| 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 | 44.3 | Very low | 43.2 | Very low | 223 Ų | 223 | 166.1 Ų | 166.1 | 100% | 1.099 | 87% | 0.869 | S | S | * | * | 0 | 81.4 | 0 | -81.7 | -69.7 | 175.3 | 0 | 0 | 104.7 | |||||
| 2 | D | 45 | Very low | 42.6 | Very low | 158 Ų | 158 | 164.6 Ų | 164.6 | 85% | 0.845 | 87% | 0.872 | S | S | * | * | trans | -117.1 | 111.7 | -160.7 | -60.3 | -81.6 | 0 | 0 | 0 | 107.1 | K4 | D2-K4 PolarHBondContact O-N 3.04Š| ||
| 3 | C | 52.9 | Low | 42.1 | Very low | 130 Ų | 130 | 161.9 Ų | 161.9 | 88% | 0.878 | 86% | 0.858 | S | S | * | * | trans | -81.7 | 100.9 | -172.3 | -67.1 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 4 | K | 42.8 | Very low | 41.9 | Very low | 195 Ų | 195 | 158 Ų | 158 | 85% | 0.848 | 85% | 0.85 | S | S | * | * | trans | 35.9 | 116.5 | 139.3 | -61 | -177.1 | 175.4 | -176.6 | 0 | 119.9 | D2 | D2-K4 PolarHBondContact O-N 3.04Š| ||
| 5 | S | 44.6 | Very low | 41.3 | Very low | 120 Ų | 120 | 159.1 Ų | 159.1 | 84% | 0.839 | 85% | 0.848 | S | S | * | * | trans | -73.8 | 137.4 | 155.4 | -43.4 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 6 | E | 44.2 | Very low | 41.1 | Very low | 193 Ų | 193 | 154.6 Ų | 154.6 | 90% | 0.902 | 84% | 0.84 | S | S | * | * | trans | -144.4 | 101.6 | 155.4 | -68.5 | -169.2 | 132.4 | 0 | 0 | 109.1 | ||||
| 7 | E | 37.8 | Very low | 40.4 | Very low | 200 Ų | 200 | 156.5 Ų | 156.5 | 94% | 0.935 | 84% | 0.839 | S | S | * | * | trans | -94.8 | 115.3 | 168.5 | -178.1 | 177.5 | 127.8 | 0 | 0 | 107.1 | A9 | E7-A9 PolarHBondContact O-N 3.48Š| ||
| 8 | S | 41.7 | Very low | 40.1 | Very low | 112 Ų | 112 | 158 Ų | 158 | 78% | 0.783 | 84% | 0.84 | S | S | * | * | trans | -84.1 | 113.8 | -178.1 | -174.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 9 | A | 38.9 | Very low | 39.9 | Very low | 85 Ų | 85 | 157.2 Ų | 157.2 | 70% | 0.702 | 83% | 0.831 | S | S | * | * | trans | -69.4 | 139.6 | 164.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | E7 | E7-A9 PolarHBondContact O-N 3.48Š| ||
| 10 | Q | 42.5 | Very low | 39.8 | Very low | 192 Ų | 192 | 155.6 Ų | 155.6 | 90% | 0.897 | 83% | 0.83 | S | S | * | * | trans | -121.8 | 109.8 | 154.6 | -73.1 | -171.7 | -24.1 | 0 | 0 | 108.1 | ||||
| 11 | R | 41.1 | Very low | 39.7 | Very low | 219 Ų | 219 | 154.7 Ų | 154.7 | 83% | 0.826 | 83% | 0.825 | S | S | * | * | trans | -88.7 | 138.9 | 161.3 | -72.7 | -175.9 | 174.8 | -157.6 | -0.6 | 108 | ||||
| 12 | T | 35.8 | Very low | 39 | Very low | 148 Ų | 148 | 147.2 Ų | 147.2 | 91% | 0.908 | 81% | 0.806 | S | S | * | * | trans | -143.5 | 130.6 | 143.4 | 32.5 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 13 | D | 35.9 | Very low | 38.9 | Very low | 130 Ų | 130 | 147.1 Ų | 147.1 | 70% | 0.695 | 80% | 0.804 | S | S | * | * | trans | -73 | 144 | -166.3 | -84.3 | -67 | 0 | 0 | 0 | 116.2 | ||||
| 14 | S | 39.5 | Very low | 38.6 | Very low | 107 Ų | 107 | 146.4 Ų | 146.4 | 75% | 0.748 | 80% | 0.798 | S | S | * | * | 55.3 | 120.1 | 124.4 | -52.8 | 0 | 0 | 0 | 0 | 121.5 | |||||
| 15 | Q | 32.7 | Very low | 38.6 | Very low | 174 Ų | 174 | 144.6 Ų | 144.6 | 81% | 0.813 | 79% | 0.793 | S | S | * | * | trans | -138.6 | 112.8 | 136.8 | -164.7 | 166.6 | 12.5 | 0 | 0 | 110 | ||||
| 16 | A | 37.8 | Very low | 38.6 | Very low | 88 Ų | 88 | 143.3 Ų | 143.3 | 73% | 0.727 | 79% | 0.79 | S | S | * | * | trans | -72.5 | 136.8 | 171.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 17 | F | 28.6 | Very low | 38.3 | Very low | 187 Ų | 187 | 137.8 Ų | 137.8 | 82% | 0.82 | 78% | 0.784 | S | S | * | * | trans | -144.3 | 142.7 | 148.5 | -97.2 | -78.6 | 0 | 0 | 0 | 109.5 | ||||
| 18 | Q | 36.1 | Very low | 38.8 | Very low | 183 Ų | 183 | 130.7 Ų | 130.7 | 86% | 0.855 | 76% | 0.764 | S | S | * | * | trans | -78.4 | 159.4 | -156.6 | -67.2 | 164.8 | 14.5 | 0 | 0 | 113.6 | ||||
| 19 | E | 36 | Very low | 39.3 | Very low | 142 Ų | 142 | 134.3 Ų | 134.3 | 66% | 0.664 | 77% | 0.769 | S | S | * | * | trans | -32.7 | 156.5 | 159.3 | -107.2 | -175 | 115.3 | 0 | 0 | 116 | D21 | E19-D21 WeakPolarHBondContact OE1-CA 3.38Å; E19-D21 PolarHBondContact OE1-N 3.03Å | ||
| 20 | P | 38.7 | Very low | 40.3 | Very low | 126 Ų | 126 | 136 Ų | 136 | 82% | 0.818 | 77% | 0.766 | S | S | * | * | -126.8 | 118.7 | 98.8 | 13.5 | 5.6 | 0 | 0 | 0 | 112.2 | |||||
| 21 | D | 36.7 | Very low | 41 | Very low | 136 Ų | 136 | 129.7 Ų | 129.7 | 73% | 0.727 | 75% | 0.753 | S | S | * | * | 15.5 | 125.7 | 127.6 | -95.3 | -46.6 | 0 | 0 | 0 | 116.7 | E19 | E19-D21 WeakPolarHBondContact OE1-CA 3.38Å; E19-D21 PolarHBondContact OE1-N 3.03Å | |||
| 22 | G | 30.6 | Very low | 41.8 | Very low | 67 Ų | 67 | 125.2 Ų | 125.2 | 69% | 0.691 | 75% | 0.745 | S | S | * | * | trans | 148.2 | 70.7 | 155.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | P24 | G22-P24 WeakPolarHBondContact O-CD 3.47Š| ||
| 23 | L | 42.4 | Very low | 43.2 | Very low | 155 Ų | 155 | 121.2 Ų | 121.2 | 81% | 0.812 | 72% | 0.723 | S | S | * | * | trans | -70.3 | 135.6 | 153.3 | -174.8 | 68.9 | 0 | 0 | 0 | 108.4 | ||||
| 24 | P | 46.5 | Very low | 44.5 | Very low | 115 Ų | 115 | 121.4 Ų | 121.4 | 75% | 0.747 | 72% | 0.72 | S | S | * | * | trans | -122.2 | 122.1 | 130.8 | 32.8 | -24.4 | 0 | 0 | 0 | 110.4 | G22 | G22-P24 WeakPolarHBondContact O-CD 3.47Š| ||
| 25 | E | 42.3 | Very low | 45.8 | Very low | 157 Ų | 157 | 118.8 Ų | 118.8 | 73% | 0.734 | 70% | 0.701 | S | S | * | * | trans | 3.1 | 132.3 | 144.3 | -79.1 | -79.1 | 143.4 | 0 | 0 | 118.7 | ||||
| 26 | A | 44.6 | Very low | 47.4 | Very low | 94 Ų | 94 | 116.8 Ų | 116.8 | 78% | 0.777 | 69% | 0.69 | S | S | * | * | trans | 73.5 | 124.7 | 134.2 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 27 | G | 37.5 | Very low | 49 | Very low | 77 Ų | 77 | 118.6 Ų | 118.6 | 79% | 0.794 | 68% | 0.683 | S | S | * | * | trans | 118.2 | 89.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 28 | G | 48.9 | Very low | 51 | Low | 50 Ų | 50 | 117.1 Ų | 117.1 | 52% | 0.515 | 68% | 0.683 | S | S | . | * | 91.8 | 102.1 | 87.9 | 0 | 0 | 0 | 0 | 0 | 108.3 | D30 | G28-D30 PolarHBondContact O-N 3.39Š| |||
| 29 | E | 52.9 | Low | 52.6 | Low | 188 Ų | 188 | 114.5 Ų | 114.5 | 88% | 0.879 | 67% | 0.674 | S | S | * | * | S | Bend | trans | 58.8 | 13.6 | 149.7 | 73.2 | -151 | 141.7 | 0 | 0 | 123.1 | ||
| 30 | D | 58.6 | Low | 54.1 | Low | 120 Ų | 120 | 114.1 Ų | 114.1 | 64% | 0.642 | 67% | 0.673 | S | S | * | * | trans | -104.7 | -10.2 | -175.2 | -72.5 | -35.7 | 0 | 0 | 0 | 118.1 | G28 L32 | G28-D30 PolarHBondContact O-N 3.39Å; D30-L32 PolarHBondContact O-N 3.41Å | ||
| 31 | G | 57.7 | Low | 55.7 | Low | 60 Ų | 60 | 113.7 Ų | 113.7 | 62% | 0.619 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -74.6 | -26.7 | -178.4 | 0 | 0 | 0 | 0 | 0 | 115 | ||
| 32 | L | 58.4 | Low | 57.2 | Low | 125 Ų | 125 | 114 Ų | 114 | 65% | 0.654 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -77.8 | -39.1 | 178 | -69 | 173.8 | 0 | 0 | 0 | 111 | D30 E34 S35 F36 | D30-L32 PolarHBondContact O-N 3.41Å; L32-E34 VanDerWaalsContact C-N 3.31Å; L32-E34 PolarHBondContact O-N 3.05Å; L32-S35 PolarHBondContact O-N 3.14Å; L32-S35 VanDerWaalsContact O-N 3.14Å; L32-S35 PolarHBondContact O-OG 3.42Å; L32-F36 HydrophobicContact CB-CD2 4.4Å; L32-F36 HydrophobicContact CB-CE2 4.06Å; L32-F36 WeakPolarHBondContact O-CD2 3.18Å; L32-F36 PolarHBondContact O-N 3.15Å |
