| 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 | 37.1 | Very low | 40.1 | Very low | 243 Ų | 243 | 154.8 Ų | 154.8 | 100% | 1.197 | 81% | 0.806 | S | S | * | * | 0 | 129.3 | 0 | -89.7 | 153.5 | 60.8 | 0 | 0 | 108.5 | |||||
| 2 | V | 50.8 | Low | 39.5 | Very low | 142 Ų | 142 | 149.4 Ų | 149.4 | 86% | 0.861 | 79% | 0.792 | S | S | * | * | trans | -61.9 | 143.5 | -175.7 | -86.3 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 3 | K | 44.5 | Very low | 38.7 | Very low | 207 Ų | 207 | 146.5 Ų | 146.5 | 90% | 0.9 | 78% | 0.783 | S | S | * | * | trans | -163.3 | 122.1 | 130.3 | -148.2 | 156.6 | -179.6 | 167.4 | 0 | 111.7 | ||||
| 4 | L | 53.4 | Low | 38.2 | Very low | 171 Ų | 171 | 150 Ų | 150 | 90% | 0.895 | 79% | 0.788 | S | S | * | * | trans | -70.4 | 139.8 | 165.1 | -75.1 | 106.7 | 0 | 0 | 0 | 110.1 | ||||
| 5 | G | 36.6 | Very low | 38.2 | Very low | 70 Ų | 70 | 152.4 Ų | 152.4 | 72% | 0.722 | 79% | 0.793 | S | S | * | * | trans | -143 | 103.8 | 160.4 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 6 | N | 42.3 | Very low | 38.5 | Very low | 147 Ų | 147 | 150.3 Ų | 150.3 | 79% | 0.786 | 79% | 0.792 | S | S | * | * | 60.4 | 102.7 | 91.4 | -99.8 | 32.5 | 0 | 0 | 0 | 115.3 | |||||
| 7 | N | 40.8 | Very low | 38.6 | Very low | 127 Ų | 127 | 151.1 Ų | 151.1 | 68% | 0.679 | 80% | 0.796 | S | S | * | * | 71 | 150.5 | 127.1 | -65.6 | -49.1 | 0 | 0 | 0 | 122.1 | |||||
| 8 | F | 35 | Very low | 38.4 | Very low | 193 Ų | 193 | 151 Ų | 151 | 85% | 0.846 | 80% | 0.795 | S | S | * | * | trans | 76.2 | 139.3 | 154.1 | -110.2 | -118.8 | 0 | 0 | 0 | 114.6 | ||||
| 9 | S | 33.1 | Very low | 38.3 | Very low | 67 Ų | 67 | 151.4 Ų | 151.4 | 47% | 0.469 | 79% | 0.792 | S | S | . | * | cis | 173.5 | 148.5 | -12.8 | 50.1 | 0 | 0 | 0 | 0 | 102.5 | ||||
| 10 | E | 33 | Very low | 38.2 | Very low | 163 Ų | 163 | 150.7 Ų | 150.7 | 76% | 0.762 | 79% | 0.789 | S | S | * | * | trans | 61.1 | 115.2 | 144.3 | -75.9 | -174.5 | 122 | 0 | 0 | 120.3 | ||||
| 11 | K | 34.9 | Very low | 38.4 | Very low | 173 Ų | 173 | 146.2 Ų | 146.2 | 75% | 0.752 | 78% | 0.78 | S | S | * | * | 88 | 92.6 | 114.6 | -163 | 171.6 | -168.5 | -172.8 | 0 | 116.7 | |||||
| 12 | S | 32.2 | Very low | 38.2 | Very low | 90 Ų | 90 | 144.3 Ų | 144.3 | 63% | 0.629 | 77% | 0.765 | S | S | * | * | 71.6 | 135.1 | 119.3 | 87.1 | 0 | 0 | 0 | 0 | 119.6 | |||||
| 13 | T | 29.6 | Very low | 38.4 | Very low | 112 Ų | 112 | 144.8 Ų | 144.8 | 69% | 0.687 | 76% | 0.763 | S | S | * | * | trans | 100.5 | 100.5 | 136.3 | -47.6 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 14 | K | 32.1 | Very low | 38.5 | Very low | 195 Ų | 195 | 141.4 Ų | 141.4 | 85% | 0.848 | 76% | 0.76 | S | S | * | * | trans | 54.9 | 118.5 | 131.7 | -58.1 | 178.4 | -178.3 | -179.9 | 0 | 120.1 | ||||
| 15 | Q | 37.8 | Very low | 38.3 | Very low | 186 Ų | 186 | 140.8 Ų | 140.8 | 87% | 0.869 | 76% | 0.755 | S | S | * | * | trans | -20.1 | 154.5 | 142.1 | -78.3 | 178.3 | -17.1 | 0 | 0 | 116.3 | ||||
| 16 | P | 43.2 | Very low | 38.9 | Very low | 118 Ų | 118 | 142.6 Ų | 142.6 | 77% | 0.766 | 76% | 0.755 | S | S | * | * | -151.4 | 151.2 | 67.8 | 38.3 | -15.6 | 0 | 0 | 0 | 117 | |||||
| 17 | L | 39.6 | Very low | 39.4 | Very low | 165 Ų | 165 | 142.3 Ų | 142.3 | 86% | 0.864 | 75% | 0.752 | S | S | * | * | 71.5 | 121.8 | 105 | -166.7 | 78.7 | 0 | 0 | 0 | 117.1 | |||||
| 18 | L | 34.6 | Very low | 40.4 | Very low | 149 Ų | 149 | 143.6 Ų | 143.6 | 78% | 0.78 | 76% | 0.758 | S | S | * | * | trans | 165.3 | 133.2 | 153.6 | -101.2 | 161.9 | 0 | 0 | 0 | 106.9 | ||||
| 19 | E | 36.8 | Very low | 41.1 | Very low | 159 Ų | 159 | 140.9 Ų | 140.9 | 74% | 0.743 | 76% | 0.757 | S | S | * | * | cis | -151.5 | 160.5 | 18.8 | -74.6 | -95.8 | 71.9 | 0 | 0 | 104.8 | ||||
| 20 | D | 36.9 | Very low | 41.8 | Very low | 136 Ų | 136 | 143.2 Ų | 143.2 | 73% | 0.727 | 77% | 0.771 | S | S | * | * | cis | -176.9 | 125.2 | 46.4 | -167 | 9.1 | 0 | 0 | 0 | 103.6 | ||||
| 21 | G | 41.8 | Very low | 43 | Very low | 57 Ų | 57 | 143.4 Ų | 143.4 | 59% | 0.588 | 78% | 0.776 | S | S | * | * | 87.4 | 100.3 | 92.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 22 | F | 34.3 | Very low | 43.8 | Very low | 204 Ų | 204 | 140.4 Ų | 140.4 | 90% | 0.895 | 77% | 0.768 | S | S | * | * | 160.5 | 119 | 128 | -93.1 | -80.5 | 0 | 0 | 0 | 111.4 | |||||
| 23 | D | 54 | Low | 44.9 | Very low | 152 Ų | 152 | 140.9 Ų | 140.9 | 81% | 0.813 | 77% | 0.767 | S | S | * | * | trans | -50.7 | 137.7 | 173.5 | -75.7 | -59.5 | 0 | 0 | 0 | 114.4 | ||||
| 24 | T | 45.8 | Very low | 46.1 | Very low | 136 Ų | 136 | 141 Ų | 141 | 83% | 0.834 | 76% | 0.764 | S | S | * | * | trans | -178.1 | 111.2 | 136 | 17 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 25 | I | 50.6 | Low | 47 | Very low | 157 Ų | 157 | 139.1 Ų | 139.1 | 81% | 0.805 | 76% | 0.758 | S | S | * | * | trans | -85.6 | 131.9 | 162.8 | -60.3 | 160 | 0 | 0 | 0 | 106.4 | L27 | I25-L27 HydrophobicContact CG2-CD1 4.46Š| ||
| 26 | P | 47.7 | Very low | 47.8 | Very low | 109 Ų | 109 | 137.4 Ų | 137.4 | 71% | 0.708 | 75% | 0.754 | S | S | * | * | -146 | 141.2 | 104.5 | 33.9 | -15 | 0 | 0 | 0 | 115.9 | |||||
| 27 | L | 54.1 | Low | 48.3 | Very low | 140 Ų | 140 | 139 Ų | 139 | 73% | 0.733 | 75% | 0.751 | S | S | * | * | trans | 11.2 | 116.5 | 144 | -69.3 | 88.1 | 0 | 0 | 0 | 118.9 | I25 | I25-L27 HydrophobicContact CG2-CD1 4.46Š| ||
| 28 | I | 61 | Low | 48.8 | Very low | 154 Ų | 154 | 139.7 Ų | 139.7 | 79% | 0.79 | 75% | 0.748 | S | S | * | * | trans | 54 | 106.5 | 139.7 | -46.7 | 161.8 | 0 | 0 | 0 | 117.7 | ||||
| 29 | T | 50.4 | Low | 49.7 | Very low | 137 Ų | 137 | 137.1 Ų | 137.1 | 84% | 0.84 | 74% | 0.74 | S | S | * | * | trans | -154.1 | 161.6 | 143.6 | 50.9 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 30 | P | 47.2 | Very low | 50.4 | Low | 116 Ų | 116 | 135.9 Ų | 135.9 | 75% | 0.753 | 75% | 0.745 | S | S | * | * | -104.3 | 173.2 | -93.9 | 22.2 | 0.7 | 0 | 0 | 0 | 113.3 | D32 | P30-D32 PolarHBondContact O-N 3.09Å; P30-D32 VanDerWaalsContact O-N 3.09Å | |||
| 31 | L | 58.2 | Low | 50.9 | Low | 167 Ų | 167 | 134.6 Ų | 134.6 | 87% | 0.874 | 74% | 0.744 | S | S | * | * | trans | -50.4 | 108.7 | 175.4 | -169.7 | 77.3 | 0 | 0 | 0 | 112.3 | V33 | L31-V33 PolarHBondContact O-N 3.24Š| ||
| 32 | D | 51.3 | Low | 51.1 | Low | 110 Ų | 110 | 138.4 Ų | 138.4 | 59% | 0.588 | 75% | 0.751 | S | S | * | * | trans | -88.7 | 106.4 | 173.2 | -171 | 19.5 | 0 | 0 | 0 | 110.6 | P30 N34 | P30-D32 PolarHBondContact O-N 3.09Å; P30-D32 VanDerWaalsContact O-N 3.09Å; D32-N34 PolarHBondContact O-N 3.29Å; D32-N34 VanDerWaalsContact OD1-CB 3.27Å; D32-N34 WeakPolarHBondContact OD1-CB 3.27Å; D32-N34 PolarHBondContact OD1-N 3.23Å | ||
| 33 | V | 56.3 | Low | 52.2 | Low | 100 Ų | 100 | 138.3 Ų | 138.3 | 61% | 0.606 | 75% | 0.751 | S | S | * | * | G | 310 helix | trans | -72.6 | -5.5 | 179.9 | -155.3 | 0 | 0 | 0 | 0 | 111.5 | L31 Q35 L36 | L31-V33 PolarHBondContact O-N 3.24Å; V33-Q35 PolarHBondContact O-N 3.48Å; V33-L36 HydrophobicContact CG1-CD1 4.49Å; V33-L36 PolarHBondContact O-N 3.32Å |
| 34 | N | 54.3 | Low | 51.8 | Low | 115 Ų | 115 | 137.1 Ų | 137.1 | 62% | 0.615 | 75% | 0.749 | S | S | * | * | G | 310 helix | trans | -77.5 | -1.1 | -178.3 | -131 | -15.3 | 0 | 0 | 0 | 114.3 | D32 | D32-N34 PolarHBondContact O-N 3.29Å; D32-N34 VanDerWaalsContact OD1-CB 3.27Å; D32-N34 WeakPolarHBondContact OD1-CB 3.27Å; D32-N34 PolarHBondContact OD1-N 3.23Å |
| 35 | Q | 50.8 | Low | 52.5 | Low | 155 Ų | 155 | 136.6 Ų | 136.6 | 72% | 0.724 | 75% | 0.745 | S | S | * | * | G | 310 helix | trans | -91.5 | -3.4 | 169 | -66 | -156.2 | 33.9 | 0 | 0 | 114.6 | V33 | V33-Q35 PolarHBondContact O-N 3.48Š|
| 36 | L | 53.9 | Low | 52.3 | Low | 150 Ų | 150 | 134.4 Ų | 134.4 | 79% | 0.785 | 74% | 0.738 | S | S | * | * | S | Bend | trans | -90.2 | -5.9 | 171.3 | -75.2 | 170 | 0 | 0 | 0 | 113.2 | V33 F38 | V33-L36 HydrophobicContact CG1-CD1 4.49Å; V33-L36 PolarHBondContact O-N 3.32Å; L36-F38 PolarHBondContact O-N 3.31Å |
| 37 | Q | 54.1 | Low | 52.5 | Low | 152 Ų | 152 | 138.7 Ų | 138.7 | 71% | 0.71 | 75% | 0.746 | S | S | * | * | trans | -97.6 | 74.5 | 179.5 | -161.9 | 133.6 | 43.7 | 0 | 0 | 110.2 | P39 | Q37-P39 VanDerWaalsContact O-CD 3.27Å; Q37-P39 WeakPolarHBondContact O-CD 3.27Å | ||
| 38 | F | 50.3 | Low | 52.7 | Low | 179 Ų | 179 | 138 Ų | 138 | 79% | 0.785 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -72 | 116.3 | 163.6 | -75.8 | -81.3 | 0 | 0 | 0 | 108.6 | L36 | L36-F38 PolarHBondContact O-N 3.31Š|
| 39 | P | 55 | Low | 52 | Low | 95 Ų | 95 | 138.6 Ų | 138.6 | 62% | 0.617 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 142.5 | 173.2 | 28.8 | -32.7 | 0 | 0 | 0 | 108.7 | Q37 P41 | Q37-P39 VanDerWaalsContact O-CD 3.27Å; Q37-P39 WeakPolarHBondContact O-CD 3.27Å; P39-P41 WeakPolarHBondContact O-CD 3.09Å |
