| 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 | 42.4 | Very low | 46.4 | Very low | 247 Ų | 247 | 143.6 Ų | 143.6 | 100% | 1.217 | 81% | 0.808 | S | S | * | * | 0 | 110.4 | 0 | -68.9 | 165.8 | 165.8 | 0 | 0 | 106.4 | |||||
| 2 | N | 39.3 | Very low | 46.3 | Very low | 168 Ų | 168 | 145.2 Ų | 145.2 | 90% | 0.898 | 81% | 0.807 | S | S | * | * | trans | -66.6 | 147.7 | 178.2 | -61.6 | -31.3 | 0 | 0 | 0 | 110.4 | ||||
| 3 | A | 41.2 | Very low | 46.6 | Very low | 100 Ų | 100 | 143.9 Ų | 143.9 | 83% | 0.826 | 81% | 0.806 | S | S | * | * | trans | -165.5 | 117.1 | 137.2 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 4 | E | 50.2 | Low | 47 | Very low | 176 Ų | 176 | 140 Ų | 140 | 82% | 0.822 | 79% | 0.793 | S | S | * | * | trans | -67.9 | 153.7 | 170.7 | -58.7 | 170.3 | 117.1 | 0 | 0 | 110.3 | ||||
| 5 | T | 53.4 | Low | 47.3 | Very low | 145 Ų | 145 | 143.1 Ų | 143.1 | 89% | 0.89 | 80% | 0.801 | S | S | * | * | trans | -140.3 | 110.9 | 154.5 | -40.9 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 6 | C | 44.1 | Very low | 46.9 | Very low | 96 Ų | 96 | 144.2 Ų | 144.2 | 65% | 0.649 | 81% | 0.805 | S | S | * | * | trans | -76.8 | 137.9 | 177.9 | -68.5 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 7 | V | 44.2 | Very low | 46.6 | Very low | 131 Ų | 131 | 142.1 Ų | 142.1 | 79% | 0.794 | 80% | 0.802 | S | S | * | * | 66.8 | 149.9 | 126.7 | 179.7 | 0 | 0 | 0 | 0 | 117.1 | |||||
| 8 | P | 56.1 | Low | 46.5 | Very low | 107 Ų | 107 | 147 Ų | 147 | 70% | 0.695 | 81% | 0.808 | S | S | * | * | cis | -134.4 | 164.1 | 17.7 | 16 | 11.5 | 0 | 0 | 0 | 119.1 | ||||
| 9 | Y | 48.7 | Very low | 46.3 | Very low | 197 Ų | 197 | 151.8 Ų | 151.8 | 77% | 0.773 | 82% | 0.815 | S | S | * | * | trans | -41 | 129.2 | 149 | -171.8 | -93.8 | 0 | 0 | 0 | 113.6 | D11 | Y9-D11 HydrophobicContact CE1-CB 4.32Š| ||
| 10 | S | 46.1 | Very low | 46.1 | Very low | 112 Ų | 112 | 150.2 Ų | 150.2 | 78% | 0.783 | 82% | 0.815 | S | S | * | * | trans | -150 | 108.3 | 155.7 | -72.1 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 11 | D | 44.4 | Very low | 46.3 | Very low | 101 Ų | 101 | 149.2 Ų | 149.2 | 54% | 0.54 | 82% | 0.817 | S | S | . | * | trans | -53.6 | 127.8 | 160.1 | -163 | -31 | 0 | 0 | 0 | 110.2 | Y9 T13 | Y9-D11 HydrophobicContact CE1-CB 4.32Å; D11-T13 PolarHBondContact OD1-N 3.04Å; D11-T13 PolarHBondContact OD1-OG1 3.39Å | ||
| 12 | M | 45.7 | Very low | 46 | Very low | 162 Ų | 162 | 143 Ų | 143 | 80% | 0.798 | 80% | 0.797 | S | S | * | * | trans | -140.6 | 72.3 | 160.2 | -98.4 | -155.7 | 72.8 | 0 | 0 | 109.1 | S14 | M12-S14 VanDerWaalsContact C-N 3.26Å; M12-S14 PolarHBondContact O-N 3.39Å | ||
| 13 | T | 50.5 | Low | 46.1 | Very low | 129 Ų | 129 | 139.6 Ų | 139.6 | 79% | 0.791 | 79% | 0.793 | S | S | * | * | trans | -55.6 | 88.5 | 153.4 | -50.1 | 0 | 0 | 0 | 0 | 109.4 | D11 | D11-T13 PolarHBondContact OD1-N 3.04Å; D11-T13 PolarHBondContact OD1-OG1 3.39Å | ||
| 14 | S | 52.5 | Low | 45.9 | Very low | 89 Ų | 89 | 138.9 Ų | 138.9 | 62% | 0.622 | 79% | 0.787 | S | S | * | * | trans | -167.3 | 83.6 | 170.3 | -171.5 | 0 | 0 | 0 | 0 | 111.6 | M12 | M12-S14 VanDerWaalsContact C-N 3.26Å; M12-S14 PolarHBondContact O-N 3.39Å | ||
| 15 | M | 50.2 | Low | 45.4 | Very low | 186 Ų | 186 | 140 Ų | 140 | 92% | 0.916 | 79% | 0.792 | S | S | * | * | trans | -165.7 | 46.1 | 150.2 | -130.6 | 162.7 | 73.9 | 0 | 0 | 113.9 | ||||
| 16 | D | 41.8 | Very low | 44.4 | Very low | 161 Ų | 161 | 136.8 Ų | 136.8 | 86% | 0.861 | 79% | 0.788 | S | S | * | * | trans | -136.7 | 77.8 | 166.7 | -137.1 | -65.9 | 0 | 0 | 0 | 109.7 | ||||
| 17 | S | 42.2 | Very low | 44.1 | Very low | 109 Ų | 109 | 143.2 Ų | 143.2 | 76% | 0.762 | 80% | 0.799 | S | S | * | * | trans | -154.3 | 58 | 177.6 | -65.6 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 18 | Y | 44.5 | Very low | 43.7 | Very low | 230 Ų | 230 | 142.6 Ų | 142.6 | 90% | 0.902 | 79% | 0.791 | S | S | * | * | trans | -150.1 | 73.7 | 164 | -89.6 | -78.9 | 0 | 0 | 0 | 109.4 | ||||
| 19 | Y | 42.8 | Very low | 43 | Very low | 239 Ų | 239 | 145.3 Ų | 145.3 | 94% | 0.937 | 79% | 0.794 | S | S | * | * | S | Bend | trans | -178.6 | 79.5 | 143.9 | -110.2 | -79 | 0 | 0 | 0 | 109.5 | ||
| 20 | S | 41.4 | Very low | 42.4 | Very low | 119 Ų | 119 | 144.2 Ų | 144.2 | 83% | 0.832 | 80% | 0.796 | S | S | * | * | trans | -171.5 | 121.4 | 152.7 | -88.5 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 21 | P | 50.1 | Low | 41.8 | Very low | 129 Ų | 129 | 142.7 Ų | 142.7 | 84% | 0.838 | 79% | 0.79 | S | S | * | * | trans | -91 | 121.2 | 161.1 | 8 | 11.2 | 0 | 0 | 0 | 110.5 | ||||
| 22 | S | 37.4 | Very low | 41.5 | Very low | 116 Ų | 116 | 144 Ų | 144 | 81% | 0.811 | 80% | 0.797 | S | S | * | * | trans | -48.4 | 130.3 | 161.6 | -70.4 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 23 | A | 40.7 | Very low | 41.1 | Very low | 97 Ų | 97 | 143 Ų | 143 | 80% | 0.802 | 79% | 0.79 | S | S | * | * | 62.8 | 117.4 | 86.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | |||||
| 24 | A | 37.6 | Very low | 40.2 | Very low | 85 Ų | 85 | 145.1 Ų | 145.1 | 70% | 0.702 | 79% | 0.789 | S | S | * | * | 175.7 | 129.3 | 123.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 25 | Q | 38.2 | Very low | 39.6 | Very low | 199 Ų | 199 | 150.5 Ų | 150.5 | 93% | 0.93 | 80% | 0.795 | S | S | * | * | trans | 54.1 | 135 | 137.2 | -71.8 | 169.1 | -72.4 | 0 | 0 | 122.2 | ||||
| 26 | G | 33.5 | Very low | 39.1 | Very low | 79 Ų | 79 | 147.5 Ų | 147.5 | 81% | 0.814 | 79% | 0.788 | S | S | * | * | trans | 151 | 103.3 | 139.8 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 27 | R | 37.4 | Very low | 38.9 | Very low | 231 Ų | 231 | 148.3 Ų | 148.3 | 87% | 0.872 | 78% | 0.784 | S | S | * | * | trans | -35.5 | 152.8 | 163.2 | -95.2 | 174.1 | 176 | 165.1 | -1.2 | 119.4 | ||||
| 28 | D | 36.9 | Very low | 39.5 | Very low | 117 Ų | 117 | 148.5 Ų | 148.5 | 63% | 0.626 | 78% | 0.783 | S | S | * | * | trans | 78.8 | 122.3 | 136.2 | -69.7 | -45.5 | 0 | 0 | 0 | 123 | ||||
| 29 | H | 40.7 | Very low | 39.1 | Very low | 164 Ų | 164 | 142.3 Ų | 142.3 | 76% | 0.759 | 78% | 0.779 | S | S | * | * | trans | 64.2 | 122.5 | 135.5 | -71.7 | -59.7 | 0 | 0 | 0 | 123.8 | ||||
| 30 | Q | 35 | Very low | 39.3 | Very low | 175 Ų | 175 | 136.7 Ų | 136.7 | 82% | 0.818 | 78% | 0.775 | S | S | * | * | 87.9 | 124.3 | 121.9 | -170.4 | 169.9 | 19 | 0 | 0 | 120.6 | |||||
| 31 | A | 34.4 | Very low | 39.2 | Very low | 79 Ų | 79 | 137.7 Ų | 137.7 | 65% | 0.653 | 77% | 0.771 | S | S | * | * | trans | 63.2 | 147.7 | 149 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 32 | D | 37.5 | Very low | 38.9 | Very low | 129 Ų | 129 | 139.2 Ų | 139.2 | 69% | 0.69 | 77% | 0.77 | S | S | * | * | cis | -169.4 | 157.7 | 2.8 | -116 | -37.6 | 0 | 0 | 0 | 107.4 | ||||
| 33 | H | 36.9 | Very low | 39.2 | Very low | 140 Ų | 140 | 141.4 Ų | 141.4 | 65% | 0.648 | 77% | 0.765 | S | S | * | * | trans | 57.1 | 113.5 | 144.8 | -69.1 | 54.7 | 0 | 0 | 0 | 120.3 | ||||
| 34 | F | 31.9 | Very low | 39.2 | Very low | 175 Ų | 175 | 147.3 Ų | 147.3 | 77% | 0.768 | 77% | 0.768 | S | S | * | * | 178.4 | 130.2 | 98.5 | -101.6 | -78.8 | 0 | 0 | 0 | 113.1 | |||||
| 35 | R | 40.3 | Very low | 39 | Very low | 202 Ų | 202 | 148.5 Ų | 148.5 | 76% | 0.762 | 77% | 0.771 | S | S | * | * | trans | 79.2 | 83.2 | 152.7 | -79 | 161.1 | -164 | -94.6 | 3.8 | 120.8 | ||||
| 36 | T | 39.8 | Very low | 39 | Very low | 123 Ų | 123 | 144.7 Ų | 144.7 | 76% | 0.755 | 77% | 0.766 | S | S | * | * | trans | -67.1 | 155.7 | 133.8 | -51.1 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 37 | F | 37.5 | Very low | 39.1 | Very low | 177 Ų | 177 | 147.5 Ų | 147.5 | 78% | 0.776 | 77% | 0.768 | S | S | * | * | trans | -171.9 | 157.8 | 137.9 | -84.6 | -60.8 | 0 | 0 | 0 | 109.7 | ||||
| 38 | P | 55.4 | Low | 39.5 | Very low | 114 Ų | 114 | 140.6 Ų | 140.6 | 74% | 0.74 | 76% | 0.761 | S | S | * | * | -130.9 | 159.1 | -55.2 | 26.4 | -6.4 | 0 | 0 | 0 | 113.3 | |||||
| 39 | A | 35.9 | Very low | 39.3 | Very low | 100 Ų | 100 | 144 Ų | 144 | 83% | 0.826 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -98.1 | 140 | 157.5 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||
| 40 | S | 46.2 | Very low | 39.2 | Very low | 121 Ų | 121 | 143.1 Ų | 143.1 | 85% | 0.846 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -77.5 | 136.8 | -179.3 | 36.9 | 0 | 0 | 0 | 0 | 113.1 | ||
| 41 | D | 38.8 | Very low | 39.2 | Very low | 140 Ų | 140 | 140.3 Ų | 140.3 | 75% | 0.749 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -50.3 | 153 | 176.1 | -71.7 | -75.8 | 0 | 0 | 0 | 116.1 | ||
| 42 | I | 44.2 | Very low | 39.2 | Very low | 160 Ų | 160 | 142 Ų | 142 | 82% | 0.821 | 78% | 0.777 | S | S | * | * | -164.1 | 100.4 | 121.4 | -84.5 | 141.2 | 0 | 0 | 0 | 110.2 | |||||
| 43 | K | 43.8 | Very low | 39.2 | Very low | 163 Ų | 163 | 146.2 Ų | 146.2 | 71% | 0.709 | 79% | 0.789 | S | S | * | * | trans | 32.8 | 115.2 | 131.9 | -45.8 | 176 | -173 | 176.7 | 0 | 120.9 | ||||
| 44 | Y | 40.2 | Very low | 39.1 | Very low | 220 Ų | 220 | 142.7 Ų | 142.7 | 86% | 0.863 | 79% | 0.791 | S | S | * | * | 169.3 | 143.2 | 98.4 | -106.9 | -85.5 | 0 | 0 | 0 | 112.3 | |||||
| 45 | S | 33.9 | Very low | 39.2 | Very low | 111 Ų | 111 | 144 Ų | 144 | 78% | 0.776 | 80% | 0.799 | S | S | * | * | trans | -72.8 | 150.2 | -154.2 | -52.3 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 46 | S | 38 | Very low | 39 | Very low | 118 Ų | 118 | 138.2 Ų | 138.2 | 83% | 0.825 | 80% | 0.795 | S | S | * | * | trans | -70.4 | 144.9 | 150.6 | -78 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 47 | T | 36 | Very low | 38.6 | Very low | 138 Ų | 138 | 143.5 Ų | 143.5 | 85% | 0.847 | 80% | 0.803 | S | S | * | * | trans | -148.2 | 129.5 | 145.3 | 33.6 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 48 | A | 45.3 | Very low | 38.5 | Very low | 87 Ų | 87 | 138.7 Ų | 138.7 | 72% | 0.719 | 80% | 0.803 | S | S | * | * | trans | -86.2 | 150.3 | 169.1 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 49 | F | 33.4 | Very low | 37.7 | Very low | 188 Ų | 188 | 141.5 Ų | 141.5 | 83% | 0.825 | 81% | 0.806 | S | S | * | * | trans | -164.5 | 123.6 | 149.5 | -99.3 | -66.3 | 0 | 0 | 0 | 113 | ||||
| 50 | L | 39.5 | Very low | 37.6 | Very low | 146 Ų | 146 | 146.4 Ų | 146.4 | 76% | 0.764 | 81% | 0.809 | S | S | * | * | trans | 39.6 | 125.3 | 141.4 | -68.3 | 165.1 | 0 | 0 | 0 | 121.9 | ||||
| 51 | S | 33.8 | Very low | 37.4 | Very low | 116 Ų | 116 | 145.9 Ų | 145.9 | 81% | 0.811 | 81% | 0.805 | S | S | * | * | 161.2 | 149.2 | 100.7 | -94.4 | 0 | 0 | 0 | 0 | 115 | |||||
| 52 | S | 35.3 | Very low | 37.1 | Very low | 115 Ų | 115 | 150.7 Ų | 150.7 | 80% | 0.804 | 81% | 0.812 | S | S | * | * | trans | -68.4 | 150.9 | -170.6 | -48.5 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 53 | K | 36 | Very low | 36.8 | Very low | 216 Ų | 216 | 148.4 Ų | 148.4 | 94% | 0.939 | 81% | 0.81 | S | S | * | * | trans | 156.7 | 132.6 | 137 | -99.6 | 179.9 | 170.2 | 175.8 | 0 | 107.4 | ||||
| 54 | G | 35.2 | Very low | 36.9 | Very low | 66 Ų | 66 | 145.8 Ų | 145.8 | 68% | 0.68 | 81% | 0.81 | S | S | * | * | cis | 154 | 130.6 | 8.5 | 0 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 55 | Q | 34.8 | Very low | 36.5 | Very low | 202 Ų | 202 | 144.4 Ų | 144.4 | 94% | 0.944 | 81% | 0.809 | S | S | * | * | trans | 59.2 | 155.1 | 159.5 | -67.6 | -175.4 | -26.4 | 0 | 0 | 119.1 | ||||
| 56 | A | 35.6 | Very low | 36.4 | Very low | 81 Ų | 81 | 146.9 Ų | 146.9 | 67% | 0.669 | 81% | 0.808 | S | S | * | * | cis | -177 | 145.5 | -22.6 | 0 | 0 | 0 | 0 | 0 | 106 | ||||
| 57 | Y | 32.2 | Very low | 36.2 | Very low | 235 Ų | 235 | 148.4 Ų | 148.4 | 92% | 0.922 | 80% | 0.802 | S | S | * | * | trans | 49.2 | 127.9 | 147.6 | -91.5 | -97.1 | 0 | 0 | 0 | 122.2 | ||||
| 58 | G | 34.3 | Very low | 36 | Very low | 75 Ų | 75 | 149 Ų | 149 | 77% | 0.773 | 80% | 0.795 | S | S | * | * | trans | 175.3 | 61.3 | 162.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 59 | E | 40 | Very low | 35.4 | Very low | 174 Ų | 174 | 151.5 Ų | 151.5 | 81% | 0.813 | 81% | 0.806 | S | S | * | * | trans | -66.2 | 129.9 | 160.5 | -168.3 | -175.2 | 163.2 | 0 | 0 | 109.2 | ||||
| 60 | K | 33.7 | Very low | 35.5 | Very low | 203 Ų | 203 | 151.5 Ų | 151.5 | 88% | 0.883 | 81% | 0.809 | S | S | * | * | trans | -172.7 | 129.5 | 152.2 | -85.5 | 129.4 | -164.1 | -166.6 | 0 | 112.2 | ||||
| 61 | S | 40.7 | Very low | 35.1 | Very low | 109 Ų | 109 | 148.9 Ų | 148.9 | 76% | 0.762 | 80% | 0.802 | S | S | * | * | trans | -60.6 | 146.3 | 167.4 | -35.3 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 62 | R | 33.9 | Very low | 35.2 | Very low | 242 Ų | 242 | 151.3 Ų | 151.3 | 91% | 0.913 | 81% | 0.805 | S | S | * | * | trans | 149.5 | 123.9 | 132.6 | -87.9 | -180 | 175.9 | -167.6 | -1.1 | 113.1 | ||||
| 63 | S | 37.6 | Very low | 35.1 | Very low | 111 Ų | 111 | 152.4 Ų | 152.4 | 78% | 0.776 | 80% | 0.802 | S | S | * | * | trans | -66.7 | 146.2 | 141.7 | 172.8 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 64 | P | 46.3 | Very low | 35.2 | Very low | 108 Ų | 108 | 145.8 Ų | 145.8 | 70% | 0.701 | 79% | 0.788 | S | S | * | * | -154.7 | 157.1 | 58.4 | 40.1 | -17.6 | 0 | 0 | 0 | 119.5 | |||||
| 65 | F | 30.2 | Very low | 35.1 | Very low | 192 Ų | 192 | 147.6 Ų | 147.6 | 84% | 0.842 | 80% | 0.796 | S | S | * | * | trans | 61.1 | 143.9 | 145.6 | -128.2 | -110.3 | 0 | 0 | 0 | 122.9 | ||||
| 66 | Q | 32.3 | Very low | 35.1 | Very low | 163 Ų | 163 | 142.5 Ų | 142.5 | 76% | 0.762 | 79% | 0.789 | S | S | * | * | trans | 74.9 | 139.9 | 172.7 | -51.3 | -168.9 | -72.2 | 0 | 0 | 114.9 | ||||
| 67 | Q | 34 | Very low | 35.4 | Very low | 150 Ų | 150 | 143.7 Ų | 143.7 | 70% | 0.701 | 80% | 0.799 | S | S | * | * | cis | -166.9 | 146.4 | 30.4 | -142 | 170.5 | -46.1 | 0 | 0 | 102.8 | ||||
| 68 | E | 32.1 | Very low | 35.5 | Very low | 150 Ų | 150 | 136.3 Ų | 136.3 | 70% | 0.701 | 80% | 0.795 | S | S | * | * | 154.7 | 129.9 | 64.8 | -176 | 140.2 | 94.8 | 0 | 0 | 104.5 | |||||
| 69 | C | 31.8 | Very low | 35.7 | Very low | 139 Ų | 139 | 142.6 Ų | 142.6 | 94% | 0.939 | 80% | 0.804 | S | S | * | * | trans | -167.6 | 86.8 | 156.7 | -95.4 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 70 | Q | 35.2 | Very low | 35.6 | Very low | 188 Ų | 188 | 137.7 Ų | 137.7 | 88% | 0.879 | 80% | 0.8 | S | S | * | * | trans | -84.9 | 153.9 | 145.8 | -78.4 | 178.1 | 28.4 | 0 | 0 | 106.4 | ||||
| 71 | S | 32.2 | Very low | 35.9 | Very low | 91 Ų | 91 | 133.9 Ų | 133.9 | 64% | 0.636 | 80% | 0.799 | S | S | * | * | cis | -171.7 | 149.7 | 0.7 | 171 | 0 | 0 | 0 | 0 | 104.9 | ||||
| 72 | L | 36.6 | Very low | 35.6 | Very low | 167 Ų | 167 | 138.4 Ų | 138.4 | 87% | 0.874 | 81% | 0.805 | S | S | * | * | trans | -159.2 | 113.6 | 134.6 | -95.9 | 176.5 | 0 | 0 | 0 | 108.4 | ||||
| 73 | D | 31.9 | Very low | 36.1 | Very low | 138 Ų | 138 | 132 Ų | 132 | 74% | 0.738 | 80% | 0.797 | S | S | * | * | trans | 3.3 | 149.8 | 157 | -76.9 | -86.7 | 0 | 0 | 0 | 121.1 | ||||