| 33 | S | 64.5 | Low | 58.9 | Low | 64 Ų | 64 | 116.1 Ų | 116.1 | 45% | 0.448 | 67% | 0.668 | S | S | . | * | H | α-helix | trans | -59.5 | -41.3 | 179.8 | -164.2 | 0 | 0 | 0 | 0 | 112 | F36 Q37 | S33-F36 PolarHBondContact O-N 3.45Å; S33-Q37 PolarHBondContact O-N 3.31Å |
| 34 | E | 64.6 | Low | 59.5 | Low | 135 Ų | 135 | 117.8 Ų | 117.8 | 63% | 0.631 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -67.1 | -37.9 | 176.3 | -160.8 | 177.9 | -165.1 | 0 | 0 | 112.1 | L32 F36 Q37 L38 | L32-E34 VanDerWaalsContact C-N 3.31Å; L32-E34 PolarHBondContact O-N 3.05Å; E34-F36 VanDerWaalsContact C-N 3.31Å; E34-F36 PolarHBondContact O-N 3.18Å; E34-Q37 PolarHBondContact O-N 2.69Å; E34-L38 PolarHBondContact O-N 3.49Å |
| 35 | S | 66.1 | Low | 59.6 | Low | 51 Ų | 51 | 120.1 Ų | 120.1 | 36% | 0.357 | 67% | 0.667 | S | S | . | * | H | α-helix | trans | -67.3 | -30.2 | 175.9 | 77 | 0 | 0 | 0 | 0 | 113.3 | L32 L39 | L32-S35 PolarHBondContact O-N 3.14Å; L32-S35 VanDerWaalsContact O-N 3.14Å; L32-S35 PolarHBondContact O-OG 3.42Å; S35-L39 PolarHBondContact O-N 3.29Å |
| 36 | F | 65.8 | Low | 60.1 | Low | 133 Ų | 133 | 121.3 Ų | 121.3 | 58% | 0.583 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -77.2 | -26.7 | 175.9 | -72 | -64.4 | 0 | 0 | 0 | 113 | L32 S33 E34 L39 Q40 | L32-F36 HydrophobicContact CB-CD2 4.4Å; L32-F36 HydrophobicContact CB-CE2 4.06Å; L32-F36 WeakPolarHBondContact O-CD2 3.18Å; L32-F36 PolarHBondContact O-N 3.15Å; S33-F36 PolarHBondContact O-N 3.45Å; E34-F36 VanDerWaalsContact C-N 3.31Å; E34-F36 PolarHBondContact O-N 3.18Å; F36-L39 HydrophobicContact CD1-CD1 4.29Å; F36-L39 PolarHBondContact O-N 2.95Å; F36-Q40 PolarHBondContact O-N 3.3Å |
| 37 | Q | 70.9 | Confident | 60.3 | Low | 125 Ų | 125 | 125.8 Ų | 125.8 | 58% | 0.584 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -67 | -35.2 | 171.8 | -77.5 | 176.2 | 13.9 | 0 | 0 | 112.2 | S33 E34 L39 Q40 | S33-Q37 PolarHBondContact O-N 3.31Å; E34-Q37 PolarHBondContact O-N 2.69Å; Q37-L39 VanDerWaalsContact C-N 3.29Å; Q37-L39 PolarHBondContact O-N 3.46Å; Q37-Q40 WeakPolarHBondContact O-CB 2.93Å; Q37-Q40 PolarHBondContact O-N 3.29Å; Q37-Q40 VanDerWaalsContact O-N 3.15Å |
| 38 | L | 72 | Confident | 60.9 | Low | 157 Ų | 157 | 126 Ų | 126 | 82% | 0.822 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -70.8 | -24.6 | 174.5 | -74.7 | 163.2 | 0 | 0 | 0 | 113.3 | E34 Q40 | E34-L38 PolarHBondContact O-N 3.49Å; L38-Q40 VanDerWaalsContact C-N 3.27Å |
| 39 | L | 69.1 | Low | 60.8 | Low | 127 Ų | 127 | 131.3 Ų | 131.3 | 67% | 0.665 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.1 | -3.6 | 172.7 | -79.3 | 157.8 | 0 | 0 | 0 | 112.8 | S35 F36 Q37 V41 | S35-L39 PolarHBondContact O-N 3.29Å; F36-L39 HydrophobicContact CD1-CD1 4.29Å; F36-L39 PolarHBondContact O-N 2.95Å; Q37-L39 VanDerWaalsContact C-N 3.29Å; Q37-L39 PolarHBondContact O-N 3.46Å; L39-V41 VanDerWaalsContact C-N 3.34Å; L39-V41 PolarHBondContact O-N 3.3Å |
| 40 | Q | 66.6 | Low | 60.7 | Low | 135 Ų | 135 | 131.2 Ų | 131.2 | 63% | 0.631 | 67% | 0.667 | S | S | * | * | trans | -75.9 | 89.1 | 177.4 | -163.9 | 162.4 | 10 | 0 | 0 | 109.4 | F36 Q37 L38 D42 | F36-Q40 PolarHBondContact O-N 3.3Å; Q37-Q40 WeakPolarHBondContact O-CB 2.93Å; Q37-Q40 PolarHBondContact O-N 3.29Å; Q37-Q40 VanDerWaalsContact O-N 3.15Å; L38-Q40 VanDerWaalsContact C-N 3.27Å; Q40-D42 PolarHBondContact O-N 3.13Å | ||
| 41 | V | 72.8 | Confident | 60.2 | Low | 117 Ų | 117 | 129.5 Ų | 129.5 | 71% | 0.709 | 66% | 0.661 | S | S | * | * | trans | -75.7 | 107.7 | 167.3 | 179.8 | 0 | 0 | 0 | 0 | 107.1 | L39 V43 | L39-V41 VanDerWaalsContact C-N 3.34Å; L39-V41 PolarHBondContact O-N 3.3Å; V41-V43 VanDerWaalsContact C-N 3.3Å; V41-V43 HydrophobicContact CG1-CG2 4.01Å; V41-V43 PolarHBondContact O-N 2.91Å | ||
| 42 | D | 68.1 | Low | 59.8 | Low | 143 Ų | 143 | 130 Ų | 130 | 77% | 0.765 | 66% | 0.655 | S | S | * | * | trans | -66.7 | 94.4 | 167.2 | -84.3 | -28.3 | 0 | 0 | 0 | 108.6 | Q40 E44 | Q40-D42 PolarHBondContact O-N 3.13Å; D42-E44 VanDerWaalsContact C-N 3.32Å; D42-E44 PolarHBondContact O-N 2.83Å; D42-E44 VanDerWaalsContact O-N 3.13Å | ||
| 43 | V | 66.1 | Low | 59.5 | Low | 111 Ų | 111 | 129.3 Ų | 129.3 | 67% | 0.673 | 66% | 0.658 | S | S | * | * | trans | -78.5 | 90.6 | 165.6 | 179.8 | 0 | 0 | 0 | 0 | 106.2 | V41 Y45 | V41-V43 VanDerWaalsContact C-N 3.3Å; V41-V43 HydrophobicContact CG1-CG2 4.01Å; V41-V43 PolarHBondContact O-N 2.91Å; V43-Y45 PolarHBondContact O-N 2.97Å | ||
| 44 | E | 55.2 | Low | 58.8 | Low | 189 Ų | 189 | 129.5 Ų | 129.5 | 88% | 0.883 | 66% | 0.664 | S | S | * | * | trans | -58.9 | 96.1 | 156 | -87.3 | -165 | 157.7 | 0 | 0 | 107.2 | D42 E46 | D42-E44 VanDerWaalsContact C-N 3.32Å; D42-E44 PolarHBondContact O-N 2.83Å; D42-E44 VanDerWaalsContact O-N 3.13Å; E44-E46 PolarHBondContact O-N 3.25Å | ||
| 45 | Y | 49.3 | Very low | 58.1 | Low | 164 Ų | 164 | 126.5 Ų | 126.5 | 64% | 0.643 | 65% | 0.652 | S | S | * | * | trans | -75.5 | 83 | 171.3 | -171.7 | -101.4 | 0 | 0 | 0 | 107.3 | V43 R47 | V43-Y45 PolarHBondContact O-N 2.97Å; Y45-R47 HydrophobicContact CD1-CB 3.95Å; Y45-R47 VanDerWaalsContact CE1-CA 3.42Å; Y45-R47 HydrophobicContact CE1-CB 3.65Å; Y45-R47 HydrophobicContact CE1-CG 3.96Å; Y45-R47 PolarHBondContact O-N 2.9Å | ||
| 46 | E | 53 | Low | 57.6 | Low | 182 Ų | 182 | 128.1 Ų | 128.1 | 85% | 0.85 | 66% | 0.663 | S | S | * | * | trans | -62.5 | 99.3 | 155.7 | -162.7 | -175.7 | -139.4 | 0 | 0 | 105.4 | E44 P48 | E44-E46 PolarHBondContact O-N 3.25Å; E46-P48 WeakPolarHBondContact O-CD 3.03Å | ||
| 47 | R | 48.7 | Very low | 57.1 | Low | 189 Ų | 189 | 124.7 Ų | 124.7 | 71% | 0.713 | 66% | 0.66 | S | S | * | * | trans | -52.2 | 110.2 | -179.2 | 173.5 | -177 | -70 | -123.9 | -0.5 | 107.6 | Y45 E49 | Y45-R47 HydrophobicContact CD1-CB 3.95Å; Y45-R47 VanDerWaalsContact CE1-CA 3.42Å; Y45-R47 HydrophobicContact CE1-CB 3.65Å; Y45-R47 HydrophobicContact CE1-CG 3.96Å; Y45-R47 PolarHBondContact O-N 2.9Å; R47-E49 PolarHBondContact O-N 2.64Å | ||
| 48 | P | 49.2 | Very low | 56.3 | Low | 80 Ų | 80 | 123.7 Ų | 123.7 | 52% | 0.519 | 66% | 0.662 | S | S | . | * | trans | -67.9 | 114.7 | 163.1 | -4.8 | 23.8 | 0 | 0 | 0 | 103.9 | E46 E50 | E46-P48 WeakPolarHBondContact O-CD 3.03Å; P48-E50 PolarHBondContact O-N 3.04Å | ||
| 49 | E | 46.4 | Very low | 55.3 | Low | 163 Ų | 163 | 125.8 Ų | 125.8 | 76% | 0.762 | 66% | 0.659 | S | S | * | * | trans | -28.6 | 132.5 | 156.8 | -86.2 | -81.2 | 149.2 | 0 | 0 | 109.8 | R47 T51 | R47-E49 PolarHBondContact O-N 2.64Å; E49-T51 VanDerWaalsContact C-N 3.27Å; E49-T51 PolarHBondContact O-N 3.37Å | ||
| 50 | E | 50.9 | Low | 55.3 | Low | 185 Ų | 185 | 121 Ų | 121 | 86% | 0.864 | 64% | 0.636 | S | S | * | * | trans | -48 | 83.8 | -174.6 | -73.3 | 174.7 | 136.5 | 0 | 0 | 112.4 | P48 S52 | P48-E50 PolarHBondContact O-N 3.04Å; E50-S52 PolarHBondContact O-N 2.91Å | ||
| 51 | T | 48.8 | Very low | 56.2 | Low | 84 Ų | 84 | 118.1 Ų | 118.1 | 52% | 0.515 | 63% | 0.631 | S | S | . | * | trans | -78.8 | 88 | 167.7 | 48.2 | 0 | 0 | 0 | 0 | 106.6 | E49 W59 | E49-T51 VanDerWaalsContact C-N 3.27Å; E49-T51 PolarHBondContact O-N 3.37Å; T51-W59 HydrophobicContact CG2-CH2 4.41Å | ||
| 52 | S | 50.5 | Low | 57.2 | Low | 70 Ų | 70 | 120.7 Ų | 120.7 | 49% | 0.49 | 63% | 0.633 | S | S | . | * | trans | -33.9 | 134.5 | 161.4 | -153.7 | 0 | 0 | 0 | 0 | 109.8 | E50 A54 N55 | E50-S52 PolarHBondContact O-N 2.91Å; S52-A54 PolarHBondContact O-N 2.85Å; S52-N55 PolarHBondContact O-N 2.89Å | ||
