| 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 | 39.8 | Very low | 67.3 | Low | 227 Ų | 227 | 146.1 Ų | 146.1 | 100% | 1.118 | 84% | 0.837 | S | S | * | * | 0 | 98.2 | 0 | -83.1 | 164.6 | 156.6 | 0 | 0 | 108 | K3 | M1-K3 PolarHBondContact O-N 3.21Š| |||
| 2 | N | 48.2 | Very low | 69 | Low | 163 Ų | 163 | 143.4 Ų | 143.4 | 87% | 0.872 | 83% | 0.825 | S | S | * | * | trans | -90.7 | 92 | -167.7 | -40.9 | -13.5 | 0 | 0 | 0 | 105.9 | G4 | N2-G4 PolarHBondContact O-N 3.12Å; N2-G4 VanDerWaalsContact O-N 3.09Å | ||
| 3 | K | 57.3 | Low | 70.4 | Confident | 199 Ų | 199 | 142.9 Ų | 142.9 | 87% | 0.865 | 81% | 0.807 | S | S | * | * | trans | -62 | 114.4 | 175.7 | -70.9 | 178.7 | 179.1 | 174.1 | 0 | 107.5 | M1 K5 | M1-K3 PolarHBondContact O-N 3.21Å; K3-K5 PolarHBondContact O-N 3.09Å; K3-K5 VanDerWaalsContact O-N 3.15Å | ||
| 4 | G | 57.5 | Low | 71.8 | Confident | 75 Ų | 75 | 140 Ų | 140 | 77% | 0.773 | 80% | 0.797 | S | S | * | * | trans | -53.2 | 118.8 | 179.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | N2 A6 | N2-G4 PolarHBondContact O-N 3.12Å; N2-G4 VanDerWaalsContact O-N 3.09Å; G4-A6 PolarHBondContact O-N 3.15Å; G4-A6 VanDerWaalsContact O-N 3.12Å | ||
| 5 | K | 67.7 | Low | 73 | Confident | 206 Ų | 206 | 136.5 Ų | 136.5 | 90% | 0.896 | 79% | 0.792 | S | S | * | * | trans | -64.5 | 109.8 | 177 | -3.6 | -177.3 | -177.4 | -169.4 | 0 | 106.3 | K3 S7 | K3-K5 PolarHBondContact O-N 3.09Å; K3-K5 VanDerWaalsContact O-N 3.15Å; K5-S7 PolarHBondContact O-N 3.02Å | ||
| 6 | A | 68.3 | Low | 74 | Confident | 94 Ų | 94 | 132.1 Ų | 132.1 | 78% | 0.777 | 76% | 0.762 | S | S | * | * | trans | -55.9 | 126.9 | 171.3 | 0 | 0 | 0 | 0 | 0 | 107.5 | G4 G8 | G4-A6 PolarHBondContact O-N 3.15Å; G4-A6 VanDerWaalsContact O-N 3.12Å; A6-G8 PolarHBondContact O-N 3.24Å | ||
| 7 | S | 68.6 | Low | 75.1 | Confident | 101 Ų | 101 | 128.8 Ų | 128.8 | 71% | 0.706 | 75% | 0.746 | S | S | * | * | trans | -53.3 | 114.5 | 175.3 | 50.1 | 0 | 0 | 0 | 0 | 108 | K5 V9 | K5-S7 PolarHBondContact O-N 3.02Å; S7-V9 PolarHBondContact O-N 2.75Å | ||
| 8 | G | 81.4 | Confident | 76 | Confident | 82 Ų | 82 | 126.3 Ų | 126.3 | 85% | 0.845 | 74% | 0.737 | S | S | * | * | trans | -70.6 | 39.9 | -173.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | A6 | A6-G8 PolarHBondContact O-N 3.24Š| ||
| 9 | V | 81.6 | Confident | 76.9 | Confident | 132 Ų | 132 | 127.5 Ų | 127.5 | 80% | 0.8 | 73% | 0.733 | S | S | * | * | trans | -90.2 | 110 | 180 | -177 | 0 | 0 | 0 | 0 | 108.1 | S7 | S7-V9 PolarHBondContact O-N 2.75Š| ||
| 10 | S | 84.3 | Confident | 77.6 | Confident | 97 Ų | 97 | 125 Ų | 125 | 68% | 0.678 | 72% | 0.716 | S | S | * | * | trans | -104.5 | 137.4 | 170.5 | 58.1 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 11 | W | 86.3 | Confident | 78.3 | Confident | 231 Ų | 231 | 124.1 Ų | 124.1 | 88% | 0.875 | 70% | 0.704 | S | S | * | * | trans | -81.8 | 124 | 171.9 | 179.5 | -95.4 | 0 | 0 | 0 | 110.3 | ||||
| 12 | V | 87.1 | Confident | 80.8 | Confident | 114 Ų | 114 | 119.9 Ų | 119.9 | 69% | 0.691 | 68% | 0.679 | S | S | * | * | trans | -115.4 | 117.1 | 172 | -180 | 0 | 0 | 0 | 0 | 107.6 | P14 | V12-P14 WeakPolarHBondContact O-CD 3.22Š| ||
| 13 | K | 86.8 | Confident | 83.1 | Confident | 137 Ų | 137 | 117.6 Ų | 117.6 | 60% | 0.596 | 66% | 0.662 | S | S | * | * | trans | -76.4 | 110.8 | 174.1 | -171.4 | 175.6 | -177.9 | 179.2 | 0 | 108.1 | ||||
| 14 | P | 89.9 | Confident | 84.8 | Confident | 102 Ų | 102 | 110.8 Ų | 110.8 | 66% | 0.662 | 63% | 0.632 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 149.5 | 178.3 | 27.3 | -33.7 | 0 | 0 | 0 | 110.4 | V12 E16 | V12-P14 WeakPolarHBondContact O-CD 3.22Å; P14-E16 PolarHBondContact O-N 3.24Å |
| 15 | A | 89.6 | Confident | 86.4 | Confident | 87 Ų | 87 | 112.5 Ų | 112.5 | 72% | 0.719 | 63% | 0.628 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 136.8 | 178 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||
| 16 | E | 89.4 | Confident | 87.7 | Confident | 67 Ų | 67 | 109 Ų | 109 | 31% | 0.313 | 62% | 0.619 | S | S | . | * | P | Polyproline II helix | trans | -63.3 | 137 | 176.9 | -59.6 | -171.3 | 168.6 | 0 | 0 | 110.8 | P14 K21 K24 | P14-E16 PolarHBondContact O-N 3.24Å; E16-K21 HydrophobicContact CB-CG 4.13Å; E16-K21 WeakPolarHBondContact O-CE 3.1Å; E16-K21 PolarHBondContact O-NZ 2.66Å; E16-K24 IonicContact OE1-NZ 3.49Å; E16-K24 PolarHBondContact OE1-NZ 3.03Å; E16-K24 IonicContact OE2-NZ 4Å; E16-K24 PolarHBondContact OE2-NZ 3.29Å |
| 17 | P | 93.5 | Very high | 88.9 | Confident | 75 Ų | 75 | 108.5 Ų | 108.5 | 49% | 0.487 | 61% | 0.606 | S | S | . | * | P | Polyproline II helix | trans | -65.6 | 152.7 | 179.4 | 28.6 | -35 | 0 | 0 | 0 | 110.9 | F19 L20 K21 | P17-F19 PolarHBondContact O-N 3.49Å; P17-L20 HydrophobicContact CG-CB 4.21Å; P17-L20 HydrophobicContact CG-CD1 3.51Å; P17-L20 HydrophobicContact CG-CG 4.46Å; P17-L20 PolarHBondContact O-N 3.32Å; P17-L20 VanDerWaalsContact O-N 3.15Å; P17-K21 PolarHBondContact O-N 2.95Å |
| 18 | S | 91.4 | Very high | 90 | Very high | 85 Ų | 85 | 106.2 Ų | 106.2 | 59% | 0.594 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -58.1 | -33.1 | -174.6 | 57.3 | 0 | 0 | 0 | 0 | 113.6 | K22 | S18-K22 VanDerWaalsContact O-CG 3.3Å; S18-K22 WeakPolarHBondContact O-CG 3.33Å; S18-K22 PolarHBondContact O-N 2.84Å; S18-K22 VanDerWaalsContact O-N 3.13Å |
| 19 | F | 93.2 | Very high | 90.4 | Very high | 149 Ų | 149 | 108.9 Ų | 108.9 | 65% | 0.654 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -61.4 | -51.1 | 175 | 169.8 | -101.7 | 0 | 0 | 0 | 112.5 | P17 K21 K22 F23 | P17-F19 PolarHBondContact O-N 3.49Å; F19-K21 VanDerWaalsContact C-N 3.3Å; F19-K21 PolarHBondContact O-N 3.01Å; F19-K22 PolarHBondContact O-N 3.01Å; F19-F23 WeakPolarHBondContact O-CB 2.86Å; F19-F23 PolarHBondContact O-N 3.47Å |
| 20 | L | 90.9 | Very high | 90.7 | Very high | 77 Ų | 77 | 111.4 Ų | 111.4 | 40% | 0.403 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -64.5 | -36.1 | 179.4 | -92.4 | 102.3 | 0 | 0 | 0 | 112 | P17 F23 K24 | P17-L20 HydrophobicContact CG-CB 4.21Å; P17-L20 HydrophobicContact CG-CD1 3.51Å; P17-L20 HydrophobicContact CG-CG 4.46Å; P17-L20 PolarHBondContact O-N 3.32Å; P17-L20 VanDerWaalsContact O-N 3.15Å; L20-F23 PolarHBondContact O-N 3Å; L20-K24 WeakPolarHBondContact O-CB 3.08Å; L20-K24 VanDerWaalsContact O-CG 3.26Å; L20-K24 WeakPolarHBondContact O-CG 3.18Å; L20-K24 PolarHBondContact O-N 3.27Å |
| 21 | K | 90.8 | Very high | 90.7 | Very high | 106 Ų | 106 | 113 Ų | 113 | 46% | 0.461 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -60.9 | -48.3 | 175.8 | -73.2 | 175.5 | 174 | 165.1 | 0 | 111.9 | E16 P17 F19 K24 T25 | E16-K21 HydrophobicContact CB-CG 4.13Å; E16-K21 WeakPolarHBondContact O-CE 3.1Å; E16-K21 PolarHBondContact O-NZ 2.66Å; P17-K21 PolarHBondContact O-N 2.95Å; F19-K21 VanDerWaalsContact C-N 3.3Å; F19-K21 PolarHBondContact O-N 3.01Å; K21-K24 PolarHBondContact O-N 3.49Å; K21-T25 PolarHBondContact O-N 3.38Å; K21-T25 VanDerWaalsContact O-N 3.14Å; K21-T25 PolarHBondContact O-OG1 3.02Å |
