| 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 | A | 62.8 | Low | 88.6 | Confident | 132 Ų | 132 | 130.5 Ų | 130.5 | 100% | 1.091 | 73% | 0.726 | S | S | * | * | 0 | 15.9 | 0 | 0 | 0 | 0 | 0 | 0 | 112.8 | F3 | A1-F3 PolarHBondContact O-N 3.45Š| |||
| 2 | D | 76.8 | Confident | 89.1 | Confident | 111 Ų | 111 | 134.9 Ų | 134.9 | 59% | 0.594 | 73% | 0.732 | S | S | * | * | G | 310 helix | trans | -76.9 | -6.2 | -176.2 | -62.4 | -58.3 | 0 | 0 | 0 | 115 | L4 K5 | D2-L4 PolarHBondContact O-N 3.11Å; D2-K5 PolarHBondContact O-N 3.23Å; D2-K5 WeakPolarHBondContact OD1-CE 3.42Å; D2-K5 IonicContact OD1-NZ 2.69Å; D2-K5 PolarHBondContact OD1-NZ 3.41Å |
| 3 | F | 89.3 | Confident | 89.6 | Confident | 194 Ų | 194 | 129.6 Ų | 129.6 | 85% | 0.851 | 71% | 0.711 | S | S | * | * | G | 310 helix | trans | -63.1 | -25.9 | -179.6 | -177 | -102.5 | 0 | 0 | 0 | 114 | A1 | A1-F3 PolarHBondContact O-N 3.45Š|
| 4 | L | 88.8 | Confident | 89.8 | Confident | 139 Ų | 139 | 127.3 Ų | 127.3 | 73% | 0.728 | 70% | 0.698 | S | S | * | * | G | 310 helix | trans | -96.6 | 8.6 | -175.9 | -67.4 | 172.9 | 0 | 0 | 0 | 114.1 | D2 | D2-L4 PolarHBondContact O-N 3.11Š|
| 5 | K | 91.9 | Very high | 89.9 | Confident | 151 Ų | 151 | 129.8 Ų | 129.8 | 66% | 0.657 | 70% | 0.699 | S | S | * | * | trans | -90.5 | 156.1 | 177.7 | -65.5 | 176.3 | 179.2 | 171.3 | 0 | 110.8 | D2 | D2-K5 PolarHBondContact O-N 3.23Å; D2-K5 WeakPolarHBondContact OD1-CE 3.42Å; D2-K5 IonicContact OD1-NZ 2.69Å; D2-K5 PolarHBondContact OD1-NZ 3.41Å | ||
| 6 | G | 90.6 | Very high | 90 | Very high | 83 Ų | 83 | 126.9 Ų | 126.9 | 86% | 0.856 | 69% | 0.692 | S | S | * | * | trans | 78.9 | 26.4 | 171.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 7 | L | 92.9 | Very high | 89.9 | Confident | 128 Ų | 128 | 131.9 Ų | 131.9 | 67% | 0.67 | 70% | 0.698 | S | S | * | * | trans | -58.7 | 149.1 | 174.5 | -63.5 | 175.8 | 0 | 0 | 0 | 111.6 | V9 | L7-V9 PolarHBondContact O-N 3.45Š| ||
| 8 | P | 95.8 | Very high | 89.6 | Confident | 103 Ų | 103 | 133 Ų | 133 | 67% | 0.669 | 70% | 0.696 | S | S | * | * | trans | -55.1 | 131.5 | 179.9 | -26.9 | 34.9 | 0 | 0 | 0 | 113 | Y10 | P8-Y10 HydrophobicContact CB-CE2 4.29Š| ||
| 9 | V | 95 | Very high | 89 | Confident | 99 Ų | 99 | 133.7 Ų | 133.7 | 60% | 0.6 | 70% | 0.696 | S | S | * | * | trans | -118.9 | 95.1 | 175.1 | -176.5 | 0 | 0 | 0 | 0 | 109.2 | L7 K12 | L7-V9 PolarHBondContact O-N 3.45Å; V9-K12 HydrophobicContact CG1-CB 4.33Å; V9-K12 HydrophobicContact CG1-CG 3.64Å | ||
| 10 | Y | 95.6 | Very high | 87.9 | Confident | 216 Ų | 216 | 131.1 Ų | 131.1 | 85% | 0.847 | 69% | 0.694 | S | S | * | * | S | Bend | trans | -67.7 | -38.2 | 174.1 | -60.5 | -78.7 | 0 | 0 | 0 | 111.7 | P8 | P8-Y10 HydrophobicContact CB-CE2 4.29Š|
| 11 | N | 95.6 | Very high | 86.6 | Confident | 80 Ų | 80 | 132.1 Ų | 132.1 | 43% | 0.428 | 70% | 0.7 | S | S | . | * | trans | -153.1 | 122.7 | 173.4 | -179.6 | -3.1 | 0 | 0 | 0 | 110.2 | S13 N14 | N11-S13 VanDerWaalsContact CG-OG 3.28Å; N11-S13 PolarHBondContact ND2-OG 3.28Å; N11-S13 PolarHBondContact O-N 3.1Å; N11-S13 PolarHBondContact OD1-N 3.19Å; N11-S13 PolarHBondContact OD1-OG 3.46Å; N11-N14 WeakPolarHBondContact CB-OD1 3.31Å; N11-N14 PolarHBondContact ND2-OD1 2.87Å; N11-N14 PolarHBondContact O-N 3.29Å | ||
| 12 | K | 94.4 | Very high | 86.3 | Confident | 183 Ų | 183 | 130.4 Ų | 130.4 | 80% | 0.796 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.2 | -25.2 | -179.4 | -69.1 | 177.3 | -179.2 | -179.6 | 0 | 112.9 | V9 | V9-K12 HydrophobicContact CG1-CB 4.33Å; V9-K12 HydrophobicContact CG1-CG 3.64Å |