| 40 | P | 51.2 | Low | 52.1 | Low | 132 Ų | 132 | 139.2 Ų | 139.2 | 86% | 0.857 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -79.4 | 116.7 | 179.6 | 28.7 | -30.1 | 0 | 0 | 0 | 110.8 | ||
| 41 | P | 46.4 | Very low | 51.5 | Low | 109 Ų | 109 | 140.5 Ų | 140.5 | 71% | 0.708 | 74% | 0.744 | S | S | * | * | trans | -107.6 | 122.5 | 171.3 | 11.8 | 13.3 | 0 | 0 | 0 | 110.9 | P39 | P39-P41 WeakPolarHBondContact O-CD 3.09Š| ||
| 42 | D | 45.7 | Very low | 50.7 | Low | 137 Ų | 137 | 142.2 Ų | 142.2 | 73% | 0.733 | 74% | 0.741 | S | S | * | * | trans | 64.5 | 95.5 | 146.4 | -62.6 | -24.9 | 0 | 0 | 0 | 120.4 | V44 | D42-V44 PolarHBondContact O-N 3.35Š| ||
| 43 | K | 58.5 | Low | 49.9 | Very low | 203 Ų | 203 | 144 Ų | 144 | 88% | 0.883 | 75% | 0.745 | S | S | * | * | trans | 8.1 | 73.7 | 133.4 | -54.8 | 177.7 | -171.6 | 174 | 0 | 115.9 | V45 | K43-V45 PolarHBondContact O-N 2.84Š| ||
| 44 | V | 44.6 | Very low | 49.6 | Very low | 127 Ų | 127 | 143 Ų | 143 | 77% | 0.77 | 74% | 0.741 | S | S | * | * | trans | -85.6 | 96.7 | 155.2 | -165.9 | 0 | 0 | 0 | 0 | 106.8 | D42 V46 | D42-V44 PolarHBondContact O-N 3.35Å; V44-V46 HydrophobicContact CG1-CG2 3.96Å; V44-V46 PolarHBondContact O-N 3.04Å | ||
| 45 | V | 61 | Low | 48.8 | Very low | 124 Ų | 124 | 143 Ų | 143 | 75% | 0.752 | 74% | 0.741 | S | S | * | * | trans | -73.3 | 94.7 | 173 | 178.2 | 0 | 0 | 0 | 0 | 108 | K43 | K43-V45 PolarHBondContact O-N 2.84Š| ||
| 46 | V | 46.5 | Very low | 48.9 | Very low | 111 Ų | 111 | 146.7 Ų | 146.7 | 67% | 0.673 | 75% | 0.748 | S | S | * | * | trans | -111.2 | 89.9 | 158 | -167 | 0 | 0 | 0 | 0 | 107.4 | V44 | V44-V46 HydrophobicContact CG1-CG2 3.96Å; V44-V46 PolarHBondContact O-N 3.04Å | ||
| 47 | K | 51.2 | Low | 48.2 | Very low | 199 Ų | 199 | 148 Ų | 148 | 87% | 0.865 | 75% | 0.747 | S | S | * | * | trans | -101.4 | 82.2 | 168.6 | -92.3 | -172.9 | 174.7 | 178.4 | 0 | 109.1 | ||||
| 48 | T | 59.2 | Low | 48.3 | Very low | 126 Ų | 126 | 151.2 Ų | 151.2 | 77% | 0.773 | 76% | 0.759 | S | S | * | * | trans | -113.6 | 93.5 | 156.9 | 46.8 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 49 | K | 45 | Very low | 48.5 | Very low | 166 Ų | 166 | 146 Ų | 146 | 72% | 0.722 | 76% | 0.756 | S | S | * | * | trans | -146 | 89.4 | 158.1 | -161.3 | 175.7 | -177.6 | -177.4 | 0 | 109.9 | E51 | K49-E51 WeakPolarHBondContact CE-OE2 2.88Å; K49-E51 HydrophobicContact CG-CB 4.3Å; K49-E51 IonicContact NZ-OE2 2.68Å; K49-E51 PolarHBondContact NZ-OE2 2.8Å | ||
| 50 | T | 53.4 | Low | 48.1 | Very low | 151 Ų | 151 | 151.1 Ų | 151.1 | 93% | 0.926 | 77% | 0.769 | S | S | * | * | trans | -82.5 | 106 | 152.2 | 52.4 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 51 | E | 34.1 | Very low | 47.8 | Very low | 143 Ų | 143 | 155.1 Ų | 155.1 | 67% | 0.668 | 77% | 0.773 | S | S | * | * | trans | -140.9 | 109.7 | 161.1 | -162.6 | 168.3 | -152.6 | 0 | 0 | 108 | K49 | K49-E51 WeakPolarHBondContact CE-OE2 2.88Å; K49-E51 HydrophobicContact CG-CB 4.3Å; K49-E51 IonicContact NZ-OE2 2.68Å; K49-E51 PolarHBondContact NZ-OE2 2.8Å | ||
| 52 | Y | 41.3 | Very low | 48 | Very low | 202 Ų | 202 | 161.1 Ų | 161.1 | 79% | 0.792 | 78% | 0.781 | S | S | * | * | trans | -83.3 | 123.7 | 174.3 | 170.7 | -93.5 | 0 | 0 | 0 | 107.8 | P54 | Y52-P54 HydrophobicContact CD1-CG 4.47Å; Y52-P54 HydrophobicContact CE1-CB 4.17Å; Y52-P54 HydrophobicContact CE1-CG 3.69Å | ||
| 53 | E | 35.5 | Very low | 48.2 | Very low | 147 Ų | 147 | 158.6 Ų | 158.6 | 69% | 0.687 | 78% | 0.779 | S | S | * | * | trans | -135.9 | 115.3 | 167 | -136 | -62.5 | 148.9 | 0 | 0 | 107.7 | D55 | E53-D55 PolarHBondContact O-N 3.06Å; E53-D55 PolarHBondContact OE2-N 3.33Å | ||
| 54 | P | 50.3 | Low | 47.7 | Very low | 79 Ų | 79 | 153.5 Ų | 153.5 | 51% | 0.513 | 77% | 0.767 | S | S | . | * | trans | -92.2 | 67.7 | -179.7 | 37.3 | -31.6 | 0 | 0 | 0 | 110.5 | Y52 R56 | Y52-P54 HydrophobicContact CD1-CG 4.47Å; Y52-P54 HydrophobicContact CE1-CB 4.17Å; Y52-P54 HydrophobicContact CE1-CG 3.69Å; P54-R56 PolarHBondContact O-N 3.37Å | ||
| 55 | D | 36 | Very low | 48 | Very low | 115 Ų | 115 | 156 Ų | 156 | 62% | 0.615 | 77% | 0.768 | S | S | * | * | trans | -78.7 | 121.3 | 173.7 | -165 | 37.7 | 0 | 0 | 0 | 111.8 | E53 K57 | E53-D55 PolarHBondContact O-N 3.06Å; E53-D55 PolarHBondContact OE2-N 3.33Å; D55-K57 PolarHBondContact O-N 3.29Å | ||
| 56 | R | 53.8 | Low | 47.8 | Very low | 234 Ų | 234 | 155.2 Ų | 155.2 | 88% | 0.883 | 76% | 0.758 | S | S | * | * | trans | -92 | 87 | -162.3 | -162.9 | 170.3 | 89 | 163.3 | 7.3 | 108.7 | P54 | P54-R56 PolarHBondContact O-N 3.37Š| ||
| 57 | K | 39.9 | Very low | 48.1 | Very low | 176 Ų | 176 | 152.9 Ų | 152.9 | 77% | 0.765 | 75% | 0.75 | S | S | * | * | trans | -130.6 | 113.8 | 172.4 | -66.2 | -170.2 | -176.2 | 173.9 | 0 | 113.5 | D55 G59 | D55-K57 PolarHBondContact O-N 3.29Å; K57-G59 PolarHBondContact O-N 3.25Å | ||
| 58 | K | 55.8 | Low | 48.1 | Very low | 221 Ų | 221 | 150.2 Ų | 150.2 | 96% | 0.961 | 74% | 0.741 | S | S | * | * | trans | -45 | 126.5 | 168.3 | -68.1 | 174.2 | 175.4 | 179.8 | 0 | 110.8 | ||||
| 59 | G | 53.8 | Low | 47.8 | Very low | 69 Ų | 69 | 152 Ų | 152 | 71% | 0.711 | 74% | 0.739 | S | S | * | * | trans | 159.8 | 86.5 | 163.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | K57 | K57-G59 PolarHBondContact O-N 3.25Š| ||
| 60 | K | 46 | Very low | 48.3 | Very low | 203 Ų | 203 | 147.5 Ų | 147.5 | 88% | 0.883 | 73% | 0.725 | S | S | * | * | trans | 68.7 | 94.6 | 162.2 | -60.6 | 176.1 | 179.4 | 177.9 | 0 | 115.3 | R62 | K60-R62 VanDerWaalsContact C-N 3.31Å; K60-R62 PolarHBondContact O-N 2.82Å | ||
| 61 | F | 45.8 | Very low | 48.3 | Very low | 215 Ų | 215 | 145.6 Ų | 145.6 | 94% | 0.943 | 71% | 0.708 | S | S | * | * | trans | -51.2 | 93.1 | 154.7 | -80.9 | -92 | 0 | 0 | 0 | 110.1 | A63 | F61-A63 VanDerWaalsContact C-N 3.3Å; F61-A63 PolarHBondContact O-N 3.45Å | ||
| 62 | R | 51 | Low | 49.2 | Very low | 235 Ų | 235 | 142.7 Ų | 142.7 | 89% | 0.887 | 70% | 0.704 | S | S | * | * | trans | -76.4 | 94.3 | 150.1 | -80.9 | -82.2 | -162 | -166.3 | 2.2 | 105.3 | K60 P64 | K60-R62 VanDerWaalsContact C-N 3.31Å; K60-R62 PolarHBondContact O-N 2.82Å; R62-P64 WeakPolarHBondContact O-CD 3.38Å | ||
| 63 | A | 48.7 | Very low | 49.9 | Very low | 84 Ų | 84 | 137.9 Ų | 137.9 | 69% | 0.694 | 69% | 0.69 | S | S | * | * | trans | -56 | 120.8 | 170.8 | 0 | 0 | 0 | 0 | 0 | 108.9 | F61 | F61-A63 VanDerWaalsContact C-N 3.3Å; F61-A63 PolarHBondContact O-N 3.45Å | ||
| 64 | P | 49.8 | Very low | 51 | Low | 97 Ų | 97 | 135 Ų | 135 | 63% | 0.63 | 68% | 0.683 | S | S | * | * | trans | -68.6 | 144 | 168.9 | 27.2 | -27.9 | 0 | 0 | 0 | 108.3 | R62 I66 | R62-P64 WeakPolarHBondContact O-CD 3.38Å; P64-I66 VanDerWaalsContact C-N 3.34Å; P64-I66 WeakPolarHBondContact O-CG1 3.33Å; P64-I66 PolarHBondContact O-N 2.91Å | ||
| 65 | K | 49.5 | Very low | 51.2 | Low | 180 Ų | 180 | 138.3 Ų | 138.3 | 78% | 0.783 | 69% | 0.692 | S | S | * | * | trans | -53.6 | 93.2 | 173 | -86.6 | -178.9 | 165.3 | -170.9 | 0 | 110.1 | A67 | K65-A67 VanDerWaalsContact C-N 3.27Š| ||
| 66 | I | 56.4 | Low | 52.2 | Low | 106 Ų | 106 | 135 Ų | 135 | 54% | 0.544 | 68% | 0.684 | S | S | . | * | trans | -85.1 | -4.4 | 174.1 | -66.7 | 155.4 | 0 | 0 | 0 | 111 | P64 E68 T70 | P64-I66 VanDerWaalsContact C-N 3.34Å; P64-I66 WeakPolarHBondContact O-CG1 3.33Å; P64-I66 PolarHBondContact O-N 2.91Å; I66-E68 VanDerWaalsContact C-N 3.28Å; I66-E68 PolarHBondContact O-N 3.15Å; I66-E68 VanDerWaalsContact O-N 3.15Å; I66-T70 HydrophobicContact CG2-CG2 3.7Å; I66-T70 PolarHBondContact O-OG1 2.8Å | ||
| 67 | A | 53.6 | Low | 52.4 | Low | 62 Ų | 62 | 125.5 Ų | 125.5 | 51% | 0.512 | 65% | 0.652 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -66.4 | -18.3 | -170.7 | 0 | 0 | 0 | 0 | 0 | 115.8 | K65 I71 | K65-A67 VanDerWaalsContact C-N 3.27Å; A67-I71 WeakPolarHBondContact O-CD1 3.17Å; A67-I71 WeakPolarHBondContact O-CG1 3.42Å |
| 68 | E | 50.8 | Low | 53.4 | Low | 143 Ų | 143 | 119.8 Ų | 119.8 | 67% | 0.668 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.2 | -20.4 | -174 | -67.7 | 170.5 | -154.4 | 0 | 0 | 113.4 | I66 | I66-E68 VanDerWaalsContact C-N 3.28Å; I66-E68 PolarHBondContact O-N 3.15Å; I66-E68 VanDerWaalsContact O-N 3.15Å |
| 69 | F | 53 | Low | 54 | Low | 165 Ų | 165 | 115.9 Ų | 115.9 | 72% | 0.724 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -94.9 | -21 | 177.2 | -87.9 | -83.3 | 0 | 0 | 0 | 113.8 | I73 | F69-I73 WeakPolarHBondContact O-CD1 3.4Å; F69-I73 WeakPolarHBondContact O-CG1 3.48Å |
| 70 | T | 55.1 | Low | 54.9 | Low | 70 Ų | 70 | 121.7 Ų | 121.7 | 43% | 0.429 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -77 | -28.8 | 178.7 | 34.5 | 0 | 0 | 0 | 0 | 113.5 | I66 T74 | I66-T70 HydrophobicContact CG2-CG2 3.7Å; I66-T70 PolarHBondContact O-OG1 2.8Å; T70-T74 PolarHBondContact O-N 3.45Å; T70-T74 VanDerWaalsContact O-N 3.11Å; T70-T74 PolarHBondContact O-OG1 3.34Å |
