| 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 | 34.4 | Very low | 34.6 | Very low | 239 Ų | 239 | 159.1 Ų | 159.1 | 100% | 1.177 | 85% | 0.847 | S | S | * | * | 0 | 112.3 | 0 | -63.6 | 171.2 | -178 | 0 | 0 | 105 | |||||
| 2 | T | 36.7 | Very low | 34.3 | Very low | 142 Ų | 142 | 159.4 Ų | 159.4 | 87% | 0.871 | 84% | 0.84 | S | S | * | * | cis | -155 | 140 | 28.5 | -34.4 | 0 | 0 | 0 | 0 | 109 | ||||
| 3 | L | 37.6 | Very low | 34.1 | Very low | 177 Ų | 177 | 160.5 Ų | 160.5 | 93% | 0.927 | 84% | 0.838 | S | S | * | * | trans | -71 | 163.4 | 174.2 | -94.1 | 83.4 | 0 | 0 | 0 | 112.6 | ||||
| 4 | G | 32.3 | Very low | 34.2 | Very low | 84 Ų | 84 | 162.5 Ų | 162.5 | 87% | 0.866 | 84% | 0.84 | S | S | * | * | trans | 178.8 | 92.9 | 151.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 5 | A | 43 | Very low | 34 | Very low | 92 Ų | 92 | 163.3 Ų | 163.3 | 76% | 0.76 | 84% | 0.839 | S | S | * | * | trans | -98.5 | 154 | 170.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 6 | F | 37.8 | Very low | 33.8 | Very low | 203 Ų | 203 | 163.9 Ų | 163.9 | 89% | 0.89 | 84% | 0.837 | S | S | * | * | trans | -149 | 115.8 | 158.1 | -95.1 | -86 | 0 | 0 | 0 | 105.2 | ||||
| 7 | R | 35.2 | Very low | 33.5 | Very low | 242 Ų | 242 | 160.2 Ų | 160.2 | 91% | 0.913 | 83% | 0.829 | S | S | * | * | 42.6 | 115.6 | 62 | -110.4 | -173 | -176.6 | -166.4 | 1.2 | 111 | |||||
| 8 | G | 29.5 | Very low | 33.5 | Very low | 64 Ų | 64 | 159.6 Ų | 159.6 | 66% | 0.66 | 83% | 0.834 | S | S | * | * | cis | 123.5 | 129.9 | 22.6 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 9 | H | 31.2 | Very low | 33.4 | Very low | 175 Ų | 175 | 162.5 Ų | 162.5 | 81% | 0.81 | 83% | 0.832 | S | S | * | * | trans | 162.6 | 118.4 | 156 | -98.1 | 65.7 | 0 | 0 | 0 | 108.8 | ||||
| 10 | D | 31.8 | Very low | 33.2 | Very low | 122 Ų | 122 | 161.9 Ų | 161.9 | 65% | 0.652 | 83% | 0.83 | S | S | * | * | 75.3 | 142.5 | 92 | -89.5 | -21.9 | 0 | 0 | 0 | 112.5 | |||||
| 11 | R | 31.3 | Very low | 33.1 | Very low | 210 Ų | 210 | 162.8 Ų | 162.8 | 79% | 0.792 | 83% | 0.83 | S | S | * | * | cis | -177 | 171.5 | -8.1 | -137.4 | 175.3 | -175 | -174.7 | 2.6 | 105.4 | ||||
| 12 | E | 30.6 | Very low | 32.9 | Very low | 163 Ų | 163 | 155.4 Ų | 155.4 | 76% | 0.762 | 81% | 0.808 | S | S | * | * | trans | 86 | 106 | 161.8 | -68.3 | 173.1 | -174.6 | 0 | 0 | 118.4 | ||||
| 13 | Q | 32.2 | Very low | 32.6 | Very low | 174 Ų | 174 | 157 Ų | 157 | 81% | 0.813 | 81% | 0.807 | S | S | * | * | 73.9 | 107.5 | 78.3 | -76.4 | -169.3 | 11.6 | 0 | 0 | 113.9 | |||||
| 14 | H | 34.7 | Very low | 32.2 | Very low | 188 Ų | 188 | 156.5 Ų | 156.5 | 87% | 0.87 | 80% | 0.8 | S | S | * | * | -149.2 | 136 | 130 | -116.4 | 59.7 | 0 | 0 | 0 | 112 | |||||
| 15 | Q | 32.1 | Very low | 32.2 | Very low | 174 Ų | 174 | 160.7 Ų | 160.7 | 81% | 0.813 | 80% | 0.797 | S | S | * | * | trans | -120.5 | 130.8 | -174 | 176.1 | 166.5 | 19.8 | 0 | 0 | 107.2 | ||||
| 16 | Q | 30.4 | Very low | 31.5 | Very low | 174 Ų | 174 | 163.2 Ų | 163.2 | 81% | 0.813 | 80% | 0.798 | S | S | * | * | trans | -165.8 | 105.5 | 161.2 | -110.6 | 158 | -10.5 | 0 | 0 | 105 | ||||
| 17 | S | 29.4 | Very low | 31.2 | Very low | 101 Ų | 101 | 160.5 Ų | 160.5 | 71% | 0.706 | 79% | 0.791 | S | S | * | * | 54 | 91.8 | 55.9 | -158.3 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 18 | T | 33.8 | Very low | 30.8 | Very low | 148 Ų | 148 | 156.1 Ų | 156.1 | 91% | 0.908 | 79% | 0.786 | S | S | * | * | trans | -142.3 | 134 | 142.7 | -37.2 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 19 | R | 31 | Very low | 30.7 | Very low | 215 Ų | 215 | 159.2 Ų | 159.2 | 81% | 0.811 | 79% | 0.792 | S | S | * | * | trans | -116 | 156.2 | -166.3 | -153.7 | -176.3 | -163.7 | 176.6 | 3.8 | 106.8 | ||||
| 20 | L | 29.8 | Very low | 30.6 | Very low | 150 Ų | 150 | 156.5 Ų | 156.5 | 79% | 0.785 | 79% | 0.788 | S | S | * | * | trans | 88.3 | 112.2 | 159.5 | -50.9 | 168.7 | 0 | 0 | 0 | 117.1 | ||||
| 21 | H | 30.4 | Very low | 30.4 | Very low | 181 Ų | 181 | 155.4 Ų | 155.4 | 84% | 0.838 | 79% | 0.79 | S | S | * | * | -162.8 | 131.8 | 91 | -129.9 | -81.2 | 0 | 0 | 0 | 111.5 | |||||
| 22 | A | 30.1 | Very low | 30.2 | Very low | 85 Ų | 85 | 153.8 Ų | 153.8 | 70% | 0.702 | 79% | 0.791 | S | S | * | * | trans | -77.1 | 147.9 | 164.1 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 23 | M | 29.9 | Very low | 30.2 | Very low | 174 Ų | 174 | 152.1 Ų | 152.1 | 86% | 0.857 | 79% | 0.792 | S | S | * | * | trans | -145.5 | 109.7 | 149.6 | -104.9 | 169.3 | 111 | 0 | 0 | 108.2 | ||||
| 24 | E | 30.7 | Very low | 30 | Very low | 168 Ų | 168 | 153 Ų | 153 | 79% | 0.785 | 80% | 0.796 | S | S | * | * | trans | -58.2 | 136 | 154.3 | -74.4 | 164.6 | 120.3 | 0 | 0 | 109.3 | ||||
| 25 | E | 30.8 | Very low | 29.6 | Very low | 171 Ų | 171 | 147.1 Ų | 147.1 | 80% | 0.799 | 79% | 0.786 | S | S | * | * | trans | -132.7 | 104.4 | 145.4 | -96.2 | -173.7 | 169.3 | 0 | 0 | 108.5 | ||||
| 26 | N | 28.6 | Very low | 29.3 | Very low | 146 Ų | 146 | 146.3 Ų | 146.3 | 78% | 0.781 | 79% | 0.787 | S | S | * | * | trans | -75.2 | 122.9 | 154.6 | -82.1 | -58 | 0 | 0 | 0 | 107.7 | ||||
| 27 | I | 31.6 | Very low | 29.2 | Very low | 146 Ų | 146 | 145.2 Ų | 145.2 | 75% | 0.749 | 79% | 0.786 | S | S | * | * | trans | -140.8 | 106.7 | 152.3 | -58.7 | -176.6 | 0 | 0 | 0 | 110 | ||||
| 28 | D | 26.4 | Very low | 29 | Very low | 150 Ų | 150 | 143.7 Ų | 143.7 | 80% | 0.802 | 79% | 0.787 | S | S | * | * | trans | 34.4 | 131 | 144.1 | -88.2 | -29.5 | 0 | 0 | 0 | 124.6 | ||||
| 29 | V | 29.2 | Very low | 28.7 | Very low | 129 Ų | 129 | 145.2 Ų | 145.2 | 78% | 0.782 | 79% | 0.788 | S | S | * | * | trans | -69.6 | 126.4 | 154.2 | 170.5 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 30 | T | 27.6 | Very low | 28.4 | Very low | 117 Ų | 117 | 139.7 Ų | 139.7 | 72% | 0.718 | 78% | 0.783 | S | S | * | * | trans | -134.8 | 110.9 | 153.2 | 46.3 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 31 | S | 29 | Very low | 28.3 | Very low | 99 Ų | 99 | 141.1 Ų | 141.1 | 69% | 0.692 | 79% | 0.785 | S | S | * | * | trans | -64.9 | 127.8 | 158.7 | 49.7 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 32 | H | 26.6 | Very low | 28.1 | Very low | 177 Ų | 177 | 139.7 Ų | 139.7 | 82% | 0.819 | 78% | 0.778 | S | S | * | * | trans | -129.9 | 103.5 | 158.2 | -90.2 | -68.7 | 0 | 0 | 0 | 110.4 | ||||
| 33 | T | 30.3 | Very low | 27.8 | Very low | 127 Ų | 127 | 147.5 Ų | 147.5 | 78% | 0.779 | 79% | 0.79 | S | S | * | * | trans | -85.4 | 127 | 155.4 | 38.1 | 0 | 0 | 0 | 0 | 109 | ||||
| 34 | E | 28.1 | Very low | 27.8 | Very low | 192 Ų | 192 | 147.3 Ų | 147.3 | 90% | 0.897 | 78% | 0.784 | S | S | * | * | trans | 172.7 | 121.7 | 153.7 | -99.3 | 167.5 | -171 | 0 | 0 | 104.5 | ||||
| 35 | G | 25.7 | Very low | 27.9 | Very low | 65 Ų | 65 | 145 Ų | 145 | 67% | 0.67 | 78% | 0.784 | S | S | * | * | cis | 93.3 | 93.4 | 31.6 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 36 | L | 27.1 | Very low | 27.8 | Very low | 157 Ų | 157 | 143.8 Ų | 143.8 | 82% | 0.822 | 79% | 0.788 | S | S | * | * | trans | 167.9 | 115.2 | 135.1 | -88.5 | 159.1 | 0 | 0 | 0 | 113.7 | ||||
| 37 | N | 27.7 | Very low | 27.8 | Very low | 151 Ų | 151 | 144.5 Ų | 144.5 | 81% | 0.807 | 79% | 0.787 | S | S | * | * | trans | 47.8 | 117.1 | 132 | -66.2 | -8.4 | 0 | 0 | 0 | 122.2 | ||||
| 38 | G | 25.4 | Very low | 27.7 | Very low | 69 Ų | 69 | 145.6 Ų | 145.6 | 71% | 0.711 | 79% | 0.794 | S | S | * | * | 113 | 106.6 | 109.3 | 0 | 0 | 0 | 0 | 0 | 116.6 | |||||
| 39 | L | 26.4 | Very low | 27.8 | Very low | 181 Ų | 181 | 144.8 Ų | 144.8 | 95% | 0.948 | 79% | 0.788 | S | S | * | * | -172 | 146.1 | 126.6 | -99.1 | 156.2 | 0 | 0 | 0 | 111.3 | |||||
| 40 | S | 25.6 | Very low | 27.9 | Very low | 99 Ų | 99 | 144.7 Ų | 144.7 | 69% | 0.692 | 79% | 0.788 | S | S | * | * | trans | -101.7 | 174.6 | -158.5 | -54 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 41 | H | 27.3 | Very low | 27.9 | Very low | 179 Ų | 179 | 147 Ų | 147 | 83% | 0.829 | 80% | 0.796 | S | S | * | * | trans | 87.4 | 130.7 | 171.4 | -67.9 | -79.5 | 0 | 0 | 0 | 114.8 | ||||
| 42 | E | 26.5 | Very low | 27.8 | Very low | 151 Ų | 151 | 146 Ų | 146 | 71% | 0.706 | 80% | 0.801 | S | S | * | * | cis | -160.7 | 133.6 | 23.6 | -153.1 | 173.2 | 138.6 | 0 | 0 | 109 | ||||
| 43 | R | 24.3 | Very low | 27.8 | Very low | 249 Ų | 249 | 146.4 Ų | 146.4 | 94% | 0.94 | 80% | 0.803 | S | S | * | * | trans | -91.6 | 127.4 | 171.3 | -119.6 | -178.2 | -167.9 | 168.9 | 3.4 | 107.6 | ||||
| 44 | K | 29.5 | Very low | 27.8 | Very low | 171 Ų | 171 | 145 Ų | 145 | 74% | 0.743 | 80% | 0.799 | S | S | * | * | trans | -119.6 | 142.6 | 158.2 | -80.4 | -175.9 | -179.4 | 175.8 | 0 | 110.4 | ||||
| 45 | P | 31.6 | Very low | 27.8 | Very low | 119 Ų | 119 | 142.1 Ų | 142.1 | 77% | 0.773 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -83.8 | 147.7 | -173.4 | 10.2 | 8.7 | 0 | 0 | 0 | 111.2 | ||
| 46 | V | 29.7 | Very low | 28 | Very low | 146 Ų | 146 | 149.3 Ų | 149.3 | 89% | 0.885 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -72 | 130.9 | 170.9 | 170.6 | 0 | 0 | 0 | 0 | 108.9 | ||
| 47 | E | 28.7 | Very low | 28.1 | Very low | 161 Ų | 161 | 150.8 Ų | 150.8 | 75% | 0.752 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 130.2 | -179.5 | -66.2 | 173.1 | 152.9 | 0 | 0 | 111.6 | I49 | E47-I49 HydrophobicContact CB-CD1 4.33Å; E47-I49 HydrophobicContact CB-CG1 4.07Å |
| 48 | D | 28.2 | Very low | 28.3 | Very low | 169 Ų | 169 | 148.8 Ų | 148.8 | 90% | 0.904 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 118.1 | 156.5 | -95 | -34.5 | 0 | 0 | 0 | 108.2 | ||
| 49 | I | 29.5 | Very low | 28.4 | Very low | 133 Ų | 133 | 151.9 Ų | 151.9 | 68% | 0.682 | 80% | 0.802 | S | S | * | * | trans | -129.8 | 104.1 | 167.8 | -42.8 | 179.3 | 0 | 0 | 0 | 109.6 | E47 | E47-I49 HydrophobicContact CB-CD1 4.33Å; E47-I49 HydrophobicContact CB-CG1 4.07Å | ||
| 50 | T | 31.3 | Very low | 28.7 | Very low | 127 Ų | 127 | 150.3 Ų | 150.3 | 78% | 0.779 | 79% | 0.793 | S | S | * | * | trans | -8.6 | 136 | 157.1 | 52.2 | 0 | 0 | 0 | 0 | 119.8 | G52 | T50-G52 PolarHBondContact O-N 3.39Š| ||
| 51 | N | 27.5 | Very low | 29 | Very low | 166 Ų | 166 | 153.1 Ų | 153.1 | 89% | 0.888 | 80% | 0.801 | S | S | * | * | trans | -54 | 112.9 | 162.2 | -80.3 | -29 | 0 | 0 | 0 | 111.3 | H53 | N51-H53 PolarHBondContact O-N 2.86Š| ||
| 52 | G | 27.2 | Very low | 29.1 | Very low | 77 Ų | 77 | 147.7 Ų | 147.7 | 79% | 0.794 | 79% | 0.793 | S | S | * | * | trans | -73.3 | 119 | 169.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | T50 S54 | T50-G52 PolarHBondContact O-N 3.39Å; G52-S54 PolarHBondContact O-N 3.49Å | ||
| 53 | H | 27.5 | Very low | 29.2 | Very low | 185 Ų | 185 | 146.9 Ų | 146.9 | 86% | 0.856 | 80% | 0.798 | S | S | * | * | trans | -58.7 | 120.8 | 167.5 | -88.5 | -102.8 | 0 | 0 | 0 | 111.3 | N51 | N51-H53 PolarHBondContact O-N 2.86Š| ||
| 54 | S | 28.3 | Very low | 29.4 | Very low | 99 Ų | 99 | 139.9 Ų | 139.9 | 69% | 0.692 | 79% | 0.793 | S | S | * | * | trans | -85.8 | 112.2 | 162.4 | 179.3 | 0 | 0 | 0 | 0 | 109.4 | G52 Y56 | G52-S54 PolarHBondContact O-N 3.49Å; S54-Y56 PolarHBondContact O-N 2.78Å | ||
| 55 | T | 29.7 | Very low | 29.5 | Very low | 130 Ų | 130 | 139.2 Ų | 139.2 | 80% | 0.798 | 80% | 0.796 | S | S | * | * | trans | -76.5 | 91.7 | 173.5 | 31.3 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 56 | Y | 28.8 | Very low | 29.3 | Very low | 217 Ų | 217 | 136.5 Ų | 136.5 | 85% | 0.851 | 79% | 0.79 | S | S | * | * | trans | -92.1 | 112.8 | 159 | -99.7 | -90.6 | 0 | 0 | 0 | 109.3 | S54 | S54-Y56 PolarHBondContact O-N 2.78Š| ||
| 57 | K | 30.4 | Very low | 29.5 | Very low | 188 Ų | 188 | 138.8 Ų | 138.8 | 82% | 0.817 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -83.1 | 127.7 | 167.2 | -70.3 | -175.2 | 176.9 | -178.1 | 0 | 108.7 | ||
| 58 | P | 30.7 | Very low | 29.6 | Very low | 109 Ų | 109 | 139.4 Ų | 139.4 | 71% | 0.708 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -78.3 | 124.7 | 161 | 16.9 | -4.7 | 0 | 0 | 0 | 108.9 | I60 | P58-I60 PolarHBondContact O-N 3.23Š|
| 59 | V | 28.9 | Very low | 29.7 | Very low | 133 Ų | 133 | 135 Ų | 135 | 81% | 0.806 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 116.7 | 168.7 | 173.9 | 0 | 0 | 0 | 0 | 107.6 | ||
| 60 | I | 32.6 | Very low | 29.8 | Very low | 148 Ų | 148 | 138.4 Ų | 138.4 | 76% | 0.759 | 80% | 0.803 | S | S | * | * | trans | -101.9 | 109.3 | 172.2 | -58 | 174.4 | 0 | 0 | 0 | 106.4 | P58 G62 | P58-I60 PolarHBondContact O-N 3.23Å; I60-G62 PolarHBondContact O-N 3.05Å | ||
| 61 | N | 31.1 | Very low | 29.8 | Very low | 159 Ų | 159 | 140.1 Ų | 140.1 | 85% | 0.85 | 81% | 0.808 | S | S | * | * | trans | -71.6 | 118.6 | 163 | -91.1 | -8.7 | 0 | 0 | 0 | 107.9 | ||||
| 62 | G | 29.3 | Very low | 30.1 | Very low | 64 Ų | 64 | 140.9 Ų | 140.9 | 66% | 0.66 | 81% | 0.806 | S | S | * | * | trans | -81.8 | 161 | -170.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | I60 | I60-G62 PolarHBondContact O-N 3.05Š| ||
| 63 | V | 29.2 | Very low | 30.3 | Very low | 135 Ų | 135 | 144.5 Ų | 144.5 | 82% | 0.818 | 81% | 0.813 | S | S | * | * | trans | -142.8 | 117.9 | 137.5 | 174.5 | 0 | 0 | 0 | 0 | 106.3 | I65 | V63-I65 HydrophobicContact CG1-CG1 4.29Š| ||
| 64 | A | 27.3 | Very low | 30.5 | Very low | 102 Ų | 102 | 144 Ų | 144 | 84% | 0.843 | 82% | 0.816 | S | S | * | * | trans | -86.7 | 122.9 | 172.6 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 65 | I | 31.8 | Very low | 30.5 | Very low | 156 Ų | 156 | 142.7 Ų | 142.7 | 80% | 0.8 | 82% | 0.818 | S | S | * | * | trans | -126.7 | 110 | 158 | -61.8 | -179.6 | 0 | 0 | 0 | 106.1 | V63 | V63-I65 HydrophobicContact CG1-CG1 4.29Š| ||
| 66 | G | 28.8 | Very low | 30.7 | Very low | 62 Ų | 62 | 144.9 Ų | 144.9 | 64% | 0.639 | 83% | 0.825 | S | S | * | * | trans | -76.9 | 145.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 67 | H | 32.5 | Very low | 30.9 | Very low | 194 Ų | 194 | 138.7 Ų | 138.7 | 90% | 0.898 | 82% | 0.819 | S | S | * | * | trans | -159.1 | 133.6 | 144.5 | -107 | -75 | 0 | 0 | 0 | 110.2 | ||||
| 68 | N | 31 | Very low | 31.3 | Very low | 174 Ų | 174 | 135.7 Ų | 135.7 | 93% | 0.93 | 82% | 0.818 | S | S | * | * | trans | -60.5 | 144 | 175.5 | -91.5 | -31.4 | 0 | 0 | 0 | 112.9 | ||||
| 69 | G | 29.6 | Very low | 31.4 | Very low | 77 Ų | 77 | 140.9 Ų | 140.9 | 79% | 0.794 | 83% | 0.83 | S | S | * | * | trans | 174.2 | 101.7 | 162.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 70 | K | 32.2 | Very low | 31.9 | Very low | 204 Ų | 204 | 145.8 Ų | 145.8 | 89% | 0.887 | 83% | 0.834 | S | S | * | * | trans | -65 | 136.6 | 164.6 | -81.3 | 172.4 | 171.4 | 173.2 | 0 | 108.7 | ||||
| 71 | D | 30.9 | Very low | 32.3 | Very low | 164 Ų | 164 | 144.1 Ų | 144.1 | 88% | 0.877 | 84% | 0.836 | S | S | * | * | trans | -165.8 | 138.3 | 134.5 | -92.2 | -25.5 | 0 | 0 | 0 | 111.8 | ||||
| 72 | H | 34.2 | Very low | 32.9 | Very low | 182 Ų | 182 | 143.7 Ų | 143.7 | 84% | 0.843 | 83% | 0.833 | S | S | * | * | trans | -78.8 | 141.3 | 173.4 | -72.9 | -79.1 | 0 | 0 | 0 | 110.3 | ||||
| 73 | T | 32.5 | Very low | 33.8 | Very low | 153 Ų | 153 | 144.8 Ų | 144.8 | 94% | 0.939 | 83% | 0.828 | S | S | * | * | trans | -179.7 | 153.6 | 132 | 27.6 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 74 | N | 31 | Very low | 34.8 | Very low | 175 Ų | 175 | 145.6 Ų | 145.6 | 94% | 0.936 | 83% | 0.826 | S | S | * | * | trans | -83.7 | 145.7 | -168.3 | -155.5 | 10.5 | 0 | 0 | 0 | 111.8 | ||||
| 75 | G | 28.9 | Very low | 35.6 | Very low | 71 Ų | 71 | 145.2 Ų | 145.2 | 73% | 0.732 | 82% | 0.818 | S | S | * | * | trans | 170.8 | 105.4 | 169.7 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 76 | N | 33.6 | Very low | 36.3 | Very low | 176 Ų | 176 | 140 Ų | 140 | 94% | 0.941 | 80% | 0.798 | S | S | * | * | trans | -58.9 | 129.5 | 167.8 | -101.8 | -15.3 | 0 | 0 | 0 | 112.5 | ||||
| 77 | A | 32.9 | Very low | 37.1 | Very low | 87 Ų | 87 | 143.1 Ų | 143.1 | 72% | 0.719 | 80% | 0.799 | S | S | * | * | trans | -156.3 | 140.1 | 152.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 78 | P | 38.5 | Very low | 37.9 | Very low | 124 Ų | 124 | 143 Ų | 143 | 81% | 0.805 | 80% | 0.796 | S | S | * | * | trans | -79 | 140.5 | -174.8 | 31.6 | -33.5 | 0 | 0 | 0 | 112.5 | R80 | P78-R80 PolarHBondContact O-N 3.37Å; P78-R80 VanDerWaalsContact O-N 3.09Å | ||
| 79 | F | 33.6 | Very low | 38.8 | Very low | 218 Ų | 218 | 143.3 Ų | 143.3 | 96% | 0.956 | 79% | 0.792 | S | S | * | * | trans | -63.9 | 108 | 173.9 | -74.8 | -84.1 | 0 | 0 | 0 | 110.8 | ||||
| 80 | R | 37.3 | Very low | 39.7 | Very low | 236 Ų | 236 | 144.6 Ų | 144.6 | 89% | 0.891 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -87.6 | 117.7 | 168.2 | -139.5 | -179.3 | -168 | -179.2 | 3.4 | 107.7 | P78 L82 | P78-R80 PolarHBondContact O-N 3.37Å; P78-R80 VanDerWaalsContact O-N 3.09Å; R80-L82 PolarHBondContact O-N 3.11Å |
| 81 | S | 42.6 | Very low | 40.4 | Very low | 114 Ų | 114 | 137.8 Ų | 137.8 | 80% | 0.797 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 122.3 | 170.7 | 53.5 | 0 | 0 | 0 | 0 | 109.9 | ||
| 82 | L | 43.7 | Very low | 41.2 | Very low | 150 Ų | 150 | 135.8 Ų | 135.8 | 79% | 0.785 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -81.2 | 135.3 | 174.3 | -75.3 | 162.8 | 0 | 0 | 0 | 110.2 | R80 | R80-L82 PolarHBondContact O-N 3.11Š|
| 83 | P | 48.5 | Very low | 41.7 | Very low | 86 Ų | 86 | 133.3 Ų | 133.3 | 56% | 0.558 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 147.7 | 174.1 | 26.8 | -31 | 0 | 0 | 0 | 111.6 | S85 A86 | P83-S85 PolarHBondContact O-N 3.47Å; P83-A86 PolarHBondContact O-N 2.76Å |
| 84 | I | 48.9 | Very low | 42.4 | Very low | 152 Ų | 152 | 133.5 Ų | 133.5 | 78% | 0.779 | 74% | 0.739 | S | S | * | * | G | 310 helix | trans | -55.8 | -18.8 | -176.6 | -64 | 170.7 | 0 | 0 | 0 | 113 | A86 L87 | I84-A86 PolarHBondContact O-N 2.99Å; I84-L87 PolarHBondContact O-N 3.31Å |
| 85 | S | 45 | Very low | 42.8 | Very low | 95 Ų | 95 | 131.9 Ų | 131.9 | 66% | 0.664 | 73% | 0.73 | S | S | * | * | G | 310 helix | trans | -65.4 | -17 | 174.3 | 42.2 | 0 | 0 | 0 | 0 | 114.9 | P83 | P83-S85 PolarHBondContact O-N 3.47Š|
| 86 | A | 45.3 | Very low | 43.5 | Very low | 47 Ų | 47 | 135.5 Ų | 135.5 | 39% | 0.388 | 73% | 0.732 | S | S | . | * | G | 310 helix | trans | -83.2 | -12.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | P83 I84 | P83-A86 PolarHBondContact O-N 2.76Å; I84-A86 PolarHBondContact O-N 2.99Å |
| 87 | L | 47 | Very low | 43.9 | Very low | 127 Ų | 127 | 132.7 Ų | 132.7 | 67% | 0.665 | 72% | 0.722 | S | S | * | * | G | 310 helix | trans | -86.4 | -5.6 | 178.8 | -88.6 | 155.9 | 0 | 0 | 0 | 113.9 | I84 | I84-L87 PolarHBondContact O-N 3.31Š|
| 88 | K | 47.6 | Very low | 44.6 | Very low | 192 Ų | 192 | 134.2 Ų | 134.2 | 84% | 0.835 | 72% | 0.722 | S | S | * | * | G | 310 helix | trans | -86.1 | -10.6 | -178.9 | -151.6 | 178.2 | -178.1 | -178.1 | 0 | 114 | ||
| 89 | Q | 51.6 | Low | 44.4 | Very low | 179 Ų | 179 | 132.2 Ų | 132.2 | 84% | 0.836 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -99.6 | -13.3 | -176.4 | -88.4 | -178.3 | -11.1 | 0 | 0 | 115 | ||
| 90 | N | 46.9 | Very low | 44.4 | Very low | 104 Ų | 104 | 125.4 Ų | 125.4 | 56% | 0.556 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -97.2 | 115.6 | 171.5 | -65.3 | -38.7 | 0 | 0 | 0 | 107.3 | I92 | N90-I92 HydrophobicContact CB-CD1 4.05Å; N90-I92 HydrophobicContact CB-CG1 4.2Å; N90-I92 PolarHBondContact O-N 3.22Å |
| 91 | G | 48.6 | Very low | 44.8 | Very low | 62 Ų | 62 | 122.2 Ų | 122.2 | 64% | 0.639 | 72% | 0.716 | S | S | * | * | G | 310 helix | trans | -62.2 | 34.6 | -177.2 | 0 | 0 | 0 | 0 | 0 | 116.3 | L93 | G91-L93 VanDerWaalsContact C-N 3.27Å; G91-L93 PolarHBondContact O-N 3.21Å |
| 92 | I | 47.7 | Very low | 44.8 | Very low | 121 Ų | 121 | 125.7 Ų | 125.7 | 62% | 0.621 | 72% | 0.717 | S | S | * | * | G | 310 helix | trans | -72.8 | -20.6 | 179.2 | -62.5 | 174.2 | 0 | 0 | 0 | 111.1 | N90 | N90-I92 HydrophobicContact CB-CD1 4.05Å; N90-I92 HydrophobicContact CB-CG1 4.2Å; N90-I92 PolarHBondContact O-N 3.22Å |
| 93 | L | 43.5 | Very low | 44.7 | Very low | 130 Ų | 130 | 123.6 Ų | 123.6 | 68% | 0.681 | 71% | 0.712 | S | S | * | * | G | 310 helix | trans | -80.1 | -14.7 | 176.9 | -90 | 160.9 | 0 | 0 | 0 | 114.9 | G91 T97 | G91-L93 VanDerWaalsContact C-N 3.27Å; G91-L93 PolarHBondContact O-N 3.21Å; L93-T97 PolarHBondContact O-OG1 3.13Å |
| 94 | Q | 47.3 | Very low | 44.5 | Very low | 157 Ų | 157 | 121.7 Ų | 121.7 | 73% | 0.734 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -86.3 | -18.2 | 179.3 | -73.2 | -155.3 | 8.5 | 0 | 0 | 114.3 | L96 T98 | Q94-L96 VanDerWaalsContact C-N 3.34Å; Q94-T98 PolarHBondContact O-OG1 3.49Å |
| 95 | N | 40.3 | Very low | 44.5 | Very low | 141 Ų | 141 | 119.9 Ų | 119.9 | 75% | 0.754 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.9 | -3.3 | 177.5 | -76 | -1 | 0 | 0 | 0 | 114.1 | ||
| 96 | L | 43 | Very low | 44.9 | Very low | 147 Ų | 147 | 119.1 Ų | 119.1 | 77% | 0.77 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.8 | -0.7 | 175.3 | -72.9 | 166.8 | 0 | 0 | 0 | 113.1 | Q94 | Q94-L96 VanDerWaalsContact C-N 3.34Š|
| 97 | T | 41.5 | Very low | 45.2 | Very low | 117 Ų | 117 | 122.6 Ų | 122.6 | 72% | 0.718 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -111 | 8 | -176 | -33.2 | 0 | 0 | 0 | 0 | 113.3 | L93 | L93-T97 PolarHBondContact O-OG1 3.13Š|
| 98 | T | 47.3 | Very low | 45.6 | Very low | 120 Ų | 120 | 123.4 Ų | 123.4 | 74% | 0.736 | 70% | 0.699 | S | S | * | * | trans | -141.4 | 85.9 | -178.1 | 25.6 | 0 | 0 | 0 | 0 | 110.5 | Q94 | Q94-T98 PolarHBondContact O-OG1 3.49Š| ||
| 99 | G | 34.3 | Very low | 45.9 | Very low | 81 Ų | 81 | 120 Ų | 120 | 84% | 0.835 | 69% | 0.686 | S | S | * | * | trans | -174.8 | 79.8 | 175 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 100 | G | 34.3 | Very low | 46.1 | Very low | 75 Ų | 75 | 117.3 Ų | 117.3 | 77% | 0.773 | 67% | 0.673 | S | S | * | * | trans | 92.4 | 101.1 | 140.3 | 0 | 0 | 0 | 0 | 0 | 118.3 | K102 | G100-K102 PolarHBondContact O-N 3.35Š| ||
| 101 | D | 46.3 | Very low | 47 | Very low | 170 Ų | 170 | 117.9 Ų | 117.9 | 91% | 0.909 | 68% | 0.676 | S | S | * | * | trans | -54.7 | 109.7 | 154.5 | -77.1 | -44.3 | 0 | 0 | 0 | 111.2 | ||||
| 102 | K | 41.1 | Very low | 48 | Very low | 187 Ų | 187 | 117.3 Ų | 117.3 | 81% | 0.813 | 67% | 0.666 | S | S | * | * | trans | -170.6 | 124.3 | 147 | -111.1 | 175 | -177.3 | -179.9 | 0 | 109.4 | G100 S104 | G100-K102 PolarHBondContact O-N 3.35Å; K102-S104 PolarHBondContact O-N 3.34Å | ||
| 103 | P | 42.6 | Very low | 49.2 | Very low | 105 Ų | 105 | 116 Ų | 116 | 68% | 0.682 | 66% | 0.66 | S | S | * | * | trans | -67.1 | 121.8 | 179.6 | 26.4 | -31 | 0 | 0 | 0 | 109.5 | ||||
| 104 | S | 43.3 | Very low | 50.6 | Low | 46 Ų | 46 | 115.6 Ų | 115.6 | 32% | 0.322 | 66% | 0.658 | S | S | . | * | trans | -86.1 | 144.7 | 169.3 | 70.9 | 0 | 0 | 0 | 0 | 108.7 | K102 T106 E107 | K102-S104 PolarHBondContact O-N 3.34Å; S104-T106 PolarHBondContact O-N 3.35Å; S104-E107 PolarHBondContact O-N 3.41Å | ||
| 105 | P | 50.4 | Low | 51.7 | Low | 114 Ų | 114 | 112.1 Ų | 112.1 | 74% | 0.74 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.6 | 2.5 | -175.7 | 26.5 | -33 | 0 | 0 | 0 | 114 | ||
| 106 | T | 53.5 | Low | 53.6 | Low | 79 Ų | 79 | 110.9 Ų | 110.9 | 49% | 0.485 | 63% | 0.629 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -94.2 | -28 | 179.6 | -29.4 | 0 | 0 | 0 | 0 | 112 | S104 Q109 E110 | S104-T106 PolarHBondContact O-N 3.35Å; T106-Q109 PolarHBondContact O-N 2.92Å; T106-E110 WeakPolarHBondContact O-CG 3.1Å; T106-E110 PolarHBondContact O-N 2.79Å |
| 107 | E | 51.7 | Low | 55.1 | Low | 120 Ų | 120 | 106.4 Ų | 106.4 | 56% | 0.561 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -72.9 | -37.6 | -178.4 | -73.5 | 169.7 | -161.4 | 0 | 0 | 112 | S104 Q109 D111 | S104-E107 PolarHBondContact O-N 3.41Å; E107-Q109 VanDerWaalsContact C-N 3.27Å; E107-Q109 PolarHBondContact O-N 3.23Å; E107-D111 WeakPolarHBondContact O-CB 3.49Å; E107-D111 PolarHBondContact O-N 3.25Å |
| 108 | E | 53.8 | Low | 56.4 | Low | 145 Ų | 145 | 107.8 Ų | 107.8 | 68% | 0.678 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -68.2 | -28.6 | 173.6 | -67.1 | 178.3 | 176.9 | 0 | 0 | 112 | A112 | E108-A112 VanDerWaalsContact O-CB 3.26Å; E108-A112 WeakPolarHBondContact O-CB 3.27Å; E108-A112 PolarHBondContact O-N 2.95Å; E108-A112 VanDerWaalsContact O-N 3.11Å |
| 109 | Q | 54.9 | Low | 57.8 | Low | 119 Ų | 119 | 107.2 Ų | 107.2 | 56% | 0.556 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -78.7 | -39.8 | 179.1 | -162 | 71.6 | 51.2 | 0 | 0 | 111.5 | T106 E107 A112 D113 | T106-Q109 PolarHBondContact O-N 2.92Å; E107-Q109 VanDerWaalsContact C-N 3.27Å; E107-Q109 PolarHBondContact O-N 3.23Å; Q109-A112 PolarHBondContact O-N 3.37Å; Q109-D113 PolarHBondContact O-N 3.11Å |
| 110 | E | 56 | Low | 59.7 | Low | 123 Ų | 123 | 108.6 Ų | 108.6 | 58% | 0.575 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -68.7 | -37 | 174.7 | -74.1 | -179.6 | 179.2 | 0 | 0 | 112.1 | T106 D113 L114 | T106-E110 WeakPolarHBondContact O-CG 3.1Å; T106-E110 PolarHBondContact O-N 2.79Å; E110-D113 PolarHBondContact O-N 3.19Å; E110-L114 WeakPolarHBondContact O-CB 3.35Å; E110-L114 PolarHBondContact O-N 2.87Å |
| 111 | D | 64.9 | Low | 61.4 | Low | 116 Ų | 116 | 114.1 Ų | 114.1 | 62% | 0.62 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -67.6 | -39.8 | 173.9 | -166.7 | 45 | 0 | 0 | 0 | 111.6 | E107 L114 E115 | E107-D111 WeakPolarHBondContact O-CB 3.49Å; E107-D111 PolarHBondContact O-N 3.25Å; D111-L114 PolarHBondContact O-N 3.49Å; D111-E115 VanDerWaalsContact O-CB 3.28Å; D111-E115 WeakPolarHBondContact O-CB 3.4Å; D111-E115 PolarHBondContact O-N 3.4Å |
| 112 | A | 70.9 | Confident | 62.5 | Low | 51 Ų | 51 | 111.1 Ų | 111.1 | 42% | 0.421 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -65.4 | -38.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113 | E108 Q109 K116 | E108-A112 VanDerWaalsContact O-CB 3.26Å; E108-A112 WeakPolarHBondContact O-CB 3.27Å; E108-A112 PolarHBondContact O-N 2.95Å; E108-A112 VanDerWaalsContact O-N 3.11Å; Q109-A112 PolarHBondContact O-N 3.37Å; A112-K116 VanDerWaalsContact O-CB 3.22Å; A112-K116 WeakPolarHBondContact O-CB 3.41Å; A112-K116 PolarHBondContact O-N 3.12Å |
| 113 | D | 71.8 | Confident | 63.9 | Low | 94 Ų | 94 | 104.7 Ų | 104.7 | 50% | 0.503 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -71.6 | -36.1 | 176.8 | -77.8 | -18.1 | 0 | 0 | 0 | 111.9 | Q109 E110 A117 | Q109-D113 PolarHBondContact O-N 3.11Å; E110-D113 PolarHBondContact O-N 3.19Å; D113-A117 WeakPolarHBondContact O-CB 3.48Å; D113-A117 PolarHBondContact O-N 2.89Å |
| 114 | L | 72.4 | Confident | 64.6 | Low | 121 Ų | 121 | 104.5 Ų | 104.5 | 63% | 0.634 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -65.4 | -42.9 | 172.8 | -101.2 | 152.8 | 0 | 0 | 0 | 112.2 | E110 D111 A117 R118 | E110-L114 WeakPolarHBondContact O-CB 3.35Å; E110-L114 PolarHBondContact O-N 2.87Å; D111-L114 PolarHBondContact O-N 3.49Å; L114-A117 PolarHBondContact O-N 3.36Å; L114-R118 WeakPolarHBondContact O-CB 3.39Å; L114-R118 PolarHBondContact O-N 2.88Å |
| 115 | E | 71.8 | Confident | 64.9 | Low | 84 Ų | 84 | 109.1 Ų | 109.1 | 39% | 0.393 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -69.9 | -37 | 178.1 | -174 | 54.5 | -150.8 | 0 | 0 | 111.1 | D111 R118 Q119 | D111-E115 VanDerWaalsContact O-CB 3.28Å; D111-E115 WeakPolarHBondContact O-CB 3.4Å; D111-E115 PolarHBondContact O-N 3.4Å; E115-R118 WeakPolarHBondContact O-CB 3.45Å; E115-R118 PolarHBondContact O-N 2.64Å; E115-Q119 WeakPolarHBondContact O-CB 3.5Å; E115-Q119 VanDerWaalsContact O-CG 3.24Å; E115-Q119 WeakPolarHBondContact O-CG 3.29Å; E115-Q119 PolarHBondContact O-N 3.42Å; E115-Q119 PolarHBondContact OE1-NE2 2.66Å; E115-Q119 VanDerWaalsContact OE1-NE2 3.1Å |
| 116 | K | 80.1 | Confident | 64.9 | Low | 114 Ų | 114 | 110.5 Ų | 110.5 | 50% | 0.496 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -64.9 | -43.1 | 172 | -170.3 | -175.6 | 177.4 | -160.6 | 0 | 111.9 | A112 R118 Q119 E120 | A112-K116 VanDerWaalsContact O-CB 3.22Å; A112-K116 WeakPolarHBondContact O-CB 3.41Å; A112-K116 PolarHBondContact O-N 3.12Å; K116-R118 VanDerWaalsContact C-N 3.31Å; K116-R118 PolarHBondContact O-N 2.95Å; K116-Q119 PolarHBondContact O-N 3.32Å; K116-E120 VanDerWaalsContact CE-OE1 3.29Å; K116-E120 WeakPolarHBondContact CE-OE1 3.41Å; K116-E120 IonicContact NZ-OE1 3.93Å; K116-E120 WeakPolarHBondContact O-CB 3.44Å; K116-E120 WeakPolarHBondContact O-CG 3.24Å; K116-E120 PolarHBondContact O-N 3.38Å |
| 117 | A | 73.6 | Confident | 64.6 | Low | 53 Ų | 53 | 112.2 Ų | 112.2 | 44% | 0.438 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -64.1 | -36.5 | 175 | 0 | 0 | 0 | 0 | 0 | 112 | D113 L114 W121 | D113-A117 WeakPolarHBondContact O-CB 3.48Å; D113-A117 PolarHBondContact O-N 2.89Å; L114-A117 PolarHBondContact O-N 3.36Å; A117-W121 WeakPolarHBondContact O-CB 3.43Å; A117-W121 PolarHBondContact O-N 3.16Å |
| 118 | R | 69.5 | Low | 64.2 | Low | 147 Ų | 147 | 113.6 Ų | 113.6 | 56% | 0.555 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -64.6 | -44.8 | 172.8 | 179.8 | -177.9 | -70.9 | -82.6 | -0.8 | 111.5 | L114 E115 K116 W121 E122 | L114-R118 WeakPolarHBondContact O-CB 3.39Å; L114-R118 PolarHBondContact O-N 2.88Å; E115-R118 WeakPolarHBondContact O-CB 3.45Å; E115-R118 PolarHBondContact O-N 2.64Å; K116-R118 VanDerWaalsContact C-N 3.31Å; K116-R118 PolarHBondContact O-N 2.95Å; R118-W121 PolarHBondContact O-N 2.98Å; R118-E122 WeakPolarHBondContact O-CB 3.36Å; R118-E122 WeakPolarHBondContact O-CG 3.33Å; R118-E122 PolarHBondContact O-N 3.44Å |
| 119 | Q | 76.6 | Confident | 63.8 | Low | 107 Ų | 107 | 111.4 Ų | 111.4 | 50% | 0.5 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -66.9 | -37.8 | 177.3 | -72.3 | 171.3 | 15.5 | 0 | 0 | 112.3 | E115 K116 W121 A123 | E115-Q119 WeakPolarHBondContact O-CB 3.5Å; E115-Q119 VanDerWaalsContact O-CG 3.24Å; E115-Q119 WeakPolarHBondContact O-CG 3.29Å; E115-Q119 PolarHBondContact O-N 3.42Å; E115-Q119 PolarHBondContact OE1-NE2 2.66Å; E115-Q119 VanDerWaalsContact OE1-NE2 3.1Å; K116-Q119 PolarHBondContact O-N 3.32Å; Q119-W121 VanDerWaalsContact C-N 3.33Å; Q119-A123 WeakPolarHBondContact O-CB 3.37Å; Q119-A123 PolarHBondContact O-N 3.48Å |
| 120 | E | 74.1 | Confident | 63 | Low | 111 Ų | 111 | 110.4 Ų | 110.4 | 52% | 0.519 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -64.1 | -38.7 | 171.6 | -74.8 | 177.6 | -169.6 | 0 | 0 | 111 | K116 A123 L124 | K116-E120 VanDerWaalsContact CE-OE1 3.29Å; K116-E120 WeakPolarHBondContact CE-OE1 3.41Å; K116-E120 IonicContact NZ-OE1 3.93Å; K116-E120 WeakPolarHBondContact O-CB 3.44Å; K116-E120 WeakPolarHBondContact O-CG 3.24Å; K116-E120 PolarHBondContact O-N 3.38Å; E120-A123 PolarHBondContact O-N 3.08Å; E120-L124 WeakPolarHBondContact O-CG 3.38Å; E120-L124 PolarHBondContact O-N 3.43Å |