| 13 | S | 95.4 | Very high | 85.3 | Confident | 66 Ų | 66 | 131.1 Ų | 131.1 | 46% | 0.462 | 69% | 0.688 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -79.5 | -25.5 | -176.7 | 68.7 | 0 | 0 | 0 | 0 | 114.1 | N11 F15 S16 | N11-S13 VanDerWaalsContact CG-OG 3.28Å; N11-S13 PolarHBondContact ND2-OG 3.28Å; N11-S13 PolarHBondContact O-N 3.1Å; N11-S13 PolarHBondContact OD1-N 3.19Å; N11-S13 PolarHBondContact OD1-OG 3.46Å; S13-F15 PolarHBondContact O-N 3.31Å; S13-S16 WeakPolarHBondContact CA-OG 3.42Å; S13-S16 PolarHBondContact O-N 2.83Å; S13-S16 VanDerWaalsContact O-N 3.15Å; S13-S16 PolarHBondContact O-OG 3.43Å |
| 14 | N | 92.7 | Very high | 83.7 | Confident | 97 Ų | 97 | 128.3 Ų | 128.3 | 52% | 0.519 | 69% | 0.691 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -50.3 | -39 | -166.9 | -76.3 | -1.9 | 0 | 0 | 0 | 114.5 | N11 | N11-N14 WeakPolarHBondContact CB-OD1 3.31Å; N11-N14 PolarHBondContact ND2-OD1 2.87Å; N11-N14 PolarHBondContact O-N 3.29Å |
| 15 | F | 91 | Very high | 82 | Confident | 165 Ų | 165 | 131 Ų | 131 | 72% | 0.724 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.7 | 2.4 | -178.7 | -62.9 | -77.9 | 0 | 0 | 0 | 113.7 | S13 R17 F18 | S13-F15 PolarHBondContact O-N 3.31Å; F15-R17 PolarHBondContact O-N 3.15Å; F15-R17 VanDerWaalsContact O-N 3.15Å; F15-F18 PolarHBondContact O-N 3.21Å |
| 16 | S | 91.8 | Very high | 80.3 | Confident | 83 Ų | 83 | 128 Ų | 128 | 58% | 0.58 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.2 | -23.5 | -176.5 | 62.6 | 0 | 0 | 0 | 0 | 114.6 | S13 | S13-S16 WeakPolarHBondContact CA-OG 3.42Å; S13-S16 PolarHBondContact O-N 2.83Å; S13-S16 VanDerWaalsContact O-N 3.15Å; S13-S16 PolarHBondContact O-OG 3.43Å |
| 17 | R | 88.1 | Confident | 78.7 | Confident | 212 Ų | 212 | 128 Ų | 128 | 80% | 0.8 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -119 | 10.3 | -176.2 | -63.2 | 177.1 | 64.1 | -171.3 | 0.3 | 113 | F15 H19 | F15-R17 PolarHBondContact O-N 3.15Å; F15-R17 VanDerWaalsContact O-N 3.15Å; R17-H19 PolarHBondContact O-CD2 3.37Å; R17-H19 PolarHBondContact O-N 2.94Å |
| 18 | F | 84.6 | Confident | 77.1 | Confident | 152 Ų | 152 | 129.9 Ų | 129.9 | 67% | 0.667 | 70% | 0.698 | S | S | * | * | trans | -73.9 | 123.2 | 179.8 | 179.1 | -100 | 0 | 0 | 0 | 109.5 | F15 A20 | F15-F18 PolarHBondContact O-N 3.21Å; F18-A20 HydrophobicContact CE1-CB 4.19Å | ||
| 19 | H | 78.1 | Confident | 75.6 | Confident | 147 Ų | 147 | 135.2 Ų | 135.2 | 68% | 0.681 | 71% | 0.705 | S | S | * | * | trans | -125 | 112.5 | 177.5 | -63.4 | -72.9 | 0 | 0 | 0 | 109.3 | R17 D21 | R17-H19 PolarHBondContact O-CD2 3.37Å; R17-H19 PolarHBondContact O-N 2.94Å; H19-D21 VanDerWaalsContact C-N 3.35Å | ||
| 20 | A | 67.5 | Low | 74.7 | Confident | 80 Ų | 80 | 141.2 Ų | 141.2 | 66% | 0.661 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.9 | -28.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | F18 S22 | F18-A20 HydrophobicContact CE1-CB 4.19Å; A20-S22 VanDerWaalsContact C-N 3.33Å; A20-S22 PolarHBondContact O-N 3.41Å |
| 21 | D | 59.7 | Low | 74.2 | Confident | 153 Ų | 153 | 136.6 Ų | 136.6 | 82% | 0.818 | 71% | 0.713 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.5 | 17.8 | -171.3 | -55.2 | -42.9 | 0 | 0 | 0 | 114.1 | H19 V23 | H19-D21 VanDerWaalsContact C-N 3.35Å; D21-V23 PolarHBondContact O-N 3.13Å |