| 71 | I | 54.1 | Low | 56.5 | Low | 111 Ų | 111 | 117.7 Ų | 117.7 | 57% | 0.569 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -75.7 | -39.4 | -175.5 | -58.5 | 171.4 | 0 | 0 | 0 | 111.5 | A67 T74 E75 | A67-I71 WeakPolarHBondContact O-CD1 3.17Å; A67-I71 WeakPolarHBondContact O-CG1 3.42Å; I71-T74 WeakPolarHBondContact CA-OG1 3.03Å; I71-T74 PolarHBondContact O-N 2.86Å; I71-T74 PolarHBondContact O-OG1 3.31Å; I71-E75 PolarHBondContact O-N 3.14Å |
| 72 | S | 53.3 | Low | 58.4 | Low | 83 Ų | 83 | 114.1 Ų | 114.1 | 58% | 0.58 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -76.7 | -27 | 178.5 | 58 | 0 | 0 | 0 | 0 | 113.3 | ||
| 73 | I | 54.8 | Low | 60.2 | Low | 101 Ų | 101 | 107.7 Ų | 107.7 | 52% | 0.518 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -70.1 | -47.2 | 170.7 | -66.8 | 174.4 | 0 | 0 | 0 | 109 | F69 E75 G76 V77 | F69-I73 WeakPolarHBondContact O-CD1 3.4Å; F69-I73 WeakPolarHBondContact O-CG1 3.48Å; I73-E75 PolarHBondContact O-N 2.86Å; I73-G76 PolarHBondContact O-N 3.46Å; I73-V77 HydrophobicContact CG2-CB 4.45Å; I73-V77 HydrophobicContact CG2-CG2 3.49Å; I73-V77 VanDerWaalsContact CG2-CG2 3.49Å; I73-V77 WeakPolarHBondContact O-CB 2.98Å; I73-V77 WeakPolarHBondContact O-CG2 3.07Å; I73-V77 PolarHBondContact O-N 3.11Å |
| 74 | T | 58.6 | Low | 62.1 | Low | 85 Ų | 85 | 107.2 Ų | 107.2 | 52% | 0.521 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -60.8 | -37.3 | -177.4 | 22.8 | 0 | 0 | 0 | 0 | 114.6 | T70 I71 S78 | T70-T74 PolarHBondContact O-N 3.45Å; T70-T74 VanDerWaalsContact O-N 3.11Å; T70-T74 PolarHBondContact O-OG1 3.34Å; I71-T74 WeakPolarHBondContact CA-OG1 3.03Å; I71-T74 PolarHBondContact O-N 2.86Å; I71-T74 PolarHBondContact O-OG1 3.31Å; T74-S78 WeakPolarHBondContact O-CB 3.4Å; T74-S78 PolarHBondContact O-N 3.32Å |
| 75 | E | 55.9 | Low | 64 | Low | 150 Ų | 150 | 107 Ų | 107 | 70% | 0.701 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -62.9 | -49.5 | -179.5 | -155 | 79.5 | -155.9 | 0 | 0 | 111.7 | I71 I73 S78 | I71-E75 PolarHBondContact O-N 3.14Å; I73-E75 PolarHBondContact O-N 2.86Å; E75-S78 PolarHBondContact O-OG 2.62Å |
| 76 | G | 56.8 | Low | 66 | Low | 45 Ų | 45 | 104 Ų | 104 | 46% | 0.464 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -83.2 | -18.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | I73 | I73-G76 PolarHBondContact O-N 3.46Å |
| 77 | V | 57.3 | Low | 67.8 | Low | 35 Ų | 35 | 102.4 Ų | 102.4 | 21% | 0.212 | 54% | 0.541 | C | S | . | . | H | α-helix | trans | -74.5 | -35.8 | 170 | 148 | 0 | 0 | 0 | 0 | 110.4 | I73 E79 R80 F81 | I73-V77 HydrophobicContact CG2-CB 4.45Å; I73-V77 HydrophobicContact CG2-CG2 3.49Å; I73-V77 VanDerWaalsContact CG2-CG2 3.49Å; I73-V77 WeakPolarHBondContact O-CB 2.98Å; I73-V77 WeakPolarHBondContact O-CG2 3.07Å; I73-V77 PolarHBondContact O-N 3.11Å; V77-E79 VanDerWaalsContact C-N 3.25Å; V77-E79 PolarHBondContact O-N 2.65Å; V77-E79 VanDerWaalsContact O-N 3.15Å; V77-R80 CarbonylContact O-C 3.58Å; V77-R80 PolarHBondContact O-N 2.91Å; V77-F81 HydrophobicContact CB-CD2 3.64Å; V77-F81 HydrophobicContact CB-CE2 3.66Å; V77-F81 HydrophobicContact CB-CG 4.41Å; V77-F81 HydrophobicContact CB-CZ 4.44Å; V77-F81 HydrophobicContact CG1-CB 4.21Å; V77-F81 HydrophobicContact CG1-CD1 3.84Å; V77-F81 HydrophobicContact CG1-CD2 3.03Å; V77-F81 HydrophobicContact CG1-CE1 3.89Å; V77-F81 HydrophobicContact CG1-CE2 3.1Å; V77-F81 HydrophobicContact CG1-CG 3.41Å; V77-F81 VanDerWaalsContact CG1-CG 3.41Å; V77-F81 HydrophobicContact CG1-CZ 3.53Å; V77-F81 HydrophobicContact CG2-CD2 3.97Å; V77-F81 HydrophobicContact CG2-CE2 3.48Å; V77-F81 VanDerWaalsContact CG2-CE2 3.48Å; V77-F81 HydrophobicContact CG2-CZ 4.25Å; V77-F81 WeakPolarHBondContact O-CA 3.4Å; V77-F81 WeakPolarHBondContact O-CB 3.35Å; V77-F81 WeakPolarHBondContact O-CD2 3.5Å; V77-F81 WeakPolarHBondContact O-CG 3.3Å; V77-F81 PolarHBondContact O-N 3.03Å |
| 78 | S | 60.4 | Low | 69.8 | Low | 55 Ų | 55 | 104.5 Ų | 104.5 | 39% | 0.385 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -55.5 | -39.7 | -175.3 | 73.7 | 0 | 0 | 0 | 0 | 113.1 | T74 E75 K82 | T74-S78 WeakPolarHBondContact O-CB 3.4Å; T74-S78 PolarHBondContact O-N 3.32Å; E75-S78 PolarHBondContact O-OG 2.62Å; S78-K82 WeakPolarHBondContact O-CB 3.09Å; S78-K82 WeakPolarHBondContact O-CD 3.34Å; S78-K82 WeakPolarHBondContact O-CG 3.41Å; S78-K82 PolarHBondContact O-N 2.86Å |
| 79 | E | 69.4 | Low | 71.9 | Confident | 140 Ų | 140 | 103.6 Ų | 103.6 | 65% | 0.654 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -76.3 | -44.5 | 178.9 | -166.3 | 166.9 | -163.6 | 0 | 0 | 112.2 | V77 F81 K82 I83 | V77-E79 VanDerWaalsContact C-N 3.25Å; V77-E79 PolarHBondContact O-N 2.65Å; V77-E79 VanDerWaalsContact O-N 3.15Å; E79-F81 VanDerWaalsContact C-N 3.3Å; E79-F81 PolarHBondContact O-N 3.49Å; E79-K82 WeakPolarHBondContact O-CB 3.07Å; E79-K82 PolarHBondContact O-N 3.42Å; E79-I83 WeakPolarHBondContact O-CG1 3.19Å; E79-I83 PolarHBondContact O-N 3.19Å |
| 80 | R | 71.7 | Confident | 73.9 | Confident | 190 Ų | 190 | 98 Ų | 98 | 72% | 0.717 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -68.1 | -30.7 | 176.9 | -61.9 | -174.4 | -176.1 | -170.4 | 1.9 | 112.4 | V77 T84 | V77-R80 CarbonylContact O-C 3.58Å; V77-R80 PolarHBondContact O-N 2.91Å; R80-T84 VanDerWaalsContact O-CB 3.3Å; R80-T84 WeakPolarHBondContact O-CB 3.22Å; R80-T84 PolarHBondContact O-N 2.73Å; R80-T84 PolarHBondContact O-OG1 3.25Å |
| 81 | F | 80.4 | Confident | 75.9 | Confident | 120 Ų | 120 | 99.2 Ų | 99.2 | 53% | 0.526 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -81.1 | -35.3 | 176.3 | -80.2 | -123.3 | 0 | 0 | 0 | 110.8 | V77 E79 I83 T84 V85 | V77-F81 HydrophobicContact CB-CD2 3.64Å; V77-F81 HydrophobicContact CB-CE2 3.66Å; V77-F81 HydrophobicContact CB-CG 4.41Å; V77-F81 HydrophobicContact CB-CZ 4.44Å; V77-F81 HydrophobicContact CG1-CB 4.21Å; V77-F81 HydrophobicContact CG1-CD1 3.84Å; V77-F81 HydrophobicContact CG1-CD2 3.03Å; V77-F81 HydrophobicContact CG1-CE1 3.89Å; V77-F81 HydrophobicContact CG1-CE2 3.1Å; V77-F81 HydrophobicContact CG1-CG 3.41Å; V77-F81 VanDerWaalsContact CG1-CG 3.41Å; V77-F81 HydrophobicContact CG1-CZ 3.53Å; V77-F81 HydrophobicContact CG2-CD2 3.97Å; V77-F81 HydrophobicContact CG2-CE2 3.48Å; V77-F81 VanDerWaalsContact CG2-CE2 3.48Å; V77-F81 HydrophobicContact CG2-CZ 4.25Å; V77-F81 WeakPolarHBondContact O-CA 3.4Å; V77-F81 WeakPolarHBondContact O-CB 3.35Å; V77-F81 WeakPolarHBondContact O-CD2 3.5Å; V77-F81 WeakPolarHBondContact O-CG 3.3Å; V77-F81 PolarHBondContact O-N 3.03Å; E79-F81 VanDerWaalsContact C-N 3.3Å; E79-F81 PolarHBondContact O-N 3.49Å; F81-I83 VanDerWaalsContact C-N 3.32Å; F81-I83 PolarHBondContact O-N 3.15Å; F81-T84 PolarHBondContact O-N 2.86Å; F81-V85 WeakPolarHBondContact O-CB 3.44Å; F81-V85 WeakPolarHBondContact O-CG2 3.12Å; F81-V85 PolarHBondContact O-N 3.35Å |
| 82 | K | 85.2 | Confident | 77.9 | Confident | 139 Ų | 139 | 96.5 Ų | 96.5 | 60% | 0.604 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -55.9 | -50 | 167.7 | -84.1 | 166 | 172.5 | 173.2 | 0 | 110.4 | S78 E79 V85 L86 | S78-K82 WeakPolarHBondContact O-CB 3.09Å; S78-K82 WeakPolarHBondContact O-CD 3.34Å; S78-K82 WeakPolarHBondContact O-CG 3.41Å; S78-K82 PolarHBondContact O-N 2.86Å; E79-K82 WeakPolarHBondContact O-CB 3.07Å; E79-K82 PolarHBondContact O-N 3.42Å; K82-V85 PolarHBondContact O-N 2.67Å; K82-L86 WeakPolarHBondContact O-CB 3.18Å; K82-L86 WeakPolarHBondContact O-CG 3.38Å; K82-L86 PolarHBondContact O-N 3.44Å |
| 83 | I | 88.8 | Confident | 80 | Confident | 100 Ų | 100 | 98 Ų | 98 | 51% | 0.513 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.6 | -47.2 | 177.1 | -63.4 | 160.9 | 0 | 0 | 0 | 110.4 | E79 F81 V85 L86 V87 | E79-I83 WeakPolarHBondContact O-CG1 3.19Å; E79-I83 PolarHBondContact O-N 3.19Å; F81-I83 VanDerWaalsContact C-N 3.32Å; F81-I83 PolarHBondContact O-N 3.15Å; I83-V85 PolarHBondContact O-N 2.91Å; I83-L86 PolarHBondContact O-N 2.82Å; I83-V87 HydrophobicContact CG2-CG2 4.23Å; I83-V87 WeakPolarHBondContact O-CB 3.19Å; I83-V87 WeakPolarHBondContact O-CG2 3.33Å; I83-V87 PolarHBondContact O-N 2.84Å |
| 84 | T | 88.8 | Confident | 82 | Confident | 75 Ų | 75 | 98.5 Ų | 98.5 | 46% | 0.46 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62.6 | -40.9 | 180 | -56.6 | 0 | 0 | 0 | 0 | 112.2 | R80 F81 V87 L88 | R80-T84 VanDerWaalsContact O-CB 3.3Å; R80-T84 WeakPolarHBondContact O-CB 3.22Å; R80-T84 PolarHBondContact O-N 2.73Å; R80-T84 PolarHBondContact O-OG1 3.25Å; F81-T84 PolarHBondContact O-N 2.86Å; T84-V87 PolarHBondContact O-N 3.43Å; T84-L88 HydrophobicContact CG2-CD1 4.34Å; T84-L88 WeakPolarHBondContact O-CB 3.27Å; T84-L88 VanDerWaalsContact O-CG 3.27Å; T84-L88 WeakPolarHBondContact O-CG 3.48Å; T84-L88 PolarHBondContact O-N 2.86Å |