| 121 | W | 69.2 | Low | 62.4 | Low | 190 Ų | 190 | 109.6 Ų | 109.6 | 72% | 0.72 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -70.1 | -41.1 | 176.6 | -156.9 | -106.9 | 0 | 0 | 0 | 113 | A117 R118 Q119 A123 L124 D125 | A117-W121 WeakPolarHBondContact O-CB 3.43Å; A117-W121 PolarHBondContact O-N 3.16Å; R118-W121 PolarHBondContact O-N 2.98Å; Q119-W121 VanDerWaalsContact C-N 3.33Å; W121-A123 VanDerWaalsContact C-N 3.33Å; W121-L124 HydrophobicContact CE3-CD1 3.95Å; W121-L124 HydrophobicContact CZ3-CD1 4.12Å; W121-L124 WeakPolarHBondContact O-CB 3.3Å; W121-L124 PolarHBondContact O-N 3.37Å; W121-D125 PolarHBondContact O-N 2.95Å |
| 122 | E | 71 | Confident | 61.5 | Low | 108 Ų | 108 | 108.9 Ų | 108.9 | 51% | 0.505 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -69.4 | -31.1 | 173.4 | -73.6 | -179.5 | -173.7 | 0 | 0 | 112.1 | R118 L124 D125 N126 | R118-E122 WeakPolarHBondContact O-CB 3.36Å; R118-E122 WeakPolarHBondContact O-CG 3.33Å; R118-E122 PolarHBondContact O-N 3.44Å; E122-L124 VanDerWaalsContact C-N 3.33Å; E122-D125 PolarHBondContact O-N 3.1Å; E122-N126 PolarHBondContact O-N 3.34Å |
| 123 | A | 69.6 | Low | 60.2 | Low | 51 Ų | 51 | 115.9 Ų | 115.9 | 42% | 0.421 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -67.1 | -34.7 | 172 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q119 E120 W121 D125 N126 I127 | Q119-A123 WeakPolarHBondContact O-CB 3.37Å; Q119-A123 PolarHBondContact O-N 3.48Å; E120-A123 PolarHBondContact O-N 3.08Å; W121-A123 VanDerWaalsContact C-N 3.33Å; A123-D125 VanDerWaalsContact C-N 3.34Å; A123-N126 CarbonylContact O-C 3.6Å; A123-N126 PolarHBondContact O-N 3.47Å; A123-I127 WeakPolarHBondContact O-CG1 3.48Å; A123-I127 PolarHBondContact O-N 3.31Å; A123-I127 VanDerWaalsContact O-N 3.09Å |
| 124 | L | 57 | Low | 59 | Low | 102 Ų | 102 | 118.6 Ų | 118.6 | 53% | 0.534 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -68 | -30.9 | 173.6 | -70.3 | 174.6 | 0 | 0 | 0 | 112.8 | E120 W121 E122 N126 I127 | E120-L124 WeakPolarHBondContact O-CG 3.38Å; E120-L124 PolarHBondContact O-N 3.43Å; W121-L124 HydrophobicContact CE3-CD1 3.95Å; W121-L124 HydrophobicContact CZ3-CD1 4.12Å; W121-L124 WeakPolarHBondContact O-CB 3.3Å; W121-L124 PolarHBondContact O-N 3.37Å; E122-L124 VanDerWaalsContact C-N 3.33Å; L124-N126 VanDerWaalsContact C-N 3.26Å; L124-N126 PolarHBondContact O-N 3.07Å; L124-I127 HydrophobicContact CD2-CD1 4.08Å; L124-I127 PolarHBondContact O-N 3.49Å |
| 125 | D | 50.5 | Low | 58.4 | Low | 142 Ų | 142 | 116.3 Ų | 116.3 | 76% | 0.759 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -69.4 | -25.3 | 173 | -117 | 4.5 | 0 | 0 | 0 | 112.1 | W121 E122 A123 | W121-D125 PolarHBondContact O-N 2.95Å; E122-D125 PolarHBondContact O-N 3.1Å; A123-D125 VanDerWaalsContact C-N 3.34Å |
| 126 | N | 49.8 | Very low | 58.3 | Low | 144 Ų | 144 | 119.4 Ų | 119.4 | 77% | 0.77 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -89.9 | -11.2 | 173.9 | -82.8 | -30.4 | 0 | 0 | 0 | 114.3 | E122 A123 L124 Q128 | E122-N126 PolarHBondContact O-N 3.34Å; A123-N126 CarbonylContact O-C 3.6Å; A123-N126 PolarHBondContact O-N 3.47Å; L124-N126 VanDerWaalsContact C-N 3.26Å; L124-N126 PolarHBondContact O-N 3.07Å; N126-Q128 PolarHBondContact O-N 3.36Å |
| 127 | I | 46.8 | Very low | 58.3 | Low | 115 Ų | 115 | 117.2 Ų | 117.2 | 59% | 0.59 | 62% | 0.624 | S | S | * | * | trans | -81.2 | 69.9 | 165.2 | -56.5 | 170.4 | 0 | 0 | 0 | 107.1 | A123 L124 P129 | A123-I127 WeakPolarHBondContact O-CG1 3.48Å; A123-I127 PolarHBondContact O-N 3.31Å; A123-I127 VanDerWaalsContact O-N 3.09Å; L124-I127 HydrophobicContact CD2-CD1 4.08Å; L124-I127 PolarHBondContact O-N 3.49Å; I127-P129 WeakPolarHBondContact O-CD 3.02Å | ||
| 128 | Q | 44.7 | Very low | 59 | Low | 149 Ų | 149 | 116.9 Ų | 116.9 | 70% | 0.696 | 62% | 0.617 | S | S | * | * | trans | -60.5 | 120.3 | 152.5 | -145.9 | 140.8 | 75.9 | 0 | 0 | 104.9 | N126 A130 | N126-Q128 PolarHBondContact O-N 3.36Å; Q128-A130 PolarHBondContact O-N 2.84Å | ||
| 129 | P | 45 | Very low | 60.1 | Low | 98 Ų | 98 | 114.1 Ų | 114.1 | 64% | 0.636 | 62% | 0.618 | S | S | * | * | trans | -52.5 | 123.5 | 174.3 | 21.4 | -30.5 | 0 | 0 | 0 | 105.7 | I127 L131 | I127-P129 WeakPolarHBondContact O-CD 3.02Å; P129-L131 VanDerWaalsContact C-N 3.29Å; P129-L131 PolarHBondContact O-N 3.4Å | ||
| 130 | A | 37.1 | Very low | 61.1 | Low | 99 Ų | 99 | 112.5 Ų | 112.5 | 82% | 0.818 | 61% | 0.613 | S | S | * | * | trans | -45.8 | 98.9 | -176.6 | 0 | 0 | 0 | 0 | 0 | 108.5 | Q128 T132 | Q128-A130 PolarHBondContact O-N 2.84Å; A130-T132 PolarHBondContact O-N 2.84Å | ||
| 131 | L | 44.3 | Very low | 62.2 | Low | 106 Ų | 106 | 107.2 Ų | 107.2 | 56% | 0.555 | 59% | 0.588 | S | S | * | * | trans | -70 | 109.5 | 175.5 | -75.7 | 172.1 | 0 | 0 | 0 | 103 | P129 E133 L226 | P129-L131 VanDerWaalsContact C-N 3.29Å; P129-L131 PolarHBondContact O-N 3.4Å; L131-E133 PolarHBondContact O-N 2.86Å; L131-L226 HydrophobicContact CD1-CD1 4.03Å; L131-L226 HydrophobicContact CD2-CD1 3.95Å | ||
| 132 | T | 44.8 | Very low | 63.6 | Low | 101 Ų | 101 | 100.5 Ų | 100.5 | 62% | 0.62 | 57% | 0.57 | S | S | * | * | trans | -52.7 | 113.3 | 166 | 42.6 | 0 | 0 | 0 | 0 | 106.9 | A130 D134 S135 | A130-T132 PolarHBondContact O-N 2.84Å; T132-D134 PolarHBondContact O-N 3.3Å; T132-S135 PolarHBondContact O-N 3.18Å; T132-S135 PolarHBondContact O-OG 2.87Å; T132-S135 PolarHBondContact OG1-OG 3.27Å | ||
| 133 | E | 44.7 | Very low | 64.9 | Low | 198 Ų | 198 | 96.4 Ų | 96.4 | 93% | 0.925 | 55% | 0.551 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.2 | -1.1 | -175.7 | -68.5 | -165.8 | 148.1 | 0 | 0 | 113.5 | L131 | L131-E133 PolarHBondContact O-N 2.86Š|
| 134 | D | 46.4 | Very low | 66.3 | Low | 151 Ų | 151 | 99.5 Ų | 99.5 | 81% | 0.807 | 56% | 0.56 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.8 | 0.4 | -179.4 | -68.5 | -38.2 | 0 | 0 | 0 | 115.3 | T132 N136 | T132-D134 PolarHBondContact O-N 3.3Å; D134-N136 PolarHBondContact O-N 2.76Å |
| 135 | S | 60 | Low | 68.3 | Low | 73 Ų | 73 | 98.1 Ų | 98.1 | 51% | 0.51 | 55% | 0.551 | S | S | . | * | trans | -86 | 78.6 | -174.3 | -54.5 | 0 | 0 | 0 | 0 | 112 | T132 P137 | T132-S135 PolarHBondContact O-N 3.18Å; T132-S135 PolarHBondContact O-OG 2.87Å; T132-S135 PolarHBondContact OG1-OG 3.27Å; S135-P137 WeakPolarHBondContact O-CD 3.29Å; S135-P137 VanDerWaalsContact O-N 3.17Å | ||
| 136 | N | 69.8 | Low | 70.6 | Confident | 148 Ų | 148 | 91.3 Ų | 91.3 | 79% | 0.791 | 52% | 0.515 | S | S | * | . | P | Polyproline II helix | trans | -53.7 | 121.9 | 165.2 | -79.7 | -48 | 0 | 0 | 0 | 108.9 | D134 T138 | D134-N136 PolarHBondContact O-N 2.76Å; N136-T138 PolarHBondContact O-N 3.09Å |
| 137 | P | 80.4 | Confident | 72.9 | Confident | 68 Ų | 68 | 85.3 Ų | 85.3 | 44% | 0.442 | 48% | 0.482 | S | S | . | . | P | Polyproline II helix | trans | -61.9 | 128.3 | -174.7 | 5.9 | -7.2 | 0 | 0 | 0 | 110.1 | S135 R225 | S135-P137 WeakPolarHBondContact O-CD 3.29Å; S135-P137 VanDerWaalsContact O-N 3.17Å; P137-R225 WeakPolarHBondContact CB-O 3.39Å |
| 138 | T | 88.3 | Confident | 75.4 | Confident | 46 Ų | 46 | 85.4 Ų | 85.4 | 28% | 0.282 | 48% | 0.48 | S | S | . | . | P | Polyproline II helix | trans | -57.8 | 131.1 | -179.1 | -55.5 | 0 | 0 | 0 | 0 | 109.7 | N136 R212 K219 D227 | N136-T138 PolarHBondContact O-N 3.09Å; T138-R212 HydrophobicContact CG2-CG 3.55Å; T138-K219 PolarHBondContact O-NZ 3.36Å; T138-D227 WeakPolarHBondContact CB-OD2 3.23Å; T138-D227 PolarHBondContact N-OD2 3.46Å; T138-D227 PolarHBondContact OG1-OD2 3.02Å |
| 139 | P | 92.6 | Very high | 77.9 | Confident | 90 Ų | 90 | 80.1 Ų | 80.1 | 58% | 0.584 | 45% | 0.454 | S | S | * | . | P | Polyproline II helix | trans | -62.4 | 140.6 | -178.9 | 25 | -34.4 | 0 | 0 | 0 | 110.7 | R212 | P139-R212 PolarHBondContact O-NE 3.45Å; P139-R212 PolarHBondContact O-NH2 3.39Å |
| 140 | L | 96.9 | Very high | 80.5 | Confident | 72 Ų | 72 | 75.6 Ų | 75.6 | 38% | 0.377 | 42% | 0.424 | S | S | . | . | P | Polyproline II helix | trans | -56 | 141 | 175.6 | -56.8 | 177.4 | 0 | 0 | 0 | 109.8 | R212 T216 K219 M265 | L140-R212 PolarHBondContact O-NH2 3Å; L140-T216 HydrophobicContact CB-CG2 4.16Å; L140-T216 HydrophobicContact CD2-CG2 4.06Å; L140-K219 HydrophobicContact CD2-CB 4.09Å; L140-K219 HydrophobicContact CD2-CD 3.68Å; L140-M265 HydrophobicContact CB-CE 4.19Å |
| 141 | I | 98.1 | Very high | 83.3 | Confident | 0 Ų | 0 | 76.4 Ų | 76.4 | 0% | 0 | 41% | 0.411 | C | S | . | . | P | Polyproline II helix | trans | -94.2 | 134.5 | 173.9 | -173.1 | 160.7 | 0 | 0 | 0 | 109.9 | E145 A146 V209 R212 V213 T216 L261 | I141-E145 HydrophobicContact CD1-CB 4.43Å; I141-E145 HydrophobicContact CD1-CG 4.05Å; I141-E145 HydrophobicContact CG1-CB 3.89Å; I141-E145 HydrophobicContact CG1-CG 3.87Å; I141-A146 HydrophobicContact CD1-CB 3.91Å; I141-A146 HydrophobicContact CG1-CB 4.17Å; I141-V209 HydrophobicContact CD1-CB 4.49Å; I141-V209 HydrophobicContact CD1-CG1 3.8Å; I141-R212 HydrophobicContact CB-CB 4.27Å; I141-R212 HydrophobicContact CG2-CB 4.16Å; I141-V213 HydrophobicContact CD1-CG2 4.43Å; I141-V213 HydrophobicContact CG2-CB 4.45Å; I141-V213 HydrophobicContact CG2-CG2 3.98Å; I141-T216 HydrophobicContact CG2-CG2 4.42Å; I141-T216 PolarHBondContact N-OG1 3.17Å; I141-T216 VanDerWaalsContact N-OG1 3.13Å; I141-L261 HydrophobicContact CG2-CD1 4.19Å; I141-L261 HydrophobicContact CG2-CD2 4.14Å |
| 142 | S | 98.5 | Very high | 85.9 | Confident | 50 Ų | 50 | 76.3 Ų | 76.3 | 35% | 0.35 | 42% | 0.415 | S | S | . | . | P | Polyproline II helix | trans | -78.3 | 158 | 172.5 | 74.3 | 0 | 0 | 0 | 0 | 111 | N144 E145 A146 | S142-N144 VanDerWaalsContact C-N 3.27Å; S142-N144 PolarHBondContact O-N 3.46Å; S142-E145 PolarHBondContact O-N 3.49Å; S142-E145 VanDerWaalsContact OG-CB 3.3Å; S142-E145 WeakPolarHBondContact OG-CB 3.5Å; S142-E145 PolarHBondContact OG-N 2.87Å; S142-A146 PolarHBondContact O-N 3.06Å; S142-A146 VanDerWaalsContact O-N 3.1Å |
| 143 | F | 98.6 | Very high | 88.3 | Confident | 22 Ų | 22 | 73.7 Ų | 73.7 | 10% | 0.096 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -56.8 | -42.5 | 172.6 | 175.7 | -95.8 | 0 | 0 | 0 | 112.1 | E145 A146 L147 M258 Y262 V320 N324 | F143-E145 PolarHBondContact O-N 3.28Å; F143-A146 PolarHBondContact O-N 2.87Å; F143-L147 HydrophobicContact CE1-CB 4.31Å; F143-L147 HydrophobicContact CE1-CD2 3.9Å; F143-L147 HydrophobicContact CZ-CD2 4.36Å; F143-L147 WeakPolarHBondContact O-CB 3.29Å; F143-L147 PolarHBondContact O-N 2.86Å; F143-M258 HydrophobicContact CD2-CE 4Å; F143-M258 WeakPolarHBondContact CD2-O 3.46Å; F143-M258 HydrophobicContact CE2-CB 4.25Å; F143-M258 HydrophobicContact CE2-CE 3.66Å; F143-M258 HydrophobicContact CZ-CE 4.17Å; F143-Y262 HydrophobicContact CD1-CD2 4.11Å; F143-Y262 HydrophobicContact CD2-CD2 4.22Å; F143-Y262 HydrophobicContact CD2-CG 4.42Å; F143-Y262 HydrophobicContact CE1-CD2 4.41Å; F143-Y262 HydrophobicContact CE2-CD2 4.49Å; F143-Y262 HydrophobicContact CG-CD2 4.02Å; F143-V320 HydrophobicContact CE1-CG1 3.9Å; F143-V320 HydrophobicContact CZ-CG1 3.7Å; F143-N324 VanDerWaalsContact CE1-ND2 3.29Å; F143-N324 WeakPolarHBondContact CE1-ND2 3.47Å; F143-N324 WeakPolarHBondContact CZ-ND2 3.47Å |
| 144 | N | 98.4 | Very high | 90.7 | Very high | 116 Ų | 116 | 71.3 Ų | 71.3 | 62% | 0.62 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -66.8 | -37.4 | -178.9 | -68.2 | -28.1 | 0 | 0 | 0 | 112.4 | S142 L147 Q148 | S142-N144 VanDerWaalsContact C-N 3.27Å; S142-N144 PolarHBondContact O-N 3.46Å; N144-L147 PolarHBondContact O-N 2.85Å; N144-Q148 VanDerWaalsContact O-CB 3.27Å; N144-Q148 WeakPolarHBondContact O-CB 3.41Å; N144-Q148 PolarHBondContact O-N 2.69Å |
| 145 | E | 98.4 | Very high | 93 | Very high | 72 Ų | 72 | 65 Ų | 65 | 34% | 0.336 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -64.6 | -45 | 175 | -177 | -173.7 | 163.4 | 0 | 0 | 111.1 | I141 S142 F143 Q148 Y149 R212 | I141-E145 HydrophobicContact CD1-CB 4.43Å; I141-E145 HydrophobicContact CD1-CG 4.05Å; I141-E145 HydrophobicContact CG1-CB 3.89Å; I141-E145 HydrophobicContact CG1-CG 3.87Å; S142-E145 PolarHBondContact O-N 3.49Å; S142-E145 VanDerWaalsContact OG-CB 3.3Å; S142-E145 WeakPolarHBondContact OG-CB 3.5Å; S142-E145 PolarHBondContact OG-N 2.87Å; F143-E145 PolarHBondContact O-N 3.28Å; E145-Q148 PolarHBondContact O-N 2.88Å; E145-Y149 PolarHBondContact O-N 3.37Å; E145-Y149 VanDerWaalsContact O-N 3.16Å; E145-R212 IonicContact OE1-CZ 2.88Å; E145-R212 VanDerWaalsContact OE1-CZ 3.26Å; E145-R212 IonicContact OE1-NH1 2.98Å; E145-R212 PolarHBondContact OE1-NH1 3.47Å; E145-R212 IonicContact OE1-NH2 3.4Å; E145-R212 PolarHBondContact OE1-NH2 3.27Å; E145-R212 IonicContact OE2-NH2 3.26Å; E145-R212 PolarHBondContact OE2-NH2 3.01Å |
| 146 | A | 98.6 | Very high | 94.6 | Very high | 0 Ų | 0 | 62.6 Ų | 62.6 | 0% | 0 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -65.8 | -38 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | I141 S142 F143 Y149 F150 V213 M258 L261 | I141-A146 HydrophobicContact CD1-CB 3.91Å; I141-A146 HydrophobicContact CG1-CB 4.17Å; S142-A146 PolarHBondContact O-N 3.06Å; S142-A146 VanDerWaalsContact O-N 3.1Å; F143-A146 PolarHBondContact O-N 2.87Å; A146-Y149 WeakPolarHBondContact O-CB 3.5Å; A146-Y149 PolarHBondContact O-N 2.95Å; A146-F150 VanDerWaalsContact O-CD2 3.24Å; A146-F150 WeakPolarHBondContact O-CD2 3.33Å; A146-F150 PolarHBondContact O-N 3.11Å; A146-V213 HydrophobicContact CB-CG2 4.02Å; A146-M258 HydrophobicContact CB-CE 3.85Å; A146-M258 HydrophobicContact CB-SD 3.65Å; A146-L261 HydrophobicContact CB-CD2 3.77Å |
| 147 | L | 98.6 | Very high | 95.7 | Very high | 18 Ų | 18 | 61 Ų | 61 | 9% | 0.094 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -66.6 | -41.7 | 176.2 | -178.4 | 63.7 | 0 | 0 | 0 | 111.1 | F143 N144 Y149 F150 Q151 L194 I198 M258 V320 | F143-L147 HydrophobicContact CE1-CB 4.31Å; F143-L147 HydrophobicContact CE1-CD2 3.9Å; F143-L147 HydrophobicContact CZ-CD2 4.36Å; F143-L147 WeakPolarHBondContact O-CB 3.29Å; F143-L147 PolarHBondContact O-N 2.86Å; N144-L147 PolarHBondContact O-N 2.85Å; L147-Y149 VanDerWaalsContact C-N 3.27Å; L147-Y149 PolarHBondContact O-N 3.38Å; L147-F150 PolarHBondContact O-N 2.86Å; L147-F150 VanDerWaalsContact O-N 3.08Å; L147-Q151 HydrophobicContact CG-CG 4.38Å; L147-Q151 WeakPolarHBondContact O-CG 3.5Å; L147-Q151 PolarHBondContact O-N 2.89Å; L147-L194 HydrophobicContact CD1-CD2 4.29Å; L147-I198 HydrophobicContact CD1-CD1 4.21Å; L147-M258 HydrophobicContact CB-CE 3.96Å; L147-M258 HydrophobicContact CD1-CE 4.46Å; L147-V320 HydrophobicContact CD2-CG1 4.05Å |
| 148 | Q | 98.6 | Very high | 96.4 | Very high | 116 Ų | 116 | 59.6 Ų | 59.6 | 54% | 0.542 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -58.4 | -41.2 | 177.2 | -175.2 | 177.5 | 11.6 | 0 | 0 | 111.2 | N144 E145 F150 Q151 T152 | N144-Q148 VanDerWaalsContact O-CB 3.27Å; N144-Q148 WeakPolarHBondContact O-CB 3.41Å; N144-Q148 PolarHBondContact O-N 2.69Å; E145-Q148 PolarHBondContact O-N 2.88Å; Q148-F150 VanDerWaalsContact C-N 3.32Å; Q148-F150 PolarHBondContact O-N 3.34Å; Q148-Q151 WeakPolarHBondContact O-CB 3.39Å; Q148-Q151 PolarHBondContact O-N 2.74Å; Q148-Q151 VanDerWaalsContact O-N 3.11Å; Q148-T152 HydrophobicContact CG-CG2 4.41Å; Q148-T152 PolarHBondContact O-N 3.41Å; Q148-T152 PolarHBondContact O-OG1 3.19Å; Q148-T152 VanDerWaalsContact O-OG1 3.05Å |
| 149 | Y | 98.4 | Very high | 96.8 | Very high | 39 Ų | 39 | 61.1 Ų | 61.1 | 15% | 0.153 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -53.4 | -48.2 | 173.3 | 165 | -96.6 | 0 | 0 | 0 | 111.9 | E145 A146 L147 Q151 T152 T153 Q207 V209 H210 | E145-Y149 PolarHBondContact O-N 3.37Å; E145-Y149 VanDerWaalsContact O-N 3.16Å; A146-Y149 WeakPolarHBondContact O-CB 3.5Å; A146-Y149 PolarHBondContact O-N 2.95Å; L147-Y149 VanDerWaalsContact C-N 3.27Å; L147-Y149 PolarHBondContact O-N 3.38Å; Y149-Q151 VanDerWaalsContact C-N 3.34Å; Y149-Q151 PolarHBondContact O-N 2.89Å; Y149-T152 PolarHBondContact O-N 2.65Å; Y149-T152 PolarHBondContact O-OG1 2.66Å; Y149-T153 WeakPolarHBondContact CE2-OG1 3.4Å; Y149-T153 VanDerWaalsContact O-CB 3.29Å; Y149-T153 WeakPolarHBondContact O-CB 3.5Å; Y149-T153 PolarHBondContact O-N 3.01Å; Y149-T153 PolarHBondContact O-OG1 3.31Å; Y149-Q207 VanDerWaalsContact OH-CD 3.3Å; Y149-Q207 WeakPolarHBondContact OH-CG 3.41Å; Y149-Q207 PolarHBondContact OH-OE1 2.92Å; Y149-V209 HydrophobicContact CD1-CB 4.35Å; Y149-V209 HydrophobicContact CD1-CG1 3.87Å; Y149-V209 HydrophobicContact CD2-CB 4.18Å; Y149-V209 HydrophobicContact CD2-CG1 4.41Å; Y149-V209 HydrophobicContact CD2-CG2 3.85Å; Y149-V209 HydrophobicContact CE1-CG1 4.49Å; Y149-V209 HydrophobicContact CE2-CB 4.49Å; Y149-V209 HydrophobicContact CE2-CG2 4.43Å; Y149-V209 HydrophobicContact CG-CB 4.1Å; Y149-V209 HydrophobicContact CG-CG1 3.83Å; Y149-V209 HydrophobicContact CG-CG2 4.02Å; Y149-H210 AromaticContact CE1-NE2 3.49Å; Y149-H210 WeakPolarHBondContact CE1-NE2 3.48Å |
| 150 | F | 98.2 | Very high | 96.9 | Very high | 2 Ų | 2 | 64.1 Ų | 64.1 | 1% | 0.009 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -70.6 | -28.2 | 178.1 | -71.6 | -70.3 | 0 | 0 | 0 | 113.6 | A146 L147 Q148 T152 L155 L194 I198 C201 H210 F254 M258 | A146-F150 VanDerWaalsContact O-CD2 3.24Å; A146-F150 WeakPolarHBondContact O-CD2 3.33Å; A146-F150 PolarHBondContact O-N 3.11Å; L147-F150 PolarHBondContact O-N 2.86Å; L147-F150 VanDerWaalsContact O-N 3.08Å; Q148-F150 VanDerWaalsContact C-N 3.32Å; Q148-F150 PolarHBondContact O-N 3.34Å; F150-T152 VanDerWaalsContact C-N 3.32Å; F150-L155 HydrophobicContact CB-CD1 4.38Å; F150-L155 HydrophobicContact CD1-CD1 4.29Å; F150-L155 HydrophobicContact CD1-CD2 4.31Å; F150-L155 WeakPolarHBondContact O-CD1 2.99Å; F150-L194 HydrophobicContact CB-CD1 4.22Å; F150-I198 HydrophobicContact CB-CD1 3.74Å; F150-I198 HydrophobicContact CB-CG1 3.83Å; F150-I198 HydrophobicContact CD1-CG1 3.86Å; F150-I198 HydrophobicContact CD2-CD1 4.08Å; F150-I198 HydrophobicContact CD2-CG1 4.16Å; F150-I198 HydrophobicContact CD2-CG2 4.39Å; F150-I198 HydrophobicContact CE1-CG1 4.5Å; F150-I198 HydrophobicContact CE2-CG2 4.3Å; F150-I198 HydrophobicContact CG-CD1 3.89Å; F150-I198 HydrophobicContact CG-CG1 3.68Å; F150-I198 HydrophobicContact CZ-CG2 4.37Å; F150-C201 HydrophobicContact CE1-CB 4.29Å; F150-H210 AromaticContact CE1-NE2 3.94Å; F150-H210 AromaticContact CZ-NE2 3.58Å; F150-F254 HydrophobicContact CE1-CD1 4.5Å; F150-F254 AromaticContact CE2-CD1 3.44Å; F150-F254 HydrophobicContact CE2-CD1 3.44Å; F150-F254 VanDerWaalsContact CE2-CD1 3.44Å; F150-F254 AromaticContact CE2-CE1 3.78Å; F150-F254 HydrophobicContact CE2-CE1 3.78Å; F150-F254 HydrophobicContact CE2-CG 4.31Å; F150-F254 HydrophobicContact CZ-CB 4.09Å; F150-F254 AromaticContact CZ-CD1 3.28Å; F150-F254 HydrophobicContact CZ-CD1 3.28Å; F150-F254 AromaticContact CZ-CE1 3.85Å; F150-F254 HydrophobicContact CZ-CE1 3.85Å; F150-F254 AromaticContact CZ-CG 3.71Å; F150-F254 HydrophobicContact CZ-CG 3.71Å; F150-M258 HydrophobicContact CD2-CE 4.42Å; F150-M258 HydrophobicContact CD2-SD 4.31Å; F150-M258 HydrophobicContact CE2-CG 4.29Å; F150-M258 HydrophobicContact CE2-SD 3.99Å |
| 151 | Q | 97.6 | Very high | 96.6 | Very high | 116 Ų | 116 | 65.8 Ų | 65.8 | 54% | 0.542 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -70.8 | -28.7 | 174.6 | -71.4 | 173.5 | -31.3 | 0 | 0 | 112.6 | L147 Q148 Y149 L194 | L147-Q151 HydrophobicContact CG-CG 4.38Å; L147-Q151 WeakPolarHBondContact O-CG 3.5Å; L147-Q151 PolarHBondContact O-N 2.89Å; Q148-Q151 WeakPolarHBondContact O-CB 3.39Å; Q148-Q151 PolarHBondContact O-N 2.74Å; Q148-Q151 VanDerWaalsContact O-N 3.11Å; Y149-Q151 VanDerWaalsContact C-N 3.34Å; Y149-Q151 PolarHBondContact O-N 2.89Å; Q151-L194 HydrophobicContact CG-CD2 3.64Å |
| 152 | T | 97.1 | Very high | 96.5 | Very high | 104 Ų | 104 | 66.6 Ų | 66.6 | 64% | 0.638 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -100.8 | -13.1 | -178.2 | 57.8 | 0 | 0 | 0 | 0 | 114.1 | Q148 Y149 F150 | Q148-T152 HydrophobicContact CG-CG2 4.41Å; Q148-T152 PolarHBondContact O-N 3.41Å; Q148-T152 PolarHBondContact O-OG1 3.19Å; Q148-T152 VanDerWaalsContact O-OG1 3.05Å; Y149-T152 PolarHBondContact O-N 2.65Å; Y149-T152 PolarHBondContact O-OG1 2.66Å; F150-T152 VanDerWaalsContact C-N 3.32Å |
| 153 | T | 95.9 | Very high | 96.4 | Very high | 47 Ų | 47 | 69.1 Ų | 69.1 | 29% | 0.288 | 36% | 0.356 | S | S | . | . | S | Bend | trans | -81 | 142.7 | 178.7 | -61.3 | 0 | 0 | 0 | 0 | 110.3 | Y149 L155 | Y149-T153 WeakPolarHBondContact CE2-OG1 3.4Å; Y149-T153 VanDerWaalsContact O-CB 3.29Å; Y149-T153 WeakPolarHBondContact O-CB 3.5Å; Y149-T153 PolarHBondContact O-N 3.01Å; Y149-T153 PolarHBondContact O-OG1 3.31Å; T153-L155 HydrophobicContact CG2-CD2 3.97Å; T153-L155 PolarHBondContact O-N 3.46Å; T153-L155 VanDerWaalsContact O-N 3.12Å |
| 154 | D | 94.4 | Very high | 96.2 | Very high | 148 Ų | 148 | 69 Ų | 69 | 79% | 0.791 | 36% | 0.357 | S | S | * | . | trans | -70 | 107.2 | 170.7 | -175.9 | 6.5 | 0 | 0 | 0 | 110.2 | G156 | D154-G156 PolarHBondContact OD1-N 2.64Š| ||
| 155 | L | 94.8 | Very high | 95.9 | Very high | 18 Ų | 18 | 65.7 Ų | 65.7 | 9% | 0.094 | 34% | 0.341 | C | S | . | . | trans | -104.7 | 17.3 | 176.8 | -55.3 | 178.2 | 0 | 0 | 0 | 111.9 | F150 T153 D157 L158 L159 L194 A197 | F150-L155 HydrophobicContact CB-CD1 4.38Å; F150-L155 HydrophobicContact CD1-CD1 4.29Å; F150-L155 HydrophobicContact CD1-CD2 4.31Å; F150-L155 WeakPolarHBondContact O-CD1 2.99Å; T153-L155 HydrophobicContact CG2-CD2 3.97Å; T153-L155 PolarHBondContact O-N 3.46Å; T153-L155 VanDerWaalsContact O-N 3.12Å; L155-D157 VanDerWaalsContact C-N 3.27Å; L155-D157 PolarHBondContact O-N 3.35Å; L155-D157 VanDerWaalsContact O-N 3.16Å; L155-L158 HydrophobicContact CD2-CD1 4.04Å; L155-L158 WeakPolarHBondContact O-CB 3.32Å; L155-L158 PolarHBondContact O-N 2.74Å; L155-L159 HydrophobicContact CB-CG 4.49Å; L155-L159 WeakPolarHBondContact O-CG 3.28Å; L155-L159 PolarHBondContact O-N 3.23Å; L155-L194 HydrophobicContact CD1-CD1 3.63Å; L155-A197 HydrophobicContact CB-CB 4.38Å; L155-A197 HydrophobicContact CD1-CB 4.13Å | ||
| 156 | G | 94.1 | Very high | 95.6 | Very high | 23 Ų | 23 | 65.4 Ų | 65.4 | 24% | 0.237 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -52.9 | -39.7 | -172.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | D154 L159 K160 | D154-G156 PolarHBondContact OD1-N 2.64Å; G156-L159 PolarHBondContact O-N 3.31Å; G156-K160 WeakPolarHBondContact O-CG 3.35Å; G156-K160 PolarHBondContact O-N 3.3Å |
| 157 | D | 94 | Very high | 95.2 | Very high | 114 Ų | 114 | 75.7 Ų | 75.7 | 61% | 0.61 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -71.9 | -32.3 | 178 | -72.3 | -26.8 | 0 | 0 | 0 | 113.5 | L155 K160 N161 | L155-D157 VanDerWaalsContact C-N 3.27Å; L155-D157 PolarHBondContact O-N 3.35Å; L155-D157 VanDerWaalsContact O-N 3.16Å; D157-K160 IonicContact OD1-NZ 3.24Å; D157-K160 PolarHBondContact OD1-NZ 3.38Å; D157-N161 PolarHBondContact O-ND2 3.4Å; D157-N161 VanDerWaalsContact O-ND2 3.1Å |
| 158 | L | 95.2 | Very high | 94.7 | Very high | 39 Ų | 39 | 78 Ų | 78 | 20% | 0.204 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -72.4 | -41.4 | 174.3 | -58.4 | -179.1 | 0 | 0 | 0 | 110.6 | L155 K160 N161 I162 A197 Q200 C201 | L155-L158 HydrophobicContact CD2-CD1 4.04Å; L155-L158 WeakPolarHBondContact O-CB 3.32Å; L155-L158 PolarHBondContact O-N 2.74Å; L158-K160 PolarHBondContact O-N 2.94Å; L158-N161 PolarHBondContact O-N 2.91Å; L158-I162 WeakPolarHBondContact O-CG2 3.39Å; L158-I162 PolarHBondContact O-N 3.16Å; L158-A197 HydrophobicContact CB-CB 4.19Å; L158-Q200 HydrophobicContact CB-CB 4.5Å; L158-Q200 HydrophobicContact CD2-CB 4.17Å; L158-Q200 PolarHBondContact O-OE1 3.08Å; L158-C201 HydrophobicContact CD1-CB 3.76Å |
| 159 | L | 95.2 | Very high | 94.4 | Very high | 78 Ų | 78 | 78.2 Ų | 78.2 | 41% | 0.408 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -60.3 | -29.7 | 178.3 | -74.5 | 168.1 | 0 | 0 | 0 | 113.1 | L155 G156 N161 I162 D193 A197 | L155-L159 HydrophobicContact CB-CG 4.49Å; L155-L159 WeakPolarHBondContact O-CG 3.28Å; L155-L159 PolarHBondContact O-N 3.23Å; G156-L159 PolarHBondContact O-N 3.31Å; L159-N161 PolarHBondContact O-N 2.96Å; L159-I162 HydrophobicContact CD2-CD1 4.27Å; L159-I162 WeakPolarHBondContact O-CG1 3.46Å; L159-D193 HydrophobicContact CD2-CB 4.05Å; L159-A197 HydrophobicContact CD2-CB 3.89Å; L159-A197 HydrophobicContact CG-CB 4.16Å |
| 160 | K | 94.4 | Very high | 94.2 | Very high | 152 Ų | 152 | 79 Ų | 79 | 66% | 0.661 | 42% | 0.417 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.2 | -27.4 | 176 | -70.4 | 165.7 | -165.5 | 163.5 | 0 | 113.1 | G156 D157 L158 | G156-K160 WeakPolarHBondContact O-CG 3.35Å; G156-K160 PolarHBondContact O-N 3.3Å; D157-K160 IonicContact OD1-NZ 3.24Å; D157-K160 PolarHBondContact OD1-NZ 3.38Å; L158-K160 PolarHBondContact O-N 2.94Å |
| 161 | N | 92.4 | Very high | 93.9 | Very high | 108 Ų | 108 | 86 Ų | 86 | 58% | 0.578 | 45% | 0.453 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.4 | -0.4 | -169.7 | -66.5 | -46.1 | 0 | 0 | 0 | 113.1 | D157 L158 L159 Q200 | D157-N161 PolarHBondContact O-ND2 3.4Å; D157-N161 VanDerWaalsContact O-ND2 3.1Å; L158-N161 PolarHBondContact O-N 2.91Å; L159-N161 PolarHBondContact O-N 2.96Å; N161-Q200 VanDerWaalsContact C-NE2 3.25Å; N161-Q200 PolarHBondContact O-NE2 3.26Å |
| 162 | I | 96 | Very high | 93.6 | Very high | 17 Ų | 17 | 83.1 Ų | 83.1 | 9% | 0.087 | 45% | 0.45 | C | S | . | . | trans | -68.6 | 146.1 | -179.1 | 68.2 | 173.1 | 0 | 0 | 0 | 112.5 | L158 L159 P164 D193 F196 A197 Q200 | L158-I162 WeakPolarHBondContact O-CG2 3.39Å; L158-I162 PolarHBondContact O-N 3.16Å; L159-I162 HydrophobicContact CD2-CD1 4.27Å; L159-I162 WeakPolarHBondContact O-CG1 3.46Å; I162-P164 HydrophobicContact CD1-CB 4.37Å; I162-P164 HydrophobicContact CD1-CG 4.24Å; I162-P164 HydrophobicContact CG1-CG 4.39Å; I162-D193 HydrophobicContact CD1-CB 3.51Å; I162-F196 HydrophobicContact CB-CB 3.91Å; I162-F196 HydrophobicContact CD1-CB 4.37Å; I162-F196 HydrophobicContact CG2-CB 3.78Å; I162-A197 HydrophobicContact CG2-CB 4.47Å; I162-Q200 VanDerWaalsContact CA-NE2 3.29Å | ||
| 163 | Q | 94.4 | Very high | 93.3 | Very high | 103 Ų | 103 | 80 Ų | 80 | 48% | 0.481 | 43% | 0.434 | S | S | . | . | trans | -121.8 | 83.7 | 168.8 | -65.2 | -60.8 | -32.5 | 0 | 0 | 107.8 | R305 | Q163-R305 PolarHBondContact O-NE 3.32Š| ||
| 164 | P | 94.4 | Very high | 93.1 | Very high | 19 Ų | 19 | 82.4 Ų | 82.4 | 12% | 0.123 | 44% | 0.444 | C | S | . | . | trans | -83 | -15.8 | -168 | 31.9 | -33.9 | 0 | 0 | 0 | 113.3 | I162 F196 R305 | I162-P164 HydrophobicContact CD1-CB 4.37Å; I162-P164 HydrophobicContact CD1-CG 4.24Å; I162-P164 HydrophobicContact CG1-CG 4.39Å; P164-F196 VanDerWaalsContact CA-CE2 3.45Å; P164-F196 HydrophobicContact CB-CD2 3.55Å; P164-F196 HydrophobicContact CB-CE2 3.74Å; P164-F196 HydrophobicContact CB-CG 4.27Å; P164-F196 WeakPolarHBondContact O-CE2 3.26Å; P164-R305 WeakPolarHBondContact O-CA 3.44Å | ||
| 165 | T | 93.9 | Very high | 93 | Very high | 46 Ų | 46 | 77.8 Ų | 77.8 | 28% | 0.282 | 43% | 0.427 | S | S | . | . | S | Bend | trans | -137.2 | 160.1 | 175.7 | 59.1 | 0 | 0 | 0 | 0 | 111.1 | R305 E307 | T165-R305 WeakPolarHBondContact CA-O 3.43Å; T165-E307 HydrophobicContact CG2-CG 4.17Å |
| 166 | I | 92.4 | Very high | 92.8 | Very high | 67 Ų | 67 | 78.8 Ų | 78.8 | 34% | 0.344 | 43% | 0.431 | S | S | . | . | trans | -80.7 | 124.3 | 172.5 | -58.5 | -169.9 | 0 | 0 | 0 | 109.7 | R168 R305 E306 | I166-R168 HydrophobicContact CG2-CG 4.32Å; I166-R168 PolarHBondContact O-N 3.29Å; I166-R168 PolarHBondContact O-NH1 3.26Å; I166-R305 HydrophobicContact CG1-CG 3.85Å; I166-R305 PolarHBondContact N-O 3.06Å; I166-E306 HydrophobicContact CD1-CG 3.43Å; I166-E306 VanDerWaalsContact CD1-CG 3.43Å; I166-E306 HydrophobicContact CG1-CG 4.33Å | ||
| 167 | R | 88.4 | Confident | 92.6 | Very high | 215 Ų | 215 | 85.1 Ų | 85.1 | 81% | 0.811 | 45% | 0.452 | S | S | * | . | trans | -68.8 | 124.9 | 168.3 | -69 | -171.6 | 179.2 | -169 | -0.5 | 109.6 | ||||
| 168 | R | 89.4 | Confident | 92.5 | Very high | 68 Ų | 68 | 84.9 Ų | 84.9 | 26% | 0.257 | 45% | 0.45 | S | S | . | . | trans | -117 | 137.3 | 178.5 | -61.1 | 176.7 | -176 | 94.8 | -14.2 | 108.8 | I166 A173 H176 E306 E307 | I166-R168 HydrophobicContact CG2-CG 4.32Å; I166-R168 PolarHBondContact O-N 3.29Å; I166-R168 PolarHBondContact O-NH1 3.26Å; R168-A173 HydrophobicContact CB-CB 4.34Å; R168-H176 PolarHBondContact NE-CD2 3.49Å; R168-H176 VanDerWaalsContact NE-CD2 3.26Å; R168-H176 PolarHBondContact NH1-NE2 3.1Å; R168-H176 PolarHBondContact NH2-CD2 3.19Å; R168-H176 PolarHBondContact NH2-NE2 2.91Å; R168-H176 VanDerWaalsContact NH2-NE2 3.18Å; R168-E306 PolarHBondContact NH2-O 3.48Å; R168-E307 IonicContact CZ-OE2 3.15Å; R168-E307 IonicContact NH1-OE2 3.84Å; R168-E307 PolarHBondContact NH1-OE2 3.13Å; R168-E307 IonicContact NH2-OE2 2.69Å | ||
| 169 | T | 91.4 | Very high | 92.3 | Very high | 120 Ų | 120 | 91.7 Ų | 91.7 | 74% | 0.736 | 48% | 0.479 | S | S | * | . | trans | -128.1 | 159.9 | -179 | 56.5 | 0 | 0 | 0 | 0 | 111 | A172 A173 | T169-A172 PolarHBondContact O-N 2.99Å; T169-A173 PolarHBondContact O-N 3.48Å | ||
| 170 | G | 93.9 | Very high | 92 | Very high | 56 Ų | 56 | 89.4 Ų | 89.4 | 58% | 0.577 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | 57.3 | -137.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | A172 A173 I174 | G170-A172 PolarHBondContact O-N 3.34Å; G170-A173 WeakPolarHBondContact O-CB 3.49Å; G170-A173 PolarHBondContact O-N 2.87Å; G170-A173 VanDerWaalsContact O-N 3.09Å; G170-I174 PolarHBondContact O-N 2.9Å |
| 171 | L | 92.8 | Very high | 91.8 | Very high | 147 Ų | 147 | 84.3 Ų | 84.3 | 77% | 0.77 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -60.6 | -31.1 | -178.7 | -64.1 | 177.3 | 0 | 0 | 0 | 113.2 | A173 I174 A175 | L171-A173 VanDerWaalsContact C-N 3.3Å; L171-A173 PolarHBondContact O-N 3.1Å; L171-I174 HydrophobicContact CD2-CD1 4.46Å; L171-I174 PolarHBondContact O-N 3.49Å; L171-A175 WeakPolarHBondContact O-CB 3.49Å; L171-A175 PolarHBondContact O-N 3.13Å |
| 172 | A | 91 | Very high | 91.8 | Very high | 57 Ų | 57 | 82 Ų | 82 | 47% | 0.471 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -66.8 | -32.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | T169 G170 H176 | T169-A172 PolarHBondContact O-N 2.99Å; G170-A172 PolarHBondContact O-N 3.34Å; A172-H176 VanDerWaalsContact O-CB 3.26Å; A172-H176 WeakPolarHBondContact O-CB 3.39Å; A172-H176 PolarHBondContact O-N 2.85Å |
| 173 | A | 91.6 | Very high | 91.7 | Very high | 37 Ų | 37 | 90.1 Ų | 90.1 | 31% | 0.306 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -67.6 | -41.4 | 174 | 0 | 0 | 0 | 0 | 0 | 111.4 | R168 T169 G170 L171 H176 F177 | R168-A173 HydrophobicContact CB-CB 4.34Å; T169-A173 PolarHBondContact O-N 3.48Å; G170-A173 WeakPolarHBondContact O-CB 3.49Å; G170-A173 PolarHBondContact O-N 2.87Å; G170-A173 VanDerWaalsContact O-N 3.09Å; L171-A173 VanDerWaalsContact C-N 3.3Å; L171-A173 PolarHBondContact O-N 3.1Å; A173-H176 PolarHBondContact O-N 2.94Å; A173-F177 WeakPolarHBondContact O-CB 3.46Å; A173-F177 PolarHBondContact O-N 3.28Å |