| 53 | P | 51.8 | Low | 58.3 | Low | 111 Ų | 111 | 118.2 Ų | 118.2 | 72% | 0.721 | 62% | 0.62 | S | S | * | * | G | 310 helix | trans | -58.8 | -14.8 | -173.9 | 21.3 | -31.3 | 0 | 0 | 0 | 113.3 | N55 S56 | P53-N55 VanDerWaalsContact C-N 3.28Å; P53-N55 PolarHBondContact O-N 2.86Å; P53-S56 PolarHBondContact O-N 3.46Å; P53-S56 PolarHBondContact O-OG 3.49Å |
| 54 | A | 49.9 | Very low | 59.7 | Low | 68 Ų | 68 | 118.4 Ų | 118.4 | 56% | 0.562 | 62% | 0.615 | S | S | * | * | G | 310 helix | trans | -60 | -29.1 | 170.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | S52 | S52-A54 PolarHBondContact O-N 2.85Š|
| 55 | N | 49.9 | Very low | 61.4 | Low | 73 Ų | 73 | 112 Ų | 112 | 39% | 0.39 | 58% | 0.584 | S | S | . | * | G | 310 helix | trans | -83.4 | -20 | -176.1 | -66 | -25.4 | 0 | 0 | 0 | 113.2 | S52 P53 A57 V58 | S52-N55 PolarHBondContact O-N 2.89Å; P53-N55 VanDerWaalsContact C-N 3.28Å; P53-N55 PolarHBondContact O-N 2.86Å; N55-A57 VanDerWaalsContact C-N 3.26Å; N55-A57 PolarHBondContact O-N 3.14Å; N55-V58 WeakPolarHBondContact O-CB 3.31Å; N55-V58 PolarHBondContact O-N 3.27Å; N55-V58 VanDerWaalsContact O-N 3.14Å |
| 56 | S | 55.4 | Low | 63.5 | Low | 84 Ų | 84 | 112.8 Ų | 112.8 | 59% | 0.587 | 59% | 0.587 | S | S | * | * | G | 310 helix | trans | -66.2 | -28 | 177.7 | 70.4 | 0 | 0 | 0 | 0 | 113.1 | P53 V58 | P53-S56 PolarHBondContact O-N 3.46Å; P53-S56 PolarHBondContact O-OG 3.49Å; S56-V58 PolarHBondContact O-N 2.96Å |
| 57 | A | 55.4 | Low | 65.6 | Low | 61 Ų | 61 | 110.3 Ų | 110.3 | 50% | 0.504 | 57% | 0.573 | S | S | . | * | G | 310 helix | trans | -69.5 | -20.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | N55 S60 Q65 | N55-A57 VanDerWaalsContact C-N 3.26Å; N55-A57 PolarHBondContact O-N 3.14Å; A57-S60 PolarHBondContact O-OG 3.33Å; A57-Q65 PolarHBondContact O-NE2 3.42Å |
| 58 | V | 54.1 | Low | 67.9 | Low | 105 Ų | 105 | 106.2 Ų | 106.2 | 64% | 0.636 | 56% | 0.562 | S | S | * | * | G | 310 helix | trans | -83.1 | -21.2 | -175 | -176.6 | 0 | 0 | 0 | 0 | 112.1 | N55 S56 | N55-V58 WeakPolarHBondContact O-CB 3.31Å; N55-V58 PolarHBondContact O-N 3.27Å; N55-V58 VanDerWaalsContact O-N 3.14Å; S56-V58 PolarHBondContact O-N 2.96Å |
| 59 | W | 51.1 | Low | 70.1 | Confident | 200 Ų | 200 | 109.7 Ų | 109.7 | 76% | 0.758 | 57% | 0.565 | S | S | * | * | S | Bend | trans | -100.7 | -0.9 | -171.6 | -56.5 | -10.9 | 0 | 0 | 0 | 114.6 | T51 S61 | T51-W59 HydrophobicContact CG2-CH2 4.41Å; W59-S61 PolarHBondContact O-N 3.24Å |
| 60 | S | 67.1 | Low | 72.6 | Confident | 26 Ų | 26 | 106.6 Ų | 106.6 | 18% | 0.182 | 55% | 0.55 | C | S | . | * | S | Bend | trans | -76.9 | 123 | 175.2 | 31.5 | 0 | 0 | 0 | 0 | 110.3 | A57 K62 M64 Q65 | A57-S60 PolarHBondContact O-OG 3.33Å; S60-K62 PolarHBondContact O-N 2.84Å; S60-M64 VanDerWaalsContact CB-SD 3.52Å; S60-Q65 PolarHBondContact O-NE2 3.26Å; S60-Q65 PolarHBondContact OG-NE2 3.36Å |
| 61 | S | 87.4 | Confident | 74.8 | Confident | 76 Ų | 76 | 105.5 Ų | 105.5 | 53% | 0.531 | 54% | 0.538 | S | S | . | . | trans | -48.6 | 141.8 | 176.6 | 170.7 | 0 | 0 | 0 | 0 | 111.4 | W59 N63 M64 Q65 | W59-S61 PolarHBondContact O-N 3.24Å; S61-N63 PolarHBondContact O-N 3.39Å; S61-N63 PolarHBondContact OG-N 3.14Å; S61-M64 WeakPolarHBondContact O-CA 3.47Å; S61-M64 WeakPolarHBondContact O-CB 3.34Å; S61-M64 PolarHBondContact O-N 2.97Å; S61-Q65 PolarHBondContact O-N 3.34Å; S61-Q65 VanDerWaalsContact O-N 3.14Å | ||
| 62 | K | 92.5 | Very high | 77.1 | Confident | 170 Ų | 170 | 106.3 Ų | 106.3 | 74% | 0.739 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -49.3 | -31.5 | 177.3 | -69 | 176.9 | 179.2 | 171.8 | 0 | 112.6 | S60 R66 | S60-K62 PolarHBondContact O-N 2.84Å; K62-R66 VanDerWaalsContact O-CG 3.23Å; K62-R66 WeakPolarHBondContact O-CG 3.23Å; K62-R66 PolarHBondContact O-N 3.49Å; K62-R66 VanDerWaalsContact O-N 3.13Å |
| 63 | N | 92.2 | Very high | 79.4 | Confident | 92 Ų | 92 | 110.7 Ų | 110.7 | 49% | 0.492 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -69.6 | -44.7 | 176.2 | -166.7 | -44.9 | 0 | 0 | 0 | 112.3 | S61 Q65 R66 K67 | S61-N63 PolarHBondContact O-N 3.39Å; S61-N63 PolarHBondContact OG-N 3.14Å; N63-Q65 PolarHBondContact O-N 3.44Å; N63-R66 WeakPolarHBondContact O-CB 3.46Å; N63-R66 PolarHBondContact O-N 2.91Å; N63-K67 PolarHBondContact O-N 3.2Å; N63-K67 VanDerWaalsContact OD1-CE 3.31Å; N63-K67 WeakPolarHBondContact OD1-CE 3.33Å |
| 64 | M | 94 | Very high | 81.6 | Confident | 114 Ų | 114 | 107.8 Ų | 107.8 | 56% | 0.562 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -59 | -47.2 | 176.7 | -173.6 | -168.7 | -66.4 | 0 | 0 | 110.9 | S60 S61 R66 K67 Q68 | S60-M64 VanDerWaalsContact CB-SD 3.52Å; S61-M64 WeakPolarHBondContact O-CA 3.47Å; S61-M64 WeakPolarHBondContact O-CB 3.34Å; S61-M64 PolarHBondContact O-N 2.97Å; M64-R66 VanDerWaalsContact C-N 3.34Å; M64-R66 PolarHBondContact O-N 2.98Å; M64-K67 PolarHBondContact O-N 3.46Å; M64-Q68 PolarHBondContact O-N 2.96Å |
| 65 | Q | 91.4 | Very high | 83.9 | Confident | 54 Ų | 54 | 107.8 Ų | 107.8 | 25% | 0.252 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.9 | -38.3 | 177.4 | -64.9 | -176.9 | 0.4 | 0 | 0 | 112.4 | A57 S60 S61 N63 Q68 R69 | A57-Q65 PolarHBondContact O-NE2 3.42Å; S60-Q65 PolarHBondContact O-NE2 3.26Å; S60-Q65 PolarHBondContact OG-NE2 3.36Å; S61-Q65 PolarHBondContact O-N 3.34Å; S61-Q65 VanDerWaalsContact O-N 3.14Å; N63-Q65 PolarHBondContact O-N 3.44Å; Q65-Q68 PolarHBondContact O-N 2.9Å; Q65-R69 WeakPolarHBondContact O-CB 3.47Å; Q65-R69 WeakPolarHBondContact O-CG 3.49Å; Q65-R69 PolarHBondContact O-N 3.26Å |
| 66 | R | 94.8 | Very high | 86.1 | Confident | 182 Ų | 182 | 107.6 Ų | 107.6 | 69% | 0.687 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -61.9 | -45.8 | 174.4 | -77.6 | 173.3 | -175.6 | -162 | 2 | 111.7 | K62 N63 M64 R69 H70 | K62-R66 VanDerWaalsContact O-CG 3.23Å; K62-R66 WeakPolarHBondContact O-CG 3.23Å; K62-R66 PolarHBondContact O-N 3.49Å; K62-R66 VanDerWaalsContact O-N 3.13Å; N63-R66 WeakPolarHBondContact O-CB 3.46Å; N63-R66 PolarHBondContact O-N 2.91Å; M64-R66 VanDerWaalsContact C-N 3.34Å; M64-R66 PolarHBondContact O-N 2.98Å; R66-R69 PolarHBondContact O-N 3.22Å; R66-H70 WeakPolarHBondContact O-CB 3.44Å; R66-H70 PolarHBondContact O-N 3.39Å |
| 67 | K | 96.3 | Very high | 88.1 | Confident | 130 Ų | 130 | 107.3 Ų | 107.3 | 57% | 0.565 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -62.7 | -44.2 | 177.3 | -72.9 | -176.6 | 176.9 | -178.3 | 0 | 111.3 | N63 M64 H70 W71 | N63-K67 PolarHBondContact O-N 3.2Å; N63-K67 VanDerWaalsContact OD1-CE 3.31Å; N63-K67 WeakPolarHBondContact OD1-CE 3.33Å; M64-K67 PolarHBondContact O-N 3.46Å; K67-H70 WeakPolarHBondContact O-CB 3.29Å; K67-H70 PolarHBondContact O-N 3.13Å; K67-W71 VanDerWaalsContact O-CD1 3.23Å; K67-W71 PolarHBondContact O-N 3.4Å |
| 68 | Q | 96.4 | Very high | 90.1 | Very high | 103 Ų | 103 | 110.5 Ų | 110.5 | 48% | 0.481 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -57.9 | -55 | 175.8 | 179.8 | 179.9 | -10.2 | 0 | 0 | 111.5 | M64 Q65 H70 W71 E72 | M64-Q68 PolarHBondContact O-N 2.96Å; Q65-Q68 PolarHBondContact O-N 2.9Å; Q68-H70 PolarHBondContact O-N 3.11Å; Q68-W71 PolarHBondContact O-N 3.2Å; Q68-W71 VanDerWaalsContact O-N 3.11Å; Q68-E72 HydrophobicContact CG-CG 4.43Å; Q68-E72 VanDerWaalsContact CG-OE1 3.29Å; Q68-E72 WeakPolarHBondContact CG-OE1 3.5Å; Q68-E72 PolarHBondContact NE2-OE1 2.94Å; Q68-E72 WeakPolarHBondContact O-CG 3.34Å; Q68-E72 PolarHBondContact O-N 3.13Å |