| 22 | K | 93.7 | Very high | 90.7 | Very high | 138 Ų | 138 | 104 Ų | 104 | 60% | 0.6 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -61.5 | -49.1 | 177.5 | -68.6 | 173.8 | -177.6 | -170.7 | 0 | 111 | S18 F19 K24 T25 D26 | S18-K22 VanDerWaalsContact O-CG 3.3Å; S18-K22 WeakPolarHBondContact O-CG 3.33Å; S18-K22 PolarHBondContact O-N 2.84Å; S18-K22 VanDerWaalsContact O-N 3.13Å; F19-K22 PolarHBondContact O-N 3.01Å; K22-K24 PolarHBondContact O-N 3.45Å; K22-T25 WeakPolarHBondContact O-CB 3.21Å; K22-T25 PolarHBondContact O-N 3.03Å; K22-T25 VanDerWaalsContact O-N 3.12Å; K22-D26 PolarHBondContact O-N 3.35Å |
| 23 | F | 94.9 | Very high | 90.7 | Very high | 115 Ų | 115 | 104.5 Ų | 104.5 | 50% | 0.504 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -57.6 | -46.7 | 178.9 | -178.5 | -97.6 | 0 | 0 | 0 | 112.4 | F19 L20 T25 D26 V27 | F19-F23 WeakPolarHBondContact O-CB 2.86Å; F19-F23 PolarHBondContact O-N 3.47Å; L20-F23 PolarHBondContact O-N 3Å; F23-T25 VanDerWaalsContact C-N 3.3Å; F23-T25 PolarHBondContact O-N 3.28Å; F23-D26 PolarHBondContact O-N 2.96Å; F23-V27 HydrophobicContact CD1-CG1 4.48Å; F23-V27 HydrophobicContact CD1-CG2 4.41Å; F23-V27 HydrophobicContact CD2-CG1 4.23Å; F23-V27 HydrophobicContact CE1-CG1 4.09Å; F23-V27 HydrophobicContact CE1-CG2 4.2Å; F23-V27 HydrophobicContact CE2-CG1 3.82Å; F23-V27 HydrophobicContact CZ-CG1 3.75Å; F23-V27 WeakPolarHBondContact O-CG1 3.45Å; F23-V27 VanDerWaalsContact O-CG2 3.25Å; F23-V27 WeakPolarHBondContact O-CG2 3.39Å; F23-V27 PolarHBondContact O-N 2.87Å |
| 24 | K | 93.9 | Very high | 90.7 | Very high | 56 Ų | 56 | 101.4 Ų | 101.4 | 24% | 0.243 | 56% | 0.555 | C | S | . | * | H | α-helix | trans | -60 | -39.4 | 177.1 | -76 | 176.9 | 179.2 | -173.8 | 0 | 112.4 | E16 L20 K21 K22 G28 Y29 | E16-K24 IonicContact OE1-NZ 3.49Å; E16-K24 PolarHBondContact OE1-NZ 3.03Å; E16-K24 IonicContact OE2-NZ 4Å; E16-K24 PolarHBondContact OE2-NZ 3.29Å; L20-K24 WeakPolarHBondContact O-CB 3.08Å; L20-K24 VanDerWaalsContact O-CG 3.26Å; L20-K24 WeakPolarHBondContact O-CG 3.18Å; L20-K24 PolarHBondContact O-N 3.27Å; K21-K24 PolarHBondContact O-N 3.49Å; K22-K24 PolarHBondContact O-N 3.45Å; K24-G28 PolarHBondContact O-N 3.42Å; K24-Y29 HydrophobicContact CD-CD1 4.16Å; K24-Y29 HydrophobicContact CG-CD1 4.11Å; K24-Y29 HydrophobicContact CG-CG 4.28Å; K24-Y29 WeakPolarHBondContact O-CB 3.48Å; K24-Y29 PolarHBondContact O-N 3.48Å |
| 25 | T | 90.9 | Very high | 90.3 | Very high | 111 Ų | 111 | 100.9 Ų | 100.9 | 68% | 0.681 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -67.3 | -46 | 175.3 | -55.4 | 0 | 0 | 0 | 0 | 111.5 | K21 K22 F23 V27 G28 | K21-T25 PolarHBondContact O-N 3.38Å; K21-T25 VanDerWaalsContact O-N 3.14Å; K21-T25 PolarHBondContact O-OG1 3.02Å; K22-T25 WeakPolarHBondContact O-CB 3.21Å; K22-T25 PolarHBondContact O-N 3.03Å; K22-T25 VanDerWaalsContact O-N 3.12Å; F23-T25 VanDerWaalsContact C-N 3.3Å; F23-T25 PolarHBondContact O-N 3.28Å; T25-V27 VanDerWaalsContact C-N 3.35Å; T25-V27 PolarHBondContact O-N 3.24Å; T25-G28 PolarHBondContact O-N 3.19Å; T25-G28 VanDerWaalsContact O-N 3.13Å |
| 26 | D | 94.3 | Very high | 90 | Very high | 133 Ų | 133 | 101.5 Ų | 101.5 | 71% | 0.711 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -64.5 | -38.6 | -176.7 | -65.3 | -17.8 | 0 | 0 | 0 | 112 | K22 F23 G28 | K22-D26 PolarHBondContact O-N 3.35Å; F23-D26 PolarHBondContact O-N 2.96Å; D26-G28 VanDerWaalsContact C-N 3.31Å |
| 27 | V | 94.1 | Very high | 89.7 | Confident | 84 Ų | 84 | 101.1 Ų | 101.1 | 51% | 0.509 | 54% | 0.544 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87 | 0.9 | 177.5 | -52.8 | 0 | 0 | 0 | 0 | 113.4 | F23 T25 Y29 | F23-V27 HydrophobicContact CD1-CG1 4.48Å; F23-V27 HydrophobicContact CD1-CG2 4.41Å; F23-V27 HydrophobicContact CD2-CG1 4.23Å; F23-V27 HydrophobicContact CE1-CG1 4.09Å; F23-V27 HydrophobicContact CE1-CG2 4.2Å; F23-V27 HydrophobicContact CE2-CG1 3.82Å; F23-V27 HydrophobicContact CZ-CG1 3.75Å; F23-V27 WeakPolarHBondContact O-CG1 3.45Å; F23-V27 VanDerWaalsContact O-CG2 3.25Å; F23-V27 WeakPolarHBondContact O-CG2 3.39Å; F23-V27 PolarHBondContact O-N 2.87Å; T25-V27 VanDerWaalsContact C-N 3.35Å; T25-V27 PolarHBondContact O-N 3.24Å; V27-Y29 VanDerWaalsContact C-N 3.29Å; V27-Y29 PolarHBondContact O-N 3.15Å |
| 28 | G | 91.1 | Very high | 89.2 | Confident | 52 Ų | 52 | 106.1 Ų | 106.1 | 54% | 0.536 | 56% | 0.558 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 63.6 | 31.1 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | K24 T25 D26 K30 | K24-G28 PolarHBondContact O-N 3.42Å; T25-G28 PolarHBondContact O-N 3.19Å; T25-G28 VanDerWaalsContact O-N 3.13Å; D26-G28 VanDerWaalsContact C-N 3.31Å; G28-K30 PolarHBondContact O-N 3.18Å |
| 29 | Y | 91.3 | Very high | 89 | Confident | 138 Ų | 138 | 112.2 Ų | 112.2 | 54% | 0.541 | 57% | 0.568 | S | S | . | * | P | Polyproline II helix | trans | -61.7 | 118.2 | -178.8 | -177.9 | -95.1 | 0 | 0 | 0 | 110.8 | K24 V27 E31 | K24-Y29 HydrophobicContact CD-CD1 4.16Å; K24-Y29 HydrophobicContact CG-CD1 4.11Å; K24-Y29 HydrophobicContact CG-CG 4.28Å; K24-Y29 WeakPolarHBondContact O-CB 3.48Å; K24-Y29 PolarHBondContact O-N 3.48Å; V27-Y29 VanDerWaalsContact C-N 3.29Å; V27-Y29 PolarHBondContact O-N 3.15Å; Y29-E31 HydrophobicContact CE1-CB 4.4Å |
| 30 | K | 87.5 | Confident | 88.6 | Confident | 186 Ų | 186 | 111.5 Ų | 111.5 | 81% | 0.809 | 57% | 0.566 | S | S | * | * | P | Polyproline II helix | trans | -101.6 | 123 | 170.3 | -63.4 | -170.2 | 179 | 179.2 | 0 | 108.4 | G28 G32 | G28-K30 PolarHBondContact O-N 3.18Å; K30-G32 PolarHBondContact O-N 3.2Å |
| 31 | E | 84.6 | Confident | 88 | Confident | 130 Ų | 130 | 112.6 Ų | 112.6 | 61% | 0.607 | 59% | 0.587 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 126.5 | 175.3 | -168.4 | 167.9 | -167.2 | 0 | 0 | 108.8 | Y29 | Y29-E31 HydrophobicContact CE1-CB 4.4Š|
| 32 | G | 85.3 | Confident | 87.2 | Confident | 43 Ų | 43 | 115.6 Ų | 115.6 | 44% | 0.443 | 60% | 0.604 | S | S | . | * | trans | -68.9 | 175.5 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | K30 N34 | K30-G32 PolarHBondContact O-N 3.2Å; G32-N34 PolarHBondContact O-N 2.63Å | ||
| 33 | P | 87.9 | Confident | 86.5 | Confident | 124 Ų | 124 | 114.5 Ų | 114.5 | 81% | 0.805 | 61% | 0.612 | S | S | * | * | trans | -52.1 | 115.5 | 175.8 | -24.6 | 33.9 | 0 | 0 | 0 | 111.1 | T37 | P33-T37 HydrophobicContact CB-CG2 4.45Å; P33-T37 WeakPolarHBondContact CB-OG1 3.35Å | ||
| 34 | N | 86.3 | Confident | 85.4 | Confident | 71 Ų | 71 | 115 Ų | 115 | 38% | 0.38 | 62% | 0.624 | S | S | . | * | trans | -91.9 | 172.4 | 179.6 | -165.2 | 1.7 | 0 | 0 | 0 | 110.5 | G32 D36 T37 | G32-N34 PolarHBondContact O-N 2.63Å; N34-D36 PolarHBondContact O-N 3.45Å; N34-D36 VanDerWaalsContact O-N 3.08Å; N34-T37 PolarHBondContact N-OG1 3.07Å; N34-T37 PolarHBondContact O-N 3.19Å; N34-T37 PolarHBondContact O-OG1 3.39Å | ||