| 174 | I | 91.7 | Very high | 91.8 | Very high | 98 Ų | 98 | 86.1 Ų | 86.1 | 50% | 0.503 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -66.3 | -47.6 | 177.3 | -59.9 | 173.5 | 0 | 0 | 0 | 110.5 | G170 L171 H176 F177 L178 | G170-I174 PolarHBondContact O-N 2.9Å; L171-I174 HydrophobicContact CD2-CD1 4.46Å; L171-I174 PolarHBondContact O-N 3.49Å; I174-H176 VanDerWaalsContact C-N 3.31Å; I174-H176 PolarHBondContact O-N 3.48Å; I174-F177 WeakPolarHBondContact O-CB 3.35Å; I174-F177 PolarHBondContact O-N 3.35Å; I174-F177 VanDerWaalsContact O-N 3.15Å; I174-L178 HydrophobicContact CG2-CD1 4.09Å; I174-L178 WeakPolarHBondContact O-CG 3.33Å; I174-L178 PolarHBondContact O-N 3.25Å |
| 175 | A | 91.8 | Very high | 92 | Very high | 51 Ų | 51 | 89 Ų | 89 | 42% | 0.421 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -59.6 | -42.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | L171 L178 F179 | L171-A175 WeakPolarHBondContact O-CB 3.49Å; L171-A175 PolarHBondContact O-N 3.13Å; A175-L178 PolarHBondContact O-N 3.18Å; A175-F179 WeakPolarHBondContact O-CB 3.47Å; A175-F179 PolarHBondContact O-N 3.12Å |
| 176 | H | 90.8 | Very high | 92.2 | Very high | 40 Ų | 40 | 97.1 Ų | 97.1 | 19% | 0.185 | 50% | 0.496 | C | S | . | . | H | α-helix | trans | -67.4 | -35.7 | 175.9 | -172 | -88.3 | 0 | 0 | 0 | 112.7 | R168 A172 A173 I174 L178 G180 E307 | R168-H176 PolarHBondContact NE-CD2 3.49Å; R168-H176 VanDerWaalsContact NE-CD2 3.26Å; R168-H176 PolarHBondContact NH1-NE2 3.1Å; R168-H176 PolarHBondContact NH2-CD2 3.19Å; R168-H176 PolarHBondContact NH2-NE2 2.91Å; R168-H176 VanDerWaalsContact NH2-NE2 3.18Å; A172-H176 VanDerWaalsContact O-CB 3.26Å; A172-H176 WeakPolarHBondContact O-CB 3.39Å; A172-H176 PolarHBondContact O-N 2.85Å; A173-H176 PolarHBondContact O-N 2.94Å; I174-H176 VanDerWaalsContact C-N 3.31Å; I174-H176 PolarHBondContact O-N 3.48Å; H176-L178 VanDerWaalsContact C-N 3.33Å; H176-G180 WeakPolarHBondContact O-CA 3.22Å; H176-G180 PolarHBondContact O-N 3.01Å; H176-E307 IonicContact CE1-OE2 2.67Å; H176-E307 PolarHBondContact CE1-OE2 3.33Å; H176-E307 VanDerWaalsContact CE1-OE2 3.3Å; H176-E307 IonicContact NE2-OE2 2.71Å |
| 177 | F | 89.4 | Confident | 92.4 | Very high | 156 Ų | 156 | 99.3 Ų | 99.3 | 68% | 0.684 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -64.4 | -39 | 176.1 | 177.8 | -102.3 | 0 | 0 | 0 | 112.2 | A173 I174 | A173-F177 WeakPolarHBondContact O-CB 3.46Å; A173-F177 PolarHBondContact O-N 3.28Å; I174-F177 WeakPolarHBondContact O-CB 3.35Å; I174-F177 PolarHBondContact O-N 3.35Å; I174-F177 VanDerWaalsContact O-N 3.15Å |
| 178 | L | 91.8 | Very high | 92.9 | Very high | 108 Ų | 108 | 89.4 Ų | 89.4 | 57% | 0.565 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -85.7 | -37.1 | -177.3 | -64.5 | 175.7 | 0 | 0 | 0 | 113.8 | I174 A175 H176 | I174-L178 HydrophobicContact CG2-CD1 4.09Å; I174-L178 WeakPolarHBondContact O-CG 3.33Å; I174-L178 PolarHBondContact O-N 3.25Å; A175-L178 PolarHBondContact O-N 3.18Å; H176-L178 VanDerWaalsContact C-N 3.33Å |
| 179 | F | 91.4 | Very high | 93.3 | Very high | 182 Ų | 182 | 88.7 Ų | 88.7 | 80% | 0.798 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -127.3 | 0.7 | -169.9 | -55.2 | -72.3 | 0 | 0 | 0 | 113.9 | A175 | A175-F179 WeakPolarHBondContact O-CB 3.47Å; A175-F179 PolarHBondContact O-N 3.12Å |
| 180 | G | 88.3 | Confident | 93.6 | Very high | 30 Ų | 30 | 90.9 Ų | 90.9 | 31% | 0.309 | 47% | 0.471 | S | S | . | . | S | Bend | trans | -76.5 | 168.4 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | H176 | H176-G180 WeakPolarHBondContact O-CA 3.22Å; H176-G180 PolarHBondContact O-N 3.01Å |
| 181 | P | 90.1 | Very high | 93.8 | Very high | 45 Ų | 45 | 90.6 Ų | 90.6 | 29% | 0.292 | 45% | 0.454 | S | S | . | . | P | Polyproline II helix | trans | -59 | 155.5 | 172.2 | 26.9 | -35.5 | 0 | 0 | 0 | 111.6 | E307 | P181-E307 VanDerWaalsContact CB-O 3.24Å; P181-E307 WeakPolarHBondContact CB-O 3.14Å; P181-E307 HydrophobicContact CG-CB 3.79Å; P181-E307 WeakPolarHBondContact CG-O 3.49Å |
| 182 | P | 93 | Very high | 94.1 | Very high | 61 Ų | 61 | 85.1 Ų | 85.1 | 40% | 0.396 | 42% | 0.423 | S | S | . | . | P | Polyproline II helix | trans | -61.6 | 149.6 | 174.5 | 28.8 | -35.5 | 0 | 0 | 0 | 110.3 | S310 K311 | P182-S310 WeakPolarHBondContact O-CB 3.36Å; P182-K311 HydrophobicContact CG-CB 3.66Å; P182-K311 HydrophobicContact CG-CG 4.24Å |
| 183 | R | 92.9 | Very high | 94.4 | Very high | 187 Ų | 187 | 84.2 Ų | 84.2 | 71% | 0.706 | 41% | 0.411 | S | S | * | . | P | Polyproline II helix | trans | -66.4 | 147.6 | 173.4 | -66.8 | -175.7 | -177.4 | 172.8 | 1.5 | 110.5 | N314 | R183-N314 PolarHBondContact O-ND2 3.23Š|
| 184 | L | 97.4 | Very high | 94.8 | Very high | 19 Ų | 19 | 83.6 Ų | 83.6 | 10% | 0.099 | 40% | 0.402 | C | S | . | . | P | Polyproline II helix | trans | -64.9 | 138.8 | 171.3 | -165 | 72.3 | 0 | 0 | 0 | 109.8 | L188 L189 R192 C313 N314 V319 | L184-L188 HydrophobicContact CD1-CB 4.13Å; L184-L188 HydrophobicContact CD1-CD1 3.89Å; L184-L188 HydrophobicContact CD2-CB 3.9Å; L184-L188 HydrophobicContact CG-CB 3.81Å; L184-L188 HydrophobicContact CG-CD1 4.37Å; L184-L189 HydrophobicContact CD2-CD2 4.34Å; L184-R192 HydrophobicContact CD2-CB 3.87Å; L184-R192 HydrophobicContact CD2-CG 4.3Å; L184-C313 HydrophobicContact CD1-CB 3.47Å; L184-C313 VanDerWaalsContact CD1-CB 3.47Å; L184-N314 WeakPolarHBondContact CA-OD1 3.36Å; L184-V319 HydrophobicContact CD1-CG2 4.31Å; L184-V319 HydrophobicContact CD2-CG2 4.04Å |
| 185 | H | 98.1 | Very high | 95.1 | Very high | 80 Ų | 80 | 79 Ų | 79 | 37% | 0.37 | 38% | 0.379 | S | S | . | . | P | Polyproline II helix | trans | -65.1 | 155.9 | 177.3 | -65.7 | -172.8 | 0 | 0 | 0 | 112.3 | E187 L188 N314 | H185-E187 VanDerWaalsContact C-N 3.33Å; H185-E187 HydrophobicContact CB-CG 4.32Å; H185-E187 WeakPolarHBondContact CB-OE1 3.49Å; H185-E187 WeakPolarHBondContact CB-OE2 3.44Å; H185-E187 IonicContact CG-OE1 2.61Å; H185-E187 IonicContact ND1-OE1 3.3Å; H185-E187 PolarHBondContact ND1-OE1 3.45Å; H185-E187 PolarHBondContact O-N 2.85Å; H185-L188 PolarHBondContact O-N 2.97Å; H185-L188 VanDerWaalsContact O-N 3.13Å; H185-N314 PolarHBondContact CD2-ND2 3.16Å; H185-N314 PolarHBondContact CD2-OD1 3.05Å; H185-N314 PolarHBondContact N-OD1 3.45Å |
| 186 | R | 97.8 | Very high | 95.4 | Very high | 216 Ų | 216 | 76.8 Ų | 76.8 | 82% | 0.815 | 36% | 0.36 | S | S | * | . | G | 310 helix | trans | -64.9 | -38.2 | -171.8 | -67.3 | -177.7 | 77.2 | 165.4 | 2.8 | 112.1 | L188 L189 | R186-L188 PolarHBondContact O-N 3.36Å; R186-L189 HydrophobicContact CB-CD1 4.45Å; R186-L189 WeakPolarHBondContact O-CB 3.44Å; R186-L189 WeakPolarHBondContact O-CG 3.15Å; R186-L189 PolarHBondContact O-N 2.9Å |
| 187 | E | 97.6 | Very high | 95.8 | Very high | 113 Ų | 113 | 74.9 Ų | 74.9 | 53% | 0.528 | 35% | 0.351 | S | S | . | . | G | 310 helix | trans | -63.7 | -17.2 | 177.7 | 62.7 | -83.9 | -167.8 | 0 | 0 | 113.8 | H185 Q317 | H185-E187 VanDerWaalsContact C-N 3.33Å; H185-E187 HydrophobicContact CB-CG 4.32Å; H185-E187 WeakPolarHBondContact CB-OE1 3.49Å; H185-E187 WeakPolarHBondContact CB-OE2 3.44Å; H185-E187 IonicContact CG-OE1 2.61Å; H185-E187 IonicContact ND1-OE1 3.3Å; H185-E187 PolarHBondContact ND1-OE1 3.45Å; H185-E187 PolarHBondContact O-N 2.85Å; E187-Q317 PolarHBondContact OE1-OE1 3.5Å |
| 188 | L | 98.4 | Very high | 96.2 | Very high | 6 Ų | 6 | 67.6 Ų | 67.6 | 3% | 0.031 | 32% | 0.319 | C | S | . | . | G | 310 helix | trans | -100.3 | -3.2 | -179.7 | -61.4 | -177.7 | 0 | 0 | 0 | 113.3 | L184 H185 R186 R192 C313 V319 | L184-L188 HydrophobicContact CD1-CB 4.13Å; L184-L188 HydrophobicContact CD1-CD1 3.89Å; L184-L188 HydrophobicContact CD2-CB 3.9Å; L184-L188 HydrophobicContact CG-CB 3.81Å; L184-L188 HydrophobicContact CG-CD1 4.37Å; H185-L188 PolarHBondContact O-N 2.97Å; H185-L188 VanDerWaalsContact O-N 3.13Å; R186-L188 PolarHBondContact O-N 3.36Å; L188-R192 PolarHBondContact O-N 2.85Å; L188-R192 VanDerWaalsContact O-N 3.09Å; L188-C313 HydrophobicContact CD1-CB 4.19Å; L188-V319 HydrophobicContact CB-CG2 3.84Å; L188-V319 HydrophobicContact CD1-CG2 4.5Å |
| 189 | L | 98.1 | Very high | 96.5 | Very high | 53 Ų | 53 | 63.1 Ų | 63.1 | 28% | 0.277 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -68.1 | -40.6 | -176.1 | -64.9 | 175 | 0 | 0 | 0 | 112.1 | L184 R186 E191 R192 D193 | L184-L189 HydrophobicContact CD2-CD2 4.34Å; R186-L189 HydrophobicContact CB-CD1 4.45Å; R186-L189 WeakPolarHBondContact O-CB 3.44Å; R186-L189 WeakPolarHBondContact O-CG 3.15Å; R186-L189 PolarHBondContact O-N 2.9Å; L189-E191 VanDerWaalsContact C-N 3.33Å; L189-E191 PolarHBondContact O-N 3.36Å; L189-R192 WeakPolarHBondContact O-CB 3.39Å; L189-R192 PolarHBondContact O-N 3.31Å; L189-D193 WeakPolarHBondContact O-CB 3.26Å; L189-D193 PolarHBondContact O-N 3.25Å |
| 190 | E | 97.5 | Very high | 96.8 | Very high | 167 Ų | 167 | 58 Ų | 58 | 78% | 0.78 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -62.3 | -42.9 | 178.5 | -66.3 | 180 | -177 | 0 | 0 | 111.3 | D193 L194 | E190-D193 PolarHBondContact O-N 3.32Å; E190-L194 WeakPolarHBondContact O-CB 3.31Å; E190-L194 PolarHBondContact O-N 3.26Å |
| 191 | E | 98.3 | Very high | 97.3 | Very high | 49 Ų | 49 | 57.2 Ų | 57.2 | 23% | 0.229 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -66.1 | -39.6 | 177.9 | -166.5 | -173.5 | 178.6 | 0 | 0 | 111.9 | L189 V195 Q318 V319 V320 | L189-E191 VanDerWaalsContact C-N 3.33Å; L189-E191 PolarHBondContact O-N 3.36Å; E191-V195 WeakPolarHBondContact O-CG2 3.46Å; E191-V195 PolarHBondContact O-N 3.22Å; E191-V195 VanDerWaalsContact O-N 3.16Å; E191-Q318 WeakPolarHBondContact OE2-CA 3.28Å; E191-V319 HydrophobicContact CB-CB 4.25Å; E191-V319 HydrophobicContact CB-CG2 4.33Å; E191-V319 HydrophobicContact CG-CB 3.96Å; E191-V319 PolarHBondContact OE1-N 3.22Å; E191-V319 PolarHBondContact OE2-N 3.45Å; E191-V320 HydrophobicContact CG-CB 4.44Å; E191-V320 HydrophobicContact CG-CG2 3.69Å; E191-V320 VanDerWaalsContact OE1-CB 3.23Å; E191-V320 WeakPolarHBondContact OE1-CB 3.48Å; E191-V320 WeakPolarHBondContact OE1-CG2 3.37Å; E191-V320 PolarHBondContact OE1-N 2.87Å |
| 192 | R | 98.6 | Very high | 97.6 | Very high | 32 Ų | 32 | 59.2 Ų | 59.2 | 12% | 0.121 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -61.5 | -46.5 | 171.8 | 179.1 | -157 | 66.8 | -172.2 | -1.1 | 111.3 | L184 L188 L189 L194 V195 F196 L304 V319 | L184-R192 HydrophobicContact CD2-CB 3.87Å; L184-R192 HydrophobicContact CD2-CG 4.3Å; L188-R192 PolarHBondContact O-N 2.85Å; L188-R192 VanDerWaalsContact O-N 3.09Å; L189-R192 WeakPolarHBondContact O-CB 3.39Å; L189-R192 PolarHBondContact O-N 3.31Å; R192-L194 VanDerWaalsContact C-N 3.32Å; R192-V195 WeakPolarHBondContact O-CB 3.46Å; R192-V195 PolarHBondContact O-N 2.97Å; R192-F196 HydrophobicContact CG-CD2 4.01Å; R192-F196 HydrophobicContact CG-CE2 3.82Å; R192-F196 VanDerWaalsContact O-CD2 3.26Å; R192-F196 WeakPolarHBondContact O-CD2 3.4Å; R192-F196 PolarHBondContact O-N 3.41Å; R192-L304 HydrophobicContact CG-CD2 4.28Å; R192-V319 HydrophobicContact CB-CG1 4.28Å; R192-V319 HydrophobicContact CB-CG2 4.43Å |
| 193 | D | 98.5 | Very high | 97.8 | Very high | 39 Ų | 39 | 57.3 Ų | 57.3 | 21% | 0.209 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -69.1 | -35.4 | -175.6 | -69.7 | -8 | 0 | 0 | 0 | 111 | L159 I162 L189 E190 F196 A197 | L159-D193 HydrophobicContact CD2-CB 4.05Å; I162-D193 HydrophobicContact CD1-CB 3.51Å; L189-D193 WeakPolarHBondContact O-CB 3.26Å; L189-D193 PolarHBondContact O-N 3.25Å; E190-D193 PolarHBondContact O-N 3.32Å; D193-F196 PolarHBondContact O-N 3.04Å; D193-A197 WeakPolarHBondContact O-CB 3.45Å; D193-A197 PolarHBondContact O-N 3.45Å |
| 194 | L | 98.6 | Very high | 98 | Very high | 23 Ų | 23 | 51.5 Ų | 51.5 | 12% | 0.12 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -57.1 | -47.9 | 169.1 | 178 | 63 | 0 | 0 | 0 | 111.8 | L147 F150 Q151 L155 E190 R192 F196 A197 I198 | L147-L194 HydrophobicContact CD1-CD2 4.29Å; F150-L194 HydrophobicContact CB-CD1 4.22Å; Q151-L194 HydrophobicContact CG-CD2 3.64Å; L155-L194 HydrophobicContact CD1-CD1 3.63Å; E190-L194 WeakPolarHBondContact O-CB 3.31Å; E190-L194 PolarHBondContact O-N 3.26Å; R192-L194 VanDerWaalsContact C-N 3.32Å; L194-F196 VanDerWaalsContact C-N 3.3Å; L194-F196 PolarHBondContact O-N 3.3Å; L194-A197 PolarHBondContact O-N 2.82Å; L194-A197 VanDerWaalsContact O-N 3.12Å; L194-I198 HydrophobicContact CD1-CD1 4.07Å; L194-I198 HydrophobicContact CD1-CG1 4.14Å; L194-I198 HydrophobicContact CG-CD1 3.92Å; L194-I198 HydrophobicContact CG-CG1 4.4Å; L194-I198 VanDerWaalsContact O-CG1 3.28Å; L194-I198 WeakPolarHBondContact O-CG1 3.38Å; L194-I198 PolarHBondContact O-N 2.83Å |
| 195 | V | 98.6 | Very high | 97.8 | Very high | 3 Ų | 3 | 54.2 Ų | 54.2 | 2% | 0.018 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -55.1 | -47 | 176.1 | 164 | 0 | 0 | 0 | 0 | 111.2 | E191 R192 A197 I198 A199 L255 L301 L304 V320 L323 | E191-V195 WeakPolarHBondContact O-CG2 3.46Å; E191-V195 PolarHBondContact O-N 3.22Å; E191-V195 VanDerWaalsContact O-N 3.16Å; R192-V195 WeakPolarHBondContact O-CB 3.46Å; R192-V195 PolarHBondContact O-N 2.97Å; V195-A197 VanDerWaalsContact C-N 3.35Å; V195-I198 PolarHBondContact O-N 3.3Å; V195-A199 WeakPolarHBondContact O-CB 3.24Å; V195-A199 PolarHBondContact O-N 3.13Å; V195-L255 HydrophobicContact CG1-CD1 4.43Å; V195-L255 HydrophobicContact CG1-CD2 3.75Å; V195-L301 HydrophobicContact CG1-CD2 4Å; V195-L304 HydrophobicContact CG1-CD2 4.13Å; V195-V320 HydrophobicContact CG2-CG2 3.75Å; V195-L323 HydrophobicContact CB-CD2 4.37Å; V195-L323 HydrophobicContact CG1-CD2 3.33Å; V195-L323 HydrophobicContact CG2-CD2 4.11Å |
| 196 | F | 98.6 | Very high | 97.7 | Very high | 4 Ų | 4 | 54.4 Ų | 54.4 | 2% | 0.018 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -69.8 | -31.1 | 179 | -75.7 | -73.4 | 0 | 0 | 0 | 112.7 | I162 P164 R192 D193 L194 A199 Q200 L301 L304 R305 | I162-F196 HydrophobicContact CB-CB 3.91Å; I162-F196 HydrophobicContact CD1-CB 4.37Å; I162-F196 HydrophobicContact CG2-CB 3.78Å; P164-F196 VanDerWaalsContact CA-CE2 3.45Å; P164-F196 HydrophobicContact CB-CD2 3.55Å; P164-F196 HydrophobicContact CB-CE2 3.74Å; P164-F196 HydrophobicContact CB-CG 4.27Å; P164-F196 WeakPolarHBondContact O-CE2 3.26Å; R192-F196 HydrophobicContact CG-CD2 4.01Å; R192-F196 HydrophobicContact CG-CE2 3.82Å; R192-F196 VanDerWaalsContact O-CD2 3.26Å; R192-F196 WeakPolarHBondContact O-CD2 3.4Å; R192-F196 PolarHBondContact O-N 3.41Å; D193-F196 PolarHBondContact O-N 3.04Å; L194-F196 VanDerWaalsContact C-N 3.3Å; L194-F196 PolarHBondContact O-N 3.3Å; F196-A199 WeakPolarHBondContact O-CB 3.38Å; F196-A199 PolarHBondContact O-N 2.92Å; F196-Q200 WeakPolarHBondContact O-CG 3.21Å; F196-Q200 PolarHBondContact O-N 2.83Å; F196-L301 HydrophobicContact CD1-CD2 3.86Å; F196-L301 HydrophobicContact CE1-CD2 3.72Å; F196-L301 HydrophobicContact CZ-CD2 4.41Å; F196-L304 HydrophobicContact CE2-CD2 3.87Å; F196-L304 HydrophobicContact CE2-CG 4.13Å; F196-L304 HydrophobicContact CZ-CB 4.46Å; F196-L304 HydrophobicContact CZ-CD2 4.18Å; F196-L304 HydrophobicContact CZ-CG 4.24Å; F196-R305 HydrophobicContact CE1-CB 4.39Å; F196-R305 HydrophobicContact CZ-CB 4Å |
| 197 | A | 98.4 | Very high | 97.7 | Very high | 0 Ų | 0 | 47.2 Ų | 47.2 | 0% | 0 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -67.7 | -45.5 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | L155 L158 L159 I162 D193 L194 V195 A199 Q200 C201 | L155-A197 HydrophobicContact CB-CB 4.38Å; L155-A197 HydrophobicContact CD1-CB 4.13Å; L158-A197 HydrophobicContact CB-CB 4.19Å; L159-A197 HydrophobicContact CD2-CB 3.89Å; L159-A197 HydrophobicContact CG-CB 4.16Å; I162-A197 HydrophobicContact CG2-CB 4.47Å; D193-A197 WeakPolarHBondContact O-CB 3.45Å; D193-A197 PolarHBondContact O-N 3.45Å; L194-A197 PolarHBondContact O-N 2.82Å; L194-A197 VanDerWaalsContact O-N 3.12Å; V195-A197 VanDerWaalsContact C-N 3.35Å; A197-A199 PolarHBondContact O-N 3.24Å; A197-Q200 WeakPolarHBondContact O-CA 3.49Å; A197-Q200 PolarHBondContact O-N 3.38Å; A197-C201 PolarHBondContact O-N 2.95Å; A197-C201 VanDerWaalsContact O-N 3.1Å |
| 198 | I | 98.6 | Very high | 97.6 | Very high | 3 Ų | 3 | 46.8 Ų | 46.8 | 2% | 0.015 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -59.1 | -36.1 | 173.1 | -61.9 | 169.2 | 0 | 0 | 0 | 110.1 | L147 F150 L194 V195 Q200 C201 F254 L255 M258 | L147-I198 HydrophobicContact CD1-CD1 4.21Å; F150-I198 HydrophobicContact CB-CD1 3.74Å; F150-I198 HydrophobicContact CB-CG1 3.83Å; F150-I198 HydrophobicContact CD1-CG1 3.86Å; F150-I198 HydrophobicContact CD2-CD1 4.08Å; F150-I198 HydrophobicContact CD2-CG1 4.16Å; F150-I198 HydrophobicContact CD2-CG2 4.39Å; F150-I198 HydrophobicContact CE1-CG1 4.5Å; F150-I198 HydrophobicContact CE2-CG2 4.3Å; F150-I198 HydrophobicContact CG-CD1 3.89Å; F150-I198 HydrophobicContact CG-CG1 3.68Å; F150-I198 HydrophobicContact CZ-CG2 4.37Å; L194-I198 HydrophobicContact CD1-CD1 4.07Å; L194-I198 HydrophobicContact CD1-CG1 4.14Å; L194-I198 HydrophobicContact CG-CD1 3.92Å; L194-I198 HydrophobicContact CG-CG1 4.4Å; L194-I198 VanDerWaalsContact O-CG1 3.28Å; L194-I198 WeakPolarHBondContact O-CG1 3.38Å; L194-I198 PolarHBondContact O-N 2.83Å; V195-I198 PolarHBondContact O-N 3.3Å; I198-Q200 PolarHBondContact O-N 3.39Å; I198-C201 WeakPolarHBondContact O-CB 3.4Å; I198-C201 PolarHBondContact O-N 3.37Å; I198-C201 VanDerWaalsContact O-N 3.16Å; I198-F254 HydrophobicContact CG2-CB 4.18Å; I198-F254 PolarHBondContact O-N 2.87Å; I198-L255 HydrophobicContact CG2-CB 4.02Å; I198-L255 HydrophobicContact CG2-CD1 4.36Å; I198-L255 PolarHBondContact O-N 3.49Å; I198-M258 HydrophobicContact CG2-CG 4.04Å |
| 199 | A | 98.4 | Very high | 97.6 | Very high | 14 Ų | 14 | 47.5 Ų | 47.5 | 12% | 0.116 | 26% | 0.259 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -69.1 | -14.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | V195 F196 A197 T252 G253 L255 L301 | V195-A199 WeakPolarHBondContact O-CB 3.24Å; V195-A199 PolarHBondContact O-N 3.13Å; F196-A199 WeakPolarHBondContact O-CB 3.38Å; F196-A199 PolarHBondContact O-N 2.92Å; A197-A199 PolarHBondContact O-N 3.24Å; A199-T252 WeakPolarHBondContact CA-O 3.31Å; A199-T252 CarbonylContact O-C 3.59Å; A199-G253 VanDerWaalsContact O-CA 3.27Å; A199-G253 WeakPolarHBondContact O-CA 3.43Å; A199-G253 PolarHBondContact O-N 2.92Å; A199-G253 VanDerWaalsContact O-N 3.07Å; A199-L255 HydrophobicContact CB-CB 3.99Å; A199-L255 HydrophobicContact CB-CD2 4.03Å; A199-L301 HydrophobicContact CB-CD1 3.78Å; A199-L301 HydrophobicContact CB-CD2 4.05Å |
| 200 | Q | 97.5 | Very high | 97.6 | Very high | 74 Ų | 74 | 45 Ų | 45 | 35% | 0.346 | 25% | 0.246 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -99.7 | -11.7 | 171.6 | -66 | -166.1 | 18.9 | 0 | 0 | 113.2 | L158 N161 I162 F196 A197 I198 P202 | L158-Q200 HydrophobicContact CB-CB 4.5Å; L158-Q200 HydrophobicContact CD2-CB 4.17Å; L158-Q200 PolarHBondContact O-OE1 3.08Å; N161-Q200 VanDerWaalsContact C-NE2 3.25Å; N161-Q200 PolarHBondContact O-NE2 3.26Å; I162-Q200 VanDerWaalsContact CA-NE2 3.29Å; F196-Q200 WeakPolarHBondContact O-CG 3.21Å; F196-Q200 PolarHBondContact O-N 2.83Å; A197-Q200 WeakPolarHBondContact O-CA 3.49Å; A197-Q200 PolarHBondContact O-N 3.38Å; I198-Q200 PolarHBondContact O-N 3.39Å; Q200-P202 WeakPolarHBondContact O-CD 3.5Å |
| 201 | C | 97.7 | Very high | 97.5 | Very high | 13 Ų | 13 | 38.7 Ų | 38.7 | 9% | 0.088 | 22% | 0.217 | C | C | . | . | P | Polyproline II helix | trans | -72.4 | 120.6 | 179.8 | -176.4 | 0 | 0 | 0 | 0 | 110 | F150 L158 A197 I198 G253 F254 | F150-C201 HydrophobicContact CE1-CB 4.29Å; L158-C201 HydrophobicContact CD1-CB 3.76Å; A197-C201 PolarHBondContact O-N 2.95Å; A197-C201 VanDerWaalsContact O-N 3.1Å; I198-C201 WeakPolarHBondContact O-CB 3.4Å; I198-C201 PolarHBondContact O-N 3.37Å; I198-C201 VanDerWaalsContact O-N 3.16Å; C201-G253 CarbonylContact O-C 3.56Å; C201-G253 WeakPolarHBondContact O-CA 3.42Å; C201-F254 HydrophobicContact CB-CB 4.08Å; C201-F254 WeakPolarHBondContact O-CB 3.22Å; C201-F254 PolarHBondContact O-N 3.22Å |
| 202 | P | 97.1 | Very high | 97.5 | Very high | 88 Ų | 88 | 38.3 Ų | 38.3 | 57% | 0.571 | 21% | 0.213 | S | C | * | . | P | Polyproline II helix | trans | -75.1 | 164.3 | 170.7 | 32.5 | -34.5 | 0 | 0 | 0 | 111 | Q200 D204 | Q200-P202 WeakPolarHBondContact O-CD 3.5Å; P202-D204 PolarHBondContact O-N 3.09Å |
| 203 | V | 97.3 | Very high | 97.5 | Very high | 21 Ų | 21 | 36.8 Ų | 36.8 | 13% | 0.127 | 21% | 0.208 | C | C | . | . | P | Polyproline II helix | trans | -68.3 | 116.3 | 169.5 | 179.1 | 0 | 0 | 0 | 0 | 108.9 | M211 L214 A246 L249 F254 L257 | V203-M211 HydrophobicContact CG1-CE 3.72Å; V203-L214 HydrophobicContact CG1-CD1 4.25Å; V203-A246 HydrophobicContact CB-CB 3.97Å; V203-A246 HydrophobicContact CG2-CB 4.16Å; V203-L249 HydrophobicContact CG2-CD1 3.61Å; V203-F254 HydrophobicContact CG2-CD2 4.08Å; V203-F254 HydrophobicContact CG2-CE2 4.22Å; V203-L257 HydrophobicContact CG2-CD1 3.91Å |
| 204 | D | 96.3 | Very high | 97.5 | Very high | 65 Ų | 65 | 35 Ų | 35 | 35% | 0.348 | 20% | 0.198 | S | C | . | . | P | Polyproline II helix | trans | -101.9 | 119.7 | 173.2 | -177.7 | -5.3 | 0 | 0 | 0 | 110.6 | P202 S206 Q207 H210 | P202-D204 PolarHBondContact O-N 3.09Å; D204-S206 VanDerWaalsContact C-N 3.28Å; D204-S206 PolarHBondContact O-N 2.86Å; D204-S206 WeakPolarHBondContact OD1-CB 3.43Å; D204-S206 PolarHBondContact OD1-N 3.39Å; D204-S206 PolarHBondContact OD1-OG 3.05Å; D204-S206 PolarHBondContact OD2-OG 3.15Å; D204-Q207 HydrophobicContact CB-CB 4.48Å; D204-Q207 HydrophobicContact CB-CG 3.9Å; D204-Q207 PolarHBondContact O-N 2.84Å; D204-Q207 WeakPolarHBondContact OD2-CG 3.48Å; D204-H210 PolarHBondContact N-ND1 3.45Å; D204-H210 VanDerWaalsContact N-ND1 3.11Å; D204-H210 PolarHBondContact O-ND1 3.32Å |
| 205 | N | 94.7 | Very high | 97.4 | Very high | 75 Ų | 75 | 35.6 Ų | 35.6 | 40% | 0.401 | 20% | 0.2 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -71.6 | -19.4 | -179.9 | -68.9 | -16.8 | 0 | 0 | 0 | 113.4 | Q207 R230 Y231 | N205-Q207 PolarHBondContact O-N 3.39Å; N205-R230 PolarHBondContact OD1-NE 3.29Å; N205-Y231 PolarHBondContact ND2-OH 3.25Å |
| 206 | S | 95.9 | Very high | 97.4 | Very high | 85 Ų | 85 | 35.6 Ų | 35.6 | 59% | 0.594 | 20% | 0.2 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -73.7 | -17.3 | 175.5 | 73.3 | 0 | 0 | 0 | 0 | 112.4 | D204 | D204-S206 VanDerWaalsContact C-N 3.28Å; D204-S206 PolarHBondContact O-N 2.86Å; D204-S206 WeakPolarHBondContact OD1-CB 3.43Å; D204-S206 PolarHBondContact OD1-N 3.39Å; D204-S206 PolarHBondContact OD1-OG 3.05Å; D204-S206 PolarHBondContact OD2-OG 3.15Å |
| 207 | Q | 96.3 | Very high | 97.4 | Very high | 65 Ų | 65 | 35.4 Ų | 35.4 | 30% | 0.304 | 20% | 0.2 | S | C | . | . | trans | -94.1 | 113.6 | -177.5 | -57.8 | -60.5 | -19.9 | 0 | 0 | 111.2 | Y149 D204 N205 V209 H210 M211 | Y149-Q207 VanDerWaalsContact OH-CD 3.3Å; Y149-Q207 WeakPolarHBondContact OH-CG 3.41Å; Y149-Q207 PolarHBondContact OH-OE1 2.92Å; D204-Q207 HydrophobicContact CB-CB 4.48Å; D204-Q207 HydrophobicContact CB-CG 3.9Å; D204-Q207 PolarHBondContact O-N 2.84Å; D204-Q207 WeakPolarHBondContact OD2-CG 3.48Å; N205-Q207 PolarHBondContact O-N 3.39Å; Q207-V209 VanDerWaalsContact C-N 3.27Å; Q207-V209 PolarHBondContact O-N 3.17Å; Q207-H210 HydrophobicContact CB-CB 4.18Å; Q207-H210 WeakPolarHBondContact O-CB 3.45Å; Q207-H210 PolarHBondContact O-N 3.42Å; Q207-H210 VanDerWaalsContact O-N 3.08Å; Q207-M211 PolarHBondContact O-N 3.41Å | ||
| 208 | T | 95.9 | Very high | 97.3 | Very high | 104 Ų | 104 | 36 Ų | 36 | 64% | 0.638 | 20% | 0.202 | S | C | * | . | H | α-helix | trans | -62.3 | -34.8 | -179.2 | 60 | 0 | 0 | 0 | 0 | 112.4 | H210 M211 R212 | T208-H210 VanDerWaalsContact C-N 3.29Å; T208-H210 PolarHBondContact O-N 3.06Å; T208-M211 PolarHBondContact O-N 3.32Å; T208-R212 WeakPolarHBondContact O-CB 3.48Å; T208-R212 WeakPolarHBondContact O-CG 3.39Å; T208-R212 PolarHBondContact O-N 2.98Å |
| 209 | V | 98.1 | Very high | 97.2 | Very high | 20 Ų | 20 | 36.6 Ų | 36.6 | 12% | 0.121 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -58.2 | -42.3 | 174.9 | 170.8 | 0 | 0 | 0 | 0 | 110.8 | I141 Y149 Q207 M211 R212 V213 | I141-V209 HydrophobicContact CD1-CB 4.49Å; I141-V209 HydrophobicContact CD1-CG1 3.8Å; Y149-V209 HydrophobicContact CD1-CB 4.35Å; Y149-V209 HydrophobicContact CD1-CG1 3.87Å; Y149-V209 HydrophobicContact CD2-CB 4.18Å; Y149-V209 HydrophobicContact CD2-CG1 4.41Å; Y149-V209 HydrophobicContact CD2-CG2 3.85Å; Y149-V209 HydrophobicContact CE1-CG1 4.49Å; Y149-V209 HydrophobicContact CE2-CB 4.49Å; Y149-V209 HydrophobicContact CE2-CG2 4.43Å; Y149-V209 HydrophobicContact CG-CB 4.1Å; Y149-V209 HydrophobicContact CG-CG1 3.83Å; Y149-V209 HydrophobicContact CG-CG2 4.02Å; Q207-V209 VanDerWaalsContact C-N 3.27Å; Q207-V209 PolarHBondContact O-N 3.17Å; V209-M211 PolarHBondContact O-N 3.18Å; V209-R212 PolarHBondContact O-N 3.36Å; V209-V213 HydrophobicContact CG1-CG2 4.42Å; V209-V213 WeakPolarHBondContact O-CG2 3.23Å; V209-V213 PolarHBondContact O-N 3.39Å |
| 210 | H | 97.9 | Very high | 97.1 | Very high | 2 Ų | 2 | 38.6 Ų | 38.6 | 1% | 0.009 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -64.3 | -43.2 | -179.8 | -67.1 | 176.3 | 0 | 0 | 0 | 112.2 | Y149 F150 D204 Q207 T208 V213 L214 F254 | Y149-H210 AromaticContact CE1-NE2 3.49Å; Y149-H210 WeakPolarHBondContact CE1-NE2 3.48Å; F150-H210 AromaticContact CE1-NE2 3.94Å; F150-H210 AromaticContact CZ-NE2 3.58Å; D204-H210 PolarHBondContact N-ND1 3.45Å; D204-H210 VanDerWaalsContact N-ND1 3.11Å; D204-H210 PolarHBondContact O-ND1 3.32Å; Q207-H210 HydrophobicContact CB-CB 4.18Å; Q207-H210 WeakPolarHBondContact O-CB 3.45Å; Q207-H210 PolarHBondContact O-N 3.42Å; Q207-H210 VanDerWaalsContact O-N 3.08Å; T208-H210 VanDerWaalsContact C-N 3.29Å; T208-H210 PolarHBondContact O-N 3.06Å; H210-V213 PolarHBondContact O-N 3.38Å; H210-L214 PolarHBondContact O-N 3.33Å; H210-F254 HydrophobicContact CB-CE2 3.62Å; H210-F254 HydrophobicContact CB-CZ 3.95Å; H210-F254 AromaticContact CD2-CD2 3.96Å; H210-F254 AromaticContact CD2-CE2 3.46Å; H210-F254 VanDerWaalsContact CD2-CE2 3.46Å; H210-F254 WeakPolarHBondContact CD2-CE2 3.2Å; H210-F254 AromaticContact CD2-CZ 3.54Å; H210-F254 AromaticContact CG-CE2 3.43Å; H210-F254 VanDerWaalsContact CG-CE2 3.43Å; H210-F254 AromaticContact CG-CZ 3.86Å |
| 211 | M | 97.1 | Very high | 97 | Very high | 33 Ų | 33 | 35.5 Ų | 35.5 | 16% | 0.163 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -66.1 | -41.7 | 177.9 | -56.7 | -58.5 | 93.6 | 0 | 0 | 111.2 | V203 Q207 T208 V209 V213 L214 Q215 R230 | V203-M211 HydrophobicContact CG1-CE 3.72Å; Q207-M211 PolarHBondContact O-N 3.41Å; T208-M211 PolarHBondContact O-N 3.32Å; V209-M211 PolarHBondContact O-N 3.18Å; M211-V213 VanDerWaalsContact C-N 3.33Å; M211-V213 PolarHBondContact O-N 3.28Å; M211-L214 HydrophobicContact CE-CD1 4.24Å; M211-L214 PolarHBondContact O-N 3.27Å; M211-Q215 WeakPolarHBondContact O-CG 3.33Å; M211-Q215 PolarHBondContact O-N 3.02Å; M211-R230 VanDerWaalsContact SD-CD 3.55Å; M211-R230 HydrophobicContact SD-CG 4.19Å |
| 212 | R | 97.8 | Very high | 96.8 | Very high | 41 Ų | 41 | 38.4 Ų | 38.4 | 16% | 0.155 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -62.6 | -37.5 | 177.1 | -79.1 | -178.2 | 64.1 | -143.9 | -4.9 | 113 | T138 P139 L140 I141 E145 T208 V209 T216 | T138-R212 HydrophobicContact CG2-CG 3.55Å; P139-R212 PolarHBondContact O-NE 3.45Å; P139-R212 PolarHBondContact O-NH2 3.39Å; L140-R212 PolarHBondContact O-NH2 3Å; I141-R212 HydrophobicContact CB-CB 4.27Å; I141-R212 HydrophobicContact CG2-CB 4.16Å; E145-R212 IonicContact OE1-CZ 2.88Å; E145-R212 VanDerWaalsContact OE1-CZ 3.26Å; E145-R212 IonicContact OE1-NH1 2.98Å; E145-R212 PolarHBondContact OE1-NH1 3.47Å; E145-R212 IonicContact OE1-NH2 3.4Å; E145-R212 PolarHBondContact OE1-NH2 3.27Å; E145-R212 IonicContact OE2-NH2 3.26Å; E145-R212 PolarHBondContact OE2-NH2 3.01Å; T208-R212 WeakPolarHBondContact O-CB 3.48Å; T208-R212 WeakPolarHBondContact O-CG 3.39Å; T208-R212 PolarHBondContact O-N 2.98Å; V209-R212 PolarHBondContact O-N 3.36Å; R212-T216 WeakPolarHBondContact O-CB 3.3Å; R212-T216 PolarHBondContact O-N 3.4Å; R212-T216 PolarHBondContact O-OG1 3.24Å |
| 213 | V | 98.6 | Very high | 96.5 | Very high | 0 Ų | 0 | 36.9 Ų | 36.9 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -61 | -50.9 | 175.3 | 170.6 | 0 | 0 | 0 | 0 | 110.2 | I141 A146 V209 H210 M211 T216 I217 F254 L257 L261 | I141-V213 HydrophobicContact CD1-CG2 4.43Å; I141-V213 HydrophobicContact CG2-CB 4.45Å; I141-V213 HydrophobicContact CG2-CG2 3.98Å; A146-V213 HydrophobicContact CB-CG2 4.02Å; V209-V213 HydrophobicContact CG1-CG2 4.42Å; V209-V213 WeakPolarHBondContact O-CG2 3.23Å; V209-V213 PolarHBondContact O-N 3.39Å; H210-V213 PolarHBondContact O-N 3.38Å; M211-V213 VanDerWaalsContact C-N 3.33Å; M211-V213 PolarHBondContact O-N 3.28Å; V213-T216 PolarHBondContact O-N 3.08Å; V213-I217 HydrophobicContact CG1-CD1 3.88Å; V213-I217 WeakPolarHBondContact O-CG1 3.26Å; V213-I217 PolarHBondContact O-N 3.45Å; V213-F254 HydrophobicContact CB-CE1 4.25Å; V213-F254 HydrophobicContact CB-CZ 3.86Å; V213-F254 HydrophobicContact CG1-CE1 4.07Å; V213-F254 HydrophobicContact CG1-CZ 3.95Å; V213-F254 HydrophobicContact CG2-CE1 3.95Å; V213-F254 HydrophobicContact CG2-CZ 3.92Å; V213-L257 HydrophobicContact CG1-CB 3.83Å; V213-L261 HydrophobicContact CG1-CB 4.34Å; V213-L261 HydrophobicContact CG1-CD2 4.25Å; V213-L261 HydrophobicContact CG2-CD2 4.11Å |
| 214 | L | 97.9 | Very high | 96.1 | Very high | 3 Ų | 3 | 37.5 Ų | 37.5 | 2% | 0.016 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -57.6 | -52.2 | 178 | -80.2 | 171.2 | 0 | 0 | 0 | 111.8 | V203 H210 M211 T216 I217 H218 W235 P245 L257 | V203-L214 HydrophobicContact CG1-CD1 4.25Å; H210-L214 PolarHBondContact O-N 3.33Å; M211-L214 HydrophobicContact CE-CD1 4.24Å; M211-L214 PolarHBondContact O-N 3.27Å; L214-T216 VanDerWaalsContact C-N 3.29Å; L214-T216 PolarHBondContact O-N 3Å; L214-I217 PolarHBondContact O-N 2.87Å; L214-H218 PolarHBondContact O-N 3.12Å; L214-W235 HydrophobicContact CB-CH2 3.69Å; L214-W235 HydrophobicContact CB-CZ2 4.16Å; L214-W235 HydrophobicContact CB-CZ3 4.47Å; L214-W235 HydrophobicContact CD2-CH2 4.14Å; L214-W235 HydrophobicContact CD2-CZ3 4.24Å; L214-W235 HydrophobicContact CG-CH2 4.45Å; L214-W235 WeakPolarHBondContact O-CH2 3.17Å; L214-P245 HydrophobicContact CD2-CB 3.8Å; L214-P245 HydrophobicContact CD2-CG 3.95Å; L214-L257 HydrophobicContact CD2-CD1 3.75Å; L214-L257 HydrophobicContact CD2-CD2 3.73Å; L214-L257 HydrophobicContact CD2-CG 4.42Å; L214-L257 HydrophobicContact CG-CD1 3.97Å |
| 215 | Q | 97.2 | Very high | 95.7 | Very high | 34 Ų | 34 | 44.7 Ų | 44.7 | 16% | 0.159 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -61.2 | -39.2 | 179.4 | -71.2 | 169.7 | -25.6 | 0 | 0 | 111.8 | M211 H218 K219 C228 | M211-Q215 WeakPolarHBondContact O-CG 3.33Å; M211-Q215 PolarHBondContact O-N 3.02Å; Q215-H218 PolarHBondContact O-N 2.93Å; Q215-K219 WeakPolarHBondContact O-CB 3.5Å; Q215-K219 VanDerWaalsContact O-CG 3.25Å; Q215-K219 WeakPolarHBondContact O-CG 3.5Å; Q215-K219 PolarHBondContact O-N 3.44Å; Q215-C228 PolarHBondContact NE2-O 3.26Å |