| 22 | S | 56.1 | Low | 73.9 | Confident | 96 Ų | 96 | 138.5 Ų | 138.5 | 67% | 0.671 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -71.3 | 79.3 | 171.3 | -161.9 | 0 | 0 | 0 | 0 | 109.6 | A20 C24 | A20-S22 VanDerWaalsContact C-N 3.33Å; A20-S22 PolarHBondContact O-N 3.41Å; S22-C24 PolarHBondContact O-N 3.5Å |
| 23 | V | 56.4 | Low | 73.9 | Confident | 127 Ų | 127 | 135.2 Ų | 135.2 | 77% | 0.77 | 73% | 0.728 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 17.4 | 85.6 | 164.2 | -159.2 | 0 | 0 | 0 | 0 | 113.6 | D21 K25 | D21-V23 PolarHBondContact O-N 3.13Å; V23-K25 PolarHBondContact O-N 2.92Å |
| 24 | C | 55.3 | Low | 73.9 | Confident | 135 Ų | 135 | 140.6 Ų | 140.6 | 91% | 0.912 | 74% | 0.739 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 10.5 | 55.6 | 160.3 | -70.6 | 0 | 0 | 0 | 0 | 118.1 | S22 | S22-C24 PolarHBondContact O-N 3.5Š|
| 25 | K | 54.4 | Low | 74 | Confident | 195 Ų | 195 | 142.3 Ų | 142.3 | 85% | 0.848 | 75% | 0.747 | S | S | * | * | trans | -131.5 | 31.2 | 157.5 | -65.6 | -168.9 | -176.3 | -179.8 | 0 | 108.9 | V23 S27 | V23-K25 PolarHBondContact O-N 2.92Å; K25-S27 PolarHBondContact O-N 3.45Å | ||
| 26 | A | 55.1 | Low | 74.2 | Confident | 87 Ų | 87 | 138.7 Ų | 138.7 | 72% | 0.719 | 74% | 0.741 | S | S | * | * | trans | -58.9 | 87.5 | 154.5 | 0 | 0 | 0 | 0 | 0 | 105.4 | N28 | A26-N28 PolarHBondContact O-N 3.25Š| ||
| 27 | S | 58.2 | Low | 74.5 | Confident | 85 Ų | 85 | 141.1 Ų | 141.1 | 59% | 0.594 | 75% | 0.752 | S | S | * | * | trans | -41.8 | 118.4 | 170.9 | -176.1 | 0 | 0 | 0 | 0 | 105.3 | K25 R29 | K25-S27 PolarHBondContact O-N 3.45Å; S27-R29 PolarHBondContact O-N 3.29Å; S27-R29 WeakPolarHBondContact OG-CB 3.2Å; S27-R29 PolarHBondContact OG-N 3.37Å | ||
| 28 | N | 57.5 | Low | 74.9 | Confident | 166 Ų | 166 | 139.5 Ų | 139.5 | 89% | 0.888 | 75% | 0.746 | S | S | * | * | trans | -59.8 | 32.3 | 162.1 | -69.1 | -61.1 | 0 | 0 | 0 | 111 | A26 R30 | A26-N28 PolarHBondContact O-N 3.25Å; N28-R30 PolarHBondContact O-N 3.06Å | ||
| 29 | R | 64.6 | Low | 75.4 | Confident | 215 Ų | 215 | 141.6 Ų | 141.6 | 81% | 0.811 | 76% | 0.758 | S | S | * | * | trans | -67 | 93.5 | 167.8 | -118 | -178.7 | 171.2 | 179.7 | -2.3 | 105.5 | S27 | S27-R29 PolarHBondContact O-N 3.29Å; S27-R29 WeakPolarHBondContact OG-CB 3.2Å; S27-R29 PolarHBondContact OG-N 3.37Å | ||
| 30 | R | 76.1 | Confident | 76.2 | Confident | 225 Ų | 225 | 142.6 Ų | 142.6 | 85% | 0.849 | 76% | 0.757 | S | S | * | * | trans | -40.5 | 133.2 | 155.5 | -63.3 | 179.6 | 177.4 | -177.9 | -1.9 | 107.2 | N28 S32 | N28-R30 PolarHBondContact O-N 3.06Å; R30-S32 PolarHBondContact O-N 3.42Å | ||
| 31 | P | 85.8 | Confident | 77.6 | Confident | 119 Ų | 119 | 144.7 Ų | 144.7 | 77% | 0.773 | 76% | 0.764 | S | S | * | * | trans | -45.1 | 142.6 | 171.6 | -28.5 | 35 | 0 | 0 | 0 | 109.9 | V33 | P31-V33 PolarHBondContact O-N 3.46Š| ||
| 32 | S | 89 | Confident | 79.4 | Confident | 121 Ų | 121 | 142.2 Ų | 142.2 | 85% | 0.846 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 134.5 | 175.7 | -175 | 0 | 0 | 0 | 0 | 109.2 | R30 | R30-S32 PolarHBondContact O-N 3.42Š|
| 33 | V | 94.1 | Very high | 81.3 | Confident | 114 Ų | 114 | 147 Ų | 147 | 69% | 0.691 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -74 | 137.1 | 178.8 | 179.7 | 0 | 0 | 0 | 0 | 108.3 | P31 L35 | P31-V33 PolarHBondContact O-N 3.46Å; V33-L35 WeakPolarHBondContact O-CD1 3.47Å; V33-L35 PolarHBondContact O-N 2.86Å |
| 34 | Y | 95.4 | Very high | 83.3 | Confident | 179 Ų | 179 | 149.2 Ų | 149.2 | 70% | 0.702 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -74.1 | 120.7 | 170.5 | 176.1 | -117.3 | 0 | 0 | 0 | 109.6 | P36 | Y34-P36 HydrophobicContact CD1-CG 3.89Å; Y34-P36 HydrophobicContact CE1-CB 3.86Å; Y34-P36 HydrophobicContact CE1-CG 3.54Å; Y34-P36 WeakPolarHBondContact O-CD 3.41Å |