| 35 | V | 82.6 | Confident | 84.2 | Confident | 92 Ų | 92 | 117.9 Ų | 117.9 | 56% | 0.558 | 65% | 0.648 | S | S | * | * | G | 310 helix | trans | -54.2 | -29.2 | 174.9 | -67 | 0 | 0 | 0 | 0 | 113.1 | T37 K38 | V35-T37 VanDerWaalsContact C-N 3.34Å; V35-K38 WeakPolarHBondContact O-CB 3.1Å; V35-K38 PolarHBondContact O-N 3.15Å |
| 36 | D | 82.6 | Confident | 83 | Confident | 100 Ų | 100 | 119.7 Ų | 119.7 | 54% | 0.535 | 65% | 0.654 | S | S | . | * | G | 310 helix | trans | -69.5 | -29.6 | 176.4 | -64.2 | -40 | 0 | 0 | 0 | 112.8 | N34 K38 R39 Q40 | N34-D36 PolarHBondContact O-N 3.45Å; N34-D36 VanDerWaalsContact O-N 3.08Å; D36-K38 PolarHBondContact O-N 3.37Å; D36-R39 WeakPolarHBondContact O-CB 3.44Å; D36-R39 PolarHBondContact O-N 2.78Å; D36-Q40 PolarHBondContact O-N 3.08Å |
| 37 | T | 83.8 | Confident | 81.4 | Confident | 58 Ų | 58 | 120.1 Ų | 120.1 | 36% | 0.356 | 66% | 0.656 | S | S | . | * | G | 310 helix | trans | -68.1 | -20.9 | 176.5 | 69.7 | 0 | 0 | 0 | 0 | 111.8 | P33 N34 V35 R39 | P33-T37 HydrophobicContact CB-CG2 4.45Å; P33-T37 WeakPolarHBondContact CB-OG1 3.35Å; N34-T37 PolarHBondContact N-OG1 3.07Å; N34-T37 PolarHBondContact O-N 3.19Å; N34-T37 PolarHBondContact O-OG1 3.39Å; V35-T37 VanDerWaalsContact C-N 3.34Å; T37-R39 VanDerWaalsContact C-N 3.3Å |
| 38 | K | 81.6 | Confident | 79.7 | Confident | 180 Ų | 180 | 123.1 Ų | 123.1 | 78% | 0.783 | 67% | 0.67 | S | S | * | * | G | 310 helix | trans | -73.7 | -21.5 | 171.3 | -57.6 | -175.5 | 178.3 | -175.9 | 0 | 113.1 | V35 D36 | V35-K38 WeakPolarHBondContact O-CB 3.1Å; V35-K38 PolarHBondContact O-N 3.15Å; D36-K38 PolarHBondContact O-N 3.37Å |
| 39 | R | 86.9 | Confident | 78.2 | Confident | 213 Ų | 213 | 126.9 Ų | 126.9 | 80% | 0.804 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.6 | -15 | 179.3 | -61.9 | -178.6 | 178.4 | -81.5 | -0.3 | 112.2 | D36 T37 A41 | D36-R39 WeakPolarHBondContact O-CB 3.44Å; D36-R39 PolarHBondContact O-N 2.78Å; T37-R39 VanDerWaalsContact C-N 3.3Å; R39-A41 PolarHBondContact O-N 2.94Å |
| 40 | Q | 84.6 | Confident | 76.9 | Confident | 134 Ų | 134 | 123 Ų | 123 | 63% | 0.626 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -65.7 | 125.4 | 173.8 | -71.5 | -179.2 | -71 | 0 | 0 | 109.1 | D36 M42 | D36-Q40 PolarHBondContact O-N 3.08Å; Q40-M42 PolarHBondContact O-N 2.84Å; Q40-M42 VanDerWaalsContact O-N 3.12Å |
| 41 | A | 79.1 | Confident | 76 | Confident | 100 Ų | 100 | 118.5 Ų | 118.5 | 83% | 0.826 | 68% | 0.682 | S | S | * | * | trans | -63.3 | 113.7 | 169 | 0 | 0 | 0 | 0 | 0 | 107.5 | R39 | R39-A41 PolarHBondContact O-N 2.94Š| ||
| 42 | M | 74.8 | Confident | 75.9 | Confident | 169 Ų | 169 | 117.5 Ų | 117.5 | 83% | 0.833 | 68% | 0.68 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 144.5 | 173.7 | -68.1 | -159.9 | -73.1 | 0 | 0 | 108.9 | Q40 T44 | Q40-M42 PolarHBondContact O-N 2.84Å; Q40-M42 VanDerWaalsContact O-N 3.12Å; M42-T44 PolarHBondContact O-N 3.12Å |
| 43 | P | 79.1 | Confident | 75.7 | Confident | 116 Ų | 116 | 123.3 Ų | 123.3 | 75% | 0.753 | 69% | 0.689 | S | S | * | * | P | Polyproline II helix | trans | -50.7 | 140.5 | 166.1 | -20.4 | 31.2 | 0 | 0 | 0 | 108.9 | P45 | P43-P45 WeakPolarHBondContact O-CD 3.26Å; P43-P45 VanDerWaalsContact O-N 3.09Å |
| 44 | T | 71.4 | Confident | 75.4 | Confident | 124 Ų | 124 | 124.8 Ų | 124.8 | 76% | 0.761 | 69% | 0.685 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 120 | 167 | 43.4 | 0 | 0 | 0 | 0 | 106.5 | M42 D46 | M42-T44 PolarHBondContact O-N 3.12Å; T44-D46 PolarHBondContact O-N 3.49Å |
| 45 | P | 67.6 | Low | 75.4 | Confident | 117 Ų | 117 | 128.6 Ų | 128.6 | 76% | 0.76 | 71% | 0.705 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 135.9 | 172.9 | 24.4 | -31.9 | 0 | 0 | 0 | 107.1 | P43 D47 | P43-P45 WeakPolarHBondContact O-CD 3.26Å; P43-P45 VanDerWaalsContact O-N 3.09Å; P45-D47 PolarHBondContact O-N 2.69Å |
| 46 | D | 66.6 | Low | 75.6 | Confident | 150 Ų | 150 | 129.3 Ų | 129.3 | 80% | 0.802 | 70% | 0.703 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 130.5 | 171.4 | -68.6 | -51.6 | 0 | 0 | 0 | 107.1 | T44 D48 | T44-D46 PolarHBondContact O-N 3.49Å; D46-D48 PolarHBondContact O-N 3.02Å |
| 47 | D | 60.4 | Low | 75.8 | Confident | 142 Ų | 142 | 127.9 Ų | 127.9 | 76% | 0.759 | 70% | 0.695 | S | S | * | * | S | Bend | trans | -68.8 | 32.2 | -176 | -168.4 | 29.8 | 0 | 0 | 0 | 112.5 | P45 S49 G50 | P45-D47 PolarHBondContact O-N 2.69Å; D47-S49 PolarHBondContact O-N 2.79Å; D47-G50 PolarHBondContact O-N 3.4Å |
| 48 | D | 58.4 | Low | 76 | Confident | 147 Ų | 147 | 130.3 Ų | 130.3 | 79% | 0.786 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.7 | 13.3 | -178.1 | -124 | 14.2 | 0 | 0 | 0 | 112.1 | D46 | D46-D48 PolarHBondContact O-N 3.02Š|
| 49 | S | 60.8 | Low | 76.5 | Confident | 130 Ų | 130 | 129.9 Ų | 129.9 | 91% | 0.909 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -114.8 | 8.8 | 173.3 | -97.8 | 0 | 0 | 0 | 0 | 113 | D47 | D47-S49 PolarHBondContact O-N 2.79Š|
| 50 | G | 63.5 | Low | 76.6 | Confident | 58 Ų | 58 | 122.3 Ų | 122.3 | 60% | 0.598 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -99.8 | -18.9 | -177.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | D47 | D47-G50 PolarHBondContact O-N 3.4Š|
| 51 | S | 68.8 | Low | 77 | Confident | 90 Ų | 90 | 120.3 Ų | 120.3 | 63% | 0.629 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -111.3 | 107.6 | -177 | 52.9 | 0 | 0 | 0 | 0 | 111.6 | R53 | S51-R53 PolarHBondContact O-N 2.93Š|
| 52 | D | 81.1 | Confident | 77.7 | Confident | 109 Ų | 109 | 119.4 Ų | 119.4 | 58% | 0.583 | 67% | 0.671 | S | S | * | * | trans | -50.7 | 131.4 | 167.4 | -70.5 | -22.6 | 0 | 0 | 0 | 109.3 | E56 L57 | D52-E56 HydrophobicContact CB-CB 4.15Å; D52-L57 HydrophobicContact CB-CD2 4.05Å | ||
| 53 | R | 82.9 | Confident | 78.6 | Confident | 166 Ų | 166 | 118.3 Ų | 118.3 | 63% | 0.626 | 67% | 0.667 | S | S | * | * | trans | -64.3 | 160.5 | 175.6 | -67.6 | -172.2 | 169.9 | 112.2 | 0.6 | 111.1 | S51 D55 E56 L57 | S51-R53 PolarHBondContact O-N 2.93Å; R53-D55 PolarHBondContact O-N 2.99Å; R53-D55 VanDerWaalsContact O-N 3.09Å; R53-E56 HydrophobicContact CB-CG 4.18Å; R53-E56 PolarHBondContact N-OE2 3.48Å; R53-E56 VanDerWaalsContact N-OE2 3.13Å; R53-E56 IonicContact NH1-OE1 3.86Å; R53-E56 WeakPolarHBondContact O-CB 3.39Å; R53-E56 PolarHBondContact O-N 3.31Å; R53-L57 PolarHBondContact O-N 3.16Å | ||
| 54 | E | 80.3 | Confident | 79.3 | Confident | 155 Ų | 155 | 120.2 Ų | 120.2 | 72% | 0.724 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.8 | -31.9 | 178.1 | 58.1 | -95.1 | -151.9 | 0 | 0 | 113.9 | E56 | E54-E56 VanDerWaalsContact C-N 3.34Š|