| 216 | T | 98.3 | Very high | 95.4 | Very high | 3 Ų | 3 | 45.3 Ų | 45.3 | 2% | 0.018 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -63.9 | -46.2 | 176.9 | -64.7 | 0 | 0 | 0 | 0 | 111.2 | L140 I141 R212 V213 L214 H218 K219 R220 L261 M265 | L140-T216 HydrophobicContact CB-CG2 4.16Å; L140-T216 HydrophobicContact CD2-CG2 4.06Å; I141-T216 HydrophobicContact CG2-CG2 4.42Å; I141-T216 PolarHBondContact N-OG1 3.17Å; I141-T216 VanDerWaalsContact N-OG1 3.13Å; R212-T216 WeakPolarHBondContact O-CB 3.3Å; R212-T216 PolarHBondContact O-N 3.4Å; R212-T216 PolarHBondContact O-OG1 3.24Å; V213-T216 PolarHBondContact O-N 3.08Å; L214-T216 VanDerWaalsContact C-N 3.29Å; L214-T216 PolarHBondContact O-N 3Å; T216-H218 VanDerWaalsContact C-N 3.32Å; T216-H218 PolarHBondContact O-N 3Å; T216-K219 PolarHBondContact O-N 2.84Å; T216-R220 HydrophobicContact CG2-CG 4.09Å; T216-R220 WeakPolarHBondContact O-CB 3.38Å; T216-R220 WeakPolarHBondContact O-CG 3.24Å; T216-R220 PolarHBondContact O-N 2.92Å; T216-L261 HydrophobicContact CG2-CD1 3.5Å; T216-M265 HydrophobicContact CG2-CE 4.45Å; T216-M265 HydrophobicContact CG2-CG 4.06Å; T216-M265 HydrophobicContact CG2-SD 3.46Å; T216-M265 WeakPolarHBondContact CG2-SD 3.1Å |
| 217 | I | 98.2 | Very high | 95.2 | Very high | 1 Ų | 1 | 43.7 Ų | 43.7 | 1% | 0.005 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -56.3 | -49.7 | 176.5 | -70.6 | 162.3 | 0 | 0 | 0 | 110.5 | V213 L214 R220 L221 I238 L257 T260 L261 V264 | V213-I217 HydrophobicContact CG1-CD1 3.88Å; V213-I217 WeakPolarHBondContact O-CG1 3.26Å; V213-I217 PolarHBondContact O-N 3.45Å; L214-I217 PolarHBondContact O-N 2.87Å; I217-R220 PolarHBondContact O-N 3.28Å; I217-L221 HydrophobicContact CG2-CD1 3.9Å; I217-L221 WeakPolarHBondContact O-CG 3.39Å; I217-L221 PolarHBondContact O-N 3.48Å; I217-I238 HydrophobicContact CG2-CD1 4.35Å; I217-L257 HydrophobicContact CD1-CB 4.16Å; I217-L257 HydrophobicContact CD1-CD2 3.95Å; I217-T260 HydrophobicContact CD1-CG2 4.1Å; I217-T260 HydrophobicContact CG1-CG2 4.09Å; I217-T260 HydrophobicContact CG2-CG2 3.63Å; I217-L261 HydrophobicContact CD1-CB 4.44Å; I217-L261 HydrophobicContact CG1-CB 4.33Å; I217-L261 HydrophobicContact CG1-CD1 4.45Å; I217-V264 HydrophobicContact CG1-CG2 4.41Å |
| 218 | H | 97.1 | Very high | 95 | Very high | 12 Ų | 12 | 41.1 Ų | 41.1 | 6% | 0.056 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -58.6 | -54.8 | 178.6 | -179.3 | -98.3 | 0 | 0 | 0 | 111.6 | L214 Q215 T216 R220 L221 I222 H234 W235 I238 | L214-H218 PolarHBondContact O-N 3.12Å; Q215-H218 PolarHBondContact O-N 2.93Å; T216-H218 VanDerWaalsContact C-N 3.32Å; T216-H218 PolarHBondContact O-N 3Å; H218-R220 VanDerWaalsContact C-N 3.26Å; H218-R220 PolarHBondContact O-N 3.44Å; H218-L221 PolarHBondContact O-N 2.97Å; H218-I222 WeakPolarHBondContact CE1-CD1 3.47Å; H218-I222 WeakPolarHBondContact NE2-CD1 3.45Å; H218-I222 WeakPolarHBondContact O-CG1 3.45Å; H218-I222 PolarHBondContact O-N 3.18Å; H218-I222 VanDerWaalsContact O-N 3.11Å; H218-H234 AromaticContact CD2-CD2 3.96Å; H218-H234 AromaticContact NE2-CD2 3.85Å; H218-W235 HydrophobicContact CB-CH2 4.09Å; H218-W235 HydrophobicContact CB-CZ3 3.89Å; H218-I238 HydrophobicContact CB-CD1 4.5Å |
| 219 | K | 96.4 | Very high | 95 | Very high | 15 Ų | 15 | 40.3 Ų | 40.3 | 7% | 0.065 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -54.1 | -41.3 | 178.5 | -73.1 | 178.5 | -173.9 | -173.8 | 0 | 112.4 | T138 L140 Q215 T216 G223 A224 L226 D227 | T138-K219 PolarHBondContact O-NZ 3.36Å; L140-K219 HydrophobicContact CD2-CB 4.09Å; L140-K219 HydrophobicContact CD2-CD 3.68Å; Q215-K219 WeakPolarHBondContact O-CB 3.5Å; Q215-K219 VanDerWaalsContact O-CG 3.25Å; Q215-K219 WeakPolarHBondContact O-CG 3.5Å; Q215-K219 PolarHBondContact O-N 3.44Å; T216-K219 PolarHBondContact O-N 2.84Å; K219-G223 CarbonylContact O-C 3.46Å; K219-G223 WeakPolarHBondContact O-CA 3.48Å; K219-G223 PolarHBondContact O-N 2.95Å; K219-A224 WeakPolarHBondContact CB-O 3.46Å; K219-A224 HydrophobicContact CG-CB 4.5Å; K219-A224 WeakPolarHBondContact CG-O 3.37Å; K219-A224 PolarHBondContact O-N 2.75Å; K219-L226 VanDerWaalsContact CE-O 3.31Å; K219-L226 WeakPolarHBondContact CE-O 3.37Å; K219-D227 WeakPolarHBondContact CE-OD1 3.46Å; K219-D227 IonicContact NZ-OD1 3.15Å; K219-D227 PolarHBondContact NZ-OD1 3.11Å |
| 220 | R | 96.8 | Very high | 94.8 | Very high | 56 Ų | 56 | 41.2 Ų | 41.2 | 21% | 0.211 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -74 | -36.1 | -176 | -68.2 | -66.4 | -65.9 | -168.3 | -15.8 | 113.6 | T216 I217 H218 V264 M265 | T216-R220 HydrophobicContact CG2-CG 4.09Å; T216-R220 WeakPolarHBondContact O-CB 3.38Å; T216-R220 WeakPolarHBondContact O-CG 3.24Å; T216-R220 PolarHBondContact O-N 2.92Å; I217-R220 PolarHBondContact O-N 3.28Å; H218-R220 VanDerWaalsContact C-N 3.26Å; H218-R220 PolarHBondContact O-N 3.44Å; R220-V264 HydrophobicContact CB-CB 3.79Å; R220-V264 HydrophobicContact CB-CG2 3.75Å; R220-V264 HydrophobicContact CG-CG2 4.17Å; R220-V264 PolarHBondContact NE-O 3.35Å; R220-V264 PolarHBondContact NH2-O 2.97Å; R220-M265 HydrophobicContact CG-SD 3.71Å |
| 221 | L | 94.3 | Very high | 94.8 | Very high | 9 Ų | 9 | 47 Ų | 47 | 5% | 0.047 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -72.7 | -47.6 | 178.2 | -72.7 | 173.6 | 0 | 0 | 0 | 112 | I217 H218 I238 V264 Y277 F289 | I217-L221 HydrophobicContact CG2-CD1 3.9Å; I217-L221 WeakPolarHBondContact O-CG 3.39Å; I217-L221 PolarHBondContact O-N 3.48Å; H218-L221 PolarHBondContact O-N 2.97Å; L221-I238 HydrophobicContact CD1-CB 4.26Å; L221-I238 HydrophobicContact CD1-CD1 4.26Å; L221-I238 HydrophobicContact CD1-CG2 4.48Å; L221-V264 HydrophobicContact CD2-CG1 3.7Å; L221-V264 HydrophobicContact CG-CG1 4.04Å; L221-Y277 HydrophobicContact CD2-CG 4.49Å; L221-F289 HydrophobicContact CD1-CD1 3.92Å; L221-F289 HydrophobicContact CD1-CE1 3.71Å; L221-F289 HydrophobicContact CD1-CZ 4.4Å; L221-F289 HydrophobicContact CD2-CD1 4.42Å; L221-F289 HydrophobicContact CD2-CE1 3.8Å; L221-F289 HydrophobicContact CD2-CE2 4.07Å; L221-F289 HydrophobicContact CD2-CZ 3.62Å; L221-F289 HydrophobicContact CG-CE1 4.41Å |
| 222 | I | 92.7 | Very high | 94.8 | Very high | 74 Ų | 74 | 46 Ų | 46 | 38% | 0.379 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -98.8 | -5.7 | -172.5 | 77.9 | 166.1 | 0 | 0 | 0 | 114.1 | H218 A224 I238 Y277 | H218-I222 WeakPolarHBondContact CE1-CD1 3.47Å; H218-I222 WeakPolarHBondContact NE2-CD1 3.45Å; H218-I222 WeakPolarHBondContact O-CG1 3.45Å; H218-I222 PolarHBondContact O-N 3.18Å; H218-I222 VanDerWaalsContact O-N 3.11Å; I222-A224 VanDerWaalsContact C-N 3.32Å; I222-A224 HydrophobicContact CD1-CB 3.92Å; I222-A224 HydrophobicContact CG1-CB 3.74Å; I222-I238 HydrophobicContact CG2-CG2 3.59Å; I222-Y277 HydrophobicContact CG2-CE1 4Å; I222-Y277 VanDerWaalsContact CG2-OH 3.27Å; I222-Y277 WeakPolarHBondContact CG2-OH 3.47Å |
| 223 | G | 91.1 | Very high | 94.8 | Very high | 57 Ų | 57 | 48.4 Ų | 48.4 | 59% | 0.588 | 26% | 0.255 | S | S | * | . | trans | 74.4 | 19.9 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | K219 | K219-G223 CarbonylContact O-C 3.46Å; K219-G223 WeakPolarHBondContact O-CA 3.48Å; K219-G223 PolarHBondContact O-N 2.95Å | ||
| 224 | A | 90.4 | Very high | 94.7 | Very high | 33 Ų | 33 | 49.8 Ų | 49.8 | 27% | 0.273 | 26% | 0.261 | S | S | . | . | trans | -69.9 | 147.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | K219 I222 | K219-A224 WeakPolarHBondContact CB-O 3.46Å; K219-A224 HydrophobicContact CG-CB 4.5Å; K219-A224 WeakPolarHBondContact CG-O 3.37Å; K219-A224 PolarHBondContact O-N 2.75Å; I222-A224 VanDerWaalsContact C-N 3.32Å; I222-A224 HydrophobicContact CD1-CB 3.92Å; I222-A224 HydrophobicContact CG1-CB 3.74Å | ||
| 225 | R | 86.7 | Confident | 94.7 | Very high | 217 Ų | 217 | 49.7 Ų | 49.7 | 82% | 0.819 | 26% | 0.261 | S | S | * | . | trans | -97.7 | -37.7 | 175.6 | -64.3 | -175.6 | 179.3 | -178.5 | 0.1 | 112.4 | P137 | P137-R225 WeakPolarHBondContact CB-O 3.39Š| ||
| 226 | L | 89.8 | Confident | 94.6 | Very high | 88 Ų | 88 | 52.7 Ų | 52.7 | 46% | 0.461 | 28% | 0.275 | S | S | . | . | S | Bend | trans | -81.6 | 155.7 | -176.9 | -58.8 | 178.8 | 0 | 0 | 0 | 111.5 | L131 K219 | L131-L226 HydrophobicContact CD1-CD1 4.03Å; L131-L226 HydrophobicContact CD2-CD1 3.95Å; K219-L226 VanDerWaalsContact CE-O 3.31Å; K219-L226 WeakPolarHBondContact CE-O 3.37Å |
| 227 | D | 91.3 | Very high | 94.5 | Very high | 51 Ų | 51 | 57.5 Ų | 57.5 | 27% | 0.273 | 30% | 0.3 | S | S | . | . | P | Polyproline II helix | trans | -69.6 | 140.6 | 171.5 | -70.5 | -32 | 0 | 0 | 0 | 110.3 | T138 K219 | T138-D227 WeakPolarHBondContact CB-OD2 3.23Å; T138-D227 PolarHBondContact N-OD2 3.46Å; T138-D227 PolarHBondContact OG1-OD2 3.02Å; K219-D227 WeakPolarHBondContact CE-OD1 3.46Å; K219-D227 IonicContact NZ-OD1 3.15Å; K219-D227 PolarHBondContact NZ-OD1 3.11Å |
| 228 | C | 92.6 | Very high | 94.4 | Very high | 10 Ų | 10 | 57.4 Ų | 57.4 | 7% | 0.068 | 30% | 0.3 | C | S | . | . | P | Polyproline II helix | trans | -93.9 | 149.4 | 169 | 65.6 | 0 | 0 | 0 | 0 | 110 | Q215 H234 W235 | Q215-C228 PolarHBondContact NE2-O 3.26Å; C228-H234 WeakPolarHBondContact CB-NE2 3.36Å; C228-H234 PolarHBondContact SG-NE2 3.19Å; C228-H234 VanDerWaalsContact SG-NE2 3.43Å; C228-W235 VanDerWaalsContact SG-CZ2 3.59Å |
| 229 | P | 94.8 | Very high | 94.4 | Very high | 87 Ų | 87 | 57.6 Ų | 57.6 | 57% | 0.565 | 31% | 0.305 | S | S | * | . | P | Polyproline II helix | trans | -59.7 | 157.8 | 172.8 | -22.9 | 33.6 | 0 | 0 | 0 | 112.2 | Y231 H234 | P229-Y231 PolarHBondContact O-N 2.61Å; P229-H234 PolarHBondContact O-CE1 2.97Å; P229-H234 PolarHBondContact O-NE2 2.87Å |
| 230 | R | 94.9 | Very high | 94.4 | Very high | 40 Ų | 40 | 57.4 Ų | 57.4 | 15% | 0.151 | 30% | 0.304 | C | S | . | . | S | Bend | trans | -58.8 | -33.1 | 177 | 173.4 | 55.2 | -177.1 | 85.7 | 4.5 | 113.1 | N205 M211 W235 D244 | N205-R230 PolarHBondContact OD1-NE 3.29Å; M211-R230 VanDerWaalsContact SD-CD 3.55Å; M211-R230 HydrophobicContact SD-CG 4.19Å; R230-W235 PolarHBondContact O-NE1 2.72Å; R230-D244 IonicContact CZ-OD1 2.66Å; R230-D244 IonicContact NH1-OD1 3.81Å; R230-D244 PolarHBondContact NH1-OD1 3.42Å; R230-D244 IonicContact NH2-OD1 2.74Å; R230-D244 PolarHBondContact NH2-OD1 3.3Å; R230-D244 IonicContact NH2-OD2 3.75Å |
| 231 | Y | 97.6 | Very high | 94.4 | Very high | 123 Ų | 123 | 61.4 Ų | 61.4 | 48% | 0.482 | 33% | 0.325 | S | S | . | . | S | Bend | trans | -124.6 | 144.7 | -177.8 | -55.6 | -73 | 0 | 0 | 0 | 110.4 | N205 P229 S243 D244 | N205-Y231 PolarHBondContact ND2-OH 3.25Å; P229-Y231 PolarHBondContact O-N 2.61Å; Y231-S243 WeakPolarHBondContact CA-O 3.47Å; Y231-D244 HydrophobicContact CD1-CB 3.92Å; Y231-D244 HydrophobicContact CE1-CB 4.09Å |
| 232 | G | 97.1 | Very high | 94.5 | Very high | 13 Ų | 13 | 61.8 Ų | 61.8 | 13% | 0.134 | 33% | 0.331 | C | S | . | . | S | Bend | trans | 150.3 | 171.2 | 172.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | H234 W235 S243 | G232-H234 PolarHBondContact O-N 3.22Å; G232-H234 VanDerWaalsContact O-N 3.13Å; G232-W235 PolarHBondContact O-N 2.78Å; G232-S243 PolarHBondContact N-O 3.42Å; G232-S243 VanDerWaalsContact O-CA 3.29Å; G232-S243 WeakPolarHBondContact O-CA 3.44Å; G232-S243 WeakPolarHBondContact O-CB 3.33Å |
| 233 | P | 97.2 | Very high | 94.7 | Very high | 90 Ų | 90 | 61 Ų | 61 | 58% | 0.584 | 33% | 0.332 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.1 | -14.5 | -174 | 27.4 | -36 | 0 | 0 | 0 | 113.8 | W235 E236 N237 | P233-W235 PolarHBondContact O-N 3.43Å; P233-W235 VanDerWaalsContact O-N 3.16Å; P233-E236 WeakPolarHBondContact O-CB 3.47Å; P233-E236 PolarHBondContact O-N 2.9Å; P233-N237 PolarHBondContact O-N 3.37Å |
| 234 | H | 95.7 | Very high | 95 | Very high | 29 Ų | 29 | 60 Ų | 60 | 13% | 0.134 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -61.5 | -22 | 176 | 62 | -88.3 | 0 | 0 | 0 | 113.2 | H218 C228 P229 G232 N237 | H218-H234 AromaticContact CD2-CD2 3.96Å; H218-H234 AromaticContact NE2-CD2 3.85Å; C228-H234 WeakPolarHBondContact CB-NE2 3.36Å; C228-H234 PolarHBondContact SG-NE2 3.19Å; C228-H234 VanDerWaalsContact SG-NE2 3.43Å; P229-H234 PolarHBondContact O-CE1 2.97Å; P229-H234 PolarHBondContact O-NE2 2.87Å; G232-H234 PolarHBondContact O-N 3.22Å; G232-H234 VanDerWaalsContact O-N 3.13Å; H234-N237 WeakPolarHBondContact O-CB 2.97Å |
| 235 | W | 97.8 | Very high | 95.4 | Very high | 1 Ų | 1 | 58.4 Ų | 58.4 | 0% | 0.004 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -71.6 | -37 | 172.5 | -64.3 | 120.4 | 0 | 0 | 0 | 112.6 | L214 H218 C228 R230 G232 P233 N237 I238 G239 F240 S243 P245 | L214-W235 HydrophobicContact CB-CH2 3.69Å; L214-W235 HydrophobicContact CB-CZ2 4.16Å; L214-W235 HydrophobicContact CB-CZ3 4.47Å; L214-W235 HydrophobicContact CD2-CH2 4.14Å; L214-W235 HydrophobicContact CD2-CZ3 4.24Å; L214-W235 HydrophobicContact CG-CH2 4.45Å; L214-W235 WeakPolarHBondContact O-CH2 3.17Å; H218-W235 HydrophobicContact CB-CH2 4.09Å; H218-W235 HydrophobicContact CB-CZ3 3.89Å; C228-W235 VanDerWaalsContact SG-CZ2 3.59Å; R230-W235 PolarHBondContact O-NE1 2.72Å; G232-W235 PolarHBondContact O-N 2.78Å; P233-W235 PolarHBondContact O-N 3.43Å; P233-W235 VanDerWaalsContact O-N 3.16Å; W235-N237 VanDerWaalsContact C-N 3.27Å; W235-N237 PolarHBondContact O-N 3.16Å; W235-I238 HydrophobicContact CE3-CD1 3.77Å; W235-I238 HydrophobicContact CE3-CG1 4.3Å; W235-I238 HydrophobicContact CZ3-CD1 3.89Å; W235-I238 WeakPolarHBondContact O-CG1 3.33Å; W235-I238 PolarHBondContact O-N 3.28Å; W235-G239 PolarHBondContact O-N 3.26Å; W235-F240 HydrophobicContact CB-CB 4.2Å; W235-F240 HydrophobicContact CB-CD2 3.99Å; W235-F240 HydrophobicContact CB-CG 4.44Å; W235-F240 AromaticContact CE3-CD2 3.96Å; W235-F240 HydrophobicContact CE3-CD2 3.96Å; W235-F240 AromaticContact CE3-CE2 3.82Å; W235-F240 HydrophobicContact CE3-CE2 3.82Å; W235-F240 HydrophobicContact CZ3-CE2 4.39Å; W235-F240 WeakPolarHBondContact O-CB 3.31Å; W235-F240 WeakPolarHBondContact O-CD2 3.37Å; W235-F240 PolarHBondContact O-N 3.07Å; W235-F240 VanDerWaalsContact O-N 3.12Å; W235-S243 VanDerWaalsContact CD1-O 3.24Å; W235-P245 HydrophobicContact CB-CG 3.98Å; W235-P245 VanDerWaalsContact CD1-CD 3.43Å; W235-P245 HydrophobicContact CD2-CG 3.28Å; W235-P245 HydrophobicContact CE3-CG 3.64Å; W235-P245 VanDerWaalsContact CG-CD 3.46Å; W235-P245 HydrophobicContact CG-CG 3.43Å; W235-P245 VanDerWaalsContact CG-CG 3.43Å; W235-P245 HydrophobicContact CZ2-CG 4.41Å; W235-P245 HydrophobicContact CZ3-CG 4.35Å |
| 236 | E | 96.6 | Very high | 95.9 | Very high | 97 Ų | 97 | 49.5 Ų | 49.5 | 45% | 0.453 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -64.5 | -35.7 | 174.8 | -62.6 | 174 | -125.2 | 0 | 0 | 110.8 | P233 I238 G239 G242 | P233-E236 WeakPolarHBondContact O-CB 3.47Å; P233-E236 PolarHBondContact O-N 2.9Å; E236-I238 PolarHBondContact O-N 2.9Å; E236-G239 WeakPolarHBondContact O-CA 3.44Å; E236-G239 PolarHBondContact O-N 3.25Å; E236-G242 VanDerWaalsContact CG-C 3.49Å |
| 237 | N | 94.5 | Very high | 96.2 | Very high | 104 Ų | 104 | 48 Ų | 48 | 56% | 0.556 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -60.4 | -28.4 | 177.3 | -64.6 | -15.9 | 0 | 0 | 0 | 113.6 | P233 H234 W235 Y277 | P233-N237 PolarHBondContact O-N 3.37Å; H234-N237 WeakPolarHBondContact O-CB 2.97Å; W235-N237 VanDerWaalsContact C-N 3.27Å; W235-N237 PolarHBondContact O-N 3.16Å; N237-Y277 PolarHBondContact O-OH 2.93Å |
| 238 | I | 96.6 | Very high | 96.5 | Very high | 0 Ų | 0 | 46.3 Ų | 46.3 | 0% | 0 | 26% | 0.259 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -97.3 | 6.3 | 174.4 | 67.6 | 170.2 | 0 | 0 | 0 | 113.5 | I217 H218 L221 I222 W235 E236 F240 Y277 C290 | I217-I238 HydrophobicContact CG2-CD1 4.35Å; H218-I238 HydrophobicContact CB-CD1 4.5Å; L221-I238 HydrophobicContact CD1-CB 4.26Å; L221-I238 HydrophobicContact CD1-CD1 4.26Å; L221-I238 HydrophobicContact CD1-CG2 4.48Å; I222-I238 HydrophobicContact CG2-CG2 3.59Å; W235-I238 HydrophobicContact CE3-CD1 3.77Å; W235-I238 HydrophobicContact CE3-CG1 4.3Å; W235-I238 HydrophobicContact CZ3-CD1 3.89Å; W235-I238 WeakPolarHBondContact O-CG1 3.33Å; W235-I238 PolarHBondContact O-N 3.28Å; E236-I238 PolarHBondContact O-N 2.9Å; I238-F240 HydrophobicContact CD1-CD2 4.16Å; I238-F240 HydrophobicContact CD1-CE2 3.85Å; I238-F240 HydrophobicContact CG1-CD2 3.88Å; I238-F240 HydrophobicContact CG1-CE2 4.07Å; I238-Y277 HydrophobicContact CB-CE2 4.35Å; I238-Y277 HydrophobicContact CG2-CE2 4.06Å; I238-C290 WeakPolarHBondContact O-CB 3.44Å; I238-C290 PolarHBondContact O-N 2.67Å; I238-C290 VanDerWaalsContact O-N 3.15Å; I238-C290 PolarHBondContact O-SG 3.17Å |
| 239 | G | 97 | Very high | 96.7 | Very high | 15 Ų | 15 | 46.1 Ų | 46.1 | 16% | 0.155 | 26% | 0.257 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 92.6 | 25.3 | 169.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | W235 E236 V291 | W235-G239 PolarHBondContact O-N 3.26Å; E236-G239 WeakPolarHBondContact O-CA 3.44Å; E236-G239 PolarHBondContact O-N 3.25Å; G239-V291 VanDerWaalsContact O-CG2 3.23Å; G239-V291 WeakPolarHBondContact O-CG2 3.5Å; G239-V291 PolarHBondContact O-N 2.96Å |
| 240 | F | 97.9 | Very high | 96.5 | Very high | 11 Ų | 11 | 51.6 Ų | 51.6 | 5% | 0.048 | 27% | 0.266 | C | S | . | . | trans | -74.8 | 159.4 | 159.2 | -72 | -76.1 | 0 | 0 | 0 | 110.2 | W235 I238 G242 P245 D248 L257 C290 I294 | W235-F240 HydrophobicContact CB-CB 4.2Å; W235-F240 HydrophobicContact CB-CD2 3.99Å; W235-F240 HydrophobicContact CB-CG 4.44Å; W235-F240 AromaticContact CE3-CD2 3.96Å; W235-F240 HydrophobicContact CE3-CD2 3.96Å; W235-F240 AromaticContact CE3-CE2 3.82Å; W235-F240 HydrophobicContact CE3-CE2 3.82Å; W235-F240 HydrophobicContact CZ3-CE2 4.39Å; W235-F240 WeakPolarHBondContact O-CB 3.31Å; W235-F240 WeakPolarHBondContact O-CD2 3.37Å; W235-F240 PolarHBondContact O-N 3.07Å; W235-F240 VanDerWaalsContact O-N 3.12Å; I238-F240 HydrophobicContact CD1-CD2 4.16Å; I238-F240 HydrophobicContact CD1-CE2 3.85Å; I238-F240 HydrophobicContact CG1-CD2 3.88Å; I238-F240 HydrophobicContact CG1-CE2 4.07Å; F240-G242 VanDerWaalsContact C-N 3.28Å; F240-G242 PolarHBondContact O-N 3.41Å; F240-P245 HydrophobicContact CD1-CB 3.91Å; F240-P245 HydrophobicContact CD1-CG 4.38Å; F240-P245 HydrophobicContact CD2-CB 4.27Å; F240-P245 HydrophobicContact CD2-CG 3.94Å; F240-P245 HydrophobicContact CE1-CB 3.66Å; F240-P245 HydrophobicContact CE1-CG 4.37Å; F240-P245 HydrophobicContact CE2-CB 4.04Å; F240-P245 HydrophobicContact CE2-CG 3.91Å; F240-P245 HydrophobicContact CG-CB 4.22Å; F240-P245 HydrophobicContact CG-CG 4.18Å; F240-P245 HydrophobicContact CZ-CB 3.74Å; F240-P245 HydrophobicContact CZ-CG 4.14Å; F240-D248 WeakPolarHBondContact CA-OD2 3.27Å; F240-D248 WeakPolarHBondContact CB-OD2 3.4Å; F240-D248 HydrophobicContact CD1-CB 4.23Å; F240-D248 WeakPolarHBondContact CD1-OD2 3.4Å; F240-L257 HydrophobicContact CZ-CD2 4.1Å; F240-C290 HydrophobicContact CD1-CB 3.97Å; F240-C290 HydrophobicContact CD2-CB 3.86Å; F240-C290 HydrophobicContact CE1-CB 3.94Å; F240-C290 HydrophobicContact CE2-CB 3.83Å; F240-C290 WeakPolarHBondContact CE2-SG 3.25Å; F240-C290 HydrophobicContact CG-CB 3.93Å; F240-C290 HydrophobicContact CZ-CB 3.87Å; F240-I294 HydrophobicContact CD1-CD1 4.4Å; F240-I294 HydrophobicContact CE1-CD1 4.11Å | ||
| 241 | Q | 96.2 | Very high | 96.2 | Very high | 141 Ų | 141 | 51.2 Ų | 51.2 | 66% | 0.659 | 28% | 0.275 | S | S | * | . | S | Bend | trans | -78.3 | -12.8 | -176.6 | -54.3 | -167 | -76.8 | 0 | 0 | 113.4 | D248 V291 | Q241-D248 WeakPolarHBondContact CB-OD1 3.33Å; Q241-D248 WeakPolarHBondContact CG-OD1 3.34Å; Q241-D248 PolarHBondContact N-OD2 3.26Å; Q241-D248 PolarHBondContact OE1-OD1 3.24Å; Q241-V291 HydrophobicContact CG-CG2 3.52Å |
| 242 | G | 96.1 | Very high | 96.2 | Very high | 17 Ų | 17 | 45.4 Ų | 45.4 | 18% | 0.175 | 25% | 0.252 | C | S | . | . | S | Bend | trans | -163.7 | -170.4 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | E236 F240 D244 | E236-G242 VanDerWaalsContact CG-C 3.49Å; F240-G242 VanDerWaalsContact C-N 3.28Å; F240-G242 PolarHBondContact O-N 3.41Å; G242-D244 PolarHBondContact O-N 2.93Å |
| 243 | S | 97.6 | Very high | 96.3 | Very high | 56 Ų | 56 | 45.1 Ų | 45.1 | 39% | 0.392 | 25% | 0.249 | S | C | . | . | S | Bend | trans | -75.1 | 1 | -175.7 | 62.2 | 0 | 0 | 0 | 0 | 115.2 | Y231 G232 W235 | Y231-S243 WeakPolarHBondContact CA-O 3.47Å; G232-S243 PolarHBondContact N-O 3.42Å; G232-S243 VanDerWaalsContact O-CA 3.29Å; G232-S243 WeakPolarHBondContact O-CA 3.44Å; G232-S243 WeakPolarHBondContact O-CB 3.33Å; W235-S243 VanDerWaalsContact CD1-O 3.24Å |
| 244 | D | 97.6 | Very high | 96.3 | Very high | 37 Ų | 37 | 40.8 Ų | 40.8 | 20% | 0.198 | 22% | 0.222 | C | C | . | . | trans | -130 | 104.3 | 175.8 | -178.7 | 6.2 | 0 | 0 | 0 | 111.6 | R230 Y231 G242 A246 T247 | R230-D244 IonicContact CZ-OD1 2.66Å; R230-D244 IonicContact NH1-OD1 3.81Å; R230-D244 PolarHBondContact NH1-OD1 3.42Å; R230-D244 IonicContact NH2-OD1 2.74Å; R230-D244 PolarHBondContact NH2-OD1 3.3Å; R230-D244 IonicContact NH2-OD2 3.75Å; Y231-D244 HydrophobicContact CD1-CB 3.92Å; Y231-D244 HydrophobicContact CE1-CB 4.09Å; G242-D244 PolarHBondContact O-N 2.93Å; D244-A246 PolarHBondContact O-N 3.41Å; D244-A246 VanDerWaalsContact OD1-CB 3.29Å; D244-A246 WeakPolarHBondContact OD1-CB 3.13Å; D244-A246 PolarHBondContact OD1-N 3.29Å; D244-T247 HydrophobicContact CB-CG2 4.12Å; D244-T247 PolarHBondContact O-N 2.99Å; D244-T247 VanDerWaalsContact O-N 3.14Å; D244-T247 PolarHBondContact O-OG1 3.37Å | ||
| 245 | P | 97.7 | Very high | 96.5 | Very high | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 22% | 0.217 | C | C | . | . | G | 310 helix | trans | -52.9 | -28.1 | 174.8 | -32.3 | 37.9 | 0 | 0 | 0 | 115.2 | L214 W235 F240 T247 D248 L249 | L214-P245 HydrophobicContact CD2-CB 3.8Å; L214-P245 HydrophobicContact CD2-CG 3.95Å; W235-P245 HydrophobicContact CB-CG 3.98Å; W235-P245 VanDerWaalsContact CD1-CD 3.43Å; W235-P245 HydrophobicContact CD2-CG 3.28Å; W235-P245 HydrophobicContact CE3-CG 3.64Å; W235-P245 VanDerWaalsContact CG-CD 3.46Å; W235-P245 HydrophobicContact CG-CG 3.43Å; W235-P245 VanDerWaalsContact CG-CG 3.43Å; W235-P245 HydrophobicContact CZ2-CG 4.41Å; W235-P245 HydrophobicContact CZ3-CG 4.35Å; F240-P245 HydrophobicContact CD1-CB 3.91Å; F240-P245 HydrophobicContact CD1-CG 4.38Å; F240-P245 HydrophobicContact CD2-CB 4.27Å; F240-P245 HydrophobicContact CD2-CG 3.94Å; F240-P245 HydrophobicContact CE1-CB 3.66Å; F240-P245 HydrophobicContact CE1-CG 4.37Å; F240-P245 HydrophobicContact CE2-CB 4.04Å; F240-P245 HydrophobicContact CE2-CG 3.91Å; F240-P245 HydrophobicContact CG-CB 4.22Å; F240-P245 HydrophobicContact CG-CG 4.18Å; F240-P245 HydrophobicContact CZ-CB 3.74Å; F240-P245 HydrophobicContact CZ-CG 4.14Å; P245-T247 PolarHBondContact O-N 3.17Å; P245-D248 PolarHBondContact O-N 3.02Å; P245-L249 WeakPolarHBondContact O-CG 3.4Å |
| 246 | A | 97.2 | Very high | 96.5 | Very high | 30 Ų | 30 | 39.7 Ų | 39.7 | 25% | 0.248 | 22% | 0.217 | C | C | . | . | G | 310 helix | trans | -64.5 | -26.5 | -178 | 0 | 0 | 0 | 0 | 0 | 112.8 | V203 D244 D248 L249 | V203-A246 HydrophobicContact CB-CB 3.97Å; V203-A246 HydrophobicContact CG2-CB 4.16Å; D244-A246 PolarHBondContact O-N 3.41Å; D244-A246 VanDerWaalsContact OD1-CB 3.29Å; D244-A246 WeakPolarHBondContact OD1-CB 3.13Å; D244-A246 PolarHBondContact OD1-N 3.29Å; A246-D248 VanDerWaalsContact C-N 3.26Å; A246-D248 PolarHBondContact O-N 3.34Å; A246-L249 PolarHBondContact O-N 3.05Å |
| 247 | T | 96.6 | Very high | 96.6 | Very high | 55 Ų | 55 | 35.1 Ų | 35.1 | 34% | 0.337 | 20% | 0.196 | S | C | . | . | G | 310 helix | trans | -68.5 | -27.6 | -180 | 62.8 | 0 | 0 | 0 | 0 | 112.6 | D244 P245 R250 | D244-T247 HydrophobicContact CB-CG2 4.12Å; D244-T247 PolarHBondContact O-N 2.99Å; D244-T247 VanDerWaalsContact O-N 3.14Å; D244-T247 PolarHBondContact O-OG1 3.37Å; P245-T247 PolarHBondContact O-N 3.17Å; T247-R250 PolarHBondContact O-NE 3.24Å; T247-R250 PolarHBondContact O-NH1 3.46Å; T247-R250 PolarHBondContact O-NH2 2.78Å |
| 248 | D | 97.5 | Very high | 96.8 | Very high | 16 Ų | 16 | 30.3 Ų | 30.3 | 9% | 0.086 | 17% | 0.17 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -87.1 | -19.9 | -176 | -60.9 | -26.5 | 0 | 0 | 0 | 112.4 | F240 Q241 P245 A246 R250 I294 | F240-D248 WeakPolarHBondContact CA-OD2 3.27Å; F240-D248 WeakPolarHBondContact CB-OD2 3.4Å; F240-D248 HydrophobicContact CD1-CB 4.23Å; F240-D248 WeakPolarHBondContact CD1-OD2 3.4Å; Q241-D248 WeakPolarHBondContact CB-OD1 3.33Å; Q241-D248 WeakPolarHBondContact CG-OD1 3.34Å; Q241-D248 PolarHBondContact N-OD2 3.26Å; Q241-D248 PolarHBondContact OE1-OD1 3.24Å; P245-D248 PolarHBondContact O-N 3.02Å; A246-D248 VanDerWaalsContact C-N 3.26Å; A246-D248 PolarHBondContact O-N 3.34Å; D248-R250 VanDerWaalsContact C-N 3.32Å; D248-R250 PolarHBondContact O-N 3.34Å; D248-I294 HydrophobicContact CB-CD1 3.64Å |
| 249 | L | 96.8 | Very high | 97 | Very high | 7 Ų | 7 | 30.3 Ų | 30.3 | 4% | 0.037 | 17% | 0.17 | C | C | . | . | G | 310 helix | trans | -84.7 | 3.5 | -172 | -64.9 | 168 | 0 | 0 | 0 | 114 | V203 P245 A246 G251 T252 G253 L257 I294 | V203-L249 HydrophobicContact CG2-CD1 3.61Å; P245-L249 WeakPolarHBondContact O-CG 3.4Å; A246-L249 PolarHBondContact O-N 3.05Å; L249-G251 PolarHBondContact O-N 2.92Å; L249-T252 PolarHBondContact O-N 3.34Å; L249-T252 VanDerWaalsContact O-N 3.08Å; L249-G253 WeakPolarHBondContact O-CA 3.38Å; L249-G253 PolarHBondContact O-N 3.19Å; L249-L257 HydrophobicContact CD1-CD1 3.68Å; L249-L257 HydrophobicContact CD1-CD2 4.05Å; L249-L257 HydrophobicContact CD1-CG 3.64Å; L249-L257 HydrophobicContact CD2-CD2 4.4Å; L249-L257 HydrophobicContact CD2-CG 4.22Å; L249-I294 HydrophobicContact CD2-CD1 3.88Å; L249-I294 HydrophobicContact CD2-CG1 3.93Å |
| 250 | R | 90.3 | Very high | 97 | Very high | 201 Ų | 201 | 29.8 Ų | 29.8 | 76% | 0.758 | 16% | 0.163 | S | C | * | . | G | 310 helix | trans | -51.4 | -33.3 | -175 | -70.9 | -175.5 | -71.5 | -101.7 | -5.1 | 115 | T247 D248 | T247-R250 PolarHBondContact O-NE 3.24Å; T247-R250 PolarHBondContact O-NH1 3.46Å; T247-R250 PolarHBondContact O-NH2 2.78Å; D248-R250 VanDerWaalsContact C-N 3.32Å; D248-R250 PolarHBondContact O-N 3.34Å |
| 251 | G | 89.3 | Confident | 97.1 | Very high | 33 Ų | 33 | 29.2 Ų | 29.2 | 34% | 0.34 | 16% | 0.161 | S | C | . | . | G | 310 helix | trans | -96.7 | -9.7 | -176.8 | 0 | 0 | 0 | 0 | 0 | 116.1 | L249 | L249-G251 PolarHBondContact O-N 2.92Š|
| 252 | T | 97.8 | Very high | 97.2 | Very high | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 14% | 0.137 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -128.7 | -6.8 | -177.5 | 57.5 | 0 | 0 | 0 | 0 | 113.1 | A199 L249 L255 I294 T297 R298 | A199-T252 WeakPolarHBondContact CA-O 3.31Å; A199-T252 CarbonylContact O-C 3.59Å; L249-T252 PolarHBondContact O-N 3.34Å; L249-T252 VanDerWaalsContact O-N 3.08Å; T252-L255 WeakPolarHBondContact O-CB 3.48Å; T252-L255 PolarHBondContact O-N 2.91Å; T252-I294 HydrophobicContact CG2-CG2 4.01Å; T252-I294 WeakPolarHBondContact CG2-O 3.48Å; T252-T297 HydrophobicContact CG2-CG2 3.76Å; T252-R298 HydrophobicContact CG2-CB 4.05Å |
| 253 | G | 97.9 | Very high | 97.3 | Very high | 7 Ų | 7 | 23.7 Ų | 23.7 | 7% | 0.072 | 13% | 0.129 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 50.2 | -150.1 | -173.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | A199 C201 L249 L255 G256 | A199-G253 VanDerWaalsContact O-CA 3.27Å; A199-G253 WeakPolarHBondContact O-CA 3.43Å; A199-G253 PolarHBondContact O-N 2.92Å; A199-G253 VanDerWaalsContact O-N 3.07Å; C201-G253 CarbonylContact O-C 3.56Å; C201-G253 WeakPolarHBondContact O-CA 3.42Å; L249-G253 WeakPolarHBondContact O-CA 3.38Å; L249-G253 PolarHBondContact O-N 3.19Å; G253-L255 PolarHBondContact O-N 3.29Å; G253-G256 PolarHBondContact O-N 3.1Å |
| 254 | F | 98.6 | Very high | 97.4 | Very high | 0 Ų | 0 | 21 Ų | 21 | 0% | 0 | 11% | 0.11 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -65.2 | -18.6 | 179.8 | -151.6 | -89.6 | 0 | 0 | 0 | 112.8 | F150 I198 C201 V203 H210 V213 G256 L257 M258 | F150-F254 HydrophobicContact CE1-CD1 4.5Å; F150-F254 AromaticContact CE2-CD1 3.44Å; F150-F254 HydrophobicContact CE2-CD1 3.44Å; F150-F254 VanDerWaalsContact CE2-CD1 3.44Å; F150-F254 AromaticContact CE2-CE1 3.78Å; F150-F254 HydrophobicContact CE2-CE1 3.78Å; F150-F254 HydrophobicContact CE2-CG 4.31Å; F150-F254 HydrophobicContact CZ-CB 4.09Å; F150-F254 AromaticContact CZ-CD1 3.28Å; F150-F254 HydrophobicContact CZ-CD1 3.28Å; F150-F254 AromaticContact CZ-CE1 3.85Å; F150-F254 HydrophobicContact CZ-CE1 3.85Å; F150-F254 AromaticContact CZ-CG 3.71Å; F150-F254 HydrophobicContact CZ-CG 3.71Å; I198-F254 HydrophobicContact CG2-CB 4.18Å; I198-F254 PolarHBondContact O-N 2.87Å; C201-F254 HydrophobicContact CB-CB 4.08Å; C201-F254 WeakPolarHBondContact O-CB 3.22Å; C201-F254 PolarHBondContact O-N 3.22Å; V203-F254 HydrophobicContact CG2-CD2 4.08Å; V203-F254 HydrophobicContact CG2-CE2 4.22Å; H210-F254 HydrophobicContact CB-CE2 3.62Å; H210-F254 HydrophobicContact CB-CZ 3.95Å; H210-F254 AromaticContact CD2-CD2 3.96Å; H210-F254 AromaticContact CD2-CE2 3.46Å; H210-F254 VanDerWaalsContact CD2-CE2 3.46Å; H210-F254 WeakPolarHBondContact CD2-CE2 3.2Å; H210-F254 AromaticContact CD2-CZ 3.54Å; H210-F254 AromaticContact CG-CE2 3.43Å; H210-F254 VanDerWaalsContact CG-CE2 3.43Å; H210-F254 AromaticContact CG-CZ 3.86Å; V213-F254 HydrophobicContact CB-CE1 4.25Å; V213-F254 HydrophobicContact CB-CZ 3.86Å; V213-F254 HydrophobicContact CG1-CE1 4.07Å; V213-F254 HydrophobicContact CG1-CZ 3.95Å; V213-F254 HydrophobicContact CG2-CE1 3.95Å; V213-F254 HydrophobicContact CG2-CZ 3.92Å; F254-G256 PolarHBondContact O-N 3.34Å; F254-L257 HydrophobicContact CD2-CD1 4.05Å; F254-L257 HydrophobicContact CE1-CB 4.34Å; F254-L257 HydrophobicContact CE2-CD1 3.65Å; F254-L257 HydrophobicContact CZ-CB 4.39Å; F254-L257 HydrophobicContact CZ-CD1 3.97Å; F254-L257 WeakPolarHBondContact O-CB 3.2Å; F254-L257 PolarHBondContact O-N 3.3Å; F254-M258 HydrophobicContact CD1-CG 3.87Å; F254-M258 HydrophobicContact CD1-SD 4.29Å; F254-M258 HydrophobicContact CE1-CG 4.24Å; F254-M258 HydrophobicContact CE1-SD 4.13Å; F254-M258 PolarHBondContact O-N 2.92Å |
| 255 | L | 98.8 | Very high | 97.4 | Very high | 6 Ų | 6 | 21.2 Ų | 21.2 | 3% | 0.031 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -61 | -32.7 | 177.2 | -174.9 | 68 | 0 | 0 | 0 | 111.8 | V195 I198 A199 T252 G253 L257 M258 H259 T297 L301 | V195-L255 HydrophobicContact CG1-CD1 4.43Å; V195-L255 HydrophobicContact CG1-CD2 3.75Å; I198-L255 HydrophobicContact CG2-CB 4.02Å; I198-L255 HydrophobicContact CG2-CD1 4.36Å; I198-L255 PolarHBondContact O-N 3.49Å; A199-L255 HydrophobicContact CB-CB 3.99Å; A199-L255 HydrophobicContact CB-CD2 4.03Å; T252-L255 WeakPolarHBondContact O-CB 3.48Å; T252-L255 PolarHBondContact O-N 2.91Å; G253-L255 PolarHBondContact O-N 3.29Å; L255-L257 PolarHBondContact O-N 3.06Å; L255-M258 HydrophobicContact CD1-CB 4.28Å; L255-M258 PolarHBondContact O-N 3.43Å; L255-H259 PolarHBondContact O-N 3.46Å; L255-T297 HydrophobicContact CB-CG2 4.39Å; L255-T297 HydrophobicContact CD2-CG2 4.05Å; L255-T297 HydrophobicContact CG-CG2 4.01Å; L255-L301 HydrophobicContact CD2-CD1 4.06Å; L255-L301 HydrophobicContact CD2-CD2 3.51Å; L255-L301 HydrophobicContact CD2-CG 3.79Å |