| 35 | L | 95.6 | Very high | 85.3 | Confident | 132 Ų | 132 | 149.4 Ų | 149.4 | 69% | 0.691 | 76% | 0.763 | S | S | * | * | trans | -105.4 | 101.6 | 171 | -68.2 | 95.6 | 0 | 0 | 0 | 108.8 | V33 T37 | V33-L35 WeakPolarHBondContact O-CD1 3.47Å; V33-L35 PolarHBondContact O-N 2.86Å; L35-T37 PolarHBondContact O-N 3.44Å | ||
| 36 | P | 95.6 | Very high | 87.3 | Confident | 90 Ų | 90 | 148.4 Ų | 148.4 | 58% | 0.584 | 77% | 0.765 | S | S | * | * | trans | -62.7 | 123.2 | 175.6 | -9.6 | 20.2 | 0 | 0 | 0 | 110.2 | Y34 | Y34-P36 HydrophobicContact CD1-CG 3.89Å; Y34-P36 HydrophobicContact CE1-CB 3.86Å; Y34-P36 HydrophobicContact CE1-CG 3.54Å; Y34-P36 WeakPolarHBondContact O-CD 3.41Å | ||
| 37 | T | 97.1 | Very high | 89.4 | Confident | 133 Ų | 133 | 149.7 Ų | 149.7 | 82% | 0.816 | 76% | 0.763 | S | S | * | * | trans | -110.2 | -10.7 | 178.6 | 51.6 | 0 | 0 | 0 | 0 | 113.5 | L35 | L35-T37 PolarHBondContact O-N 3.44Š| ||
| 38 | R | 96.9 | Very high | 91.3 | Very high | 179 Ų | 179 | 152 Ų | 152 | 68% | 0.675 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -129.1 | 136.3 | 179.4 | -64.1 | -177.5 | -179.6 | 178.1 | -0.5 | 108.3 | Y40 | R38-Y40 HydrophobicContact CB-CE2 3.82Å; R38-Y40 WeakPolarHBondContact CD-OH 3.4Å |
| 39 | E | 94.5 | Very high | 93.2 | Very high | 196 Ų | 196 | 149.7 Ų | 149.7 | 92% | 0.916 | 76% | 0.758 | S | S | * | * | trans | -87.2 | 135.9 | 172.2 | -64.1 | -169.2 | 170.8 | 0 | 0 | 109.7 | ||||
| 40 | Y | 96.4 | Very high | 94.8 | Very high | 167 Ų | 167 | 149.4 Ų | 149.4 | 66% | 0.655 | 76% | 0.763 | S | S | * | * | trans | -125.1 | 126.5 | 172.1 | -63.1 | -80.2 | 0 | 0 | 0 | 107.4 | R38 | R38-Y40 HydrophobicContact CB-CE2 3.82Å; R38-Y40 WeakPolarHBondContact CD-OH 3.4Å | ||
| 41 | P | 96.2 | Very high | 95.8 | Very high | 125 Ų | 125 | 141.4 Ų | 141.4 | 81% | 0.812 | 74% | 0.739 | S | S | * | * | trans | -68.6 | 142.6 | -178.8 | 28.4 | -34.1 | 0 | 0 | 0 | 110.9 | ||||
| 42 | S | 96.6 | Very high | 96.4 | Very high | 101 Ų | 101 | 140.2 Ų | 140.2 | 71% | 0.706 | 73% | 0.726 | S | S | * | * | trans | -73.1 | 135.3 | 171.8 | -60.3 | 0 | 0 | 0 | 0 | 110.6 | Q44 | S42-Q44 VanDerWaalsContact C-N 3.32Š| ||
| 43 | E | 97.5 | Very high | 96.8 | Very high | 197 Ų | 197 | 140.4 Ų | 140.4 | 92% | 0.921 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -69.6 | -30.5 | 176.6 | -65.1 | -179.2 | 179.7 | 0 | 0 | 112.8 | ||
| 44 | Q | 97.8 | Very high | 97 | Very high | 172 Ų | 172 | 140 Ų | 140 | 80% | 0.804 | 71% | 0.71 | S | S | * | * | trans | -138.8 | 154.5 | -177.3 | -64.3 | -177.4 | -13.1 | 0 | 0 | 110.7 | S42 | S42-Q44 VanDerWaalsContact C-N 3.32Š| ||
| 45 | I | 96.6 | Very high | 97.1 | Very high | 139 Ų | 139 | 136.1 Ų | 136.1 | 71% | 0.713 | 70% | 0.7 | S | S | * | * | trans | -122 | 142.7 | 175.3 | 61.3 | 165.8 | 0 | 0 | 0 | 110.3 | V47 | I45-V47 HydrophobicContact CD1-CG1 3.85Å; I45-V47 HydrophobicContact CG1-CG1 4.01Å | ||
| 46 | I | 97.5 | Very high | 97.2 | Very high | 175 Ų | 175 | 135.2 Ų | 135.2 | 90% | 0.897 | 69% | 0.688 | S | S | * | * | trans | -81.6 | 122.2 | 173.7 | -62.5 | 165.4 | 0 | 0 | 0 | 107.8 | ||||
| 47 | V | 98.3 | Very high | 97.3 | Very high | 113 Ų | 113 | 137.1 Ų | 137.1 | 69% | 0.685 | 68% | 0.684 | S | S | * | * | trans | -118.4 | 145.1 | 177.1 | -62 | 0 | 0 | 0 | 0 | 110.7 | I45 | I45-V47 HydrophobicContact CD1-CG1 3.85Å; I45-V47 HydrophobicContact CG1-CG1 4.01Å | ||