| 69 | R | 96.8 | Very high | 92.2 | Very high | 153 Ų | 153 | 112.4 Ų | 112.4 | 58% | 0.577 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -60 | -31.5 | 178.6 | -69.5 | 179.4 | -168.8 | -179 | 5.2 | 112.9 | Q65 R66 R73 | Q65-R69 WeakPolarHBondContact O-CB 3.47Å; Q65-R69 WeakPolarHBondContact O-CG 3.49Å; Q65-R69 PolarHBondContact O-N 3.26Å; R66-R69 PolarHBondContact O-N 3.22Å; R69-R73 WeakPolarHBondContact O-CB 3.35Å; R69-R73 WeakPolarHBondContact O-CG 3.29Å; R69-R73 PolarHBondContact O-N 3.13Å; R69-R73 VanDerWaalsContact O-N 3.13Å; R69-R73 PolarHBondContact O-NE 3.36Å; R69-R73 VanDerWaalsContact O-NE 3.17Å |
| 70 | H | 97.4 | Very high | 94.4 | Very high | 98 Ų | 98 | 106.6 Ų | 106.6 | 45% | 0.454 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -68.8 | -47.2 | 175.8 | 177.1 | 70.4 | 0 | 0 | 0 | 111.3 | R66 K67 Q68 R73 I74 | R66-H70 WeakPolarHBondContact O-CB 3.44Å; R66-H70 PolarHBondContact O-N 3.39Å; K67-H70 WeakPolarHBondContact O-CB 3.29Å; K67-H70 PolarHBondContact O-N 3.13Å; Q68-H70 PolarHBondContact O-N 3.11Å; H70-R73 WeakPolarHBondContact O-CB 3.39Å; H70-R73 PolarHBondContact O-N 3.28Å; H70-I74 VanDerWaalsContact NE2-CD1 3.29Å; H70-I74 WeakPolarHBondContact NE2-CD1 3.19Å; H70-I74 WeakPolarHBondContact O-CG1 3.45Å; H70-I74 PolarHBondContact O-N 3Å |
| 71 | W | 97.8 | Very high | 95.8 | Very high | 162 Ų | 162 | 112.7 Ų | 112.7 | 61% | 0.614 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -62.1 | -44.5 | 175.9 | -83.3 | 115.5 | 0 | 0 | 0 | 112.5 | K67 Q68 R73 I74 V75 | K67-W71 VanDerWaalsContact O-CD1 3.23Å; K67-W71 PolarHBondContact O-N 3.4Å; Q68-W71 PolarHBondContact O-N 3.2Å; Q68-W71 VanDerWaalsContact O-N 3.11Å; W71-R73 VanDerWaalsContact C-N 3.3Å; W71-R73 PolarHBondContact O-N 2.97Å; W71-I74 HydrophobicContact CE3-CD1 4.26Å; W71-I74 HydrophobicContact CZ3-CD1 4.48Å; W71-I74 PolarHBondContact O-N 3.5Å; W71-I74 VanDerWaalsContact O-N 3.13Å; W71-V75 WeakPolarHBondContact O-CG2 3.48Å; W71-V75 PolarHBondContact O-N 2.89Å |
| 72 | E | 97.6 | Very high | 96.2 | Very high | 100 Ų | 100 | 118.2 Ų | 118.2 | 47% | 0.467 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -58 | -43.1 | 175.4 | -72.7 | 170.1 | 178.2 | 0 | 0 | 111.6 | Q68 V75 S76 | Q68-E72 HydrophobicContact CG-CG 4.43Å; Q68-E72 VanDerWaalsContact CG-OE1 3.29Å; Q68-E72 WeakPolarHBondContact CG-OE1 3.5Å; Q68-E72 PolarHBondContact NE2-OE1 2.94Å; Q68-E72 WeakPolarHBondContact O-CG 3.34Å; Q68-E72 PolarHBondContact O-N 3.13Å; E72-V75 PolarHBondContact O-N 3.48Å; E72-S76 WeakPolarHBondContact O-CB 3.4Å; E72-S76 PolarHBondContact O-N 2.96Å; E72-S76 PolarHBondContact O-OG 3.33Å |
| 73 | R | 98.1 | Very high | 96.4 | Very high | 162 Ų | 162 | 117.1 Ų | 117.1 | 61% | 0.611 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -61.7 | -41.4 | 174 | -83.9 | -176.6 | -80 | 165.1 | -9 | 112.9 | R69 H70 W71 S76 S77 | R69-R73 WeakPolarHBondContact O-CB 3.35Å; R69-R73 WeakPolarHBondContact O-CG 3.29Å; R69-R73 PolarHBondContact O-N 3.13Å; R69-R73 VanDerWaalsContact O-N 3.13Å; R69-R73 PolarHBondContact O-NE 3.36Å; R69-R73 VanDerWaalsContact O-NE 3.17Å; H70-R73 WeakPolarHBondContact O-CB 3.39Å; H70-R73 PolarHBondContact O-N 3.28Å; W71-R73 VanDerWaalsContact C-N 3.3Å; W71-R73 PolarHBondContact O-N 2.97Å; R73-S76 WeakPolarHBondContact CA-OG 3.39Å; R73-S76 PolarHBondContact O-OG 2.94Å; R73-S76 VanDerWaalsContact O-OG 3.06Å; R73-S77 WeakPolarHBondContact O-CB 3.38Å; R73-S77 PolarHBondContact O-N 3.06Å |
| 74 | I | 97.9 | Very high | 96.6 | Very high | 50 Ų | 50 | 119.5 Ų | 119.5 | 26% | 0.256 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -63.4 | -46.1 | 176.6 | -70 | 166.7 | 0 | 0 | 0 | 110.4 | H70 W71 S77 K78 | H70-I74 VanDerWaalsContact NE2-CD1 3.29Å; H70-I74 WeakPolarHBondContact NE2-CD1 3.19Å; H70-I74 WeakPolarHBondContact O-CG1 3.45Å; H70-I74 PolarHBondContact O-N 3Å; W71-I74 HydrophobicContact CE3-CD1 4.26Å; W71-I74 HydrophobicContact CZ3-CD1 4.48Å; W71-I74 PolarHBondContact O-N 3.5Å; W71-I74 VanDerWaalsContact O-N 3.13Å; I74-S77 PolarHBondContact O-N 3.17Å; I74-K78 HydrophobicContact CG2-CD 4.13Å; I74-K78 WeakPolarHBondContact O-CB 3.49Å; I74-K78 WeakPolarHBondContact O-CG 3.43Å; I74-K78 PolarHBondContact O-N 3.16Å |
| 75 | V | 98.1 | Very high | 96.6 | Very high | 69 Ų | 69 | 117 Ų | 117 | 42% | 0.418 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.3 | -46.2 | -178.9 | 172.7 | 0 | 0 | 0 | 0 | 110.8 | W71 E72 K78 K79 | W71-V75 WeakPolarHBondContact O-CG2 3.48Å; W71-V75 PolarHBondContact O-N 2.89Å; E72-V75 PolarHBondContact O-N 3.48Å; V75-K78 PolarHBondContact O-N 2.89Å; V75-K79 HydrophobicContact CG1-CD 4.28Å; V75-K79 WeakPolarHBondContact O-CG 3.42Å; V75-K79 PolarHBondContact O-N 3.06Å |
| 76 | S | 96.4 | Very high | 96.7 | Very high | 69 Ų | 69 | 122.3 Ų | 122.3 | 48% | 0.483 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -64.6 | -42 | 179 | 66.4 | 0 | 0 | 0 | 0 | 111.8 | E72 R73 K79 S80 | E72-S76 WeakPolarHBondContact O-CB 3.4Å; E72-S76 PolarHBondContact O-N 2.96Å; E72-S76 PolarHBondContact O-OG 3.33Å; R73-S76 WeakPolarHBondContact CA-OG 3.39Å; R73-S76 PolarHBondContact O-OG 2.94Å; R73-S76 VanDerWaalsContact O-OG 3.06Å; S76-K79 PolarHBondContact O-N 3.38Å; S76-S80 WeakPolarHBondContact O-CB 3.37Å; S76-S80 PolarHBondContact O-N 3.27Å |
| 77 | S | 96.8 | Very high | 96.7 | Very high | 77 Ų | 77 | 117.7 Ų | 117.7 | 54% | 0.538 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -59.8 | -47.3 | 173.9 | 178.9 | 0 | 0 | 0 | 0 | 112 | R73 I74 K79 S80 K81 | R73-S77 WeakPolarHBondContact O-CB 3.38Å; R73-S77 PolarHBondContact O-N 3.06Å; I74-S77 PolarHBondContact O-N 3.17Å; S77-K79 PolarHBondContact O-N 2.92Å; S77-S80 PolarHBondContact O-N 3.3Å; S77-K81 PolarHBondContact O-N 3.49Å |
| 78 | K | 97.9 | Very high | 96.5 | Very high | 128 Ų | 128 | 116.7 Ų | 116.7 | 56% | 0.557 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -61 | -42.8 | 175.8 | -76.7 | -179.7 | 176.4 | -179.7 | 0 | 112.3 | I74 V75 K81 R82 | I74-K78 HydrophobicContact CG2-CD 4.13Å; I74-K78 WeakPolarHBondContact O-CB 3.49Å; I74-K78 WeakPolarHBondContact O-CG 3.43Å; I74-K78 PolarHBondContact O-N 3.16Å; V75-K78 PolarHBondContact O-N 2.89Å; K78-K81 PolarHBondContact O-N 2.91Å; K78-R82 WeakPolarHBondContact O-CG 3.38Å; K78-R82 PolarHBondContact O-N 3.44Å |
| 79 | K | 97.9 | Very high | 96.1 | Very high | 145 Ų | 145 | 118.9 Ų | 118.9 | 63% | 0.63 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -63.7 | -44.7 | 176.2 | -76.8 | -177.4 | 177.8 | -178.9 | 0 | 111.5 | V75 S76 S77 R82 K83 | V75-K79 HydrophobicContact CG1-CD 4.28Å; V75-K79 WeakPolarHBondContact O-CG 3.42Å; V75-K79 PolarHBondContact O-N 3.06Å; S76-K79 PolarHBondContact O-N 3.38Å; S77-K79 PolarHBondContact O-N 2.92Å; K79-R82 PolarHBondContact O-N 3.1Å; K79-K83 PolarHBondContact O-N 2.84Å |
| 80 | S | 96.6 | Very high | 95.6 | Very high | 78 Ų | 78 | 116.3 Ų | 116.3 | 55% | 0.545 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -59.4 | -46.9 | 176.6 | -175 | 0 | 0 | 0 | 0 | 111.4 | S76 S77 R82 K83 Q84 | S76-S80 WeakPolarHBondContact O-CB 3.37Å; S76-S80 PolarHBondContact O-N 3.27Å; S77-S80 PolarHBondContact O-N 3.3Å; S80-R82 PolarHBondContact O-N 2.94Å; S80-K83 WeakPolarHBondContact O-CB 3.25Å; S80-K83 PolarHBondContact O-N 2.94Å; S80-K83 VanDerWaalsContact O-N 3.1Å; S80-Q84 PolarHBondContact O-N 3.38Å |
| 81 | K | 97.4 | Very high | 95 | Very high | 154 Ų | 154 | 113.8 Ų | 113.8 | 67% | 0.67 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -59 | -43.1 | 176 | -171.2 | 175 | -177.4 | 174.1 | 0 | 112.5 | S77 K78 Q84 E85 | S77-K81 PolarHBondContact O-N 3.49Å; K78-K81 PolarHBondContact O-N 2.91Å; K81-Q84 PolarHBondContact O-N 3.29Å; K81-E85 WeakPolarHBondContact O-CB 3.29Å; K81-E85 PolarHBondContact O-N 3.49Å |