| 256 | G | 98.8 | Very high | 97.3 | Very high | 1 Ų | 1 | 23 Ų | 23 | 1% | 0.01 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -59.4 | -37 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | G253 F254 T260 | G253-G256 PolarHBondContact O-N 3.1Å; F254-G256 PolarHBondContact O-N 3.34Å; G256-T260 PolarHBondContact O-N 3.3Å; G256-T260 PolarHBondContact O-OG1 3.27Å |
| 257 | L | 98.8 | Very high | 97.2 | Very high | 1 Ų | 1 | 26.6 Ų | 26.6 | 1% | 0.005 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -75.8 | -39.3 | 174.1 | -62.6 | 179.4 | 0 | 0 | 0 | 111.5 | V203 V213 L214 I217 F240 L249 F254 L255 H259 T260 L261 | V203-L257 HydrophobicContact CG2-CD1 3.91Å; V213-L257 HydrophobicContact CG1-CB 3.83Å; L214-L257 HydrophobicContact CD2-CD1 3.75Å; L214-L257 HydrophobicContact CD2-CD2 3.73Å; L214-L257 HydrophobicContact CD2-CG 4.42Å; L214-L257 HydrophobicContact CG-CD1 3.97Å; I217-L257 HydrophobicContact CD1-CB 4.16Å; I217-L257 HydrophobicContact CD1-CD2 3.95Å; F240-L257 HydrophobicContact CZ-CD2 4.1Å; L249-L257 HydrophobicContact CD1-CD1 3.68Å; L249-L257 HydrophobicContact CD1-CD2 4.05Å; L249-L257 HydrophobicContact CD1-CG 3.64Å; L249-L257 HydrophobicContact CD2-CD2 4.4Å; L249-L257 HydrophobicContact CD2-CG 4.22Å; F254-L257 HydrophobicContact CD2-CD1 4.05Å; F254-L257 HydrophobicContact CE1-CB 4.34Å; F254-L257 HydrophobicContact CE2-CD1 3.65Å; F254-L257 HydrophobicContact CZ-CB 4.39Å; F254-L257 HydrophobicContact CZ-CD1 3.97Å; F254-L257 WeakPolarHBondContact O-CB 3.2Å; F254-L257 PolarHBondContact O-N 3.3Å; L255-L257 PolarHBondContact O-N 3.06Å; L257-H259 PolarHBondContact O-N 2.79Å; L257-T260 PolarHBondContact O-N 2.93Å; L257-L261 VanDerWaalsContact O-CB 3.31Å; L257-L261 WeakPolarHBondContact O-CB 3.35Å; L257-L261 PolarHBondContact O-N 3.19Å |
| 258 | M | 98.9 | Very high | 97.1 | Very high | 2 Ų | 2 | 28.7 Ų | 28.7 | 1% | 0.01 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -59.5 | -45.1 | 176.7 | -71.1 | -63 | -72 | 0 | 0 | 112.7 | F143 A146 L147 F150 I198 F254 L255 L261 Y262 | F143-M258 HydrophobicContact CD2-CE 4Å; F143-M258 WeakPolarHBondContact CD2-O 3.46Å; F143-M258 HydrophobicContact CE2-CB 4.25Å; F143-M258 HydrophobicContact CE2-CE 3.66Å; F143-M258 HydrophobicContact CZ-CE 4.17Å; A146-M258 HydrophobicContact CB-CE 3.85Å; A146-M258 HydrophobicContact CB-SD 3.65Å; L147-M258 HydrophobicContact CB-CE 3.96Å; L147-M258 HydrophobicContact CD1-CE 4.46Å; F150-M258 HydrophobicContact CD2-CE 4.42Å; F150-M258 HydrophobicContact CD2-SD 4.31Å; F150-M258 HydrophobicContact CE2-CG 4.29Å; F150-M258 HydrophobicContact CE2-SD 3.99Å; I198-M258 HydrophobicContact CG2-CG 4.04Å; F254-M258 HydrophobicContact CD1-CG 3.87Å; F254-M258 HydrophobicContact CD1-SD 4.29Å; F254-M258 HydrophobicContact CE1-CG 4.24Å; F254-M258 HydrophobicContact CE1-SD 4.13Å; F254-M258 PolarHBondContact O-N 2.92Å; L255-M258 HydrophobicContact CD1-CB 4.28Å; L255-M258 PolarHBondContact O-N 3.43Å; M258-L261 PolarHBondContact O-N 3.43Å; M258-Y262 PolarHBondContact O-N 3.32Å |
| 259 | H | 98.9 | Very high | 97.1 | Very high | 0 Ų | 0 | 28.1 Ų | 28.1 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -63.8 | -42.9 | 175 | -80.5 | 159 | 0 | 0 | 0 | 112.4 | L255 L257 L261 Y262 F263 T297 N324 Y327 | L255-H259 PolarHBondContact O-N 3.46Å; L257-H259 PolarHBondContact O-N 2.79Å; H259-L261 VanDerWaalsContact C-N 3.31Å; H259-L261 PolarHBondContact O-N 3.37Å; H259-Y262 WeakPolarHBondContact O-CB 3.33Å; H259-Y262 PolarHBondContact O-N 3.42Å; H259-F263 WeakPolarHBondContact O-CB 3.36Å; H259-F263 PolarHBondContact O-N 3.5Å; H259-T297 VanDerWaalsContact ND1-CG2 3.33Å; H259-T297 WeakPolarHBondContact ND1-CG2 3.34Å; H259-T297 PolarHBondContact ND1-OG1 3.28Å; H259-N324 PolarHBondContact CD2-OD1 2.99Å; H259-N324 VanDerWaalsContact CD2-OD1 3.22Å; H259-Y327 HydrophobicContact CB-CD1 3.78Å; H259-Y327 HydrophobicContact CB-CD2 3.69Å; H259-Y327 HydrophobicContact CB-CE1 3.8Å; H259-Y327 HydrophobicContact CB-CE2 3.67Å; H259-Y327 HydrophobicContact CB-CG 3.74Å; H259-Y327 AromaticContact CG-CD2 3.77Å; H259-Y327 AromaticContact CG-CG 3.65Å; H259-Y327 AromaticContact ND1-CD2 3.63Å; H259-Y327 AromaticContact ND1-CG 3.83Å; H259-Y327 WeakPolarHBondContact O-CE1 3.45Å |
| 260 | T | 98.8 | Very high | 97.1 | Very high | 4 Ų | 4 | 28.4 Ų | 28.4 | 3% | 0.025 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -63 | -41.7 | 176.8 | -52.5 | 0 | 0 | 0 | 0 | 110.6 | I217 G256 L257 F263 V264 F289 S293 | I217-T260 HydrophobicContact CD1-CG2 4.1Å; I217-T260 HydrophobicContact CG1-CG2 4.09Å; I217-T260 HydrophobicContact CG2-CG2 3.63Å; G256-T260 PolarHBondContact O-N 3.3Å; G256-T260 PolarHBondContact O-OG1 3.27Å; L257-T260 PolarHBondContact O-N 2.93Å; T260-F263 PolarHBondContact O-N 3.02Å; T260-V264 WeakPolarHBondContact O-CG1 3.31Å; T260-V264 WeakPolarHBondContact O-CG2 3.48Å; T260-V264 PolarHBondContact O-N 3.1Å; T260-V264 VanDerWaalsContact O-N 3.1Å; T260-F289 HydrophobicContact CG2-CE1 4.2Å; T260-S293 PolarHBondContact OG1-OG 3.28Å |
| 261 | L | 98.8 | Very high | 97.4 | Very high | 0 Ų | 0 | 20.9 Ų | 20.9 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -60.7 | -48.4 | 175.8 | -178.9 | 68.4 | 0 | 0 | 0 | 111.5 | I141 A146 V213 T216 I217 L257 M258 H259 F263 V264 M265 | I141-L261 HydrophobicContact CG2-CD1 4.19Å; I141-L261 HydrophobicContact CG2-CD2 4.14Å; A146-L261 HydrophobicContact CB-CD2 3.77Å; V213-L261 HydrophobicContact CG1-CB 4.34Å; V213-L261 HydrophobicContact CG1-CD2 4.25Å; V213-L261 HydrophobicContact CG2-CD2 4.11Å; T216-L261 HydrophobicContact CG2-CD1 3.5Å; I217-L261 HydrophobicContact CD1-CB 4.44Å; I217-L261 HydrophobicContact CG1-CB 4.33Å; I217-L261 HydrophobicContact CG1-CD1 4.45Å; L257-L261 VanDerWaalsContact O-CB 3.31Å; L257-L261 WeakPolarHBondContact O-CB 3.35Å; L257-L261 PolarHBondContact O-N 3.19Å; M258-L261 PolarHBondContact O-N 3.43Å; H259-L261 VanDerWaalsContact C-N 3.31Å; H259-L261 PolarHBondContact O-N 3.37Å; L261-F263 PolarHBondContact O-N 2.92Å; L261-V264 PolarHBondContact O-N 3.19Å; L261-M265 HydrophobicContact CD1-CG 3.59Å; L261-M265 HydrophobicContact CG-CG 4.14Å; L261-M265 VanDerWaalsContact O-CB 3.24Å; L261-M265 WeakPolarHBondContact O-CB 3.48Å; L261-M265 VanDerWaalsContact O-CG 3.31Å; L261-M265 WeakPolarHBondContact O-CG 3.36Å; L261-M265 PolarHBondContact O-N 3.35Å |
| 262 | Y | 98.8 | Very high | 97.8 | Very high | 41 Ų | 41 | 19.3 Ų | 19.3 | 16% | 0.161 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -51.1 | -49.1 | 174.7 | 175.3 | -95.7 | 0 | 0 | 0 | 110.9 | F143 M258 H259 V264 M265 D266 N324 V328 | F143-Y262 HydrophobicContact CD1-CD2 4.11Å; F143-Y262 HydrophobicContact CD2-CD2 4.22Å; F143-Y262 HydrophobicContact CD2-CG 4.42Å; F143-Y262 HydrophobicContact CE1-CD2 4.41Å; F143-Y262 HydrophobicContact CE2-CD2 4.49Å; F143-Y262 HydrophobicContact CG-CD2 4.02Å; M258-Y262 PolarHBondContact O-N 3.32Å; H259-Y262 WeakPolarHBondContact O-CB 3.33Å; H259-Y262 PolarHBondContact O-N 3.42Å; Y262-V264 PolarHBondContact O-N 3.48Å; Y262-M265 PolarHBondContact O-N 2.91Å; Y262-D266 WeakPolarHBondContact O-CB 3.36Å; Y262-D266 PolarHBondContact O-N 3.19Å; Y262-N324 HydrophobicContact CD1-CB 3.77Å; Y262-N324 HydrophobicContact CD2-CB 3.93Å; Y262-N324 VanDerWaalsContact CD2-ND2 3.26Å; Y262-N324 WeakPolarHBondContact CD2-ND2 3.23Å; Y262-N324 HydrophobicContact CE1-CB 3.71Å; Y262-N324 HydrophobicContact CE2-CB 3.84Å; Y262-N324 HydrophobicContact CG-CB 3.89Å; Y262-V328 HydrophobicContact CD1-CG2 3.93Å; Y262-V328 HydrophobicContact CE1-CG2 3.8Å |
| 263 | F | 98.7 | Very high | 97.8 | Very high | 0 Ų | 0 | 19.3 Ų | 19.3 | 0% | 0 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -69 | -30.8 | -174.1 | -174.1 | -153.1 | 0 | 0 | 0 | 114.6 | H259 T260 L261 T269 L270 L272 A273 I276 F289 Y327 V328 F331 | H259-F263 WeakPolarHBondContact O-CB 3.36Å; H259-F263 PolarHBondContact O-N 3.5Å; T260-F263 PolarHBondContact O-N 3.02Å; L261-F263 PolarHBondContact O-N 2.92Å; F263-T269 WeakPolarHBondContact CE2-O 3.39Å; F263-T269 PolarHBondContact O-OG1 2.86Å; F263-T269 VanDerWaalsContact O-OG1 3.13Å; F263-L270 PolarHBondContact O-N 3.49Å; F263-L272 HydrophobicContact CE2-CB 4.11Å; F263-L272 HydrophobicContact CE2-CD2 4.03Å; F263-L272 HydrophobicContact CE2-CG 4.08Å; F263-L272 HydrophobicContact CZ-CB 4.31Å; F263-L272 HydrophobicContact CZ-CD2 4.09Å; F263-L272 HydrophobicContact CZ-CG 3.91Å; F263-A273 HydrophobicContact CD1-CB 3.93Å; F263-A273 HydrophobicContact CD2-CB 4.04Å; F263-A273 HydrophobicContact CE1-CB 3.73Å; F263-A273 HydrophobicContact CE2-CB 3.83Å; F263-A273 HydrophobicContact CG-CB 4.09Å; F263-A273 VanDerWaalsContact CZ-CA 3.47Å; F263-A273 HydrophobicContact CZ-CB 3.68Å; F263-I276 HydrophobicContact CE1-CD1 4.01Å; F263-I276 HydrophobicContact CZ-CD1 3.77Å; F263-F289 HydrophobicContact CD1-CZ 4.23Å; F263-F289 HydrophobicContact CE1-CE2 4.4Å; F263-F289 HydrophobicContact CE1-CZ 4.16Å; F263-Y327 HydrophobicContact CB-CE1 3.88Å; F263-Y327 HydrophobicContact CD1-CE1 4.17Å; F263-Y327 HydrophobicContact CG-CE1 4.21Å; F263-V328 HydrophobicContact CB-CG2 4.3Å; F263-V328 HydrophobicContact CD2-CG1 3.99Å; F263-V328 HydrophobicContact CD2-CG2 3.83Å; F263-V328 HydrophobicContact CE2-CG1 3.78Å; F263-V328 HydrophobicContact CE2-CG2 4.42Å; F263-V328 HydrophobicContact CG-CG2 4.21Å; F263-F331 AromaticContact CD1-CD1 3.76Å; F263-F331 HydrophobicContact CD1-CD1 3.76Å; F263-F331 AromaticContact CD1-CE1 3.98Å; F263-F331 HydrophobicContact CD1-CE1 3.98Å; F263-F331 HydrophobicContact CE1-CB 4.47Å; F263-F331 AromaticContact CE1-CD1 3.46Å; F263-F331 HydrophobicContact CE1-CD1 3.46Å; F263-F331 VanDerWaalsContact CE1-CD1 3.46Å; F263-F331 AromaticContact CE1-CE1 3.77Å; F263-F331 HydrophobicContact CE1-CE1 3.77Å; F263-F331 HydrophobicContact CE1-CG 4Å; F263-F331 HydrophobicContact CZ-CD1 4.44Å |
| 264 | V | 98.4 | Very high | 97.8 | Very high | 0 Ų | 0 | 24.8 Ų | 24.8 | 0% | 0 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -96.4 | -13.2 | -179.2 | -55.9 | 0 | 0 | 0 | 0 | 113.2 | I217 R220 L221 T260 L261 Y262 L270 A273 | I217-V264 HydrophobicContact CG1-CG2 4.41Å; R220-V264 HydrophobicContact CB-CB 3.79Å; R220-V264 HydrophobicContact CB-CG2 3.75Å; R220-V264 HydrophobicContact CG-CG2 4.17Å; R220-V264 PolarHBondContact NE-O 3.35Å; R220-V264 PolarHBondContact NH2-O 2.97Å; L221-V264 HydrophobicContact CD2-CG1 3.7Å; L221-V264 HydrophobicContact CG-CG1 4.04Å; T260-V264 WeakPolarHBondContact O-CG1 3.31Å; T260-V264 WeakPolarHBondContact O-CG2 3.48Å; T260-V264 PolarHBondContact O-N 3.1Å; T260-V264 VanDerWaalsContact O-N 3.1Å; L261-V264 PolarHBondContact O-N 3.19Å; Y262-V264 PolarHBondContact O-N 3.48Å; V264-L270 WeakPolarHBondContact O-CD1 3.5Å; V264-A273 HydrophobicContact CG1-CB 4.13Å |
| 265 | M | 98.1 | Very high | 97.7 | Very high | 42 Ų | 42 | 27.6 Ų | 27.6 | 21% | 0.207 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -95.1 | -29 | 179.5 | -72.8 | -59.4 | -67.5 | 0 | 0 | 113.4 | L140 T216 R220 L261 Y262 P267 | L140-M265 HydrophobicContact CB-CE 4.19Å; T216-M265 HydrophobicContact CG2-CE 4.45Å; T216-M265 HydrophobicContact CG2-CG 4.06Å; T216-M265 HydrophobicContact CG2-SD 3.46Å; T216-M265 WeakPolarHBondContact CG2-SD 3.1Å; R220-M265 HydrophobicContact CG-SD 3.71Å; L261-M265 HydrophobicContact CD1-CG 3.59Å; L261-M265 HydrophobicContact CG-CG 4.14Å; L261-M265 VanDerWaalsContact O-CB 3.24Å; L261-M265 WeakPolarHBondContact O-CB 3.48Å; L261-M265 VanDerWaalsContact O-CG 3.31Å; L261-M265 WeakPolarHBondContact O-CG 3.36Å; L261-M265 PolarHBondContact O-N 3.35Å; Y262-M265 PolarHBondContact O-N 2.91Å; M265-P267 WeakPolarHBondContact O-CD 3.41Å |
| 266 | D | 95.5 | Very high | 97.7 | Very high | 37 Ų | 37 | 27.3 Ų | 27.3 | 20% | 0.198 | 14% | 0.139 | C | C | . | . | S | Bend | trans | -73.8 | 123.2 | 178.3 | 173.8 | 2.3 | 0 | 0 | 0 | 111.6 | Y262 E268 T269 L270 | Y262-D266 WeakPolarHBondContact O-CB 3.36Å; Y262-D266 PolarHBondContact O-N 3.19Å; D266-E268 PolarHBondContact O-N 3.43Å; D266-E268 PolarHBondContact OD1-N 2.89Å; D266-T269 WeakPolarHBondContact CB-OG1 3.39Å; D266-T269 PolarHBondContact O-N 3.09Å; D266-L270 WeakPolarHBondContact O-CB 3.44Å; D266-L270 PolarHBondContact O-N 3.5Å |
| 267 | P | 94.8 | Very high | 97.7 | Very high | 105 Ų | 105 | 29 Ų | 29 | 68% | 0.682 | 15% | 0.145 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -56.7 | -30.3 | 177.1 | -25.1 | 35 | 0 | 0 | 0 | 115.1 | M265 P271 | M265-P267 WeakPolarHBondContact O-CD 3.41Å; P267-P271 WeakPolarHBondContact O-CD 3.32Å |
| 268 | E | 95.3 | Very high | 97.6 | Very high | 100 Ų | 100 | 36.6 Ų | 36.6 | 47% | 0.467 | 18% | 0.178 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -74 | -36.9 | -179.7 | -61.8 | -165 | 157.4 | 0 | 0 | 111.7 | D266 L374 Q378 | D266-E268 PolarHBondContact O-N 3.43Å; D266-E268 PolarHBondContact OD1-N 2.89Å; E268-L374 WeakPolarHBondContact O-CD2 3.35Å; E268-Q378 PolarHBondContact OE1-NE2 2.87Å |
| 269 | T | 97.4 | Very high | 97.5 | Very high | 3 Ų | 3 | 37 Ų | 37 | 2% | 0.018 | 18% | 0.18 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -98.9 | -23.5 | -174.1 | 64.8 | 0 | 0 | 0 | 0 | 113.7 | F263 D266 P271 L272 A273 V328 L374 | F263-T269 WeakPolarHBondContact CE2-O 3.39Å; F263-T269 PolarHBondContact O-OG1 2.86Å; F263-T269 VanDerWaalsContact O-OG1 3.13Å; D266-T269 WeakPolarHBondContact CB-OG1 3.39Å; D266-T269 PolarHBondContact O-N 3.09Å; T269-P271 VanDerWaalsContact C-CD 3.49Å; T269-L272 WeakPolarHBondContact O-CA 3.47Å; T269-L272 VanDerWaalsContact O-CB 3.32Å; T269-L272 WeakPolarHBondContact O-CB 3.46Å; T269-L272 PolarHBondContact O-N 3.46Å; T269-A273 PolarHBondContact O-N 3.26Å; T269-V328 HydrophobicContact CG2-CG1 4.1Å; T269-L374 HydrophobicContact CG2-CD1 4.21Å; T269-L374 HydrophobicContact CG2-CD2 4.42Å |
| 270 | L | 96.5 | Very high | 97.3 | Very high | 13 Ų | 13 | 37.7 Ų | 37.7 | 7% | 0.068 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -51.2 | -43.8 | 176.8 | 168.9 | 71 | 0 | 0 | 0 | 113.7 | F263 V264 D266 L272 A273 R274 | F263-L270 PolarHBondContact O-N 3.49Å; V264-L270 WeakPolarHBondContact O-CD1 3.5Å; D266-L270 WeakPolarHBondContact O-CB 3.44Å; D266-L270 PolarHBondContact O-N 3.5Å; L270-L272 PolarHBondContact O-N 3.37Å; L270-A273 WeakPolarHBondContact O-CB 3.48Å; L270-A273 PolarHBondContact O-N 3.45Å; L270-A273 VanDerWaalsContact O-N 3.16Å; L270-R274 HydrophobicContact CD1-CG 4.11Å; L270-R274 HydrophobicContact CG-CG 4.5Å; L270-R274 WeakPolarHBondContact O-CG 3.4Å; L270-R274 PolarHBondContact O-N 3.23Å |
| 271 | P | 96.3 | Very high | 97.2 | Very high | 43 Ų | 43 | 42.7 Ų | 42.7 | 28% | 0.279 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -59 | -33.9 | 176.7 | -27.8 | 38.5 | 0 | 0 | 0 | 112.8 | P267 T269 D275 R377 | P267-P271 WeakPolarHBondContact O-CD 3.32Å; T269-P271 VanDerWaalsContact C-CD 3.49Å; P271-D275 PolarHBondContact O-N 3.27Å; P271-D275 VanDerWaalsContact O-N 3.11Å; P271-R377 VanDerWaalsContact C-NH1 3.29Å; P271-R377 PolarHBondContact O-NH2 3.18Å |
| 272 | L | 98.3 | Very high | 97.1 | Very high | 0 Ų | 0 | 45.8 Ų | 45.8 | 0% | 0 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -70.3 | -46.1 | 174.4 | 175.8 | 62.3 | 0 | 0 | 0 | 110.1 | F263 T269 L270 R274 D275 I276 V328 L332 Y335 F373 R377 | F263-L272 HydrophobicContact CE2-CB 4.11Å; F263-L272 HydrophobicContact CE2-CD2 4.03Å; F263-L272 HydrophobicContact CE2-CG 4.08Å; F263-L272 HydrophobicContact CZ-CB 4.31Å; F263-L272 HydrophobicContact CZ-CD2 4.09Å; F263-L272 HydrophobicContact CZ-CG 3.91Å; T269-L272 WeakPolarHBondContact O-CA 3.47Å; T269-L272 VanDerWaalsContact O-CB 3.32Å; T269-L272 WeakPolarHBondContact O-CB 3.46Å; T269-L272 PolarHBondContact O-N 3.46Å; L270-L272 PolarHBondContact O-N 3.37Å; L272-R274 PolarHBondContact O-N 3.27Å; L272-D275 PolarHBondContact O-N 3.38Å; L272-D275 VanDerWaalsContact O-N 3.07Å; L272-I276 HydrophobicContact CD1-CD1 4.16Å; L272-I276 HydrophobicContact CD1-CG1 4.17Å; L272-I276 HydrophobicContact CG-CD1 4.04Å; L272-I276 HydrophobicContact CG-CG1 4.43Å; L272-I276 VanDerWaalsContact O-CG1 3.3Å; L272-I276 WeakPolarHBondContact O-CG1 3.44Å; L272-I276 PolarHBondContact O-N 3.16Å; L272-V328 HydrophobicContact CD2-CG1 4.18Å; L272-L332 HydrophobicContact CD1-CD1 3.72Å; L272-L332 HydrophobicContact CD2-CB 3.95Å; L272-L332 HydrophobicContact CD2-CD1 3.88Å; L272-L332 HydrophobicContact CD2-CG 4.38Å; L272-L332 HydrophobicContact CG-CD1 4.47Å; L272-Y335 HydrophobicContact CD1-CD1 4.13Å; L272-Y335 HydrophobicContact CD1-CE1 4.36Å; L272-F373 HydrophobicContact CB-CE1 4.19Å; L272-F373 HydrophobicContact CD1-CE1 3.92Å; L272-F373 HydrophobicContact CD1-CZ 3.91Å; L272-F373 HydrophobicContact CD2-CE1 4.1Å; L272-F373 HydrophobicContact CG-CE1 4.28Å; L272-R377 VanDerWaalsContact CA-NH1 3.25Å |
| 273 | A | 98.3 | Very high | 96.8 | Very high | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -54.5 | -41.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | F263 V264 T269 L270 I276 Y277 F289 | F263-A273 HydrophobicContact CD1-CB 3.93Å; F263-A273 HydrophobicContact CD2-CB 4.04Å; F263-A273 HydrophobicContact CE1-CB 3.73Å; F263-A273 HydrophobicContact CE2-CB 3.83Å; F263-A273 HydrophobicContact CG-CB 4.09Å; F263-A273 VanDerWaalsContact CZ-CA 3.47Å; F263-A273 HydrophobicContact CZ-CB 3.68Å; V264-A273 HydrophobicContact CG1-CB 4.13Å; T269-A273 PolarHBondContact O-N 3.26Å; L270-A273 WeakPolarHBondContact O-CB 3.48Å; L270-A273 PolarHBondContact O-N 3.45Å; L270-A273 VanDerWaalsContact O-N 3.16Å; A273-I276 PolarHBondContact O-N 3.09Å; A273-Y277 WeakPolarHBondContact O-CB 3.49Å; A273-Y277 PolarHBondContact O-N 3.48Å; A273-F289 HydrophobicContact CB-CZ 4.44Å; A273-F289 WeakPolarHBondContact O-CE2 3.49Å |
| 274 | R | 97.1 | Very high | 96.6 | Very high | 122 Ų | 122 | 53.2 Ų | 53.2 | 46% | 0.46 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -66.4 | -39.6 | 175.8 | -73.5 | 178 | 173 | 159.3 | -1.3 | 113.5 | L270 L272 I276 Y277 K278 | L270-R274 HydrophobicContact CD1-CG 4.11Å; L270-R274 HydrophobicContact CG-CG 4.5Å; L270-R274 WeakPolarHBondContact O-CG 3.4Å; L270-R274 PolarHBondContact O-N 3.23Å; L272-R274 PolarHBondContact O-N 3.27Å; R274-I276 VanDerWaalsContact C-N 3.31Å; R274-I276 PolarHBondContact O-N 3.06Å; R274-Y277 PolarHBondContact O-N 3.28Å; R274-K278 WeakPolarHBondContact O-CB 3.48Å; R274-K278 PolarHBondContact O-N 3.35Å |
| 275 | D | 97.3 | Very high | 96.5 | Very high | 60 Ų | 60 | 53.4 Ų | 53.4 | 32% | 0.321 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -64.8 | -37.4 | 175.3 | -73.7 | -23.1 | 0 | 0 | 0 | 112.3 | P271 L272 L279 R377 | P271-D275 PolarHBondContact O-N 3.27Å; P271-D275 VanDerWaalsContact O-N 3.11Å; L272-D275 PolarHBondContact O-N 3.38Å; L272-D275 VanDerWaalsContact O-N 3.07Å; D275-L279 PolarHBondContact O-N 2.81Å; D275-R377 IonicContact OD1-NH2 3.66Å; D275-R377 IonicContact OD2-CZ 2.74Å; D275-R377 IonicContact OD2-NH1 2.65Å; D275-R377 IonicContact OD2-NH2 2.89Å; D275-R377 PolarHBondContact OD2-NH2 3.34Å |
| 276 | I | 98.3 | Very high | 96.2 | Very high | 0 Ų | 0 | 54.6 Ų | 54.6 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -69.9 | -43.6 | 175.4 | -58.9 | 177.2 | 0 | 0 | 0 | 109.8 | F263 L272 A273 R274 K278 L279 S280 F287 F289 F331 Y335 | F263-I276 HydrophobicContact CE1-CD1 4.01Å; F263-I276 HydrophobicContact CZ-CD1 3.77Å; L272-I276 HydrophobicContact CD1-CD1 4.16Å; L272-I276 HydrophobicContact CD1-CG1 4.17Å; L272-I276 HydrophobicContact CG-CD1 4.04Å; L272-I276 HydrophobicContact CG-CG1 4.43Å; L272-I276 VanDerWaalsContact O-CG1 3.3Å; L272-I276 WeakPolarHBondContact O-CG1 3.44Å; L272-I276 PolarHBondContact O-N 3.16Å; A273-I276 PolarHBondContact O-N 3.09Å; R274-I276 VanDerWaalsContact C-N 3.31Å; R274-I276 PolarHBondContact O-N 3.06Å; I276-K278 VanDerWaalsContact C-N 3.29Å; I276-K278 PolarHBondContact O-N 3.34Å; I276-L279 WeakPolarHBondContact O-CA 3.45Å; I276-L279 VanDerWaalsContact O-CB 3.25Å; I276-L279 WeakPolarHBondContact O-CB 3.4Å; I276-L279 PolarHBondContact O-N 3.23Å; I276-S280 PolarHBondContact O-N 3.47Å; I276-S280 VanDerWaalsContact O-N 3.1Å; I276-F287 HydrophobicContact CG2-CD1 3.72Å; I276-F287 HydrophobicContact CG2-CE1 3.41Å; I276-F287 VanDerWaalsContact CG2-CE1 3.41Å; I276-F287 HydrophobicContact CG2-CZ 4.08Å; I276-F289 HydrophobicContact CB-CD2 4.13Å; I276-F289 HydrophobicContact CB-CE2 3.98Å; I276-F289 HydrophobicContact CG2-CD2 3.66Å; I276-F289 HydrophobicContact CG2-CE2 3.9Å; I276-F331 HydrophobicContact CD1-CD2 3.74Å; I276-F331 HydrophobicContact CD1-CE2 4.08Å; I276-F331 HydrophobicContact CD1-CG 4.15Å; I276-F331 HydrophobicContact CG2-CD2 4.39Å; I276-F331 HydrophobicContact CG2-CE2 3.76Å; I276-F331 HydrophobicContact CG2-CZ 4.31Å; I276-Y335 HydrophobicContact CB-CD2 4.11Å; I276-Y335 HydrophobicContact CB-CE2 4.47Å; I276-Y335 HydrophobicContact CD1-CG 4.19Å; I276-Y335 HydrophobicContact CG1-CD1 4.17Å; I276-Y335 HydrophobicContact CG1-CD2 3.54Å; I276-Y335 HydrophobicContact CG1-CE2 4.06Å; I276-Y335 HydrophobicContact CG1-CG 3.57Å; I276-Y335 HydrophobicContact CG2-CD2 4.27Å |
| 277 | Y | 97.8 | Very high | 96.3 | Very high | 36 Ų | 36 | 52.9 Ų | 52.9 | 14% | 0.141 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -62.2 | -37 | 175 | -175 | -111.7 | 0 | 0 | 0 | 111.8 | L221 I222 N237 I238 A273 R274 L279 S280 Q281 F289 | L221-Y277 HydrophobicContact CD2-CG 4.49Å; I222-Y277 HydrophobicContact CG2-CE1 4Å; I222-Y277 VanDerWaalsContact CG2-OH 3.27Å; I222-Y277 WeakPolarHBondContact CG2-OH 3.47Å; N237-Y277 PolarHBondContact O-OH 2.93Å; I238-Y277 HydrophobicContact CB-CE2 4.35Å; I238-Y277 HydrophobicContact CG2-CE2 4.06Å; A273-Y277 WeakPolarHBondContact O-CB 3.49Å; A273-Y277 PolarHBondContact O-N 3.48Å; R274-Y277 PolarHBondContact O-N 3.28Å; Y277-L279 PolarHBondContact O-N 2.9Å; Y277-S280 WeakPolarHBondContact CD2-OG 3.29Å; Y277-S280 WeakPolarHBondContact O-CB 3.31Å; Y277-S280 PolarHBondContact O-N 3.11Å; Y277-S280 PolarHBondContact O-OG 2.94Å; Y277-Q281 PolarHBondContact O-N 3.24Å; Y277-Q281 PolarHBondContact OH-NE2 3.38Å; Y277-F289 HydrophobicContact CD2-CB 4.44Å; Y277-F289 HydrophobicContact CD2-CG 4.48Å |
| 278 | K | 96.6 | Very high | 96.3 | Very high | 161 Ų | 161 | 49.1 Ų | 49.1 | 70% | 0.7 | 25% | 0.249 | S | C | * | . | H | α-helix | trans | -61 | -34.3 | 171.9 | -172 | 176.3 | -179 | 177.4 | 0 | 112.3 | R274 I276 S280 Q281 | R274-K278 WeakPolarHBondContact O-CB 3.48Å; R274-K278 PolarHBondContact O-N 3.35Å; I276-K278 VanDerWaalsContact C-N 3.29Å; I276-K278 PolarHBondContact O-N 3.34Å; K278-S280 VanDerWaalsContact C-N 3.29Å; K278-Q281 PolarHBondContact O-N 3.2Å |
| 279 | L | 97.1 | Very high | 96.4 | Very high | 11 Ų | 11 | 44.4 Ų | 44.4 | 6% | 0.058 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -68.7 | -28.2 | 173.7 | -168 | 67.5 | 0 | 0 | 0 | 112.4 | D275 I276 Y277 Q281 H282 Q285 F287 Y335 W338 K339 | D275-L279 PolarHBondContact O-N 2.81Å; I276-L279 WeakPolarHBondContact O-CA 3.45Å; I276-L279 VanDerWaalsContact O-CB 3.25Å; I276-L279 WeakPolarHBondContact O-CB 3.4Å; I276-L279 PolarHBondContact O-N 3.23Å; Y277-L279 PolarHBondContact O-N 2.9Å; L279-Q281 PolarHBondContact O-N 2.7Å; L279-H282 HydrophobicContact CD1-CB 4.29Å; L279-H282 VanDerWaalsContact O-CB 3.23Å; L279-H282 WeakPolarHBondContact O-CB 3.43Å; L279-H282 PolarHBondContact O-N 2.91Å; L279-H282 VanDerWaalsContact O-N 3.14Å; L279-Q285 HydrophobicContact CD1-CB 4.47Å; L279-F287 HydrophobicContact CB-CB 4.22Å; L279-F287 HydrophobicContact CD2-CB 4.05Å; L279-F287 HydrophobicContact CD2-CD2 4.23Å; L279-F287 HydrophobicContact CD2-CG 4.26Å; L279-F287 HydrophobicContact CG-CB 3.9Å; L279-F287 PolarHBondContact O-N 3Å; L279-Y335 HydrophobicContact CB-CD2 4.48Å; L279-Y335 HydrophobicContact CB-CE2 3.99Å; L279-Y335 HydrophobicContact CD2-CD2 3.62Å; L279-Y335 HydrophobicContact CD2-CE2 3.69Å; L279-Y335 HydrophobicContact CG-CE2 4.39Å; L279-W338 HydrophobicContact CD2-CG 4.4Å; L279-K339 HydrophobicContact CD1-CG 4.46Å; L279-K339 HydrophobicContact CD2-CB 4.13Å |
| 280 | S | 96.1 | Very high | 96.5 | Very high | 14 Ų | 14 | 44.3 Ų | 44.3 | 10% | 0.098 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -63.5 | -30.6 | 174 | 82.3 | 0 | 0 | 0 | 0 | 112.5 | I276 Y277 K278 H282 F287 | I276-S280 PolarHBondContact O-N 3.47Å; I276-S280 VanDerWaalsContact O-N 3.1Å; Y277-S280 WeakPolarHBondContact CD2-OG 3.29Å; Y277-S280 WeakPolarHBondContact O-CB 3.31Å; Y277-S280 PolarHBondContact O-N 3.11Å; Y277-S280 PolarHBondContact O-OG 2.94Å; K278-S280 VanDerWaalsContact C-N 3.29Å; S280-H282 VanDerWaalsContact C-N 3.3Å; S280-F287 WeakPolarHBondContact CA-O 3.34Å; S280-F287 WeakPolarHBondContact CB-O 3.45Å |
| 281 | Q | 95.1 | Very high | 96.6 | Very high | 109 Ų | 109 | 45.2 Ų | 45.2 | 51% | 0.509 | 23% | 0.232 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -88.1 | 4.4 | 178.4 | -51.5 | -55.3 | -36.3 | 0 | 0 | 113 | Y277 K278 L279 | Y277-Q281 PolarHBondContact O-N 3.24Å; Y277-Q281 PolarHBondContact OH-NE2 3.38Å; K278-Q281 PolarHBondContact O-N 3.2Å; L279-Q281 PolarHBondContact O-N 2.7Å |
| 282 | H | 96.6 | Very high | 96.7 | Very high | 65 Ų | 65 | 43.3 Ų | 43.3 | 30% | 0.301 | 22% | 0.219 | S | C | . | . | trans | -73.2 | 127.4 | -179.7 | -171.8 | -73.6 | 0 | 0 | 0 | 110.4 | L279 S280 T284 Q285 N286 | L279-H282 HydrophobicContact CD1-CB 4.29Å; L279-H282 VanDerWaalsContact O-CB 3.23Å; L279-H282 WeakPolarHBondContact O-CB 3.43Å; L279-H282 PolarHBondContact O-N 2.91Å; L279-H282 VanDerWaalsContact O-N 3.14Å; S280-H282 VanDerWaalsContact C-N 3.3Å; H282-T284 PolarHBondContact CE1-OG1 3.18Å; H282-T284 PolarHBondContact ND1-N 3.07Å; H282-T284 PolarHBondContact ND1-OG1 2.86Å; H282-T284 VanDerWaalsContact ND1-OG1 3.1Å; H282-T284 PolarHBondContact O-N 2.63Å; H282-Q285 HydrophobicContact CB-CB 4.22Å; H282-Q285 PolarHBondContact ND1-N 3.27Å; H282-N286 PolarHBondContact O-N 3Å; H282-N286 PolarHBondContact O-OD1 2.91Å; H282-N286 VanDerWaalsContact O-OD1 3.09Å | ||
| 283 | P | 94.3 | Very high | 96.7 | Very high | 108 Ų | 108 | 43.3 Ų | 43.3 | 70% | 0.701 | 22% | 0.219 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -59.7 | -29.3 | -166.9 | 21.4 | -34.5 | 0 | 0 | 0 | 114.7 | N286 | P283-N286 PolarHBondContact O-ND2 3.04Š|
| 284 | T | 94.2 | Very high | 96.7 | Very high | 88 Ų | 88 | 43.9 Ų | 43.9 | 54% | 0.54 | 22% | 0.222 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -100.7 | -51 | 178.7 | 60.2 | 0 | 0 | 0 | 0 | 113.4 | H282 N286 | H282-T284 PolarHBondContact CE1-OG1 3.18Å; H282-T284 PolarHBondContact ND1-N 3.07Å; H282-T284 PolarHBondContact ND1-OG1 2.86Å; H282-T284 VanDerWaalsContact ND1-OG1 3.1Å; H282-T284 PolarHBondContact O-N 2.63Å; T284-N286 PolarHBondContact O-ND2 2.99Å |
| 285 | Q | 96.6 | Very high | 96.8 | Very high | 4 Ų | 4 | 40 Ų | 40 | 2% | 0.019 | 21% | 0.21 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -69.1 | -36.7 | -174.4 | -66.1 | -168.5 | 40.9 | 0 | 0 | 113.6 | L279 H282 F287 W338 Q342 K343 | L279-Q285 HydrophobicContact CD1-CB 4.47Å; H282-Q285 HydrophobicContact CB-CB 4.22Å; H282-Q285 PolarHBondContact ND1-N 3.27Å; Q285-F287 PolarHBondContact O-N 3.06Å; Q285-W338 WeakPolarHBondContact O-CZ2 3.46Å; Q285-W338 PolarHBondContact OE1-O 3.04Å; Q285-Q342 VanDerWaalsContact NE2-NE2 3.18Å; Q285-K343 WeakPolarHBondContact CB-O 3.46Å; Q285-K343 WeakPolarHBondContact CG-O 3.4Å |
| 286 | N | 91.9 | Very high | 96.8 | Very high | 67 Ų | 67 | 37.1 Ų | 37.1 | 36% | 0.358 | 20% | 0.195 | S | C | . | . | trans | 44.2 | 54.9 | 174.9 | -62.2 | -64.9 | 0 | 0 | 0 | 113.9 | H282 P283 T284 P288 I345 | H282-N286 PolarHBondContact O-N 3Å; H282-N286 PolarHBondContact O-OD1 2.91Å; H282-N286 VanDerWaalsContact O-OD1 3.09Å; P283-N286 PolarHBondContact O-ND2 3.04Å; T284-N286 PolarHBondContact O-ND2 2.99Å; N286-P288 WeakPolarHBondContact O-CD 3.34Å; N286-I345 HydrophobicContact CB-CD1 3.96Å; N286-I345 HydrophobicContact CB-CG1 4.42Å; N286-I345 WeakPolarHBondContact O-CD1 3.37Å; N286-I345 WeakPolarHBondContact O-CG1 3.26Å | ||
| 287 | F | 96.7 | Very high | 96.9 | Very high | 1 Ų | 1 | 37.1 Ų | 37.1 | 0% | 0.004 | 20% | 0.195 | C | C | . | . | trans | -61.9 | 117.8 | -176.7 | -179.2 | -88.1 | 0 | 0 | 0 | 112.1 | I276 L279 S280 Q285 F289 M292 F331 I334 W338 | I276-F287 HydrophobicContact CG2-CD1 3.72Å; I276-F287 HydrophobicContact CG2-CE1 3.41Å; I276-F287 VanDerWaalsContact CG2-CE1 3.41Å; I276-F287 HydrophobicContact CG2-CZ 4.08Å; L279-F287 HydrophobicContact CB-CB 4.22Å; L279-F287 HydrophobicContact CD2-CB 4.05Å; L279-F287 HydrophobicContact CD2-CD2 4.23Å; L279-F287 HydrophobicContact CD2-CG 4.26Å; L279-F287 HydrophobicContact CG-CB 3.9Å; L279-F287 PolarHBondContact O-N 3Å; S280-F287 WeakPolarHBondContact CA-O 3.34Å; S280-F287 WeakPolarHBondContact CB-O 3.45Å; Q285-F287 PolarHBondContact O-N 3.06Å; F287-F289 HydrophobicContact CD1-CB 4.49Å; F287-F289 PolarHBondContact O-N 3.18Å; F287-M292 HydrophobicContact CE1-CB 3.81Å; F287-M292 HydrophobicContact CE1-CG 3.98Å; F287-M292 HydrophobicContact CE2-CB 4.35Å; F287-M292 HydrophobicContact CE2-CG 3.93Å; F287-M292 HydrophobicContact CZ-CB 3.49Å; F287-M292 VanDerWaalsContact CZ-CB 3.49Å; F287-M292 HydrophobicContact CZ-CG 3.53Å; F287-F331 AromaticContact CE1-CE2 3.63Å; F287-F331 HydrophobicContact CE1-CE2 3.63Å; F287-F331 HydrophobicContact CE1-CZ 4.23Å; F287-F331 HydrophobicContact CZ-CD2 4.37Å; F287-F331 AromaticContact CZ-CE2 3.61Å; F287-F331 HydrophobicContact CZ-CE2 3.61Å; F287-I334 HydrophobicContact CE2-CG1 4.44Å; F287-I334 HydrophobicContact CZ-CG2 4.39Å; F287-W338 HydrophobicContact CD2-CB 4.23Å; F287-W338 AromaticContact CD2-CD1 3.99Å; F287-W338 AromaticContact CD2-CD2 3.52Å; F287-W338 HydrophobicContact CD2-CD2 3.52Å; F287-W338 AromaticContact CD2-CE2 3.8Å; F287-W338 AromaticContact CD2-CE3 3.9Å; F287-W338 HydrophobicContact CD2-CE3 3.9Å; F287-W338 AromaticContact CD2-CG 3.66Å; F287-W338 HydrophobicContact CD2-CG 3.66Å; F287-W338 HydrophobicContact CD2-CZ2 4.38Å; F287-W338 HydrophobicContact CD2-CZ3 4.49Å; F287-W338 HydrophobicContact CE2-CB 4.39Å; F287-W338 HydrophobicContact CE2-CD2 4.02Å; F287-W338 AromaticContact CE2-CE3 4Å; F287-W338 HydrophobicContact CE2-CE3 4Å; F287-W338 HydrophobicContact CE2-CG 4.2Å | ||
| 288 | P | 94.6 | Very high | 96.9 | Very high | 27 Ų | 27 | 40.8 Ų | 40.8 | 18% | 0.175 | 21% | 0.209 | C | C | . | . | trans | -82.7 | 89.9 | -173.7 | 29.8 | -29.9 | 0 | 0 | 0 | 111.7 | N286 C290 V291 M292 | N286-P288 WeakPolarHBondContact O-CD 3.34Å; P288-C290 PolarHBondContact O-N 3.23Å; P288-V291 HydrophobicContact CB-CB 4.3Å; P288-M292 HydrophobicContact CG-CE 3.67Å; P288-M292 HydrophobicContact CG-CG 3.92Å; P288-M292 WeakPolarHBondContact O-CB 3.43Å; P288-M292 VanDerWaalsContact O-CG 3.22Å; P288-M292 WeakPolarHBondContact O-CG 3.36Å; P288-M292 PolarHBondContact O-N 2.92Å | ||