| 74 | A | 37.6 | Very low | 36.6 | Very low | 78 Ų | 78 | 135 Ų | 135 | 65% | 0.645 | 80% | 0.797 | S | S | * | * | cis | -173 | 151 | -2.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 75 | A | 34.3 | Very low | 36.6 | Very low | 103 Ų | 103 | 140.6 Ų | 140.6 | 85% | 0.851 | 81% | 0.805 | S | S | * | * | trans | 58.2 | 131.1 | 148.3 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 76 | A | 35.6 | Very low | 37.5 | Very low | 95 Ų | 95 | 140.2 Ų | 140.2 | 79% | 0.785 | 81% | 0.806 | S | S | * | * | cis | -162.6 | 153.3 | 22.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 77 | A | 39.8 | Very low | 38.3 | Very low | 106 Ų | 106 | 140.2 Ų | 140.2 | 88% | 0.876 | 81% | 0.81 | S | S | * | * | trans | 70.4 | 113.8 | 149.1 | 0 | 0 | 0 | 0 | 0 | 121 | ||||
| 78 | G | 35.8 | Very low | 38.9 | Very low | 81 Ų | 81 | 142.9 Ų | 142.9 | 84% | 0.835 | 82% | 0.82 | S | S | * | * | 105.7 | 93.7 | 125.7 | 0 | 0 | 0 | 0 | 0 | 117.8 | |||||
| 79 | Q | 38.7 | Very low | 39.6 | Very low | 206 Ų | 206 | 144.4 Ų | 144.4 | 96% | 0.963 | 83% | 0.829 | S | S | * | * | trans | -50.4 | 152.2 | 159.1 | -56 | -179 | -2.4 | 0 | 0 | 111.3 | ||||
| 80 | G | 36.6 | Very low | 40.1 | Very low | 72 Ų | 72 | 146.8 Ų | 146.8 | 74% | 0.742 | 83% | 0.826 | S | S | * | * | cis | 175.4 | 177.4 | 7.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 81 | S | 39.7 | Very low | 40.3 | Very low | 122 Ų | 122 | 149.7 Ų | 149.7 | 85% | 0.853 | 83% | 0.829 | S | S | * | * | trans | 70.7 | 97.8 | 164.7 | -148.3 | 0 | 0 | 0 | 0 | 119.1 | S83 | S81-S83 PolarHBondContact O-N 2.98Š| ||
| 82 | F | 36.2 | Very low | 40.4 | Very low | 204 Ų | 204 | 151.1 Ų | 151.1 | 90% | 0.895 | 84% | 0.839 | S | S | * | * | trans | -68.6 | 109.9 | 172.1 | -133.5 | -100.9 | 0 | 0 | 0 | 110.9 | K84 | F82-K84 PolarHBondContact O-N 3.23Š| ||
| 83 | S | 42.7 | Very low | 40.6 | Very low | 107 Ų | 107 | 148.7 Ų | 148.7 | 75% | 0.748 | 84% | 0.836 | S | S | * | * | trans | -81.2 | 97.1 | 167.7 | -78.5 | 0 | 0 | 0 | 0 | 110.7 | S81 Y85 | S81-S83 PolarHBondContact O-N 2.98Å; S83-Y85 PolarHBondContact O-N 3.35Å | ||
| 84 | K | 49 | Very low | 40.7 | Very low | 176 Ų | 176 | 148 Ų | 148 | 77% | 0.765 | 84% | 0.84 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.5 | 52.7 | 178.2 | -166.7 | -173.7 | 177.4 | 171.3 | 0 | 112.8 | F82 | F82-K84 PolarHBondContact O-N 3.23Š|
| 85 | Y | 46.3 | Very low | 40.8 | Very low | 224 Ų | 224 | 154.2 Ų | 154.2 | 88% | 0.878 | 85% | 0.853 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -145.4 | 16.4 | 177.6 | -62.9 | -72.6 | 0 | 0 | 0 | 116.5 | S83 | S83-Y85 PolarHBondContact O-N 3.35Š|
| 86 | H | 49.2 | Very low | 41.5 | Very low | 184 Ų | 184 | 155.3 Ų | 155.3 | 85% | 0.852 | 85% | 0.849 | S | S | * | * | trans | -118.4 | 40 | -175 | -144.7 | -76.4 | 0 | 0 | 0 | 115.8 | ||||
| 87 | L | 49.5 | Very low | 42.2 | Very low | 164 Ų | 164 | 156.4 Ų | 156.4 | 86% | 0.859 | 85% | 0.848 | S | S | * | * | trans | -136 | 40.3 | 180 | -147.5 | 77.1 | 0 | 0 | 0 | 116.4 | ||||
| 88 | F | 46.5 | Very low | 42.6 | Very low | 205 Ų | 205 | 157.7 Ų | 157.7 | 90% | 0.899 | 85% | 0.848 | S | S | * | * | S | Bend | trans | -141 | 34.2 | 170.8 | -125.2 | -85 | 0 | 0 | 0 | 116.2 | ||
| 89 | M | 47.2 | Very low | 43 | Very low | 183 Ų | 183 | 158.1 Ų | 158.1 | 90% | 0.901 | 84% | 0.843 | S | S | * | * | trans | -141 | 58.7 | 167.3 | -76.8 | -66.8 | -82.3 | 0 | 0 | 111.4 | ||||
| 90 | H | 41.9 | Very low | 43.1 | Very low | 189 Ų | 189 | 155.4 Ų | 155.4 | 88% | 0.875 | 84% | 0.835 | S | S | * | * | trans | -126.9 | 103.6 | 160.3 | -116.7 | -90.6 | 0 | 0 | 0 | 109.3 | ||||
| 91 | R | 39.3 | Very low | 43.2 | Very low | 248 Ų | 248 | 159.3 Ų | 159.3 | 94% | 0.936 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 127.2 | 170.9 | -84 | 170.4 | 124 | -161.7 | -0.7 | 109.1 | S93 | R91-S93 PolarHBondContact O-N 3.05Š|
| 92 | S | 34.9 | Very low | 43.4 | Very low | 121 Ų | 121 | 162.2 Ų | 162.2 | 85% | 0.846 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 121 | 168.9 | -40 | 0 | 0 | 0 | 0 | 109.7 | ||
| 93 | S | 40.4 | Very low | 43.4 | Very low | 117 Ų | 117 | 159.7 Ų | 159.7 | 82% | 0.818 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 145.2 | 169.7 | -164.7 | 0 | 0 | 0 | 0 | 110.6 | R91 | R91-S93 PolarHBondContact O-N 3.05Š|
| 94 | C | 33.6 | Very low | 43 | Very low | 122 Ų | 122 | 162.1 Ų | 162.1 | 82% | 0.824 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -56.3 | 135.1 | -177.9 | -55.1 | 0 | 0 | 0 | 0 | 111.8 | ||
| 95 | K | 39.7 | Very low | 42.8 | Very low | 210 Ų | 210 | 158.8 Ų | 158.8 | 91% | 0.913 | 83% | 0.832 | S | S | * | * | trans | -89.9 | 109.4 | 179.6 | -163.6 | 141.8 | 178.3 | 172.4 | 0 | 109.3 | ||||
| 96 | T | 48.8 | Very low | 42.1 | Very low | 125 Ų | 125 | 154.8 Ų | 154.8 | 77% | 0.767 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -81.8 | 142.5 | 163.9 | 42.2 | 0 | 0 | 0 | 0 | 109.5 | ||
| 97 | P | 51.2 | Low | 41.4 | Very low | 118 Ų | 118 | 155.4 Ų | 155.4 | 77% | 0.766 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -82.5 | 148.4 | 174.1 | 31.8 | -30.2 | 0 | 0 | 0 | 110.9 | ||
| 98 | P | 47.3 | Very low | 40.6 | Very low | 134 Ų | 134 | 150.3 Ų | 150.3 | 87% | 0.87 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -81.7 | 133.6 | 175.5 | 33.1 | -29.5 | 0 | 0 | 0 | 109.9 | ||
| 99 | A | 43.5 | Very low | 40.4 | Very low | 89 Ų | 89 | 147.4 Ų | 147.4 | 74% | 0.736 | 79% | 0.792 | S | S | * | * | trans | -107.1 | 123.8 | 161.9 | 0 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 100 | D | 40.7 | Very low | 40 | Very low | 149 Ų | 149 | 146.3 Ų | 146.3 | 80% | 0.797 | 79% | 0.79 | S | S | * | * | trans | -173.7 | 118.5 | 147.2 | -103.9 | -52.9 | 0 | 0 | 0 | 109.1 | ||||
| 101 | D | 38.8 | Very low | 39.8 | Very low | 154 Ų | 154 | 141.1 Ų | 141.1 | 82% | 0.824 | 79% | 0.787 | S | S | * | * | trans | -152.4 | 115.8 | 133.4 | -143.3 | -67.8 | 0 | 0 | 0 | 108.5 | ||||
| 102 | K | 45.6 | Very low | 39.8 | Very low | 183 Ų | 183 | 133.8 Ų | 133.8 | 80% | 0.796 | 78% | 0.78 | S | S | * | * | trans | -123.7 | 120.4 | 177.6 | -96.2 | -178.7 | 178 | -81.1 | 0 | 107.6 | ||||
| 103 | L | 35.8 | Very low | 40.1 | Very low | 151 Ų | 151 | 136.1 Ų | 136.1 | 79% | 0.791 | 78% | 0.782 | S | S | * | * | trans | -152.1 | 125.4 | 154.7 | -71.3 | -178.2 | 0 | 0 | 0 | 104.3 | ||||
| 104 | L | 33 | Very low | 40.3 | Very low | 159 Ų | 159 | 135.4 Ų | 135.4 | 83% | 0.832 | 77% | 0.772 | S | S | * | * | cis | -169.4 | -179.3 | 43.5 | -104.6 | 153.9 | 0 | 0 | 0 | 107.8 | ||||
| 105 | P | 45.7 | Very low | 40.6 | Very low | 106 Ų | 106 | 135.6 Ų | 135.6 | 69% | 0.688 | 77% | 0.772 | S | S | * | * | trans | -122.2 | -156.6 | -143.5 | 40.6 | -19.8 | 0 | 0 | 0 | 113.2 | ||||
| 106 | E | 31.8 | Very low | 40.3 | Very low | 139 Ų | 139 | 129.5 Ų | 129.5 | 65% | 0.65 | 76% | 0.755 | S | S | * | * | trans | 91.6 | 102.7 | 173.5 | -74.4 | -85.3 | 108.7 | 0 | 0 | 115.1 | ||||
| 107 | R | 33.1 | Very low | 39.7 | Very low | 197 Ų | 197 | 134 Ų | 134 | 74% | 0.743 | 76% | 0.759 | S | S | * | * | 85.3 | 121.2 | 92 | -179.4 | -172.7 | -74.7 | -103.8 | -0.5 | 110.2 | |||||
| 108 | G | 34.3 | Very low | 38.9 | Very low | 57 Ų | 57 | 131.9 Ų | 131.9 | 59% | 0.588 | 76% | 0.759 | S | S | * | * | cis | 175.6 | -175.6 | 0.8 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 109 | H | 40.8 | Very low | 38.4 | Very low | 145 Ų | 145 | 134.6 Ų | 134.6 | 67% | 0.671 | 76% | 0.757 | S | S | * | * | trans | 86.7 | 107.9 | 156.7 | -41 | 90.3 | 0 | 0 | 0 | 119 | ||||
| 110 | N | 40.1 | Very low | 38 | Very low | 160 Ų | 160 | 136 Ų | 136 | 86% | 0.856 | 75% | 0.752 | S | S | * | * | trans | 61.9 | 125.9 | 131.9 | -48.3 | -31.5 | 0 | 0 | 0 | 120.7 | ||||
| 111 | G | 37.7 | Very low | 38.1 | Very low | 79 Ų | 79 | 133.6 Ų | 133.6 | 81% | 0.814 | 75% | 0.747 | S | S | * | * | trans | 156.7 | 93.8 | 155.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 112 | A | 38.9 | Very low | 38.4 | Very low | 95 Ų | 95 | 132.2 Ų | 132.2 | 79% | 0.785 | 75% | 0.749 | S | S | * | * | trans | -57.1 | 148.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 113 | L | 40.5 | Very low | 37.9 | Very low | 170 Ų | 170 | 127 Ų | 127 | 89% | 0.89 | 75% | 0.747 | S | S | * | * | trans | -158.8 | 93.6 | 141.8 | -105.8 | 157 | 0 | 0 | 0 | 109.6 | ||||
| 114 | V | 45.6 | Very low | 38.2 | Very low | 101 Ų | 101 | 127.3 Ų | 127.3 | 61% | 0.612 | 75% | 0.749 | S | S | * | * | trans | -67.5 | 142.4 | 151.1 | 173.8 | 0 | 0 | 0 | 0 | 106.8 | C116 | V114-C116 HydrophobicContact CG1-CB 4.2Å; V114-C116 WeakPolarHBondContact CG1-SG 3.24Å | ||
| 115 | P | 38.9 | Very low | 38.5 | Very low | 127 Ų | 127 | 125.7 Ų | 125.7 | 83% | 0.825 | 75% | 0.746 | S | S | * | * | -123.7 | 140.8 | 103.9 | -10 | 30.1 | 0 | 0 | 0 | 116.5 | |||||
| 116 | C | 34.1 | Very low | 37.8 | Very low | 82 Ų | 82 | 127.5 Ų | 127.5 | 55% | 0.554 | 75% | 0.749 | S | S | * | * | trans | -83.3 | 159 | 179.5 | -72.2 | 0 | 0 | 0 | 0 | 114.1 | V114 | V114-C116 HydrophobicContact CG1-CB 4.2Å; V114-C116 WeakPolarHBondContact CG1-SG 3.24Å | ||
| 117 | Y | 35.6 | Very low | 38.4 | Very low | 219 Ų | 219 | 125.1 Ų | 125.1 | 86% | 0.859 | 75% | 0.748 | S | S | * | * | trans | -27.6 | 158.4 | 154 | -16.8 | -85.5 | 0 | 0 | 0 | 118.3 | ||||
| 118 | G | 34.6 | Very low | 38.5 | Very low | 73 Ų | 73 | 122.3 Ų | 122.3 | 75% | 0.753 | 75% | 0.748 | S | S | * | * | trans | 106.3 | 117.2 | 147 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 119 | K | 36.7 | Very low | 38.8 | Very low | 191 Ų | 191 | 127.2 Ų | 127.2 | 83% | 0.83 | 76% | 0.76 | S | S | * | * | 84.6 | 100.5 | 59.1 | -173.2 | 141 | -178.5 | 173.5 | 0 | 112.7 | |||||
| 120 | D | 36.7 | Very low | 38.8 | Very low | 120 Ų | 120 | 124.7 Ų | 124.7 | 64% | 0.642 | 76% | 0.764 | S | S | * | * | trans | 70.4 | 135 | 143 | 86.6 | -113.4 | 0 | 0 | 0 | 124.8 | ||||
| 121 | S | 41.1 | Very low | 39.4 | Very low | 97 Ų | 97 | 122.5 Ų | 122.5 | 68% | 0.678 | 76% | 0.759 | S | S | * | * | trans | 85.2 | 88.3 | 142.3 | -43.8 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 122 | S | 45.3 | Very low | 39.2 | Very low | 126 Ų | 126 | 125.9 Ų | 125.9 | 88% | 0.881 | 76% | 0.758 | S | S | * | * | 48.5 | 126.8 | 126.2 | 62.4 | 0 | 0 | 0 | 0 | 124.7 | |||||
| 123 | G | 35.9 | Very low | 39.3 | Very low | 72 Ų | 72 | 125.8 Ų | 125.8 | 74% | 0.742 | 75% | 0.752 | S | S | * | * | trans | 161.5 | 125.3 | 142.9 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 124 | L | 42.3 | Very low | 39.5 | Very low | 159 Ų | 159 | 125.2 Ų | 125.2 | 83% | 0.832 | 75% | 0.75 | S | S | * | * | trans | 98.6 | 96.1 | 153.3 | -52 | 177.2 | 0 | 0 | 0 | 119.7 | ||||
| 125 | T | 39.3 | Very low | 39.8 | Very low | 125 Ų | 125 | 126.1 Ų | 126.1 | 77% | 0.767 | 76% | 0.758 | S | S | * | * | 73 | 127.4 | 105.5 | 67.7 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 126 | D | 31.8 | Very low | 40.5 | Very low | 143 Ų | 143 | 125.8 Ų | 125.8 | 77% | 0.765 | 76% | 0.755 | S | S | * | * | -175.3 | 140.5 | 50.5 | -178.7 | -105.9 | 0 | 0 | 0 | 110.7 | |||||
| 127 | S | 43.5 | Very low | 40.9 | Very low | 89 Ų | 89 | 125.1 Ų | 125.1 | 62% | 0.622 | 76% | 0.762 | S | S | * | * | trans | 54.6 | 138.2 | 153.8 | -48.9 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 128 | D | 35.9 | Very low | 41.2 | Very low | 139 Ų | 139 | 123.3 Ų | 123.3 | 74% | 0.743 | 76% | 0.764 | S | S | * | * | cis | -169.3 | 157.3 | 14.4 | -138.8 | -49.2 | 0 | 0 | 0 | 111.1 | ||||
| 129 | L | 38.8 | Very low | 41.5 | Very low | 160 Ų | 160 | 125.1 Ų | 125.1 | 84% | 0.838 | 76% | 0.756 | S | S | * | * | trans | 82.5 | 108 | 163.1 | -53 | 177.1 | 0 | 0 | 0 | 122.5 | ||||
| 130 | A | 41.1 | Very low | 42 | Very low | 92 Ų | 92 | 121.9 Ų | 121.9 | 76% | 0.76 | 76% | 0.758 | S | S | * | * | trans | -89.2 | -177.4 | 157.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 131 | P | 54.1 | Low | 42.5 | Very low | 114 Ų | 114 | 126.3 Ų | 126.3 | 74% | 0.74 | 77% | 0.766 | S | S | * | * | cis | -148.8 | 172.4 | 45.9 | 41.3 | -19.4 | 0 | 0 | 0 | 118.5 | ||||
| 132 | D | 33.6 | Very low | 42.2 | Very low | 149 Ų | 149 | 131.9 Ų | 131.9 | 80% | 0.797 | 77% | 0.773 | S | S | * | * | trans | 66.1 | 135.2 | 144.6 | -109.2 | -113.3 | 0 | 0 | 0 | 119.8 | ||||
| 133 | S | 39.8 | Very low | 41.8 | Very low | 94 Ų | 94 | 133.7 Ų | 133.7 | 66% | 0.657 | 77% | 0.772 | S | S | * | * | cis | -158.4 | 156.3 | 13.6 | -36 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 134 | D | 44.1 | Very low | 42 | Very low | 158 Ų | 158 | 135 Ų | 135 | 85% | 0.845 | 78% | 0.776 | S | S | * | * | trans | -55.6 | 161.5 | 168.7 | -69.7 | -67.9 | 0 | 0 | 0 | 114 | ||||
| 135 | P | 53.4 | Low | 41.6 | Very low | 120 Ų | 120 | 134 Ų | 134 | 78% | 0.779 | 78% | 0.776 | S | S | * | * | trans | -121.4 | 135.6 | 136 | 34.2 | -26.8 | 0 | 0 | 0 | 112.6 | ||||
| 136 | P | 52 | Low | 41.6 | Very low | 120 Ų | 120 | 137.8 Ų | 137.8 | 78% | 0.779 | 78% | 0.782 | S | S | * | * | trans | -80.5 | 165.9 | 176 | 34.2 | -33.1 | 0 | 0 | 0 | 112 | ||||
| 137 | G | 43 | Very low | 41.8 | Very low | 68 Ų | 68 | 137.6 Ų | 137.6 | 70% | 0.701 | 78% | 0.781 | S | S | * | * | trans | -50.7 | 142.7 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 138 | M | 42 | Very low | 41.3 | Very low | 180 Ų | 180 | 142 Ų | 142 | 89% | 0.887 | 79% | 0.792 | S | S | * | * | trans | -106 | 98.5 | 175.6 | -161 | 75.4 | 174.9 | 0 | 0 | 109.1 | ||||
| 139 | D | 40.8 | Very low | 41.3 | Very low | 111 Ų | 111 | 138 Ų | 138 | 59% | 0.594 | 78% | 0.783 | S | S | * | * | trans | -68.9 | 148 | 165.9 | 33.7 | -79.1 | 0 | 0 | 0 | 112.7 | R141 | D139-R141 PolarHBondContact O-N 2.92Š| ||
| 140 | S | 48.4 | Very low | 41.3 | Very low | 124 Ų | 124 | 137.9 Ų | 137.9 | 87% | 0.867 | 79% | 0.788 | S | S | * | * | trans | -63.2 | 91.2 | -175.2 | -177.3 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 141 | R | 46.1 | Very low | 41.1 | Very low | 213 Ų | 213 | 143.3 Ų | 143.3 | 80% | 0.804 | 80% | 0.795 | S | S | * | * | trans | -143.5 | 93.3 | 163.5 | -90.3 | -172.1 | -85 | -154.5 | -4 | 112.7 | D139 | D139-R141 PolarHBondContact O-N 2.92Š| ||
| 142 | Y | 34.2 | Very low | 40.1 | Very low | 214 Ų | 214 | 142.9 Ų | 142.9 | 84% | 0.839 | 80% | 0.801 | S | S | * | * | trans | -137.9 | 113 | 157.5 | -107.1 | -99.7 | 0 | 0 | 0 | 103.2 | ||||
| 143 | L | 38.9 | Very low | 40.2 | Very low | 164 Ų | 164 | 140.7 Ų | 140.7 | 86% | 0.859 | 80% | 0.804 | S | S | * | * | -162 | 115 | 67.5 | -73.7 | 162 | 0 | 0 | 0 | 109.4 | |||||
| 144 | A | 38.9 | Very low | 40 | Very low | 99 Ų | 99 | 141.6 Ų | 141.6 | 82% | 0.818 | 81% | 0.81 | S | S | * | * | trans | -161 | 125.7 | 150.2 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 145 | V | 34.3 | Very low | 39.6 | Very low | 137 Ų | 137 | 142.8 Ų | 142.8 | 83% | 0.83 | 81% | 0.81 | S | S | * | * | trans | 138 | 108.7 | 148.9 | 170.8 | 0 | 0 | 0 | 0 | 110 | ||||
| 146 | K | 38.2 | Very low | 39 | Very low | 206 Ų | 206 | 149 Ų | 149 | 90% | 0.896 | 82% | 0.818 | S | S | * | * | trans | -120.6 | 104.1 | 152.3 | -175.6 | 163.9 | -178.3 | 172.6 | 0 | 105.9 | ||||
| 147 | D | 36 | Very low | 38.4 | Very low | 138 Ų | 138 | 148.2 Ų | 148.2 | 74% | 0.738 | 82% | 0.816 | S | S | * | * | trans | -98.1 | 135.5 | 162.8 | -175.1 | -87.8 | 0 | 0 | 0 | 108.1 | ||||
| 148 | Q | 34.6 | Very low | 38.9 | Very low | 183 Ų | 183 | 150.3 Ų | 150.3 | 86% | 0.855 | 82% | 0.817 | S | S | * | * | trans | -153.7 | 103.8 | 149.6 | -166 | 129.5 | 58.3 | 0 | 0 | 108.3 | ||||