| 82 | R | 96.1 | Very high | 94.2 | Very high | 192 Ų | 192 | 112.5 Ų | 112.5 | 73% | 0.725 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -62.5 | -41.1 | 174.9 | -72.1 | 175.8 | -176.8 | -176.2 | 0.7 | 112 | K78 K79 S80 R86 | K78-R82 WeakPolarHBondContact O-CG 3.38Å; K78-R82 PolarHBondContact O-N 3.44Å; K79-R82 PolarHBondContact O-N 3.1Å; S80-R82 PolarHBondContact O-N 2.94Å; R82-R86 WeakPolarHBondContact O-CB 3.49Å; R82-R86 PolarHBondContact O-N 2.94Å |
| 83 | K | 96.8 | Very high | 93.1 | Very high | 147 Ų | 147 | 116.4 Ų | 116.4 | 64% | 0.639 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -64.2 | -48.5 | 177 | -172.5 | -179.7 | 178.9 | -176.5 | 0 | 110.8 | K79 S80 E85 R86 E87 | K79-K83 PolarHBondContact O-N 2.84Å; S80-K83 WeakPolarHBondContact O-CB 3.25Å; S80-K83 PolarHBondContact O-N 2.94Å; S80-K83 VanDerWaalsContact O-N 3.1Å; K83-E85 PolarHBondContact O-N 3Å; K83-R86 WeakPolarHBondContact O-CB 3.48Å; K83-R86 PolarHBondContact O-N 3.12Å; K83-R86 VanDerWaalsContact O-N 3.14Å; K83-E87 WeakPolarHBondContact O-CG 3.44Å; K83-E87 PolarHBondContact O-N 3.2Å |
| 84 | Q | 95.6 | Very high | 91.9 | Very high | 142 Ų | 142 | 112.7 Ų | 112.7 | 66% | 0.664 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -58.4 | -45.7 | 177.4 | -171.7 | -174 | 27.8 | 0 | 0 | 111.9 | S80 K81 R86 E87 R88 | S80-Q84 PolarHBondContact O-N 3.38Å; K81-Q84 PolarHBondContact O-N 3.29Å; Q84-R86 VanDerWaalsContact C-N 3.31Å; Q84-R86 PolarHBondContact O-N 3.28Å; Q84-E87 PolarHBondContact O-N 2.83Å; Q84-R88 WeakPolarHBondContact O-CB 3.42Å; Q84-R88 PolarHBondContact O-N 2.77Å |
| 85 | E | 95.4 | Very high | 90.6 | Very high | 61 Ų | 61 | 117.8 Ų | 117.8 | 29% | 0.285 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -64.1 | -36.3 | 176.9 | 175.7 | 57.5 | -162.7 | 0 | 0 | 112.2 | K81 K83 R88 R89 | K81-E85 WeakPolarHBondContact O-CB 3.29Å; K81-E85 PolarHBondContact O-N 3.49Å; K83-E85 PolarHBondContact O-N 3Å; E85-R88 PolarHBondContact O-N 3.43Å; E85-R88 IonicContact OE1-CZ 2.74Å; E85-R88 IonicContact OE1-NE 3.49Å; E85-R88 IonicContact OE1-NH2 3.64Å; E85-R88 PolarHBondContact OE1-NH2 2.95Å; E85-R88 IonicContact OE2-CZ 2.77Å; E85-R88 IonicContact OE2-NE 3.59Å; E85-R88 PolarHBondContact OE2-NE 3.45Å; E85-R88 IonicContact OE2-NH2 2.77Å; E85-R88 PolarHBondContact OE2-NH2 2.85Å; E85-R89 VanDerWaalsContact O-CG 3.29Å; E85-R89 WeakPolarHBondContact O-CG 3.42Å; E85-R89 PolarHBondContact O-N 2.97Å; E85-R89 IonicContact OE1-CZ 3.48Å; E85-R89 IonicContact OE1-NE 2.83Å; E85-R89 PolarHBondContact OE1-NE 3.31Å; E85-R89 IonicContact OE1-NH2 3.28Å; E85-R89 PolarHBondContact OE1-NH2 3.39Å |
| 86 | R | 93.4 | Very high | 89 | Confident | 167 Ų | 167 | 118.5 Ų | 118.5 | 63% | 0.63 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -63.6 | -45.6 | 173.9 | -174 | -179.8 | -174.9 | -179.8 | 0.2 | 111.4 | R82 K83 Q84 R89 K90 | R82-R86 WeakPolarHBondContact O-CB 3.49Å; R82-R86 PolarHBondContact O-N 2.94Å; K83-R86 WeakPolarHBondContact O-CB 3.48Å; K83-R86 PolarHBondContact O-N 3.12Å; K83-R86 VanDerWaalsContact O-N 3.14Å; Q84-R86 VanDerWaalsContact C-N 3.31Å; Q84-R86 PolarHBondContact O-N 3.28Å; R86-R89 PolarHBondContact O-N 2.77Å; R86-K90 WeakPolarHBondContact O-CG 3.45Å; R86-K90 PolarHBondContact O-N 3.3Å |
| 87 | E | 93 | Very high | 87.1 | Confident | 85 Ų | 85 | 120.8 Ų | 120.8 | 40% | 0.397 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -65.9 | -41.3 | 177.4 | -64 | -49.6 | 129.7 | 0 | 0 | 111.4 | K83 Q84 R89 K90 A91 | K83-E87 WeakPolarHBondContact O-CG 3.44Å; K83-E87 PolarHBondContact O-N 3.2Å; Q84-E87 PolarHBondContact O-N 2.83Å; E87-R89 VanDerWaalsContact C-N 3.29Å; E87-R89 PolarHBondContact O-N 2.74Å; E87-K90 WeakPolarHBondContact O-CB 3.47Å; E87-K90 PolarHBondContact O-N 3.31Å; E87-K90 VanDerWaalsContact O-N 3.1Å; E87-K90 IonicContact OE1-NZ 3.49Å; E87-K90 PolarHBondContact OE1-NZ 3.14Å; E87-K90 WeakPolarHBondContact OE2-CD 3.34Å; E87-K90 IonicContact OE2-NZ 3.38Å; E87-K90 PolarHBondContact OE2-NZ 2.94Å; E87-A91 PolarHBondContact O-N 2.8Å |
| 88 | R | 92.7 | Very high | 85.2 | Confident | 109 Ų | 109 | 120.8 Ų | 120.8 | 41% | 0.411 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -56.6 | -41.9 | 172.6 | -168.7 | -165.7 | 68.7 | 76.8 | 0 | 112.1 | Q84 E85 K92 | Q84-R88 WeakPolarHBondContact O-CB 3.42Å; Q84-R88 PolarHBondContact O-N 2.77Å; E85-R88 PolarHBondContact O-N 3.43Å; E85-R88 IonicContact OE1-CZ 2.74Å; E85-R88 IonicContact OE1-NE 3.49Å; E85-R88 IonicContact OE1-NH2 3.64Å; E85-R88 PolarHBondContact OE1-NH2 2.95Å; E85-R88 IonicContact OE2-CZ 2.77Å; E85-R88 IonicContact OE2-NE 3.59Å; E85-R88 PolarHBondContact OE2-NE 3.45Å; E85-R88 IonicContact OE2-NH2 2.77Å; E85-R88 PolarHBondContact OE2-NH2 2.85Å; R88-K92 VanDerWaalsContact NH1-CD 3.29Å; R88-K92 WeakPolarHBondContact O-CB 3.4Å; R88-K92 WeakPolarHBondContact O-CG 3.43Å; R88-K92 PolarHBondContact O-N 3Å |
| 89 | R | 87.9 | Confident | 83.1 | Confident | 149 Ų | 149 | 119.2 Ų | 119.2 | 56% | 0.562 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -67.4 | -37 | 176.4 | -72.5 | 173.7 | -170.5 | -172.2 | 0.6 | 112.7 | E85 R86 E87 R93 | E85-R89 VanDerWaalsContact O-CG 3.29Å; E85-R89 WeakPolarHBondContact O-CG 3.42Å; E85-R89 PolarHBondContact O-N 2.97Å; E85-R89 IonicContact OE1-CZ 3.48Å; E85-R89 IonicContact OE1-NE 2.83Å; E85-R89 PolarHBondContact OE1-NE 3.31Å; E85-R89 IonicContact OE1-NH2 3.28Å; E85-R89 PolarHBondContact OE1-NH2 3.39Å; R86-R89 PolarHBondContact O-N 2.77Å; E87-R89 VanDerWaalsContact C-N 3.29Å; E87-R89 PolarHBondContact O-N 2.74Å; R89-R93 WeakPolarHBondContact O-CG 3.46Å; R89-R93 PolarHBondContact O-N 3.38Å; R89-R93 VanDerWaalsContact O-N 3.13Å |
| 90 | K | 86.1 | Confident | 81 | Confident | 98 Ų | 98 | 114.6 Ų | 114.6 | 43% | 0.426 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -66 | -46.6 | 174.4 | -72.1 | 173.1 | 178.3 | 173.2 | 0 | 111 | R86 E87 R93 A94 | R86-K90 WeakPolarHBondContact O-CG 3.45Å; R86-K90 PolarHBondContact O-N 3.3Å; E87-K90 WeakPolarHBondContact O-CB 3.47Å; E87-K90 PolarHBondContact O-N 3.31Å; E87-K90 VanDerWaalsContact O-N 3.1Å; E87-K90 IonicContact OE1-NZ 3.49Å; E87-K90 PolarHBondContact OE1-NZ 3.14Å; E87-K90 WeakPolarHBondContact OE2-CD 3.34Å; E87-K90 IonicContact OE2-NZ 3.38Å; E87-K90 PolarHBondContact OE2-NZ 2.94Å; K90-R93 WeakPolarHBondContact O-CB 3.46Å; K90-R93 PolarHBondContact O-N 3.26Å; K90-R93 VanDerWaalsContact O-N 3.12Å; K90-A94 PolarHBondContact O-N 2.99Å |
| 91 | A | 85.9 | Confident | 78.9 | Confident | 45 Ų | 45 | 117.9 Ų | 117.9 | 37% | 0.372 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -58.7 | -48.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | E87 R93 A94 E95 | E87-A91 PolarHBondContact O-N 2.8Å; A91-R93 PolarHBondContact O-N 3.43Å; A91-A94 PolarHBondContact O-N 3.33Å; A91-E95 PolarHBondContact O-N 2.86Å |
| 92 | K | 80.9 | Confident | 76.8 | Confident | 136 Ų | 136 | 113.8 Ų | 113.8 | 59% | 0.591 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -58.4 | -32.1 | 174.5 | -79.3 | -153.3 | 171.4 | -167.2 | 0 | 114.3 | R88 | R88-K92 VanDerWaalsContact NH1-CD 3.29Å; R88-K92 WeakPolarHBondContact O-CB 3.4Å; R88-K92 WeakPolarHBondContact O-CG 3.43Å; R88-K92 PolarHBondContact O-N 3Å |