| 289 | F | 98.4 | Very high | 97 | Very high | 0 Ų | 0 | 33.5 Ų | 33.5 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -52.9 | -61.3 | -167.1 | -175.1 | -79.1 | 0 | 0 | 0 | 114.5 | L221 T260 F263 A273 I276 Y277 F287 M292 S293 F331 | L221-F289 HydrophobicContact CD1-CD1 3.92Å; L221-F289 HydrophobicContact CD1-CE1 3.71Å; L221-F289 HydrophobicContact CD1-CZ 4.4Å; L221-F289 HydrophobicContact CD2-CD1 4.42Å; L221-F289 HydrophobicContact CD2-CE1 3.8Å; L221-F289 HydrophobicContact CD2-CE2 4.07Å; L221-F289 HydrophobicContact CD2-CZ 3.62Å; L221-F289 HydrophobicContact CG-CE1 4.41Å; T260-F289 HydrophobicContact CG2-CE1 4.2Å; F263-F289 HydrophobicContact CD1-CZ 4.23Å; F263-F289 HydrophobicContact CE1-CE2 4.4Å; F263-F289 HydrophobicContact CE1-CZ 4.16Å; A273-F289 HydrophobicContact CB-CZ 4.44Å; A273-F289 WeakPolarHBondContact O-CE2 3.49Å; I276-F289 HydrophobicContact CB-CD2 4.13Å; I276-F289 HydrophobicContact CB-CE2 3.98Å; I276-F289 HydrophobicContact CG2-CD2 3.66Å; I276-F289 HydrophobicContact CG2-CE2 3.9Å; Y277-F289 HydrophobicContact CD2-CB 4.44Å; Y277-F289 HydrophobicContact CD2-CG 4.48Å; F287-F289 HydrophobicContact CD1-CB 4.49Å; F287-F289 PolarHBondContact O-N 3.18Å; F289-M292 PolarHBondContact O-N 3.43Å; F289-S293 WeakPolarHBondContact O-CB 3.44Å; F289-S293 PolarHBondContact O-N 2.88Å; F289-F331 HydrophobicContact CD2-CZ 4.17Å; F289-F331 HydrophobicContact CE1-CE1 4.41Å; F289-F331 HydrophobicContact CE1-CZ 4.4Å; F289-F331 HydrophobicContact CE2-CE1 4.4Å; F289-F331 HydrophobicContact CE2-CZ 4.04Å; F289-F331 HydrophobicContact CG-CZ 4.4Å; F289-F331 HydrophobicContact CZ-CE1 4.12Å; F289-F331 HydrophobicContact CZ-CZ 4.14Å |
| 290 | C | 98.4 | Very high | 97.1 | Very high | 1 Ų | 1 | 33 Ų | 33 | 1% | 0.007 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -68 | -41.1 | -175.6 | -78.1 | 0 | 0 | 0 | 0 | 112.9 | I238 F240 P288 M292 S293 I294 | I238-C290 WeakPolarHBondContact O-CB 3.44Å; I238-C290 PolarHBondContact O-N 2.67Å; I238-C290 VanDerWaalsContact O-N 3.15Å; I238-C290 PolarHBondContact O-SG 3.17Å; F240-C290 HydrophobicContact CD1-CB 3.97Å; F240-C290 HydrophobicContact CD2-CB 3.86Å; F240-C290 HydrophobicContact CE1-CB 3.94Å; F240-C290 HydrophobicContact CE2-CB 3.83Å; F240-C290 WeakPolarHBondContact CE2-SG 3.25Å; F240-C290 HydrophobicContact CG-CB 3.93Å; F240-C290 HydrophobicContact CZ-CB 3.87Å; P288-C290 PolarHBondContact O-N 3.23Å; C290-M292 VanDerWaalsContact C-N 3.32Å; C290-M292 PolarHBondContact O-N 2.74Å; C290-S293 VanDerWaalsContact O-CB 3.29Å; C290-S293 WeakPolarHBondContact O-CB 3.29Å; C290-S293 PolarHBondContact O-N 3.06Å; C290-I294 WeakPolarHBondContact O-CG1 3.43Å; C290-I294 PolarHBondContact O-N 3.23Å |
| 291 | V | 98.1 | Very high | 97.2 | Very high | 32 Ų | 32 | 32.6 Ų | 32.6 | 19% | 0.194 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -58.8 | -42.2 | 173 | 163.3 | 0 | 0 | 0 | 0 | 111.7 | G239 Q241 P288 I294 N295 | G239-V291 VanDerWaalsContact O-CG2 3.23Å; G239-V291 WeakPolarHBondContact O-CG2 3.5Å; G239-V291 PolarHBondContact O-N 2.96Å; Q241-V291 HydrophobicContact CG-CG2 3.52Å; P288-V291 HydrophobicContact CB-CB 4.3Å; V291-I294 PolarHBondContact O-N 3.41Å; V291-N295 PolarHBondContact O-N 2.69Å; V291-N295 VanDerWaalsContact O-N 3.14Å; V291-N295 PolarHBondContact O-ND2 2.71Å |
| 292 | M | 98.3 | Very high | 97.4 | Very high | 3 Ų | 3 | 29.9 Ų | 29.9 | 2% | 0.015 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -67.9 | -40.3 | 176.2 | -69.9 | -65.8 | 168.4 | 0 | 0 | 111.7 | F287 P288 F289 C290 I294 N295 M296 F331 I334 W338 L352 | F287-M292 HydrophobicContact CE1-CB 3.81Å; F287-M292 HydrophobicContact CE1-CG 3.98Å; F287-M292 HydrophobicContact CE2-CB 4.35Å; F287-M292 HydrophobicContact CE2-CG 3.93Å; F287-M292 HydrophobicContact CZ-CB 3.49Å; F287-M292 VanDerWaalsContact CZ-CB 3.49Å; F287-M292 HydrophobicContact CZ-CG 3.53Å; P288-M292 HydrophobicContact CG-CE 3.67Å; P288-M292 HydrophobicContact CG-CG 3.92Å; P288-M292 WeakPolarHBondContact O-CB 3.43Å; P288-M292 VanDerWaalsContact O-CG 3.22Å; P288-M292 WeakPolarHBondContact O-CG 3.36Å; P288-M292 PolarHBondContact O-N 2.92Å; F289-M292 PolarHBondContact O-N 3.43Å; C290-M292 VanDerWaalsContact C-N 3.32Å; C290-M292 PolarHBondContact O-N 2.74Å; M292-I294 VanDerWaalsContact C-N 3.31Å; M292-I294 PolarHBondContact O-N 2.97Å; M292-N295 CarbonylContact O-C 3.59Å; M292-N295 WeakPolarHBondContact O-CA 3.49Å; M292-N295 WeakPolarHBondContact O-CB 3.44Å; M292-N295 PolarHBondContact O-N 2.72Å; M292-N295 VanDerWaalsContact O-N 3.07Å; M292-M296 WeakPolarHBondContact O-CG 3.41Å; M292-M296 PolarHBondContact O-N 3.41Å; M292-F331 HydrophobicContact CB-CE2 4.29Å; M292-F331 HydrophobicContact CB-CZ 4.5Å; M292-I334 HydrophobicContact SD-CD1 3.71Å; M292-W338 HydrophobicContact CE-CH2 3.95Å; M292-W338 HydrophobicContact CE-CZ3 3.54Å; M292-L352 HydrophobicContact SD-CD1 4.49Å; M292-L352 HydrophobicContact SD-CD2 3.94Å; M292-L352 HydrophobicContact SD-CG 4.31Å |
| 293 | S | 98.8 | Very high | 97.4 | Very high | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -53.5 | -46.8 | 172.7 | -179.3 | 0 | 0 | 0 | 0 | 112.3 | T260 F289 C290 N295 M296 T297 Y327 | T260-S293 PolarHBondContact OG1-OG 3.28Å; F289-S293 WeakPolarHBondContact O-CB 3.44Å; F289-S293 PolarHBondContact O-N 2.88Å; C290-S293 VanDerWaalsContact O-CB 3.29Å; C290-S293 WeakPolarHBondContact O-CB 3.29Å; C290-S293 PolarHBondContact O-N 3.06Å; S293-N295 VanDerWaalsContact C-N 3.31Å; S293-N295 PolarHBondContact O-N 2.99Å; S293-M296 PolarHBondContact O-N 3.08Å; S293-T297 PolarHBondContact O-N 3.11Å; S293-T297 PolarHBondContact O-OG1 2.85Å; S293-Y327 WeakPolarHBondContact O-CE2 3.48Å; S293-Y327 PolarHBondContact OG-OH 3.06Å |
| 294 | I | 98.7 | Very high | 97.6 | Very high | 12 Ų | 12 | 21.9 Ų | 21.9 | 6% | 0.062 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -61.2 | -42.2 | 177.1 | -67.8 | 167.3 | 0 | 0 | 0 | 110.4 | F240 D248 L249 T252 C290 V291 M292 T297 R298 | F240-I294 HydrophobicContact CD1-CD1 4.4Å; F240-I294 HydrophobicContact CE1-CD1 4.11Å; D248-I294 HydrophobicContact CB-CD1 3.64Å; L249-I294 HydrophobicContact CD2-CD1 3.88Å; L249-I294 HydrophobicContact CD2-CG1 3.93Å; T252-I294 HydrophobicContact CG2-CG2 4.01Å; T252-I294 WeakPolarHBondContact CG2-O 3.48Å; C290-I294 WeakPolarHBondContact O-CG1 3.43Å; C290-I294 PolarHBondContact O-N 3.23Å; V291-I294 PolarHBondContact O-N 3.41Å; M292-I294 VanDerWaalsContact C-N 3.31Å; M292-I294 PolarHBondContact O-N 2.97Å; I294-T297 WeakPolarHBondContact O-CB 3.38Å; I294-T297 PolarHBondContact O-N 3.37Å; I294-R298 PolarHBondContact O-N 3.38Å |
| 295 | N | 98.6 | Very high | 97.8 | Very high | 40 Ų | 40 | 21.3 Ų | 21.3 | 21% | 0.214 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -64.9 | -39.8 | 175.5 | -77.1 | -72.9 | 0 | 0 | 0 | 112.8 | V291 M292 S293 T297 R298 I299 L352 | V291-N295 PolarHBondContact O-N 2.69Å; V291-N295 VanDerWaalsContact O-N 3.14Å; V291-N295 PolarHBondContact O-ND2 2.71Å; M292-N295 CarbonylContact O-C 3.59Å; M292-N295 WeakPolarHBondContact O-CA 3.49Å; M292-N295 WeakPolarHBondContact O-CB 3.44Å; M292-N295 PolarHBondContact O-N 2.72Å; M292-N295 VanDerWaalsContact O-N 3.07Å; S293-N295 VanDerWaalsContact C-N 3.31Å; S293-N295 PolarHBondContact O-N 2.99Å; N295-T297 VanDerWaalsContact C-N 3.28Å; N295-T297 PolarHBondContact O-N 3.19Å; N295-R298 WeakPolarHBondContact O-CB 3.41Å; N295-R298 PolarHBondContact O-N 3.4Å; N295-R298 VanDerWaalsContact O-N 3.15Å; N295-I299 WeakPolarHBondContact O-CG1 3.4Å; N295-I299 PolarHBondContact O-N 2.6Å; N295-L352 HydrophobicContact CB-CD1 4.33Å; N295-L352 HydrophobicContact CB-CD2 3.59Å |
| 296 | M | 98.8 | Very high | 97.7 | Very high | 0 Ų | 0 | 23.3 Ų | 23.3 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -63 | -38 | 175.5 | -61.5 | -52.2 | 91 | 0 | 0 | 111.1 | M292 S293 I299 A300 Y327 T330 F331 I334 L352 V355 | M292-M296 WeakPolarHBondContact O-CG 3.41Å; M292-M296 PolarHBondContact O-N 3.41Å; S293-M296 PolarHBondContact O-N 3.08Å; M296-I299 HydrophobicContact CE-CD1 3.72Å; M296-I299 PolarHBondContact O-N 2.96Å; M296-I299 HydrophobicContact SD-CD1 4.48Å; M296-A300 WeakPolarHBondContact O-CB 3.44Å; M296-A300 PolarHBondContact O-N 3.35Å; M296-Y327 HydrophobicContact CB-CD2 3.75Å; M296-Y327 HydrophobicContact CB-CE2 3.79Å; M296-T330 HydrophobicContact SD-CG2 3.38Å; M296-T330 WeakPolarHBondContact SD-CG2 3.47Å; M296-F331 HydrophobicContact CG-CB 4.14Å; M296-F331 HydrophobicContact CG-CD1 4.38Å; M296-F331 HydrophobicContact CG-CD2 4.27Å; M296-F331 HydrophobicContact CG-CG 4.01Å; M296-I334 HydrophobicContact CE-CD1 3.83Å; M296-I334 HydrophobicContact CE-CG2 4.39Å; M296-I334 HydrophobicContact CG-CG2 4.47Å; M296-I334 HydrophobicContact SD-CB 4.25Å; M296-I334 HydrophobicContact SD-CG2 3.73Å; M296-L352 HydrophobicContact CE-CD2 3.58Å; M296-V355 HydrophobicContact CE-CG1 4.39Å; M296-V355 HydrophobicContact SD-CG1 4.26Å |
| 297 | T | 98.9 | Very high | 97.9 | Very high | 0 Ų | 0 | 21.2 Ų | 21.2 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -62.7 | -42.4 | 173.2 | -62.7 | 0 | 0 | 0 | 0 | 111.7 | T252 L255 H259 S293 I294 N295 I299 A300 L301 | T252-T297 HydrophobicContact CG2-CG2 3.76Å; L255-T297 HydrophobicContact CB-CG2 4.39Å; L255-T297 HydrophobicContact CD2-CG2 4.05Å; L255-T297 HydrophobicContact CG-CG2 4.01Å; H259-T297 VanDerWaalsContact ND1-CG2 3.33Å; H259-T297 WeakPolarHBondContact ND1-CG2 3.34Å; H259-T297 PolarHBondContact ND1-OG1 3.28Å; S293-T297 PolarHBondContact O-N 3.11Å; S293-T297 PolarHBondContact O-OG1 2.85Å; I294-T297 WeakPolarHBondContact O-CB 3.38Å; I294-T297 PolarHBondContact O-N 3.37Å; N295-T297 VanDerWaalsContact C-N 3.28Å; N295-T297 PolarHBondContact O-N 3.19Å; T297-I299 PolarHBondContact O-N 2.97Å; T297-A300 PolarHBondContact O-N 3.15Å; T297-L301 HydrophobicContact CG2-CD1 4.36Å; T297-L301 WeakPolarHBondContact O-CG 3.14Å; T297-L301 PolarHBondContact O-N 2.67Å |
| 298 | R | 98.6 | Very high | 97.9 | Very high | 114 Ų | 114 | 22.5 Ų | 22.5 | 43% | 0.43 | 11% | 0.109 | S | C | . | . | H | α-helix | trans | -60.3 | -45.4 | 175.5 | -176.4 | -174.3 | -61.4 | -81.1 | 3 | 111.7 | T252 I294 N295 L301 Q302 | T252-R298 HydrophobicContact CG2-CB 4.05Å; I294-R298 PolarHBondContact O-N 3.38Å; N295-R298 WeakPolarHBondContact O-CB 3.41Å; N295-R298 PolarHBondContact O-N 3.4Å; N295-R298 VanDerWaalsContact O-N 3.15Å; R298-L301 PolarHBondContact O-N 3.15Å; R298-Q302 WeakPolarHBondContact O-CB 3.3Å; R298-Q302 PolarHBondContact O-N 3.49Å |
| 299 | I | 98.8 | Very high | 98.1 | Very high | 7 Ų | 7 | 21.3 Ų | 21.3 | 4% | 0.036 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -61 | -47.2 | 176.2 | -65.4 | 171.3 | 0 | 0 | 0 | 109.9 | N295 M296 T297 L301 Q302 V303 T330 V355 E356 A359 | N295-I299 WeakPolarHBondContact O-CG1 3.4Å; N295-I299 PolarHBondContact O-N 2.6Å; M296-I299 HydrophobicContact CE-CD1 3.72Å; M296-I299 PolarHBondContact O-N 2.96Å; M296-I299 HydrophobicContact SD-CD1 4.48Å; T297-I299 PolarHBondContact O-N 2.97Å; I299-L301 PolarHBondContact O-N 3.26Å; I299-Q302 PolarHBondContact O-N 2.98Å; I299-Q302 VanDerWaalsContact O-N 3.1Å; I299-V303 HydrophobicContact CG2-CG2 4.2Å; I299-V303 VanDerWaalsContact O-CG2 3.3Å; I299-V303 WeakPolarHBondContact O-CG2 3.37Å; I299-V303 PolarHBondContact O-N 3.45Å; I299-T330 HydrophobicContact CD1-CG2 4.31Å; I299-T330 HydrophobicContact CG2-CG2 4.17Å; I299-V355 HydrophobicContact CD1-CG1 4.1Å; I299-E356 HydrophobicContact CD1-CB 3.97Å; I299-E356 HydrophobicContact CG1-CB 4.09Å; I299-E356 HydrophobicContact CG1-CG 4.14Å; I299-A359 HydrophobicContact CG2-CB 3.89Å |
| 300 | A | 98.8 | Very high | 98.1 | Very high | 0 Ų | 0 | 21.5 Ų | 21.5 | 0% | 0 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -57.8 | -46.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | M296 T297 Q302 V303 L304 L323 F326 | M296-A300 WeakPolarHBondContact O-CB 3.44Å; M296-A300 PolarHBondContact O-N 3.35Å; T297-A300 PolarHBondContact O-N 3.15Å; A300-Q302 VanDerWaalsContact C-N 3.28Å; A300-Q302 PolarHBondContact O-N 3.07Å; A300-V303 PolarHBondContact O-N 2.85Å; A300-L304 WeakPolarHBondContact O-CB 3.28Å; A300-L304 PolarHBondContact O-N 2.96Å; A300-L323 HydrophobicContact CB-CD1 3.82Å; A300-L323 HydrophobicContact CB-CG 4.4Å; A300-F326 HydrophobicContact CB-CD1 3.95Å; A300-F326 HydrophobicContact CB-CE1 4.4Å |
| 301 | L | 98.5 | Very high | 98 | Very high | 7 Ų | 7 | 28.6 Ų | 28.6 | 4% | 0.037 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -58.3 | -40.6 | 174.4 | -80 | 172.8 | 0 | 0 | 0 | 112.2 | V195 F196 A199 L255 T297 R298 I299 R305 | V195-L301 HydrophobicContact CG1-CD2 4Å; F196-L301 HydrophobicContact CD1-CD2 3.86Å; F196-L301 HydrophobicContact CE1-CD2 3.72Å; F196-L301 HydrophobicContact CZ-CD2 4.41Å; A199-L301 HydrophobicContact CB-CD1 3.78Å; A199-L301 HydrophobicContact CB-CD2 4.05Å; L255-L301 HydrophobicContact CD2-CD1 4.06Å; L255-L301 HydrophobicContact CD2-CD2 3.51Å; L255-L301 HydrophobicContact CD2-CG 3.79Å; T297-L301 HydrophobicContact CG2-CD1 4.36Å; T297-L301 WeakPolarHBondContact O-CG 3.14Å; T297-L301 PolarHBondContact O-N 2.67Å; R298-L301 PolarHBondContact O-N 3.15Å; I299-L301 PolarHBondContact O-N 3.26Å; L301-R305 VanDerWaalsContact O-CB 3.31Å; L301-R305 WeakPolarHBondContact O-CB 3.49Å; L301-R305 PolarHBondContact O-N 3.17Å |
| 302 | Q | 98 | Very high | 98 | Very high | 52 Ų | 52 | 28.3 Ų | 28.3 | 24% | 0.243 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -69.9 | -43.3 | -179.8 | -173.8 | 164.3 | 9.6 | 0 | 0 | 112.3 | R298 I299 A300 L304 R305 E306 E356 K360 | R298-Q302 WeakPolarHBondContact O-CB 3.3Å; R298-Q302 PolarHBondContact O-N 3.49Å; I299-Q302 PolarHBondContact O-N 2.98Å; I299-Q302 VanDerWaalsContact O-N 3.1Å; A300-Q302 VanDerWaalsContact C-N 3.28Å; A300-Q302 PolarHBondContact O-N 3.07Å; Q302-L304 VanDerWaalsContact C-N 3.29Å; Q302-L304 PolarHBondContact O-N 2.83Å; Q302-R305 PolarHBondContact O-N 3.02Å; Q302-E306 HydrophobicContact CG-CG 4.5Å; Q302-E306 VanDerWaalsContact CG-OE1 3.27Å; Q302-E306 WeakPolarHBondContact CG-OE1 3.3Å; Q302-E306 PolarHBondContact NE2-OE1 3.24Å; Q302-E306 WeakPolarHBondContact O-CB 3.27Å; Q302-E306 WeakPolarHBondContact O-CG 3.45Å; Q302-E306 PolarHBondContact O-N 2.83Å; Q302-E356 PolarHBondContact OE1-OE1 2.98Å; Q302-K360 VanDerWaalsContact CD-CE 3.41Å |
| 303 | V | 98.2 | Very high | 98 | Very high | 0 Ų | 0 | 28.2 Ų | 28.2 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -62.4 | -38.8 | 176.1 | 176.8 | 0 | 0 | 0 | 0 | 110.8 | I299 A300 E306 E307 A308 L309 F326 K360 P363 | I299-V303 HydrophobicContact CG2-CG2 4.2Å; I299-V303 VanDerWaalsContact O-CG2 3.3Å; I299-V303 WeakPolarHBondContact O-CG2 3.37Å; I299-V303 PolarHBondContact O-N 3.45Å; A300-V303 PolarHBondContact O-N 2.85Å; V303-E306 PolarHBondContact O-N 3.01Å; V303-E307 PolarHBondContact O-N 3.43Å; V303-A308 HydrophobicContact CG1-CB 3.76Å; V303-A308 PolarHBondContact O-N 3.22Å; V303-A308 VanDerWaalsContact O-N 3.09Å; V303-L309 HydrophobicContact CG1-CD1 4.11Å; V303-L309 HydrophobicContact CG1-CD2 4.47Å; V303-L309 HydrophobicContact CG1-CG 3.8Å; V303-F326 HydrophobicContact CB-CE1 3.8Å; V303-F326 HydrophobicContact CB-CZ 4.1Å; V303-F326 HydrophobicContact CG1-CE1 3.91Å; V303-F326 HydrophobicContact CG1-CZ 3.81Å; V303-F326 HydrophobicContact CG2-CE1 3.75Å; V303-F326 HydrophobicContact CG2-CZ 3.83Å; V303-K360 HydrophobicContact CG2-CG 3.73Å; V303-P363 HydrophobicContact CG1-CB 4.28Å |
| 304 | L | 98.2 | Very high | 98 | Very high | 5 Ų | 5 | 29.1 Ų | 29.1 | 3% | 0.026 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -65 | -44.7 | 173.1 | -176.3 | 61.5 | 0 | 0 | 0 | 111.8 | R192 V195 F196 A300 Q302 E306 E307 L309 V319 L323 | R192-L304 HydrophobicContact CG-CD2 4.28Å; V195-L304 HydrophobicContact CG1-CD2 4.13Å; F196-L304 HydrophobicContact CE2-CD2 3.87Å; F196-L304 HydrophobicContact CE2-CG 4.13Å; F196-L304 HydrophobicContact CZ-CB 4.46Å; F196-L304 HydrophobicContact CZ-CD2 4.18Å; F196-L304 HydrophobicContact CZ-CG 4.24Å; A300-L304 WeakPolarHBondContact O-CB 3.28Å; A300-L304 PolarHBondContact O-N 2.96Å; Q302-L304 VanDerWaalsContact C-N 3.29Å; Q302-L304 PolarHBondContact O-N 2.83Å; L304-E306 VanDerWaalsContact C-N 3.27Å; L304-E306 PolarHBondContact O-N 3.34Å; L304-E307 WeakPolarHBondContact O-CA 3.22Å; L304-E307 PolarHBondContact O-N 3.49Å; L304-L309 HydrophobicContact CD1-CB 4.48Å; L304-V319 HydrophobicContact CD1-CG1 4.1Å; L304-V319 HydrophobicContact CD2-CG1 4.06Å; L304-L323 HydrophobicContact CB-CD1 4.08Å; L304-L323 HydrophobicContact CD2-CD1 4.18Å; L304-L323 HydrophobicContact CD2-CD2 4.1Å |
| 305 | R | 97.1 | Very high | 98 | Very high | 75 Ų | 75 | 36.1 Ų | 36.1 | 28% | 0.283 | 16% | 0.159 | S | C | . | . | H | α-helix | trans | -63.8 | -32.8 | 178.1 | -167.6 | -176.3 | -69.9 | 115.9 | -0.8 | 113 | Q163 P164 T165 I166 F196 L301 Q302 E307 | Q163-R305 PolarHBondContact O-NE 3.32Å; P164-R305 WeakPolarHBondContact O-CA 3.44Å; T165-R305 WeakPolarHBondContact CA-O 3.43Å; I166-R305 HydrophobicContact CG1-CG 3.85Å; I166-R305 PolarHBondContact N-O 3.06Å; F196-R305 HydrophobicContact CE1-CB 4.39Å; F196-R305 HydrophobicContact CZ-CB 4Å; L301-R305 VanDerWaalsContact O-CB 3.31Å; L301-R305 WeakPolarHBondContact O-CB 3.49Å; L301-R305 PolarHBondContact O-N 3.17Å; Q302-R305 PolarHBondContact O-N 3.02Å; R305-E307 PolarHBondContact O-N 2.99Å |
| 306 | E | 95.9 | Very high | 98 | Very high | 46 Ų | 46 | 37 Ų | 37 | 22% | 0.215 | 16% | 0.159 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -77.3 | -0.5 | 173.9 | -73.7 | 174.4 | -160.1 | 0 | 0 | 112.8 | I166 R168 Q302 V303 L304 A308 K360 | I166-E306 HydrophobicContact CD1-CG 3.43Å; I166-E306 VanDerWaalsContact CD1-CG 3.43Å; I166-E306 HydrophobicContact CG1-CG 4.33Å; R168-E306 PolarHBondContact NH2-O 3.48Å; Q302-E306 HydrophobicContact CG-CG 4.5Å; Q302-E306 VanDerWaalsContact CG-OE1 3.27Å; Q302-E306 WeakPolarHBondContact CG-OE1 3.3Å; Q302-E306 PolarHBondContact NE2-OE1 3.24Å; Q302-E306 WeakPolarHBondContact O-CB 3.27Å; Q302-E306 WeakPolarHBondContact O-CG 3.45Å; Q302-E306 PolarHBondContact O-N 2.83Å; V303-E306 PolarHBondContact O-N 3.01Å; L304-E306 VanDerWaalsContact C-N 3.27Å; L304-E306 PolarHBondContact O-N 3.34Å; E306-A308 PolarHBondContact O-N 3.4Å; E306-K360 WeakPolarHBondContact OE1-CE 3.4Å; E306-K360 IonicContact OE1-NZ 3.57Å; E306-K360 PolarHBondContact OE1-NZ 3.08Å; E306-K360 VanDerWaalsContact OE1-NZ 3.15Å; E306-K360 WeakPolarHBondContact OE2-CD 3.5Å; E306-K360 WeakPolarHBondContact OE2-CE 3.16Å |
| 307 | E | 96.5 | Very high | 97.9 | Very high | 24 Ų | 24 | 41.7 Ų | 41.7 | 11% | 0.112 | 18% | 0.181 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 65.4 | 12.6 | 179.7 | -57.6 | 171.9 | 91.7 | 0 | 0 | 113.6 | T165 R168 H176 P181 V303 L304 R305 L309 S310 | T165-E307 HydrophobicContact CG2-CG 4.17Å; R168-E307 IonicContact CZ-OE2 3.15Å; R168-E307 IonicContact NH1-OE2 3.84Å; R168-E307 PolarHBondContact NH1-OE2 3.13Å; R168-E307 IonicContact NH2-OE2 2.69Å; H176-E307 IonicContact CE1-OE2 2.67Å; H176-E307 PolarHBondContact CE1-OE2 3.33Å; H176-E307 VanDerWaalsContact CE1-OE2 3.3Å; H176-E307 IonicContact NE2-OE2 2.71Å; P181-E307 VanDerWaalsContact CB-O 3.24Å; P181-E307 WeakPolarHBondContact CB-O 3.14Å; P181-E307 HydrophobicContact CG-CB 3.79Å; P181-E307 WeakPolarHBondContact CG-O 3.49Å; V303-E307 PolarHBondContact O-N 3.43Å; L304-E307 WeakPolarHBondContact O-CA 3.22Å; L304-E307 PolarHBondContact O-N 3.49Å; R305-E307 PolarHBondContact O-N 2.99Å; E307-L309 PolarHBondContact O-N 2.94Å; E307-S310 WeakPolarHBondContact CB-OG 3.34Å; E307-S310 VanDerWaalsContact O-CB 3.28Å; E307-S310 WeakPolarHBondContact O-CB 3.44Å; E307-S310 PolarHBondContact O-N 3.24Å; E307-S310 VanDerWaalsContact O-N 3.09Å; E307-S310 PolarHBondContact O-OG 2.97Å; E307-S310 VanDerWaalsContact O-OG 3.06Å |
| 308 | A | 96.4 | Very high | 97.9 | Very high | 28 Ų | 28 | 45.4 Ų | 45.4 | 23% | 0.231 | 20% | 0.199 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -70.5 | -19 | -175.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | V303 E306 P363 | V303-A308 HydrophobicContact CG1-CB 3.76Å; V303-A308 PolarHBondContact O-N 3.22Å; V303-A308 VanDerWaalsContact O-N 3.09Å; E306-A308 PolarHBondContact O-N 3.4Å; A308-P363 HydrophobicContact CB-CG 4.28Å |
| 309 | L | 97.9 | Very high | 97.9 | Very high | 2 Ų | 2 | 40 Ų | 40 | 1% | 0.01 | 18% | 0.178 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -91.1 | -12.1 | 172.4 | -71.1 | 169.2 | 0 | 0 | 0 | 113.8 | V303 L304 E307 K311 E312 C313 V322 L323 F326 P363 L367 | V303-L309 HydrophobicContact CG1-CD1 4.11Å; V303-L309 HydrophobicContact CG1-CD2 4.47Å; V303-L309 HydrophobicContact CG1-CG 3.8Å; L304-L309 HydrophobicContact CD1-CB 4.48Å; E307-L309 PolarHBondContact O-N 2.94Å; L309-K311 VanDerWaalsContact C-N 3.26Å; L309-K311 PolarHBondContact O-N 3.19Å; L309-K311 VanDerWaalsContact O-N 3.11Å; L309-E312 WeakPolarHBondContact O-CA 3.41Å; L309-E312 PolarHBondContact O-N 3Å; L309-C313 PolarHBondContact O-N 2.95Å; L309-C313 PolarHBondContact O-SG 3.37Å; L309-C313 VanDerWaalsContact O-SG 3.37Å; L309-V322 HydrophobicContact CB-CG1 4.48Å; L309-V322 HydrophobicContact CD2-CG1 4.09Å; L309-L323 HydrophobicContact CD1-CD1 3.9Å; L309-F326 HydrophobicContact CD1-CB 4.21Å; L309-F326 HydrophobicContact CD1-CD1 4.01Å; L309-F326 HydrophobicContact CD1-CG 4.02Å; L309-F326 HydrophobicContact CD2-CB 4.31Å; L309-F326 HydrophobicContact CD2-CD2 3.88Å; L309-F326 HydrophobicContact CD2-CE2 4.39Å; L309-F326 HydrophobicContact CD2-CG 4.01Å; L309-P363 HydrophobicContact CD2-CB 3.95Å; L309-L367 HydrophobicContact CD2-CD1 4.45Å |
| 310 | S | 97.8 | Very high | 97.9 | Very high | 4 Ų | 4 | 40.1 Ų | 40.1 | 3% | 0.028 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -54.5 | -39.8 | -170.6 | -63.8 | 0 | 0 | 0 | 0 | 113.5 | P182 E307 E312 C313 N314 | P182-S310 WeakPolarHBondContact O-CB 3.36Å; E307-S310 WeakPolarHBondContact CB-OG 3.34Å; E307-S310 VanDerWaalsContact O-CB 3.28Å; E307-S310 WeakPolarHBondContact O-CB 3.44Å; E307-S310 PolarHBondContact O-N 3.24Å; E307-S310 VanDerWaalsContact O-N 3.09Å; E307-S310 PolarHBondContact O-OG 2.97Å; E307-S310 VanDerWaalsContact O-OG 3.06Å; S310-E312 VanDerWaalsContact C-N 3.3Å; S310-E312 PolarHBondContact O-N 2.98Å; S310-C313 PolarHBondContact O-N 2.91Å; S310-N314 WeakPolarHBondContact O-CB 3.44Å; S310-N314 PolarHBondContact O-N 3.26Å; S310-N314 PolarHBondContact O-ND2 3.14Å; S310-N314 PolarHBondContact O-OD1 2.93Å |
| 311 | K | 97.6 | Very high | 97.9 | Very high | 149 Ų | 149 | 40.7 Ų | 40.7 | 65% | 0.648 | 19% | 0.186 | S | C | * | . | H | α-helix | trans | -59.3 | -42 | 176.7 | -175.2 | 172.2 | -178.2 | 167.8 | 0 | 112.4 | P182 L309 R315 | P182-K311 HydrophobicContact CG-CB 3.66Å; P182-K311 HydrophobicContact CG-CG 4.24Å; L309-K311 VanDerWaalsContact C-N 3.26Å; L309-K311 PolarHBondContact O-N 3.19Å; L309-K311 VanDerWaalsContact O-N 3.11Å; K311-R315 WeakPolarHBondContact O-CB 3.42Å; K311-R315 PolarHBondContact O-N 3.35Å; K311-R315 VanDerWaalsContact O-N 3.11Å |
| 312 | E | 98.2 | Very high | 97.9 | Very high | 26 Ų | 26 | 40.4 Ų | 40.4 | 12% | 0.121 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -77.1 | -39.7 | -178.7 | -172.5 | 68.2 | 178.5 | 0 | 0 | 111.4 | L309 S310 N314 R315 R316 V322 L367 | L309-E312 WeakPolarHBondContact O-CA 3.41Å; L309-E312 PolarHBondContact O-N 3Å; S310-E312 VanDerWaalsContact C-N 3.3Å; S310-E312 PolarHBondContact O-N 2.98Å; E312-N314 PolarHBondContact O-N 3.27Å; E312-R315 WeakPolarHBondContact O-CB 3.5Å; E312-R315 PolarHBondContact O-N 3.31Å; E312-R315 IonicContact OE1-CZ 3.38Å; E312-R315 IonicContact OE1-NE 3.42Å; E312-R315 PolarHBondContact OE1-NE 3.05Å; E312-R315 IonicContact OE1-NH2 2.69Å; E312-R315 PolarHBondContact OE1-NH2 3.42Å; E312-R315 IonicContact OE2-CZ 2.86Å; E312-R315 IonicContact OE2-NE 3.7Å; E312-R315 PolarHBondContact OE2-NE 3.45Å; E312-R315 IonicContact OE2-NH2 3.39Å; E312-R316 PolarHBondContact O-N 3.24Å; E312-R316 IonicContact OE1-CZ 3.44Å; E312-R316 VanDerWaalsContact OE1-CZ 3.24Å; E312-R316 IonicContact OE1-NE 2.66Å; E312-R316 PolarHBondContact OE1-NE 3.12Å; E312-R316 IonicContact OE1-NH2 2.85Å; E312-R316 PolarHBondContact OE1-NH2 3.16Å; E312-V322 HydrophobicContact CB-CG1 4.26Å; E312-V322 HydrophobicContact CG-CG1 4Å; E312-V322 HydrophobicContact CG-CG2 4.23Å; E312-L367 HydrophobicContact CB-CD1 4.49Å; E312-L367 HydrophobicContact CG-CD1 3.72Å |
| 313 | C | 98.6 | Very high | 98 | Very high | 1 Ų | 1 | 38 Ų | 38 | 1% | 0.007 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -57.9 | -48.1 | 172.3 | -59.6 | 0 | 0 | 0 | 0 | 111.3 | L184 L188 L309 S310 R315 R316 Q317 Q318 V319 | L184-C313 HydrophobicContact CD1-CB 3.47Å; L184-C313 VanDerWaalsContact CD1-CB 3.47Å; L188-C313 HydrophobicContact CD1-CB 4.19Å; L309-C313 PolarHBondContact O-N 2.95Å; L309-C313 PolarHBondContact O-SG 3.37Å; L309-C313 VanDerWaalsContact O-SG 3.37Å; S310-C313 PolarHBondContact O-N 2.91Å; C313-R315 VanDerWaalsContact C-N 3.3Å; C313-R315 PolarHBondContact O-N 3.18Å; C313-R316 CarbonylContact O-C 3.18Å; C313-R316 PolarHBondContact O-N 3.35Å; C313-Q317 WeakPolarHBondContact O-CA 3.37Å; C313-Q317 PolarHBondContact O-N 2.8Å; C313-Q318 WeakPolarHBondContact CA-O 3.32Å; C313-Q318 PolarHBondContact O-N 3.19Å; C313-V319 HydrophobicContact CB-CG2 4.33Å |
| 314 | N | 98.6 | Very high | 98 | Very high | 19 Ų | 19 | 38.1 Ų | 38.1 | 10% | 0.102 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -61.3 | -39.2 | 176.5 | -66.7 | -11.1 | 0 | 0 | 0 | 111.6 | R183 L184 H185 S310 E312 Q317 | R183-N314 PolarHBondContact O-ND2 3.23Å; L184-N314 WeakPolarHBondContact CA-OD1 3.36Å; H185-N314 PolarHBondContact CD2-ND2 3.16Å; H185-N314 PolarHBondContact CD2-OD1 3.05Å; H185-N314 PolarHBondContact N-OD1 3.45Å; S310-N314 WeakPolarHBondContact O-CB 3.44Å; S310-N314 PolarHBondContact O-N 3.26Å; S310-N314 PolarHBondContact O-ND2 3.14Å; S310-N314 PolarHBondContact O-OD1 2.93Å; E312-N314 PolarHBondContact O-N 3.27Å; N314-Q317 PolarHBondContact O-NE2 3.25Å |
| 315 | R | 98.1 | Very high | 98 | Very high | 159 Ų | 159 | 40.4 Ų | 40.4 | 60% | 0.6 | 18% | 0.184 | S | C | * | . | H | α-helix | trans | -65.6 | -39.2 | 178.3 | -171.6 | -171.8 | 71.4 | 77.5 | -7.3 | 112.3 | K311 E312 C313 | K311-R315 WeakPolarHBondContact O-CB 3.42Å; K311-R315 PolarHBondContact O-N 3.35Å; K311-R315 VanDerWaalsContact O-N 3.11Å; E312-R315 WeakPolarHBondContact O-CB 3.5Å; E312-R315 PolarHBondContact O-N 3.31Å; E312-R315 IonicContact OE1-CZ 3.38Å; E312-R315 IonicContact OE1-NE 3.42Å; E312-R315 PolarHBondContact OE1-NE 3.05Å; E312-R315 IonicContact OE1-NH2 2.69Å; E312-R315 PolarHBondContact OE1-NH2 3.42Å; E312-R315 IonicContact OE2-CZ 2.86Å; E312-R315 IonicContact OE2-NE 3.7Å; E312-R315 PolarHBondContact OE2-NE 3.45Å; E312-R315 IonicContact OE2-NH2 3.39Å; C313-R315 VanDerWaalsContact C-N 3.3Å; C313-R315 PolarHBondContact O-N 3.18Å |
| 316 | R | 97.9 | Very high | 98.1 | Very high | 58 Ų | 58 | 36.9 Ų | 36.9 | 22% | 0.219 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -94.6 | -5.6 | -177.2 | -60.5 | -161.1 | -162.4 | -169.2 | 7.6 | 114.4 | E312 C313 Q318 V322 E325 | E312-R316 PolarHBondContact O-N 3.24Å; E312-R316 IonicContact OE1-CZ 3.44Å; E312-R316 VanDerWaalsContact OE1-CZ 3.24Å; E312-R316 IonicContact OE1-NE 2.66Å; E312-R316 PolarHBondContact OE1-NE 3.12Å; E312-R316 IonicContact OE1-NH2 2.85Å; E312-R316 PolarHBondContact OE1-NH2 3.16Å; C313-R316 CarbonylContact O-C 3.18Å; C313-R316 PolarHBondContact O-N 3.35Å; R316-Q318 VanDerWaalsContact C-N 3.25Å; R316-Q318 HydrophobicContact CB-CG 3.97Å; R316-Q318 PolarHBondContact O-N 3.15Å; R316-Q318 PolarHBondContact O-NE2 3.5Å; R316-V322 HydrophobicContact CB-CG2 4.08Å; R316-V322 HydrophobicContact CG-CG2 4.22Å; R316-E325 IonicContact CZ-OE2 2.63Å; R316-E325 IonicContact NH1-OE1 3.63Å; R316-E325 PolarHBondContact NH1-OE1 3.4Å; R316-E325 IonicContact NH1-OE2 3.98Å; R316-E325 PolarHBondContact NH1-OE2 3.45Å; R316-E325 IonicContact NH2-OE2 3.93Å; R316-E325 PolarHBondContact NH2-OE2 3.39Å |
| 317 | Q | 98.4 | Very high | 98.3 | Very high | 99 Ų | 99 | 34.7 Ų | 34.7 | 46% | 0.463 | 16% | 0.16 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 54.5 | 40.4 | -177.6 | -63.5 | -71.2 | -59.5 | 0 | 0 | 112.7 | E187 C313 N314 | E187-Q317 PolarHBondContact OE1-OE1 3.5Å; C313-Q317 WeakPolarHBondContact O-CA 3.37Å; C313-Q317 PolarHBondContact O-N 2.8Å; N314-Q317 PolarHBondContact O-NE2 3.25Å |
| 318 | Q | 98.3 | Very high | 98.4 | Very high | 78 Ų | 78 | 33.5 Ų | 33.5 | 36% | 0.364 | 16% | 0.155 | S | C | . | . | trans | -161.7 | 145.8 | 177.2 | 62.6 | -171.2 | -67.9 | 0 | 0 | 111 | E191 C313 R316 V322 | E191-Q318 WeakPolarHBondContact OE2-CA 3.28Å; C313-Q318 WeakPolarHBondContact CA-O 3.32Å; C313-Q318 PolarHBondContact O-N 3.19Å; R316-Q318 VanDerWaalsContact C-N 3.25Å; R316-Q318 HydrophobicContact CB-CG 3.97Å; R316-Q318 PolarHBondContact O-N 3.15Å; R316-Q318 PolarHBondContact O-NE2 3.5Å; Q318-V322 HydrophobicContact CG-CG2 4.26Å; Q318-V322 WeakPolarHBondContact O-CG2 3.46Å | ||
| 319 | V | 98.8 | Very high | 98.5 | Very high | 0 Ų | 0 | 32.3 Ų | 32.3 | 0% | 0 | 15% | 0.145 | C | C | . | . | S | Bend | trans | -102.5 | -47.8 | 177.5 | -178.9 | 0 | 0 | 0 | 0 | 111.3 | L184 L188 E191 R192 L304 C313 G321 V322 L323 | L184-V319 HydrophobicContact CD1-CG2 4.31Å; L184-V319 HydrophobicContact CD2-CG2 4.04Å; L188-V319 HydrophobicContact CB-CG2 3.84Å; L188-V319 HydrophobicContact CD1-CG2 4.5Å; E191-V319 HydrophobicContact CB-CB 4.25Å; E191-V319 HydrophobicContact CB-CG2 4.33Å; E191-V319 HydrophobicContact CG-CB 3.96Å; E191-V319 PolarHBondContact OE1-N 3.22Å; E191-V319 PolarHBondContact OE2-N 3.45Å; R192-V319 HydrophobicContact CB-CG1 4.28Å; R192-V319 HydrophobicContact CB-CG2 4.43Å; L304-V319 HydrophobicContact CD1-CG1 4.1Å; L304-V319 HydrophobicContact CD2-CG1 4.06Å; C313-V319 HydrophobicContact CB-CG2 4.33Å; V319-G321 PolarHBondContact O-N 3.32Å; V319-V322 PolarHBondContact O-N 3.07Å; V319-L323 VanDerWaalsContact O-CB 3.29Å; V319-L323 WeakPolarHBondContact O-CB 3.46Å; V319-L323 PolarHBondContact O-N 2.94Å |
| 320 | V | 98.8 | Very high | 98.5 | Very high | 11 Ų | 11 | 32.2 Ų | 32.2 | 7% | 0.067 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -62.2 | -48.1 | -175.6 | 169.8 | 0 | 0 | 0 | 0 | 110.4 | F143 L147 E191 V195 V322 L323 N324 | F143-V320 HydrophobicContact CE1-CG1 3.9Å; F143-V320 HydrophobicContact CZ-CG1 3.7Å; L147-V320 HydrophobicContact CD2-CG1 4.05Å; E191-V320 HydrophobicContact CG-CB 4.44Å; E191-V320 HydrophobicContact CG-CG2 3.69Å; E191-V320 VanDerWaalsContact OE1-CB 3.23Å; E191-V320 WeakPolarHBondContact OE1-CB 3.48Å; E191-V320 WeakPolarHBondContact OE1-CG2 3.37Å; E191-V320 PolarHBondContact OE1-N 2.87Å; V195-V320 HydrophobicContact CG2-CG2 3.75Å; V320-V322 PolarHBondContact O-N 2.71Å; V320-L323 PolarHBondContact O-N 3.4Å; V320-N324 WeakPolarHBondContact O-CB 3.46Å; V320-N324 PolarHBondContact O-N 2.9Å; V320-N324 PolarHBondContact O-OD1 3.1Å |
| 321 | G | 98.5 | Very high | 98.6 | Very high | 12 Ų | 12 | 32 Ų | 32 | 12% | 0.124 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -62 | -44.1 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | V319 L323 N324 E325 | V319-G321 PolarHBondContact O-N 3.32Å; G321-L323 VanDerWaalsContact C-N 3.35Å; G321-L323 PolarHBondContact O-N 2.82Å; G321-N324 PolarHBondContact O-N 3.14Å; G321-E325 WeakPolarHBondContact O-CG 3.4Å; G321-E325 PolarHBondContact O-N 3.21Å |