| 85 | V | 89.4 | Confident | 83.7 | Confident | 91 Ų | 91 | 98.8 Ų | 98.8 | 55% | 0.552 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -67.7 | -42.8 | 176.6 | 169.7 | 0 | 0 | 0 | 0 | 110.9 | F81 K82 I83 V87 L88 F89 | F81-V85 WeakPolarHBondContact O-CB 3.44Å; F81-V85 WeakPolarHBondContact O-CG2 3.12Å; F81-V85 PolarHBondContact O-N 3.35Å; K82-V85 PolarHBondContact O-N 2.67Å; I83-V85 PolarHBondContact O-N 2.91Å; V85-V87 VanDerWaalsContact C-N 3.31Å; V85-V87 PolarHBondContact O-N 3.3Å; V85-L88 PolarHBondContact O-N 2.88Å; V85-F89 WeakPolarHBondContact O-CB 3.26Å; V85-F89 PolarHBondContact O-N 2.87Å |
| 86 | L | 92.9 | Very high | 85.6 | Confident | 117 Ų | 117 | 94.8 Ų | 94.8 | 61% | 0.613 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -63.2 | -38.6 | 174.3 | -72.2 | 174.3 | 0 | 0 | 0 | 111.7 | K82 I83 F89 A90 | K82-L86 WeakPolarHBondContact O-CB 3.18Å; K82-L86 WeakPolarHBondContact O-CG 3.38Å; K82-L86 PolarHBondContact O-N 3.44Å; I83-L86 PolarHBondContact O-N 2.82Å; L86-F89 PolarHBondContact O-N 3.48Å; L86-A90 WeakPolarHBondContact O-CB 3.46Å; L86-A90 PolarHBondContact O-N 3.37Å |
| 87 | V | 94.1 | Very high | 87.4 | Confident | 73 Ų | 73 | 96.5 Ų | 96.5 | 44% | 0.442 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -65.7 | -45.6 | 175 | 169.5 | 0 | 0 | 0 | 0 | 110.6 | I83 T84 V85 F89 A90 L91 | I83-V87 HydrophobicContact CG2-CG2 4.23Å; I83-V87 WeakPolarHBondContact O-CB 3.19Å; I83-V87 WeakPolarHBondContact O-CG2 3.33Å; I83-V87 PolarHBondContact O-N 2.84Å; T84-V87 PolarHBondContact O-N 3.43Å; V85-V87 VanDerWaalsContact C-N 3.31Å; V85-V87 PolarHBondContact O-N 3.3Å; V87-F89 VanDerWaalsContact C-N 3.32Å; V87-F89 PolarHBondContact O-N 2.88Å; V87-A90 PolarHBondContact O-N 3.42Å; V87-L91 HydrophobicContact CG1-CD1 3.98Å; V87-L91 HydrophobicContact CG1-CG 4.36Å; V87-L91 WeakPolarHBondContact O-CB 3.35Å; V87-L91 VanDerWaalsContact O-CG 3.26Å; V87-L91 WeakPolarHBondContact O-CG 3.3Å; V87-L91 PolarHBondContact O-N 3.43Å |
| 88 | L | 94.5 | Very high | 89.2 | Confident | 107 Ų | 107 | 99.2 Ų | 99.2 | 56% | 0.56 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -61.3 | -41.5 | 175.7 | -73.3 | 171.9 | 0 | 0 | 0 | 111.8 | T84 V85 L91 A92 | T84-L88 HydrophobicContact CG2-CD1 4.34Å; T84-L88 WeakPolarHBondContact O-CB 3.27Å; T84-L88 VanDerWaalsContact O-CG 3.27Å; T84-L88 WeakPolarHBondContact O-CG 3.48Å; T84-L88 PolarHBondContact O-N 2.86Å; V85-L88 PolarHBondContact O-N 2.88Å; L88-L91 PolarHBondContact O-N 3.32Å; L88-A92 WeakPolarHBondContact O-CB 3.35Å; L88-A92 PolarHBondContact O-N 3.33Å |
| 89 | F | 95.6 | Very high | 90.6 | Very high | 123 Ų | 123 | 103 Ų | 103 | 54% | 0.539 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -61.4 | -50.9 | 173.9 | -168.9 | -97 | 0 | 0 | 0 | 110.2 | V85 L86 V87 L91 A92 F93 | V85-F89 WeakPolarHBondContact O-CB 3.26Å; V85-F89 PolarHBondContact O-N 2.87Å; L86-F89 PolarHBondContact O-N 3.48Å; V87-F89 VanDerWaalsContact C-N 3.32Å; V87-F89 PolarHBondContact O-N 2.88Å; F89-L91 VanDerWaalsContact C-N 3.3Å; F89-L91 PolarHBondContact O-N 3.46Å; F89-A92 PolarHBondContact O-N 2.88Å; F89-A92 VanDerWaalsContact O-N 3.11Å; F89-F93 AromaticContact CD1-CD2 3.57Å; F89-F93 HydrophobicContact CD1-CD2 3.57Å; F89-F93 AromaticContact CD1-CE2 3.64Å; F89-F93 HydrophobicContact CD1-CE2 3.64Å; F89-F93 HydrophobicContact CD2-CD2 4.14Å; F89-F93 AromaticContact CD2-CE2 3.67Å; F89-F93 HydrophobicContact CD2-CE2 3.67Å; F89-F93 AromaticContact CE1-CD2 3.49Å; F89-F93 HydrophobicContact CE1-CD2 3.49Å; F89-F93 VanDerWaalsContact CE1-CD2 3.49Å; F89-F93 AromaticContact CE1-CE2 3.15Å; F89-F93 HydrophobicContact CE1-CE2 3.15Å; F89-F93 HydrophobicContact CE1-CG 4.35Å; F89-F93 AromaticContact CE1-CZ 3.7Å; F89-F93 HydrophobicContact CE1-CZ 3.7Å; F89-F93 HydrophobicContact CE2-CD2 4.1Å; F89-F93 AromaticContact CE2-CE2 3.22Å; F89-F93 HydrophobicContact CE2-CE2 3.22Å; F89-F93 AromaticContact CE2-CZ 3.92Å; F89-F93 HydrophobicContact CE2-CZ 3.92Å; F89-F93 AromaticContact CG-CD2 3.92Å; F89-F93 HydrophobicContact CG-CD2 3.92Å; F89-F93 AromaticContact CG-CE2 3.89Å; F89-F93 HydrophobicContact CG-CE2 3.89Å; F89-F93 AromaticContact CZ-CD2 3.79Å; F89-F93 HydrophobicContact CZ-CD2 3.79Å; F89-F93 HydrophobicContact CZ-CE1 4.46Å; F89-F93 AromaticContact CZ-CE2 2.95Å; F89-F93 HydrophobicContact CZ-CE2 2.95Å; F89-F93 AromaticContact CZ-CZ 3.34Å; F89-F93 HydrophobicContact CZ-CZ 3.34Å; F89-F93 VanDerWaalsContact O-CD2 3.24Å; F89-F93 WeakPolarHBondContact O-CD2 3.36Å; F89-F93 PolarHBondContact O-N 3.4Å |
| 90 | A | 95.6 | Very high | 91.6 | Very high | 49 Ų | 49 | 101.4 Ų | 101.4 | 41% | 0.405 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -56.6 | -42.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | L86 V87 F93 L94 | L86-A90 WeakPolarHBondContact O-CB 3.46Å; L86-A90 PolarHBondContact O-N 3.37Å; V87-A90 PolarHBondContact O-N 3.42Å; A90-F93 PolarHBondContact O-N 2.93Å; A90-L94 WeakPolarHBondContact O-CB 3.4Å; A90-L94 WeakPolarHBondContact O-CG 3.39Å; A90-L94 PolarHBondContact O-N 3.28Å |
| 91 | L | 96.1 | Very high | 92.5 | Very high | 95 Ų | 95 | 96.3 Ų | 96.3 | 50% | 0.497 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -66 | -41.2 | 175.8 | -69.3 | 173.5 | 0 | 0 | 0 | 112.4 | V87 L88 F89 F93 L94 T95 | V87-L91 HydrophobicContact CG1-CD1 3.98Å; V87-L91 HydrophobicContact CG1-CG 4.36Å; V87-L91 WeakPolarHBondContact O-CB 3.35Å; V87-L91 VanDerWaalsContact O-CG 3.26Å; V87-L91 WeakPolarHBondContact O-CG 3.3Å; V87-L91 PolarHBondContact O-N 3.43Å; L88-L91 PolarHBondContact O-N 3.32Å; F89-L91 VanDerWaalsContact C-N 3.3Å; F89-L91 PolarHBondContact O-N 3.46Å; L91-F93 VanDerWaalsContact C-N 3.35Å; L91-L94 PolarHBondContact O-N 3.4Å; L91-T95 WeakPolarHBondContact O-CB 3.33Å; L91-T95 WeakPolarHBondContact O-CG2 3.2Å; L91-T95 PolarHBondContact O-N 2.94Å; L91-T95 PolarHBondContact O-OG1 2.87Å |
| 92 | A | 96.6 | Very high | 92.8 | Very high | 53 Ų | 53 | 94.3 Ų | 94.3 | 44% | 0.438 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.8 | -40.2 | 175 | 0 | 0 | 0 | 0 | 0 | 111.6 | L88 F89 T95 C96 | L88-A92 WeakPolarHBondContact O-CB 3.35Å; L88-A92 PolarHBondContact O-N 3.33Å; F89-A92 PolarHBondContact O-N 2.88Å; F89-A92 VanDerWaalsContact O-N 3.11Å; A92-T95 WeakPolarHBondContact CA-OG1 3.24Å; A92-T95 PolarHBondContact O-OG1 3.11Å; A92-C96 WeakPolarHBondContact O-CB 3.32Å; A92-C96 PolarHBondContact O-N 3.45Å |
| 93 | F | 97.1 | Very high | 92.6 | Very high | 114 Ų | 114 | 93.3 Ų | 93.3 | 50% | 0.5 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -68.8 | -43.7 | 175.7 | -86.4 | -95.9 | 0 | 0 | 0 | 112.1 | F89 A90 L91 C96 V97 | F89-F93 AromaticContact CD1-CD2 3.57Å; F89-F93 HydrophobicContact CD1-CD2 3.57Å; F89-F93 AromaticContact CD1-CE2 3.64Å; F89-F93 HydrophobicContact CD1-CE2 3.64Å; F89-F93 HydrophobicContact CD2-CD2 4.14Å; F89-F93 AromaticContact CD2-CE2 3.67Å; F89-F93 HydrophobicContact CD2-CE2 3.67Å; F89-F93 AromaticContact CE1-CD2 3.49Å; F89-F93 HydrophobicContact CE1-CD2 3.49Å; F89-F93 VanDerWaalsContact CE1-CD2 3.49Å; F89-F93 AromaticContact CE1-CE2 3.15Å; F89-F93 HydrophobicContact CE1-CE2 3.15Å; F89-F93 HydrophobicContact CE1-CG 4.35Å; F89-F93 AromaticContact CE1-CZ 3.7Å; F89-F93 HydrophobicContact CE1-CZ 3.7Å; F89-F93 HydrophobicContact CE2-CD2 4.1Å; F89-F93 AromaticContact CE2-CE2 3.22Å; F89-F93 HydrophobicContact CE2-CE2 3.22Å; F89-F93 AromaticContact CE2-CZ 3.92Å; F89-F93 HydrophobicContact CE2-CZ 3.92Å; F89-F93 AromaticContact CG-CD2 3.92Å; F89-F93 HydrophobicContact CG-CD2 3.92Å; F89-F93 AromaticContact CG-CE2 3.89Å; F89-F93 HydrophobicContact CG-CE2 3.89Å; F89-F93 AromaticContact CZ-CD2 3.79Å; F89-F93 HydrophobicContact CZ-CD2 3.79Å; F89-F93 HydrophobicContact CZ-CE1 4.46Å; F89-F93 AromaticContact CZ-CE2 2.95Å; F89-F93 HydrophobicContact CZ-CE2 2.95Å; F89-F93 AromaticContact CZ-CZ 3.34Å; F89-F93 HydrophobicContact CZ-CZ 3.34Å; F89-F93 VanDerWaalsContact O-CD2 3.24Å; F89-F93 WeakPolarHBondContact O-CD2 3.36Å; F89-F93 PolarHBondContact O-N 3.4Å; A90-F93 PolarHBondContact O-N 2.93Å; L91-F93 VanDerWaalsContact C-N 3.35Å; F93-C96 PolarHBondContact O-N 2.82Å; F93-V97 WeakPolarHBondContact O-CG2 3.43Å; F93-V97 PolarHBondContact O-N 3.27Å |
| 94 | L | 96.4 | Very high | 92.2 | Very high | 112 Ų | 112 | 95.3 Ų | 95.3 | 59% | 0.586 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -59.4 | -47.9 | 175.9 | -79.2 | 169.8 | 0 | 0 | 0 | 111.6 | A90 L91 C96 V97 V98 | A90-L94 WeakPolarHBondContact O-CB 3.4Å; A90-L94 WeakPolarHBondContact O-CG 3.39Å; A90-L94 PolarHBondContact O-N 3.28Å; L91-L94 PolarHBondContact O-N 3.4Å; L94-C96 VanDerWaalsContact C-N 3.33Å; L94-C96 PolarHBondContact O-N 2.92Å; L94-V97 PolarHBondContact O-N 2.87Å; L94-V98 VanDerWaalsContact O-CG2 3.3Å; L94-V98 WeakPolarHBondContact O-CG2 2.96Å; L94-V98 PolarHBondContact O-N 2.94Å |