| 149 | G | 34.4 | Very low | 38.7 | Very low | 54 Ų | 54 | 146.9 Ų | 146.9 | 56% | 0.557 | 81% | 0.811 | S | S | * | * | trans | -85.2 | 156.3 | 171 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 150 | V | 39 | Very low | 38.6 | Very low | 157 Ų | 157 | 147.7 Ų | 147.7 | 95% | 0.952 | 82% | 0.815 | S | S | * | * | trans | -149.4 | 139.4 | 141.8 | -129.3 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 151 | K | 38.2 | Very low | 38.1 | Very low | 207 Ų | 207 | 147.8 Ų | 147.8 | 90% | 0.9 | 81% | 0.806 | S | S | * | * | trans | -75.1 | 152.4 | -169.7 | -66.4 | 176.4 | 170.6 | 175.7 | 0 | 114.8 | ||||
| 152 | A | 31.5 | Very low | 38.1 | Very low | 105 Ų | 105 | 145.7 Ų | 145.7 | 87% | 0.868 | 81% | 0.81 | S | S | * | * | -178 | 140.5 | 115 | 0 | 0 | 0 | 0 | 0 | 114.2 | |||||
| 153 | A | 36.4 | Very low | 38.4 | Very low | 103 Ų | 103 | 140.3 Ų | 140.3 | 85% | 0.851 | 81% | 0.809 | S | S | * | * | trans | -23.1 | 143.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 154 | S | 36.6 | Very low | 38.5 | Very low | 113 Ų | 113 | 138 Ų | 138 | 79% | 0.79 | 81% | 0.807 | S | S | * | * | 174.9 | 119.6 | 112.4 | -172.8 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 155 | E | 35.1 | Very low | 39.5 | Very low | 182 Ų | 182 | 138.7 Ų | 138.7 | 85% | 0.85 | 80% | 0.803 | S | S | * | * | trans | 25.4 | 117.6 | 142.3 | -59.4 | -74.8 | 123.6 | 0 | 0 | 120.4 | ||||
| 156 | R | 40 | Very low | 39.9 | Very low | 250 Ų | 250 | 139.9 Ų | 139.9 | 94% | 0.943 | 80% | 0.804 | S | S | * | * | 168.7 | 121.6 | 122.6 | -176.4 | 172.1 | -105.1 | -169.7 | -5.6 | 111.4 | |||||
| 157 | S | 40.1 | Very low | 40.3 | Very low | 104 Ų | 104 | 137.7 Ų | 137.7 | 73% | 0.727 | 80% | 0.797 | S | S | * | * | trans | -76.9 | -175.4 | 173.1 | -132.7 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 158 | P | 53.3 | Low | 40.8 | Very low | 112 Ų | 112 | 140.9 Ų | 140.9 | 73% | 0.727 | 80% | 0.804 | S | S | * | * | -128.2 | 167.9 | -56.3 | 30.3 | -11.6 | 0 | 0 | 0 | 111.4 | |||||
| 159 | S | 37.4 | Very low | 41.5 | Very low | 109 Ų | 109 | 139 Ų | 139 | 76% | 0.762 | 81% | 0.805 | S | S | * | * | trans | -169.2 | 127.7 | 146.9 | -119.1 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 160 | N | 38.2 | Very low | 41.8 | Very low | 128 Ų | 128 | 144.1 Ų | 144.1 | 68% | 0.684 | 82% | 0.82 | S | S | * | * | trans | 75.2 | 111.9 | 141.7 | -79.6 | 43.4 | 0 | 0 | 0 | 122.7 | ||||
| 161 | D | 39.8 | Very low | 42.3 | Very low | 125 Ų | 125 | 140 Ų | 140 | 67% | 0.668 | 81% | 0.808 | S | S | * | * | 88.9 | 95.9 | 130 | -57.6 | -40.3 | 0 | 0 | 0 | 120.6 | |||||
| 162 | L | 44.9 | Very low | 42.7 | Very low | 169 Ų | 169 | 133.7 Ų | 133.7 | 89% | 0.885 | 80% | 0.802 | S | S | * | * | 6.7 | 120.5 | 125.6 | -81.3 | 117.5 | 0 | 0 | 0 | 117.4 | |||||
| 163 | A | 40.5 | Very low | 43.6 | Very low | 101 Ų | 101 | 136.8 Ų | 136.8 | 84% | 0.835 | 80% | 0.799 | S | S | * | * | -176.6 | 126 | 106.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 164 | S | 42.1 | Very low | 44.4 | Very low | 117 Ų | 117 | 137.5 Ų | 137.5 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | trans | -107.1 | -178 | 166.9 | -143.6 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 165 | P | 58.8 | Low | 45.1 | Very low | 112 Ų | 112 | 139.5 Ų | 139.5 | 73% | 0.727 | 80% | 0.8 | S | S | * | * | -116.2 | 145.3 | -116.5 | 29.1 | -8.1 | 0 | 0 | 0 | 112.5 | |||||
| 166 | L | 43.7 | Very low | 46.1 | Very low | 162 Ų | 162 | 140 Ų | 140 | 85% | 0.848 | 80% | 0.799 | S | S | * | * | trans | -154.8 | 111.5 | 162.4 | -151.3 | 69.3 | 0 | 0 | 0 | 112.9 | ||||
| 167 | E | 46.3 | Very low | 46.9 | Very low | 161 Ų | 161 | 130.3 Ų | 130.3 | 75% | 0.752 | 78% | 0.777 | S | S | * | * | trans | 35.8 | 120.3 | 132.3 | -45.8 | -92.2 | 120.2 | 0 | 0 | 118.3 | ||||
| 168 | K | 46.3 | Very low | 48.2 | Very low | 205 Ų | 205 | 135.4 Ų | 135.4 | 89% | 0.891 | 79% | 0.786 | S | S | * | * | -178.9 | 130.1 | 107.1 | -97.5 | 171.5 | -179 | -173.8 | 0 | 112.9 | |||||
| 169 | V | 49.4 | Very low | 49 | Very low | 143 Ų | 143 | 139.2 Ų | 139.2 | 87% | 0.867 | 79% | 0.792 | S | S | * | * | trans | -44.1 | 130.9 | 161.8 | 166.9 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 170 | D | 40.9 | Very low | 51.1 | Low | 162 Ų | 162 | 144.6 Ų | 144.6 | 87% | 0.866 | 80% | 0.795 | S | S | * | * | trans | -152.6 | 145.1 | 135.1 | -165.5 | -132.9 | 0 | 0 | 0 | 111.3 | ||||
| 171 | G | 48.9 | Very low | 53.1 | Low | 69 Ų | 69 | 149.8 Ų | 149.8 | 71% | 0.711 | 81% | 0.805 | S | S | * | * | trans | -65.7 | 135.7 | -158.1 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 172 | G | 45.7 | Very low | 55.2 | Low | 75 Ų | 75 | 150.7 Ų | 150.7 | 77% | 0.773 | 81% | 0.81 | S | S | * | * | trans | -139 | 27 | 172.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 173 | E | 51.5 | Low | 57.4 | Low | 170 Ų | 170 | 153 Ų | 153 | 79% | 0.794 | 81% | 0.807 | S | S | * | * | trans | -114.4 | 77.1 | -178.2 | -68.7 | -167.4 | 89.5 | 0 | 0 | 112.1 | ||||
| 174 | S | 53.5 | Low | 59.8 | Low | 119 Ų | 119 | 150.5 Ų | 150.5 | 83% | 0.832 | 78% | 0.781 | S | S | * | * | trans | -163.6 | 41.7 | 155.7 | -84.2 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 175 | N | 50.9 | Low | 62.3 | Low | 155 Ų | 155 | 150.9 Ų | 150.9 | 83% | 0.829 | 78% | 0.779 | S | S | * | * | trans | -133.3 | 60.3 | 160.1 | -131.7 | -64 | 0 | 0 | 0 | 110.7 | G177 | N175-G177 PolarHBondContact O-N 3.16Š| ||
| 176 | K | 55.5 | Low | 64.1 | Low | 191 Ų | 191 | 148.5 Ų | 148.5 | 83% | 0.83 | 76% | 0.757 | S | S | * | * | trans | -70.5 | 67.8 | 158.9 | -77 | 169.1 | 177.6 | 161.2 | 0 | 107.9 | K178 | K176-K178 PolarHBondContact O-N 3.37Š| ||
| 177 | G | 57.5 | Low | 66.7 | Low | 48 Ų | 48 | 144.4 Ų | 144.4 | 50% | 0.495 | 74% | 0.739 | S | S | . | * | trans | -51.5 | 127.2 | 170.8 | 0 | 0 | 0 | 0 | 0 | 108.2 | N175 K179 | N175-G177 PolarHBondContact O-N 3.16Å; G177-K179 PolarHBondContact O-N 3.03Å | ||
| 178 | K | 66.7 | Low | 69.2 | Low | 210 Ų | 210 | 140.6 Ų | 140.6 | 91% | 0.913 | 73% | 0.73 | S | S | * | * | trans | -49.9 | 99.7 | 178.5 | -80 | 137.7 | 176.2 | 166.4 | 0 | 109 | K176 R180 | K176-K178 PolarHBondContact O-N 3.37Å; K178-R180 PolarHBondContact O-N 3.46Å | ||
| 179 | K | 71 | Confident | 71.6 | Confident | 193 Ų | 193 | 136.8 Ų | 136.8 | 84% | 0.839 | 71% | 0.711 | S | S | * | * | trans | -62.4 | 108.6 | 179.1 | -165.7 | 155 | -178.4 | 171.2 | 0 | 106.7 | G177 R181 | G177-K179 PolarHBondContact O-N 3.03Å; K179-R181 PolarHBondContact O-N 3.48Å | ||
| 180 | R | 80.1 | Confident | 74 | Confident | 222 Ų | 222 | 131.1 Ų | 131.1 | 84% | 0.838 | 68% | 0.675 | S | S | * | * | trans | -52.9 | 126.5 | -178.9 | -134.5 | 173.6 | 83.4 | -156.8 | 5.6 | 107.3 | K178 N182 | K178-R180 PolarHBondContact O-N 3.46Å; R180-N182 PolarHBondContact O-N 3.16Å | ||
| 181 | R | 81.4 | Confident | 76.7 | Confident | 236 Ų | 236 | 126.7 Ų | 126.7 | 89% | 0.891 | 65% | 0.651 | S | S | * | * | trans | -50.3 | 128.8 | 178.8 | -90.3 | -177.4 | -98.3 | 163 | -7.2 | 109.4 | K179 R183 | K179-R181 PolarHBondContact O-N 3.48Å; R181-R183 PolarHBondContact O-N 3.36Å; R181-R183 VanDerWaalsContact O-N 3.08Å | ||
| 182 | N | 83.5 | Confident | 79.1 | Confident | 144 Ų | 144 | 128.9 Ų | 128.9 | 77% | 0.77 | 64% | 0.643 | S | S | * | * | trans | -56.4 | 115.3 | -179.8 | -49.9 | 43.2 | 0 | 0 | 0 | 107.8 | R180 | R180-N182 PolarHBondContact O-N 3.16Š| ||
| 183 | R | 90.8 | Very high | 81.6 | Confident | 218 Ų | 218 | 126.9 Ų | 126.9 | 82% | 0.823 | 61% | 0.613 | S | S | * | * | P | Polyproline II helix | trans | -81.2 | 129.3 | 179.4 | -170.9 | 179.6 | -171.8 | 177.6 | 3.8 | 108.3 | R181 T185 | R181-R183 PolarHBondContact O-N 3.36Å; R181-R183 VanDerWaalsContact O-N 3.08Å; R183-T185 PolarHBondContact O-N 2.95Å |
| 184 | T | 90.6 | Very high | 83.8 | Confident | 49 Ų | 49 | 118.8 Ų | 118.8 | 30% | 0.301 | 58% | 0.576 | S | S | . | * | P | Polyproline II helix | trans | -66.5 | 127.2 | 172.1 | -46.8 | 0 | 0 | 0 | 0 | 109.7 | F186 L218 R222 | T184-F186 HydrophobicContact CG2-CD1 4.45Å; T184-F186 HydrophobicContact CG2-CE1 4.06Å; T184-F186 HydrophobicContact CG2-CZ 4.34Å; T184-L218 HydrophobicContact CG2-CD2 4.5Å; T184-R222 WeakPolarHBondContact OG1-CD 3.34Å; T184-R222 PolarHBondContact OG1-NH1 3.5Å |
| 185 | T | 94.7 | Very high | 86 | Confident | 124 Ų | 124 | 115.2 Ų | 115.2 | 76% | 0.761 | 55% | 0.546 | S | S | * | . | P | Polyproline II helix | trans | -102.5 | 127.9 | 168.5 | 48.8 | 0 | 0 | 0 | 0 | 108.4 | R183 | R183-T185 PolarHBondContact O-N 2.95Š|
| 186 | F | 97.4 | Very high | 88.2 | Confident | 63 Ų | 63 | 112.4 Ų | 112.4 | 28% | 0.276 | 53% | 0.526 | S | S | . | . | P | Polyproline II helix | trans | -90.4 | 140.9 | -179.9 | -58.7 | -74.2 | 0 | 0 | 0 | 110.3 | T184 Q190 L191 L218 W226 | T184-F186 HydrophobicContact CG2-CD1 4.45Å; T184-F186 HydrophobicContact CG2-CE1 4.06Å; T184-F186 HydrophobicContact CG2-CZ 4.34Å; F186-Q190 VanDerWaalsContact CA-OE1 3.3Å; F186-Q190 HydrophobicContact CB-CB 4.45Å; F186-L191 HydrophobicContact CB-CD1 4.43Å; F186-L191 HydrophobicContact CB-CD2 3.7Å; F186-L191 HydrophobicContact CB-CG 3.83Å; F186-L191 HydrophobicContact CD2-CD2 4.27Å; F186-L191 HydrophobicContact CG-CD2 4.15Å; F186-L218 HydrophobicContact CD1-CD1 3.72Å; F186-L218 HydrophobicContact CD1-CD2 4.13Å; F186-L218 HydrophobicContact CE1-CD1 3.62Å; F186-L218 HydrophobicContact CE1-CD2 4.05Å; F186-L218 HydrophobicContact CE1-CG 4.5Å; F186-W226 AromaticContact CD2-CD1 3.87Å; F186-W226 AromaticContact CE2-CD1 3.59Å; F186-W226 HydrophobicContact CZ-CB 4.33Å; F186-W226 AromaticContact CZ-CD1 3.87Å |
| 187 | T | 98.4 | Very high | 90.3 | Very high | 75 Ų | 75 | 104.8 Ų | 104.8 | 46% | 0.46 | 50% | 0.495 | S | S | . | . | P | Polyproline II helix | trans | -75.7 | 166.1 | 171.6 | 70.9 | 0 | 0 | 0 | 0 | 110.7 | Y189 Q190 L191 | T187-Y189 PolarHBondContact O-N 3.13Å; T187-Q190 PolarHBondContact O-N 2.87Å; T187-Q190 VanDerWaalsContact OG1-CG 3.26Å; T187-Q190 WeakPolarHBondContact OG1-CG 3.38Å; T187-Q190 PolarHBondContact OG1-N 2.77Å; T187-L191 WeakPolarHBondContact O-CG 3.35Å; T187-L191 PolarHBondContact O-N 3.34Å; T187-L191 VanDerWaalsContact O-N 3.14Å |
| 188 | S | 97.9 | Very high | 92.2 | Very high | 82 Ų | 82 | 102.7 Ų | 102.7 | 57% | 0.573 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -58 | -49.5 | 177.3 | -162.9 | 0 | 0 | 0 | 0 | 111.5 | Q190 L191 E192 | S188-Q190 VanDerWaalsContact C-N 3.31Å; S188-Q190 PolarHBondContact O-N 2.87Å; S188-L191 WeakPolarHBondContact O-CB 3.49Å; S188-L191 PolarHBondContact O-N 2.94Å; S188-E192 WeakPolarHBondContact O-CG 3.47Å; S188-E192 PolarHBondContact O-N 3.46Å; S188-E192 PolarHBondContact OG-OE1 3.22Å |
| 189 | Y | 98.3 | Very high | 93.7 | Very high | 124 Ų | 124 | 99.8 Ų | 99.8 | 49% | 0.486 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -53.8 | -45.3 | 178.2 | 174.4 | -102.9 | 0 | 0 | 0 | 112.9 | T187 L191 E192 E193 | T187-Y189 PolarHBondContact O-N 3.13Å; Y189-L191 VanDerWaalsContact C-N 3.34Å; Y189-L191 PolarHBondContact O-N 3.01Å; Y189-E192 PolarHBondContact O-N 3.45Å; Y189-E193 HydrophobicContact CE2-CG 4.17Å; Y189-E193 PolarHBondContact O-N 3.1Å; Y189-E193 VanDerWaalsContact O-N 3.11Å |
| 190 | Q | 98.3 | Very high | 95 | Very high | 24 Ų | 24 | 98.4 Ų | 98.4 | 11% | 0.112 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -62.2 | -43.3 | 177.8 | -68.9 | 173.3 | -23 | 0 | 0 | 111.4 | F186 T187 S188 E192 L194 T216 L218 | F186-Q190 VanDerWaalsContact CA-OE1 3.3Å; F186-Q190 HydrophobicContact CB-CB 4.45Å; T187-Q190 PolarHBondContact O-N 2.87Å; T187-Q190 VanDerWaalsContact OG1-CG 3.26Å; T187-Q190 WeakPolarHBondContact OG1-CG 3.38Å; T187-Q190 PolarHBondContact OG1-N 2.77Å; S188-Q190 VanDerWaalsContact C-N 3.31Å; S188-Q190 PolarHBondContact O-N 2.87Å; Q190-E192 VanDerWaalsContact C-N 3.34Å; Q190-L194 WeakPolarHBondContact O-CB 3.42Å; Q190-L194 WeakPolarHBondContact O-CD1 3.28Å; Q190-L194 WeakPolarHBondContact O-CG 3.41Å; Q190-L194 PolarHBondContact O-N 2.8Å; Q190-L194 VanDerWaalsContact O-N 3.08Å; Q190-T216 WeakPolarHBondContact CG-O 3.49Å; Q190-T216 PolarHBondContact NE2-O 2.89Å; Q190-L218 HydrophobicContact CB-CD1 4.47Å; Q190-L218 HydrophobicContact CG-CD1 4.47Å |
| 191 | L | 98.4 | Very high | 95.8 | Very high | 70 Ų | 70 | 90.6 Ų | 90.6 | 37% | 0.366 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -65.5 | -38.4 | 178.3 | -67 | 174.8 | 0 | 0 | 0 | 112 | F186 T187 S188 Y189 L194 E195 W226 | F186-L191 HydrophobicContact CB-CD1 4.43Å; F186-L191 HydrophobicContact CB-CD2 3.7Å; F186-L191 HydrophobicContact CB-CG 3.83Å; F186-L191 HydrophobicContact CD2-CD2 4.27Å; F186-L191 HydrophobicContact CG-CD2 4.15Å; T187-L191 WeakPolarHBondContact O-CG 3.35Å; T187-L191 PolarHBondContact O-N 3.34Å; T187-L191 VanDerWaalsContact O-N 3.14Å; S188-L191 WeakPolarHBondContact O-CB 3.49Å; S188-L191 PolarHBondContact O-N 2.94Å; Y189-L191 VanDerWaalsContact C-N 3.34Å; Y189-L191 PolarHBondContact O-N 3.01Å; L191-L194 PolarHBondContact O-N 3.15Å; L191-E195 VanDerWaalsContact O-CB 3.26Å; L191-E195 WeakPolarHBondContact O-CB 3.43Å; L191-E195 PolarHBondContact O-N 3.08Å; L191-W226 HydrophobicContact CD2-CZ2 4.35Å; L191-W226 VanDerWaalsContact CD2-NE1 3.27Å |
| 192 | E | 98.4 | Very high | 96.6 | Very high | 115 Ų | 115 | 82.1 Ų | 82.1 | 54% | 0.537 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -63.2 | -49.9 | 178.5 | -73.2 | 162.3 | -146.3 | 0 | 0 | 111.8 | S188 Y189 Q190 L194 E195 K196 | S188-E192 WeakPolarHBondContact O-CG 3.47Å; S188-E192 PolarHBondContact O-N 3.46Å; S188-E192 PolarHBondContact OG-OE1 3.22Å; Y189-E192 PolarHBondContact O-N 3.45Å; Q190-E192 VanDerWaalsContact C-N 3.34Å; E192-L194 PolarHBondContact O-N 3.29Å; E192-E195 PolarHBondContact O-N 3.18Å; E192-K196 VanDerWaalsContact O-CB 3.27Å; E192-K196 WeakPolarHBondContact O-CB 3.33Å; E192-K196 PolarHBondContact O-N 3.04Å |
| 193 | E | 98.4 | Very high | 97.3 | Very high | 33 Ų | 33 | 82.6 Ų | 82.6 | 15% | 0.154 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -65.9 | -38.2 | 177.7 | -78.1 | -64.7 | 133.1 | 0 | 0 | 112.3 | Y189 K196 V197 T216 | Y189-E193 HydrophobicContact CE2-CG 4.17Å; Y189-E193 PolarHBondContact O-N 3.1Å; Y189-E193 VanDerWaalsContact O-N 3.11Å; E193-K196 IonicContact OE1-NZ 2.67Å; E193-K196 PolarHBondContact OE1-NZ 2.66Å; E193-K196 IonicContact OE2-NZ 3.15Å; E193-V197 PolarHBondContact O-N 3.06Å; E193-T216 HydrophobicContact CB-CG2 3.94Å |
