CG 4.29Å; P363-L368 HydrophobicContact CG-CD1 4.27Å; P363-L368 HydrophobicContact CG-CD2 4.07Å; P363-L368 HydrophobicContact CG-CG 4.29Å |
| 364 | S | 93.8 | Very high | 89.6 | Confident | 42 Ų | 42 | 67.5 Ų | 67.5 | 29% | 0.294 | 39% | 0.387 | S | S | . | . | P | Polyproline II helix | trans | -70.8 | 154 | 177.3 | 68.3 | 0 | 0 | 0 | 0 | 112 | K366 E367 L368 | S364-K366 PolarHBondContact O-N 3.02Å; S364-E367 WeakPolarHBondContact CB-OE1 3.4Å; S364-E367 PolarHBondContact N-OE1 3.3Å; S364-E367 PolarHBondContact O-N 2.79Å; S364-E367 VanDerWaalsContact O-N 3.15Å; S364-E367 VanDerWaalsContact OG-CD 3.24Å; S364-E367 VanDerWaalsContact OG-CG 3.24Å; S364-E367 WeakPolarHBondContact OG-CG 3.25Å; S364-E367 PolarHBondContact OG-N 2.83Å; S364-E367 PolarHBondContact OG-OE1 2.83Å; S364-L368 PolarHBondContact O-N 2.83Å; S364-L368 VanDerWaalsContact O-N 3.14Å |
| 365 | L | 94.5 | Very high | 88.6 | Confident | 7 Ų | 7 | 67.7 Ų | 67.7 | 4% | 0.037 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -55.7 | -36.5 | 174 | -71.1 | 172.7 | 0 | 0 | 0 | 111.9 | A289 A292 V293 P326 F327 A330 L368 L369 | A289-L365 HydrophobicContact CB-CD2 4.01Å; A292-L365 HydrophobicContact CB-CD1 4.11Å; V293-L365 HydrophobicContact CG2-CB 3.72Å; P326-L365 HydrophobicContact CB-CD2 3.69Å; P326-L365 HydrophobicContact CB-CG 4.21Å; F327-L365 HydrophobicContact CD1-CD1 3.86Å; F327-L365 HydrophobicContact CD1-CD2 3.74Å; F327-L365 HydrophobicContact CD1-CG 4.44Å; F327-L365 HydrophobicContact CD2-CD2 4.2Å; F327-L365 HydrophobicContact CE1-CD1 3.92Å; F327-L365 HydrophobicContact CE1-CD2 3.75Å; F327-L365 HydrophobicContact CE2-CD2 4.2Å; F327-L365 HydrophobicContact CG-CD2 3.96Å; F327-L365 HydrophobicContact CZ-CD2 3.98Å; A330-L365 HydrophobicContact CB-CD1 3.65Å; A330-L365 HydrophobicContact CB-CG 4.31Å; L365-L368 PolarHBondContact O-N 2.84Å; L365-L369 WeakPolarHBondContact O-CB 3.18Å; L365-L369 PolarHBondContact O-N 3.34Å |
| 366 | K | 93.4 | Very high | 88.5 | Confident | 63 Ų | 63 | 67.8 Ų | 67.8 | 27% | 0.274 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -66.3 | -43.5 | 178.1 | -170.3 | 176.4 | -172.2 | 172.1 | 0 | 111.8 | Y258 V293 E297 S364 L368 L369 I370 | Y258-K366 WeakPolarHBondContact OH-CE 3.44Å; Y258-K366 PolarHBondContact OH-NZ 3.01Å; V293-K366 HydrophobicContact CG1-CB 4.14Å; V293-K366 HydrophobicContact CG1-CD 4.33Å; V293-K366 HydrophobicContact CG1-CG 4.09Å; V293-K366 HydrophobicContact CG2-CB 4.08Å; E297-K366 IonicContact OE1-NZ 2.72Å; E297-K366 PolarHBondContact OE1-NZ 3.42Å; S364-K366 PolarHBondContact O-N 3.02Å; K366-L368 VanDerWaalsContact C-N 3.33Å; K366-L368 PolarHBondContact O-N 2.8Å; K366-L369 PolarHBondContact O-N 3.22Å; K366-I370 HydrophobicContact CG-CD1 4.15Å; K366-I370 WeakPolarHBondContact O-CD1 3.38Å; K366-I370 VanDerWaalsContact O-CG1 3.26Å; K366-I370 WeakPolarHBondContact O-CG1 3.14Å; K366-I370 PolarHBondContact O-N 2.92Å |