| 322 | V | 98.8 | Very high | 98.6 | Very high | 0 Ų | 0 | 25.1 Ų | 25.1 | 0% | 0 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -63.7 | -41.3 | 177 | 172.6 | 0 | 0 | 0 | 0 | 111.3 | L309 E312 R316 Q318 V319 V320 F326 L367 | L309-V322 HydrophobicContact CB-CG1 4.48Å; L309-V322 HydrophobicContact CD2-CG1 4.09Å; E312-V322 HydrophobicContact CB-CG1 4.26Å; E312-V322 HydrophobicContact CG-CG1 4Å; E312-V322 HydrophobicContact CG-CG2 4.23Å; R316-V322 HydrophobicContact CB-CG2 4.08Å; R316-V322 HydrophobicContact CG-CG2 4.22Å; Q318-V322 HydrophobicContact CG-CG2 4.26Å; Q318-V322 WeakPolarHBondContact O-CG2 3.46Å; V319-V322 PolarHBondContact O-N 3.07Å; V320-V322 PolarHBondContact O-N 2.71Å; V322-F326 VanDerWaalsContact O-CB 3.23Å; V322-F326 WeakPolarHBondContact O-CB 3.49Å; V322-F326 PolarHBondContact O-N 2.87Å; V322-L367 HydrophobicContact CG1-CD1 4.41Å |
| 323 | L | 98.9 | Very high | 98.7 | Very high | 1 Ų | 1 | 24.9 Ų | 24.9 | 1% | 0.005 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -68.4 | -42.7 | 179.9 | -168.9 | 70.2 | 0 | 0 | 0 | 112 | V195 A300 L304 L309 V319 V320 G321 F326 Y327 | V195-L323 HydrophobicContact CB-CD2 4.37Å; V195-L323 HydrophobicContact CG1-CD2 3.33Å; V195-L323 HydrophobicContact CG2-CD2 4.11Å; A300-L323 HydrophobicContact CB-CD1 3.82Å; A300-L323 HydrophobicContact CB-CG 4.4Å; L304-L323 HydrophobicContact CB-CD1 4.08Å; L304-L323 HydrophobicContact CD2-CD1 4.18Å; L304-L323 HydrophobicContact CD2-CD2 4.1Å; L309-L323 HydrophobicContact CD1-CD1 3.9Å; V319-L323 VanDerWaalsContact O-CB 3.29Å; V319-L323 WeakPolarHBondContact O-CB 3.46Å; V319-L323 PolarHBondContact O-N 2.94Å; V320-L323 PolarHBondContact O-N 3.4Å; G321-L323 VanDerWaalsContact C-N 3.35Å; G321-L323 PolarHBondContact O-N 2.82Å; L323-F326 PolarHBondContact O-N 3.42Å; L323-Y327 WeakPolarHBondContact O-CB 3.49Å; L323-Y327 PolarHBondContact O-N 2.99Å |
| 324 | N | 98.9 | Very high | 98.7 | Very high | 4 Ų | 4 | 24.9 Ų | 24.9 | 2% | 0.021 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -60.3 | -48.6 | 175.9 | -73.9 | -9.3 | 0 | 0 | 0 | 111.4 | F143 H259 Y262 V320 G321 F326 Y327 V328 | F143-N324 VanDerWaalsContact CE1-ND2 3.29Å; F143-N324 WeakPolarHBondContact CE1-ND2 3.47Å; F143-N324 WeakPolarHBondContact CZ-ND2 3.47Å; H259-N324 PolarHBondContact CD2-OD1 2.99Å; H259-N324 VanDerWaalsContact CD2-OD1 3.22Å; Y262-N324 HydrophobicContact CD1-CB 3.77Å; Y262-N324 HydrophobicContact CD2-CB 3.93Å; Y262-N324 VanDerWaalsContact CD2-ND2 3.26Å; Y262-N324 WeakPolarHBondContact CD2-ND2 3.23Å; Y262-N324 HydrophobicContact CE1-CB 3.71Å; Y262-N324 HydrophobicContact CE2-CB 3.84Å; Y262-N324 HydrophobicContact CG-CB 3.89Å; V320-N324 WeakPolarHBondContact O-CB 3.46Å; V320-N324 PolarHBondContact O-N 2.9Å; V320-N324 PolarHBondContact O-OD1 3.1Å; G321-N324 PolarHBondContact O-N 3.14Å; N324-F326 VanDerWaalsContact C-N 3.31Å; N324-F326 PolarHBondContact O-N 3.29Å; N324-Y327 WeakPolarHBondContact O-CB 3.27Å; N324-Y327 PolarHBondContact O-N 3.36Å; N324-V328 WeakPolarHBondContact O-CG2 3.45Å; N324-V328 PolarHBondContact O-N 2.89Å |
| 325 | E | 98.8 | Very high | 98.7 | Very high | 53 Ų | 53 | 24.8 Ų | 24.8 | 25% | 0.248 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -61.8 | -40.3 | 174.8 | -75.8 | -178.4 | -147.8 | 0 | 0 | 111.7 | R316 G321 Y327 V328 A329 L367 L370 | R316-E325 IonicContact CZ-OE2 2.63Å; R316-E325 IonicContact NH1-OE1 3.63Å; R316-E325 PolarHBondContact NH1-OE1 3.4Å; R316-E325 IonicContact NH1-OE2 3.98Å; R316-E325 PolarHBondContact NH1-OE2 3.45Å; R316-E325 IonicContact NH2-OE2 3.93Å; R316-E325 PolarHBondContact NH2-OE2 3.39Å; G321-E325 WeakPolarHBondContact O-CG 3.4Å; G321-E325 PolarHBondContact O-N 3.21Å; E325-Y327 VanDerWaalsContact C-N 3.34Å; E325-Y327 PolarHBondContact O-N 3.44Å; E325-V328 PolarHBondContact O-N 3Å; E325-A329 WeakPolarHBondContact O-CB 3.42Å; E325-A329 PolarHBondContact O-N 3.22Å; E325-L367 HydrophobicContact CB-CD2 3.73Å; E325-L370 HydrophobicContact CB-CD2 4.46Å; E325-L370 VanDerWaalsContact O-CD2 3.3Å; E325-L370 WeakPolarHBondContact O-CD2 3.32Å |
| 326 | F | 98.9 | Very high | 98.7 | Very high | 0 Ų | 0 | 20.7 Ų | 20.7 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -64.6 | -39.2 | 177.5 | -175.9 | -103.3 | 0 | 0 | 0 | 112.1 | A300 V303 L309 V322 L323 N324 A329 T330 A359 P363 M366 L367 | A300-F326 HydrophobicContact CB-CD1 3.95Å; A300-F326 HydrophobicContact CB-CE1 4.4Å; V303-F326 HydrophobicContact CB-CE1 3.8Å; V303-F326 HydrophobicContact CB-CZ 4.1Å; V303-F326 HydrophobicContact CG1-CE1 3.91Å; V303-F326 HydrophobicContact CG1-CZ 3.81Å; V303-F326 HydrophobicContact CG2-CE1 3.75Å; V303-F326 HydrophobicContact CG2-CZ 3.83Å; L309-F326 HydrophobicContact CD1-CB 4.21Å; L309-F326 HydrophobicContact CD1-CD1 4.01Å; L309-F326 HydrophobicContact CD1-CG 4.02Å; L309-F326 HydrophobicContact CD2-CB 4.31Å; L309-F326 HydrophobicContact CD2-CD2 3.88Å; L309-F326 HydrophobicContact CD2-CE2 4.39Å; L309-F326 HydrophobicContact CD2-CG 4.01Å; V322-F326 VanDerWaalsContact O-CB 3.23Å; V322-F326 WeakPolarHBondContact O-CB 3.49Å; V322-F326 PolarHBondContact O-N 2.87Å; L323-F326 PolarHBondContact O-N 3.42Å; N324-F326 VanDerWaalsContact C-N 3.31Å; N324-F326 PolarHBondContact O-N 3.29Å; F326-A329 PolarHBondContact O-N 3.44Å; F326-T330 WeakPolarHBondContact O-CB 3.43Å; F326-T330 PolarHBondContact O-N 2.98Å; F326-T330 PolarHBondContact O-OG1 3.5Å; F326-A359 HydrophobicContact CZ-CB 3.92Å; F326-P363 HydrophobicContact CD2-CB 4.44Å; F326-P363 HydrophobicContact CE2-CB 3.8Å; F326-P363 HydrophobicContact CZ-CB 4.39Å; F326-M366 HydrophobicContact CD2-CB 4.26Å; F326-M366 HydrophobicContact CE2-CB 3.92Å; F326-M366 HydrophobicContact CE2-CG 4.07Å; F326-L367 HydrophobicContact CB-CD2 4.05Å; F326-L367 HydrophobicContact CD2-CD2 4.47Å; F326-L367 HydrophobicContact CD2-CG 4.36Å |
| 327 | Y | 98.9 | Very high | 98.7 | Very high | 0 Ų | 0 | 18.6 Ų | 18.6 | 0% | 0 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -58.1 | -50.3 | 171.3 | 158.2 | -90.4 | 0 | 0 | 0 | 110.8 | H259 F263 S293 M296 L323 N324 E325 A329 T330 F331 | H259-Y327 HydrophobicContact CB-CD1 3.78Å; H259-Y327 HydrophobicContact CB-CD2 3.69Å; H259-Y327 HydrophobicContact CB-CE1 3.8Å; H259-Y327 HydrophobicContact CB-CE2 3.67Å; H259-Y327 HydrophobicContact CB-CG 3.74Å; H259-Y327 AromaticContact CG-CD2 3.77Å; H259-Y327 AromaticContact CG-CG 3.65Å; H259-Y327 AromaticContact ND1-CD2 3.63Å; H259-Y327 AromaticContact ND1-CG 3.83Å; H259-Y327 WeakPolarHBondContact O-CE1 3.45Å; F263-Y327 HydrophobicContact CB-CE1 3.88Å; F263-Y327 HydrophobicContact CD1-CE1 4.17Å; F263-Y327 HydrophobicContact CG-CE1 4.21Å; S293-Y327 WeakPolarHBondContact O-CE2 3.48Å; S293-Y327 PolarHBondContact OG-OH 3.06Å; M296-Y327 HydrophobicContact CB-CD2 3.75Å; M296-Y327 HydrophobicContact CB-CE2 3.79Å; L323-Y327 WeakPolarHBondContact O-CB 3.49Å; L323-Y327 PolarHBondContact O-N 2.99Å; N324-Y327 WeakPolarHBondContact O-CB 3.27Å; N324-Y327 PolarHBondContact O-N 3.36Å; E325-Y327 VanDerWaalsContact C-N 3.34Å; E325-Y327 PolarHBondContact O-N 3.44Å; Y327-A329 VanDerWaalsContact C-N 3.3Å; Y327-A329 PolarHBondContact O-N 2.82Å; Y327-T330 PolarHBondContact O-N 2.94Å; Y327-F331 HydrophobicContact CE1-CD1 4.19Å; Y327-F331 HydrophobicContact CE2-CD1 4.19Å; Y327-F331 AromaticContact CZ-CD1 3.66Å; Y327-F331 PolarHBondContact O-N 3.05Å; Y327-F331 WeakPolarHBondContact OH-CD1 3.35Å; Y327-F331 WeakPolarHBondContact OH-CE1 2.81Å |
| 328 | V | 98.9 | Very high | 98.7 | Very high | 0 Ų | 0 | 13.9 Ų | 13.9 | 0% | 0 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -63.1 | -38.5 | 178.4 | 179.3 | 0 | 0 | 0 | 0 | 111.1 | Y262 F263 T269 L272 N324 E325 T330 F331 L332 L370 | Y262-V328 HydrophobicContact CD1-CG2 3.93Å; Y262-V328 HydrophobicContact CE1-CG2 3.8Å; F263-V328 HydrophobicContact CB-CG2 4.3Å; F263-V328 HydrophobicContact CD2-CG1 3.99Å; F263-V328 HydrophobicContact CD2-CG2 3.83Å; F263-V328 HydrophobicContact CE2-CG1 3.78Å; F263-V328 HydrophobicContact CE2-CG2 4.42Å; F263-V328 HydrophobicContact CG-CG2 4.21Å; T269-V328 HydrophobicContact CG2-CG1 4.1Å; L272-V328 HydrophobicContact CD2-CG1 4.18Å; N324-V328 WeakPolarHBondContact O-CG2 3.45Å; N324-V328 PolarHBondContact O-N 2.89Å; E325-V328 PolarHBondContact O-N 3Å; V328-T330 VanDerWaalsContact C-N 3.34Å; V328-T330 PolarHBondContact O-N 3.35Å; V328-F331 PolarHBondContact O-N 3.04Å; V328-L332 WeakPolarHBondContact O-CB 3.22Å; V328-L332 PolarHBondContact O-N 2.9Å; V328-L370 HydrophobicContact CB-CD2 3.89Å; V328-L370 HydrophobicContact CG1-CD1 3.72Å; V328-L370 HydrophobicContact CG1-CD2 3.9Å; V328-L370 HydrophobicContact CG1-CG 4.48Å |
| 329 | A | 98.9 | Very high | 98.7 | Very high | 3 Ų | 3 | 14.8 Ų | 14.8 | 3% | 0.025 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -64.8 | -38.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | E325 F326 Y327 F331 H333 M366 L370 | E325-A329 WeakPolarHBondContact O-CB 3.42Å; E325-A329 PolarHBondContact O-N 3.22Å; F326-A329 PolarHBondContact O-N 3.44Å; Y327-A329 VanDerWaalsContact C-N 3.3Å; Y327-A329 PolarHBondContact O-N 2.82Å; A329-F331 VanDerWaalsContact C-N 3.34Å; A329-H333 WeakPolarHBondContact O-CB 3.35Å; A329-H333 PolarHBondContact O-N 3.4Å; A329-M366 HydrophobicContact CB-CB 3.98Å; A329-M366 WeakPolarHBondContact CB-O 3.46Å; A329-L370 HydrophobicContact CB-CB 3.79Å; A329-L370 HydrophobicContact CB-CD2 4.03Å; A329-L370 HydrophobicContact CB-CG 4.48Å |
| 330 | T | 98.9 | Very high | 98.6 | Very high | 0 Ų | 0 | 20 Ų | 20 | 0% | 0 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -67.2 | -40.4 | 175.4 | -47.1 | 0 | 0 | 0 | 0 | 109.9 | M296 I299 F326 Y327 V328 H333 I334 V355 A359 | M296-T330 HydrophobicContact SD-CG2 3.38Å; M296-T330 WeakPolarHBondContact SD-CG2 3.47Å; I299-T330 HydrophobicContact CD1-CG2 4.31Å; I299-T330 HydrophobicContact CG2-CG2 4.17Å; F326-T330 WeakPolarHBondContact O-CB 3.43Å; F326-T330 PolarHBondContact O-N 2.98Å; F326-T330 PolarHBondContact O-OG1 3.5Å; Y327-T330 PolarHBondContact O-N 2.94Å; V328-T330 VanDerWaalsContact C-N 3.34Å; V328-T330 PolarHBondContact O-N 3.35Å; T330-H333 WeakPolarHBondContact O-CB 3.25Å; T330-H333 PolarHBondContact O-N 2.67Å; T330-I334 PolarHBondContact O-N 2.95Å; T330-V355 HydrophobicContact CG2-CG1 3.58Å; T330-A359 HydrophobicContact CG2-CB 4.31Å |
| 331 | F | 98.6 | Very high | 98.6 | Very high | 0 Ų | 0 | 24.1 Ų | 24.1 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -66.1 | -40.8 | 177.1 | -142.5 | 155.6 | 0 | 0 | 0 | 112.6 | F263 I276 F287 F289 M292 M296 Y327 V328 A329 H333 I334 Y335 | F263-F331 AromaticContact CD1-CD1 3.76Å; F263-F331 HydrophobicContact CD1-CD1 3.76Å; F263-F331 AromaticContact CD1-CE1 3.98Å; F263-F331 HydrophobicContact CD1-CE1 3.98Å; F263-F331 HydrophobicContact CE1-CB 4.47Å; F263-F331 AromaticContact CE1-CD1 3.46Å; F263-F331 HydrophobicContact CE1-CD1 3.46Å; F263-F331 VanDerWaalsContact CE1-CD1 3.46Å; F263-F331 AromaticContact CE1-CE1 3.77Å; F263-F331 HydrophobicContact CE1-CE1 3.77Å; F263-F331 HydrophobicContact CE1-CG 4Å; F263-F331 HydrophobicContact CZ-CD1 4.44Å; I276-F331 HydrophobicContact CD1-CD2 3.74Å; I276-F331 HydrophobicContact CD1-CE2 4.08Å; I276-F331 HydrophobicContact CD1-CG 4.15Å; I276-F331 HydrophobicContact CG2-CD2 4.39Å; I276-F331 HydrophobicContact CG2-CE2 3.76Å; I276-F331 HydrophobicContact CG2-CZ 4.31Å; F287-F331 AromaticContact CE1-CE2 3.63Å; F287-F331 HydrophobicContact CE1-CE2 3.63Å; F287-F331 HydrophobicContact CE1-CZ 4.23Å; F287-F331 HydrophobicContact CZ-CD2 4.37Å; F287-F331 AromaticContact CZ-CE2 3.61Å; F287-F331 HydrophobicContact CZ-CE2 3.61Å; F289-F331 HydrophobicContact CD2-CZ 4.17Å; F289-F331 HydrophobicContact CE1-CE1 4.41Å; F289-F331 HydrophobicContact CE1-CZ 4.4Å; F289-F331 HydrophobicContact CE2-CE1 4.4Å; F289-F331 HydrophobicContact CE2-CZ 4.04Å; F289-F331 HydrophobicContact CG-CZ 4.4Å; F289-F331 HydrophobicContact CZ-CE1 4.12Å; F289-F331 HydrophobicContact CZ-CZ 4.14Å; M292-F331 HydrophobicContact CB-CE2 4.29Å; M292-F331 HydrophobicContact CB-CZ 4.5Å; M296-F331 HydrophobicContact CG-CB 4.14Å; M296-F331 HydrophobicContact CG-CD1 4.38Å; M296-F331 HydrophobicContact CG-CD2 4.27Å; M296-F331 HydrophobicContact CG-CG 4.01Å; Y327-F331 HydrophobicContact CE1-CD1 4.19Å; Y327-F331 HydrophobicContact CE2-CD1 4.19Å; Y327-F331 AromaticContact CZ-CD1 3.66Å; Y327-F331 PolarHBondContact O-N 3.05Å; Y327-F331 WeakPolarHBondContact OH-CD1 3.35Å; Y327-F331 WeakPolarHBondContact OH-CE1 2.81Å; V328-F331 PolarHBondContact O-N 3.04Å; A329-F331 VanDerWaalsContact C-N 3.34Å; F331-H333 VanDerWaalsContact C-N 3.3Å; F331-H333 PolarHBondContact O-N 3.35Å; F331-I334 HydrophobicContact CD2-CG2 3.88Å; F331-I334 WeakPolarHBondContact O-CG2 3.43Å; F331-Y335 VanDerWaalsContact O-CB 3.28Å; F331-Y335 WeakPolarHBondContact O-CB 3.28Å; F331-Y335 PolarHBondContact O-N 3.03Å |
| 332 | L | 98.8 | Very high | 98.5 | Very high | 3 Ų | 3 | 29 Ų | 29 | 2% | 0.016 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -59.1 | -44.1 | 171.6 | 176.4 | 60.6 | 0 | 0 | 0 | 111 | L272 V328 Y335 Q336 L370 F373 | L272-L332 HydrophobicContact CD1-CD1 3.72Å; L272-L332 HydrophobicContact CD2-CB 3.95Å; L272-L332 HydrophobicContact CD2-CD1 3.88Å; L272-L332 HydrophobicContact CD2-CG 4.38Å; L272-L332 HydrophobicContact CG-CD1 4.47Å; V328-L332 WeakPolarHBondContact O-CB 3.22Å; V328-L332 PolarHBondContact O-N 2.9Å; L332-Y335 PolarHBondContact O-N 3.09Å; L332-Q336 HydrophobicContact CD1-CG 4.13Å; L332-Q336 WeakPolarHBondContact O-CG 3.36Å; L332-Q336 PolarHBondContact O-N 2.95Å; L332-L370 HydrophobicContact CD2-CB 4.43Å; L332-L370 HydrophobicContact CD2-CD1 3.92Å; L332-F373 HydrophobicContact CD1-CD1 4.1Å; L332-F373 HydrophobicContact CD1-CD2 4.12Å; L332-F373 HydrophobicContact CD1-CE1 4.1Å; L332-F373 HydrophobicContact CD1-CE2 4.1Å; L332-F373 HydrophobicContact CD1-CG 4.11Å; L332-F373 HydrophobicContact CD1-CZ 4.1Å; L332-F373 HydrophobicContact CD2-CB 3.74Å; L332-F373 HydrophobicContact CD2-CD1 3.93Å; L332-F373 HydrophobicContact CD2-CD2 4.38Å; L332-F373 HydrophobicContact CD2-CG 3.75Å |
| 333 | H | 98.8 | Very high | 98.5 | Very high | 22 Ų | 22 | 31 Ų | 31 | 10% | 0.102 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -64.4 | -48.8 | -178.2 | -175.2 | 44.5 | 0 | 0 | 0 | 112.2 | A329 T330 F331 Y335 Q336 L337 F358 M366 | A329-H333 WeakPolarHBondContact O-CB 3.35Å; A329-H333 PolarHBondContact O-N 3.4Å; T330-H333 WeakPolarHBondContact O-CB 3.25Å; T330-H333 PolarHBondContact O-N 2.67Å; F331-H333 VanDerWaalsContact C-N 3.3Å; F331-H333 PolarHBondContact O-N 3.35Å; H333-Y335 VanDerWaalsContact C-N 3.32Å; H333-Y335 PolarHBondContact O-N 3.32Å; H333-Q336 PolarHBondContact O-N 3.13Å; H333-L337 WeakPolarHBondContact O-CB 3.47Å; H333-L337 PolarHBondContact O-N 3.46Å; H333-F358 AromaticContact CD2-CD1 3.95Å; H333-F358 AromaticContact NE2-CD1 3.62Å; H333-F358 AromaticContact NE2-CG 3.81Å; H333-M366 HydrophobicContact CB-CE 3.69Å; H333-M366 HydrophobicContact CB-SD 4.05Å |
| 334 | I | 98.6 | Very high | 98.4 | Very high | 0 Ų | 0 | 33.3 Ų | 33.3 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -63.9 | -38.3 | 176.9 | -168.7 | 168 | 0 | 0 | 0 | 111.4 | F287 M292 M296 T330 F331 Q336 L337 W338 V351 L352 V355 | F287-I334 HydrophobicContact CE2-CG1 4.44Å; F287-I334 HydrophobicContact CZ-CG2 4.39Å; M292-I334 HydrophobicContact SD-CD1 3.71Å; M296-I334 HydrophobicContact CE-CD1 3.83Å; M296-I334 HydrophobicContact CE-CG2 4.39Å; M296-I334 HydrophobicContact CG-CG2 4.47Å; M296-I334 HydrophobicContact SD-CB 4.25Å; M296-I334 HydrophobicContact SD-CG2 3.73Å; T330-I334 PolarHBondContact O-N 2.95Å; F331-I334 HydrophobicContact CD2-CG2 3.88Å; F331-I334 WeakPolarHBondContact O-CG2 3.43Å; I334-Q336 PolarHBondContact O-N 3.28Å; I334-L337 PolarHBondContact O-N 3.26Å; I334-W338 WeakPolarHBondContact O-CB 3.37Å; I334-W338 PolarHBondContact O-N 3.31Å; I334-V351 HydrophobicContact CD1-CG1 3.78Å; I334-V351 HydrophobicContact CG1-CG1 3.62Å; I334-L352 HydrophobicContact CD1-CD2 3.98Å; I334-V355 HydrophobicContact CB-CG1 4.48Å; I334-V355 HydrophobicContact CB-CG2 3.93Å; I334-V355 HydrophobicContact CD1-CG2 4.45Å; I334-V355 HydrophobicContact CG1-CG2 4.09Å |
| 335 | Y | 98.5 | Very high | 98.2 | Very high | 18 Ų | 18 | 37.5 Ų | 37.5 | 7% | 0.071 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -59.3 | -49 | 175.9 | 168.5 | -112.8 | 0 | 0 | 0 | 112 | L272 I276 L279 F331 L332 H333 W338 K339 | L272-Y335 HydrophobicContact CD1-CD1 4.13Å; L272-Y335 HydrophobicContact CD1-CE1 4.36Å; I276-Y335 HydrophobicContact CB-CD2 4.11Å; I276-Y335 HydrophobicContact CB-CE2 4.47Å; I276-Y335 HydrophobicContact CD1-CG 4.19Å; I276-Y335 HydrophobicContact CG1-CD1 4.17Å; I276-Y335 HydrophobicContact CG1-CD2 3.54Å; I276-Y335 HydrophobicContact CG1-CE2 4.06Å; I276-Y335 HydrophobicContact CG1-CG 3.57Å; I276-Y335 HydrophobicContact CG2-CD2 4.27Å; L279-Y335 HydrophobicContact CB-CD2 4.48Å; L279-Y335 HydrophobicContact CB-CE2 3.99Å; L279-Y335 HydrophobicContact CD2-CD2 3.62Å; L279-Y335 HydrophobicContact CD2-CE2 3.69Å; L279-Y335 HydrophobicContact CG-CE2 4.39Å; F331-Y335 VanDerWaalsContact O-CB 3.28Å; F331-Y335 WeakPolarHBondContact O-CB 3.28Å; F331-Y335 PolarHBondContact O-N 3.03Å; L332-Y335 PolarHBondContact O-N 3.09Å; H333-Y335 VanDerWaalsContact C-N 3.32Å; H333-Y335 PolarHBondContact O-N 3.32Å; Y335-W338 PolarHBondContact O-N 3.3Å; Y335-K339 HydrophobicContact CE1-CD 4.25Å; Y335-K339 HydrophobicContact CE2-CD 4.09Å; Y335-K339 WeakPolarHBondContact O-CB 3.41Å; Y335-K339 PolarHBondContact O-N 3.47Å; Y335-K339 WeakPolarHBondContact OH-CD 3.47Å; Y335-K339 PolarHBondContact OH-NZ 2.89Å |
| 336 | Q | 98.3 | Very high | 98.1 | Very high | 73 Ų | 73 | 39.2 Ų | 39.2 | 34% | 0.341 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -63.9 | -43.8 | 179.4 | -73.1 | 175.5 | -18 | 0 | 0 | 111.6 | L332 H333 I334 T340 | L332-Q336 HydrophobicContact CD1-CG 4.13Å; L332-Q336 WeakPolarHBondContact O-CG 3.36Å; L332-Q336 PolarHBondContact O-N 2.95Å; H333-Q336 PolarHBondContact O-N 3.13Å; I334-Q336 PolarHBondContact O-N 3.28Å; Q336-T340 WeakPolarHBondContact O-CB 3.31Å; Q336-T340 PolarHBondContact O-N 3.31Å; Q336-T340 PolarHBondContact O-OG1 3.03Å |
| 337 | L | 98.1 | Very high | 98 | Very high | 14 Ų | 14 | 41.4 Ų | 41.4 | 7% | 0.073 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -59.8 | -51.5 | 176.4 | 176.3 | 60.4 | 0 | 0 | 0 | 111 | H333 I334 Q341 V351 E354 V355 | H333-L337 WeakPolarHBondContact O-CB 3.47Å; H333-L337 PolarHBondContact O-N 3.46Å; I334-L337 PolarHBondContact O-N 3.26Å; L337-Q341 VanDerWaalsContact CD1-CD 3.45Å; L337-Q341 HydrophobicContact CD1-CG 4.13Å; L337-Q341 WeakPolarHBondContact O-CB 3.2Å; L337-Q341 PolarHBondContact O-N 3.36Å; L337-V351 HydrophobicContact CD2-CG1 3.93Å; L337-E354 HydrophobicContact CD2-CG 4.5Å; L337-V355 HydrophobicContact CD2-CG2 3.89Å |
| 338 | W | 98.4 | Very high | 97.9 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -59.6 | -51.7 | -178.5 | -168 | -68.1 | 0 | 0 | 0 | 111.4 | L279 Q285 F287 M292 I334 Y335 Q342 K343 T344 V351 | L279-W338 HydrophobicContact CD2-CG 4.4Å; Q285-W338 WeakPolarHBondContact O-CZ2 3.46Å; Q285-W338 PolarHBondContact OE1-O 3.04Å; F287-W338 HydrophobicContact CD2-CB 4.23Å; F287-W338 AromaticContact CD2-CD1 3.99Å; F287-W338 AromaticContact CD2-CD2 3.52Å; F287-W338 HydrophobicContact CD2-CD2 3.52Å; F287-W338 AromaticContact CD2-CE2 3.8Å; F287-W338 AromaticContact CD2-CE3 3.9Å; F287-W338 HydrophobicContact CD2-CE3 3.9Å; F287-W338 AromaticContact CD2-CG 3.66Å; F287-W338 HydrophobicContact CD2-CG 3.66Å; F287-W338 HydrophobicContact CD2-CZ2 4.38Å; F287-W338 HydrophobicContact CD2-CZ3 4.49Å; F287-W338 HydrophobicContact CE2-CB 4.39Å; F287-W338 HydrophobicContact CE2-CD2 4.02Å; F287-W338 AromaticContact CE2-CE3 4Å; F287-W338 HydrophobicContact CE2-CE3 4Å; F287-W338 HydrophobicContact CE2-CG 4.2Å; M292-W338 HydrophobicContact CE-CH2 3.95Å; M292-W338 HydrophobicContact CE-CZ3 3.54Å; I334-W338 WeakPolarHBondContact O-CB 3.37Å; I334-W338 PolarHBondContact O-N 3.31Å; Y335-W338 PolarHBondContact O-N 3.3Å; W338-Q342 WeakPolarHBondContact O-CA 3.16Å; W338-Q342 PolarHBondContact O-N 3.41Å; W338-K343 HydrophobicContact CB-CB 4.35Å; W338-K343 HydrophobicContact CD2-CB 3.73Å; W338-K343 HydrophobicContact CE3-CB 4.17Å; W338-K343 HydrophobicContact CG-CB 3.82Å; W338-K343 PolarHBondContact NE1-O 3.42Å; W338-K343 PolarHBondContact O-N 3.27Å; W338-T344 VanDerWaalsContact CH2-O 3.24Å; W338-T344 WeakPolarHBondContact CH2-O 3.4Å; W338-T344 WeakPolarHBondContact CZ2-O 3.29Å; W338-V351 HydrophobicContact CE3-CG1 4.19Å |
| 339 | K | 97.8 | Very high | 97.8 | Very high | 96 Ų | 96 | 45.2 Ų | 45.2 | 42% | 0.417 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -65.3 | -45.4 | -178.2 | -175.6 | 178.4 | -178.6 | -178.3 | 0 | 112.7 | L279 Y335 Q342 | L279-K339 HydrophobicContact CD1-CG 4.46Å; L279-K339 HydrophobicContact CD2-CB 4.13Å; Y335-K339 HydrophobicContact CE1-CD 4.25Å; Y335-K339 HydrophobicContact CE2-CD 4.09Å; Y335-K339 WeakPolarHBondContact O-CB 3.41Å; Y335-K339 PolarHBondContact O-N 3.47Å; Y335-K339 WeakPolarHBondContact OH-CD 3.47Å; Y335-K339 PolarHBondContact OH-NZ 2.89Å; K339-Q342 PolarHBondContact O-N 3.46Å; K339-Q342 PolarHBondContact O-NE2 3.14Å |
| 340 | T | 97.6 | Very high | 97.8 | Very high | 109 Ų | 109 | 52.7 Ų | 52.7 | 67% | 0.669 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -71.1 | -38.2 | -174.2 | -53.3 | 0 | 0 | 0 | 0 | 111.4 | Q336 Q342 | Q336-T340 WeakPolarHBondContact O-CB 3.31Å; Q336-T340 PolarHBondContact O-N 3.31Å; Q336-T340 PolarHBondContact O-OG1 3.03Å; T340-Q342 VanDerWaalsContact C-N 3.33Å |
| 341 | Q | 97.8 | Very high | 97.7 | Very high | 99 Ų | 99 | 52.7 Ų | 52.7 | 46% | 0.463 | 29% | 0.288 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92 | 7.6 | 179.3 | -59.4 | -171.3 | 12.8 | 0 | 0 | 113.4 | L337 K343 | L337-Q341 VanDerWaalsContact CD1-CD 3.45Å; L337-Q341 HydrophobicContact CD1-CG 4.13Å; L337-Q341 WeakPolarHBondContact O-CB 3.2Å; L337-Q341 PolarHBondContact O-N 3.36Å; Q341-K343 VanDerWaalsContact C-N 3.25Å; Q341-K343 HydrophobicContact CB-CD 4.16Å; Q341-K343 HydrophobicContact CB-CG 4.12Å; Q341-K343 PolarHBondContact O-N 2.87Å; Q341-K343 VanDerWaalsContact OE1-NZ 3.08Å |
| 342 | Q | 97.4 | Very high | 97.7 | Very high | 114 Ų | 114 | 54.2 Ų | 54.2 | 53% | 0.533 | 30% | 0.296 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 51.4 | 43.1 | -179.6 | -59.9 | -69.2 | -48.7 | 0 | 0 | 112.9 | Q285 W338 K339 T340 | Q285-Q342 VanDerWaalsContact NE2-NE2 3.18Å; W338-Q342 WeakPolarHBondContact O-CA 3.16Å; W338-Q342 PolarHBondContact O-N 3.41Å; K339-Q342 PolarHBondContact O-N 3.46Å; K339-Q342 PolarHBondContact O-NE2 3.14Å; T340-Q342 VanDerWaalsContact C-N 3.33Å |
| 343 | K | 98 | Very high | 97.7 | Very high | 43 Ų | 43 | 61.4 Ų | 61.4 | 19% | 0.187 | 33% | 0.327 | C | S | . | . | trans | -66 | 157.5 | -179.1 | -61.4 | -61.7 | -171.5 | -174.8 | 0 | 111.4 | Q285 W338 Q341 D347 V351 | Q285-K343 WeakPolarHBondContact CB-O 3.46Å; Q285-K343 WeakPolarHBondContact CG-O 3.4Å; W338-K343 HydrophobicContact CB-CB 4.35Å; W338-K343 HydrophobicContact CD2-CB 3.73Å; W338-K343 HydrophobicContact CE3-CB 4.17Å; W338-K343 HydrophobicContact CG-CB 3.82Å; W338-K343 PolarHBondContact NE1-O 3.42Å; W338-K343 PolarHBondContact O-N 3.27Å; Q341-K343 VanDerWaalsContact C-N 3.25Å; Q341-K343 HydrophobicContact CB-CD 4.16Å; Q341-K343 HydrophobicContact CB-CG 4.12Å; Q341-K343 PolarHBondContact O-N 2.87Å; Q341-K343 VanDerWaalsContact OE1-NZ 3.08Å; K343-D347 HydrophobicContact CB-CB 4.2Å; K343-D347 HydrophobicContact CD-CB 3.82Å; K343-D347 HydrophobicContact CG-CB 4.47Å; K343-V351 HydrophobicContact CB-CG2 4.36Å; K343-V351 HydrophobicContact CD-CG2 4.01Å; K343-V351 HydrophobicContact CG-CG2 3.84Å | ||
| 344 | T | 96.9 | Very high | 97.6 | Very high | 49 Ų | 49 | 64.7 Ų | 64.7 | 30% | 0.301 | 34% | 0.342 | S | S | . | . | trans | -126.6 | 174.3 | 175.6 | 68 | 0 | 0 | 0 | 0 | 110.5 | W338 A346 D347 | W338-T344 VanDerWaalsContact CH2-O 3.24Å; W338-T344 WeakPolarHBondContact CH2-O 3.4Å; W338-T344 WeakPolarHBondContact CZ2-O 3.29Å; T344-A346 PolarHBondContact O-N 2.99Å; T344-A346 VanDerWaalsContact O-N 3.13Å; T344-A346 PolarHBondContact OG1-N 3.28Å; T344-D347 PolarHBondContact N-OD2 3.42Å; T344-D347 WeakPolarHBondContact O-CB 3.36Å; T344-D347 PolarHBondContact O-N 3.48Å; T344-D347 PolarHBondContact OG1-OD2 3.07Å; T344-D347 VanDerWaalsContact OG1-OD2 3.08Å | ||
| 345 | I | 94.8 | Very high | 97.6 | Very high | 91 Ų | 91 | 64.7 Ų | 64.7 | 47% | 0.467 | 34% | 0.342 | S | S | . | . | G | 310 helix | trans | -54.5 | -32.5 | 175.7 | -63 | 172.7 | 0 | 0 | 0 | 112 | N286 D347 S348 | N286-I345 HydrophobicContact CB-CD1 3.96Å; N286-I345 HydrophobicContact CB-CG1 4.42Å; N286-I345 WeakPolarHBondContact O-CD1 3.37Å; N286-I345 WeakPolarHBondContact O-CG1 3.26Å; I345-D347 PolarHBondContact O-N 3.29Å; I345-S348 WeakPolarHBondContact O-CB 3.08Å; I345-S348 PolarHBondContact O-N 3.42Å; I345-S348 VanDerWaalsContact O-N 3.12Å; I345-S348 PolarHBondContact O-OG 2.98Å |
| 346 | A | 96.7 | Very high | 97.6 | Very high | 89 Ų | 89 | 66.9 Ų | 66.9 | 74% | 0.736 | 35% | 0.353 | S | S | * | . | G | 310 helix | trans | -62.7 | -26.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113 | T344 | T344-A346 PolarHBondContact O-N 2.99Å; T344-A346 VanDerWaalsContact O-N 3.13Å; T344-A346 PolarHBondContact OG1-N 3.28Å |
| 347 | D | 97.6 | Very high | 97.6 | Very high | 47 Ų | 47 | 68 Ų | 68 | 25% | 0.251 | 36% | 0.361 | S | S | . | . | G | 310 helix | trans | -86.6 | -9.5 | 179.3 | -56.2 | -72.8 | 0 | 0 | 0 | 113.3 | K343 T344 I345 G349 F350 V351 | K343-D347 HydrophobicContact CB-CB 4.2Å; K343-D347 HydrophobicContact CD-CB 3.82Å; K343-D347 HydrophobicContact CG-CB 4.47Å; T344-D347 PolarHBondContact N-OD2 3.42Å; T344-D347 WeakPolarHBondContact O-CB 3.36Å; T344-D347 PolarHBondContact O-N 3.48Å; T344-D347 PolarHBondContact OG1-OD2 3.07Å; T344-D347 VanDerWaalsContact OG1-OD2 3.08Å; I345-D347 PolarHBondContact O-N 3.29Å; D347-G349 VanDerWaalsContact C-N 3.31Å; D347-G349 PolarHBondContact O-N 2.99Å; D347-G349 VanDerWaalsContact O-N 3.16Å; D347-F350 PolarHBondContact O-N 3.25Å; D347-V351 HydrophobicContact CB-CG2 4.07Å; D347-V351 WeakPolarHBondContact O-CG2 3.47Å; D347-V351 PolarHBondContact O-N 3.44Å |
| 348 | S | 96.2 | Very high | 97.6 | Very high | 33 Ų | 33 | 69.7 Ų | 69.7 | 23% | 0.231 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -52 | -44.1 | -167.7 | 56.2 | 0 | 0 | 0 | 0 | 113.8 | I345 F350 V351 L352 | I345-S348 WeakPolarHBondContact O-CB 3.08Å; I345-S348 PolarHBondContact O-N 3.42Å; I345-S348 VanDerWaalsContact O-N 3.12Å; I345-S348 PolarHBondContact O-OG 2.98Å; S348-F350 PolarHBondContact O-N 3.43Å; S348-V351 PolarHBondContact O-N 2.91Å; S348-L352 WeakPolarHBondContact O-CB 3.36Å; S348-L352 VanDerWaalsContact O-CG 3.26Å; S348-L352 WeakPolarHBondContact O-CG 3.33Å; S348-L352 PolarHBondContact O-N 3.06Å |
| 349 | G | 97.2 | Very high | 97.6 | Very high | 47 Ų | 47 | 69.7 Ų | 69.7 | 49% | 0.485 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -61.9 | -41.7 | 179 | 0 | 0 | 0 | 0 | 0 | 113.3 | D347 K353 | D347-G349 VanDerWaalsContact C-N 3.31Å; D347-G349 PolarHBondContact O-N 2.99Å; D347-G349 VanDerWaalsContact O-N 3.16Å; G349-K353 PolarHBondContact O-N 3.28Å |
| 350 | F | 97.9 | Very high | 97.5 | Very high | 159 Ų | 159 | 67.1 Ų | 67.1 | 70% | 0.697 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -70.7 | -43.9 | 177.7 | -63.1 | -73.3 | 0 | 0 | 0 | 111.5 | D347 S348 L352 K353 E354 | D347-F350 PolarHBondContact O-N 3.25Å; S348-F350 PolarHBondContact O-N 3.43Å; F350-L352 PolarHBondContact O-N 3.26Å; F350-K353 PolarHBondContact O-N 3.07Å; F350-E354 PolarHBondContact O-N 2.82Å |
| 351 | V | 98.1 | Very high | 97.4 | Very high | 1 Ų | 1 | 69 Ų | 69 | 1% | 0.006 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -59.9 | -46.7 | 178 | 171.6 | 0 | 0 | 0 | 0 | 110.9 | I334 L337 W338 K343 D347 S348 K353 E354 V355 | I334-V351 HydrophobicContact CD1-CG1 3.78Å; I334-V351 HydrophobicContact CG1-CG1 3.62Å; L337-V351 HydrophobicContact CD2-CG1 3.93Å; W338-V351 HydrophobicContact CE3-CG1 4.19Å; K343-V351 HydrophobicContact CB-CG2 4.36Å; K343-V351 HydrophobicContact CD-CG2 4.01Å; K343-V351 HydrophobicContact CG-CG2 3.84Å; D347-V351 HydrophobicContact CB-CG2 4.07Å; D347-V351 WeakPolarHBondContact O-CG2 3.47Å; D347-V351 PolarHBondContact O-N 3.44Å; S348-V351 PolarHBondContact O-N 2.91Å; V351-K353 VanDerWaalsContact C-N 3.33Å; V351-K353 PolarHBondContact O-N 3.22Å; V351-E354 PolarHBondContact O-N 3.32Å; V351-V355 HydrophobicContact CG1-CG2 4.34Å; V351-V355 WeakPolarHBondContact O-CB 3.35Å; V351-V355 VanDerWaalsContact O-CG2 3.28Å; V351-V355 WeakPolarHBondContact O-CG2 3.2Å; V351-V355 PolarHBondContact O-N 3.09Å |
| 352 | L | 98.4 | Very high | 97.4 | Very high | 31 Ų | 31 | 66.9 Ų | 66.9 | 16% | 0.162 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -60.8 | -42.3 | 178.5 | -76.3 | 172.6 | 0 | 0 | 0 | 112 | M292 N295 M296 I334 S348 F350 V355 E356 | M292-L352 HydrophobicContact SD-CD1 4.49Å; M292-L352 HydrophobicContact SD-CD2 3.94Å; M292-L352 HydrophobicContact SD-CG 4.31Å; N295-L352 HydrophobicContact CB-CD1 4.33Å; N295-L352 HydrophobicContact CB-CD2 3.59Å; M296-L352 HydrophobicContact CE-CD2 3.58Å; I334-L352 HydrophobicContact CD1-CD2 3.98Å; S348-L352 WeakPolarHBondContact O-CB 3.36Å; S348-L352 VanDerWaalsContact O-CG 3.26Å; S348-L352 WeakPolarHBondContact O-CG 3.33Å; S348-L352 PolarHBondContact O-N 3.06Å; F350-L352 PolarHBondContact O-N 3.26Å; L352-V355 PolarHBondContact O-N 2.98Å; L352-E356 VanDerWaalsContact O-CB 3.31Å; L352-E356 WeakPolarHBondContact O-CB 3.23Å; L352-E356 PolarHBondContact O-N 3.12Å |
| 353 | K | 98.2 | Very high | 97.4 | Very high | 154 Ų | 154 | 62.3 Ų | 62.3 | 67% | 0.67 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -64.5 | -41.8 | 177.6 | -172.8 | 177.9 | -178.9 | 179.9 | 0 | 112.2 | G349 F350 V351 L357 | G349-K353 PolarHBondContact O-N 3.28Å; F350-K353 PolarHBondContact O-N 3.07Å; V351-K353 VanDerWaalsContact C-N 3.33Å; V351-K353 PolarHBondContact O-N 3.22Å; K353-L357 WeakPolarHBondContact O-CB 3.26Å; K353-L357 PolarHBondContact O-N 3.44Å |
| 354 | E | 98 | Very high | 97.3 | Very high | 92 Ų | 92 | 66.7 Ų | 66.7 | 43% | 0.43 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -62.7 | -48.8 | 176.2 | -175.3 | -176.9 | 155.5 | 0 | 0 | 111.1 | L337 F350 V351 L357 F358 | L337-E354 HydrophobicContact CD2-CG 4.5Å; F350-E354 PolarHBondContact O-N 2.82Å; V351-E354 PolarHBondContact O-N 3.32Å; E354-L357 PolarHBondContact O-N 3.16Å; E354-F358 WeakPolarHBondContact O-CB 3.45Å; E354-F358 PolarHBondContact O-N 3.34Å |
| 355 | V | 98.4 | Very high | 97.4 | Very high | 0 Ų | 0 | 67.7 Ų | 67.7 | 0% | 0 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -62.4 | -45.2 | 179.2 | 171.2 | 0 | 0 | 0 | 0 | 111.1 | M296 I299 T330 I334 L337 V351 L352 L357 F358 A359 | M296-V355 HydrophobicContact CE-CG1 4.39Å; M296-V355 HydrophobicContact SD-CG1 4.26Å; I299-V355 HydrophobicContact CD1-CG1 4.1Å; T330-V355 HydrophobicContact CG2-CG1 3.58Å; I334-V355 HydrophobicContact CB-CG1 4.48Å; I334-V355 HydrophobicContact CB-CG2 3.93Å; I334-V355 HydrophobicContact CD1-CG2 4.45Å; I334-V355 HydrophobicContact CG1-CG2 4.09Å; L337-V355 HydrophobicContact CD2-CG2 3.89Å; V351-V355 HydrophobicContact CG1-CG2 4.34Å; V351-V355 WeakPolarHBondContact O-CB 3.35Å; V351-V355 VanDerWaalsContact O-CG2 3.28Å; V351-V355 WeakPolarHBondContact O-CG2 3.2Å; V351-V355 PolarHBondContact O-N 3.09Å; L352-V355 PolarHBondContact O-N 2.98Å; V355-L357 PolarHBondContact O-N 3.06Å; V355-F358 PolarHBondContact O-N 3.43Å; V355-A359 WeakPolarHBondContact O-CB 3.42Å; V355-A359 PolarHBondContact O-N 3.13Å |