| 95 | T | 95.4 | Very high | 91.6 | Very high | 92 Ų | 92 | 95.6 Ų | 95.6 | 56% | 0.564 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -62.9 | -39.3 | 176.2 | 50.5 | 0 | 0 | 0 | 0 | 111.8 | L91 A92 V98 F99 | L91-T95 WeakPolarHBondContact O-CB 3.33Å; L91-T95 WeakPolarHBondContact O-CG2 3.2Å; L91-T95 PolarHBondContact O-N 2.94Å; L91-T95 PolarHBondContact O-OG1 2.87Å; A92-T95 WeakPolarHBondContact CA-OG1 3.24Å; A92-T95 PolarHBondContact O-OG1 3.11Å; T95-V98 PolarHBondContact O-N 3.18Å; T95-F99 VanDerWaalsContact O-CB 3.26Å; T95-F99 WeakPolarHBondContact O-CB 3.47Å; T95-F99 PolarHBondContact O-N 3.45Å |
| 96 | C | 94.9 | Very high | 90.6 | Very high | 65 Ų | 65 | 98 Ų | 98 | 44% | 0.439 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64 | -43.7 | 175.4 | -163.3 | 0 | 0 | 0 | 0 | 112 | A92 F93 L94 F99 L100 | A92-C96 WeakPolarHBondContact O-CB 3.32Å; A92-C96 PolarHBondContact O-N 3.45Å; F93-C96 PolarHBondContact O-N 2.82Å; L94-C96 VanDerWaalsContact C-N 3.33Å; L94-C96 PolarHBondContact O-N 2.92Å; C96-F99 CarbonylContact O-C 3.54Å; C96-F99 PolarHBondContact O-N 3.3Å; C96-L100 WeakPolarHBondContact O-CB 3.33Å; C96-L100 VanDerWaalsContact O-CG 3.27Å; C96-L100 WeakPolarHBondContact O-CG 3.31Å; C96-L100 PolarHBondContact O-N 2.87Å |
| 97 | V | 94.8 | Very high | 89.2 | Confident | 82 Ų | 82 | 98 Ų | 98 | 50% | 0.497 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.4 | -45.9 | 175.9 | 171.9 | 0 | 0 | 0 | 0 | 111.1 | F93 L94 F99 L100 V101 | F93-V97 WeakPolarHBondContact O-CG2 3.43Å; F93-V97 PolarHBondContact O-N 3.27Å; L94-V97 PolarHBondContact O-N 2.87Å; V97-F99 VanDerWaalsContact C-N 3.31Å; V97-F99 PolarHBondContact O-N 2.81Å; V97-L100 PolarHBondContact O-N 2.85Å; V97-V101 WeakPolarHBondContact O-CG2 3.43Å; V97-V101 PolarHBondContact O-N 3.46Å |
| 98 | V | 94.4 | Very high | 87.5 | Confident | 91 Ų | 91 | 101.6 Ų | 101.6 | 55% | 0.552 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -60.3 | -44.3 | 175.4 | 172.2 | 0 | 0 | 0 | 0 | 110.3 | L94 T95 L100 V101 V102 | L94-V98 VanDerWaalsContact O-CG2 3.3Å; L94-V98 WeakPolarHBondContact O-CG2 2.96Å; L94-V98 PolarHBondContact O-N 2.94Å; T95-V98 PolarHBondContact O-N 3.18Å; V98-L100 VanDerWaalsContact C-N 3.34Å; V98-L100 PolarHBondContact O-N 2.78Å; V98-V101 PolarHBondContact O-N 2.68Å; V98-V102 HydrophobicContact CG1-CG2 4.3Å; V98-V102 WeakPolarHBondContact O-CB 3.26Å; V98-V102 VanDerWaalsContact O-CG2 3.31Å; V98-V102 WeakPolarHBondContact O-CG2 3.23Å; V98-V102 PolarHBondContact O-N 3.24Å |
| 99 | F | 91.6 | Very high | 85.8 | Confident | 136 Ų | 136 | 101.8 Ų | 101.8 | 60% | 0.596 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -64.3 | -37.1 | 176.3 | -169.4 | -97.6 | 0 | 0 | 0 | 111.9 | T95 C96 V97 Y103 | T95-F99 VanDerWaalsContact O-CB 3.26Å; T95-F99 WeakPolarHBondContact O-CB 3.47Å; T95-F99 PolarHBondContact O-N 3.45Å; C96-F99 CarbonylContact O-C 3.54Å; C96-F99 PolarHBondContact O-N 3.3Å; V97-F99 VanDerWaalsContact C-N 3.31Å; V97-F99 PolarHBondContact O-N 2.81Å; F99-Y103 HydrophobicContact CE1-CD2 4.37Å; F99-Y103 WeakPolarHBondContact O-CA 3.4Å; F99-Y103 WeakPolarHBondContact O-CB 3.27Å; F99-Y103 PolarHBondContact O-N 3.45Å |
| 100 | L | 89.6 | Confident | 83.9 | Confident | 105 Ų | 105 | 101.9 Ų | 101.9 | 55% | 0.55 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -68.5 | -36.7 | 174.6 | -74 | 175.8 | 0 | 0 | 0 | 112.4 | C96 V97 V98 K104 | C96-L100 WeakPolarHBondContact O-CB 3.33Å; C96-L100 VanDerWaalsContact O-CG 3.27Å; C96-L100 WeakPolarHBondContact O-CG 3.31Å; C96-L100 PolarHBondContact O-N 2.87Å; V97-L100 PolarHBondContact O-N 2.85Å; V98-L100 VanDerWaalsContact C-N 3.34Å; V98-L100 PolarHBondContact O-N 2.78Å; L100-K104 WeakPolarHBondContact O-CB 3.18Å; L100-K104 PolarHBondContact O-N 2.63Å |
| 101 | V | 90.2 | Very high | 82 | Confident | 84 Ų | 84 | 103.2 Ų | 103.2 | 51% | 0.509 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -68.5 | -47.8 | 174.5 | 172.4 | 0 | 0 | 0 | 0 | 110.1 | V97 V98 K104 V105 | V97-V101 WeakPolarHBondContact O-CG2 3.43Å; V97-V101 PolarHBondContact O-N 3.46Å; V98-V101 PolarHBondContact O-N 2.68Å; V101-K104 CarbonylContact O-C 3.55Å; V101-K104 PolarHBondContact O-N 2.79Å; V101-V105 WeakPolarHBondContact O-CG2 3.37Å; V101-V105 PolarHBondContact O-N 3.31Å |
| 102 | V | 86.6 | Confident | 80.1 | Confident | 78 Ų | 78 | 99.3 Ų | 99.3 | 47% | 0.473 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.9 | -41.7 | 176.4 | 173.2 | 0 | 0 | 0 | 0 | 110.4 | V98 K104 V105 Y106 | V98-V102 HydrophobicContact CG1-CG2 4.3Å; V98-V102 WeakPolarHBondContact O-CB 3.26Å; V98-V102 VanDerWaalsContact O-CG2 3.31Å; V98-V102 WeakPolarHBondContact O-CG2 3.23Å; V98-V102 PolarHBondContact O-N 3.24Å; V102-K104 VanDerWaalsContact C-N 3.32Å; V102-K104 PolarHBondContact O-N 3.44Å; V102-V105 CarbonylContact O-C 3.6Å; V102-V105 PolarHBondContact O-N 2.81Å; V102-Y106 WeakPolarHBondContact O-CA 3.43Å; V102-Y106 WeakPolarHBondContact O-CB 3.36Å; V102-Y106 PolarHBondContact O-N 2.95Å |
| 103 | Y | 81.1 | Confident | 78.2 | Confident | 117 Ų | 117 | 101 Ų | 101 | 46% | 0.459 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.6 | -41.8 | 173.4 | -178.4 | -90.5 | 0 | 0 | 0 | 110.3 | F99 V105 K107 | F99-Y103 HydrophobicContact CE1-CD2 4.37Å; F99-Y103 WeakPolarHBondContact O-CA 3.4Å; F99-Y103 WeakPolarHBondContact O-CB 3.27Å; F99-Y103 PolarHBondContact O-N 3.45Å; Y103-V105 PolarHBondContact O-N 3.49Å; Y103-K107 HydrophobicContact CD1-CB 4.44Å; Y103-K107 HydrophobicContact CD2-CB 4.14Å; Y103-K107 HydrophobicContact CD2-CG 3.67Å; Y103-K107 HydrophobicContact CE1-CB 4.35Å; Y103-K107 HydrophobicContact CE2-CB 4.06Å; Y103-K107 HydrophobicContact CE2-CD 4.36Å; Y103-K107 HydrophobicContact CE2-CG 3.61Å; Y103-K107 HydrophobicContact CG-CB 4.33Å; Y103-K107 HydrophobicContact CG-CG 4.29Å; Y103-K107 VanDerWaalsContact O-CA 3.31Å; Y103-K107 WeakPolarHBondContact O-CA 3.31Å; Y103-K107 WeakPolarHBondContact O-CB 3.13Å; Y103-K107 PolarHBondContact O-N 3.21Å |
| 104 | K | 80.4 | Confident | 76.3 | Confident | 143 Ų | 143 | 105.2 Ų | 105.2 | 62% | 0.622 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -61.8 | -46 | 175.2 | -177.6 | 172.4 | 178.5 | 168.6 | 0 | 111 | L100 V101 V102 Y108 | L100-K104 WeakPolarHBondContact O-CB 3.18Å; L100-K104 PolarHBondContact O-N 2.63Å; V101-K104 CarbonylContact O-C 3.55Å; V101-K104 PolarHBondContact O-N 2.79Å; V102-K104 VanDerWaalsContact C-N 3.32Å; V102-K104 PolarHBondContact O-N 3.44Å; K104-Y108 HydrophobicContact CB-CD2 4.47Å; K104-Y108 HydrophobicContact CG-CD2 4.12Å; K104-Y108 HydrophobicContact CG-CE2 4.48Å; K104-Y108 WeakPolarHBondContact O-CB 3.06Å; K104-Y108 WeakPolarHBondContact O-CD2 3.35Å; K104-Y108 PolarHBondContact O-N 3.24Å; K104-Y108 VanDerWaalsContact O-N 3.11Å |
| 105 | V | 76.4 | Confident | 74.6 | Confident | 81 Ų | 81 | 102.2 Ų | 102.2 | 49% | 0.491 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -71.3 | -66.4 | 177.9 | 177.5 | 0 | 0 | 0 | 0 | 109.5 | V101 V102 Y103 K107 Y108 D109 | V101-V105 WeakPolarHBondContact O-CG2 3.37Å; V101-V105 PolarHBondContact O-N 3.31Å; V102-V105 CarbonylContact O-C 3.6Å; V102-V105 PolarHBondContact O-N 2.81Å; Y103-V105 PolarHBondContact O-N 3.49Å; V105-K107 PolarHBondContact O-N 3.48Å; V105-Y108 PolarHBondContact O-N 3.19Å; V105-D109 WeakPolarHBondContact O-CA 3.34Å; V105-D109 WeakPolarHBondContact O-CB 2.88Å; V105-D109 PolarHBondContact O-N 2.76Å |
| 106 | Y | 69.3 | Low | 72.9 | Confident | 140 Ų | 140 | 101.7 Ų | 101.7 | 55% | 0.549 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -55.3 | -42.8 | -178 | -164.2 | -92.7 | 0 | 0 | 0 | 114.6 | V102 H110 | V102-Y106 WeakPolarHBondContact O-CA 3.43Å; V102-Y106 WeakPolarHBondContact O-CB 3.36Å; V102-Y106 PolarHBondContact O-N 2.95Å; Y106-H110 AromaticContact CD1-CD2 3.91Å; Y106-H110 AromaticContact CD2-CD2 3.18Å; Y106-H110 WeakPolarHBondContact CD2-CD2 3.12Å; Y106-H110 AromaticContact CD2-NE2 3.23Å; Y106-H110 WeakPolarHBondContact CD2-NE2 2.97Å; Y106-H110 AromaticContact CE2-CD2 3.36Å; Y106-H110 WeakPolarHBondContact CE2-CD2 3.35Å; Y106-H110 AromaticContact CE2-NE2 3.43Å; Y106-H110 WeakPolarHBondContact CE2-NE2 3.11Å; Y106-H110 AromaticContact CG-CD2 3.47Å; Y106-H110 VanDerWaalsContact CG-CD2 3.47Å; Y106-H110 AromaticContact CG-NE2 3.95Å; Y106-H110 AromaticContact CZ-CD2 3.79Å; Y106-H110 WeakPolarHBondContact O-CB 3.33Å; Y106-H110 PolarHBondContact O-CD2 3.43Å; Y106-H110 VanDerWaalsContact O-CG 3.23Å; Y106-H110 PolarHBondContact O-N 2.79Å |
| 107 | K | 61.8 | Low | 71.5 | Confident | 117 Ų | 117 | 102.7 Ų | 102.7 | 51% | 0.509 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -91.1 | -24.8 | -178 | -70.7 | -84.2 | -166.9 | 167.4 | 0 | 114.6 | Y103 V105 T111 | Y103-K107 HydrophobicContact CD1-CB 4.44Å; Y103-K107 HydrophobicContact CD2-CB 4.14Å; Y103-K107 HydrophobicContact CD2-CG 3.67Å; Y103-K107 HydrophobicContact CE1-CB 4.35Å; Y103-K107 HydrophobicContact CE2-CB 4.06Å; Y103-K107 HydrophobicContact CE2-CD 4.36Å; Y103-K107 HydrophobicContact CE2-CG 3.61Å; Y103-K107 HydrophobicContact CG-CB 4.33Å; Y103-K107 HydrophobicContact CG-CG 4.29Å; Y103-K107 VanDerWaalsContact O-CA 3.31Å; Y103-K107 WeakPolarHBondContact O-CA 3.31Å; Y103-K107 WeakPolarHBondContact O-CB 3.13Å; Y103-K107 PolarHBondContact O-N 3.21Å; V105-K107 PolarHBondContact O-N 3.48Å; K107-T111 PolarHBondContact O-OG1 3.11Å; K107-T111 VanDerWaalsContact O-OG1 3.13Å |