| 367 | E | 92.4 | Very high | 88.5 | Confident | 88 Ų | 88 | 68 Ų | 68 | 41% | 0.411 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -61.3 | -40.9 | 175.8 | -78 | 160.9 | -122.3 | 0 | 0 | 112.5 | S364 I370 K371 | S364-E367 WeakPolarHBondContact CB-OE1 3.4Å; S364-E367 PolarHBondContact N-OE1 3.3Å; S364-E367 PolarHBondContact O-N 2.79Å; S364-E367 VanDerWaalsContact O-N 3.15Å; S364-E367 VanDerWaalsContact OG-CD 3.24Å; S364-E367 VanDerWaalsContact OG-CG 3.24Å; S364-E367 WeakPolarHBondContact OG-CG 3.25Å; S364-E367 PolarHBondContact OG-N 2.83Å; S364-E367 PolarHBondContact OG-OE1 2.83Å; E367-I370 PolarHBondContact O-N 3.41Å; E367-K371 WeakPolarHBondContact O-CG 3.31Å; E367-K371 PolarHBondContact O-N 3.3Å |
| 368 | L | 90.9 | Very high | 88.5 | Confident | 35 Ų | 35 | 66.9 Ų | 66.9 | 18% | 0.183 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -68.4 | -41.9 | 177.6 | -66.4 | -175.6 | 0 | 0 | 0 | 111.4 | L323 P326 P363 S364 L365 K366 I370 K371 E372 | L323-L368 HydrophobicContact CD2-CB 4.28Å; L323-L368 HydrophobicContact CD2-CD1 3.67Å; P326-L368 HydrophobicContact CB-CD1 3.95Å; P326-L368 HydrophobicContact CG-CD1 3.28Å; P326-L368 HydrophobicContact CG-CG 4.47Å; P363-L368 HydrophobicContact CB-CD2 4.17Å; P363-L368 HydrophobicContact CB-CG 4.29Å; P363-L368 HydrophobicContact CG-CD1 4.27Å; P363-L368 HydrophobicContact CG-CD2 4.07Å; P363-L368 HydrophobicContact CG-CG 4.29Å; S364-L368 PolarHBondContact O-N 2.83Å; S364-L368 VanDerWaalsContact O-N 3.14Å; L365-L368 PolarHBondContact O-N 2.84Å; K366-L368 VanDerWaalsContact C-N 3.33Å; K366-L368 PolarHBondContact O-N 2.8Å; L368-I370 PolarHBondContact O-N 3.03Å; L368-K371 PolarHBondContact O-N 3.27Å; L368-K371 VanDerWaalsContact O-N 3.08Å; L368-E372 WeakPolarHBondContact O-CB 3.08Å; L368-E372 PolarHBondContact O-N 3.42Å |
| 369 | L | 90.2 | Very high | 88.5 | Confident | 1 Ų | 1 | 69.6 Ų | 69.6 | 1% | 0.005 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -58.8 | -36.1 | 176.1 | -164.5 | 77 | 0 | 0 | 0 | 112.3 | Q250 T253 W265 L286 L365 K366 | Q250-L369 HydrophobicContact CG-CG 4.44Å; Q250-L369 PolarHBondContact NE2-O 3.43Å; T253-L369 HydrophobicContact CG2-CD2 3.51Å; W265-L369 HydrophobicContact CH2-CD1 3.87Å; W265-L369 HydrophobicContact CZ2-CD1 3.84Å; W265-L369 HydrophobicContact CZ2-CD2 4.02Å; W265-L369 HydrophobicContact CZ2-CG 4.34Å; L286-L369 HydrophobicContact CD1-CD1 3.69Å; L286-L369 HydrophobicContact CG-CD1 4.14Å; L365-L369 WeakPolarHBondContact O-CB 3.18Å; L365-L369 PolarHBondContact O-N 3.34Å; K366-L369 PolarHBondContact O-N 3.22Å |