| 194 | L | 98.6 | Very high | 97.7 | Very high | 0 Ų | 0 | 72.4 Ų | 72.4 | 0% | 0 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -64 | -43.2 | 174.8 | -71.1 | 168.8 | 0 | 0 | 0 | 112 | Q190 L191 E192 V197 F198 L212 L218 V223 W226 F227 | Q190-L194 WeakPolarHBondContact O-CB 3.42Å; Q190-L194 WeakPolarHBondContact O-CD1 3.28Å; Q190-L194 WeakPolarHBondContact O-CG 3.41Å; Q190-L194 PolarHBondContact O-N 2.8Å; Q190-L194 VanDerWaalsContact O-N 3.08Å; L191-L194 PolarHBondContact O-N 3.15Å; E192-L194 PolarHBondContact O-N 3.29Å; L194-V197 PolarHBondContact O-N 2.82Å; L194-F198 WeakPolarHBondContact O-CB 3.5Å; L194-F198 PolarHBondContact O-N 3.22Å; L194-L212 HydrophobicContact CD2-CD1 4.38Å; L194-L218 HydrophobicContact CD1-CD1 4.27Å; L194-V223 HydrophobicContact CD2-CB 4.48Å; L194-V223 HydrophobicContact CD2-CG1 3.84Å; L194-V223 HydrophobicContact CD2-CG2 4.27Å; L194-W226 HydrophobicContact CB-CD2 4.09Å; L194-W226 HydrophobicContact CB-CE3 3.96Å; L194-W226 HydrophobicContact CB-CH2 3.74Å; L194-W226 HydrophobicContact CB-CZ2 3.83Å; L194-W226 HydrophobicContact CB-CZ3 3.8Å; L194-W226 HydrophobicContact CD1-CB 4.47Å; L194-W226 HydrophobicContact CD1-CD2 3.84Å; L194-W226 HydrophobicContact CD1-CE3 4.39Å; L194-W226 HydrophobicContact CD1-CG 3.84Å; L194-W226 HydrophobicContact CD2-CE3 4.41Å; L194-W226 HydrophobicContact CG-CD2 4.41Å; L194-W226 HydrophobicContact CG-CE3 4.5Å; L194-F227 HydrophobicContact CD2-CD2 4.48Å; L194-F227 HydrophobicContact CD2-CE2 3.85Å |
| 195 | E | 98.5 | Very high | 98.1 | Very high | 44 Ų | 44 | 75.4 Ų | 75.4 | 21% | 0.206 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -69.7 | -38.6 | 179.2 | -168.2 | 66.1 | -147.6 | 0 | 0 | 111.8 | L191 E192 V197 F198 Q199 W226 R230 | L191-E195 VanDerWaalsContact O-CB 3.26Å; L191-E195 WeakPolarHBondContact O-CB 3.43Å; L191-E195 PolarHBondContact O-N 3.08Å; E192-E195 PolarHBondContact O-N 3.18Å; E195-V197 VanDerWaalsContact C-N 3.29Å; E195-V197 PolarHBondContact O-N 3.41Å; E195-F198 CarbonylContact O-C 3.57Å; E195-F198 WeakPolarHBondContact O-CA 3.41Å; E195-F198 WeakPolarHBondContact O-CB 3.4Å; E195-F198 PolarHBondContact O-N 3.22Å; E195-Q199 WeakPolarHBondContact O-CG 3.49Å; E195-Q199 PolarHBondContact O-N 3.28Å; E195-W226 HydrophobicContact CB-CH2 4.49Å; E195-R230 VanDerWaalsContact CD-CZ 3.5Å; E195-R230 IonicContact OE1-CZ 3.26Å; E195-R230 VanDerWaalsContact OE1-CZ 3.26Å; E195-R230 IonicContact OE1-NE 3.33Å; E195-R230 PolarHBondContact OE1-NE 2.85Å; E195-R230 IonicContact OE1-NH2 3.56Å; E195-R230 PolarHBondContact OE1-NH2 3.28Å; E195-R230 IonicContact OE2-CZ 2.95Å; E195-R230 IonicContact OE2-NE 2.91Å; E195-R230 PolarHBondContact OE2-NE 3.38Å; E195-R230 IonicContact OE2-NH1 3.55Å; E195-R230 IonicContact OE2-NH2 2.77Å; E195-R230 PolarHBondContact OE2-NH2 3.02Å; E195-R230 VanDerWaalsContact OE2-NH2 3.15Å |
| 196 | K | 98.3 | Very high | 98.2 | Very high | 96 Ų | 96 | 72.7 Ų | 72.7 | 42% | 0.417 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -57.5 | -40.1 | 174.7 | 174.3 | -180 | 168.5 | -171.1 | 0 | 112.3 | E192 E193 | E192-K196 VanDerWaalsContact O-CB 3.27Å; E192-K196 WeakPolarHBondContact O-CB 3.33Å; E192-K196 PolarHBondContact O-N 3.04Å; E193-K196 IonicContact OE1-NZ 2.67Å; E193-K196 PolarHBondContact OE1-NZ 2.66Å; E193-K196 IonicContact OE2-NZ 3.15Å |
| 197 | V | 98.3 | Very high | 98.3 | Very high | 30 Ų | 30 | 76.7 Ų | 76.7 | 18% | 0.182 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -73.9 | -37.5 | 173.1 | 175.8 | 0 | 0 | 0 | 0 | 111.3 | E193 L194 E195 Q199 K200 T201 P204 L212 F227 | E193-V197 PolarHBondContact O-N 3.06Å; L194-V197 PolarHBondContact O-N 2.82Å; E195-V197 VanDerWaalsContact C-N 3.29Å; E195-V197 PolarHBondContact O-N 3.41Å; V197-Q199 VanDerWaalsContact C-N 3.25Å; V197-Q199 PolarHBondContact O-N 2.8Å; V197-K200 WeakPolarHBondContact O-CA 3.49Å; V197-K200 WeakPolarHBondContact O-CB 3.39Å; V197-K200 PolarHBondContact O-N 3.35Å; V197-T201 HydrophobicContact CG1-CG2 4.36Å; V197-T201 PolarHBondContact O-N 2.89Å; V197-P204 HydrophobicContact CG1-CB 4.45Å; V197-L212 HydrophobicContact CB-CD1 3.9Å; V197-L212 HydrophobicContact CB-CD2 4.46Å; V197-L212 HydrophobicContact CG1-CD1 3.88Å; V197-L212 HydrophobicContact CG2-CD1 3.9Å; V197-L212 HydrophobicContact CG2-CD2 3.73Å; V197-L212 HydrophobicContact CG2-CG 4.06Å; V197-F227 HydrophobicContact CB-CZ 4.21Å; V197-F227 HydrophobicContact CG1-CZ 4.02Å |
| 198 | F | 98.4 | Very high | 98.3 | Very high | 5 Ų | 5 | 75 Ų | 75 | 2% | 0.022 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -57.7 | -38.5 | 176.3 | -169.7 | -98 | 0 | 0 | 0 | 112.6 | L194 E195 K200 T201 H202 W226 F227 R230 R231 W234 | L194-F198 WeakPolarHBondContact O-CB 3.5Å; L194-F198 PolarHBondContact O-N 3.22Å; E195-F198 CarbonylContact O-C 3.57Å; E195-F198 WeakPolarHBondContact O-CA 3.41Å; E195-F198 WeakPolarHBondContact O-CB 3.4Å; E195-F198 PolarHBondContact O-N 3.22Å; F198-K200 PolarHBondContact O-N 2.94Å; F198-T201 WeakPolarHBondContact CA-O 3.36Å; F198-T201 CarbonylContact O-C 3.6Å; F198-T201 PolarHBondContact O-N 2.79Å; F198-H202 AromaticContact CD1-CD2 3.61Å; F198-H202 AromaticContact CD1-NE2 3.99Å; F198-H202 AromaticContact CD2-CD2 3.92Å; F198-H202 AromaticContact CE1-CD2 3.19Å; F198-H202 WeakPolarHBondContact CE1-CD2 3.46Å; F198-H202 AromaticContact CE1-NE2 3.43Å; F198-H202 WeakPolarHBondContact CE1-NE2 3.44Å; F198-H202 HydrophobicContact CE2-CB 3.92Å; F198-H202 AromaticContact CE2-CD2 3.54Å; F198-H202 AromaticContact CE2-CG 3.98Å; F198-H202 AromaticContact CG-CD2 3.95Å; F198-H202 HydrophobicContact CZ-CB 4.17Å; F198-H202 AromaticContact CZ-CD2 3.15Å; F198-H202 WeakPolarHBondContact CZ-CD2 3.23Å; F198-H202 AromaticContact CZ-CG 3.75Å; F198-H202 AromaticContact CZ-NE2 3.73Å; F198-H202 PolarHBondContact O-CD2 2.76Å; F198-W226 HydrophobicContact CB-CH2 4.49Å; F198-W226 HydrophobicContact CB-CZ3 4.31Å; F198-W226 HydrophobicContact CD2-CZ3 4.45Å; F198-F227 HydrophobicContact CB-CE1 4.02Å; F198-F227 HydrophobicContact CB-CZ 4.49Å; F198-F227 AromaticContact CD2-CD1 3.77Å; F198-F227 HydrophobicContact CD2-CD1 3.77Å; F198-F227 AromaticContact CD2-CE1 3.73Å; F198-F227 HydrophobicContact CD2-CE1 3.73Å; F198-F227 HydrophobicContact CE2-CD1 4.45Å; F198-F227 HydrophobicContact CG-CE1 4.39Å; F198-R230 HydrophobicContact CD1-CG 3.92Å; F198-R230 HydrophobicContact CD2-CB 4.25Å; F198-R230 HydrophobicContact CD2-CG 3.57Å; F198-R230 HydrophobicContact CE1-CG 3.8Å; F198-R230 HydrophobicContact CE2-CB 4.02Å; F198-R230 HydrophobicContact CE2-CG 3.44Å; F198-R230 VanDerWaalsContact CE2-CG 3.44Å; F198-R230 HydrophobicContact CG-CG 3.82Å; F198-R230 HydrophobicContact CZ-CB 4.45Å; F198-R230 HydrophobicContact CZ-CG 3.56Å; F198-R231 HydrophobicContact CE2-CG 3.84Å; F198-R231 HydrophobicContact CZ-CG 4.36Å; F198-W234 HydrophobicContact CZ-CB 4.27Å; F198-W234 HydrophobicContact CZ-CG 4.38Å |
| 199 | Q | 98.2 | Very high | 98.3 | Very high | 148 Ų | 148 | 73.2 Ų | 73.2 | 69% | 0.692 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -61.2 | -32 | 174 | -71.4 | 172.3 | -4.5 | 0 | 0 | 113.1 | E195 V197 | E195-Q199 WeakPolarHBondContact O-CG 3.49Å; E195-Q199 PolarHBondContact O-N 3.28Å; V197-Q199 VanDerWaalsContact C-N 3.25Å; V197-Q199 PolarHBondContact O-N 2.8Å |
| 200 | K | 97.8 | Very high | 98.3 | Very high | 164 Ų | 164 | 71.5 Ų | 71.5 | 71% | 0.713 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -80.9 | -43.6 | 177.1 | -61.9 | 178.6 | -178.6 | -175 | 0 | 111.8 | V197 F198 | V197-K200 WeakPolarHBondContact O-CA 3.49Å; V197-K200 WeakPolarHBondContact O-CB 3.39Å; V197-K200 PolarHBondContact O-N 3.35Å; F198-K200 PolarHBondContact O-N 2.94Å |
| 201 | T | 97.8 | Very high | 98.3 | Very high | 58 Ų | 58 | 74.1 Ų | 74.1 | 36% | 0.356 | 35% | 0.352 | S | S | . | . | trans | -151.9 | 130.7 | 177.6 | 178 | 0 | 0 | 0 | 0 | 111.3 | V197 F198 Y203 P204 | V197-T201 HydrophobicContact CG1-CG2 4.36Å; V197-T201 PolarHBondContact O-N 2.89Å; F198-T201 WeakPolarHBondContact CA-O 3.36Å; F198-T201 CarbonylContact O-C 3.6Å; F198-T201 PolarHBondContact O-N 2.79Å; T201-Y203 PolarHBondContact O-N 2.98Å; T201-Y203 PolarHBondContact OG1-N 3.41Å; T201-Y203 VanDerWaalsContact OG1-N 3.13Å; T201-Y203 PolarHBondContact OG1-O 3.41Å; T201-P204 HydrophobicContact CG2-CB 4.26Å | ||
| 202 | H | 98.1 | Very high | 98.3 | Very high | 59 Ų | 59 | 71.1 Ų | 71.1 | 27% | 0.273 | 34% | 0.337 | S | S | . | . | S | Bend | trans | -73.4 | -17.9 | 172.8 | -59.5 | 150.6 | 0 | 0 | 0 | 112.7 | F198 R231 W234 | F198-H202 AromaticContact CD1-CD2 3.61Å; F198-H202 AromaticContact CD1-NE2 3.99Å; F198-H202 AromaticContact CD2-CD2 3.92Å; F198-H202 AromaticContact CE1-CD2 3.19Å; F198-H202 WeakPolarHBondContact CE1-CD2 3.46Å; F198-H202 AromaticContact CE1-NE2 3.43Å; F198-H202 WeakPolarHBondContact CE1-NE2 3.44Å; F198-H202 HydrophobicContact CE2-CB 3.92Å; F198-H202 AromaticContact CE2-CD2 3.54Å; F198-H202 AromaticContact CE2-CG 3.98Å; F198-H202 AromaticContact CG-CD2 3.95Å; F198-H202 HydrophobicContact CZ-CB 4.17Å; F198-H202 AromaticContact CZ-CD2 3.15Å; F198-H202 WeakPolarHBondContact CZ-CD2 3.23Å; F198-H202 AromaticContact CZ-CG 3.75Å; F198-H202 AromaticContact CZ-NE2 3.73Å; F198-H202 PolarHBondContact O-CD2 2.76Å; H202-R231 HydrophobicContact CB-CG 4.31Å; H202-R231 VanDerWaalsContact O-CD 3.27Å; H202-R231 WeakPolarHBondContact O-CD 3.19Å; H202-R231 PolarHBondContact O-NH1 2.91Å; H202-W234 AromaticContact CE1-CE2 3.77Å; H202-W234 AromaticContact CE1-CZ2 3.93Å; H202-W234 AromaticContact CE1-NE1 3.79Å |
| 203 | Y | 98.4 | Very high | 98.3 | Very high | 154 Ų | 154 | 66 Ų | 66 | 60% | 0.604 | 31% | 0.314 | S | S | * | . | S | Bend | trans | -127.1 | 74 | -175.7 | -65.4 | -92.8 | 0 | 0 | 0 | 110.2 | T201 R231 | T201-Y203 PolarHBondContact O-N 2.98Å; T201-Y203 PolarHBondContact OG1-N 3.41Å; T201-Y203 VanDerWaalsContact OG1-N 3.13Å; T201-Y203 PolarHBondContact OG1-O 3.41Å; Y203-R231 VanDerWaalsContact CE1-CD 3.43Å; Y203-R231 VanDerWaalsContact CE1-NE 3.29Å |
| 204 | P | 98.1 | Very high | 98.3 | Very high | 4 Ų | 4 | 70.6 Ų | 70.6 | 3% | 0.026 | 34% | 0.339 | C | S | . | . | trans | -67.2 | 137.6 | 174.7 | 29.9 | -36.7 | 0 | 0 | 0 | 110.7 | V197 T201 A208 R209 F227 | V197-P204 HydrophobicContact CG1-CB 4.45Å; T201-P204 HydrophobicContact CG2-CB 4.26Å; P204-A208 HydrophobicContact CB-CB 4.07Å; P204-R209 HydrophobicContact CB-CG 4.03Å; P204-R209 HydrophobicContact CG-CG 3.8Å; P204-R209 PolarHBondContact O-NH1 3.35Å; P204-F227 VanDerWaalsContact CD-CD1 3.41Å; P204-F227 HydrophobicContact CG-CD1 3.59Å; P204-F227 HydrophobicContact CG-CD2 4.04Å; P204-F227 HydrophobicContact CG-CE1 3.52Å; P204-F227 HydrophobicContact CG-CE2 4Å; P204-F227 HydrophobicContact CG-CG 3.87Å; P204-F227 HydrophobicContact CG-CZ 3.76Å | ||
| 205 | D | 98.4 | Very high | 98.3 | Very high | 112 Ų | 112 | 78.1 Ų | 78.1 | 60% | 0.599 | 37% | 0.368 | S | S | * | . | trans | -68.5 | 166.8 | 174 | -172.5 | 27.4 | 0 | 0 | 0 | 112 | Y207 A208 R209 | D205-Y207 PolarHBondContact O-N 3.14Å; D205-A208 PolarHBondContact O-N 3.41Å; D205-A208 VanDerWaalsContact O-N 3.16Å; D205-R209 WeakPolarHBondContact O-CG 3.26Å; D205-R209 PolarHBondContact O-N 3.32Å | ||
| 206 | V | 98.2 | Very high | 98.2 | Very high | 66 Ų | 66 | 76.1 Ų | 76.1 | 40% | 0.4 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -49.7 | -53.2 | 180 | -178.4 | 0 | 0 | 0 | 0 | 110.9 | A208 R209 E210 | V206-A208 PolarHBondContact O-N 3.38Å; V206-R209 WeakPolarHBondContact O-CB 3.49Å; V206-R209 PolarHBondContact O-N 2.93Å; V206-E210 WeakPolarHBondContact O-CG 3.37Å; V206-E210 PolarHBondContact O-N 3.47Å |
| 207 | Y | 98.3 | Very high | 98.2 | Very high | 148 Ų | 148 | 78.5 Ų | 78.5 | 58% | 0.58 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -59.9 | -43.9 | 179.8 | 178.8 | -105.6 | 0 | 0 | 0 | 112.5 | D205 R209 E210 Q211 | D205-Y207 PolarHBondContact O-N 3.14Å; Y207-R209 VanDerWaalsContact C-N 3.28Å; Y207-R209 PolarHBondContact O-N 2.9Å; Y207-E210 PolarHBondContact O-N 3.4Å; Y207-Q211 HydrophobicContact CD1-CG 4.35Å; Y207-Q211 HydrophobicContact CE1-CG 3.93Å; Y207-Q211 HydrophobicContact CE2-CG 4.11Å; Y207-Q211 WeakPolarHBondContact O-CG 3.4Å; Y207-Q211 PolarHBondContact O-N 3.01Å |
| 208 | A | 98.3 | Very high | 98.2 | Very high | 39 Ų | 39 | 78.2 Ų | 78.2 | 32% | 0.322 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -63.1 | -34.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | P204 D205 V206 L212 | P204-A208 HydrophobicContact CB-CB 4.07Å; D205-A208 PolarHBondContact O-N 3.41Å; D205-A208 VanDerWaalsContact O-N 3.16Å; V206-A208 PolarHBondContact O-N 3.38Å; A208-L212 PolarHBondContact O-N 3.28Å; A208-L212 VanDerWaalsContact O-N 3.13Å |
| 209 | R | 98.6 | Very high | 98.2 | Very high | 44 Ų | 44 | 82.1 Ų | 82.1 | 17% | 0.166 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -71.7 | -37.8 | 175.1 | -66.7 | -165.1 | -56.5 | -100.5 | 3.2 | 112.2 | P204 D205 V206 Y207 L212 A213 E220 V223 | P204-R209 HydrophobicContact CB-CG 4.03Å; P204-R209 HydrophobicContact CG-CG 3.8Å; P204-R209 PolarHBondContact O-NH1 3.35Å; D205-R209 WeakPolarHBondContact O-CG 3.26Å; D205-R209 PolarHBondContact O-N 3.32Å; V206-R209 WeakPolarHBondContact O-CB 3.49Å; V206-R209 PolarHBondContact O-N 2.93Å; Y207-R209 VanDerWaalsContact C-N 3.28Å; Y207-R209 PolarHBondContact O-N 2.9Å; R209-L212 PolarHBondContact O-N 3.18Å; R209-A213 WeakPolarHBondContact O-CB 3.36Å; R209-A213 PolarHBondContact O-N 3.43Å; R209-E220 HydrophobicContact CB-CG 4.02Å; R209-E220 IonicContact CZ-OE1 3.35Å; R209-E220 IonicContact NE-OE1 2.89Å; R209-E220 PolarHBondContact NE-OE1 2.89Å; R209-E220 IonicContact NH2-OE1 3.01Å; R209-E220 PolarHBondContact NH2-OE1 3.19Å; R209-V223 HydrophobicContact CB-CG1 4.17Å; R209-V223 HydrophobicContact CG-CG1 4.18Å |
| 210 | E | 98.6 | Very high | 98.2 | Very high | 89 Ų | 89 | 77.5 Ų | 77.5 | 42% | 0.416 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -62.8 | -45.5 | 174.6 | -70.7 | 173.4 | 165.8 | 0 | 0 | 111.3 | V206 Y207 L212 A213 L214 E220 | V206-E210 WeakPolarHBondContact O-CG 3.37Å; V206-E210 PolarHBondContact O-N 3.47Å; Y207-E210 PolarHBondContact O-N 3.4Å; E210-L212 VanDerWaalsContact C-N 3.31Å; E210-L212 PolarHBondContact O-N 3.42Å; E210-A213 WeakPolarHBondContact O-CB 3.36Å; E210-A213 PolarHBondContact O-N 3.08Å; E210-A213 VanDerWaalsContact O-N 3.16Å; E210-L214 WeakPolarHBondContact O-CG 3.43Å; E210-L214 PolarHBondContact O-N 3.2Å; E210-E220 HydrophobicContact CG-CG 4.12Å |
| 211 | Q | 98.4 | Very high | 98.1 | Very high | 78 Ų | 78 | 71.5 Ų | 71.5 | 36% | 0.364 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -63 | -37.4 | 176 | -64.5 | -57.2 | 86.5 | 0 | 0 | 112.4 | Y207 R215 | Y207-Q211 HydrophobicContact CD1-CG 4.35Å; Y207-Q211 HydrophobicContact CE1-CG 3.93Å; Y207-Q211 HydrophobicContact CE2-CG 4.11Å; Y207-Q211 WeakPolarHBondContact O-CG 3.4Å; Y207-Q211 PolarHBondContact O-N 3.01Å; Q211-R215 VanDerWaalsContact O-CG 3.28Å; Q211-R215 WeakPolarHBondContact O-CG 3.43Å; Q211-R215 PolarHBondContact O-N 2.88Å; Q211-R215 VanDerWaalsContact O-N 3.1Å |
| 212 | L | 98.3 | Very high | 98.2 | Very high | 7 Ų | 7 | 73.7 Ų | 73.7 | 4% | 0.037 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -66.2 | -41.5 | 173.2 | -88.2 | 171.6 | 0 | 0 | 0 | 112.5 | L194 V197 A208 R209 E210 L214 R215 T216 V223 F227 | L194-L212 HydrophobicContact CD2-CD1 4.38Å; V197-L212 HydrophobicContact CB-CD1 3.9Å; V197-L212 HydrophobicContact CB-CD2 4.46Å; V197-L212 HydrophobicContact CG1-CD1 3.88Å; V197-L212 HydrophobicContact CG2-CD1 3.9Å; V197-L212 HydrophobicContact CG2-CD2 3.73Å; V197-L212 HydrophobicContact CG2-CG 4.06Å; A208-L212 PolarHBondContact O-N 3.28Å; A208-L212 VanDerWaalsContact O-N 3.13Å; R209-L212 PolarHBondContact O-N 3.18Å; E210-L212 VanDerWaalsContact C-N 3.31Å; E210-L212 PolarHBondContact O-N 3.42Å; L212-L214 VanDerWaalsContact C-N 3.31Å; L212-L214 PolarHBondContact O-N 3.41Å; L212-R215 PolarHBondContact O-N 3.18Å; L212-T216 WeakPolarHBondContact O-CB 3.33Å; L212-T216 WeakPolarHBondContact O-CG2 3.1Å; L212-T216 PolarHBondContact O-N 3.35Å; L212-T216 PolarHBondContact O-OG1 3.13Å; L212-V223 HydrophobicContact CB-CG1 4.22Å; L212-V223 HydrophobicContact CD1-CG1 4.22Å; L212-F227 HydrophobicContact CD1-CE2 3.85Å; L212-F227 HydrophobicContact CD1-CZ 4.08Å |