| 48 | T | 98.1 | Very high | 97.4 | Very high | 135 Ų | 135 | 135 Ų | 135 | 83% | 0.828 | 67% | 0.668 | S | S | * | * | trans | -97.3 | 144.4 | 172 | 51.8 | 0 | 0 | 0 | 0 | 110.1 | K50 | T48-K50 PolarHBondContact O-N 3.24Š| ||
| 49 | E | 97.6 | Very high | 97.4 | Very high | 117 Ų | 117 | 132.2 Ų | 132.2 | 55% | 0.547 | 66% | 0.662 | S | S | . | * | trans | -68 | 126.6 | 175.4 | -168.2 | 179.7 | 176.2 | 0 | 0 | 109.8 | T51 R56 | E49-T51 HydrophobicContact CG-CG2 4.14Å; E49-T51 WeakPolarHBondContact CG-OG1 3.21Å; E49-T51 PolarHBondContact O-N 3.24Å; E49-T51 PolarHBondContact OE1-OG1 3.43Å; E49-R56 WeakPolarHBondContact OE1-CD 3.2Å; E49-R56 WeakPolarHBondContact OE2-CD 3.39Å; E49-R56 IonicContact OE2-CZ 3.65Å; E49-R56 IonicContact OE2-NE 3.95Å; E49-R56 IonicContact OE2-NH1 2.62Å; E49-R56 PolarHBondContact OE2-NH1 3.46Å | ||
| 50 | K | 97.5 | Very high | 97.5 | Very high | 209 Ų | 209 | 127.5 Ų | 127.5 | 91% | 0.909 | 64% | 0.64 | S | S | * | * | trans | -72.8 | -14.9 | -178.1 | 65.6 | 179.8 | 179 | -179.1 | 0 | 114.2 | T48 | T48-K50 PolarHBondContact O-N 3.24Š| ||
| 51 | T | 97.6 | Very high | 97.5 | Very high | 57 Ų | 57 | 123.4 Ų | 123.4 | 35% | 0.35 | 63% | 0.627 | S | S | . | * | S | Bend | trans | -74 | 135.9 | -172.6 | 63.3 | 0 | 0 | 0 | 0 | 110.6 | E49 I53 | E49-T51 HydrophobicContact CG-CG2 4.14Å; E49-T51 WeakPolarHBondContact CG-OG1 3.21Å; E49-T51 PolarHBondContact O-N 3.24Å; E49-T51 PolarHBondContact OE1-OG1 3.43Å; T51-I53 PolarHBondContact O-N 2.89Å |
| 52 | N | 98 | Very high | 97.4 | Very high | 94 Ų | 94 | 125.1 Ų | 125.1 | 50% | 0.503 | 62% | 0.617 | S | S | . | * | trans | -60.3 | 135.7 | 169.9 | -177 | -82.3 | 0 | 0 | 0 | 110.5 | L54 L55 R56 | N52-L54 VanDerWaalsContact C-N 3.27Å; N52-L54 PolarHBondContact O-N 3.47Å; N52-L54 VanDerWaalsContact OD1-CB 3.31Å; N52-L54 WeakPolarHBondContact OD1-CB 3.35Å; N52-L54 PolarHBondContact OD1-N 2.99Å; N52-L55 HydrophobicContact CB-CB 4.37Å; N52-L55 HydrophobicContact CB-CD1 4.17Å; N52-L55 HydrophobicContact CB-CG 4.29Å; N52-L55 PolarHBondContact O-N 3.3Å; N52-R56 PolarHBondContact O-N 3.35Å | ||
| 53 | I | 98.2 | Very high | 97.3 | Very high | 124 Ų | 124 | 125.2 Ų | 125.2 | 64% | 0.636 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -60.9 | -33.5 | -174.9 | 58.2 | 170 | 0 | 0 | 0 | 113.4 | T51 Y57 | T51-I53 PolarHBondContact O-N 2.89Å; I53-Y57 PolarHBondContact O-N 3.18Å; I53-Y57 VanDerWaalsContact O-N 3.11Å |
| 54 | L | 98.1 | Very high | 97.1 | Very high | 106 Ų | 106 | 121.2 Ų | 121.2 | 56% | 0.555 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -70.3 | -45.8 | 178.1 | 178.7 | 60.9 | 0 | 0 | 0 | 110.5 | N52 Y57 L58 | N52-L54 VanDerWaalsContact C-N 3.27Å; N52-L54 PolarHBondContact O-N 3.47Å; N52-L54 VanDerWaalsContact OD1-CB 3.31Å; N52-L54 WeakPolarHBondContact OD1-CB 3.35Å; N52-L54 PolarHBondContact OD1-N 2.99Å; L54-Y57 WeakPolarHBondContact O-CB 3.48Å; L54-Y57 PolarHBondContact O-N 3.44Å; L54-L58 HydrophobicContact CD1-CD1 4.34Å; L54-L58 HydrophobicContact CD1-CG 4.34Å; L54-L58 HydrophobicContact CG-CD1 4.19Å; L54-L58 WeakPolarHBondContact O-CG 3.35Å; L54-L58 PolarHBondContact O-N 3.14Å |
| 55 | L | 98.1 | Very high | 96.9 | Very high | 97 Ų | 97 | 119.4 Ų | 119.4 | 51% | 0.508 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -63 | -43.2 | 177.7 | -69 | 177.9 | 0 | 0 | 0 | 111.8 | N52 Y57 L58 H59 | N52-L55 HydrophobicContact CB-CB 4.37Å; N52-L55 HydrophobicContact CB-CD1 4.17Å; N52-L55 HydrophobicContact CB-CG 4.29Å; N52-L55 PolarHBondContact O-N 3.3Å; L55-Y57 VanDerWaalsContact C-N 3.29Å; L55-Y57 PolarHBondContact O-N 3.45Å; L55-L58 PolarHBondContact O-N 2.84Å; L55-H59 WeakPolarHBondContact O-CB 3.48Å; L55-H59 PolarHBondContact O-N 3.04Å |