| 370 | I | 89.3 | Confident | 88.6 | Confident | 98 Ų | 98 | 68.8 Ų | 68.8 | 50% | 0.503 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -72.7 | -33.2 | 177.6 | -66.2 | 161.7 | 0 | 0 | 0 | 111.7 | K366 E367 L368 | K366-I370 HydrophobicContact CG-CD1 4.15Å; K366-I370 WeakPolarHBondContact O-CD1 3.38Å; K366-I370 VanDerWaalsContact O-CG1 3.26Å; K366-I370 WeakPolarHBondContact O-CG1 3.14Å; K366-I370 PolarHBondContact O-N 2.92Å; E367-I370 PolarHBondContact O-N 3.41Å; L368-I370 PolarHBondContact O-N 3.03Å |
| 371 | K | 87.9 | Confident | 88.6 | Confident | 146 Ų | 146 | 66.4 Ų | 66.4 | 64% | 0.635 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -83.8 | -23.9 | -178.4 | -71.8 | 172 | -178.6 | 171.7 | 0 | 113.4 | E367 L368 V373 | E367-K371 WeakPolarHBondContact O-CG 3.31Å; E367-K371 PolarHBondContact O-N 3.3Å; L368-K371 PolarHBondContact O-N 3.27Å; L368-K371 VanDerWaalsContact O-N 3.08Å; K371-V373 PolarHBondContact O-N 3.08Å |
| 372 | E | 87.6 | Confident | 88.8 | Confident | 92 Ų | 92 | 63.4 Ų | 63.4 | 43% | 0.43 | 33% | 0.327 | S | S | . | . | trans | -65.8 | 129.9 | -177.6 | -168.6 | 64.7 | -157.6 | 0 | 0 | 111.1 | Q250 L286 L368 | Q250-E372 PolarHBondContact NE2-O 3.46Å; L286-E372 HydrophobicContact CD1-CB 4.06Å; L286-E372 HydrophobicContact CD1-CG 3.8Å; L286-E372 HydrophobicContact CD2-CG 3.97Å; L368-E372 WeakPolarHBondContact O-CB 3.08Å; L368-E372 PolarHBondContact O-N 3.42Å | ||
| 373 | V | 85.7 | Confident | 88.7 | Confident | 102 Ų | 102 | 67.4 Ų | 67.4 | 62% | 0.618 | 35% | 0.347 | S | S | * | . | trans | -99.9 | 115.1 | 174.4 | -178.6 | 0 | 0 | 0 | 0 | 108.5 | K371 D375 | K371-V373 PolarHBondContact O-N 3.08Å; V373-D375 PolarHBondContact O-N 3.49Å | ||
| 374 | L | 83.3 | Confident | 88.4 | Confident | 18 Ų | 18 | 70.2 Ų | 70.2 | 9% | 0.094 | 36% | 0.357 | C | S | . | . | trans | -86.5 | 96.1 | 175.9 | -76.3 | 174.5 | 0 | 0 | 0 | 110 | L243 L246 R247 Q250 L286 | L243-L374 HydrophobicContact CD1-CB 4.14Å; L246-L374 HydrophobicContact CB-CD1 3.65Å; L246-L374 HydrophobicContact CD1-CD2 4.39Å; R247-L374 HydrophobicContact CG-CB 3.84Å; R247-L374 HydrophobicContact CG-CD1 4.17Å; R247-L374 PolarHBondContact NE-O 3.38Å; R247-L374 PolarHBondContact NH2-O 2.83Å; Q250-L374 HydrophobicContact CB-CD1 4.27Å; L286-L374 HydrophobicContact CD2-CD1 4.22Å; L286-L374 HydrophobicContact CD2-CD2 3.33Å; L286-L374 HydrophobicContact CD2-CG 3.97Å | ||
| 375 | D | 71.6 | Confident | 87.9 | Confident | 150 Ų | 150 | 72.7 Ų | 72.7 | 80% | 0.802 | 36% | 0.363 | S | S | * | . | trans | -90 | 0 | 175.3 | -74.8 | -27.3 | 0 | 0 | 0 | 114.1 | L243 R247 V373 | L243-D375 WeakPolarHBondContact CD2-OXT 3.41Å; R247-D375 PolarHBondContact NH2-OXT 3.28Å; V373-D375 PolarHBondContact O-N 3.49Å |
Retrieved 375 of 375 residues in 280.9 ms
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