| 108 | Y | 58.4 | Low | 70.1 | Confident | 149 Ų | 149 | 103.3 Ų | 103.3 | 58% | 0.584 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -83 | -35.3 | 169.8 | -73.3 | -111.3 | 0 | 0 | 0 | 111.9 | K104 V105 T111 | K104-Y108 HydrophobicContact CB-CD2 4.47Å; K104-Y108 HydrophobicContact CG-CD2 4.12Å; K104-Y108 HydrophobicContact CG-CE2 4.48Å; K104-Y108 WeakPolarHBondContact O-CB 3.06Å; K104-Y108 WeakPolarHBondContact O-CD2 3.35Å; K104-Y108 PolarHBondContact O-N 3.24Å; K104-Y108 VanDerWaalsContact O-N 3.11Å; V105-Y108 PolarHBondContact O-N 3.19Å; Y108-T111 PolarHBondContact O-OG1 3.17Å |
| 109 | D | 59.1 | Low | 68.6 | Low | 111 Ų | 111 | 103 Ų | 103 | 59% | 0.594 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -85.2 | -25.9 | -173.4 | -137.5 | 8 | 0 | 0 | 0 | 111.7 | V105 | V105-D109 WeakPolarHBondContact O-CA 3.34Å; V105-D109 WeakPolarHBondContact O-CB 2.88Å; V105-D109 PolarHBondContact O-N 2.76Å |
| 110 | H | 56.3 | Low | 67.3 | Low | 125 Ų | 125 | 103.3 Ų | 103.3 | 58% | 0.579 | 52% | 0.52 | S | S | * | . | S | Bend | trans | -95.4 | 1.9 | 175.9 | -56.9 | -48.1 | 0 | 0 | 0 | 115.8 | Y106 C112 | Y106-H110 AromaticContact CD1-CD2 3.91Å; Y106-H110 AromaticContact CD2-CD2 3.18Å; Y106-H110 WeakPolarHBondContact CD2-CD2 3.12Å; Y106-H110 AromaticContact CD2-NE2 3.23Å; Y106-H110 WeakPolarHBondContact CD2-NE2 2.97Å; Y106-H110 AromaticContact CE2-CD2 3.36Å; Y106-H110 WeakPolarHBondContact CE2-CD2 3.35Å; Y106-H110 AromaticContact CE2-NE2 3.43Å; Y106-H110 WeakPolarHBondContact CE2-NE2 3.11Å; Y106-H110 AromaticContact CG-CD2 3.47Å; Y106-H110 VanDerWaalsContact CG-CD2 3.47Å; Y106-H110 AromaticContact CG-NE2 3.95Å; Y106-H110 AromaticContact CZ-CD2 3.79Å; Y106-H110 WeakPolarHBondContact O-CB 3.33Å; Y106-H110 PolarHBondContact O-CD2 3.43Å; Y106-H110 VanDerWaalsContact O-CG 3.23Å; Y106-H110 PolarHBondContact O-N 2.79Å; H110-C112 VanDerWaalsContact C-N 3.28Å |
| 111 | T | 56.4 | Low | 66 | Low | 77 Ų | 77 | 105 Ų | 105 | 47% | 0.472 | 53% | 0.529 | S | S | . | . | S | Bend | trans | -72.4 | -25.4 | 167.9 | 19.4 | 0 | 0 | 0 | 0 | 112.3 | K107 Y108 C123 | K107-T111 PolarHBondContact O-OG1 3.11Å; K107-T111 VanDerWaalsContact O-OG1 3.13Å; Y108-T111 PolarHBondContact O-OG1 3.17Å; T111-C123 PolarHBondContact O-SG 3.01Å |
| 112 | C | 55.1 | Low | 64.8 | Low | 14 Ų | 14 | 107.9 Ų | 107.9 | 10% | 0.095 | 54% | 0.538 | C | S | . | . | S | Bend | trans | -128.7 | 119.8 | -176 | -57.7 | 0 | 0 | 0 | 0 | 110.1 | H110 F116 C123 | H110-C112 VanDerWaalsContact C-N 3.28Å; C112-F116 HydrophobicContact CB-CB 3.79Å; C112-C123 WeakPolarHBondContact CA-SG 3.36Å; C112-C123 HydrophobicContact CB-CB 3.76Å; C112-C123 WeakPolarHBondContact CB-SG 3.23Å; C112-C123 VanDerWaalsContact SG-CA 3.54Å; C112-C123 WeakPolarHBondContact SG-CB 3.49Å; C112-C123 CovalentContact SG-SG 2.03Å; C112-C123 PolarHBondContact SG-SG 3.13Å |
| 113 | P | 57.3 | Low | 63.9 | Low | 88 Ų | 88 | 106.3 Ų | 106.3 | 57% | 0.571 | 53% | 0.529 | S | S | * | . | trans | -61.7 | 156.4 | 175 | 23.4 | -29.9 | 0 | 0 | 0 | 111.4 | G115 F116 | P113-G115 PolarHBondContact O-N 2.92Å; P113-F116 HydrophobicContact CG-CD2 3.86Å; P113-F116 HydrophobicContact CG-CE2 4.04Å; P113-F116 WeakPolarHBondContact O-CD2 3.1Å; P113-F116 PolarHBondContact O-N 3.39Å; P113-F116 VanDerWaalsContact O-N 3.11Å | ||
| 114 | E | 56.2 | Low | 63 | Low | 203 Ų | 203 | 102.9 Ų | 102.9 | 95% | 0.949 | 52% | 0.519 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -39.2 | 120.1 | 176.8 | -85.5 | -102.2 | 164.5 | 0 | 0 | 111.8 | ||
| 115 | G | 60.8 | Low | 62.3 | Low | 48 Ų | 48 | 98.4 Ų | 98.4 | 50% | 0.495 | 50% | 0.504 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 98.8 | 8.2 | -178.1 | 0 | 0 | 0 | 0 | 0 | 115.9 | P113 P125 A126 | P113-G115 PolarHBondContact O-N 2.92Å; G115-P125 CarbonylContact O-C 3.59Å; G115-P125 WeakPolarHBondContact O-CA 3.34Å; G115-A126 VanDerWaalsContact O-CB 3.23Å; G115-A126 WeakPolarHBondContact O-CB 3.18Å; G115-A126 PolarHBondContact O-N 3.19Å |
| 116 | F | 59.5 | Low | 61.7 | Low | 82 Ų | 82 | 96.8 Ų | 96.8 | 36% | 0.36 | 50% | 0.5 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.3 | 131.2 | 175.3 | -69.3 | -108.7 | 0 | 0 | 0 | 111.6 | C112 P113 C123 I124 P125 | C112-F116 HydrophobicContact CB-CB 3.79Å; P113-F116 HydrophobicContact CG-CD2 3.86Å; P113-F116 HydrophobicContact CG-CE2 4.04Å; P113-F116 WeakPolarHBondContact O-CD2 3.1Å; P113-F116 PolarHBondContact O-N 3.39Å; P113-F116 VanDerWaalsContact O-N 3.11Å; F116-C123 HydrophobicContact CB-CB 4.18Å; F116-C123 HydrophobicContact CD1-CB 4.31Å; F116-I124 CarbonylContact C-O 3.4Å; F116-I124 WeakPolarHBondContact CA-O 3.01Å; F116-I124 VanDerWaalsContact CD1-C 3.41Å; F116-P125 VanDerWaalsContact CD1-CA 3.43Å; F116-P125 HydrophobicContact CD1-CB 3.81Å; F116-P125 HydrophobicContact CD1-CG 4.28Å; F116-P125 HydrophobicContact CE1-CB 3.54Å; F116-P125 HydrophobicContact CE1-CG 3.85Å; F116-P125 HydrophobicContact CE2-CB 4.46Å; F116-P125 HydrophobicContact CG-CB 4.36Å; F116-P125 HydrophobicContact CZ-CB 3.9Å; F116-P125 HydrophobicContact CZ-CG 4.5Å |
| 117 | V | 66.1 | Low | 61.3 | Low | 86 Ų | 86 | 93.2 Ų | 93.2 | 52% | 0.521 | 51% | 0.505 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.2 | 134.1 | 176.7 | -176.7 | 0 | 0 | 0 | 0 | 109.1 | K119 I124 A126 | V117-K119 PolarHBondContact O-N 2.73Å; V117-I124 PolarHBondContact N-O 2.77Å; V117-I124 PolarHBondContact O-N 2.98Å; V117-A126 HydrophobicContact CG2-CB 3.9Å |
| 118 | F | 65.4 | Low | 61.1 | Low | 95 Ų | 95 | 91.6 Ų | 91.6 | 42% | 0.417 | 50% | 0.502 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.4 | 106.6 | 177.3 | -173 | -101.4 | 0 | 0 | 0 | 110.6 | N121 | F118-N121 HydrophobicContact CZ-CB 4.48Å |
| 119 | K | 63.1 | Low | 60.9 | Low | 85 Ų | 85 | 87.7 Ų | 87.7 | 37% | 0.37 | 49% | 0.488 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.4 | 131.6 | -179.8 | -170.3 | 175.4 | 176 | -170.3 | 0 | 108.6 | V117 N121 Q122 I124 E129 | V117-K119 PolarHBondContact O-N 2.73Å; K119-N121 PolarHBondContact O-N 3.19Å; K119-Q122 PolarHBondContact N-O 3.31Å; K119-Q122 VanDerWaalsContact N-O 3.16Å; K119-Q122 PolarHBondContact O-N 3.11Å; K119-I124 HydrophobicContact CB-CD1 4Å; K119-I124 HydrophobicContact CD-CD1 4.41Å; K119-I124 HydrophobicContact CG-CD1 4.49Å; K119-E129 IonicContact NZ-OE1 2.8Å; K119-E129 PolarHBondContact NZ-OE1 2.03Å; K119-E129 IonicContact NZ-OE2 2.78Å; K119-E129 PolarHBondContact NZ-OE2 3.19Å |
| 120 | N | 64.7 | Low | 60.8 | Low | 141 Ų | 141 | 89.4 Ų | 89.4 | 75% | 0.754 | 50% | 0.498 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.2 | 42.4 | 179.4 | -65.3 | 76.5 | 0 | 0 | 0 | 115.2 | Q122 | N120-Q122 PolarHBondContact O-N 2.99Å; N120-Q122 VanDerWaalsContact O-N 3.12Å |
| 121 | N | 62.2 | Low | 60.3 | Low | 140 Ų | 140 | 93.4 Ų | 93.4 | 75% | 0.749 | 51% | 0.509 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 60.1 | 15.9 | -179.3 | -67.8 | 44.8 | 0 | 0 | 0 | 114.9 | F118 K119 | F118-N121 HydrophobicContact CZ-CB 4.48Å; K119-N121 PolarHBondContact O-N 3.19Å |
| 122 | Q | 65.5 | Low | 59.9 | Low | 145 Ų | 145 | 97.2 Ų | 97.2 | 68% | 0.678 | 52% | 0.516 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -130.1 | 152 | 174.6 | -67.4 | -178.8 | 11.2 | 0 | 0 | 109.9 | K119 N120 | K119-Q122 PolarHBondContact N-O 3.31Å; K119-Q122 VanDerWaalsContact N-O 3.16Å; K119-Q122 PolarHBondContact O-N 3.11Å; N120-Q122 PolarHBondContact O-N 2.99Å; N120-Q122 VanDerWaalsContact O-N 3.12Å |
| 123 | C | 67.5 | Low | 59.5 | Low | 45 Ų | 45 | 100.4 Ų | 100.4 | 30% | 0.304 | 54% | 0.538 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.6 | 119.1 | 176.4 | -64.2 | 0 | 0 | 0 | 0 | 109.8 | T111 C112 F116 | T111-C123 PolarHBondContact O-SG 3.01Å; C112-C123 WeakPolarHBondContact CA-SG 3.36Å; C112-C123 HydrophobicContact CB-CB 3.76Å; C112-C123 WeakPolarHBondContact CB-SG 3.23Å; C112-C123 VanDerWaalsContact SG-CA 3.54Å; C112-C123 WeakPolarHBondContact SG-CB 3.49Å; C112-C123 CovalentContact SG-SG 2.03Å; C112-C123 PolarHBondContact SG-SG 3.13Å; F116-C123 HydrophobicContact CB-CB 4.18Å; F116-C123 HydrophobicContact CD1-CB 4.31Å |
| 124 | I | 62.2 | Low | 59 | Low | 46 Ų | 46 | 105 Ų | 105 | 24% | 0.236 | 55% | 0.552 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -112.3 | 131.9 | -179.1 | -55 | -179.6 | 0 | 0 | 0 | 108.4 | F116 V117 K119 A126 E129 | F116-I124 CarbonylContact C-O 3.4Å; F116-I124 WeakPolarHBondContact CA-O 3.01Å; F116-I124 VanDerWaalsContact CD1-C 3.41Å; V117-I124 PolarHBondContact N-O 2.77Å; V117-I124 PolarHBondContact O-N 2.98Å; K119-I124 HydrophobicContact CB-CD1 4Å; K119-I124 HydrophobicContact CD-CD1 4.41Å; K119-I124 HydrophobicContact CG-CD1 4.49Å; I124-A126 PolarHBondContact O-N 3.16Å; I124-E129 HydrophobicContact CG2-CG 4.42Å |