| 55 | D | 85.8 | Confident | 79.9 | Confident | 150 Ų | 150 | 120.9 Ų | 120.9 | 80% | 0.802 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.5 | -18.3 | 178.5 | -64.3 | -28.9 | 0 | 0 | 0 | 113.4 | R53 | R53-D55 PolarHBondContact O-N 2.99Å; R53-D55 VanDerWaalsContact O-N 3.09Å |
| 56 | E | 87.5 | Confident | 81 | Confident | 108 Ų | 108 | 118.7 Ų | 118.7 | 51% | 0.505 | 67% | 0.672 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -91.9 | -11.6 | -179.3 | -65.2 | 165.2 | -166.2 | 0 | 0 | 111.5 | D52 R53 E54 | D52-E56 HydrophobicContact CB-CB 4.15Å; R53-E56 HydrophobicContact CB-CG 4.18Å; R53-E56 PolarHBondContact N-OE2 3.48Å; R53-E56 VanDerWaalsContact N-OE2 3.13Å; R53-E56 IonicContact NH1-OE1 3.86Å; R53-E56 WeakPolarHBondContact O-CB 3.39Å; R53-E56 PolarHBondContact O-N 3.31Å; E54-E56 VanDerWaalsContact C-N 3.34Å |
| 57 | L | 87.1 | Confident | 82.2 | Confident | 69 Ų | 69 | 115 Ų | 115 | 36% | 0.361 | 65% | 0.652 | S | S | . | * | S | Bend | trans | -70.9 | 146.5 | 177.5 | -63.8 | 177.3 | 0 | 0 | 0 | 112 | D52 R53 | D52-L57 HydrophobicContact CB-CD2 4.05Å; R53-L57 PolarHBondContact O-N 3.16Å |
| 58 | P | 88.8 | Confident | 83.6 | Confident | 110 Ų | 110 | 112.3 Ų | 112.3 | 71% | 0.714 | 64% | 0.638 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 142.5 | 179.1 | 27.7 | -35.2 | 0 | 0 | 0 | 112.1 | V60 | P58-V60 PolarHBondContact O-N 3.44Š|
| 59 | Q | 90.5 | Very high | 85.1 | Confident | 170 Ų | 170 | 107.3 Ų | 107.3 | 79% | 0.794 | 61% | 0.614 | S | S | * | * | P | Polyproline II helix | trans | -68 | 123.9 | 173.3 | -177.1 | 67.6 | 13.1 | 0 | 0 | 110.8 | V61 | Q59-V61 HydrophobicContact CG-CG2 4.02Š|
| 60 | V | 90.8 | Very high | 86.5 | Confident | 55 Ų | 55 | 103.3 Ų | 103.3 | 33% | 0.333 | 59% | 0.589 | S | S | . | * | P | Polyproline II helix | trans | -90.1 | 122.9 | 175 | -176.9 | 0 | 0 | 0 | 0 | 109.6 | P58 A70 V73 | P58-V60 PolarHBondContact O-N 3.44Å; V60-A70 HydrophobicContact CB-CB 4.32Å; V60-V73 HydrophobicContact CG1-CG2 4.45Å |
| 61 | V | 92.3 | Very high | 87.6 | Confident | 92 Ų | 92 | 105.4 Ų | 105.4 | 56% | 0.558 | 59% | 0.586 | S | S | * | * | trans | -124.3 | 128.1 | 179 | -176.3 | 0 | 0 | 0 | 0 | 109.6 | Q59 L63 | Q59-V61 HydrophobicContact CG-CG2 4.02Å; V61-L63 HydrophobicContact CG1-CD2 3.93Å; V61-L63 HydrophobicContact CG1-CG 4.3Å | ||
| 62 | V | 93.8 | Very high | 88.6 | Confident | 81 Ų | 81 | 105.5 Ų | 105.5 | 49% | 0.491 | 58% | 0.577 | S | S | . | * | trans | -93.6 | 116.6 | 177.2 | 177.5 | 0 | 0 | 0 | 0 | 108.7 | D67 | V62-D67 HydrophobicContact CG1-CB 4.14Š| ||
| 63 | L | 92.6 | Very high | 88.9 | Confident | 146 Ų | 146 | 102.9 Ų | 102.9 | 76% | 0.764 | 57% | 0.565 | S | S | * | * | trans | -108.7 | -29.7 | -179.2 | -65.1 | 178.5 | 0 | 0 | 0 | 112.4 | V61 D67 | V61-L63 HydrophobicContact CG1-CD2 3.93Å; V61-L63 HydrophobicContact CG1-CG 4.3Å; L63-D67 PolarHBondContact N-OD2 3.13Å | ||
| 64 | K | 93.8 | Very high | 89 | Confident | 156 Ų | 156 | 101.8 Ų | 101.8 | 68% | 0.678 | 57% | 0.565 | S | S | * | * | S | Bend | trans | -127.9 | 154.4 | -175.8 | -62.3 | 175.3 | -173.3 | 170.8 | 0 | 110.9 | G66 D67 | K64-G66 PolarHBondContact O-N 3.02Å; K64-D67 PolarHBondContact N-OD2 3.42Å; K64-D67 PolarHBondContact O-N 3.14Å |
| 65 | S | 84.5 | Confident | 89.3 | Confident | 137 Ų | 137 | 101.2 Ų | 101.2 | 96% | 0.958 | 56% | 0.559 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.9 | 94 | 170.4 | 55.7 | 0 | 0 | 0 | 0 | 109.6 | ||
| 66 | G | 90 | Very high | 89.3 | Confident | 72 Ų | 72 | 97.9 Ų | 97.9 | 74% | 0.742 | 54% | 0.541 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 144.2 | -14.4 | -175.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | K64 | K64-G66 PolarHBondContact O-N 3.02Š|
| 67 | D | 93.2 | Very high | 89 | Confident | 71 Ų | 71 | 97 Ų | 97 | 38% | 0.38 | 54% | 0.536 | S | S | . | . | S | Bend | trans | -73.5 | 146.6 | 172.5 | -55.2 | -28.1 | 0 | 0 | 0 | 110.3 | V62 L63 K64 | V62-D67 HydrophobicContact CG1-CB 4.14Å; L63-D67 PolarHBondContact N-OD2 3.13Å; K64-D67 PolarHBondContact N-OD2 3.42Å; K64-D67 PolarHBondContact O-N 3.14Å |
| 68 | L | 89.4 | Confident | 88.6 | Confident | 87 Ų | 87 | 95.1 Ų | 95.1 | 46% | 0.455 | 53% | 0.533 | S | S | . | . | P | Polyproline II helix | trans | -74.5 | 137.5 | 179 | -63.9 | 175.2 | 0 | 0 | 0 | 111.3 | E72 V73 L76 | L68-E72 HydrophobicContact CD2-CB 4.4Å; L68-V73 HydrophobicContact CB-CG2 3.76Å; L68-V73 HydrophobicContact CD1-CG2 4.27Å; L68-L76 HydrophobicContact CD1-CD1 3.95Å |
| 69 | S | 90.4 | Very high | 88.1 | Confident | 42 Ų | 42 | 96.1 Ų | 96.1 | 29% | 0.294 | 53% | 0.528 | S | S | . | . | P | Polyproline II helix | trans | -76.1 | 158.6 | 171.5 | 66.7 | 0 | 0 | 0 | 0 | 111.5 | D71 E72 V73 | S69-D71 PolarHBondContact O-N 2.88Å; S69-D71 VanDerWaalsContact O-N 3.13Å; S69-E72 WeakPolarHBondContact CB-OE2 3.46Å; S69-E72 PolarHBondContact N-OE2 3.14Å; S69-E72 PolarHBondContact O-N 3.45Å; S69-E72 VanDerWaalsContact O-N 3.1Å; S69-E72 VanDerWaalsContact OG-CD 3.24Å; S69-E72 WeakPolarHBondContact OG-CG 3.3Å; S69-E72 PolarHBondContact OG-OE2 3.38Å; S69-V73 WeakPolarHBondContact O-CG2 3.41Å; S69-V73 PolarHBondContact O-N 3.3Å; S69-V73 VanDerWaalsContact O-N 3.14Å |
| 70 | A | 89 | Confident | 87.1 | Confident | 45 Ų | 45 | 94.2 Ų | 94.2 | 37% | 0.372 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -55 | -34.2 | -179 | 0 | 0 | 0 | 0 | 0 | 113.1 | V60 K74 | V60-A70 HydrophobicContact CB-CB 4.32Å; A70-K74 VanDerWaalsContact O-CG 3.32Å; A70-K74 WeakPolarHBondContact O-CG 3.47Å; A70-K74 PolarHBondContact O-N 3.19Å |
| 71 | D | 87.2 | Confident | 85.8 | Confident | 103 Ų | 103 | 98.1 Ų | 98.1 | 55% | 0.551 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -73.9 | -34.2 | -179.2 | -64.8 | -31.9 | 0 | 0 | 0 | 112.6 | S69 K75 | S69-D71 PolarHBondContact O-N 2.88Å; S69-D71 VanDerWaalsContact O-N 3.13Å; D71-K75 VanDerWaalsContact O-CG 3.3Å; D71-K75 WeakPolarHBondContact O-CG 3.49Å; D71-K75 PolarHBondContact O-N 3.25Å |
| 72 | E | 89.4 | Confident | 84.2 | Confident | 92 Ų | 92 | 99.5 Ų | 99.5 | 43% | 0.43 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -71.1 | -41.2 | 177 | -68.4 | 164.2 | 140.9 | 0 | 0 | 110.9 | L68 S69 K74 K75 L76 | L68-E72 HydrophobicContact CD2-CB 4.4Å; S69-E72 WeakPolarHBondContact CB-OE2 3.46Å; S69-E72 PolarHBondContact N-OE2 3.14Å; S69-E72 PolarHBondContact O-N 3.45Å; S69-E72 VanDerWaalsContact O-N 3.1Å; S69-E72 VanDerWaalsContact OG-CD 3.24Å; S69-E72 WeakPolarHBondContact OG-CG 3.3Å; S69-E72 PolarHBondContact OG-OE2 3.38Å; E72-K74 VanDerWaalsContact C-N 3.33Å; E72-K74 PolarHBondContact O-N 3.27Å; E72-K75 PolarHBondContact O-N 3.48Å; E72-L76 WeakPolarHBondContact O-CG 3.25Å; E72-L76 PolarHBondContact O-N 3.12Å |