| 56 | R | 97.8 | Very high | 96.5 | Very high | 114 Ų | 114 | 114.8 Ų | 114.8 | 43% | 0.43 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -57.2 | -44.1 | 175 | -172.8 | 175.4 | 63.7 | -171.4 | -2.5 | 111.3 | E49 N52 Q60 | E49-R56 WeakPolarHBondContact OE1-CD 3.2Å; E49-R56 WeakPolarHBondContact OE2-CD 3.39Å; E49-R56 IonicContact OE2-CZ 3.65Å; E49-R56 IonicContact OE2-NE 3.95Å; E49-R56 IonicContact OE2-NH1 2.62Å; E49-R56 PolarHBondContact OE2-NH1 3.46Å; N52-R56 PolarHBondContact O-N 3.35Å; R56-Q60 VanDerWaalsContact O-CB 3.26Å; R56-Q60 WeakPolarHBondContact O-CB 3.48Å; R56-Q60 PolarHBondContact O-N 2.94Å |
| 57 | Y | 98.1 | Very high | 95.8 | Very high | 129 Ų | 129 | 109.4 Ų | 109.4 | 51% | 0.506 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -63.2 | -48.5 | 176.5 | 176.5 | -97.9 | 0 | 0 | 0 | 112.3 | I53 L54 L55 Q60 Q61 | I53-Y57 PolarHBondContact O-N 3.18Å; I53-Y57 VanDerWaalsContact O-N 3.11Å; L54-Y57 WeakPolarHBondContact O-CB 3.48Å; L54-Y57 PolarHBondContact O-N 3.44Å; L55-Y57 VanDerWaalsContact C-N 3.29Å; L55-Y57 PolarHBondContact O-N 3.45Å; Y57-Q60 PolarHBondContact O-N 3.31Å; Y57-Q61 HydrophobicContact CD1-CG 4.24Å; Y57-Q61 HydrophobicContact CD2-CG 4.45Å; Y57-Q61 HydrophobicContact CE1-CG 3.76Å; Y57-Q61 HydrophobicContact CE2-CG 4.01Å; Y57-Q61 WeakPolarHBondContact O-CG 3.47Å; Y57-Q61 PolarHBondContact O-N 3Å |
| 58 | L | 98.1 | Very high | 94.6 | Very high | 90 Ų | 90 | 106.6 Ų | 106.6 | 47% | 0.471 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.6 | -44.9 | -179 | -68.7 | 174.8 | 0 | 0 | 0 | 112 | L54 L55 Q60 Q61 W62 | L54-L58 HydrophobicContact CD1-CD1 4.34Å; L54-L58 HydrophobicContact CD1-CG 4.34Å; L54-L58 HydrophobicContact CG-CD1 4.19Å; L54-L58 WeakPolarHBondContact O-CG 3.35Å; L54-L58 PolarHBondContact O-N 3.14Å; L55-L58 PolarHBondContact O-N 2.84Å; L58-Q60 VanDerWaalsContact C-N 3.35Å; L58-Q60 PolarHBondContact O-N 3.25Å; L58-Q61 PolarHBondContact O-N 3.49Å; L58-W62 WeakPolarHBondContact O-CB 3.43Å; L58-W62 PolarHBondContact O-N 2.91Å |
| 59 | H | 97 | Very high | 93.1 | Very high | 119 Ų | 119 | 105.8 Ų | 105.8 | 55% | 0.551 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -59.9 | -45.4 | 174 | -72.9 | 178.9 | 0 | 0 | 0 | 111.4 | L55 Q61 W62 D63 | L55-H59 WeakPolarHBondContact O-CB 3.48Å; L55-H59 PolarHBondContact O-N 3.04Å; H59-Q61 VanDerWaalsContact C-N 3.32Å; H59-Q61 PolarHBondContact O-N 3.15Å; H59-W62 WeakPolarHBondContact O-CB 3.46Å; H59-W62 PolarHBondContact O-N 3.35Å; H59-W62 VanDerWaalsContact O-N 3.15Å; H59-D63 WeakPolarHBondContact O-CB 3.42Å; H59-D63 VanDerWaalsContact O-CG 3.3Å; H59-D63 PolarHBondContact O-N 3.26Å |
| 60 | Q | 96.6 | Very high | 91.6 | Very high | 97 Ų | 97 | 107.2 Ų | 107.2 | 45% | 0.453 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.1 | -40 | 178.4 | -170.1 | -175.6 | 25.9 | 0 | 0 | 112.4 | R56 Y57 L58 K64 | R56-Q60 VanDerWaalsContact O-CB 3.26Å; R56-Q60 WeakPolarHBondContact O-CB 3.48Å; R56-Q60 PolarHBondContact O-N 2.94Å; Y57-Q60 PolarHBondContact O-N 3.31Å; L58-Q60 VanDerWaalsContact C-N 3.35Å; L58-Q60 PolarHBondContact O-N 3.25Å; Q60-K64 HydrophobicContact CG-CD 4.36Å; Q60-K64 WeakPolarHBondContact O-CB 3.26Å; Q60-K64 WeakPolarHBondContact O-CD 3.39Å; Q60-K64 WeakPolarHBondContact O-CG 3.39Å; Q60-K64 PolarHBondContact O-N 3.38Å; Q60-K64 VanDerWaalsContact O-N 3.14Å |