| 93 | R | 74.9 | Confident | 75.1 | Confident | 182 Ų | 182 | 109.3 Ų | 109.3 | 69% | 0.687 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -74 | -28.7 | 174.9 | -76.2 | 176 | -178.9 | -97.7 | -0.1 | 112.6 | R89 K90 A91 | R89-R93 WeakPolarHBondContact O-CG 3.46Å; R89-R93 PolarHBondContact O-N 3.38Å; R89-R93 VanDerWaalsContact O-N 3.13Å; K90-R93 WeakPolarHBondContact O-CB 3.46Å; K90-R93 PolarHBondContact O-N 3.26Å; K90-R93 VanDerWaalsContact O-N 3.12Å; A91-R93 PolarHBondContact O-N 3.43Å |
| 94 | A | 72.4 | Confident | 73.7 | Confident | 84 Ų | 84 | 109.1 Ų | 109.1 | 69% | 0.694 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -80.6 | -33 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | K90 A91 | K90-A94 PolarHBondContact O-N 2.99Å; A91-A94 PolarHBondContact O-N 3.33Å |
| 95 | E | 71.1 | Confident | 72.7 | Confident | 156 Ų | 156 | 105.1 Ų | 105.1 | 73% | 0.729 | 56% | 0.558 | S | S | * | * | S | Bend | trans | -84.9 | -2.3 | -179.5 | -69.8 | -178 | -177.3 | 0 | 0 | 114.8 | A91 P97 | A91-E95 PolarHBondContact O-N 2.86Å; E95-P97 WeakPolarHBondContact O-CD 3.46Å |
| 96 | D | 64.3 | Low | 72.2 | Confident | 84 Ų | 84 | 105.7 Ų | 105.7 | 45% | 0.449 | 57% | 0.569 | S | S | . | * | trans | -99.1 | 81.8 | 173.1 | -170 | -5 | 0 | 0 | 0 | 110.2 | G98 N99 | D96-G98 PolarHBondContact O-N 2.92Å; D96-G98 PolarHBondContact OD1-N 3.47Å; D96-N99 PolarHBondContact O-N 3.11Å | ||
| 97 | P | 56.7 | Low | 71.8 | Confident | 118 Ų | 118 | 105.4 Ų | 105.4 | 77% | 0.766 | 57% | 0.573 | S | S | * | * | G | 310 helix | trans | -67.4 | -13.6 | 177.1 | 28.6 | -35.2 | 0 | 0 | 0 | 112.3 | E95 N99 G100 | E95-P97 WeakPolarHBondContact O-CD 3.46Å; P97-N99 PolarHBondContact O-N 3.04Å; P97-G100 PolarHBondContact O-N 3.32Å |
| 98 | G | 55.3 | Low | 71.6 | Confident | 76 Ų | 76 | 111.6 Ų | 111.6 | 78% | 0.784 | 59% | 0.592 | S | S | * | * | G | 310 helix | trans | -73.5 | -15.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | D96 | D96-G98 PolarHBondContact O-N 2.92Å; D96-G98 PolarHBondContact OD1-N 3.47Å |
| 99 | N | 54.6 | Low | 71.5 | Confident | 95 Ų | 95 | 110.7 Ų | 110.7 | 51% | 0.508 | 59% | 0.592 | S | S | . | * | G | 310 helix | trans | -116.9 | 19.9 | 174.9 | -159.6 | 91.3 | 0 | 0 | 0 | 111.5 | D96 P97 | D96-N99 PolarHBondContact O-N 3.11Å; P97-N99 PolarHBondContact O-N 3.04Å |
| 100 | G | 54.3 | Low | 71.7 | Confident | 49 Ų | 49 | 107.6 Ų | 107.6 | 51% | 0.505 | 59% | 0.586 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -96.6 | 20.3 | -159.1 | 0 | 0 | 0 | 0 | 0 | 118.7 | P97 | P97-G100 PolarHBondContact O-N 3.32Š|
| 101 | T | 51.3 | Low | 72 | Confident | 146 Ų | 146 | 108.9 Ų | 108.9 | 90% | 0.896 | 59% | 0.591 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -135.1 | 12.3 | 176.1 | 52.8 | 0 | 0 | 0 | 0 | 115.8 | ||
| 102 | C | 53.8 | Low | 72.4 | Confident | 68 Ų | 68 | 109.4 Ų | 109.4 | 46% | 0.459 | 60% | 0.595 | S | S | . | * | S | Bend | trans | -143.2 | 127.7 | 177.4 | -148.1 | 0 | 0 | 0 | 0 | 110.5 | Q104 H105 | C102-Q104 PolarHBondContact O-N 2.89Å; C102-H105 PolarHBondContact SG-CD2 3.1Å; C102-H105 PolarHBondContact SG-NE2 3.49Å |
| 103 | P | 61.2 | Low | 73 | Confident | 98 Ų | 98 | 105.8 Ų | 105.8 | 64% | 0.636 | 58% | 0.582 | S | S | * | * | trans | -47 | 122.1 | 158.8 | -15.3 | 26.5 | 0 | 0 | 0 | 105 | H105 | P103-H105 WeakPolarHBondContact O-CA 3.34Å; P103-H105 PolarHBondContact O-CD2 2.97Å; P103-H105 VanDerWaalsContact O-CG 3.25Å; P103-H105 PolarHBondContact O-N 3.08Å | ||
| 104 | Q | 67.4 | Low | 74 | Confident | 143 Ų | 143 | 101.5 Ų | 101.5 | 67% | 0.668 | 58% | 0.576 | S | S | * | * | trans | -60.1 | 88.4 | -175.4 | -167.1 | -179.7 | 11.1 | 0 | 0 | 107.4 | C102 S106 | C102-Q104 PolarHBondContact O-N 2.89Å; Q104-S106 PolarHBondContact O-N 3.34Å | ||
| 105 | H | 73.9 | Confident | 75.1 | Confident | 58 Ų | 58 | 104.3 Ų | 104.3 | 27% | 0.269 | 57% | 0.573 | S | S | . | * | trans | -64.9 | 136.2 | -167.9 | -75.1 | -56.3 | 0 | 0 | 0 | 105.9 | C102 P103 K107 F109 L110 | C102-H105 PolarHBondContact SG-CD2 3.1Å; C102-H105 PolarHBondContact SG-NE2 3.49Å; P103-H105 WeakPolarHBondContact O-CA 3.34Å; P103-H105 PolarHBondContact O-CD2 2.97Å; P103-H105 VanDerWaalsContact O-CG 3.25Å; P103-H105 PolarHBondContact O-N 3.08Å; H105-K107 PolarHBondContact O-N 2.57Å; H105-F109 HydrophobicContact CB-CB 4.06Å; H105-F109 HydrophobicContact CB-CD1 3.3Å; H105-F109 HydrophobicContact CB-CE1 3.95Å; H105-F109 HydrophobicContact CB-CG 3.9Å; H105-F109 AromaticContact CD2-CD1 3.74Å; H105-F109 AromaticContact CD2-CE1 3.43Å; H105-F109 VanDerWaalsContact CD2-CE1 3.43Å; H105-F109 WeakPolarHBondContact CD2-CE1 3.46Å; H105-F109 AromaticContact CE1-CE1 3.44Å; H105-F109 VanDerWaalsContact CE1-CE1 3.44Å; H105-F109 WeakPolarHBondContact CE1-CE1 3.48Å; H105-F109 AromaticContact CE1-CZ 3.66Å; H105-F109 AromaticContact CG-CD1 3.22Å; H105-F109 AromaticContact CG-CE1 3.32Å; H105-F109 AromaticContact ND1-CD1 3.46Å; H105-F109 WeakPolarHBondContact ND1-CD1 3.33Å; H105-F109 AromaticContact ND1-CE1 3.32Å; H105-F109 VanDerWaalsContact ND1-CE1 3.32Å; H105-F109 WeakPolarHBondContact ND1-CE1 3.46Å; H105-F109 AromaticContact ND1-CG 3.96Å; H105-F109 AromaticContact ND1-CZ 3.75Å; H105-F109 AromaticContact NE2-CE1 3.5Å; H105-L110 HydrophobicContact CB-CD2 3.87Å; H105-L110 HydrophobicContact CB-CG 3.87Å | ||
| 106 | S | 84 | Confident | 76.3 | Confident | 73 Ų | 73 | 102.7 Ų | 102.7 | 51% | 0.51 | 57% | 0.565 | S | S | . | * | trans | -52.4 | 145.3 | 178.4 | 75.2 | 0 | 0 | 0 | 0 | 108.8 | Q104 R108 F109 L110 | Q104-S106 PolarHBondContact O-N 3.34Å; S106-R108 CarbonylContact O-C 3.6Å; S106-R108 PolarHBondContact O-N 3.43Å; S106-F109 WeakPolarHBondContact O-CA 3.35Å; S106-F109 WeakPolarHBondContact O-CB 3.43Å; S106-F109 PolarHBondContact O-N 3.1Å; S106-F109 PolarHBondContact OG-N 3.13Å; S106-F109 VanDerWaalsContact OG-N 3.12Å; S106-L110 PolarHBondContact O-N 2.86Å; S106-L110 VanDerWaalsContact O-N 3.1Å | ||
| 107 | K | 86.4 | Confident | 77.8 | Confident | 162 Ų | 162 | 104.8 Ų | 104.8 | 70% | 0.704 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -50.8 | -29.4 | 176 | -175 | 176 | -178.1 | 174.1 | 0 | 111.9 | H105 K111 | H105-K107 PolarHBondContact O-N 2.57Å; K107-K111 WeakPolarHBondContact O-CB 3.48Å; K107-K111 VanDerWaalsContact O-CG 3.25Å; K107-K111 WeakPolarHBondContact O-CG 3.46Å; K107-K111 PolarHBondContact O-N 2.99Å |
| 108 | R | 88.7 | Confident | 79.6 | Confident | 215 Ų | 215 | 103.9 Ų | 103.9 | 81% | 0.811 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -67.6 | -43.9 | 173.8 | -66.2 | -174.3 | -180 | -165.5 | 0.2 | 112.4 | S106 K111 A112 | S106-R108 CarbonylContact O-C 3.6Å; S106-R108 PolarHBondContact O-N 3.43Å; R108-K111 PolarHBondContact O-N 3.49Å; R108-A112 WeakPolarHBondContact O-CB 3.44Å; R108-A112 PolarHBondContact O-N 3.02Å |