| 73 | V | 87.7 | Confident | 81.9 | Confident | 53 Ų | 53 | 97.9 Ų | 97.9 | 32% | 0.321 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -60.6 | -43.1 | 175.5 | 177.2 | 0 | 0 | 0 | 0 | 111 | V60 L68 S69 K75 L76 K77 | V60-V73 HydrophobicContact CG1-CG2 4.45Å; L68-V73 HydrophobicContact CB-CG2 3.76Å; L68-V73 HydrophobicContact CD1-CG2 4.27Å; S69-V73 WeakPolarHBondContact O-CG2 3.41Å; S69-V73 PolarHBondContact O-N 3.3Å; S69-V73 VanDerWaalsContact O-N 3.14Å; V73-K75 PolarHBondContact O-N 2.87Å; V73-L76 PolarHBondContact O-N 3.23Å; V73-K77 WeakPolarHBondContact O-CB 3.48Å; V73-K77 PolarHBondContact O-N 3.13Å |
| 74 | K | 85.8 | Confident | 79.5 | Confident | 144 Ų | 144 | 93.9 Ų | 93.9 | 63% | 0.626 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -62.1 | -41.6 | 177.1 | -75.1 | 173.7 | -177.5 | 178.8 | 0 | 112.4 | A70 E72 G78 | A70-K74 VanDerWaalsContact O-CG 3.32Å; A70-K74 WeakPolarHBondContact O-CG 3.47Å; A70-K74 PolarHBondContact O-N 3.19Å; E72-K74 VanDerWaalsContact C-N 3.33Å; E72-K74 PolarHBondContact O-N 3.27Å; K74-G78 PolarHBondContact O-N 3.36Å |
| 75 | K | 86.8 | Confident | 77.1 | Confident | 142 Ų | 142 | 95.9 Ų | 95.9 | 62% | 0.617 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -64.8 | -48.2 | 177.7 | -70.5 | 168.7 | -173.7 | 176.2 | 0 | 111.7 | D71 E72 V73 K77 G78 E79 | D71-K75 VanDerWaalsContact O-CG 3.3Å; D71-K75 WeakPolarHBondContact O-CG 3.49Å; D71-K75 PolarHBondContact O-N 3.25Å; E72-K75 PolarHBondContact O-N 3.48Å; V73-K75 PolarHBondContact O-N 2.87Å; K75-K77 PolarHBondContact O-N 3.39Å; K75-G78 PolarHBondContact O-N 3.17Å; K75-E79 PolarHBondContact O-N 3.13Å |
| 76 | L | 84.9 | Confident | 75.1 | Confident | 80 Ų | 80 | 92.1 Ų | 92.1 | 42% | 0.419 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -62.2 | -41.7 | 177.7 | -69.2 | 170.5 | 0 | 0 | 0 | 112.1 | L68 E72 V73 E79 L80 | L68-L76 HydrophobicContact CD1-CD1 3.95Å; E72-L76 WeakPolarHBondContact O-CG 3.25Å; E72-L76 PolarHBondContact O-N 3.12Å; V73-L76 PolarHBondContact O-N 3.23Å; L76-E79 PolarHBondContact O-N 2.84Å; L76-L80 WeakPolarHBondContact O-CB 3.41Å; L76-L80 WeakPolarHBondContact O-CG 3.29Å; L76-L80 PolarHBondContact O-N 2.99Å |
| 77 | K | 81.7 | Confident | 72.8 | Confident | 90 Ų | 90 | 98 Ų | 98 | 39% | 0.391 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -63.5 | -42 | 176 | -171.5 | -177.4 | 177.6 | -169.7 | 0 | 111.3 | V73 K75 L80 Q81 | V73-K77 WeakPolarHBondContact O-CB 3.48Å; V73-K77 PolarHBondContact O-N 3.13Å; K75-K77 PolarHBondContact O-N 3.39Å; K77-L80 PolarHBondContact O-N 3.17Å; K77-Q81 HydrophobicContact CG-CG 4.39Å; K77-Q81 WeakPolarHBondContact O-CB 3.25Å; K77-Q81 VanDerWaalsContact O-CG 3.29Å; K77-Q81 WeakPolarHBondContact O-CG 3.46Å; K77-Q81 PolarHBondContact O-N 3.3Å |
| 78 | G | 78.8 | Confident | 70.7 | Confident | 29 Ų | 29 | 102 Ų | 102 | 30% | 0.299 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -62.4 | -42.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | K74 K75 Q81 T82 | K74-G78 PolarHBondContact O-N 3.36Å; K75-G78 PolarHBondContact O-N 3.17Å; G78-Q81 PolarHBondContact O-N 3.03Å; G78-T82 WeakPolarHBondContact O-CB 3.44Å; G78-T82 WeakPolarHBondContact O-CG2 3.5Å; G78-T82 PolarHBondContact O-N 3.23Å; G78-T82 PolarHBondContact O-OG1 3.04Å |
| 79 | E | 77.4 | Confident | 68.7 | Low | 132 Ų | 132 | 100.8 Ų | 100.8 | 62% | 0.617 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -66 | -38.7 | 175.5 | -73.5 | 176.1 | 169.2 | 0 | 0 | 112.4 | K75 L76 T82 G83 | K75-E79 PolarHBondContact O-N 3.13Å; L76-E79 PolarHBondContact O-N 2.84Å; E79-T82 WeakPolarHBondContact CA-OG1 3.34Å; E79-T82 PolarHBondContact O-OG1 2.9Å; E79-G83 PolarHBondContact O-N 2.73Å |
| 80 | L | 70.1 | Confident | 66.8 | Low | 130 Ų | 130 | 104.5 Ų | 104.5 | 68% | 0.681 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -69.6 | -37.6 | 175.3 | -80.9 | 159.2 | 0 | 0 | 0 | 112.8 | L76 K77 G84 | L76-L80 WeakPolarHBondContact O-CB 3.41Å; L76-L80 WeakPolarHBondContact O-CG 3.29Å; L76-L80 PolarHBondContact O-N 2.99Å; K77-L80 PolarHBondContact O-N 3.17Å; L80-G84 VanDerWaalsContact O-CA 3.25Å; L80-G84 WeakPolarHBondContact O-CA 3.36Å; L80-G84 PolarHBondContact O-N 3.37Å |
| 81 | Q | 64.1 | Low | 65.3 | Low | 137 Ų | 137 | 108.7 Ų | 108.7 | 64% | 0.64 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -72.2 | -33.3 | 177.1 | -75 | -177.6 | -44.2 | 0 | 0 | 112.2 | K77 G78 | K77-Q81 HydrophobicContact CG-CG 4.39Å; K77-Q81 WeakPolarHBondContact O-CB 3.25Å; K77-Q81 VanDerWaalsContact O-CG 3.29Å; K77-Q81 WeakPolarHBondContact O-CG 3.46Å; K77-Q81 PolarHBondContact O-N 3.3Å; G78-Q81 PolarHBondContact O-N 3.03Å |
| 82 | T | 56.7 | Low | 64 | Low | 121 Ų | 121 | 107.9 Ų | 107.9 | 74% | 0.742 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -85 | -25.5 | 176.8 | 53.4 | 0 | 0 | 0 | 0 | 113.3 | G78 E79 | G78-T82 WeakPolarHBondContact O-CB 3.44Å; G78-T82 WeakPolarHBondContact O-CG2 3.5Å; G78-T82 PolarHBondContact O-N 3.23Å; G78-T82 PolarHBondContact O-OG1 3.04Å; E79-T82 WeakPolarHBondContact CA-OG1 3.34Å; E79-T82 PolarHBondContact O-OG1 2.9Å |
| 83 | G | 46 | Very low | 62.8 | Low | 46 Ų | 46 | 105.2 Ų | 105.2 | 47% | 0.474 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -91.6 | -6.7 | 173.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | E79 E85 G86 | E79-G83 PolarHBondContact O-N 2.73Å; G83-E85 PolarHBondContact O-N 3.13Å; G83-G86 PolarHBondContact O-N 3.44Å; G83-G86 VanDerWaalsContact O-N 3.13Å |
| 84 | G | 43.4 | Very low | 61.8 | Low | 62 Ų | 62 | 109.6 Ų | 109.6 | 64% | 0.639 | 62% | 0.617 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.8 | 5 | -170.1 | 0 | 0 | 0 | 0 | 0 | 117 | L80 | L80-G84 VanDerWaalsContact O-CA 3.25Å; L80-G84 WeakPolarHBondContact O-CA 3.36Å; L80-G84 PolarHBondContact O-N 3.37Å |
| 85 | E | 42.5 | Very low | 61.1 | Low | 198 Ų | 198 | 107.6 Ų | 107.6 | 93% | 0.925 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.7 | 0.6 | 161.8 | -80.1 | -174.7 | 125.1 | 0 | 0 | 112.2 | G83 | G83-E85 PolarHBondContact O-N 3.13Š|
| 86 | G | 42.3 | Very low | 60.8 | Low | 58 Ų | 58 | 104.1 Ų | 104.1 | 60% | 0.598 | 62% | 0.618 | S | S | * | * | trans | -110.7 | -12.6 | -162.5 | 0 | 0 | 0 | 0 | 0 | 118.5 | G83 K88 | G83-G86 PolarHBondContact O-N 3.44Å; G83-G86 VanDerWaalsContact O-N 3.13Å; G86-K88 PolarHBondContact O-N 2.93Å; G86-K88 VanDerWaalsContact O-N 3.16Å | ||
| 87 | E | 42.8 | Very low | 60.6 | Low | 196 Ų | 196 | 106.4 Ų | 106.4 | 92% | 0.916 | 62% | 0.624 | S | S | * | * | trans | -91.2 | 77.6 | 173.4 | -75.8 | -156.5 | 146.2 | 0 | 0 | 111.1 | G89 | E87-G89 VanDerWaalsContact C-N 3.25Å; E87-G89 PolarHBondContact O-N 2.83Å | ||
| 88 | K | 48.6 | Very low | 60.6 | Low | 155 Ų | 155 | 108.6 Ų | 108.6 | 67% | 0.674 | 64% | 0.639 | S | S | * | * | trans | -57 | 85.7 | 162.1 | -68.9 | -156.6 | 177.2 | -166.6 | 0 | 110.9 | G86 E91 | G86-K88 PolarHBondContact O-N 2.93Å; G86-K88 VanDerWaalsContact O-N 3.16Å; K88-E91 HydrophobicContact CD-CG 4.31Å; K88-E91 WeakPolarHBondContact CE-OE1 3.36Å; K88-E91 IonicContact NZ-OE1 2.79Å; K88-E91 PolarHBondContact NZ-OE1 2.97Å; K88-E91 IonicContact NZ-OE2 2.69Å | ||