| 61 | Q | 96.3 | Very high | 89.8 | Confident | 82 Ų | 82 | 106.1 Ų | 106.1 | 38% | 0.383 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -66.9 | -41.5 | 175.5 | -70.2 | -61.6 | -34.8 | 0 | 0 | 111.7 | Y57 L58 H59 K65 | Y57-Q61 HydrophobicContact CD1-CG 4.24Å; Y57-Q61 HydrophobicContact CD2-CG 4.45Å; Y57-Q61 HydrophobicContact CE1-CG 3.76Å; Y57-Q61 HydrophobicContact CE2-CG 4.01Å; Y57-Q61 WeakPolarHBondContact O-CG 3.47Å; Y57-Q61 PolarHBondContact O-N 3Å; L58-Q61 PolarHBondContact O-N 3.49Å; H59-Q61 VanDerWaalsContact C-N 3.32Å; H59-Q61 PolarHBondContact O-N 3.15Å; Q61-K65 WeakPolarHBondContact O-CB 3.49Å; Q61-K65 PolarHBondContact O-N 2.92Å |
| 62 | W | 95.1 | Very high | 87.9 | Confident | 161 Ų | 161 | 108 Ų | 108 | 61% | 0.61 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -62.7 | -49 | 177.7 | -178.3 | -98.4 | 0 | 0 | 0 | 112.1 | L58 H59 K64 K65 N66 | L58-W62 WeakPolarHBondContact O-CB 3.43Å; L58-W62 PolarHBondContact O-N 2.91Å; H59-W62 WeakPolarHBondContact O-CB 3.46Å; H59-W62 PolarHBondContact O-N 3.35Å; H59-W62 VanDerWaalsContact O-N 3.15Å; W62-K64 VanDerWaalsContact C-N 3.35Å; W62-K64 PolarHBondContact O-N 2.94Å; W62-K65 PolarHBondContact O-N 2.95Å; W62-N66 VanDerWaalsContact CD1-ND2 3.28Å; W62-N66 PolarHBondContact NE1-ND2 3.2Å; W62-N66 PolarHBondContact O-N 3.26Å; W62-N66 PolarHBondContact O-ND2 2.96Å |
| 63 | D | 94 | Very high | 85.9 | Confident | 103 Ų | 103 | 109 Ų | 109 | 55% | 0.551 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -62.5 | -42.1 | 179.7 | -68.6 | -20.8 | 0 | 0 | 0 | 111.4 | H59 K65 N66 A67 | H59-D63 WeakPolarHBondContact O-CB 3.42Å; H59-D63 VanDerWaalsContact O-CG 3.3Å; H59-D63 PolarHBondContact O-N 3.26Å; D63-K65 PolarHBondContact O-N 3.11Å; D63-N66 PolarHBondContact O-N 3.25Å; D63-A67 WeakPolarHBondContact O-CB 3.4Å; D63-A67 PolarHBondContact O-N 3.35Å |
| 64 | K | 93.9 | Very high | 83.8 | Confident | 113 Ų | 113 | 109.1 Ų | 109.1 | 49% | 0.491 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59.3 | -45.1 | 173.7 | -76.7 | 172.9 | -178.7 | 176 | 0 | 112.1 | Q60 W62 N66 A67 A68 | Q60-K64 HydrophobicContact CG-CD 4.36Å; Q60-K64 WeakPolarHBondContact O-CB 3.26Å; Q60-K64 WeakPolarHBondContact O-CD 3.39Å; Q60-K64 WeakPolarHBondContact O-CG 3.39Å; Q60-K64 PolarHBondContact O-N 3.38Å; Q60-K64 VanDerWaalsContact O-N 3.14Å; W62-K64 VanDerWaalsContact C-N 3.35Å; W62-K64 PolarHBondContact O-N 2.94Å; K64-N66 VanDerWaalsContact C-N 3.32Å; K64-N66 PolarHBondContact O-N 2.62Å; K64-A67 PolarHBondContact O-N 3.35Å; K64-A68 PolarHBondContact O-N 3.43Å |
| 65 | K | 91.9 | Very high | 81.6 | Confident | 133 Ų | 133 | 110.1 Ų | 110.1 | 58% | 0.578 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -64.3 | -36.9 | 179.1 | -174.3 | 175.6 | -178.3 | 177.2 | 0 | 112 | Q61 W62 D63 K69 | Q61-K65 WeakPolarHBondContact O-CB 3.49Å; Q61-K65 PolarHBondContact O-N 2.92Å; W62-K65 PolarHBondContact O-N 2.95Å; D63-K65 PolarHBondContact O-N 3.11Å; K65-K69 PolarHBondContact O-N 3.45Å |
| 66 | N | 88.2 | Confident | 79.4 | Confident | 43 Ų | 43 | 110.2 Ų | 110.2 | 23% | 0.23 | 52% | 0.519 | C | S | . | . | H | α-helix | trans | -80.5 | -30.4 | 179.5 | -68.6 | -29.8 | 0 | 0 | 0 | 113.1 | W62 D63 K64 A68 K69 K70 | W62-N66 VanDerWaalsContact CD1-ND2 3.28Å; W62-N66 PolarHBondContact NE1-ND2 3.2Å; W62-N66 PolarHBondContact O-N 3.26Å; W62-N66 PolarHBondContact O-ND2 2.96Å; D63-N66 PolarHBondContact O-N 3.25Å; K64-N66 VanDerWaalsContact C-N 3.32Å; K64-N66 PolarHBondContact O-N 2.62Å; N66-A68 VanDerWaalsContact C-N 3.28Å; N66-A68 PolarHBondContact O-N 2.94Å; N66-K69 PolarHBondContact O-N 3.36Å; N66-K70 PolarHBondContact O-N 3.32Å |