| 125 | P | 65.3 | Low | 58.6 | Low | 49 Ų | 49 | 100 Ų | 100 | 32% | 0.318 | 53% | 0.529 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -64.7 | 127.2 | 179.7 | 23.4 | -29.3 | 0 | 0 | 0 | 110.3 | G115 F116 G127 L128 | G115-P125 CarbonylContact O-C 3.59Å; G115-P125 WeakPolarHBondContact O-CA 3.34Å; F116-P125 VanDerWaalsContact CD1-CA 3.43Å; F116-P125 HydrophobicContact CD1-CB 3.81Å; F116-P125 HydrophobicContact CD1-CG 4.28Å; F116-P125 HydrophobicContact CE1-CB 3.54Å; F116-P125 HydrophobicContact CE1-CG 3.85Å; F116-P125 HydrophobicContact CE2-CB 4.46Å; F116-P125 HydrophobicContact CG-CB 4.36Å; F116-P125 HydrophobicContact CZ-CB 3.9Å; F116-P125 HydrophobicContact CZ-CG 4.5Å; P125-G127 PolarHBondContact O-N 3.32Å; P125-L128 HydrophobicContact CG-CB 4.19Å; P125-L128 PolarHBondContact O-N 3.06Å |
| 126 | A | 63.2 | Low | 57.5 | Low | 47 Ų | 47 | 103.9 Ų | 103.9 | 39% | 0.388 | 54% | 0.538 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.4 | -19 | -177.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | G115 V117 I124 | G115-A126 VanDerWaalsContact O-CB 3.23Å; G115-A126 WeakPolarHBondContact O-CB 3.18Å; G115-A126 PolarHBondContact O-N 3.19Å; V117-A126 HydrophobicContact CG2-CB 3.9Å; I124-A126 PolarHBondContact O-N 3.16Å |
| 127 | G | 60.4 | Low | 57 | Low | 64 Ų | 64 | 105.7 Ų | 105.7 | 66% | 0.66 | 56% | 0.561 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.5 | -12.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 115.7 | P125 | P125-G127 PolarHBondContact O-N 3.32Š|
| 128 | L | 58.3 | Low | 56.1 | Low | 84 Ų | 84 | 106.8 Ų | 106.8 | 44% | 0.44 | 57% | 0.573 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -95.1 | -27.6 | -173.8 | -167.1 | 68.9 | 0 | 0 | 0 | 113.8 | P125 N130 Y131 Y132 | P125-L128 HydrophobicContact CG-CB 4.19Å; P125-L128 PolarHBondContact O-N 3.06Å; L128-N130 VanDerWaalsContact C-N 3.28Å; L128-N130 PolarHBondContact O-N 3.34Å; L128-Y131 PolarHBondContact O-N 3.12Å; L128-Y132 HydrophobicContact CD1-CD2 3.86Å; L128-Y132 HydrophobicContact CD1-CE2 4.36Å; L128-Y132 HydrophobicContact CG-CD2 4.33Å; L128-Y132 PolarHBondContact O-N 3.06Å |
| 129 | E | 55.5 | Low | 55.4 | Low | 66 Ų | 66 | 103.7 Ų | 103.7 | 31% | 0.308 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -66 | -29.7 | -176.8 | -73.1 | -107.5 | 139.1 | 0 | 0 | 112.3 | K119 I124 S133 | K119-E129 IonicContact NZ-OE1 2.8Å; K119-E129 PolarHBondContact NZ-OE1 2.03Å; K119-E129 IonicContact NZ-OE2 2.78Å; K119-E129 PolarHBondContact NZ-OE2 3.19Å; I124-E129 HydrophobicContact CG2-CG 4.42Å; E129-S133 WeakPolarHBondContact O-CB 3.17Å; E129-S133 PolarHBondContact O-N 3.32Å; E129-S133 PolarHBondContact O-OG 2.68Å |
| 130 | N | 55.1 | Low | 54.8 | Low | 147 Ų | 147 | 108.9 Ų | 108.9 | 79% | 0.786 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -77.4 | -19.8 | 178.2 | -70.3 | -12.6 | 0 | 0 | 0 | 113.9 | L128 | L128-N130 VanDerWaalsContact C-N 3.28Å; L128-N130 PolarHBondContact O-N 3.34Å |
| 131 | Y | 46.9 | Very low | 54.1 | Low | 209 Ų | 209 | 105.5 Ų | 105.5 | 82% | 0.82 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -97.1 | -20.9 | 179.8 | -106.7 | -84.9 | 0 | 0 | 0 | 113.8 | L128 | L128-Y131 PolarHBondContact O-N 3.12Å |
| 132 | Y | 46.9 | Very low | 53.8 | Low | 157 Ų | 157 | 106.8 Ų | 106.8 | 62% | 0.616 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -112.9 | -15.8 | -175.1 | -102.3 | -85.3 | 0 | 0 | 0 | 115 | L128 E134 Q135 | L128-Y132 HydrophobicContact CD1-CD2 3.86Å; L128-Y132 HydrophobicContact CD1-CE2 4.36Å; L128-Y132 HydrophobicContact CG-CD2 4.33Å; L128-Y132 PolarHBondContact O-N 3.06Å; Y132-E134 VanDerWaalsContact C-N 3.31Å; Y132-E134 PolarHBondContact O-N 2.78Å; Y132-Q135 PolarHBondContact O-N 2.6Å |
| 133 | S | 47.9 | Very low | 53.3 | Low | 81 Ų | 81 | 105.9 Ų | 105.9 | 57% | 0.566 | 57% | 0.573 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.1 | -11.2 | -176.6 | -53 | 0 | 0 | 0 | 0 | 114.4 | E129 Q135 | E129-S133 WeakPolarHBondContact O-CB 3.17Å; E129-S133 PolarHBondContact O-N 3.32Å; E129-S133 PolarHBondContact O-OG 2.68Å; S133-Q135 VanDerWaalsContact C-N 3.34Å |
| 134 | E | 46.3 | Very low | 52.5 | Low | 185 Ų | 185 | 111.3 Ų | 111.3 | 86% | 0.864 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.8 | -1.1 | 173.1 | -73.2 | -143 | 129.1 | 0 | 0 | 113.6 | Y132 D136 | Y132-E134 VanDerWaalsContact C-N 3.31Å; Y132-E134 PolarHBondContact O-N 2.78Å; E134-D136 VanDerWaalsContact C-N 3.28Å; E134-D136 PolarHBondContact O-N 3.23Å |
| 135 | Q | 47.3 | Very low | 52.3 | Low | 98 Ų | 98 | 114.1 Ų | 114.1 | 46% | 0.458 | 61% | 0.608 | S | S | . | * | trans | -90.8 | 73.9 | 178.6 | -154 | 167 | 16.7 | 0 | 0 | 110.9 | Y132 S133 A139 | Y132-Q135 PolarHBondContact O-N 2.6Å; S133-Q135 VanDerWaalsContact C-N 3.34Å; Q135-A139 HydrophobicContact CG-CB 3.83Å | ||
| 136 | D | 38.5 | Very low | 51.8 | Low | 129 Ų | 129 | 117 Ų | 117 | 69% | 0.69 | 62% | 0.624 | S | S | * | * | trans | -35.7 | 138.2 | 164.5 | -95.4 | -44.4 | 0 | 0 | 0 | 112 | E134 S138 A139 | E134-D136 VanDerWaalsContact C-N 3.28Å; E134-D136 PolarHBondContact O-N 3.23Å; D136-S138 PolarHBondContact O-N 3.23Å; D136-A139 PolarHBondContact O-N 3.23Å | ||
| 137 | S | 49.4 | Very low | 51.5 | Low | 120 Ų | 120 | 120.2 Ų | 120.2 | 84% | 0.839 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -49.7 | -6.8 | 177 | 58.2 | 0 | 0 | 0 | 0 | 116.1 | ||
| 138 | S | 47 | Very low | 51.2 | Low | 110 Ų | 110 | 123.2 Ų | 123.2 | 77% | 0.769 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.8 | -15 | 176.8 | -166.6 | 0 | 0 | 0 | 0 | 114.4 | D136 | D136-S138 PolarHBondContact O-N 3.23Š|
| 139 | A | 49.2 | Very low | 51 | Low | 30 Ų | 30 | 126.4 Ų | 126.4 | 25% | 0.248 | 65% | 0.647 | C | S | . | * | G | 310 helix | trans | -86.8 | -12 | -178.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | Q135 D136 G141 K142 F143 | Q135-A139 HydrophobicContact CG-CB 3.83Å; D136-A139 PolarHBondContact O-N 3.23Å; A139-G141 PolarHBondContact O-N 3.38Å; A139-G141 VanDerWaalsContact O-N 3.11Å; A139-K142 PolarHBondContact O-N 3.04Å; A139-F143 HydrophobicContact CB-CE2 4.28Å; A139-F143 WeakPolarHBondContact O-CD2 3.43Å |
| 140 | R | 50.6 | Low | 50.9 | Low | 193 Ų | 193 | 131.1 Ų | 131.1 | 73% | 0.728 | 66% | 0.663 | S | S | * | * | G | 310 helix | trans | -65.2 | -16.1 | -175.7 | -160.7 | 170.3 | -167.5 | 151.4 | 3 | 113.9 | Y144 | R140-Y144 HydrophobicContact CG-CE2 4.38Å; R140-Y144 WeakPolarHBondContact O-CD2 3.38Å; R140-Y144 VanDerWaalsContact O-CE2 3.27Å; R140-Y144 WeakPolarHBondContact O-CE2 3.27Å |
| 141 | G | 50.6 | Low | 50.8 | Low | 70 Ų | 70 | 129.6 Ų | 129.6 | 72% | 0.722 | 66% | 0.655 | S | S | * | * | G | 310 helix | trans | -83.4 | -9.1 | 178.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | A139 | A139-G141 PolarHBondContact O-N 3.38Å; A139-G141 VanDerWaalsContact O-N 3.11Å |
| 142 | K | 55.9 | Low | 51.1 | Low | 168 Ų | 168 | 126.1 Ų | 126.1 | 73% | 0.73 | 65% | 0.65 | S | S | * | * | S | Bend | trans | -114.8 | -2.8 | -169.1 | -65.2 | -175 | -179.1 | 177 | 0 | 116 | A139 T145 | A139-K142 PolarHBondContact O-N 3.04Å; K142-T145 PolarHBondContact O-OG1 3.41Å |
| 143 | F | 54.8 | Low | 51.3 | Low | 125 Ų | 125 | 121.4 Ų | 121.4 | 55% | 0.548 | 64% | 0.643 | S | S | . | * | S | Bend | trans | -102 | -3.7 | -178 | -69 | -75.8 | 0 | 0 | 0 | 115.2 | A139 T145 | A139-F143 HydrophobicContact CB-CE2 4.28Å; A139-F143 WeakPolarHBondContact O-CD2 3.43Å; F143-T145 VanDerWaalsContact C-N 3.33Å |
| 144 | Y | 51.7 | Low | 51.3 | Low | 160 Ų | 160 | 124 Ų | 124 | 63% | 0.627 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.3 | -7.8 | 178 | -68.2 | -75.4 | 0 | 0 | 0 | 114.1 | R140 | R140-Y144 HydrophobicContact CG-CE2 4.38Å; R140-Y144 WeakPolarHBondContact O-CD2 3.38Å; R140-Y144 VanDerWaalsContact O-CE2 3.27Å; R140-Y144 WeakPolarHBondContact O-CE2 3.27Å |
| 145 | T | 57.5 | Low | 51.3 | Low | 105 Ų | 105 | 123.3 Ų | 123.3 | 64% | 0.644 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.2 | -18.7 | 178.6 | 24.8 | 0 | 0 | 0 | 0 | 114.2 | K142 F143 | K142-T145 PolarHBondContact O-OG1 3.41Å; F143-T145 VanDerWaalsContact C-N 3.33Å |
| 146 | V | 55.5 | Low | 51.3 | Low | 109 Ų | 109 | 124.6 Ų | 124.6 | 66% | 0.661 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.2 | -23.1 | -178.3 | 173.2 | 0 | 0 | 0 | 0 | 112.9 | N148 | V146-N148 VanDerWaalsContact C-N 3.34Å; V146-N148 PolarHBondContact O-N 3.02Å |
| 147 | I | 56.2 | Low | 51.9 | Low | 115 Ų | 115 | 123.8 Ų | 123.8 | 59% | 0.59 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -77.4 | -20.1 | 179.7 | -65.9 | 169.5 | 0 | 0 | 0 | 112.2 | ||
| 148 | N | 54.4 | Low | 51.6 | Low | 127 Ų | 127 | 124.3 Ų | 124.3 | 68% | 0.679 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -75.9 | -27.2 | -179.9 | -123.3 | -8.1 | 0 | 0 | 0 | 113.4 | V146 | V146-N148 VanDerWaalsContact C-N 3.34Å; V146-N148 PolarHBondContact O-N 3.02Å |