| 89 | G | 47.5 | Very low | 60.7 | Low | 61 Ų | 61 | 112.8 Ų | 112.8 | 63% | 0.629 | 65% | 0.654 | S | S | * | * | S | Bend | trans | -98.4 | -19.1 | 167.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | E87 | E87-G89 VanDerWaalsContact C-N 3.25Å; E87-G89 PolarHBondContact O-N 2.83Å |
| 90 | E | 51.1 | Low | 60.7 | Low | 121 Ų | 121 | 115.8 Ų | 115.8 | 57% | 0.565 | 67% | 0.665 | S | S | * | * | trans | -170.5 | 91.4 | 171.5 | -155.9 | 166 | 149.5 | 0 | 0 | 107.9 | A92 | E90-A92 PolarHBondContact O-N 3.32Š| ||
| 91 | E | 56.1 | Low | 61.3 | Low | 133 Ų | 133 | 117 Ų | 117 | 62% | 0.621 | 67% | 0.665 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 118.6 | 160.3 | -83.4 | -173.4 | 158.2 | 0 | 0 | 106.6 | K88 P93 | K88-E91 HydrophobicContact CD-CG 4.31Å; K88-E91 WeakPolarHBondContact CE-OE1 3.36Å; K88-E91 IonicContact NZ-OE1 2.79Å; K88-E91 PolarHBondContact NZ-OE1 2.97Å; K88-E91 IonicContact NZ-OE2 2.69Å; E91-P93 WeakPolarHBondContact O-CD 3.38Å; E91-P93 VanDerWaalsContact O-N 3.12Å |
| 92 | A | 60.5 | Low | 62.4 | Low | 86 Ų | 86 | 119.4 Ų | 119.4 | 71% | 0.711 | 67% | 0.673 | S | S | * | * | P | Polyproline II helix | trans | -50.7 | 123.7 | 169.3 | 0 | 0 | 0 | 0 | 0 | 106.6 | E90 | E90-A92 PolarHBondContact O-N 3.32Š|
| 93 | P | 64.3 | Low | 63.7 | Low | 35 Ų | 35 | 118.9 Ų | 118.9 | 23% | 0.227 | 67% | 0.672 | C | S | . | * | P | Polyproline II helix | trans | -51.4 | 132.4 | -175.6 | -30.1 | 37.1 | 0 | 0 | 0 | 109.1 | E91 D95 G96 K97 L99 | E91-P93 WeakPolarHBondContact O-CD 3.38Å; E91-P93 VanDerWaalsContact O-N 3.12Å; P93-D95 PolarHBondContact O-N 3.22Å; P93-G96 PolarHBondContact O-N 3.27Å; P93-K97 WeakPolarHBondContact CG-O 3.49Å; P93-L99 HydrophobicContact CG-CD1 4.19Å; P93-L99 HydrophobicContact CG-CG 4.34Å |
| 94 | P | 65.9 | Low | 65.4 | Low | 145 Ų | 145 | 121.1 Ų | 121.1 | 94% | 0.942 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.6 | -14 | -176 | 24.3 | -35 | 0 | 0 | 0 | 112.8 | G96 | P94-G96 VanDerWaalsContact C-N 3.34Š|
| 95 | D | 72.6 | Confident | 67.1 | Low | 103 Ų | 103 | 127.3 Ų | 127.3 | 55% | 0.551 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.7 | -0.6 | 176.7 | -159.9 | 12 | 0 | 0 | 0 | 113.4 | P93 K97 | P93-D95 PolarHBondContact O-N 3.22Å; D95-K97 PolarHBondContact O-N 2.99Å; D95-K97 IonicContact OD1-NZ 2.66Å; D95-K97 PolarHBondContact OD1-NZ 3.27Å; D95-K97 VanDerWaalsContact OD2-CD 3.22Å; D95-K97 WeakPolarHBondContact OD2-CD 3.43Å; D95-K97 WeakPolarHBondContact OD2-CE 3.47Å; D95-K97 IonicContact OD2-NZ 2.63Å; D95-K97 PolarHBondContact OD2-NZ 2.86Å |
| 96 | G | 78.8 | Confident | 68.5 | Low | 69 Ų | 69 | 129.4 Ų | 129.4 | 71% | 0.711 | 70% | 0.695 | S | S | * | * | trans | 65.9 | 5.3 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | P93 P94 | P93-G96 PolarHBondContact O-N 3.27Å; P94-G96 VanDerWaalsContact C-N 3.34Å | ||
| 97 | K | 81.6 | Confident | 69.8 | Low | 127 Ų | 127 | 133.6 Ų | 133.6 | 55% | 0.552 | 70% | 0.702 | S | S | * | * | trans | -88.1 | 114.8 | 179.3 | -65.6 | 175.5 | -167.5 | 155.3 | 0 | 109.6 | P93 D95 L99 | P93-K97 WeakPolarHBondContact CG-O 3.49Å; D95-K97 PolarHBondContact O-N 2.99Å; D95-K97 IonicContact OD1-NZ 2.66Å; D95-K97 PolarHBondContact OD1-NZ 3.27Å; D95-K97 VanDerWaalsContact OD2-CD 3.22Å; D95-K97 WeakPolarHBondContact OD2-CD 3.43Å; D95-K97 WeakPolarHBondContact OD2-CE 3.47Å; D95-K97 IonicContact OD2-NZ 2.63Å; D95-K97 PolarHBondContact OD2-NZ 2.86Å; K97-L99 PolarHBondContact O-N 3.03Å | ||
| 98 | I | 81.6 | Confident | 70.7 | Confident | 137 Ų | 137 | 130.3 Ų | 130.3 | 70% | 0.703 | 70% | 0.701 | S | S | * | * | trans | -69.9 | 122.4 | 177.5 | -56.1 | 169.7 | 0 | 0 | 0 | 109.1 | F100 | I98-F100 HydrophobicContact CG2-CE2 4.29Š| ||
| 99 | L | 80 | Confident | 71.2 | Confident | 117 Ų | 117 | 127.9 Ų | 127.9 | 61% | 0.613 | 70% | 0.703 | S | S | * | * | trans | -98.3 | 110.3 | 175.4 | -63.6 | 172.8 | 0 | 0 | 0 | 109.7 | P93 K97 K101 | P93-L99 HydrophobicContact CG-CD1 4.19Å; P93-L99 HydrophobicContact CG-CG 4.34Å; K97-L99 PolarHBondContact O-N 3.03Å; L99-K101 PolarHBondContact O-N 3.2Å | ||
| 100 | F | 77.8 | Confident | 71.9 | Confident | 194 Ų | 194 | 131.8 Ų | 131.8 | 85% | 0.851 | 71% | 0.71 | S | S | * | * | trans | -71.1 | 101.7 | 176.3 | -77 | -91.9 | 0 | 0 | 0 | 111 | I98 | I98-F100 HydrophobicContact CG2-CE2 4.29Š| ||
| 101 | K | 83.8 | Confident | 72.5 | Confident | 155 Ų | 155 | 134.4 Ų | 134.4 | 67% | 0.674 | 72% | 0.719 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 126.4 | 168.3 | -74.3 | 165.4 | 75.3 | -177.3 | 0 | 109.3 | L99 | L99-K101 PolarHBondContact O-N 3.2Š|
| 102 | K | 86.1 | Confident | 72.9 | Confident | 189 Ų | 189 | 136.6 Ų | 136.6 | 82% | 0.822 | 73% | 0.727 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 130.5 | 177.2 | -172.6 | 170.7 | -178.5 | 163.1 | 0 | 109.2 | A104 | K102-A104 PolarHBondContact O-N 2.99Š|
| 103 | P | 83.6 | Confident | 73 | Confident | 110 Ų | 110 | 142 Ų | 142 | 71% | 0.714 | 74% | 0.738 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 140.8 | 178.6 | 23.2 | -32.8 | 0 | 0 | 0 | 110.4 | K105 | P103-K105 PolarHBondContact O-N 2.94Š|
| 104 | A | 81.8 | Confident | 73 | Confident | 92 Ų | 92 | 141.6 Ų | 141.6 | 76% | 0.76 | 74% | 0.74 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 136.3 | 171.6 | 0 | 0 | 0 | 0 | 0 | 109.1 | K102 R106 | K102-A104 PolarHBondContact O-N 2.99Å; A104-R106 PolarHBondContact O-N 3.38Å |
| 105 | K | 80 | Confident | 72.8 | Confident | 192 Ų | 192 | 142.8 Ų | 142.8 | 84% | 0.835 | 74% | 0.737 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 116.7 | 173.1 | -69 | 179.3 | 177.6 | 177.3 | 0 | 107.2 | P103 L107 | P103-K105 PolarHBondContact O-N 2.94Å; K105-L107 PolarHBondContact O-N 2.88Å; K105-L107 VanDerWaalsContact O-N 3.15Å |
| 106 | R | 72.3 | Confident | 72.1 | Confident | 243 Ų | 243 | 144.2 Ų | 144.2 | 92% | 0.917 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 120.6 | 177.3 | -60.4 | 179.2 | -167.1 | 157.6 | 2 | 108.2 | A104 S108 | A104-R106 PolarHBondContact O-N 3.38Å; R106-S108 PolarHBondContact O-N 3.45Å |
| 107 | L | 70 | Confident | 71.2 | Confident | 146 Ų | 146 | 145.7 Ų | 145.7 | 76% | 0.764 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 125.7 | 168.2 | -63.3 | 174.9 | 0 | 0 | 0 | 106.7 | K105 S109 D110 | K105-L107 PolarHBondContact O-N 2.88Å; K105-L107 VanDerWaalsContact O-N 3.15Å; L107-S109 PolarHBondContact O-N 2.97Å; L107-D110 PolarHBondContact O-N 3.37Å |
| 108 | S | 60.9 | Low | 70.2 | Confident | 127 Ų | 127 | 144.5 Ų | 144.5 | 89% | 0.888 | 76% | 0.762 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.9 | 11.1 | -166.6 | 56.1 | 0 | 0 | 0 | 0 | 115.6 | R106 | R106-S108 PolarHBondContact O-N 3.45Š|