| 356 | E | 98.4 | Very high | 97.6 | Very high | 63 Ų | 63 | 63.4 Ų | 63.4 | 29% | 0.294 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -59.3 | -48.2 | 177.2 | -175.3 | -169.9 | 153.2 | 0 | 0 | 111.3 | I299 Q302 L352 F358 A359 K360 | I299-E356 HydrophobicContact CD1-CB 3.97Å; I299-E356 HydrophobicContact CG1-CB 4.09Å; I299-E356 HydrophobicContact CG1-CG 4.14Å; Q302-E356 PolarHBondContact OE1-OE1 2.98Å; L352-E356 VanDerWaalsContact O-CB 3.31Å; L352-E356 WeakPolarHBondContact O-CB 3.23Å; L352-E356 PolarHBondContact O-N 3.12Å; E356-F358 VanDerWaalsContact C-N 3.33Å; E356-F358 PolarHBondContact O-N 3.25Å; E356-A359 PolarHBondContact O-N 2.69Å; E356-K360 HydrophobicContact CG-CD 4.15Å; E356-K360 WeakPolarHBondContact O-CB 3.24Å; E356-K360 WeakPolarHBondContact O-CG 3.43Å; E356-K360 PolarHBondContact O-N 3.37Å; E356-K360 WeakPolarHBondContact OE1-CE 3.49Å; E356-K360 IonicContact OE1-NZ 2.83Å; E356-K360 PolarHBondContact OE1-NZ 2.83Å |
| 357 | L | 98 | Very high | 97.7 | Very high | 98 Ų | 98 | 59.5 Ų | 59.5 | 51% | 0.513 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -60.9 | -43.9 | 179.3 | -177 | 65.5 | 0 | 0 | 0 | 111.4 | K353 E354 V355 K361 | K353-L357 WeakPolarHBondContact O-CB 3.26Å; K353-L357 PolarHBondContact O-N 3.44Å; E354-L357 PolarHBondContact O-N 3.16Å; V355-L357 PolarHBondContact O-N 3.06Å; L357-K361 HydrophobicContact CD1-CD 4.28Å; L357-K361 HydrophobicContact CG-CD 4.43Å; L357-K361 WeakPolarHBondContact O-CB 3.5Å; L357-K361 WeakPolarHBondContact O-CG 3.33Å; L357-K361 PolarHBondContact O-N 2.92Å |
| 358 | F | 98.2 | Very high | 97.7 | Very high | 49 Ų | 49 | 64 Ų | 64 | 22% | 0.215 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -66.8 | -45.8 | 179.4 | -172 | -90.1 | 0 | 0 | 0 | 111.8 | H333 E354 V355 E356 K360 K361 N362 Q365 M366 | H333-F358 AromaticContact CD2-CD1 3.95Å; H333-F358 AromaticContact NE2-CD1 3.62Å; H333-F358 AromaticContact NE2-CG 3.81Å; E354-F358 WeakPolarHBondContact O-CB 3.45Å; E354-F358 PolarHBondContact O-N 3.34Å; V355-F358 PolarHBondContact O-N 3.43Å; E356-F358 VanDerWaalsContact C-N 3.33Å; E356-F358 PolarHBondContact O-N 3.25Å; F358-K360 PolarHBondContact O-N 3.03Å; F358-K361 PolarHBondContact O-N 3.04Å; F358-N362 HydrophobicContact CD1-CB 4.49Å; F358-N362 HydrophobicContact CE1-CB 4.04Å; F358-N362 HydrophobicContact CZ-CB 4.08Å; F358-N362 WeakPolarHBondContact O-CB 3.41Å; F358-N362 PolarHBondContact O-N 3.01Å; F358-N362 PolarHBondContact O-ND2 3.1Å; F358-N362 VanDerWaalsContact O-ND2 3.13Å; F358-Q365 VanDerWaalsContact CZ-OE1 3.28Å; F358-M366 HydrophobicContact CD1-CE 3.8Å; F358-M366 HydrophobicContact CD1-CG 4.49Å; F358-M366 HydrophobicContact CD1-SD 3.72Å; F358-M366 HydrophobicContact CE1-CE 3.47Å; F358-M366 VanDerWaalsContact CE1-CE 3.47Å; F358-M366 HydrophobicContact CE1-CG 4.43Å; F358-M366 HydrophobicContact CE1-SD 3.93Å |
| 359 | A | 97.8 | Very high | 97.8 | Very high | 0 Ų | 0 | 67 Ų | 67 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -63 | -41.7 | -177.6 | 0 | 0 | 0 | 0 | 0 | 112 | I299 F326 T330 V355 E356 P363 M366 | I299-A359 HydrophobicContact CG2-CB 3.89Å; F326-A359 HydrophobicContact CZ-CB 3.92Å; T330-A359 HydrophobicContact CG2-CB 4.31Å; V355-A359 WeakPolarHBondContact O-CB 3.42Å; V355-A359 PolarHBondContact O-N 3.13Å; E356-A359 PolarHBondContact O-N 2.69Å; A359-P363 WeakPolarHBondContact O-CD 3.5Å; A359-M366 HydrophobicContact CB-SD 4.34Å |
| 360 | K | 95.8 | Very high | 97.9 | Very high | 42 Ų | 42 | 65 Ų | 65 | 18% | 0.183 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -64.2 | -43.9 | 174.9 | -77.1 | 175.6 | 169.1 | 177 | 0 | 113.5 | Q302 V303 E306 E356 F358 P363 | Q302-K360 VanDerWaalsContact CD-CE 3.41Å; V303-K360 HydrophobicContact CG2-CG 3.73Å; E306-K360 WeakPolarHBondContact OE1-CE 3.4Å; E306-K360 IonicContact OE1-NZ 3.57Å; E306-K360 PolarHBondContact OE1-NZ 3.08Å; E306-K360 VanDerWaalsContact OE1-NZ 3.15Å; E306-K360 WeakPolarHBondContact OE2-CD 3.5Å; E306-K360 WeakPolarHBondContact OE2-CE 3.16Å; E356-K360 HydrophobicContact CG-CD 4.15Å; E356-K360 WeakPolarHBondContact O-CB 3.24Å; E356-K360 WeakPolarHBondContact O-CG 3.43Å; E356-K360 PolarHBondContact O-N 3.37Å; E356-K360 WeakPolarHBondContact OE1-CE 3.49Å; E356-K360 IonicContact OE1-NZ 2.83Å; E356-K360 PolarHBondContact OE1-NZ 2.83Å; F358-K360 PolarHBondContact O-N 3.03Å; K360-P363 WeakPolarHBondContact O-CD 3.13Å |
| 361 | K | 96.1 | Very high | 97.9 | Very high | 148 Ų | 148 | 61.9 Ų | 61.9 | 64% | 0.643 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -73.7 | -30.8 | -178.8 | -74.1 | -177.8 | 176.1 | -178.3 | 0 | 112.4 | L357 F358 P363 | L357-K361 HydrophobicContact CD1-CD 4.28Å; L357-K361 HydrophobicContact CG-CD 4.43Å; L357-K361 WeakPolarHBondContact O-CB 3.5Å; L357-K361 WeakPolarHBondContact O-CG 3.33Å; L357-K361 PolarHBondContact O-N 2.92Å; F358-K361 PolarHBondContact O-N 3.04Å; K361-P363 VanDerWaalsContact C-CD 3.45Å |
| 362 | N | 97.5 | Very high | 97.8 | Very high | 54 Ų | 54 | 65 Ų | 65 | 29% | 0.289 | 30% | 0.297 | S | S | . | . | trans | -129.9 | 47.8 | -167.5 | -53.5 | -77 | 0 | 0 | 0 | 114.3 | F358 K364 Q365 M366 | F358-N362 HydrophobicContact CD1-CB 4.49Å; F358-N362 HydrophobicContact CE1-CB 4.04Å; F358-N362 HydrophobicContact CZ-CB 4.08Å; F358-N362 WeakPolarHBondContact O-CB 3.41Å; F358-N362 PolarHBondContact O-N 3.01Å; F358-N362 PolarHBondContact O-ND2 3.1Å; F358-N362 VanDerWaalsContact O-ND2 3.13Å; N362-K364 VanDerWaalsContact C-N 3.34Å; N362-K364 PolarHBondContact O-N 3.28Å; N362-Q365 HydrophobicContact CB-CB 3.95Å; N362-Q365 WeakPolarHBondContact O-CB 3.42Å; N362-Q365 PolarHBondContact O-N 2.86Å; N362-M366 WeakPolarHBondContact O-CG 3.24Å; N362-M366 PolarHBondContact O-N 2.83Å | ||
| 363 | P | 97.1 | Very high | 97.8 | Very high | 19 Ų | 19 | 65.8 Ų | 65.8 | 12% | 0.123 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -62.9 | -39 | -171.8 | 24.5 | -34.7 | 0 | 0 | 0 | 113.3 | V303 A308 L309 F326 A359 K360 K361 Q365 M366 L367 | V303-P363 HydrophobicContact CG1-CB 4.28Å; A308-P363 HydrophobicContact CB-CG 4.28Å; L309-P363 HydrophobicContact CD2-CB 3.95Å; F326-P363 HydrophobicContact CD2-CB 4.44Å; F326-P363 HydrophobicContact CE2-CB 3.8Å; F326-P363 HydrophobicContact CZ-CB 4.39Å; A359-P363 WeakPolarHBondContact O-CD 3.5Å; K360-P363 WeakPolarHBondContact O-CD 3.13Å; K361-P363 VanDerWaalsContact C-CD 3.45Å; P363-Q365 VanDerWaalsContact C-N 3.3Å; P363-Q365 PolarHBondContact O-N 3.02Å; P363-M366 WeakPolarHBondContact O-CB 3.34Å; P363-M366 PolarHBondContact O-N 3.25Å; P363-L367 PolarHBondContact O-N 2.94Å |
| 364 | K | 96.9 | Very high | 97.7 | Very high | 134 Ų | 134 | 59.4 Ų | 59.4 | 58% | 0.583 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -62.4 | -37 | 174.2 | -175.4 | 179.1 | -179.3 | 179.8 | 0 | 112.5 | N362 R368 | N362-K364 VanDerWaalsContact C-N 3.34Å; N362-K364 PolarHBondContact O-N 3.28Å; K364-R368 WeakPolarHBondContact O-CB 3.42Å; K364-R368 PolarHBondContact O-N 3.46Å |
| 365 | Q | 98 | Very high | 97.6 | Very high | 70 Ų | 70 | 60.6 Ų | 60.6 | 33% | 0.327 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -71 | -36.3 | 179 | -167.3 | 178 | 23.3 | 0 | 0 | 111 | F358 N362 P363 R368 R369 | F358-Q365 VanDerWaalsContact CZ-OE1 3.28Å; N362-Q365 HydrophobicContact CB-CB 3.95Å; N362-Q365 WeakPolarHBondContact O-CB 3.42Å; N362-Q365 PolarHBondContact O-N 2.86Å; P363-Q365 VanDerWaalsContact C-N 3.3Å; P363-Q365 PolarHBondContact O-N 3.02Å; Q365-R368 PolarHBondContact O-N 2.91Å; Q365-R369 HydrophobicContact CG-CG 4.46Å; Q365-R369 WeakPolarHBondContact O-CB 3.43Å; Q365-R369 VanDerWaalsContact O-CG 3.31Å; Q365-R369 WeakPolarHBondContact O-CG 3.45Å; Q365-R369 PolarHBondContact O-N 2.9Å |
| 366 | M | 98.6 | Very high | 97.4 | Very high | 2 Ų | 2 | 66.2 Ų | 66.2 | 1% | 0.01 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -57.7 | -53.7 | 173.7 | -62.3 | -84.8 | 65.4 | 0 | 0 | 110.8 | F326 A329 H333 F358 A359 N362 P363 R368 R369 L370 | F326-M366 HydrophobicContact CD2-CB 4.26Å; F326-M366 HydrophobicContact CE2-CB 3.92Å; F326-M366 HydrophobicContact CE2-CG 4.07Å; A329-M366 HydrophobicContact CB-CB 3.98Å; A329-M366 WeakPolarHBondContact CB-O 3.46Å; H333-M366 HydrophobicContact CB-CE 3.69Å; H333-M366 HydrophobicContact CB-SD 4.05Å; F358-M366 HydrophobicContact CD1-CE 3.8Å; F358-M366 HydrophobicContact CD1-CG 4.49Å; F358-M366 HydrophobicContact CD1-SD 3.72Å; F358-M366 HydrophobicContact CE1-CE 3.47Å; F358-M366 VanDerWaalsContact CE1-CE 3.47Å; F358-M366 HydrophobicContact CE1-CG 4.43Å; F358-M366 HydrophobicContact CE1-SD 3.93Å; A359-M366 HydrophobicContact CB-SD 4.34Å; N362-M366 WeakPolarHBondContact O-CG 3.24Å; N362-M366 PolarHBondContact O-N 2.83Å; P363-M366 WeakPolarHBondContact O-CB 3.34Å; P363-M366 PolarHBondContact O-N 3.25Å; M366-R368 PolarHBondContact O-N 3.32Å; M366-R369 PolarHBondContact O-N 3.21Å; M366-L370 PolarHBondContact O-N 2.9Å; M366-L370 VanDerWaalsContact O-N 3.07Å |
| 367 | L | 98.7 | Very high | 97 | Very high | 7 Ų | 7 | 66.9 Ų | 66.9 | 4% | 0.037 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -58.9 | -44.4 | 178.5 | -67.7 | 172.3 | 0 | 0 | 0 | 112.3 | L309 E312 V322 E325 F326 P363 R369 L370 E371 | L309-L367 HydrophobicContact CD2-CD1 4.45Å; E312-L367 HydrophobicContact CB-CD1 4.49Å; E312-L367 HydrophobicContact CG-CD1 3.72Å; V322-L367 HydrophobicContact CG1-CD1 4.41Å; E325-L367 HydrophobicContact CB-CD2 3.73Å; F326-L367 HydrophobicContact CB-CD2 4.05Å; F326-L367 HydrophobicContact CD2-CD2 4.47Å; F326-L367 HydrophobicContact CD2-CG 4.36Å; P363-L367 PolarHBondContact O-N 2.94Å; L367-R369 PolarHBondContact O-N 2.82Å; L367-L370 PolarHBondContact O-N 3.1Å; L367-E371 PolarHBondContact O-N 3.41Å |
| 368 | R | 98.4 | Very high | 96.5 | Very high | 140 Ų | 140 | 67.9 Ų | 67.9 | 53% | 0.528 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -61.7 | -42.3 | 177.1 | -174.8 | -170.3 | -68.3 | 169 | -7.1 | 112.3 | K364 Q365 M366 L370 E371 V372 | K364-R368 WeakPolarHBondContact O-CB 3.42Å; K364-R368 PolarHBondContact O-N 3.46Å; Q365-R368 PolarHBondContact O-N 2.91Å; M366-R368 PolarHBondContact O-N 3.32Å; R368-L370 VanDerWaalsContact C-N 3.32Å; R368-E371 PolarHBondContact O-N 3.19Å; R368-V372 WeakPolarHBondContact O-CG2 3.5Å; R368-V372 PolarHBondContact O-N 3.4Å |
| 369 | R | 98.2 | Very high | 96 | Very high | 96 Ų | 96 | 69.8 Ų | 69.8 | 36% | 0.362 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -63.2 | -40.9 | 179 | -77.7 | 177.7 | -179.9 | 176.4 | 2.6 | 111.2 | Q365 M366 L367 F373 | Q365-R369 HydrophobicContact CG-CG 4.46Å; Q365-R369 WeakPolarHBondContact O-CB 3.43Å; Q365-R369 VanDerWaalsContact O-CG 3.31Å; Q365-R369 WeakPolarHBondContact O-CG 3.45Å; Q365-R369 PolarHBondContact O-N 2.9Å; M366-R369 PolarHBondContact O-N 3.21Å; L367-R369 PolarHBondContact O-N 2.82Å; R369-F373 WeakPolarHBondContact O-CB 3.28Å; R369-F373 PolarHBondContact O-N 2.98Å |
| 370 | L | 98.6 | Very high | 94.8 | Very high | 6 Ų | 6 | 72.8 Ų | 72.8 | 3% | 0.031 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -61.6 | -48.7 | 173.7 | 178.3 | 64.1 | 0 | 0 | 0 | 111.3 | E325 V328 A329 L332 M366 L367 R368 V372 F373 L374 | E325-L370 HydrophobicContact CB-CD2 4.46Å; E325-L370 VanDerWaalsContact O-CD2 3.3Å; E325-L370 WeakPolarHBondContact O-CD2 3.32Å; V328-L370 HydrophobicContact CB-CD2 3.89Å; V328-L370 HydrophobicContact CG1-CD1 3.72Å; V328-L370 HydrophobicContact CG1-CD2 3.9Å; V328-L370 HydrophobicContact CG1-CG 4.48Å; A329-L370 HydrophobicContact CB-CB 3.79Å; A329-L370 HydrophobicContact CB-CD2 4.03Å; A329-L370 HydrophobicContact CB-CG 4.48Å; L332-L370 HydrophobicContact CD2-CB 4.43Å; L332-L370 HydrophobicContact CD2-CD1 3.92Å; M366-L370 PolarHBondContact O-N 2.9Å; M366-L370 VanDerWaalsContact O-N 3.07Å; L367-L370 PolarHBondContact O-N 3.1Å; R368-L370 VanDerWaalsContact C-N 3.32Å; L370-V372 VanDerWaalsContact C-N 3.32Å; L370-V372 PolarHBondContact O-N 3.4Å; L370-F373 PolarHBondContact O-N 2.89Å; L370-L374 HydrophobicContact CD1-CD1 3.95Å; L370-L374 HydrophobicContact CD1-CD2 4.35Å; L370-L374 HydrophobicContact CD1-CG 3.94Å; L370-L374 HydrophobicContact CG-CD1 3.94Å; L370-L374 HydrophobicContact CG-CG 4.29Å; L370-L374 WeakPolarHBondContact O-CG 3.42Å; L370-L374 PolarHBondContact O-N 3.46Å |
| 371 | E | 97.8 | Very high | 92.9 | Very high | 94 Ų | 94 | 72.9 Ų | 72.9 | 44% | 0.439 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -56.5 | -45.9 | 179.6 | -172.6 | -169.1 | 165.3 | 0 | 0 | 111.9 | L367 R368 K375 | L367-E371 PolarHBondContact O-N 3.41Å; R368-E371 PolarHBondContact O-N 3.19Å; E371-K375 HydrophobicContact CG-CD 4.28Å; E371-K375 WeakPolarHBondContact O-CB 3.33Å; E371-K375 VanDerWaalsContact O-CG 3.32Å; E371-K375 WeakPolarHBondContact O-CG 3.38Å; E371-K375 PolarHBondContact O-N 3.46Å; E371-K375 VanDerWaalsContact O-N 3.08Å; E371-K375 IonicContact OE1-NZ 3.34Å; E371-K375 PolarHBondContact OE1-NZ 3.48Å |
| 372 | V | 97.9 | Very high | 90.8 | Very high | 67 Ų | 67 | 73.2 Ų | 73.2 | 41% | 0.406 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -62.7 | -47.6 | 176.7 | 172 | 0 | 0 | 0 | 0 | 110.8 | R368 L370 L374 K375 E376 | R368-V372 WeakPolarHBondContact O-CG2 3.5Å; R368-V372 PolarHBondContact O-N 3.4Å; L370-V372 VanDerWaalsContact C-N 3.32Å; L370-V372 PolarHBondContact O-N 3.4Å; V372-L374 PolarHBondContact O-N 3Å; V372-K375 PolarHBondContact O-N 3.11Å; V372-E376 HydrophobicContact CG1-CG 4.29Å; V372-E376 WeakPolarHBondContact CG1-OE1 3.22Å; V372-E376 WeakPolarHBondContact O-CG 3.29Å; V372-E376 PolarHBondContact O-N 3.44Å |
| 373 | F | 97.8 | Very high | 88.4 | Confident | 46 Ų | 46 | 76.3 Ų | 76.3 | 20% | 0.202 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -58.8 | -44.6 | 179.8 | 174.8 | -93.9 | 0 | 0 | 0 | 112.5 | L272 L332 R369 L370 R377 | L272-F373 HydrophobicContact CB-CE1 4.19Å; L272-F373 HydrophobicContact CD1-CE1 3.92Å; L272-F373 HydrophobicContact CD1-CZ 3.91Å; L272-F373 HydrophobicContact CD2-CE1 4.1Å; L272-F373 HydrophobicContact CG-CE1 4.28Å; L332-F373 HydrophobicContact CD1-CD1 4.1Å; L332-F373 HydrophobicContact CD1-CD2 4.12Å; L332-F373 HydrophobicContact CD1-CE1 4.1Å; L332-F373 HydrophobicContact CD1-CE2 4.1Å; L332-F373 HydrophobicContact CD1-CG 4.11Å; L332-F373 HydrophobicContact CD1-CZ 4.1Å; L332-F373 HydrophobicContact CD2-CB 3.74Å; L332-F373 HydrophobicContact CD2-CD1 3.93Å; L332-F373 HydrophobicContact CD2-CD2 4.38Å; L332-F373 HydrophobicContact CD2-CG 3.75Å; R369-F373 WeakPolarHBondContact O-CB 3.28Å; R369-F373 PolarHBondContact O-N 2.98Å; L370-F373 PolarHBondContact O-N 2.89Å; F373-R377 WeakPolarHBondContact O-CB 3.35Å; F373-R377 PolarHBondContact O-N 3.04Å; F373-R377 VanDerWaalsContact O-N 3.12Å |
| 374 | L | 96.6 | Very high | 85.9 | Confident | 20 Ų | 20 | 87 Ų | 87 | 11% | 0.105 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -66.6 | -41.2 | 178.9 | -65.7 | 178.2 | 0 | 0 | 0 | 111.5 | E268 T269 L370 V372 R377 Q378 | E268-L374 WeakPolarHBondContact O-CD2 3.35Å; T269-L374 HydrophobicContact CG2-CD1 4.21Å; T269-L374 HydrophobicContact CG2-CD2 4.42Å; L370-L374 HydrophobicContact CD1-CD1 3.95Å; L370-L374 HydrophobicContact CD1-CD2 4.35Å; L370-L374 HydrophobicContact CD1-CG 3.94Å; L370-L374 HydrophobicContact CG-CD1 3.94Å; L370-L374 HydrophobicContact CG-CG 4.29Å; L370-L374 WeakPolarHBondContact O-CG 3.42Å; L370-L374 PolarHBondContact O-N 3.46Å; V372-L374 PolarHBondContact O-N 3Å; L374-R377 PolarHBondContact O-N 2.98Å; L374-Q378 WeakPolarHBondContact O-CG 3.43Å; L374-Q378 PolarHBondContact O-N 3.26Å |
| 375 | K | 95.6 | Very high | 83.2 | Confident | 117 Ų | 117 | 84 Ų | 84 | 51% | 0.509 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -62.6 | -45.5 | 175.9 | -76.7 | 175.2 | 173.5 | 175.2 | 0 | 112.9 | E371 V372 R377 Q378 A379 | E371-K375 HydrophobicContact CG-CD 4.28Å; E371-K375 WeakPolarHBondContact O-CB 3.33Å; E371-K375 VanDerWaalsContact O-CG 3.32Å; E371-K375 WeakPolarHBondContact O-CG 3.38Å; E371-K375 PolarHBondContact O-N 3.46Å; E371-K375 VanDerWaalsContact O-N 3.08Å; E371-K375 IonicContact OE1-NZ 3.34Å; E371-K375 PolarHBondContact OE1-NZ 3.48Å; V372-K375 PolarHBondContact O-N 3.11Å; K375-R377 VanDerWaalsContact C-N 3.26Å; K375-R377 PolarHBondContact O-N 3.23Å; K375-Q378 PolarHBondContact O-N 2.94Å; K375-A379 WeakPolarHBondContact O-CB 3.26Å; K375-A379 PolarHBondContact O-N 3.36Å |
| 376 | E | 94.2 | Very high | 80.6 | Confident | 119 Ų | 119 | 87.4 Ų | 87.4 | 56% | 0.556 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -60.8 | -38.8 | 177.7 | -74.2 | 176.1 | 172.1 | 0 | 0 | 111.6 | V372 A379 G381 | V372-E376 HydrophobicContact CG1-CG 4.29Å; V372-E376 WeakPolarHBondContact CG1-OE1 3.22Å; V372-E376 WeakPolarHBondContact O-CG 3.29Å; V372-E376 PolarHBondContact O-N 3.44Å; E376-A379 PolarHBondContact O-N 3.29Å; E376-G381 PolarHBondContact O-N 3.33Å |
| 377 | R | 89.9 | Confident | 77.4 | Confident | 77 Ų | 77 | 92.2 Ų | 92.2 | 29% | 0.291 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -66.7 | -42.6 | 176.7 | -167.3 | 179.9 | -146.7 | 152.2 | 7.2 | 112.6 | P271 L272 D275 F373 L374 K375 A379 G380 | P271-R377 VanDerWaalsContact C-NH1 3.29Å; P271-R377 PolarHBondContact O-NH2 3.18Å; L272-R377 VanDerWaalsContact CA-NH1 3.25Å; D275-R377 IonicContact OD1-NH2 3.66Å; D275-R377 IonicContact OD2-CZ 2.74Å; D275-R377 IonicContact OD2-NH1 2.65Å; D275-R377 IonicContact OD2-NH2 2.89Å; D275-R377 PolarHBondContact OD2-NH2 3.34Å; F373-R377 WeakPolarHBondContact O-CB 3.35Å; F373-R377 PolarHBondContact O-N 3.04Å; F373-R377 VanDerWaalsContact O-N 3.12Å; L374-R377 PolarHBondContact O-N 2.98Å; K375-R377 VanDerWaalsContact C-N 3.26Å; K375-R377 PolarHBondContact O-N 3.23Å; R377-A379 VanDerWaalsContact C-N 3.28Å; R377-A379 PolarHBondContact O-N 3.34Å; R377-G380 PolarHBondContact O-N 3.02Å |
| 378 | Q | 87.1 | Confident | 74.7 | Confident | 119 Ų | 119 | 98 Ų | 98 | 56% | 0.556 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -64.4 | -35 | 176.2 | -72.1 | 174.9 | 4.7 | 0 | 0 | 111.9 | E268 L374 K375 G380 | E268-Q378 PolarHBondContact OE1-NE2 2.87Å; L374-Q378 WeakPolarHBondContact O-CG 3.43Å; L374-Q378 PolarHBondContact O-N 3.26Å; K375-Q378 PolarHBondContact O-N 2.94Å; Q378-G380 PolarHBondContact O-N 3.19Å |
| 379 | A | 86.8 | Confident | 71.5 | Confident | 89 Ų | 89 | 97.9 Ų | 97.9 | 74% | 0.736 | 56% | 0.555 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.4 | 3.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | K375 E376 R377 G381 | K375-A379 WeakPolarHBondContact O-CB 3.26Å; K375-A379 PolarHBondContact O-N 3.36Å; E376-A379 PolarHBondContact O-N 3.29Å; R377-A379 VanDerWaalsContact C-N 3.28Å; R377-A379 PolarHBondContact O-N 3.34Å; A379-G381 VanDerWaalsContact C-N 3.29Å; A379-G381 PolarHBondContact O-N 3.09Å |
| 380 | G | 73.8 | Confident | 68.7 | Low | 62 Ų | 62 | 98.6 Ų | 98.6 | 64% | 0.639 | 57% | 0.573 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 72.9 | 19.1 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114 | R377 Q378 I382 | R377-G380 PolarHBondContact O-N 3.02Å; Q378-G380 PolarHBondContact O-N 3.19Å; G380-I382 PolarHBondContact O-N 3.4Å |
| 381 | G | 55.9 | Low | 65.7 | Low | 44 Ų | 44 | 107.1 Ų | 107.1 | 45% | 0.454 | 61% | 0.612 | S | S | . | * | trans | -65 | 113.3 | -179.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | E376 A379 | E376-G381 PolarHBondContact O-N 3.33Å; A379-G381 VanDerWaalsContact C-N 3.29Å; A379-G381 PolarHBondContact O-N 3.09Å | ||
| 382 | I | 50.9 | Low | 62.5 | Low | 156 Ų | 156 | 106.7 Ų | 106.7 | 80% | 0.8 | 63% | 0.625 | S | S | * | * | trans | -58.5 | 126.3 | 161.4 | -60.9 | 173.3 | 0 | 0 | 0 | 106.8 | G380 R384 | G380-I382 PolarHBondContact O-N 3.4Å; I382-R384 PolarHBondContact O-N 3.22Å | ||
| 383 | P | 47.1 | Very low | 59.4 | Low | 119 Ų | 119 | 112.3 Ų | 112.3 | 77% | 0.773 | 65% | 0.647 | S | S | * | * | trans | -60.5 | 113.8 | 179.4 | -19 | 29.6 | 0 | 0 | 0 | 109.6 | G385 | P383-G385 VanDerWaalsContact C-N 3.35Å; P383-G385 PolarHBondContact O-N 3.47Å | ||
| 384 | R | 44.8 | Very low | 56.3 | Low | 242 Ų | 242 | 118.7 Ų | 118.7 | 91% | 0.913 | 68% | 0.678 | S | S | * | * | trans | -67.2 | 99.9 | 164.5 | -90.5 | -175.6 | 174.1 | 172.2 | -1.2 | 107.1 | I382 T386 | I382-R384 PolarHBondContact O-N 3.22Å; R384-T386 PolarHBondContact O-N 3.18Å | ||
| 385 | G | 41.3 | Very low | 53.3 | Low | 71 Ų | 71 | 123.5 Ų | 123.5 | 73% | 0.732 | 71% | 0.71 | S | S | * | * | trans | -54.4 | 120.2 | 164.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | P383 S387 | P383-G385 VanDerWaalsContact C-N 3.35Å; P383-G385 PolarHBondContact O-N 3.47Å; G385-S387 PolarHBondContact O-N 3.47Å | ||
| 386 | T | 42.7 | Very low | 50.3 | Low | 142 Ų | 142 | 123.1 Ų | 123.1 | 87% | 0.871 | 72% | 0.722 | S | S | * | * | trans | -67.8 | 97.8 | 165.7 | 45.3 | 0 | 0 | 0 | 0 | 107.8 | R384 | R384-T386 PolarHBondContact O-N 3.18Š| ||
| 387 | S | 30.5 | Very low | 47.6 | Very low | 104 Ų | 104 | 123.3 Ų | 123.3 | 73% | 0.727 | 73% | 0.734 | S | S | * | * | trans | -130.6 | 116.8 | 159.5 | -162.7 | 0 | 0 | 0 | 0 | 107.2 | G385 | G385-S387 PolarHBondContact O-N 3.47Š| ||
| 388 | P | 43.5 | Very low | 44.8 | Very low | 128 Ų | 128 | 125.4 Ų | 125.4 | 83% | 0.831 | 76% | 0.76 | S | S | * | * | trans | -87.5 | 106.1 | 165.2 | 31.3 | -21.4 | 0 | 0 | 0 | 107.1 | ||||
| 389 | D | 29.7 | Very low | 42.2 | Very low | 137 Ų | 137 | 128.3 Ų | 128.3 | 73% | 0.733 | 78% | 0.778 | S | S | * | * | trans | -136.6 | 113.2 | 153.7 | -149.4 | -7.3 | 0 | 0 | 0 | 109 | Q391 | D389-Q391 PolarHBondContact O-N 2.68Š| ||
| 390 | P | 40.4 | Very low | 39.5 | Very low | 112 Ų | 112 | 127.8 Ų | 127.8 | 73% | 0.727 | 78% | 0.781 | S | S | * | * | trans | -91.8 | 95.7 | -179 | 33.1 | -26.4 | 0 | 0 | 0 | 108.9 | ||||
| 391 | Q | 34.8 | Very low | 37.5 | Very low | 184 Ų | 184 | 128.8 Ų | 128.8 | 86% | 0.86 | 79% | 0.792 | S | S | * | * | trans | -155.3 | 131.9 | 159.3 | -113.6 | 165.3 | 21.9 | 0 | 0 | 113.4 | D389 | D389-Q391 PolarHBondContact O-N 2.68Š| ||
| 392 | A | 31.2 | Very low | 36.4 | Very low | 86 Ų | 86 | 132.3 Ų | 132.3 | 71% | 0.711 | 81% | 0.809 | S | S | * | * | trans | 72.2 | 100.8 | 166.2 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 393 | Q | 33 | Very low | 35.5 | Very low | 184 Ų | 184 | 136.5 Ų | 136.5 | 86% | 0.86 | 82% | 0.815 | S | S | * | * | 179.6 | 110 | 99.5 | -92.7 | 163.5 | 14.1 | 0 | 0 | 110.6 | |||||
| 394 | Q | 33.1 | Very low | 34.8 | Very low | 181 Ų | 181 | 135.7 Ų | 135.7 | 85% | 0.846 | 82% | 0.819 | S | S | * | * | trans | -65.8 | 144.9 | 157 | -73.1 | -109.1 | -15.3 | 0 | 0 | 109.7 | ||||
| 395 | P | 33.7 | Very low | 34.2 | Very low | 121 Ų | 121 | 128 Ų | 128 | 79% | 0.786 | 82% | 0.815 | S | S | * | * | trans | -115.9 | 128.6 | 146.4 | 14.5 | 4.3 | 0 | 0 | 0 | 111 | ||||
| 396 | S | 31.2 | Very low | 33.9 | Very low | 108 Ų | 108 | 134.2 Ų | 134.2 | 76% | 0.755 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 159.5 | 171.6 | -57.2 | 0 | 0 | 0 | 0 | 112.9 | ||
| 397 | P | 39.2 | Very low | 33.4 | Very low | 124 Ų | 124 | 131.1 Ų | 131.1 | 81% | 0.805 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -89.8 | 140.8 | -165.7 | 34.9 | -31.8 | 0 | 0 | 0 | 112.8 | ||
| 398 | S | 30 | Very low | 33.5 | Very low | 120 Ų | 120 | 135.6 Ų | 135.6 | 84% | 0.839 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -93.9 | 125.3 | 163.2 | 51.9 | 0 | 0 | 0 | 0 | 110.3 | ||
| 399 | L | 33.3 | Very low | 32.9 | Very low | 180 Ų | 180 | 133.2 Ų | 133.2 | 94% | 0.942 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 140.5 | 172.3 | -82.2 | 88.4 | 0 | 0 | 0 | 112.2 | ||
| 400 | G | 30.2 | Very low | 33.1 | Very low | 78 Ų | 78 | 132.8 Ų | 132.8 | 80% | 0.804 | 84% | 0.839 | S | S | * | * | trans | 170.1 | 117.8 | 157.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 401 | G | 30.2 | Very low | 32.9 | Very low | 83 Ų | 83 | 139 Ų | 139 | 86% | 0.856 | 85% | 0.848 | S | S | * | * | trans | 107 | 97.9 | 147.5 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 402 | S | 33.3 | Very low | 32.7 | Very low | 118 Ų | 118 | 133.6 Ų | 133.6 | 83% | 0.825 | 84% | 0.843 | S | S | * | * | trans | -75.3 | 157.6 | 168.1 | -51.2 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 403 | R | 33 | Very low | 32.9 | Very low | 244 Ų | 244 | 139.2 Ų | 139.2 | 92% | 0.921 | 85% | 0.851 | S | S | * | * | trans | 97 | 116.9 | 145.2 | -82.5 | -179.4 | 166.3 | 176.7 | -3.5 | 120.8 | ||||
| 404 | A | 32.2 | Very low | 32.7 | Very low | 103 Ų | 103 | 139.7 Ų | 139.7 | 85% | 0.851 | 85% | 0.853 | S | S | * | * | 84.6 | 122.9 | 125.4 | 0 | 0 | 0 | 0 | 0 | 119.4 | |||||
| 405 | G | 32.4 | Very low | 32.9 | Very low | 81 Ų | 81 | 139.8 Ų | 139.8 | 84% | 0.835 | 86% | 0.856 | S | S | * | * | trans | 173.1 | 91.9 | 166.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 406 | M | 34.2 | Very low | 32.6 | Very low | 200 Ų | 200 | 141.9 Ų | 141.9 | 99% | 0.985 | 86% | 0.855 | S | S | * | * | trans | -66.9 | 143.5 | 176.5 | -156.2 | 104.7 | 73.1 | 0 | 0 | 111.7 | ||||
| 407 | G | 32.3 | Very low | 32.4 | Very low | 77 Ų | 77 | 146 Ų | 146 | 79% | 0.794 | 86% | 0.86 | S | S | * | * | trans | -174.3 | 103.8 | 169.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 408 | Q | 33.3 | Very low | 32.2 | Very low | 199 Ų | 199 | 145.3 Ų | 145.3 | 93% | 0.93 | 85% | 0.853 | S | S | * | * | trans | -64.8 | 148.7 | -180 | -83 | 168.9 | -24.2 | 0 | 0 | 114.9 | ||||
| 409 | G | 30.1 | Very low | 32.1 | Very low | 77 Ų | 77 | 142.3 Ų | 142.3 | 79% | 0.794 | 84% | 0.841 | S | S | * | * | 99.2 | 108.1 | 126.7 | 0 | 0 | 0 | 0 | 0 | 118.2 | |||||
| 410 | S | 33.8 | Very low | 31.9 | Very low | 129 Ų | 129 | 140.4 Ų | 140.4 | 90% | 0.902 | 84% | 0.836 | S | S | * | * | 176.6 | 152.5 | 99.9 | -165.3 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 411 | R | 36 | Very low | 31.8 | Very low | 241 Ų | 241 | 141.2 Ų | 141.2 | 91% | 0.909 | 83% | 0.829 | S | S | * | * | trans | -64.7 | 136.4 | -168.5 | -73.8 | 162.9 | 164.2 | 173.2 | -5.5 | 114.4 | ||||
| 412 | G | 30.6 | Very low | 31.8 | Very low | 72 Ų | 72 | 144.2 Ų | 144.2 | 74% | 0.742 | 83% | 0.825 | S | S | * | * | 78.1 | 102.8 | 107.6 | 0 | 0 | 0 | 0 | 0 | 118.7 | |||||
| 413 | K | 34.9 | Very low | 31.8 | Very low | 203 Ų | 203 | 146.6 Ų | 146.6 | 88% | 0.883 | 83% | 0.828 | S | S | * | * | -164.4 | 100.1 | 124.1 | -115.7 | 173.6 | 179.6 | 176 | 0 | 109.8 | |||||
| 414 | E | 30.1 | Very low | 32 | Very low | 195 Ų | 195 | 140.5 Ų | 140.5 | 91% | 0.911 | 82% | 0.82 | S | S | * | * | trans | -68.9 | 131 | 157.6 | -80.1 | 175.9 | 144 | 0 | 0 | 108.5 | ||||
| 415 | M | 36 | Very low | 32.6 | Very low | 182 Ų | 182 | 141.2 Ų | 141.2 | 90% | 0.897 | 82% | 0.816 | S | S | * | * | trans | -119.2 | 115.5 | 152.3 | -75.8 | -165.4 | -74.2 | 0 | 0 | 107.4 | ||||
| 416 | H | 28.4 | Very low | 32.9 | Very low | 166 Ų | 166 | 144.7 Ų | 144.7 | 77% | 0.769 | 82% | 0.815 | S | S | * | * | trans | -70 | 127.7 | 174.1 | -147.9 | -85.2 | 0 | 0 | 0 | 108.5 | ||||
| 417 | F | 27.8 | Very low | 33 | Very low | 195 Ų | 195 | 143.8 Ų | 143.8 | 86% | 0.855 | 81% | 0.811 | S | S | * | * | trans | -129.6 | 96.8 | 164.1 | -169.2 | -101.3 | 0 | 0 | 0 | 108.8 | ||||
| 418 | T | 34.5 | Very low | 33.2 | Very low | 108 Ų | 108 | 149.2 Ų | 149.2 | 66% | 0.663 | 82% | 0.815 | S | S | * | * | trans | -73 | 131.8 | 166.4 | 24.8 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 419 | G | 26.9 | Very low | 33.3 | Very low | 57 Ų | 57 | 143.3 Ų | 143.3 | 59% | 0.588 | 81% | 0.808 | S | S | * | * | trans | -93.4 | -164.7 | -173.9 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 420 | V | 29.2 | Very low | 33.7 | Very low | 140 Ų | 140 | 148.8 Ų | 148.8 | 85% | 0.848 | 81% | 0.813 | S | S | * | * | trans | 90.3 | 109.6 | 156.2 | -174.8 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 421 | C | 28.9 | Very low | 33.8 | Very low | 96 Ų | 96 | 147.6 Ų | 147.6 | 65% | 0.649 | 81% | 0.811 | S | S | * | * | 149.2 | 131 | 115 | -107 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 422 | D | 30.3 | Very low | 33.9 | Very low | 146 Ų | 146 | 146.6 Ų | 146.6 | 78% | 0.781 | 81% | 0.807 | S | S | * | * | trans | 82.1 | 121.2 | 136.9 | -54.6 | -26.4 | 0 | 0 | 0 | 123 | ||||
| 423 | L | 33.8 | Very low | 34.2 | Very low | 167 Ų | 167 | 150.8 Ų | 150.8 | 87% | 0.874 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 141.8 | 162.3 | -75.4 | 143.9 | 0 | 0 | 0 | 111 | ||
| 424 | P | 37.1 | Very low | 34.7 | Very low | 116 Ų | 116 | 152.5 Ų | 152.5 | 75% | 0.753 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -83.9 | 147.6 | 159 | 16.8 | -3.8 | 0 | 0 | 0 | 111.7 | ||
| 425 | P | 43.6 | Very low | 35 | Very low | 118 Ų | 118 | 150.4 Ų | 150.4 | 77% | 0.766 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -86.5 | 164.4 | -168.9 | 36.2 | -37.1 | 0 | 0 | 0 | 114.1 | ||
| 426 | D | 38.3 | Very low | 34.9 | Very low | 154 Ų | 154 | 148.7 Ų | 148.7 | 82% | 0.824 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -49.2 | 142.5 | 166 | -66.9 | -51.6 | 0 | 0 | 0 | 112.9 | ||
| 427 | M | 36.2 | Very low | 35.3 | Very low | 181 Ų | 181 | 147.8 Ų | 147.8 | 89% | 0.892 | 82% | 0.823 | S | S | * | * | trans | -126.7 | 93.7 | 161.3 | -76 | -76.6 | -71 | 0 | 0 | 108.1 | ||||
| 428 | E | 37.1 | Very low | 35.7 | Very low | 191 Ų | 191 | 145 Ų | 145 | 89% | 0.893 | 82% | 0.821 | S | S | * | * | trans | -66.1 | 140.9 | 151.7 | -77.4 | -180 | 148.9 | 0 | 0 | 109.3 | ||||
| 429 | G | 35.9 | Very low | 35.8 | Very low | 76 Ų | 76 | 147.3 Ų | 147.3 | 78% | 0.784 | 83% | 0.831 | S | S | * | * | trans | -171.1 | 88.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 430 | E | 38.7 | Very low | 36.4 | Very low | 192 Ų | 192 | 153.3 Ų | 153.3 | 90% | 0.897 | 85% | 0.848 | S | S | * | * | trans | -55.6 | 141.6 | 159.6 | -75.1 | -176 | 127.6 | 0 | 0 | 111.1 | ||||
| 431 | A | 34.8 | Very low | 36.9 | Very low | 104 Ų | 104 | 154.3 Ų | 154.3 | 86% | 0.86 | 85% | 0.847 | S | S | * | * | trans | -163.7 | 140.7 | 130.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 432 | R | 39.4 | Very low | 37.5 | Very low | 220 Ų | 220 | 158.8 Ų | 158.8 | 83% | 0.83 | 86% | 0.863 | S | S | * | * | trans | -78.4 | 162.4 | -177.8 | -67.8 | 171.5 | 167.6 | 174.7 | -3.7 | 112.9 | ||||
| 433 | L | 35.9 | Very low | 38.1 | Very low | 159 Ų | 159 | 159.8 Ų | 159.8 | 83% | 0.832 | 87% | 0.87 | S | S | * | * | trans | 29.2 | 116.2 | 144.2 | -77.7 | 142.4 | 0 | 0 | 0 | 117.7 | ||||
| 434 | I | 46.6 | Very low | 38.5 | Very low | 240 Ų | 240 | 159.2 Ų | 159.2 | 100% | 1.231 | 87% | 0.869 | S | S | * | * | -155.4 | 0 | 91.3 | -80.4 | 163.5 | 0 | 0 | 0 | 107.3 |
Retrieved 434 of 434 residues in 133 ms
(Link to these results)