| 149 | H | 53.8 | Low | 51.9 | Low | 150 Ų | 150 | 130.7 Ų | 130.7 | 69% | 0.694 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -75 | -22.7 | 176.8 | -86.6 | -83.9 | 0 | 0 | 0 | 113.6 | ||
| 150 | Y | 53.3 | Low | 51.7 | Low | 165 Ų | 165 | 134 Ų | 134 | 65% | 0.647 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -79.9 | -28.1 | -179.7 | -141.2 | -91.9 | 0 | 0 | 0 | 112.9 | K154 | Y150-K154 HydrophobicContact CD1-CD 4.44Å; Y150-K154 HydrophobicContact CD1-CG 4.41Å; Y150-K154 PolarHBondContact O-N 2.76Å |
| 151 | N | 53.3 | Low | 51.5 | Low | 115 Ų | 115 | 131.4 Ų | 131.4 | 62% | 0.615 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -74.2 | -33.9 | 176.5 | -107.1 | -69.1 | 0 | 0 | 0 | 112.5 | K154 | N151-K154 PolarHBondContact O-N 3.11Å |
| 152 | L | 53.6 | Low | 51.2 | Low | 136 Ų | 136 | 132.2 Ų | 132.2 | 71% | 0.712 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -70.9 | -30.4 | 177.9 | -161.6 | 67.7 | 0 | 0 | 0 | 112.5 | ||
| 153 | A | 49.6 | Very low | 51.1 | Low | 58 Ų | 58 | 129.4 Ų | 129.4 | 48% | 0.479 | 68% | 0.676 | S | S | . | * | H | α-helix | trans | -79.1 | -24.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||
| 154 | K | 48.8 | Very low | 50.7 | Low | 137 Ų | 137 | 133.8 Ų | 133.8 | 60% | 0.596 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -77.2 | -15 | -178.7 | -87.8 | -162.5 | 175.8 | -158.4 | 0 | 115.1 | Y150 N151 T156 | Y150-K154 HydrophobicContact CD1-CD 4.44Å; Y150-K154 HydrophobicContact CD1-CG 4.41Å; Y150-K154 PolarHBondContact O-N 2.76Å; N151-K154 PolarHBondContact O-N 3.11Å; K154-T156 VanDerWaalsContact C-N 3.27Å; K154-T156 PolarHBondContact O-N 3.27Å |
| 155 | Q | 47.2 | Very low | 50.3 | Low | 170 Ų | 170 | 132.2 Ų | 132.2 | 79% | 0.794 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.3 | -13.2 | 173.4 | -99.7 | -174.2 | -16.9 | 0 | 0 | 114.1 | ||
| 156 | T | 45.9 | Very low | 50.2 | Low | 124 Ų | 124 | 132 Ų | 132 | 76% | 0.761 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -96.7 | -14.9 | 176.5 | -70.8 | 0 | 0 | 0 | 0 | 113.5 | K154 | K154-T156 VanDerWaalsContact C-N 3.27Å; K154-T156 PolarHBondContact O-N 3.27Å |
| 157 | I | 50.7 | Low | 49.9 | Very low | 113 Ų | 113 | 132.1 Ų | 132.1 | 58% | 0.579 | 69% | 0.688 | S | S | * | * | trans | -108.9 | 61.1 | -174 | -50.6 | 177.6 | 0 | 0 | 0 | 110.3 | R159 | I157-R159 VanDerWaalsContact C-N 3.31Š| ||
| 158 | T | 45.2 | Very low | 49.6 | Very low | 130 Ų | 130 | 133.1 Ų | 133.1 | 80% | 0.798 | 70% | 0.695 | S | S | * | * | trans | -92.5 | 17.5 | 169.2 | 10.3 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 159 | R | 52.9 | Low | 49.4 | Very low | 244 Ų | 244 | 130.6 Ų | 130.6 | 92% | 0.921 | 69% | 0.687 | S | S | * | * | trans | -133.4 | 86.1 | 171.4 | -86.8 | -172.2 | 171.3 | 139.3 | -2.9 | 110.9 | I157 | I157-R159 VanDerWaalsContact C-N 3.31Š| ||
| 160 | S | 44.3 | Very low | 49.3 | Very low | 101 Ų | 101 | 131.2 Ų | 131.2 | 71% | 0.706 | 69% | 0.69 | S | S | * | * | trans | -164.6 | 125.9 | 148.3 | 52.7 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 161 | V | 45.9 | Very low | 48.9 | Very low | 138 Ų | 138 | 131 Ų | 131 | 84% | 0.836 | 70% | 0.695 | S | S | * | * | trans | -67.6 | 150.4 | -168.6 | 179.2 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 162 | S | 44.9 | Very low | 48.6 | Very low | 87 Ų | 87 | 133.1 Ų | 133.1 | 61% | 0.608 | 70% | 0.699 | S | S | * | * | trans | -65.6 | 134.9 | -175.8 | -152.8 | 0 | 0 | 0 | 0 | 112.8 | W164 | S162-W164 VanDerWaalsContact C-N 3.29Å; S162-W164 PolarHBondContact O-N 3.49Å | ||
| 163 | P | 52.7 | Low | 48.1 | Very low | 109 Ų | 109 | 131.7 Ų | 131.7 | 71% | 0.708 | 69% | 0.691 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.2 | 9.2 | -172.2 | -24 | 35.3 | 0 | 0 | 0 | 119.3 | ||
| 164 | W | 47.7 | Very low | 48.1 | Very low | 217 Ų | 217 | 132.5 Ų | 132.5 | 82% | 0.822 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.7 | 3.2 | -172.9 | -70.2 | 93.3 | 0 | 0 | 0 | 115.2 | S162 | S162-W164 VanDerWaalsContact C-N 3.29Å; S162-W164 PolarHBondContact O-N 3.49Å |
| 165 | M | 43.3 | Very low | 48.1 | Very low | 127 Ų | 127 | 133 Ų | 133 | 63% | 0.626 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -91.6 | -5.6 | -179.9 | -84.7 | -58.9 | -50.3 | 0 | 0 | 115.2 | ||
| 166 | T | 54.8 | Low | 48.1 | Very low | 99 Ų | 99 | 131.9 Ų | 131.9 | 61% | 0.607 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -81.9 | -24.7 | -175.8 | 45.8 | 0 | 0 | 0 | 0 | 114 | ||
| 167 | V | 50.3 | Low | 48.4 | Very low | 112 Ų | 112 | 133 Ų | 133 | 68% | 0.679 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.8 | -18.7 | -171.5 | -170.5 | 0 | 0 | 0 | 0 | 113.5 | ||
| 168 | L | 49.2 | Very low | 48.3 | Very low | 137 Ų | 137 | 133.4 Ų | 133.4 | 72% | 0.717 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.2 | -7.6 | 177.3 | -90.6 | 152.7 | 0 | 0 | 0 | 114 | ||
| 169 | S | 50.8 | Low | 48.7 | Very low | 74 Ų | 74 | 135.2 Ų | 135.2 | 52% | 0.517 | 70% | 0.697 | S | S | . | * | H | α-helix | trans | -92.8 | -16.5 | -179.6 | -59.8 | 0 | 0 | 0 | 0 | 113.5 | ||
| 170 | E | 50.2 | Low | 48.6 | Very low | 162 Ų | 162 | 127.1 Ų | 127.1 | 76% | 0.757 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -78.7 | -28 | -179.7 | -114.2 | 165.7 | 94.9 | 0 | 0 | 113.1 | ||
| 171 | E | 46.7 | Very low | 49 | Very low | 161 Ų | 161 | 126.1 Ų | 126.1 | 75% | 0.752 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -76.8 | -35.5 | 177.7 | -156.3 | 174.2 | 97.6 | 0 | 0 | 111.8 | S174 | E171-S174 PolarHBondContact O-OG 3.43Å |
| 172 | K | 47.1 | Very low | 49.4 | Very low | 160 Ų | 160 | 128.3 Ų | 128.3 | 70% | 0.696 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -78.7 | -14.3 | -178.3 | -91.6 | -83 | -177.2 | -175 | 0 | 115.3 | ||
| 173 | L | 42.5 | Very low | 49.7 | Very low | 105 Ų | 105 | 133.9 Ų | 133.9 | 55% | 0.55 | 69% | 0.694 | S | S | . | * | H | α-helix | trans | -85.6 | -27.1 | 175.7 | -163.6 | 101.9 | 0 | 0 | 0 | 112.1 | E175 Q176 E177 | L173-E175 PolarHBondContact O-N 3.47Å; L173-Q176 PolarHBondContact O-N 3.43Å; L173-E177 PolarHBondContact O-N 3.36Å |
| 174 | S | 49.4 | Very low | 49.7 | Very low | 76 Ų | 76 | 133.9 Ų | 133.9 | 53% | 0.531 | 70% | 0.696 | S | S | . | * | H | α-helix | trans | -70.1 | -28 | -177 | 71.1 | 0 | 0 | 0 | 0 | 114 | E171 | E171-S174 PolarHBondContact O-OG 3.43Å |
| 175 | E | 49 | Very low | 49.4 | Very low | 146 Ų | 146 | 131.5 Ų | 131.5 | 68% | 0.682 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.8 | -16 | 173.3 | -82.7 | -179.4 | 102.5 | 0 | 0 | 113.5 | L173 | L173-E175 PolarHBondContact O-N 3.47Š|
| 176 | Q | 47.6 | Very low | 49.7 | Very low | 148 Ų | 148 | 131.8 Ų | 131.8 | 69% | 0.692 | 73% | 0.728 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100 | -7.2 | -179.3 | -169.4 | 166.8 | 48.2 | 0 | 0 | 114 | L173 | L173-Q176 PolarHBondContact O-N 3.43Š|
| 177 | E | 51.2 | Low | 49.5 | Very low | 146 Ų | 146 | 133.5 Ų | 133.5 | 68% | 0.682 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -88.8 | -13.1 | 173.5 | -87.1 | -162.7 | 120.3 | 0 | 0 | 114.2 | L173 | L173-E177 PolarHBondContact O-N 3.36Š|
| 178 | T | 49.9 | Very low | 49.4 | Very low | 122 Ų | 122 | 134.7 Ų | 134.7 | 75% | 0.748 | 74% | 0.737 | S | S | * | * | S | Bend | trans | -88.6 | -9.7 | 176.5 | 43.6 | 0 | 0 | 0 | 0 | 114.5 | ||
| 179 | E | 51.7 | Low | 49.4 | Very low | 169 Ų | 169 | 134.5 Ų | 134.5 | 79% | 0.79 | 74% | 0.739 | S | S | * | * | S | Bend | trans | -101.5 | -15.1 | 179.4 | -153 | 178.6 | 158.2 | 0 | 0 | 113.7 | ||
| 180 | A | 51.9 | Low | 49.4 | Very low | 73 Ų | 73 | 138.3 Ų | 138.3 | 60% | 0.603 | 75% | 0.753 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.7 | 0.6 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||
| 181 | A | 53.4 | Low | 49.3 | Very low | 80 Ų | 80 | 136.7 Ų | 136.7 | 66% | 0.661 | 75% | 0.752 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.7 | -5 | 176 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 182 | E | 53.4 | Low | 49.5 | Very low | 185 Ų | 185 | 135 Ų | 135 | 86% | 0.864 | 75% | 0.752 | S | S | * | * | S | Bend | trans | -104.1 | 21.1 | -179.2 | -154.3 | -177.1 | 118.9 | 0 | 0 | 113.7 | ||
| 183 | K | 51.8 | Low | 49.7 | Very low | 204 Ų | 204 | 133.1 Ų | 133.1 | 89% | 0.887 | 76% | 0.757 | S | S | * | * | S | Bend | trans | -132.7 | 15.4 | 178.4 | -116.9 | 179.3 | -175 | 177.7 | 0 | 115.8 | ||
| 184 | S | 51.7 | Low | 50.3 | Low | 108 Ų | 108 | 135.4 Ų | 135.4 | 76% | 0.755 | 77% | 0.774 | S | S | * | * | trans | -135.9 | 29.7 | 177.3 | 45.2 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 185 | A | 42.4 | Very low | 50.4 | Low | 168 Ų | 168 | 140.8 Ų | 140.8 | 100% | 1.388 | 80% | 0.796 | S | S | * | * | trans | -107.3 | 0 | 161 | 0 | 0 | 0 | 0 | 0 | 110.2 |
Retrieved 185 of 185 residues in 280.6 ms
(Link to these results)