| 109 | F | 91.3 | Very high | 81.4 | Confident | 90 Ų | 90 | 104.8 Ų | 104.8 | 40% | 0.395 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -61.5 | -48.8 | 175.9 | 178.3 | -83.5 | 0 | 0 | 0 | 111.9 | H105 S106 K111 A112 L113 | H105-F109 HydrophobicContact CB-CB 4.06Å; H105-F109 HydrophobicContact CB-CD1 3.3Å; H105-F109 HydrophobicContact CB-CE1 3.95Å; H105-F109 HydrophobicContact CB-CG 3.9Å; H105-F109 AromaticContact CD2-CD1 3.74Å; H105-F109 AromaticContact CD2-CE1 3.43Å; H105-F109 VanDerWaalsContact CD2-CE1 3.43Å; H105-F109 WeakPolarHBondContact CD2-CE1 3.46Å; H105-F109 AromaticContact CE1-CE1 3.44Å; H105-F109 VanDerWaalsContact CE1-CE1 3.44Å; H105-F109 WeakPolarHBondContact CE1-CE1 3.48Å; H105-F109 AromaticContact CE1-CZ 3.66Å; H105-F109 AromaticContact CG-CD1 3.22Å; H105-F109 AromaticContact CG-CE1 3.32Å; H105-F109 AromaticContact ND1-CD1 3.46Å; H105-F109 WeakPolarHBondContact ND1-CD1 3.33Å; H105-F109 AromaticContact ND1-CE1 3.32Å; H105-F109 VanDerWaalsContact ND1-CE1 3.32Å; H105-F109 WeakPolarHBondContact ND1-CE1 3.46Å; H105-F109 AromaticContact ND1-CG 3.96Å; H105-F109 AromaticContact ND1-CZ 3.75Å; H105-F109 AromaticContact NE2-CE1 3.5Å; S106-F109 WeakPolarHBondContact O-CA 3.35Å; S106-F109 WeakPolarHBondContact O-CB 3.43Å; S106-F109 PolarHBondContact O-N 3.1Å; S106-F109 PolarHBondContact OG-N 3.13Å; S106-F109 VanDerWaalsContact OG-N 3.12Å; F109-K111 VanDerWaalsContact C-N 3.27Å; F109-K111 PolarHBondContact O-N 2.72Å; F109-A112 WeakPolarHBondContact O-CB 3.32Å; F109-A112 PolarHBondContact O-N 3.17Å; F109-A112 VanDerWaalsContact O-N 3.08Å; F109-L113 HydrophobicContact CE1-CD2 4.32Å; F109-L113 WeakPolarHBondContact O-CB 3.46Å; F109-L113 PolarHBondContact O-N 3.42Å |
| 110 | L | 90.2 | Very high | 83.3 | Confident | 84 Ų | 84 | 106.4 Ų | 106.4 | 44% | 0.44 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -61.2 | -38.6 | 179.1 | -67.4 | 175.4 | 0 | 0 | 0 | 111.9 | H105 S106 T114 | H105-L110 HydrophobicContact CB-CD2 3.87Å; H105-L110 HydrophobicContact CB-CG 3.87Å; S106-L110 PolarHBondContact O-N 2.86Å; S106-L110 VanDerWaalsContact O-N 3.1Å; L110-T114 WeakPolarHBondContact O-CB 3.43Å; L110-T114 PolarHBondContact O-N 3.07Å; L110-T114 PolarHBondContact O-OG1 3.41Å |
| 111 | K | 93.4 | Very high | 85.1 | Confident | 125 Ų | 125 | 106.8 Ų | 106.8 | 54% | 0.543 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -64.6 | -41.1 | 173.8 | -77.3 | -179.6 | 173.9 | -164.9 | 0 | 112.5 | K107 R108 F109 T114 K115 | K107-K111 WeakPolarHBondContact O-CB 3.48Å; K107-K111 VanDerWaalsContact O-CG 3.25Å; K107-K111 WeakPolarHBondContact O-CG 3.46Å; K107-K111 PolarHBondContact O-N 2.99Å; R108-K111 PolarHBondContact O-N 3.49Å; F109-K111 VanDerWaalsContact C-N 3.27Å; F109-K111 PolarHBondContact O-N 2.72Å; K111-T114 PolarHBondContact O-N 3.22Å; K111-K115 WeakPolarHBondContact O-CG 3.45Å; K111-K115 PolarHBondContact O-N 3.48Å |
| 112 | A | 94.9 | Very high | 86.9 | Confident | 55 Ų | 55 | 106.6 Ų | 106.6 | 46% | 0.455 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -63.7 | -49.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | R108 F109 T114 K115 E116 | R108-A112 WeakPolarHBondContact O-CB 3.44Å; R108-A112 PolarHBondContact O-N 3.02Å; F109-A112 WeakPolarHBondContact O-CB 3.32Å; F109-A112 PolarHBondContact O-N 3.17Å; F109-A112 VanDerWaalsContact O-N 3.08Å; A112-T114 VanDerWaalsContact C-N 3.29Å; A112-T114 PolarHBondContact O-N 3Å; A112-K115 WeakPolarHBondContact O-CB 3.32Å; A112-K115 PolarHBondContact O-N 2.97Å; A112-K115 VanDerWaalsContact O-N 3.11Å; A112-E116 PolarHBondContact O-N 3Å |
| 113 | L | 93.8 | Very high | 88.7 | Confident | 60 Ų | 60 | 111 Ų | 111 | 31% | 0.314 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -58.1 | -41.1 | 177.1 | -174.5 | 69.9 | 0 | 0 | 0 | 112.2 | F109 E116 K117 | F109-L113 HydrophobicContact CE1-CD2 4.32Å; F109-L113 WeakPolarHBondContact O-CB 3.46Å; F109-L113 PolarHBondContact O-N 3.42Å; L113-E116 PolarHBondContact O-N 3.47Å; L113-K117 WeakPolarHBondContact O-CG 3.42Å; L113-K117 PolarHBondContact O-N 3.07Å; L113-K117 VanDerWaalsContact O-N 3.07Å |
| 114 | T | 94.9 | Very high | 90.1 | Very high | 92 Ų | 92 | 110.8 Ų | 110.8 | 56% | 0.564 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -67.1 | -40.2 | 177.7 | -52.8 | 0 | 0 | 0 | 0 | 111.5 | L110 K111 A112 L118 | L110-T114 WeakPolarHBondContact O-CB 3.43Å; L110-T114 PolarHBondContact O-N 3.07Å; L110-T114 PolarHBondContact O-OG1 3.41Å; K111-T114 PolarHBondContact O-N 3.22Å; A112-T114 VanDerWaalsContact C-N 3.29Å; A112-T114 PolarHBondContact O-N 3Å; T114-L118 WeakPolarHBondContact O-CB 3.43Å; T114-L118 PolarHBondContact O-N 3.24Å |
| 115 | K | 96.2 | Very high | 91.2 | Very high | 144 Ų | 144 | 105.3 Ų | 105.3 | 63% | 0.626 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -63.9 | -44 | 176.3 | -77.1 | -179.9 | 176.6 | -169.1 | 0 | 111.6 | K111 A112 L118 L119 | K111-K115 WeakPolarHBondContact O-CG 3.45Å; K111-K115 PolarHBondContact O-N 3.48Å; A112-K115 WeakPolarHBondContact O-CB 3.32Å; A112-K115 PolarHBondContact O-N 2.97Å; A112-K115 VanDerWaalsContact O-N 3.11Å; K115-L118 PolarHBondContact O-N 3.12Å; K115-L119 WeakPolarHBondContact O-CG 3.43Å; K115-L119 PolarHBondContact O-N 3.29Å |
| 116 | E | 95.6 | Very high | 92 | Very high | 121 Ų | 121 | 109.1 Ų | 109.1 | 57% | 0.565 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -57 | -54.3 | 176.7 | -175.7 | -174.8 | 176.4 | 0 | 0 | 110.9 | A112 L113 L118 L119 E120 | A112-E116 PolarHBondContact O-N 3Å; L113-E116 PolarHBondContact O-N 3.47Å; E116-L118 VanDerWaalsContact C-N 3.29Å; E116-L118 PolarHBondContact O-N 2.97Å; E116-L119 PolarHBondContact O-N 3.07Å; E116-L119 VanDerWaalsContact O-N 3.12Å; E116-E120 PolarHBondContact O-N 3.23Å |
| 117 | K | 94.9 | Very high | 92.2 | Very high | 128 Ų | 128 | 116 Ų | 116 | 56% | 0.557 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -59.5 | -37.8 | 177.7 | -71.4 | -171.9 | 174 | -169.6 | 0 | 113.4 | L113 E120 A121 | L113-K117 WeakPolarHBondContact O-CG 3.42Å; L113-K117 PolarHBondContact O-N 3.07Å; L113-K117 VanDerWaalsContact O-N 3.07Å; K117-E120 PolarHBondContact O-N 3.16Å; K117-A121 WeakPolarHBondContact O-CB 3.35Å; K117-A121 PolarHBondContact O-N 2.97Å |
| 118 | L | 94.8 | Very high | 92.5 | Very high | 100 Ų | 100 | 116 Ų | 116 | 52% | 0.524 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -66.2 | -41 | 177.3 | -178.7 | 66.4 | 0 | 0 | 0 | 111.7 | T114 K115 E116 A121 K122 | T114-L118 WeakPolarHBondContact O-CB 3.43Å; T114-L118 PolarHBondContact O-N 3.24Å; K115-L118 PolarHBondContact O-N 3.12Å; E116-L118 VanDerWaalsContact C-N 3.29Å; E116-L118 PolarHBondContact O-N 2.97Å; L118-A121 PolarHBondContact O-N 3.38Å; L118-K122 VanDerWaalsContact O-CG 3.32Å; L118-K122 WeakPolarHBondContact O-CG 3.28Å; L118-K122 PolarHBondContact O-N 3.17Å |
| 119 | L | 94.3 | Very high | 92.7 | Very high | 95 Ų | 95 | 110.6 Ų | 110.6 | 50% | 0.497 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -64.2 | -45.1 | 176.1 | -71.4 | 169.9 | 0 | 0 | 0 | 110.6 | K115 E116 A121 K122 H123 | K115-L119 WeakPolarHBondContact O-CG 3.43Å; K115-L119 PolarHBondContact O-N 3.29Å; E116-L119 PolarHBondContact O-N 3.07Å; E116-L119 VanDerWaalsContact O-N 3.12Å; L119-A121 VanDerWaalsContact C-N 3.34Å; L119-A121 PolarHBondContact O-N 3.21Å; L119-K122 WeakPolarHBondContact O-CB 3.46Å; L119-K122 PolarHBondContact O-N 2.62Å; L119-K122 VanDerWaalsContact O-N 3.17Å; L119-H123 PolarHBondContact O-CD2 2.93Å; L119-H123 PolarHBondContact O-N 3.12Å |
| 120 | E | 93.8 | Very high | 92.9 | Very high | 129 Ų | 129 | 111.4 Ų | 111.4 | 60% | 0.603 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -57.3 | -45.8 | 175.9 | -173.3 | -178.5 | -176.2 | 0 | 0 | 112.2 | E116 K117 K122 H123 S124 | E116-E120 PolarHBondContact O-N 3.23Å; K117-E120 PolarHBondContact O-N 3.16Å; E120-K122 VanDerWaalsContact C-N 3.33Å; E120-K122 PolarHBondContact O-N 3.07Å; E120-H123 PolarHBondContact O-N 3.34Å; E120-S124 WeakPolarHBondContact O-CB 3.48Å; E120-S124 PolarHBondContact O-N 2.77Å; E120-S124 PolarHBondContact O-OG 2.98Å |