| 213 | A | 98.5 | Very high | 98.2 | Very high | 9 Ų | 9 | 70.9 Ų | 70.9 | 7% | 0.074 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -57.9 | -46.1 | 178.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | R209 E210 T216 D217 L218 E220 V223 | R209-A213 WeakPolarHBondContact O-CB 3.36Å; R209-A213 PolarHBondContact O-N 3.43Å; E210-A213 WeakPolarHBondContact O-CB 3.36Å; E210-A213 PolarHBondContact O-N 3.08Å; E210-A213 VanDerWaalsContact O-N 3.16Å; A213-T216 PolarHBondContact O-N 2.97Å; A213-D217 PolarHBondContact O-N 3.05Å; A213-L218 CarbonylContact C-O 3.32Å; A213-L218 WeakPolarHBondContact CA-O 3.26Å; A213-L218 VanDerWaalsContact CB-O 3.23Å; A213-L218 WeakPolarHBondContact CB-O 3.47Å; A213-L218 PolarHBondContact O-N 3Å; A213-E220 HydrophobicContact CB-CB 4.39Å; A213-V223 HydrophobicContact CB-CG2 4.12Å |
| 214 | L | 98.3 | Very high | 98.2 | Very high | 128 Ų | 128 | 66.9 Ų | 66.9 | 67% | 0.67 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -62.7 | -43.6 | 174.4 | -66.8 | 172.8 | 0 | 0 | 0 | 112.7 | E210 L212 T216 | E210-L214 WeakPolarHBondContact O-CG 3.43Å; E210-L214 PolarHBondContact O-N 3.2Å; L212-L214 VanDerWaalsContact C-N 3.31Å; L212-L214 PolarHBondContact O-N 3.41Å; L214-T216 VanDerWaalsContact C-N 3.33Å; L214-T216 PolarHBondContact O-N 3.31Å |
| 215 | R | 97.9 | Very high | 98.2 | Very high | 159 Ų | 159 | 69.6 Ų | 69.6 | 60% | 0.6 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -70.3 | -27.4 | -179 | -70.8 | 178 | 100.1 | 88.8 | 4.9 | 114 | Q211 L212 | Q211-R215 VanDerWaalsContact O-CG 3.28Å; Q211-R215 WeakPolarHBondContact O-CG 3.43Å; Q211-R215 PolarHBondContact O-N 2.88Å; Q211-R215 VanDerWaalsContact O-N 3.1Å; L212-R215 PolarHBondContact O-N 3.18Å |
| 216 | T | 97.8 | Very high | 98.2 | Very high | 2 Ų | 2 | 65.5 Ų | 65.5 | 1% | 0.012 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -105.7 | 1 | -174 | 57.3 | 0 | 0 | 0 | 0 | 113.3 | Q190 E193 L212 A213 L214 L218 | Q190-T216 WeakPolarHBondContact CG-O 3.49Å; Q190-T216 PolarHBondContact NE2-O 2.89Å; E193-T216 HydrophobicContact CB-CG2 3.94Å; L212-T216 WeakPolarHBondContact O-CB 3.33Å; L212-T216 WeakPolarHBondContact O-CG2 3.1Å; L212-T216 PolarHBondContact O-N 3.35Å; L212-T216 PolarHBondContact O-OG1 3.13Å; A213-T216 PolarHBondContact O-N 2.97Å; L214-T216 VanDerWaalsContact C-N 3.33Å; L214-T216 PolarHBondContact O-N 3.31Å; T216-L218 VanDerWaalsContact C-N 3.26Å; T216-L218 PolarHBondContact O-N 3.35Å |
| 217 | D | 98.1 | Very high | 98.2 | Very high | 145 Ų | 145 | 62.4 Ų | 62.4 | 78% | 0.775 | 31% | 0.306 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.5 | 43.1 | -173.5 | -60.5 | -48.2 | 0 | 0 | 0 | 112.9 | A213 | A213-D217 PolarHBondContact O-N 3.05Š|
| 218 | L | 97.1 | Very high | 98.2 | Very high | 25 Ų | 25 | 59.5 Ų | 59.5 | 13% | 0.131 | 30% | 0.298 | C | S | . | . | trans | -117.7 | 160.6 | 176.6 | -65.1 | 174.3 | 0 | 0 | 0 | 109.8 | T184 F186 Q190 L194 A213 T216 R222 V223 | T184-L218 HydrophobicContact CG2-CD2 4.5Å; F186-L218 HydrophobicContact CD1-CD1 3.72Å; F186-L218 HydrophobicContact CD1-CD2 4.13Å; F186-L218 HydrophobicContact CE1-CD1 3.62Å; F186-L218 HydrophobicContact CE1-CD2 4.05Å; F186-L218 HydrophobicContact CE1-CG 4.5Å; Q190-L218 HydrophobicContact CB-CD1 4.47Å; Q190-L218 HydrophobicContact CG-CD1 4.47Å; L194-L218 HydrophobicContact CD1-CD1 4.27Å; A213-L218 CarbonylContact C-O 3.32Å; A213-L218 WeakPolarHBondContact CA-O 3.26Å; A213-L218 VanDerWaalsContact CB-O 3.23Å; A213-L218 WeakPolarHBondContact CB-O 3.47Å; A213-L218 PolarHBondContact O-N 3Å; T216-L218 VanDerWaalsContact C-N 3.26Å; T216-L218 PolarHBondContact O-N 3.35Å; L218-R222 HydrophobicContact CB-CB 4.33Å; L218-V223 HydrophobicContact CB-CG2 4.22Å | ||
| 219 | T | 98.1 | Very high | 98.2 | Very high | 86 Ų | 86 | 62 Ų | 62 | 53% | 0.528 | 31% | 0.306 | S | S | . | . | trans | -77.8 | 148.9 | 167.9 | 70.2 | 0 | 0 | 0 | 0 | 110.6 | A221 R222 V223 | T219-A221 PolarHBondContact O-N 3.48Å; T219-A221 VanDerWaalsContact O-N 3.15Å; T219-R222 WeakPolarHBondContact O-CA 3.43Å; T219-R222 WeakPolarHBondContact O-CB 3.46Å; T219-R222 PolarHBondContact O-N 3.46Å; T219-R222 WeakPolarHBondContact OG1-CG 3.27Å; T219-R222 PolarHBondContact OG1-N 3.22Å; T219-V223 PolarHBondContact O-N 3.08Å | ||
| 220 | E | 98.2 | Very high | 98.1 | Very high | 51 Ų | 51 | 62.8 Ų | 62.8 | 24% | 0.238 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -50.9 | -41.2 | 176.6 | -175.3 | -80.7 | 161.2 | 0 | 0 | 111.3 | R209 E210 A213 R222 V223 Q224 | R209-E220 HydrophobicContact CB-CG 4.02Å; R209-E220 IonicContact CZ-OE1 3.35Å; R209-E220 IonicContact NE-OE1 2.89Å; R209-E220 PolarHBondContact NE-OE1 2.89Å; R209-E220 IonicContact NH2-OE1 3.01Å; R209-E220 PolarHBondContact NH2-OE1 3.19Å; E210-E220 HydrophobicContact CG-CG 4.12Å; A213-E220 HydrophobicContact CB-CB 4.39Å; E220-R222 VanDerWaalsContact C-N 3.31Å; E220-R222 PolarHBondContact O-N 3.34Å; E220-V223 CarbonylContact O-C 3.45Å; E220-V223 WeakPolarHBondContact O-CA 3.27Å; E220-V223 WeakPolarHBondContact O-CB 3.38Å; E220-V223 PolarHBondContact O-N 2.87Å; E220-V223 VanDerWaalsContact O-N 3.08Å; E220-Q224 WeakPolarHBondContact O-CB 3.38Å; E220-Q224 PolarHBondContact O-N 3.11Å |
| 221 | A | 97.7 | Very high | 98.1 | Very high | 39 Ų | 39 | 60.5 Ų | 60.5 | 32% | 0.322 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -60.3 | -36 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | T219 V225 | T219-A221 PolarHBondContact O-N 3.48Å; T219-A221 VanDerWaalsContact O-N 3.15Å; A221-V225 WeakPolarHBondContact O-CB 3.36Å; A221-V225 VanDerWaalsContact O-CG2 3.26Å; A221-V225 WeakPolarHBondContact O-CG2 3.48Å; A221-V225 PolarHBondContact O-N 2.91Å |
| 222 | R | 97.9 | Very high | 98 | Very high | 103 Ų | 103 | 58.7 Ų | 58.7 | 39% | 0.389 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -67.3 | -42.3 | 174.4 | -67.7 | -59.2 | 98.6 | 148.5 | 8.5 | 111.1 | T184 L218 T219 E220 V225 W226 | T184-R222 WeakPolarHBondContact OG1-CD 3.34Å; T184-R222 PolarHBondContact OG1-NH1 3.5Å; L218-R222 HydrophobicContact CB-CB 4.33Å; T219-R222 WeakPolarHBondContact O-CA 3.43Å; T219-R222 WeakPolarHBondContact O-CB 3.46Å; T219-R222 PolarHBondContact O-N 3.46Å; T219-R222 WeakPolarHBondContact OG1-CG 3.27Å; T219-R222 PolarHBondContact OG1-N 3.22Å; E220-R222 VanDerWaalsContact C-N 3.31Å; E220-R222 PolarHBondContact O-N 3.34Å; R222-V225 PolarHBondContact O-N 3.31Å; R222-W226 WeakPolarHBondContact O-CB 3.45Å; R222-W226 PolarHBondContact O-N 2.92Å |
| 223 | V | 98.4 | Very high | 97.9 | Very high | 0 Ų | 0 | 64.3 Ų | 64.3 | 0% | 0 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -60.6 | -48.2 | 175 | 178 | 0 | 0 | 0 | 0 | 109.8 | L194 R209 L212 A213 L218 T219 E220 V225 W226 F227 | L194-V223 HydrophobicContact CD2-CB 4.48Å; L194-V223 HydrophobicContact CD2-CG1 3.84Å; L194-V223 HydrophobicContact CD2-CG2 4.27Å; R209-V223 HydrophobicContact CB-CG1 4.17Å; R209-V223 HydrophobicContact CG-CG1 4.18Å; L212-V223 HydrophobicContact CB-CG1 4.22Å; L212-V223 HydrophobicContact CD1-CG1 4.22Å; A213-V223 HydrophobicContact CB-CG2 4.12Å; L218-V223 HydrophobicContact CB-CG2 4.22Å; T219-V223 PolarHBondContact O-N 3.08Å; E220-V223 CarbonylContact O-C 3.45Å; E220-V223 WeakPolarHBondContact O-CA 3.27Å; E220-V223 WeakPolarHBondContact O-CB 3.38Å; E220-V223 PolarHBondContact O-N 2.87Å; E220-V223 VanDerWaalsContact O-N 3.08Å; V223-V225 PolarHBondContact O-N 3.45Å; V223-W226 WeakPolarHBondContact O-CB 3.26Å; V223-W226 PolarHBondContact O-N 2.94Å; V223-W226 VanDerWaalsContact O-N 3.14Å; V223-F227 HydrophobicContact CG1-CD2 3.79Å; V223-F227 HydrophobicContact CG1-CE2 3.83Å; V223-F227 WeakPolarHBondContact O-CD2 3.37Å; V223-F227 PolarHBondContact O-N 3.39Å |
| 224 | Q | 98.3 | Very high | 97.7 | Very high | 71 Ų | 71 | 69.1 Ų | 69.1 | 33% | 0.332 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -56.2 | -49.3 | 177.3 | -169.4 | -164.9 | -6.8 | 0 | 0 | 112 | E220 W226 F227 Q228 | E220-Q224 WeakPolarHBondContact O-CB 3.38Å; E220-Q224 PolarHBondContact O-N 3.11Å; Q224-W226 VanDerWaalsContact C-N 3.32Å; Q224-W226 PolarHBondContact O-N 3.47Å; Q224-F227 PolarHBondContact O-N 2.81Å; Q224-Q228 WeakPolarHBondContact O-CG 3.46Å; Q224-Q228 PolarHBondContact O-N 3.2Å |
| 225 | V | 98.1 | Very high | 97.6 | Very high | 61 Ų | 61 | 68.8 Ų | 68.8 | 37% | 0.37 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -63.8 | -38.5 | 177.9 | 170.9 | 0 | 0 | 0 | 0 | 111.4 | A221 R222 V223 Q228 N229 | A221-V225 WeakPolarHBondContact O-CB 3.36Å; A221-V225 VanDerWaalsContact O-CG2 3.26Å; A221-V225 WeakPolarHBondContact O-CG2 3.48Å; A221-V225 PolarHBondContact O-N 2.91Å; R222-V225 PolarHBondContact O-N 3.31Å; V223-V225 PolarHBondContact O-N 3.45Å; V225-Q228 PolarHBondContact O-N 3Å; V225-N229 WeakPolarHBondContact O-CB 3.47Å; V225-N229 PolarHBondContact O-N 3.12Å; V225-N229 PolarHBondContact O-ND2 3.42Å |
| 226 | W | 98.2 | Very high | 97.3 | Very high | 25 Ų | 25 | 67.1 Ų | 67.1 | 10% | 0.095 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -60.6 | -48.8 | 175.5 | -172.8 | 102.6 | 0 | 0 | 0 | 111.2 | F186 L191 L194 E195 F198 R222 V223 Q224 Q228 N229 R230 | F186-W226 AromaticContact CD2-CD1 3.87Å; F186-W226 AromaticContact CE2-CD1 3.59Å; F186-W226 HydrophobicContact CZ-CB 4.33Å; F186-W226 AromaticContact CZ-CD1 3.87Å; L191-W226 HydrophobicContact CD2-CZ2 4.35Å; L191-W226 VanDerWaalsContact CD2-NE1 3.27Å; L194-W226 HydrophobicContact CB-CD2 4.09Å; L194-W226 HydrophobicContact CB-CE3 3.96Å; L194-W226 HydrophobicContact CB-CH2 3.74Å; L194-W226 HydrophobicContact CB-CZ2 3.83Å; L194-W226 HydrophobicContact CB-CZ3 3.8Å; L194-W226 HydrophobicContact CD1-CB 4.47Å; L194-W226 HydrophobicContact CD1-CD2 3.84Å; L194-W226 HydrophobicContact CD1-CE3 4.39Å; L194-W226 HydrophobicContact CD1-CG 3.84Å; L194-W226 HydrophobicContact CD2-CE3 4.41Å; L194-W226 HydrophobicContact CG-CD2 4.41Å; L194-W226 HydrophobicContact CG-CE3 4.5Å; E195-W226 HydrophobicContact CB-CH2 4.49Å; F198-W226 HydrophobicContact CB-CH2 4.49Å; F198-W226 HydrophobicContact CB-CZ3 4.31Å; F198-W226 HydrophobicContact CD2-CZ3 4.45Å; R222-W226 WeakPolarHBondContact O-CB 3.45Å; R222-W226 PolarHBondContact O-N 2.92Å; V223-W226 WeakPolarHBondContact O-CB 3.26Å; V223-W226 PolarHBondContact O-N 2.94Å; V223-W226 VanDerWaalsContact O-N 3.14Å; Q224-W226 VanDerWaalsContact C-N 3.32Å; Q224-W226 PolarHBondContact O-N 3.47Å; W226-Q228 VanDerWaalsContact C-N 3.34Å; W226-Q228 PolarHBondContact O-N 3.03Å; W226-N229 PolarHBondContact O-N 3.11Å; W226-R230 HydrophobicContact CE3-CB 4.04Å; W226-R230 HydrophobicContact CH2-CB 4.17Å; W226-R230 HydrophobicContact CH2-CG 3.85Å; W226-R230 HydrophobicContact CZ3-CB 3.83Å; W226-R230 HydrophobicContact CZ3-CG 3.84Å; W226-R230 WeakPolarHBondContact O-CB 3.31Å; W226-R230 PolarHBondContact O-N 3.18Å |
| 227 | F | 98.7 | Very high | 96.7 | Very high | 2 Ų | 2 | 75.2 Ų | 75.2 | 1% | 0.009 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -63 | -38.3 | 178.3 | -90.1 | -90.5 | 0 | 0 | 0 | 112.4 | L194 V197 F198 P204 L212 V223 Q224 R230 R231 | L194-F227 HydrophobicContact CD2-CD2 4.48Å; L194-F227 HydrophobicContact CD2-CE2 3.85Å; V197-F227 HydrophobicContact CB-CZ 4.21Å; V197-F227 HydrophobicContact CG1-CZ 4.02Å; F198-F227 HydrophobicContact CB-CE1 4.02Å; F198-F227 HydrophobicContact CB-CZ 4.49Å; F198-F227 AromaticContact CD2-CD1 3.77Å; F198-F227 HydrophobicContact CD2-CD1 3.77Å; F198-F227 AromaticContact CD2-CE1 3.73Å; F198-F227 HydrophobicContact CD2-CE1 3.73Å; F198-F227 HydrophobicContact CE2-CD1 4.45Å; F198-F227 HydrophobicContact CG-CE1 4.39Å; P204-F227 VanDerWaalsContact CD-CD1 3.41Å; P204-F227 HydrophobicContact CG-CD1 3.59Å; P204-F227 HydrophobicContact CG-CD2 4.04Å; P204-F227 HydrophobicContact CG-CE1 3.52Å; P204-F227 HydrophobicContact CG-CE2 4Å; P204-F227 HydrophobicContact CG-CG 3.87Å; P204-F227 HydrophobicContact CG-CZ 3.76Å; L212-F227 HydrophobicContact CD1-CE2 3.85Å; L212-F227 HydrophobicContact CD1-CZ 4.08Å; V223-F227 HydrophobicContact CG1-CD2 3.79Å; V223-F227 HydrophobicContact CG1-CE2 3.83Å; V223-F227 WeakPolarHBondContact O-CD2 3.37Å; V223-F227 PolarHBondContact O-N 3.39Å; Q224-F227 PolarHBondContact O-N 2.81Å; F227-R230 PolarHBondContact O-N 3.41Å; F227-R231 WeakPolarHBondContact O-CB 3.43Å; F227-R231 WeakPolarHBondContact O-CG 3.15Å; F227-R231 PolarHBondContact O-N 3.15Å |
| 228 | Q | 98.4 | Very high | 95.6 | Very high | 86 Ų | 86 | 74.4 Ų | 74.4 | 40% | 0.402 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -60.4 | -48.6 | 173.1 | -72.2 | 176.9 | 35.9 | 0 | 0 | 111.8 | Q224 V225 W226 R230 R231 A232 | Q224-Q228 WeakPolarHBondContact O-CG 3.46Å; Q224-Q228 PolarHBondContact O-N 3.2Å; V225-Q228 PolarHBondContact O-N 3Å; W226-Q228 VanDerWaalsContact C-N 3.34Å; W226-Q228 PolarHBondContact O-N 3.03Å; Q228-R230 VanDerWaalsContact C-N 3.33Å; Q228-R230 PolarHBondContact O-N 3.14Å; Q228-R231 PolarHBondContact O-N 2.67Å; Q228-A232 WeakPolarHBondContact O-CB 3.39Å; Q228-A232 PolarHBondContact O-N 3.49Å |
| 229 | N | 97.9 | Very high | 94.2 | Very high | 93 Ų | 93 | 82.4 Ų | 82.4 | 50% | 0.497 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -64.8 | -37.5 | 178.1 | -74.4 | -34 | 0 | 0 | 0 | 112.2 | V225 W226 A232 K233 | V225-N229 WeakPolarHBondContact O-CB 3.47Å; V225-N229 PolarHBondContact O-N 3.12Å; V225-N229 PolarHBondContact O-ND2 3.42Å; W226-N229 PolarHBondContact O-N 3.11Å; N229-A232 PolarHBondContact O-N 3.33Å; N229-K233 PolarHBondContact O-N 2.92Å; N229-K233 VanDerWaalsContact O-N 3.08Å |
| 230 | R | 97.9 | Very high | 92.3 | Very high | 59 Ų | 59 | 82.8 Ų | 82.8 | 22% | 0.223 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -64.6 | -49.1 | 176.7 | -174 | 67.4 | -172.9 | 172.5 | 0.7 | 110.9 | E195 F198 W226 F227 Q228 A232 K233 W234 | E195-R230 VanDerWaalsContact CD-CZ 3.5Å; E195-R230 IonicContact OE1-CZ 3.26Å; E195-R230 VanDerWaalsContact OE1-CZ 3.26Å; E195-R230 IonicContact OE1-NE 3.33Å; E195-R230 PolarHBondContact OE1-NE 2.85Å; E195-R230 IonicContact OE1-NH2 3.56Å; E195-R230 PolarHBondContact OE1-NH2 3.28Å; E195-R230 IonicContact OE2-CZ 2.95Å; E195-R230 IonicContact OE2-NE 2.91Å; E195-R230 PolarHBondContact OE2-NE 3.38Å; E195-R230 IonicContact OE2-NH1 3.55Å; E195-R230 IonicContact OE2-NH2 2.77Å; E195-R230 PolarHBondContact OE2-NH2 3.02Å; E195-R230 VanDerWaalsContact OE2-NH2 3.15Å; F198-R230 HydrophobicContact CD1-CG 3.92Å; F198-R230 HydrophobicContact CD2-CB 4.25Å; F198-R230 HydrophobicContact CD2-CG 3.57Å; F198-R230 HydrophobicContact CE1-CG 3.8Å; F198-R230 HydrophobicContact CE2-CB 4.02Å; F198-R230 HydrophobicContact CE2-CG 3.44Å; F198-R230 VanDerWaalsContact CE2-CG 3.44Å; F198-R230 HydrophobicContact CG-CG 3.82Å; F198-R230 HydrophobicContact CZ-CB 4.45Å; F198-R230 HydrophobicContact CZ-CG 3.56Å; W226-R230 HydrophobicContact CE3-CB 4.04Å; W226-R230 HydrophobicContact CH2-CB 4.17Å; W226-R230 HydrophobicContact CH2-CG 3.85Å; W226-R230 HydrophobicContact CZ3-CB 3.83Å; W226-R230 HydrophobicContact CZ3-CG 3.84Å; W226-R230 WeakPolarHBondContact O-CB 3.31Å; W226-R230 PolarHBondContact O-N 3.18Å; F227-R230 PolarHBondContact O-N 3.41Å; Q228-R230 VanDerWaalsContact C-N 3.33Å; Q228-R230 PolarHBondContact O-N 3.14Å; R230-A232 VanDerWaalsContact C-N 3.32Å; R230-A232 PolarHBondContact O-N 2.93Å; R230-K233 PolarHBondContact O-N 3.22Å; R230-W234 WeakPolarHBondContact O-CB 3.49Å; R230-W234 PolarHBondContact O-N 3.08Å |