| 109 | S | 59.8 | Low | 69.1 | Low | 103 Ų | 103 | 143.3 Ų | 143.3 | 72% | 0.72 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.8 | -17.9 | 178.9 | 59.1 | 0 | 0 | 0 | 0 | 113.7 | L107 K111 | L107-S109 PolarHBondContact O-N 2.97Å; S109-K111 PolarHBondContact O-N 2.72Å |
| 110 | D | 61.4 | Low | 68 | Low | 143 Ų | 143 | 142.8 Ų | 142.8 | 77% | 0.765 | 77% | 0.773 | S | S | * | * | trans | -93.6 | 86.7 | 179.6 | -159.8 | 32.7 | 0 | 0 | 0 | 110.2 | L107 F112 | L107-D110 PolarHBondContact O-N 3.37Å; D110-F112 PolarHBondContact O-N 2.99Å | ||
| 111 | K | 63.8 | Low | 66.9 | Low | 176 Ų | 176 | 143.1 Ų | 143.1 | 77% | 0.765 | 77% | 0.774 | S | S | * | * | trans | -71.6 | 96.2 | 175.2 | -61.7 | -179.8 | -144.3 | 170.7 | 0 | 108 | S109 Q113 | S109-K111 PolarHBondContact O-N 2.72Å; K111-Q113 PolarHBondContact O-N 3.13Å | ||
| 112 | F | 63.8 | Low | 65.4 | Low | 180 Ų | 180 | 145.6 Ų | 145.6 | 79% | 0.789 | 79% | 0.785 | S | S | * | * | trans | -55.4 | 109.3 | 168.5 | -169.9 | -103.8 | 0 | 0 | 0 | 109.5 | D110 G114 | D110-F112 PolarHBondContact O-N 2.99Å; F112-G114 PolarHBondContact O-N 3.24Å | ||
| 113 | Q | 64.2 | Low | 63.6 | Low | 198 Ų | 198 | 145.2 Ų | 145.2 | 93% | 0.925 | 78% | 0.783 | S | S | * | * | trans | -86.5 | 30.9 | 176.7 | -64.6 | -176.3 | 30.6 | 0 | 0 | 112.1 | K111 | K111-Q113 PolarHBondContact O-N 3.13Š| ||
| 114 | G | 64.3 | Low | 61.7 | Low | 27 Ų | 27 | 149.1 Ų | 149.1 | 28% | 0.278 | 79% | 0.788 | S | S | . | * | S | Bend | trans | -86.3 | 132.6 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | F112 T116 | F112-G114 PolarHBondContact O-N 3.24Å; G114-T116 PolarHBondContact O-N 3.32Å |
| 115 | I | 60.8 | Low | 59.7 | Low | 170 Ų | 170 | 153.8 Ų | 153.8 | 87% | 0.872 | 80% | 0.795 | S | S | * | * | trans | 1.1 | 98.7 | 170.8 | 41.6 | 166.2 | 0 | 0 | 0 | 115.3 | A117 | I115-A117 PolarHBondContact O-N 3Š| ||
| 116 | T | 58.7 | Low | 57.6 | Low | 133 Ų | 133 | 150.9 Ų | 150.9 | 82% | 0.816 | 79% | 0.788 | S | S | * | * | trans | -72.7 | 92.1 | 169.1 | 67.3 | 0 | 0 | 0 | 0 | 108.5 | G114 S118 | G114-T116 PolarHBondContact O-N 3.32Å; T116-S118 PolarHBondContact O-N 3.46Å | ||
| 117 | A | 59.5 | Low | 55.9 | Low | 100 Ų | 100 | 150.6 Ų | 150.6 | 83% | 0.826 | 79% | 0.787 | S | S | * | * | trans | -71.5 | 79.3 | 166.9 | 0 | 0 | 0 | 0 | 0 | 109 | I115 S119 | I115-A117 PolarHBondContact O-N 3Å; A117-S119 PolarHBondContact O-N 3.46Å; A117-S119 VanDerWaalsContact O-N 3.17Å | ||
| 118 | S | 60.9 | Low | 54.2 | Low | 102 Ų | 102 | 148.9 Ų | 148.9 | 71% | 0.713 | 79% | 0.794 | S | S | * | * | trans | -78.1 | 93.2 | 171.5 | -178.4 | 0 | 0 | 0 | 0 | 108.4 | T116 S120 | T116-S118 PolarHBondContact O-N 3.46Å; S118-S120 PolarHBondContact O-N 3.44Å | ||
| 119 | S | 58.6 | Low | 52.8 | Low | 112 Ų | 112 | 146.7 Ų | 146.7 | 78% | 0.783 | 79% | 0.792 | S | S | * | * | trans | -78 | 97.8 | 162 | 68.8 | 0 | 0 | 0 | 0 | 107.8 | A117 K121 | A117-S119 PolarHBondContact O-N 3.46Å; A117-S119 VanDerWaalsContact O-N 3.17Å; S119-K121 VanDerWaalsContact C-N 3.25Å; S119-K121 PolarHBondContact O-N 3.26Å | ||
| 120 | S | 55.4 | Low | 51.5 | Low | 107 Ų | 107 | 150.5 Ų | 150.5 | 75% | 0.748 | 80% | 0.798 | S | S | * | * | trans | -72.9 | 81.5 | 173.4 | 49.3 | 0 | 0 | 0 | 0 | 109.8 | S118 K122 | S118-S120 PolarHBondContact O-N 3.44Å; S120-K122 PolarHBondContact O-N 2.93Å; S120-K122 VanDerWaalsContact O-N 3.13Å | ||
| 121 | K | 54.8 | Low | 50 | Low | 200 Ų | 200 | 152 Ų | 152 | 87% | 0.87 | 80% | 0.8 | S | S | * | * | trans | -71.1 | 104 | 165.5 | -157 | 174.5 | -175.8 | 93.2 | 0 | 107.4 | S119 K123 | S119-K121 VanDerWaalsContact C-N 3.25Å; S119-K121 PolarHBondContact O-N 3.26Å; K121-K123 PolarHBondContact O-N 3.48Å | ||
| 122 | K | 52.1 | Low | 48.5 | Very low | 208 Ų | 208 | 151.7 Ų | 151.7 | 90% | 0.904 | 80% | 0.802 | S | S | * | * | trans | -53.3 | 110.3 | 171.9 | -78 | 179.4 | 177.2 | 171.9 | 0 | 109.3 | S120 | S120-K122 PolarHBondContact O-N 2.93Å; S120-K122 VanDerWaalsContact O-N 3.13Å | ||
| 123 | K | 48.1 | Very low | 47.1 | Very low | 180 Ų | 180 | 150.9 Ų | 150.9 | 78% | 0.783 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -82.5 | 116.5 | 164.7 | -165.9 | 179.2 | 177.8 | -171.3 | 0 | 107 | K121 | K121-K123 PolarHBondContact O-N 3.48Š|
| 124 | K | 45 | Very low | 46 | Very low | 192 Ų | 192 | 148.5 Ų | 148.5 | 84% | 0.835 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 136.5 | 165.2 | -83.2 | -174 | 176.1 | 179.7 | 0 | 107.8 | ||
| 125 | E | 40.2 | Very low | 44.9 | Very low | 190 Ų | 190 | 156.6 Ų | 156.6 | 89% | 0.888 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 127.7 | 178.8 | -156.9 | 173.7 | -170.6 | 0 | 0 | 109.7 | R127 | E125-R127 PolarHBondContact O-N 3.2Š|
| 126 | D | 35.6 | Very low | 44.2 | Very low | 132 Ų | 132 | 155.2 Ų | 155.2 | 71% | 0.706 | 82% | 0.816 | S | S | * | * | trans | -73.4 | 116 | 177 | -70.2 | -58 | 0 | 0 | 0 | 110.3 | ||||
| 127 | R | 35.8 | Very low | 43.7 | Very low | 236 Ų | 236 | 160.6 Ų | 160.6 | 89% | 0.891 | 82% | 0.821 | S | S | * | * | trans | -138.1 | 106.3 | 153.7 | -83.1 | -163.8 | 178.8 | 177.8 | 1.6 | 110.6 | E125 | E125-R127 PolarHBondContact O-N 3.2Š| ||
| 128 | A | 34.1 | Very low | 43.1 | Very low | 111 Ų | 111 | 164.8 Ų | 164.8 | 92% | 0.917 | 82% | 0.821 | S | S | * | * | trans | 23.2 | 125.2 | 149.6 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 129 | G | 31.1 | Very low | 42.8 | Very low | 81 Ų | 81 | 165.5 Ų | 165.5 | 84% | 0.835 | 83% | 0.826 | S | S | * | * | trans | 172.8 | 124.7 | 162 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 130 | E | 32.8 | Very low | 43.1 | Very low | 183 Ų | 183 | 163.4 Ų | 163.4 | 86% | 0.855 | 82% | 0.823 | S | S | * | * | trans | -67.4 | 175.5 | -169.4 | -64.2 | 154.7 | 178.7 | 0 | 0 | 116.4 | ||||
| 131 | Q | 31.6 | Very low | 43.7 | Very low | 173 Ų | 173 | 167.9 Ų | 167.9 | 81% | 0.808 | 83% | 0.829 | S | S | * | * | trans | 98.2 | 102.9 | 161.3 | -60.3 | 176.2 | 14.9 | 0 | 0 | 115.9 | ||||
| 132 | E | 32 | Very low | 44.3 | Very low | 170 Ų | 170 | 167.4 Ų | 167.4 | 79% | 0.794 | 83% | 0.826 | S | S | * | * | 83.4 | 131.8 | 77.5 | -104.5 | -170.2 | -173.4 | 0 | 0 | 114.8 | |||||
| 133 | E | 32.8 | Very low | 45.3 | Very low | 164 Ų | 164 | 162.5 Ų | 162.5 | 77% | 0.766 | 81% | 0.814 | S | S | * | * | trans | 79.6 | 99.8 | 154.3 | -63 | -173.4 | 165.5 | 0 | 0 | 121.5 | ||||
| 134 | D | 41.6 | Very low | 46.5 | Very low | 148 Ų | 148 | 163.6 Ų | 163.6 | 79% | 0.791 | 82% | 0.819 | S | S | * | * | 30.2 | 112.5 | 116.3 | -107.6 | -41.5 | 0 | 0 | 0 | 118.6 | |||||
| 135 | K | 41.7 | Very low | 47.9 | Very low | 197 Ų | 197 | 157.6 Ų | 157.6 | 86% | 0.857 | 80% | 0.795 | S | S | * | * | trans | -150.3 | 77.3 | 145 | -68 | -162.7 | 179.5 | 161.3 | 0 | 112.5 | R137 | K135-R137 PolarHBondContact O-N 3.37Š| ||
| 136 | D | 46.4 | Very low | 49.2 | Very low | 141 Ų | 141 | 156.9 Ų | 156.9 | 75% | 0.754 | 80% | 0.798 | S | S | * | * | 30.6 | 90.7 | 115.2 | -147.2 | 4.4 | 0 | 0 | 0 | 116.5 | |||||