| 121 | A | 91.8 | Very high | 93.1 | Very high | 57 Ų | 57 | 113.4 Ų | 113.4 | 47% | 0.471 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -64.5 | -35 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | K117 L118 L119 H123 G125 | K117-A121 WeakPolarHBondContact O-CB 3.35Å; K117-A121 PolarHBondContact O-N 2.97Å; L118-A121 PolarHBondContact O-N 3.38Å; L119-A121 VanDerWaalsContact C-N 3.34Å; L119-A121 PolarHBondContact O-N 3.21Å; A121-H123 VanDerWaalsContact C-N 3.28Å; A121-H123 PolarHBondContact O-N 3.32Å; A121-G125 PolarHBondContact O-N 3.03Å |
| 122 | K | 89.7 | Confident | 93.1 | Very high | 142 Ų | 142 | 113.1 Ų | 113.1 | 62% | 0.617 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -65.1 | -32.4 | 176.1 | -77.3 | 177.1 | 176.3 | -170.8 | 0 | 112.9 | L118 L119 E120 | L118-K122 VanDerWaalsContact O-CG 3.32Å; L118-K122 WeakPolarHBondContact O-CG 3.28Å; L118-K122 PolarHBondContact O-N 3.17Å; L119-K122 WeakPolarHBondContact O-CB 3.46Å; L119-K122 PolarHBondContact O-N 2.62Å; L119-K122 VanDerWaalsContact O-N 3.17Å; E120-K122 VanDerWaalsContact C-N 3.33Å; E120-K122 PolarHBondContact O-N 3.07Å |
| 123 | H | 90.4 | Very high | 93.1 | Very high | 159 Ų | 159 | 114.1 Ų | 114.1 | 74% | 0.736 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -88.8 | -32.6 | -178.2 | -66 | -57.8 | 0 | 0 | 0 | 113 | L119 E120 A121 | L119-H123 PolarHBondContact O-CD2 2.93Å; L119-H123 PolarHBondContact O-N 3.12Å; E120-H123 PolarHBondContact O-N 3.34Å; A121-H123 VanDerWaalsContact C-N 3.28Å; A121-H123 PolarHBondContact O-N 3.32Å |
| 124 | S | 92.3 | Very high | 93.1 | Very high | 94 Ų | 94 | 116.6 Ų | 116.6 | 66% | 0.657 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -89.6 | -18.4 | -179 | 57.2 | 0 | 0 | 0 | 0 | 114.1 | E120 | E120-S124 WeakPolarHBondContact O-CB 3.48Å; E120-S124 PolarHBondContact O-N 2.77Å; E120-S124 PolarHBondContact O-OG 2.98Å |
| 125 | G | 89.5 | Confident | 93.1 | Very high | 29 Ų | 29 | 116.3 Ų | 116.3 | 30% | 0.299 | 62% | 0.617 | S | S | . | * | S | Bend | trans | -69.5 | 150.5 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | A121 R127 | A121-G125 PolarHBondContact O-N 3.03Å; G125-R127 PolarHBondContact O-N 3.19Å |
| 126 | P | 91 | Very high | 92.9 | Very high | 138 Ų | 138 | 118 Ų | 118 | 90% | 0.896 | 63% | 0.627 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 136.6 | 173.6 | 25.6 | -32.9 | 0 | 0 | 0 | 110.5 | ||
| 127 | R | 88.9 | Confident | 92.8 | Very high | 218 Ų | 218 | 119.1 Ų | 119.1 | 82% | 0.823 | 63% | 0.632 | S | S | * | * | P | Polyproline II helix | trans | -97.1 | 127.5 | -179.7 | -62 | 178.5 | 68 | -166.2 | 0.1 | 109.7 | G125 | G125-R127 PolarHBondContact O-N 3.19Š|
| 128 | L | 91.4 | Very high | 92.7 | Very high | 160 Ų | 160 | 119.9 Ų | 119.9 | 84% | 0.838 | 64% | 0.639 | S | S | * | * | trans | -84.5 | 115.6 | 166.9 | 179 | 63.7 | 0 | 0 | 0 | 108.6 | V130 | L128-V130 HydrophobicContact CG-CG2 4.31Š| ||
| 129 | C | 93.1 | Very high | 92.6 | Very high | 103 Ų | 103 | 120.2 Ų | 120.2 | 70% | 0.696 | 65% | 0.65 | S | S | * | * | trans | -106.7 | 120.9 | 173.2 | -62.8 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 130 | V | 95.4 | Very high | 92.4 | Very high | 107 Ų | 107 | 126.1 Ų | 126.1 | 65% | 0.648 | 67% | 0.671 | S | S | * | * | trans | -105 | 116.5 | 172.3 | -177.5 | 0 | 0 | 0 | 0 | 107.2 | L128 L132 | L128-V130 HydrophobicContact CG-CG2 4.31Å; V130-L132 HydrophobicContact CG1-CD2 3.89Å | ||
| 131 | D | 94.3 | Very high | 91.8 | Very high | 125 Ų | 125 | 132.7 Ų | 132.7 | 67% | 0.668 | 70% | 0.698 | S | S | * | * | trans | -79.3 | 126.3 | 174.5 | -175.8 | 16 | 0 | 0 | 0 | 110 | S133 | D131-S133 WeakPolarHBondContact OD1-CB 3.21Å; D131-S133 PolarHBondContact OD1-N 3.11Å; D131-S133 PolarHBondContact OD1-OG 2.86Å; D131-S133 VanDerWaalsContact OD1-OG 3.11Å; D131-S133 PolarHBondContact OD2-OG 3.44Å | ||
| 132 | L | 94.3 | Very high | 91.8 | Very high | 120 Ų | 120 | 136.5 Ų | 136.5 | 63% | 0.628 | 71% | 0.709 | S | S | * | * | trans | -109.6 | 6.8 | 179.5 | -58.6 | -179.6 | 0 | 0 | 0 | 112 | V130 M134 T135 | V130-L132 HydrophobicContact CG1-CD2 3.89Å; L132-M134 PolarHBondContact O-N 2.68Å; L132-T135 VanDerWaalsContact O-CB 3.28Å; L132-T135 WeakPolarHBondContact O-CB 2.86Å; L132-T135 PolarHBondContact O-N 3.2Å; L132-T135 VanDerWaalsContact O-N 3.07Å; L132-T135 PolarHBondContact O-OG1 2.99Å | ||
| 133 | S | 95 | Very high | 91.9 | Very high | 75 Ų | 75 | 136.2 Ų | 136.2 | 52% | 0.524 | 71% | 0.714 | S | S | . | * | G | 310 helix | trans | -54.2 | -36.2 | 179 | 65.9 | 0 | 0 | 0 | 0 | 112.7 | D131 T135 | D131-S133 WeakPolarHBondContact OD1-CB 3.21Å; D131-S133 PolarHBondContact OD1-N 3.11Å; D131-S133 PolarHBondContact OD1-OG 2.86Å; D131-S133 VanDerWaalsContact OD1-OG 3.11Å; D131-S133 PolarHBondContact OD2-OG 3.44Å; S133-T135 VanDerWaalsContact C-N 3.28Å; S133-T135 PolarHBondContact O-N 3.2Å |
| 134 | M | 93.6 | Very high | 92 | Very high | 113 Ų | 113 | 134.9 Ų | 134.9 | 56% | 0.557 | 71% | 0.713 | S | S | * | * | G | 310 helix | trans | -83.2 | 5 | -178.3 | -64.6 | -59 | -65.3 | 0 | 0 | 114.7 | L132 Q136 H137 | L132-M134 PolarHBondContact O-N 2.68Å; M134-Q136 PolarHBondContact O-N 3.43Å; M134-H137 HydrophobicContact CE-CB 4.18Å; M134-H137 PolarHBondContact O-N 3.37Å |
| 135 | T | 94.2 | Very high | 92 | Very high | 85 Ų | 85 | 137.3 Ų | 137.3 | 52% | 0.521 | 72% | 0.716 | S | S | . | * | G | 310 helix | trans | -60.3 | -31.7 | -174.4 | -56.5 | 0 | 0 | 0 | 0 | 112.6 | L132 S133 H137 M138 | L132-T135 VanDerWaalsContact O-CB 3.28Å; L132-T135 WeakPolarHBondContact O-CB 2.86Å; L132-T135 PolarHBondContact O-N 3.2Å; L132-T135 VanDerWaalsContact O-N 3.07Å; L132-T135 PolarHBondContact O-OG1 2.99Å; S133-T135 VanDerWaalsContact C-N 3.28Å; S133-T135 PolarHBondContact O-N 3.2Å; T135-H137 PolarHBondContact O-N 3.23Å; T135-M138 PolarHBondContact O-N 3.46Å |
| 136 | Q | 93.6 | Very high | 92.1 | Very high | 180 Ų | 180 | 144.1 Ų | 144.1 | 84% | 0.841 | 74% | 0.742 | S | S | * | * | G | 310 helix | trans | -70.6 | -16.7 | 179.3 | -63.7 | -175 | -4.5 | 0 | 0 | 113.9 | M134 | M134-Q136 PolarHBondContact O-N 3.43Š|
| 137 | H | 93.3 | Very high | 92.2 | Very high | 144 Ų | 144 | 144.5 Ų | 144.5 | 67% | 0.667 | 73% | 0.732 | S | S | * | * | G | 310 helix | trans | -101.1 | -0.6 | -179.5 | -57.7 | -61.9 | 0 | 0 | 0 | 113.1 | M134 T135 | M134-H137 HydrophobicContact CE-CB 4.18Å; M134-H137 PolarHBondContact O-N 3.37Å; T135-H137 PolarHBondContact O-N 3.23Å |
| 138 | M | 92.5 | Very high | 92.4 | Very high | 145 Ų | 145 | 139.2 Ų | 139.2 | 71% | 0.714 | 73% | 0.726 | S | S | * | * | S | Bend | trans | -87.8 | 135.3 | -179.8 | -66.5 | -103.5 | -61.9 | 0 | 0 | 110.6 | T135 | T135-M138 PolarHBondContact O-N 3.46Š|
| 139 | S | 92.6 | Very high | 92.5 | Very high | 106 Ų | 106 | 137.6 Ų | 137.6 | 74% | 0.741 | 72% | 0.717 | S | S | * | * | trans | -72.5 | 144.9 | 174.2 | 50.4 | 0 | 0 | 0 | 0 | 111.3 | K141 | S139-K141 PolarHBondContact O-N 3.24Š| ||
| 140 | K | 89.2 | Confident | 92.4 | Very high | 219 Ų | 219 | 140.5 Ų | 140.5 | 95% | 0.952 | 72% | 0.719 | S | S | * | * | trans | -70.4 | 113.5 | 170.5 | -114.7 | 177.5 | 178.6 | 176.5 | 0 | 108.2 | ||||
| 141 | K | 81.5 | Confident | 92.2 | Very high | 267 Ų | 267 | 143.5 Ų | 143.5 | 100% | 1.161 | 73% | 0.725 | S | S | * | * | trans | -104.8 | 0 | 174.4 | -120.6 | -174.3 | 178 | -174.5 | 0 | 110.6 | S139 | S139-K141 PolarHBondContact O-N 3.24Š|
Retrieved 141 of 141 residues in 98.4 ms
(Link to these results)