| 231 | R | 97.8 | Very high | 90.5 | Very high | 42 Ų | 42 | 82.8 Ų | 82.8 | 16% | 0.158 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -61.1 | -37.8 | 174.6 | -72.8 | -165 | -62.6 | -88.5 | 2.7 | 113 | F198 H202 Y203 F227 Q228 W234 R235 | F198-R231 HydrophobicContact CE2-CG 3.84Å; F198-R231 HydrophobicContact CZ-CG 4.36Å; H202-R231 HydrophobicContact CB-CG 4.31Å; H202-R231 VanDerWaalsContact O-CD 3.27Å; H202-R231 WeakPolarHBondContact O-CD 3.19Å; H202-R231 PolarHBondContact O-NH1 2.91Å; Y203-R231 VanDerWaalsContact CE1-CD 3.43Å; Y203-R231 VanDerWaalsContact CE1-NE 3.29Å; F227-R231 WeakPolarHBondContact O-CB 3.43Å; F227-R231 WeakPolarHBondContact O-CG 3.15Å; F227-R231 PolarHBondContact O-N 3.15Å; Q228-R231 PolarHBondContact O-N 2.67Å; R231-W234 PolarHBondContact O-N 2.98Å; R231-R235 WeakPolarHBondContact O-CG 3.49Å; R231-R235 PolarHBondContact O-N 3.4Å |
| 232 | A | 97.3 | Very high | 88.5 | Confident | 39 Ų | 39 | 88.6 Ų | 88.6 | 32% | 0.322 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -61.9 | -45 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q228 N229 R230 K236 | Q228-A232 WeakPolarHBondContact O-CB 3.39Å; Q228-A232 PolarHBondContact O-N 3.49Å; N229-A232 PolarHBondContact O-N 3.33Å; R230-A232 VanDerWaalsContact C-N 3.32Å; R230-A232 PolarHBondContact O-N 2.93Å; A232-K236 WeakPolarHBondContact O-CB 3.4Å; A232-K236 PolarHBondContact O-N 3.34Å |
| 233 | K | 95.6 | Very high | 86.4 | Confident | 125 Ų | 125 | 89.4 Ų | 89.4 | 54% | 0.543 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -63.8 | -41.5 | 174.6 | -76.5 | -176.4 | -78.9 | -178.4 | 0 | 112.1 | N229 R230 K236 R237 | N229-K233 PolarHBondContact O-N 2.92Å; N229-K233 VanDerWaalsContact O-N 3.08Å; R230-K233 PolarHBondContact O-N 3.22Å; K233-K236 PolarHBondContact O-N 2.73Å; K233-R237 PolarHBondContact O-N 3.21Å |
| 234 | W | 94.9 | Very high | 84.3 | Confident | 111 Ų | 111 | 95.1 Ų | 95.1 | 42% | 0.42 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -59.6 | -52.5 | 177.3 | -176.2 | 89.1 | 0 | 0 | 0 | 111.5 | F198 H202 R230 R231 K236 R237 E238 | F198-W234 HydrophobicContact CZ-CB 4.27Å; F198-W234 HydrophobicContact CZ-CG 4.38Å; H202-W234 AromaticContact CE1-CE2 3.77Å; H202-W234 AromaticContact CE1-CZ2 3.93Å; H202-W234 AromaticContact CE1-NE1 3.79Å; R230-W234 WeakPolarHBondContact O-CB 3.49Å; R230-W234 PolarHBondContact O-N 3.08Å; R231-W234 PolarHBondContact O-N 2.98Å; W234-K236 VanDerWaalsContact C-N 3.27Å; W234-K236 PolarHBondContact O-N 3.03Å; W234-R237 PolarHBondContact O-N 3.02Å; W234-R237 VanDerWaalsContact O-N 3.16Å; W234-E238 PolarHBondContact O-N 2.7Å |
| 235 | R | 95.1 | Very high | 82.1 | Confident | 120 Ų | 120 | 97.6 Ų | 97.6 | 45% | 0.453 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -61.1 | -34.1 | 175.3 | -72.4 | -172.5 | -77.2 | 97.8 | -4.6 | 113 | R231 R239 | R231-R235 WeakPolarHBondContact O-CG 3.49Å; R231-R235 PolarHBondContact O-N 3.4Å; R235-R239 PolarHBondContact O-N 3.45Å |
| 236 | K | 91.2 | Very high | 80 | Confident | 125 Ų | 125 | 99.4 Ų | 99.4 | 54% | 0.543 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -67.9 | -40.7 | 177.3 | -170.6 | 174.9 | -177.1 | -178.8 | 0 | 111.3 | A232 K233 W234 E238 R239 F240 | A232-K236 WeakPolarHBondContact O-CB 3.4Å; A232-K236 PolarHBondContact O-N 3.34Å; K233-K236 PolarHBondContact O-N 2.73Å; W234-K236 VanDerWaalsContact C-N 3.27Å; W234-K236 PolarHBondContact O-N 3.03Å; K236-E238 VanDerWaalsContact C-N 3.32Å; K236-E238 PolarHBondContact O-N 3.38Å; K236-R239 PolarHBondContact O-N 3.04Å; K236-F240 HydrophobicContact CD-CD2 4.29Å; K236-F240 HydrophobicContact CD-CE2 4.01Å; K236-F240 HydrophobicContact CG-CD2 3.47Å; K236-F240 VanDerWaalsContact CG-CD2 3.47Å; K236-F240 HydrophobicContact CG-CE2 3.59Å; K236-F240 WeakPolarHBondContact O-CB 3.35Å; K236-F240 VanDerWaalsContact O-CD2 3.31Å; K236-F240 WeakPolarHBondContact O-CD2 3.5Å; K236-F240 PolarHBondContact O-N 2.96Å |
| 237 | R | 86.3 | Confident | 77.8 | Confident | 171 Ų | 171 | 107.6 Ų | 107.6 | 65% | 0.645 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -60.4 | -42.7 | 178.9 | -175.3 | 175.2 | -67.7 | 149.6 | -3.5 | 111.9 | K233 W234 R239 F240 G241 | K233-R237 PolarHBondContact O-N 3.21Å; W234-R237 PolarHBondContact O-N 3.02Å; W234-R237 VanDerWaalsContact O-N 3.16Å; R237-R239 VanDerWaalsContact C-N 3.34Å; R237-R239 PolarHBondContact O-N 3.44Å; R237-F240 PolarHBondContact O-N 3.16Å; R237-G241 PolarHBondContact O-N 2.94Å; R237-G241 VanDerWaalsContact O-N 3.1Å |
| 238 | E | 74.3 | Confident | 75.6 | Confident | 128 Ų | 128 | 111.1 Ų | 111.1 | 60% | 0.598 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62 | -40.4 | 177.8 | -165.9 | 177.4 | -162 | 0 | 0 | 112.3 | W234 K236 | W234-E238 PolarHBondContact O-N 2.7Å; K236-E238 VanDerWaalsContact C-N 3.32Å; K236-E238 PolarHBondContact O-N 3.38Å |
| 239 | R | 67.4 | Low | 73.4 | Confident | 194 Ų | 194 | 112.8 Ų | 112.8 | 73% | 0.732 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -75.2 | -32.3 | 177.5 | -66.7 | -173.5 | -176.2 | -148.9 | -0.3 | 114 | R235 K236 R237 M243 | R235-R239 PolarHBondContact O-N 3.45Å; K236-R239 PolarHBondContact O-N 3.04Å; R237-R239 VanDerWaalsContact C-N 3.34Å; R237-R239 PolarHBondContact O-N 3.44Å; R239-M243 PolarHBondContact O-N 3.35Å |
| 240 | F | 59.2 | Low | 71.2 | Confident | 93 Ų | 93 | 114.9 Ų | 114.9 | 41% | 0.408 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -77.4 | -24.6 | 179.4 | -89.6 | -99.7 | 0 | 0 | 0 | 112.8 | K236 R237 Q242 M243 Q244 | K236-F240 HydrophobicContact CD-CD2 4.29Å; K236-F240 HydrophobicContact CD-CE2 4.01Å; K236-F240 HydrophobicContact CG-CD2 3.47Å; K236-F240 VanDerWaalsContact CG-CD2 3.47Å; K236-F240 HydrophobicContact CG-CE2 3.59Å; K236-F240 WeakPolarHBondContact O-CB 3.35Å; K236-F240 VanDerWaalsContact O-CD2 3.31Å; K236-F240 WeakPolarHBondContact O-CD2 3.5Å; K236-F240 PolarHBondContact O-N 2.96Å; R237-F240 PolarHBondContact O-N 3.16Å; F240-Q242 VanDerWaalsContact C-N 3.25Å; F240-Q242 PolarHBondContact O-N 3.27Å; F240-M243 PolarHBondContact O-N 3.29Å; F240-Q244 VanDerWaalsContact O-CB 3.24Å; F240-Q244 WeakPolarHBondContact O-CB 3.36Å; F240-Q244 PolarHBondContact O-N 2.97Å |
| 241 | G | 59.5 | Low | 69 | Low | 51 Ų | 51 | 116 Ų | 116 | 53% | 0.526 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -58.6 | -34.1 | 172.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | R237 | R237-G241 PolarHBondContact O-N 2.94Å; R237-G241 VanDerWaalsContact O-N 3.1Å |
| 242 | Q | 56.4 | Low | 66.9 | Low | 161 Ų | 161 | 118 Ų | 118 | 75% | 0.752 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -84.7 | -38 | 177.6 | -66.1 | -175 | 6.7 | 0 | 0 | 113.2 | F240 | F240-Q242 VanDerWaalsContact C-N 3.25Å; F240-Q242 PolarHBondContact O-N 3.27Å |
| 243 | M | 53.6 | Low | 64.9 | Low | 120 Ų | 120 | 119.4 Ų | 119.4 | 59% | 0.591 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -74.5 | -28.4 | -178.5 | -172.1 | 67.5 | 72.5 | 0 | 0 | 112.8 | R239 F240 Q245 V246 R247 | R239-M243 PolarHBondContact O-N 3.35Å; F240-M243 PolarHBondContact O-N 3.29Å; M243-Q245 VanDerWaalsContact C-N 3.26Å; M243-Q245 PolarHBondContact O-N 2.94Å; M243-V246 PolarHBondContact O-N 3.26Å; M243-V246 VanDerWaalsContact O-N 3.17Å; M243-R247 PolarHBondContact O-N 3.35Å |
| 244 | Q | 53.1 | Low | 62.7 | Low | 120 Ų | 120 | 121.6 Ų | 121.6 | 56% | 0.561 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -72 | -21.6 | -177.7 | -153.9 | 147.4 | 27.3 | 0 | 0 | 112.4 | F240 R247 T248 | F240-Q244 VanDerWaalsContact O-CB 3.24Å; F240-Q244 WeakPolarHBondContact O-CB 3.36Å; F240-Q244 PolarHBondContact O-N 2.97Å; Q244-R247 PolarHBondContact O-N 3.37Å; Q244-T248 WeakPolarHBondContact O-CB 3.49Å; Q244-T248 PolarHBondContact O-N 3.36Å; Q244-T248 PolarHBondContact O-OG1 3.1Å |
| 245 | Q | 52.3 | Low | 60.3 | Low | 124 Ų | 124 | 124.1 Ų | 124.1 | 58% | 0.579 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -60.6 | -43.8 | 167.7 | -68.2 | -150.4 | -19.6 | 0 | 0 | 111.2 | M243 R247 T248 H249 | M243-Q245 VanDerWaalsContact C-N 3.26Å; M243-Q245 PolarHBondContact O-N 2.94Å; Q245-R247 VanDerWaalsContact C-N 3.33Å; Q245-R247 PolarHBondContact O-N 2.93Å; Q245-T248 WeakPolarHBondContact CA-OG1 3.31Å; Q245-T248 PolarHBondContact O-N 3.17Å; Q245-T248 PolarHBondContact O-OG1 3.46Å; Q245-H249 WeakPolarHBondContact O-CB 3.41Å; Q245-H249 PolarHBondContact O-CD2 3.35Å; Q245-H249 PolarHBondContact O-N 3.21Å |
| 246 | V | 54.2 | Low | 57.9 | Low | 99 Ų | 99 | 125.1 Ų | 125.1 | 60% | 0.6 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -66.4 | -35.9 | 179 | -172.5 | 0 | 0 | 0 | 0 | 112.1 | M243 F250 | M243-V246 PolarHBondContact O-N 3.26Å; M243-V246 VanDerWaalsContact O-N 3.17Å; V246-F250 PolarHBondContact O-N 3.45Å |
| 247 | R | 51.9 | Low | 55.7 | Low | 197 Ų | 197 | 124.6 Ų | 124.6 | 74% | 0.743 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -76 | -31.4 | 175.3 | -103.2 | -179 | 164.6 | 165.6 | -3.8 | 114 | M243 Q244 Q245 S251 | M243-R247 PolarHBondContact O-N 3.35Å; Q244-R247 PolarHBondContact O-N 3.37Å; Q245-R247 VanDerWaalsContact C-N 3.33Å; Q245-R247 PolarHBondContact O-N 2.93Å; R247-S251 PolarHBondContact O-N 3.03Å |
| 248 | T | 53.6 | Low | 53.7 | Low | 75 Ų | 75 | 124.1 Ų | 124.1 | 46% | 0.46 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -74.3 | -36.7 | 172.2 | 34.4 | 0 | 0 | 0 | 0 | 111 | Q244 Q245 F250 S251 T252 | Q244-T248 WeakPolarHBondContact O-CB 3.49Å; Q244-T248 PolarHBondContact O-N 3.36Å; Q244-T248 PolarHBondContact O-OG1 3.1Å; Q245-T248 WeakPolarHBondContact CA-OG1 3.31Å; Q245-T248 PolarHBondContact O-N 3.17Å; Q245-T248 PolarHBondContact O-OG1 3.46Å; T248-F250 VanDerWaalsContact C-N 3.32Å; T248-F250 PolarHBondContact O-N 3.46Å; T248-S251 CarbonylContact O-C 3.59Å; T248-S251 PolarHBondContact O-N 2.98Å; T248-S251 VanDerWaalsContact O-N 3.09Å; T248-T252 WeakPolarHBondContact O-CG2 3.36Å; T248-T252 PolarHBondContact O-N 3.44Å; T248-T252 PolarHBondContact O-OG1 3.08Å; T248-T252 VanDerWaalsContact O-OG1 3.09Å |
| 249 | H | 51.5 | Low | 52.3 | Low | 121 Ų | 121 | 125 Ų | 125 | 56% | 0.56 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -59.5 | -38.9 | 172.3 | -76.5 | -62.8 | 0 | 0 | 0 | 112.9 | Q245 T252 A253 | Q245-H249 WeakPolarHBondContact O-CB 3.41Å; Q245-H249 PolarHBondContact O-CD2 3.35Å; Q245-H249 PolarHBondContact O-N 3.21Å; H249-T252 WeakPolarHBondContact CA-OG1 3.32Å; H249-T252 PolarHBondContact O-OG1 3.23Å; H249-T252 VanDerWaalsContact O-OG1 3.06Å; H249-A253 WeakPolarHBondContact O-CB 3.16Å; H249-A253 PolarHBondContact O-N 3.34Å |
| 250 | F | 51.8 | Low | 51 | Low | 137 Ų | 137 | 122.2 Ų | 122.2 | 60% | 0.601 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -73.8 | -29.3 | 175.3 | -151.1 | -101.8 | 0 | 0 | 0 | 112.5 | V246 T248 Y254 | V246-F250 PolarHBondContact O-N 3.45Å; T248-F250 VanDerWaalsContact C-N 3.32Å; T248-F250 PolarHBondContact O-N 3.46Å; F250-Y254 AromaticContact CD1-CE2 3.74Å; F250-Y254 HydrophobicContact CD1-CE2 3.74Å; F250-Y254 AromaticContact CE1-CE2 3.47Å; F250-Y254 HydrophobicContact CE1-CE2 3.47Å; F250-Y254 VanDerWaalsContact CE1-CE2 3.47Å; F250-Y254 AromaticContact CE1-CZ 3.95Å; F250-Y254 HydrophobicContact CZ-CE2 4.13Å; F250-Y254 WeakPolarHBondContact O-CD2 3.42Å |
| 251 | S | 52.2 | Low | 49.9 | Very low | 83 Ų | 83 | 129.1 Ų | 129.1 | 58% | 0.58 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -76.3 | -33.3 | 175.3 | -155.9 | 0 | 0 | 0 | 0 | 112.7 | R247 T248 | R247-S251 PolarHBondContact O-N 3.03Å; T248-S251 CarbonylContact O-C 3.59Å; T248-S251 PolarHBondContact O-N 2.98Å; T248-S251 VanDerWaalsContact O-N 3.09Å |
| 252 | T | 53.4 | Low | 49.1 | Very low | 84 Ų | 84 | 131.7 Ų | 131.7 | 52% | 0.515 | 67% | 0.669 | S | S | . | * | H | α-helix | trans | -77.3 | -23.6 | 173.9 | 56.4 | 0 | 0 | 0 | 0 | 112.3 | T248 H249 Y254 E255 | T248-T252 WeakPolarHBondContact O-CG2 3.36Å; T248-T252 PolarHBondContact O-N 3.44Å; T248-T252 PolarHBondContact O-OG1 3.08Å; T248-T252 VanDerWaalsContact O-OG1 3.09Å; H249-T252 WeakPolarHBondContact CA-OG1 3.32Å; H249-T252 PolarHBondContact O-OG1 3.23Å; H249-T252 VanDerWaalsContact O-OG1 3.06Å; T252-Y254 PolarHBondContact O-N 3.1Å; T252-E255 PolarHBondContact O-N 3.05Å; T252-E255 VanDerWaalsContact O-N 3.11Å |
| 253 | A | 54.6 | Low | 48.1 | Very low | 69 Ų | 69 | 132.5 Ų | 132.5 | 57% | 0.57 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68 | -16.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | H249 | H249-A253 WeakPolarHBondContact O-CB 3.16Å; H249-A253 PolarHBondContact O-N 3.34Å |
| 254 | Y | 49.6 | Very low | 47.2 | Very low | 171 Ų | 171 | 133 Ų | 133 | 67% | 0.671 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98 | -5 | 170.3 | -65.1 | -71.6 | 0 | 0 | 0 | 114 | F250 T252 L256 | F250-Y254 AromaticContact CD1-CE2 3.74Å; F250-Y254 HydrophobicContact CD1-CE2 3.74Å; F250-Y254 AromaticContact CE1-CE2 3.47Å; F250-Y254 HydrophobicContact CE1-CE2 3.47Å; F250-Y254 VanDerWaalsContact CE1-CE2 3.47Å; F250-Y254 AromaticContact CE1-CZ 3.95Å; F250-Y254 HydrophobicContact CZ-CE2 4.13Å; F250-Y254 WeakPolarHBondContact O-CD2 3.42Å; T252-Y254 PolarHBondContact O-N 3.1Å; Y254-L256 VanDerWaalsContact C-N 3.29Å; Y254-L256 PolarHBondContact O-N 3.43Å |
| 255 | E | 45.5 | Very low | 46.4 | Very low | 164 Ų | 164 | 137.3 Ų | 137.3 | 77% | 0.766 | 69% | 0.69 | S | S | * | * | trans | -86.9 | 80.2 | 160.2 | -75.4 | -134.4 | 150.1 | 0 | 0 | 108.5 | T252 P257 | T252-E255 PolarHBondContact O-N 3.05Å; T252-E255 VanDerWaalsContact O-N 3.11Å; E255-P257 WeakPolarHBondContact O-CD 3.43Å | ||
| 256 | L | 43.7 | Very low | 45.8 | Very low | 141 Ų | 141 | 134.6 Ų | 134.6 | 74% | 0.738 | 69% | 0.689 | S | S | * | * | trans | -48.6 | 124.5 | 155.4 | -87.1 | 148.5 | 0 | 0 | 0 | 108.3 | Y254 L258 | Y254-L256 VanDerWaalsContact C-N 3.29Å; Y254-L256 PolarHBondContact O-N 3.43Å; L256-L258 PolarHBondContact O-N 3.39Å | ||
| 257 | P | 46 | Very low | 45.1 | Very low | 113 Ų | 113 | 138 Ų | 138 | 73% | 0.734 | 70% | 0.699 | S | S | * | * | trans | -64.5 | 89.5 | 165.7 | -19.1 | 32.5 | 0 | 0 | 0 | 108.6 | E255 L259 | E255-P257 WeakPolarHBondContact O-CD 3.43Å; P257-L259 PolarHBondContact O-N 3.07Å | ||
| 258 | L | 44.6 | Very low | 44.8 | Very low | 161 Ų | 161 | 136.5 Ų | 136.5 | 84% | 0.843 | 70% | 0.703 | S | S | * | * | trans | -69.1 | 81.9 | 160.7 | -69.4 | 179.6 | 0 | 0 | 0 | 106.8 | L256 T260 | L256-L258 PolarHBondContact O-N 3.39Å; L258-T260 PolarHBondContact O-N 3.15Å | ||
| 259 | L | 43.4 | Very low | 44 | Very low | 148 Ų | 148 | 141.7 Ų | 141.7 | 78% | 0.775 | 72% | 0.723 | S | S | * | * | trans | -54.7 | 132.3 | 165 | -89.9 | 160.9 | 0 | 0 | 0 | 109.1 | P257 | P257-L259 PolarHBondContact O-N 3.07Š| ||
| 260 | T | 40.3 | Very low | 43.4 | Very low | 134 Ų | 134 | 142.7 Ų | 142.7 | 82% | 0.822 | 73% | 0.732 | S | S | * | * | trans | 82.8 | 88.2 | 162.3 | 72.2 | 0 | 0 | 0 | 0 | 118.5 | L258 | L258-T260 PolarHBondContact O-N 3.15Š| ||