| 137 | R | 46.7 | Very low | 51 | Low | 245 Ų | 245 | 155.4 Ų | 155.4 | 93% | 0.925 | 80% | 0.798 | S | S | * | * | trans | -106.7 | 88.5 | 156.2 | -73.8 | -169.5 | -178.5 | -176.8 | 1.2 | 108.8 | K135 S139 | K135-R137 PolarHBondContact O-N 3.37Å; R137-S139 PolarHBondContact O-N 3.09Å | ||
| 138 | K | 48.9 | Very low | 52.9 | Low | 188 Ų | 188 | 150 Ų | 150 | 82% | 0.817 | 79% | 0.786 | S | S | * | * | trans | -8.9 | 111.5 | 164.4 | -104.1 | 166.9 | 177.9 | 162.6 | 0 | 113.9 | G140 | K138-G140 PolarHBondContact O-N 2.9Š| ||
| 139 | S | 53.5 | Low | 54.8 | Low | 117 Ų | 117 | 151.5 Ų | 151.5 | 82% | 0.818 | 78% | 0.778 | S | S | * | * | trans | -51.5 | 102.9 | 165.2 | 56.7 | 0 | 0 | 0 | 0 | 110.8 | R137 K141 | R137-S139 PolarHBondContact O-N 3.09Å; S139-K141 PolarHBondContact O-N 2.71Å | ||
| 140 | G | 65.4 | Low | 56.4 | Low | 69 Ų | 69 | 153.8 Ų | 153.8 | 71% | 0.711 | 78% | 0.781 | S | S | * | * | trans | -58.9 | 133.2 | 162.3 | 0 | 0 | 0 | 0 | 0 | 108.8 | K138 K142 | K138-G140 PolarHBondContact O-N 2.9Å; G140-K142 PolarHBondContact O-N 3.14Å | ||
| 141 | K | 66.8 | Low | 57.1 | Low | 201 Ų | 201 | 153.5 Ų | 153.5 | 87% | 0.874 | 78% | 0.777 | S | S | * | * | trans | -51.7 | 114.6 | -177 | -71.4 | 170.1 | 178.2 | 171.5 | 0 | 109.9 | S139 V143 | S139-K141 PolarHBondContact O-N 2.71Å; K141-V143 PolarHBondContact O-N 3.13Å | ||
| 142 | K | 68 | Low | 58 | Low | 189 Ų | 189 | 148.5 Ų | 148.5 | 82% | 0.822 | 77% | 0.772 | S | S | * | * | trans | -61.2 | 106.5 | 176.2 | -174.7 | 170.6 | -174 | 168.7 | 0 | 109.2 | G140 K144 | G140-K142 PolarHBondContact O-N 3.14Å; K142-K144 PolarHBondContact O-N 3.1Å | ||
| 143 | V | 72.2 | Confident | 59 | Low | 106 Ų | 106 | 147.6 Ų | 147.6 | 64% | 0.642 | 77% | 0.773 | S | S | * | * | trans | -71.8 | 115 | 175 | -154.5 | 0 | 0 | 0 | 0 | 107.7 | K141 N145 | K141-V143 PolarHBondContact O-N 3.13Å; V143-N145 WeakPolarHBondContact CG1-OD1 3.38Å; V143-N145 PolarHBondContact O-N 3.18Å | ||
| 144 | K | 74.7 | Confident | 60.1 | Low | 203 Ų | 203 | 147.1 Ų | 147.1 | 88% | 0.883 | 78% | 0.776 | S | S | * | * | trans | -83.7 | 64.2 | -178.1 | -62 | 177.8 | -172.5 | 172.1 | 0 | 109.9 | K142 | K142-K144 PolarHBondContact O-N 3.1Š| ||
| 145 | N | 74.6 | Confident | 60.9 | Low | 65 Ų | 65 | 147.8 Ų | 147.8 | 35% | 0.348 | 77% | 0.774 | S | S | . | * | trans | -119.8 | 118.2 | 167.4 | 39.7 | -114.7 | 0 | 0 | 0 | 108.7 | V143 S147 L148 | V143-N145 WeakPolarHBondContact CG1-OD1 3.38Å; V143-N145 PolarHBondContact O-N 3.18Å; N145-S147 PolarHBondContact O-N 2.86Å; N145-L148 WeakPolarHBondContact ND2-CD1 3.32Å; N145-L148 WeakPolarHBondContact ND2-CG 3.3Å | ||
| 146 | N | 67.7 | Low | 61.4 | Low | 176 Ų | 176 | 147.2 Ų | 147.2 | 94% | 0.941 | 77% | 0.774 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.7 | 11.7 | 174.7 | 55.7 | -8.7 | 0 | 0 | 0 | 112.9 | ||
| 147 | S | 71.9 | Confident | 61.7 | Low | 101 Ų | 101 | 149.9 Ų | 149.9 | 71% | 0.706 | 78% | 0.782 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -128.4 | 35 | -176.6 | -174.4 | 0 | 0 | 0 | 0 | 112 | N145 | N145-S147 PolarHBondContact O-N 2.86Š|
| 148 | L | 75.8 | Confident | 61.9 | Low | 123 Ų | 123 | 147.6 Ų | 147.6 | 64% | 0.644 | 78% | 0.782 | S | S | * | * | trans | -116.6 | 117.8 | 164.5 | -68.8 | -176.4 | 0 | 0 | 0 | 108.4 | N145 S150 | N145-L148 WeakPolarHBondContact ND2-CD1 3.32Å; N145-L148 WeakPolarHBondContact ND2-CG 3.3Å; L148-S150 PolarHBondContact O-N 2.9Å | ||
| 149 | L | 73.9 | Confident | 61.6 | Low | 142 Ų | 142 | 145.7 Ų | 145.7 | 74% | 0.743 | 78% | 0.781 | S | S | * | * | trans | -64.7 | 119.9 | 173 | -66.5 | 160.8 | 0 | 0 | 0 | 108.1 | F151 | L149-F151 HydrophobicContact CB-CD2 3.7Å; L149-F151 HydrophobicContact CB-CE2 3.31Å; L149-F151 HydrophobicContact CB-CZ 4.09Å; L149-F151 HydrophobicContact CD1-CE2 3.65Å; L149-F151 HydrophobicContact CD1-CZ 3.97Å; L149-F151 HydrophobicContact CG-CE2 4.06Å; L149-F151 PolarHBondContact O-N 3.19Å | ||
| 150 | S | 65.1 | Low | 61.2 | Low | 128 Ų | 128 | 150.9 Ų | 150.9 | 90% | 0.895 | 80% | 0.8 | S | S | * | * | trans | -80.5 | 94.8 | 173.6 | -57.8 | 0 | 0 | 0 | 0 | 108.2 | L148 | L148-S150 PolarHBondContact O-N 2.9Š| ||
| 151 | F | 48.7 | Very low | 61 | Low | 177 Ų | 177 | 155 Ų | 155 | 78% | 0.776 | 80% | 0.804 | S | S | * | * | trans | -89.9 | 122 | 172.7 | -74 | -79.7 | 0 | 0 | 0 | 109.5 | L149 | L149-F151 HydrophobicContact CB-CD2 3.7Å; L149-F151 HydrophobicContact CB-CE2 3.31Å; L149-F151 HydrophobicContact CB-CZ 4.09Å; L149-F151 HydrophobicContact CD1-CE2 3.65Å; L149-F151 HydrophobicContact CD1-CZ 3.97Å; L149-F151 HydrophobicContact CG-CE2 4.06Å; L149-F151 PolarHBondContact O-N 3.19Å | ||
| 152 | G | 50.4 | Low | 60.7 | Low | 69 Ų | 69 | 152.6 Ų | 152.6 | 71% | 0.711 | 80% | 0.8 | S | S | * | * | trans | 59.8 | 91.5 | 148.3 | 0 | 0 | 0 | 0 | 0 | 117.3 | D154 | G152-D154 PolarHBondContact O-N 2.84Å; G152-D154 VanDerWaalsContact O-N 3.14Å | ||
| 153 | D | 53.2 | Low | 60.3 | Low | 151 Ų | 151 | 150.6 Ų | 150.6 | 81% | 0.807 | 80% | 0.799 | S | S | * | * | trans | -74.2 | 75.4 | 143 | -168.5 | 36.3 | 0 | 0 | 0 | 106.5 | E155 | D153-E155 PolarHBondContact O-N 3.38Š| ||
| 154 | D | 54.8 | Low | 59.6 | Low | 154 Ų | 154 | 153.2 Ų | 153.2 | 82% | 0.824 | 81% | 0.808 | S | S | * | * | trans | -91.6 | 81.5 | 172.1 | -161.6 | 35.7 | 0 | 0 | 0 | 106.4 | G152 E156 | G152-D154 PolarHBondContact O-N 2.84Å; G152-D154 VanDerWaalsContact O-N 3.14Å; D154-E156 PolarHBondContact O-N 2.93Å; D154-E156 VanDerWaalsContact O-N 3.17Å | ||
| 155 | E | 58.2 | Low | 58.6 | Low | 161 Ų | 161 | 150.1 Ų | 150.1 | 75% | 0.752 | 80% | 0.804 | S | S | * | * | trans | -68.5 | 95.3 | 167.5 | -71.9 | -167.6 | 157.4 | 0 | 0 | 108.9 | D153 | D153-E155 PolarHBondContact O-N 3.38Š| ||
| 156 | E | 51.9 | Low | 57.5 | Low | 186 Ų | 186 | 155.7 Ų | 155.7 | 87% | 0.869 | 83% | 0.834 | S | S | * | * | trans | -138.1 | 99.2 | 144.6 | -76.2 | -161.4 | 173.6 | 0 | 0 | 110.2 | D154 | D154-E156 PolarHBondContact O-N 2.93Å; D154-E156 VanDerWaalsContact O-N 3.17Å | ||
| 157 | E | 53.6 | Low | 56.8 | Low | 197 Ų | 197 | 154.3 Ų | 154.3 | 92% | 0.921 | 83% | 0.826 | S | S | * | * | trans | -75.3 | 115.7 | 163.6 | 177.4 | 178.2 | -140.6 | 0 | 0 | 108.6 | ||||
| 158 | E | 51.5 | Low | 55.7 | Low | 197 Ų | 197 | 158.4 Ų | 158.4 | 92% | 0.921 | 84% | 0.836 | S | S | * | * | trans | -150.4 | 122.4 | 147.8 | -158.8 | 159.5 | -150.1 | 0 | 0 | 110.8 | ||||
| 159 | N | 42.7 | Very low | 54 | Low | 147 Ų | 147 | 161.3 Ų | 161.3 | 79% | 0.786 | 85% | 0.852 | S | S | * | * | trans | -113.8 | 117.4 | -177 | 164.1 | 74.6 | 0 | 0 | 0 | 107.8 | ||||
| 160 | D | 43.7 | Very low | 52.2 | Low | 227 Ų | 227 | 163.1 Ų | 163.1 | 100% | 1.214 | 86% | 0.861 | S | S | * | * | trans | -159.4 | 0 | 137.1 | -146.6 | 7.5 | 0 | 0 | 0 | 110.5 |
Retrieved 160 of 160 residues in 230.4 ms
(Link to these results)