| 261 | R | 36.1 | Very low | 43.1 | Very low | 239 Ų | 239 | 141.4 Ų | 141.4 | 90% | 0.902 | 74% | 0.737 | S | S | * | * | trans | -143.2 | 119.4 | 133.3 | -167.7 | 175.8 | 167.3 | 154.4 | -2.3 | 109.9 | ||||
| 262 | P | 43 | Very low | 42.3 | Very low | 105 Ų | 105 | 142.4 Ų | 142.4 | 68% | 0.682 | 74% | 0.744 | S | S | * | * | trans | -83.7 | 147.8 | 180 | 35.7 | -32.6 | 0 | 0 | 0 | 110.5 | ||||
| 263 | E | 36.1 | Very low | 42.2 | Very low | 177 Ų | 177 | 148.2 Ų | 148.2 | 83% | 0.827 | 76% | 0.757 | S | S | * | * | trans | 79.8 | 123.3 | 150.6 | -52.4 | -98.2 | 157.3 | 0 | 0 | 119.1 | ||||
| 264 | N | 35 | Very low | 41.7 | Very low | 131 Ų | 131 | 152.4 Ų | 152.4 | 70% | 0.701 | 77% | 0.768 | S | S | * | * | trans | 102.1 | 110.7 | 146 | -125.6 | -84.1 | 0 | 0 | 0 | 119.9 | ||||
| 265 | Y | 35.4 | Very low | 41 | Very low | 210 Ų | 210 | 148 Ų | 148 | 82% | 0.824 | 78% | 0.775 | S | S | * | * | trans | 68.1 | 133.5 | 147.1 | -114.7 | -111.1 | 0 | 0 | 0 | 118.1 | ||||
| 266 | A | 38.9 | Very low | 40.6 | Very low | 67 Ų | 67 | 143.6 Ų | 143.6 | 55% | 0.554 | 77% | 0.773 | S | S | * | * | cis | -167.8 | 150.4 | -1.1 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 267 | Q | 41.2 | Very low | 40.3 | Very low | 172 Ų | 172 | 142.4 Ų | 142.4 | 80% | 0.804 | 78% | 0.777 | S | S | * | * | trans | 53 | 103.7 | 135.6 | -150.2 | 166.5 | -46 | 0 | 0 | 118.9 | Q269 | Q267-Q269 PolarHBondContact O-N 2.73Š| ||
| 268 | I | 44.8 | Very low | 40.1 | Very low | 164 Ų | 164 | 142.8 Ų | 142.8 | 84% | 0.841 | 78% | 0.782 | S | S | * | * | trans | -59 | 127.4 | 163.7 | -61.1 | 166.1 | 0 | 0 | 0 | 110 | ||||
| 269 | Q | 37.2 | Very low | 39.8 | Very low | 185 Ų | 185 | 140 Ų | 140 | 86% | 0.864 | 78% | 0.782 | S | S | * | * | trans | -132.8 | 134.2 | 145.7 | -109.8 | -177.4 | -4.4 | 0 | 0 | 110.7 | Q267 | Q267-Q269 PolarHBondContact O-N 2.73Š| ||
| 270 | N | 38.1 | Very low | 39.6 | Very low | 142 Ų | 142 | 137.8 Ų | 137.8 | 76% | 0.759 | 79% | 0.785 | S | S | * | * | trans | -57.2 | 154 | -172.3 | -130.8 | -46.2 | 0 | 0 | 0 | 113.7 | S272 | N270-S272 PolarHBondContact O-N 2.92Š| ||
| 271 | P | 46.4 | Very low | 39.5 | Very low | 109 Ų | 109 | 136.4 Ų | 136.4 | 71% | 0.708 | 78% | 0.781 | S | S | * | * | trans | -74.9 | 112.2 | -177.3 | -6.7 | 23.9 | 0 | 0 | 0 | 111.8 | ||||
| 272 | S | 34.7 | Very low | 39.8 | Very low | 104 Ų | 104 | 130.5 Ų | 130.5 | 73% | 0.727 | 77% | 0.774 | S | S | * | * | trans | -90.2 | 104.3 | 161.8 | -58.9 | 0 | 0 | 0 | 0 | 108.5 | N270 | N270-S272 PolarHBondContact O-N 2.92Š| ||
| 273 | W | 51.3 | Low | 40 | Very low | 206 Ų | 206 | 131.2 Ų | 131.2 | 78% | 0.78 | 78% | 0.776 | S | S | * | * | trans | -26.1 | 128.8 | 151.4 | 31.2 | -82.6 | 0 | 0 | 0 | 113.5 | ||||
| 274 | I | 45.3 | Very low | 40.4 | Very low | 158 Ų | 158 | 128.2 Ų | 128.2 | 81% | 0.81 | 77% | 0.772 | S | S | * | * | trans | 109.9 | 124.4 | 154.9 | -55.1 | 168.7 | 0 | 0 | 0 | 117.8 | ||||
| 275 | G | 33.7 | Very low | 41 | Very low | 78 Ų | 78 | 125.3 Ų | 125.3 | 80% | 0.804 | 77% | 0.773 | S | S | * | * | trans | 94.8 | 121.8 | 150.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 276 | G | 37.4 | Very low | 41.2 | Very low | 72 Ų | 72 | 120.7 Ų | 120.7 | 74% | 0.742 | 77% | 0.77 | S | S | * | * | cis | 117.8 | 99.4 | 23.7 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 277 | S | 37.7 | Very low | 41.8 | Very low | 116 Ų | 116 | 124.5 Ų | 124.5 | 81% | 0.811 | 79% | 0.786 | S | S | * | * | trans | 139.7 | 113.9 | 151.8 | -61.6 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 278 | S | 42.1 | Very low | 42.1 | Very low | 121 Ų | 121 | 122.1 Ų | 122.1 | 85% | 0.846 | 78% | 0.783 | S | S | * | * | trans | 39.9 | 106.6 | 141.3 | 17 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 279 | A | 38 | Very low | 42.3 | Very low | 101 Ų | 101 | 119.1 Ų | 119.1 | 84% | 0.835 | 77% | 0.774 | S | S | * | * | trans | -165.9 | 123.3 | 134.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 280 | A | 39.9 | Very low | 42.4 | Very low | 103 Ų | 103 | 116.3 Ų | 116.3 | 85% | 0.851 | 77% | 0.774 | S | S | * | * | trans | 13.7 | 110 | 159.3 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 281 | S | 36.3 | Very low | 42.3 | Very low | 104 Ų | 104 | 116.3 Ų | 116.3 | 73% | 0.727 | 77% | 0.774 | S | S | * | * | trans | -93.6 | 120.4 | 157.9 | -178.4 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 282 | P | 43.8 | Very low | 42.4 | Very low | 115 Ų | 115 | 117 Ų | 117 | 75% | 0.747 | 78% | 0.776 | S | S | * | * | trans | -84.9 | 110.2 | 160.8 | 31.9 | -24.3 | 0 | 0 | 0 | 107.2 | P284 | P282-P284 WeakPolarHBondContact O-CD 3.4Š| ||
| 283 | V | 46.7 | Very low | 42.8 | Very low | 121 Ų | 121 | 118.8 Ų | 118.8 | 73% | 0.733 | 78% | 0.782 | S | S | * | * | trans | -80.1 | 127.4 | 166.8 | -172.4 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 284 | P | 44.9 | Very low | 42.3 | Very low | 113 Ų | 113 | 115.1 Ų | 115.1 | 73% | 0.734 | 78% | 0.782 | S | S | * | * | trans | -95.4 | 111.7 | 146.9 | 30.9 | -20.7 | 0 | 0 | 0 | 107.4 | P282 C286 | P282-P284 WeakPolarHBondContact O-CD 3.4Å; P284-C286 PolarHBondContact O-N 3.17Å | ||
| 285 | G | 46.2 | Very low | 41.9 | Very low | 70 Ų | 70 | 113.2 Ų | 113.2 | 72% | 0.722 | 78% | 0.779 | S | S | * | * | trans | -63.7 | 122.6 | 169 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 286 | C | 40.3 | Very low | 42.2 | Very low | 113 Ų | 113 | 114.8 Ų | 114.8 | 76% | 0.764 | 78% | 0.776 | S | S | * | * | trans | -109.8 | 95.7 | 164.4 | 33.1 | 0 | 0 | 0 | 0 | 108.2 | P284 V288 | P284-C286 PolarHBondContact O-N 3.17Å; C286-V288 PolarHBondContact O-N 3.37Å | ||
| 287 | V | 51.8 | Low | 43 | Very low | 147 Ų | 147 | 119.2 Ų | 119.2 | 89% | 0.891 | 78% | 0.779 | S | S | * | * | trans | -55.5 | 122.5 | 154.4 | -136.5 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 288 | V | 48.3 | Very low | 43.2 | Very low | 123 Ų | 123 | 120.3 Ų | 120.3 | 75% | 0.745 | 78% | 0.781 | S | S | * | * | trans | -105.4 | 126.8 | 172.1 | -171.2 | 0 | 0 | 0 | 0 | 108.4 | C286 | C286-V288 PolarHBondContact O-N 3.37Š| ||
| 289 | P | 47.4 | Very low | 44 | Very low | 100 Ų | 100 | 119.3 Ų | 119.3 | 65% | 0.649 | 77% | 0.772 | S | S | * | * | trans | -64.4 | 134 | 172 | -15.9 | 29.6 | 0 | 0 | 0 | 110.8 | D291 | P289-D291 PolarHBondContact O-N 3.14Š| ||
| 290 | C | 40.4 | Very low | 44 | Very low | 127 Ų | 127 | 123.4 Ų | 123.4 | 86% | 0.858 | 77% | 0.773 | S | S | * | * | trans | -77.5 | 99.6 | 167.3 | -178.5 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 291 | D | 35.5 | Very low | 44.5 | Very low | 142 Ų | 142 | 122.8 Ų | 122.8 | 76% | 0.759 | 76% | 0.76 | S | S | * | * | trans | -81.8 | 131 | 166.2 | -82.5 | -54.1 | 0 | 0 | 0 | 111 | P289 | P289-D291 PolarHBondContact O-N 3.14Š| ||
| 292 | T | 49.4 | Very low | 44.8 | Very low | 123 Ų | 123 | 127.1 Ų | 127.1 | 76% | 0.755 | 77% | 0.769 | S | S | * | * | trans | -53.2 | 123.2 | 178.3 | -48.8 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 293 | V | 42.8 | Very low | 44.3 | Very low | 141 Ų | 141 | 127.2 Ų | 127.2 | 86% | 0.855 | 77% | 0.772 | S | S | * | * | trans | -129.9 | 134.8 | 155.9 | -66.7 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 294 | T | 39.8 | Very low | 43.9 | Very low | 129 Ų | 129 | 125.8 Ų | 125.8 | 79% | 0.791 | 77% | 0.773 | S | S | * | * | trans | -78.3 | 135 | -162.2 | -55 | 0 | 0 | 0 | 0 | 113.1 | C296 | T294-C296 PolarHBondContact O-N 3.45Š| ||
| 295 | T | 37.8 | Very low | 43.4 | Very low | 119 Ų | 119 | 126.5 Ų | 126.5 | 73% | 0.73 | 78% | 0.781 | S | S | * | * | trans | -45.2 | 121.1 | 162.8 | -56.5 | 0 | 0 | 0 | 0 | 112.9 | M297 | T295-M297 HydrophobicContact CG2-CB 4.29Å; T295-M297 PolarHBondContact O-N 3.46Å | ||
| 296 | C | 40.6 | Very low | 42.8 | Very low | 110 Ų | 110 | 126.1 Ų | 126.1 | 74% | 0.743 | 78% | 0.777 | S | S | * | * | trans | -93.1 | 75.4 | 165.3 | 55 | 0 | 0 | 0 | 0 | 110.3 | T294 | T294-C296 PolarHBondContact O-N 3.45Š| ||
| 297 | M | 52.8 | Low | 42.7 | Very low | 166 Ų | 166 | 127.7 Ų | 127.7 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | trans | -140.3 | 114.1 | 158.8 | -73.8 | -69.7 | 121.3 | 0 | 0 | 107.1 | T295 | T295-M297 HydrophobicContact CG2-CB 4.29Å; T295-M297 PolarHBondContact O-N 3.46Å | ||
| 298 | T | 43.5 | Very low | 42.1 | Very low | 139 Ų | 139 | 125.5 Ų | 125.5 | 85% | 0.853 | 77% | 0.774 | S | S | * | * | trans | -106.2 | 146.8 | 179.2 | -34.7 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 299 | P | 57.9 | Low | 41.5 | Very low | 100 Ų | 100 | 126.3 Ų | 126.3 | 65% | 0.649 | 77% | 0.774 | S | S | * | * | trans | -104.7 | 175.7 | -143.7 | 40 | -33.2 | 0 | 0 | 0 | 112.5 | ||||
| 300 | H | 39 | Very low | 41.2 | Very low | 187 Ų | 187 | 130.2 Ų | 130.2 | 87% | 0.866 | 78% | 0.781 | S | S | * | * | trans | -158.8 | 155.4 | 131.5 | -107.2 | 70.6 | 0 | 0 | 0 | 111.5 | ||||
| 301 | P | 48.6 | Very low | 41.1 | Very low | 89 Ų | 89 | 131.5 Ų | 131.5 | 58% | 0.578 | 78% | 0.779 | S | S | * | * | trans | -104.5 | 159.7 | -148 | 39.3 | -33.3 | 0 | 0 | 0 | 112.6 | ||||
| 302 | H | 42.5 | Very low | 41.4 | Very low | 195 Ų | 195 | 128.1 Ų | 128.1 | 90% | 0.903 | 78% | 0.777 | S | S | * | * | trans | -152.3 | 151.8 | 138.6 | -78.8 | -58.1 | 0 | 0 | 0 | 110.8 | ||||
| 303 | S | 34.5 | Very low | 40.8 | Very low | 117 Ų | 117 | 129.2 Ų | 129.2 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | trans | -86.4 | 167 | -152.3 | 42.8 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 304 | A | 37.5 | Very low | 40.6 | Very low | 91 Ų | 91 | 127.9 Ų | 127.9 | 75% | 0.752 | 78% | 0.781 | S | S | * | * | trans | -68.1 | 174.5 | -176.1 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 305 | S | 34.3 | Very low | 40.4 | Very low | 129 Ų | 129 | 127.3 Ų | 127.3 | 90% | 0.902 | 78% | 0.782 | S | S | * | * | trans | 89.5 | 133.8 | 171.7 | -52.5 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 306 | G | 33.6 | Very low | 40.9 | Very low | 62 Ų | 62 | 127.3 Ų | 127.3 | 64% | 0.639 | 78% | 0.784 | S | S | * | * | cis | 171 | 159.9 | 5 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 307 | V | 37.8 | Very low | 40.5 | Very low | 145 Ų | 145 | 125.9 Ų | 125.9 | 88% | 0.879 | 79% | 0.788 | S | S | * | * | trans | 56.4 | 121.8 | 153 | -55.6 | 0 | 0 | 0 | 0 | 122 | ||||
| 308 | S | 40.3 | Very low | 39.6 | Very low | 102 Ų | 102 | 121.9 Ų | 121.9 | 71% | 0.713 | 79% | 0.789 | S | S | * | * | 49.6 | 128.6 | 128.9 | -90.1 | 0 | 0 | 0 | 0 | 124.6 | |||||
| 309 | D | 35.5 | Very low | 39.4 | Very low | 140 Ų | 140 | 124 Ų | 124 | 75% | 0.749 | 79% | 0.788 | S | S | * | * | trans | 80.5 | 122.2 | 131.3 | -67.8 | -58.2 | 0 | 0 | 0 | 122.6 | ||||
| 310 | F | 41.1 | Very low | 38.6 | Very low | 181 Ų | 181 | 127.8 Ų | 127.8 | 79% | 0.794 | 80% | 0.802 | S | S | * | * | trans | 59.5 | 118.8 | 132.4 | -152.8 | -104.2 | 0 | 0 | 0 | 119.3 | ||||
| 311 | L | 38.7 | Very low | 38.3 | Very low | 155 Ų | 155 | 122.5 Ų | 122.5 | 81% | 0.812 | 80% | 0.797 | S | S | * | * | 179.5 | 130.4 | 119 | -90.3 | 168.8 | 0 | 0 | 0 | 109.9 | |||||
| 312 | G | 40.8 | Very low | 38 | Very low | 70 Ų | 70 | 125.5 Ų | 125.5 | 72% | 0.722 | 80% | 0.804 | S | S | * | * | trans | -76.5 | 160.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 313 | V | 38 | Very low | 38.1 | Very low | 146 Ų | 146 | 121.8 Ų | 121.8 | 89% | 0.885 | 80% | 0.797 | S | S | * | * | trans | -154.3 | 128.6 | 151.2 | 65.4 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 314 | S | 38.7 | Very low | 38.4 | Very low | 114 Ų | 114 | 122.8 Ų | 122.8 | 80% | 0.797 | 79% | 0.788 | S | S | * | * | trans | -81.9 | 146.4 | 176 | -51.5 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 315 | S | 34.6 | Very low | 38.6 | Very low | 116 Ų | 116 | 127.3 Ų | 127.3 | 81% | 0.811 | 80% | 0.796 | S | S | * | * | trans | -165.3 | 160.3 | 159.8 | -127.6 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 316 | P | 48.1 | Very low | 38.5 | Very low | 119 Ų | 119 | 123.9 Ų | 123.9 | 77% | 0.773 | 78% | 0.781 | S | S | * | * | -121.4 | 168 | -89.5 | 29.6 | -12.3 | 0 | 0 | 0 | 113.1 | |||||
| 317 | G | 33.3 | Very low | 38.6 | Very low | 81 Ų | 81 | 127 Ų | 127 | 84% | 0.835 | 79% | 0.793 | S | S | * | * | trans | -70.8 | 159.8 | 178.7 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 318 | G | 32.8 | Very low | 38.7 | Very low | 81 Ų | 81 | 127.8 Ų | 127.8 | 84% | 0.835 | 79% | 0.792 | S | S | * | * | trans | -170.1 | 74.1 | 166.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 319 | H | 39.7 | Very low | 38.6 | Very low | 183 Ų | 183 | 132.9 Ų | 132.9 | 85% | 0.847 | 80% | 0.801 | S | S | * | * | trans | -125.7 | 110.9 | 162 | 65.8 | -85.7 | 0 | 0 | 0 | 108.3 | ||||
| 320 | I | 40.9 | Very low | 38.4 | Very low | 181 Ų | 181 | 130 Ų | 130 | 93% | 0.928 | 81% | 0.805 | S | S | * | * | trans | -123.3 | 136.3 | 173.4 | -127 | 154.8 | 0 | 0 | 0 | 106.5 | ||||
| 321 | G | 33.5 | Very low | 38 | Very low | 75 Ų | 75 | 125.4 Ų | 125.4 | 77% | 0.773 | 81% | 0.808 | S | S | * | * | trans | 99.6 | 78.4 | 162.4 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 322 | Q | 42.4 | Very low | 37.7 | Very low | 152 Ų | 152 | 123.6 Ų | 123.6 | 71% | 0.71 | 81% | 0.809 | S | S | * | * | trans | -70 | 149.4 | 139.8 | -107.1 | -85.5 | -56.2 | 0 | 0 | 108.1 | ||||
| 323 | P | 44.6 | Very low | 38.2 | Very low | 117 Ų | 117 | 125.8 Ų | 125.8 | 76% | 0.76 | 81% | 0.81 | S | S | * | * | -141.7 | 141 | 88.9 | 33.9 | -17.5 | 0 | 0 | 0 | 114.9 | |||||
| 324 | H | 40.1 | Very low | 38 | Very low | 138 Ų | 138 | 121.8 Ų | 121.8 | 64% | 0.639 | 80% | 0.799 | S | S | * | * | trans | -72.5 | 140.2 | 160.4 | 98.7 | -70.6 | 0 | 0 | 0 | 110.1 | ||||
| 325 | M | 41.1 | Very low | 38 | Very low | 187 Ų | 187 | 124.9 Ų | 124.9 | 92% | 0.921 | 80% | 0.803 | S | S | * | * | trans | -129.4 | 134.5 | 149.9 | -50.8 | -158 | 84.6 | 0 | 0 | 104 | ||||
| 326 | G | 33.6 | Very low | 38 | Very low | 57 Ų | 57 | 123.9 Ų | 123.9 | 59% | 0.588 | 80% | 0.802 | S | S | * | * | cis | 172.1 | 106.5 | 0.1 | 0 | 0 | 0 | 0 | 0 | 103.2 | ||||
| 327 | S | 34 | Very low | 37.6 | Very low | 127 Ų | 127 | 123.5 Ų | 123.5 | 89% | 0.888 | 81% | 0.808 | S | S | * | * | trans | -97.2 | 108.2 | 166 | -104 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 328 | L | 40.9 | Very low | 37.5 | Very low | 162 Ų | 162 | 122.7 Ų | 122.7 | 85% | 0.848 | 80% | 0.8 | S | S | * | * | trans | -75.4 | 155.3 | 174.3 | -79.3 | 154.1 | 0 | 0 | 0 | 110.8 | ||||
| 329 | F | 39.2 | Very low | 38 | Very low | 208 Ų | 208 | 126.3 Ų | 126.3 | 91% | 0.912 | 80% | 0.799 | S | S | * | * | trans | 79.2 | 105.4 | -171.1 | -77.8 | -91.7 | 0 | 0 | 0 | 114.2 | ||||
| 330 | G | 31 | Very low | 37.9 | Very low | 80 Ų | 80 | 124.6 Ų | 124.6 | 83% | 0.825 | 80% | 0.796 | S | S | * | * | cis | 119.4 | 99.7 | 21.6 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 331 | G | 31.3 | Very low | 38.2 | Very low | 84 Ų | 84 | 122.5 Ų | 122.5 | 87% | 0.866 | 79% | 0.792 | S | S | * | * | trans | 164.7 | 78.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 332 | S | 33.1 | Very low | 38.7 | Very low | 118 Ų | 118 | 128 Ų | 128 | 83% | 0.825 | 79% | 0.791 | S | S | * | * | trans | -99.8 | 175.9 | 161.2 | -115.3 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 333 | P | 51.3 | Low | 38.5 | Very low | 116 Ų | 116 | 127.7 Ų | 127.7 | 75% | 0.753 | 79% | 0.794 | S | S | * | * | cis | -141.4 | 175.3 | -15.7 | 31.7 | -10.3 | 0 | 0 | 0 | 114.8 | ||||
| 334 | G | 33.2 | Very low | 38.3 | Very low | 62 Ų | 62 | 129.6 Ų | 129.6 | 64% | 0.639 | 80% | 0.796 | S | S | * | * | trans | 100.5 | 140.1 | 149.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 335 | M | 39.3 | Very low | 38.5 | Very low | 179 Ų | 179 | 129.8 Ų | 129.8 | 88% | 0.882 | 80% | 0.802 | S | S | * | * | cis | -156.5 | 151.1 | 10.2 | -69.4 | -64.4 | 179.1 | 0 | 0 | 109.9 | ||||
| 336 | A | 35.6 | Very low | 38.8 | Very low | 95 Ų | 95 | 128.6 Ų | 128.6 | 79% | 0.785 | 80% | 0.796 | S | S | * | * | trans | 48.4 | 115.2 | 141 | 0 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 337 | A | 38.4 | Very low | 39.1 | Very low | 110 Ų | 110 | 131.8 Ų | 131.8 | 91% | 0.909 | 80% | 0.8 | S | S | * | * | 47.3 | 125.5 | 124.5 | 0 | 0 | 0 | 0 | 0 | 120.7 | |||||
| 338 | G | 31.4 | Very low | 40 | Very low | 65 Ų | 65 | 130.1 Ų | 130.1 | 67% | 0.67 | 79% | 0.786 | S | S | * | * | trans | 153.3 | 99.7 | 150.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 339 | I | 44.3 | Very low | 40.5 | Very low | 157 Ų | 157 | 128.1 Ų | 128.1 | 81% | 0.805 | 78% | 0.776 | S | S | * | * | trans | 19.1 | 116.3 | 135.9 | 42.9 | 166.1 | 0 | 0 | 0 | 117.3 | ||||
| 340 | N | 37 | Very low | 41.1 | Very low | 147 Ų | 147 | 128.7 Ų | 128.7 | 79% | 0.786 | 77% | 0.772 | S | S | * | * | -170.3 | 128 | 126.3 | -88.5 | -39.5 | 0 | 0 | 0 | 112.9 | |||||
| 341 | T | 46.6 | Very low | 42.2 | Very low | 137 Ų | 137 | 134.3 Ų | 134.3 | 84% | 0.84 | 77% | 0.774 | S | S | * | * | trans | -76.1 | 107.6 | 170.4 | -73.1 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 342 | Y | 45.4 | Very low | 43.3 | Very low | 191 Ų | 191 | 133.7 Ų | 133.7 | 75% | 0.749 | 76% | 0.756 | S | S | * | * | trans | 169 | 126.6 | 149.4 | 61.7 | -91.1 | 0 | 0 | 0 | 105.4 | ||||
| 343 | D | 36.3 | Very low | 44.6 | Very low | 145 Ų | 145 | 132.7 Ų | 132.7 | 78% | 0.775 | 75% | 0.75 | S | S | * | * | -171 | 134.3 | 76.6 | -156.6 | -94.1 | 0 | 0 | 0 | 109.2 | N345 | D343-N345 PolarHBondContact O-N 3.34Š| |||
| 344 | L | 41.8 | Very low | 46 | Very low | 156 Ų | 156 | 130.3 Ų | 130.3 | 82% | 0.817 | 74% | 0.735 | S | S | * | * | trans | -74.4 | 105.2 | 178.1 | -75.1 | 163.3 | 0 | 0 | 0 | 110 | M346 | L344-M346 PolarHBondContact O-N 3.29Š| ||
| 345 | N | 44 | Very low | 48.2 | Very low | 143 Ų | 143 | 132.9 Ų | 132.9 | 77% | 0.765 | 73% | 0.734 | S | S | * | * | 26.9 | 83.2 | 125.4 | -165.7 | 2.3 | 0 | 0 | 0 | 115.5 | D343 | D343-N345 PolarHBondContact O-N 3.34Š| |||
| 346 | M | 47.5 | Very low | 50.1 | Low | 162 Ų | 162 | 127 Ų | 127 | 80% | 0.798 | 71% | 0.713 | S | S | * | * | trans | -121 | 55.9 | 168.1 | -124.8 | -75.1 | 99 | 0 | 0 | 109.8 | L344 P348 | L344-M346 PolarHBondContact O-N 3.29Å; M346-P348 VanDerWaalsContact O-CD 3.31Å; M346-P348 WeakPolarHBondContact O-CD 3.3Å | ||
| 347 | D | 39.5 | Very low | 52.5 | Low | 124 Ų | 124 | 124.5 Ų | 124.5 | 66% | 0.663 | 69% | 0.693 | S | S | * | * | trans | -99.9 | 101.9 | 168.2 | -103.3 | -63.3 | 0 | 0 | 0 | 109.6 | D349 | D347-D349 PolarHBondContact O-N 3.42Š| ||
| 348 | P | 53.8 | Low | 54.8 | Low | 92 Ų | 92 | 124.3 Ų | 124.3 | 60% | 0.597 | 68% | 0.676 | S | S | * | * | trans | -70.5 | 116.1 | 177.5 | 27.9 | -30.9 | 0 | 0 | 0 | 110 | M346 R350 | M346-P348 VanDerWaalsContact O-CD 3.31Å; M346-P348 WeakPolarHBondContact O-CD 3.3Å; P348-R350 PolarHBondContact O-N 3.42Å; P348-R350 VanDerWaalsContact O-N 3.11Å | ||
| 349 | D | 50.1 | Low | 57.5 | Low | 120 Ų | 120 | 129.8 Ų | 129.8 | 64% | 0.642 | 68% | 0.676 | S | S | * | * | trans | 54.8 | 39.3 | 141.6 | -100.5 | -63.4 | 0 | 0 | 0 | 119.7 | D347 K351 S352 | D347-D349 PolarHBondContact O-N 3.42Å; D349-K351 PolarHBondContact O-N 3.32Å; D349-K351 VanDerWaalsContact O-N 3.12Å; D349-S352 WeakPolarHBondContact OD1-CB 3.48Å; D349-S352 PolarHBondContact OD1-OG 3.17Å | ||
| 350 | R | 52.6 | Low | 59.4 | Low | 219 Ų | 219 | 128.4 Ų | 128.4 | 83% | 0.826 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.4 | -5.4 | 164.2 | -67.3 | -172.4 | -177 | -125.5 | 1.5 | 113.9 | P348 | P348-R350 PolarHBondContact O-N 3.42Å; P348-R350 VanDerWaalsContact O-N 3.11Å |
| 351 | K | 52.9 | Low | 61.7 | Low | 199 Ų | 199 | 127.2 Ų | 127.2 | 87% | 0.865 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.2 | -11.2 | -171.4 | -59.1 | 166.5 | -175.8 | 173.4 | 0 | 114.2 | D349 S353 | D349-K351 PolarHBondContact O-N 3.32Å; D349-K351 VanDerWaalsContact O-N 3.12Å; K351-S353 VanDerWaalsContact C-N 3.26Å; K351-S353 PolarHBondContact O-N 3Å |
| 352 | S | 55.2 | Low | 63.3 | Low | 70 Ų | 70 | 123.6 Ų | 123.6 | 49% | 0.49 | 64% | 0.64 | S | S | . | * | trans | -87.4 | 27.3 | -179.3 | -70.4 | 0 | 0 | 0 | 0 | 114.6 | D349 S354 | D349-S352 WeakPolarHBondContact OD1-CB 3.48Å; D349-S352 PolarHBondContact OD1-OG 3.17Å; S352-S354 PolarHBondContact O-N 3.34Å | ||
| 353 | S | 61.5 | Low | 64.9 | Low | 98 Ų | 98 | 121.8 Ų | 121.8 | 69% | 0.685 | 64% | 0.636 | S | S | * | * | trans | -80.1 | 32.2 | 175.9 | -57.9 | 0 | 0 | 0 | 0 | 113 | K351 | K351-S353 VanDerWaalsContact C-N 3.26Å; K351-S353 PolarHBondContact O-N 3Å | ||
| 354 | S | 80.4 | Confident | 66.7 | Low | 65 Ų | 65 | 121 Ų | 121 | 46% | 0.455 | 63% | 0.627 | S | S | . | * | trans | -73.5 | 136.8 | 174.5 | 177.3 | 0 | 0 | 0 | 0 | 109.5 | S352 A356 A357 L358 | S352-S354 PolarHBondContact O-N 3.34Å; S354-A356 PolarHBondContact O-N 3.17Å; S354-A356 PolarHBondContact OG-N 3.39Å; S354-A357 WeakPolarHBondContact O-CB 3.47Å; S354-A357 PolarHBondContact O-N 2.81Å; S354-L358 PolarHBondContact O-N 3.36Å | ||
| 355 | I | 79.1 | Confident | 68 | Low | 117 Ų | 117 | 118.8 Ų | 118.8 | 60% | 0.6 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -54 | -29.3 | 175 | -149.5 | 92.7 | 0 | 0 | 0 | 111.1 | R359 | I355-R359 WeakPolarHBondContact O-CB 3.24Å; I355-R359 WeakPolarHBondContact O-CD 3.32Å; I355-R359 WeakPolarHBondContact O-CG 3.37Å; I355-R359 PolarHBondContact O-N 3.48Å; I355-R359 VanDerWaalsContact O-N 3.1Å |
| 356 | A | 79.1 | Confident | 69 | Low | 54 Ų | 54 | 115.5 Ų | 115.5 | 45% | 0.446 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -70.1 | -46.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | S354 L358 R359 M360 | S354-A356 PolarHBondContact O-N 3.17Å; S354-A356 PolarHBondContact OG-N 3.39Å; A356-L358 VanDerWaalsContact C-N 3.34Å; A356-L358 PolarHBondContact O-N 3.37Å; A356-R359 PolarHBondContact O-N 3.37Å; A356-M360 VanDerWaalsContact O-CG 3.32Å; A356-M360 WeakPolarHBondContact O-CG 3.46Å; A356-M360 PolarHBondContact O-N 3.28Å |
| 357 | A | 86.4 | Confident | 69.8 | Low | 44 Ų | 44 | 110.3 Ų | 110.3 | 36% | 0.364 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -61.9 | -41.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | S354 R359 M360 K361 | S354-A357 WeakPolarHBondContact O-CB 3.47Å; S354-A357 PolarHBondContact O-N 2.81Å; A357-R359 PolarHBondContact O-N 3.25Å; A357-M360 PolarHBondContact O-N 2.81Å; A357-K361 WeakPolarHBondContact O-CB 3.41Å; A357-K361 PolarHBondContact O-N 2.59Å |
| 358 | L | 86.7 | Confident | 70.9 | Confident | 106 Ų | 106 | 106.1 Ų | 106.1 | 56% | 0.555 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -63.4 | -39 | 175.4 | -68.2 | 174.1 | 0 | 0 | 0 | 112.6 | S354 A356 A362 | S354-L358 PolarHBondContact O-N 3.36Å; A356-L358 VanDerWaalsContact C-N 3.34Å; A356-L358 PolarHBondContact O-N 3.37Å; L358-A362 WeakPolarHBondContact O-CB 3.45Å; L358-A362 PolarHBondContact O-N 2.88Å |
| 359 | R | 86.5 | Confident | 71.5 | Confident | 180 Ų | 180 | 107.9 Ų | 107.9 | 68% | 0.679 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -68.1 | -41.1 | 176.5 | -76.8 | 170 | 178.6 | -170.9 | -0.1 | 112.3 | I355 A356 A357 K363 | I355-R359 WeakPolarHBondContact O-CB 3.24Å; I355-R359 WeakPolarHBondContact O-CD 3.32Å; I355-R359 WeakPolarHBondContact O-CG 3.37Å; I355-R359 PolarHBondContact O-N 3.48Å; I355-R359 VanDerWaalsContact O-N 3.1Å; A356-R359 PolarHBondContact O-N 3.37Å; A357-R359 PolarHBondContact O-N 3.25Å; R359-K363 PolarHBondContact O-N 2.79Å |
| 360 | M | 85.4 | Confident | 71.9 | Confident | 127 Ų | 127 | 106.4 Ų | 106.4 | 63% | 0.626 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -64.8 | -46.8 | 176.5 | -67.2 | -65.3 | -109.2 | 0 | 0 | 110.7 | A356 A357 A362 K363 E364 | A356-M360 VanDerWaalsContact O-CG 3.32Å; A356-M360 WeakPolarHBondContact O-CG 3.46Å; A356-M360 PolarHBondContact O-N 3.28Å; A357-M360 PolarHBondContact O-N 2.81Å; M360-A362 VanDerWaalsContact C-N 3.34Å; M360-A362 PolarHBondContact O-N 3.06Å; M360-K363 WeakPolarHBondContact O-CB 3.41Å; M360-K363 PolarHBondContact O-N 2.81Å; M360-K363 VanDerWaalsContact O-N 3.08Å; M360-E364 PolarHBondContact O-N 3.17Å |
| 361 | K | 85.6 | Confident | 71.8 | Confident | 122 Ų | 122 | 105.3 Ų | 105.3 | 53% | 0.53 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -61.4 | -38.8 | 177.6 | -171.6 | 162.1 | -175.2 | 166.2 | 0 | 113 | A357 K363 E364 H365 | A357-K361 WeakPolarHBondContact O-CB 3.41Å; A357-K361 PolarHBondContact O-N 2.59Å; K361-K363 VanDerWaalsContact C-N 3.3Å; K361-K363 PolarHBondContact O-N 3.09Å; K361-E364 PolarHBondContact O-N 3.18Å; K361-H365 PolarHBondContact O-CD2 3.47Å; K361-H365 PolarHBondContact O-N 3.23Å |
| 362 | A | 79.6 | Confident | 71.8 | Confident | 61 Ų | 61 | 99.4 Ų | 99.4 | 50% | 0.504 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -63.1 | -37.5 | 175 | 0 | 0 | 0 | 0 | 0 | 112.4 | L358 M360 H365 S366 | L358-A362 WeakPolarHBondContact O-CB 3.45Å; L358-A362 PolarHBondContact O-N 2.88Å; M360-A362 VanDerWaalsContact C-N 3.34Å; M360-A362 PolarHBondContact O-N 3.06Å; A362-H365 PolarHBondContact O-N 3.09Å; A362-S366 PolarHBondContact O-N 3.37Å; A362-S366 PolarHBondContact O-OG 3.05Å |
| 363 | K | 79.6 | Confident | 71.3 | Confident | 153 Ų | 153 | 105.1 Ų | 105.1 | 67% | 0.665 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -68.8 | -36.7 | 178.2 | -164.1 | 176.3 | 167.6 | -168.2 | 0 | 111.7 | R359 M360 K361 S366 A367 | R359-K363 PolarHBondContact O-N 2.79Å; M360-K363 WeakPolarHBondContact O-CB 3.41Å; M360-K363 PolarHBondContact O-N 2.81Å; M360-K363 VanDerWaalsContact O-N 3.08Å; K361-K363 VanDerWaalsContact C-N 3.3Å; K361-K363 PolarHBondContact O-N 3.09Å; K363-S366 VanDerWaalsContact C-OG 3.31Å; K363-S366 VanDerWaalsContact CA-OG 3.3Å; K363-S366 WeakPolarHBondContact CA-OG 3.4Å; K363-S366 PolarHBondContact O-N 3.47Å; K363-S366 PolarHBondContact O-OG 3.34Å; K363-A367 PolarHBondContact O-N 3.11Å; K363-A367 VanDerWaalsContact O-N 3.14Å |
| 364 | E | 72.4 | Confident | 71.8 | Confident | 129 Ų | 129 | 105.5 Ų | 105.5 | 60% | 0.603 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -65.1 | -44.5 | 171.8 | -69.7 | 169.8 | -179.7 | 0 | 0 | 111.8 | M360 K361 S366 A367 A368 | M360-E364 PolarHBondContact O-N 3.17Å; K361-E364 PolarHBondContact O-N 3.18Å; E364-S366 VanDerWaalsContact C-N 3.31Å; E364-S366 PolarHBondContact O-N 3.29Å; E364-A367 PolarHBondContact O-N 3.23Å; E364-A368 WeakPolarHBondContact O-CB 3.33Å; E364-A368 PolarHBondContact O-N 2.79Å |
| 365 | H | 71 | Confident | 71.3 | Confident | 110 Ų | 110 | 107.6 Ų | 107.6 | 51% | 0.509 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -60.8 | -37.2 | 175.5 | -83.3 | -74 | 0 | 0 | 0 | 112.8 | K361 A362 A368 I369 | K361-H365 PolarHBondContact O-CD2 3.47Å; K361-H365 PolarHBondContact O-N 3.23Å; A362-H365 PolarHBondContact O-N 3.09Å; H365-A368 PolarHBondContact O-N 2.92Å; H365-I369 WeakPolarHBondContact O-CD1 3.21Å; H365-I369 WeakPolarHBondContact O-CG1 3.36Å; H365-I369 PolarHBondContact O-N 3.4Å |
| 366 | S | 65.1 | Low | 70.9 | Confident | 73 Ų | 73 | 107.1 Ų | 107.1 | 51% | 0.51 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -67.7 | -38 | 174.3 | 41.8 | 0 | 0 | 0 | 0 | 113.2 | A362 K363 E364 A368 S370 | A362-S366 PolarHBondContact O-N 3.37Å; A362-S366 PolarHBondContact O-OG 3.05Å; K363-S366 VanDerWaalsContact C-OG 3.31Å; K363-S366 VanDerWaalsContact CA-OG 3.3Å; K363-S366 WeakPolarHBondContact CA-OG 3.4Å; K363-S366 PolarHBondContact O-N 3.47Å; K363-S366 PolarHBondContact O-OG 3.34Å; E364-S366 VanDerWaalsContact C-N 3.31Å; E364-S366 PolarHBondContact O-N 3.29Å; S366-A368 VanDerWaalsContact C-N 3.25Å; S366-A368 PolarHBondContact O-N 3.23Å; S366-S370 PolarHBondContact O-OG 3.44Å |
| 367 | A | 64.1 | Low | 70.4 | Confident | 53 Ų | 53 | 110.2 Ų | 110.2 | 44% | 0.438 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -68.7 | -28.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | K363 E364 I369 S370 | K363-A367 PolarHBondContact O-N 3.11Å; K363-A367 VanDerWaalsContact O-N 3.14Å; E364-A367 PolarHBondContact O-N 3.23Å; A367-I369 VanDerWaalsContact C-N 3.34Å; A367-S370 WeakPolarHBondContact CA-OG 3.4Å; A367-S370 PolarHBondContact O-OG 3.45Å |
| 368 | A | 62.2 | Low | 69.4 | Low | 36 Ų | 36 | 114.4 Ų | 114.4 | 30% | 0.298 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -68.8 | -31.8 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | E364 H365 S366 W371 | E364-A368 WeakPolarHBondContact O-CB 3.33Å; E364-A368 PolarHBondContact O-N 2.79Å; H365-A368 PolarHBondContact O-N 2.92Å; S366-A368 VanDerWaalsContact C-N 3.25Å; S366-A368 PolarHBondContact O-N 3.23Å; A368-W371 HydrophobicContact CB-CZ2 4.29Å; A368-W371 WeakPolarHBondContact O-CZ2 3.33Å; A368-W371 PolarHBondContact O-NE1 2.83Å |
| 369 | I | 65.5 | Low | 68.3 | Low | 129 Ų | 129 | 114.9 Ų | 114.9 | 66% | 0.662 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -82 | -26.9 | -177.8 | -65.1 | 161.5 | 0 | 0 | 0 | 110.9 | H365 A367 W371 A372 | H365-I369 WeakPolarHBondContact O-CD1 3.21Å; H365-I369 WeakPolarHBondContact O-CG1 3.36Å; H365-I369 PolarHBondContact O-N 3.4Å; A367-I369 VanDerWaalsContact C-N 3.34Å; I369-W371 VanDerWaalsContact C-N 3.31Å; I369-W371 PolarHBondContact O-N 2.84Å; I369-A372 PolarHBondContact O-N 3.22Å |
| 370 | S | 58.7 | Low | 67 | Low | 89 Ų | 89 | 110.3 Ų | 110.3 | 62% | 0.622 | 61% | 0.607 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.3 | -9.4 | -178.6 | 40 | 0 | 0 | 0 | 0 | 115.7 | S366 A367 | S366-S370 PolarHBondContact O-OG 3.44Å; A367-S370 WeakPolarHBondContact CA-OG 3.4Å; A367-S370 PolarHBondContact O-OG 3.45Å |
| 371 | W | 50.9 | Low | 65.5 | Low | 197 Ų | 197 | 109 Ų | 109 | 75% | 0.746 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.3 | 1 | 175.8 | 54.6 | -109 | 0 | 0 | 0 | 114.4 | A368 I369 | A368-W371 HydrophobicContact CB-CZ2 4.29Å; A368-W371 WeakPolarHBondContact O-CZ2 3.33Å; A368-W371 PolarHBondContact O-NE1 2.83Å; I369-W371 VanDerWaalsContact C-N 3.31Å; I369-W371 PolarHBondContact O-N 2.84Å |
| 372 | A | 51.7 | Low | 63.9 | Low | 74 Ų | 74 | 107.9 Ų | 107.9 | 61% | 0.612 | 61% | 0.612 | S | S | * | * | trans | -101.2 | 18.9 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | I369 | I369-A372 PolarHBondContact O-N 3.22Š| ||
| 373 | T | 45.6 | Very low | 62.4 | Low | 191 Ų | 191 | 112.2 Ų | 112.2 | 100% | 1.172 | 62% | 0.622 | S | S | * | * | trans | -132 | 0 | 168.6 | -74.1 | 0 | 0 | 0 | 0 | 107.6 |
Retrieved 373 of 373 residues in 195 ms
(Link to these results)