| 67 | A | 84.6 | Confident | 77.2 | Confident | 62 Ų | 62 | 110.2 Ų | 110.2 | 51% | 0.512 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -61.6 | -38.1 | 171.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | D63 K64 K70 R71 | D63-A67 WeakPolarHBondContact O-CB 3.4Å; D63-A67 PolarHBondContact O-N 3.35Å; K64-A67 PolarHBondContact O-N 3.35Å; A67-K70 PolarHBondContact O-N 2.97Å; A67-R71 PolarHBondContact O-N 2.96Å |
| 68 | A | 72.6 | Confident | 75.2 | Confident | 54 Ų | 54 | 110.3 Ų | 110.3 | 45% | 0.446 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.5 | -43.8 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112 | K64 N66 K70 R71 D72 | K64-A68 PolarHBondContact O-N 3.43Å; N66-A68 VanDerWaalsContact C-N 3.28Å; N66-A68 PolarHBondContact O-N 2.94Å; A68-K70 PolarHBondContact O-N 3.29Å; A68-R71 PolarHBondContact O-N 3.05Å; A68-D72 PolarHBondContact O-N 3.43Å |
| 69 | K | 66.1 | Low | 72.9 | Confident | 118 Ų | 118 | 113.7 Ų | 113.7 | 51% | 0.513 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -63.9 | -37.2 | 178.2 | -70.3 | -179.5 | 174.5 | -171.1 | 0 | 113.5 | K65 N66 R71 D72 Q73 | K65-K69 PolarHBondContact O-N 3.45Å; N66-K69 PolarHBondContact O-N 3.36Å; K69-R71 VanDerWaalsContact C-N 3.33Å; K69-D72 PolarHBondContact O-N 3.31Å; K69-Q73 WeakPolarHBondContact O-CB 3.31Å; K69-Q73 PolarHBondContact O-N 3.36Å |
| 70 | K | 66.3 | Low | 70.5 | Confident | 146 Ų | 146 | 109.8 Ų | 109.8 | 64% | 0.635 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -65 | -37 | 177.9 | -72.7 | -175.2 | 175 | -169.8 | 0 | 112.2 | N66 A67 A68 E74 | N66-K70 PolarHBondContact O-N 3.32Å; A67-K70 PolarHBondContact O-N 2.97Å; A68-K70 PolarHBondContact O-N 3.29Å; K70-E74 WeakPolarHBondContact O-CG 3.49Å; K70-E74 PolarHBondContact O-N 2.83Å; K70-E74 VanDerWaalsContact O-N 3.13Å |
| 71 | R | 59.8 | Low | 68.1 | Low | 187 Ų | 187 | 113.4 Ų | 113.4 | 71% | 0.706 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -66.8 | -43 | 176.3 | -174.7 | 179.9 | -66.8 | 171.1 | -1.6 | 112.4 | A67 A68 K69 Q75 | A67-R71 PolarHBondContact O-N 2.96Å; A68-R71 PolarHBondContact O-N 3.05Å; K69-R71 VanDerWaalsContact C-N 3.33Å; R71-Q75 PolarHBondContact O-N 3.15Å |
| 72 | D | 56.8 | Low | 65.7 | Low | 96 Ų | 96 | 117.3 Ų | 117.3 | 51% | 0.513 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -71.4 | -34.6 | 178.5 | -67.8 | -10.9 | 0 | 0 | 0 | 111.3 | A68 K69 Q75 V76 | A68-D72 PolarHBondContact O-N 3.43Å; K69-D72 PolarHBondContact O-N 3.31Å; D72-Q75 PolarHBondContact O-N 3.04Å; D72-V76 WeakPolarHBondContact O-CG2 3.37Å; D72-V76 PolarHBondContact O-N 2.89Å |
| 73 | Q | 56.5 | Low | 63.5 | Low | 114 Ų | 114 | 114 Ų | 114 | 53% | 0.533 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -66.6 | -36 | 177.6 | -168.8 | 159 | 20.4 | 0 | 0 | 112.3 | K69 Q75 V76 E77 | K69-Q73 WeakPolarHBondContact O-CB 3.31Å; K69-Q73 PolarHBondContact O-N 3.36Å; Q73-Q75 VanDerWaalsContact C-N 3.34Å; Q73-Q75 PolarHBondContact O-N 3.21Å; Q73-V76 PolarHBondContact O-N 3.38Å; Q73-E77 WeakPolarHBondContact O-CB 3.47Å; Q73-E77 WeakPolarHBondContact O-CG 3.39Å; Q73-E77 PolarHBondContact O-N 3.26Å |
| 74 | E | 53.6 | Low | 61.1 | Low | 128 Ų | 128 | 113.4 Ų | 113.4 | 60% | 0.598 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -64.3 | -35.9 | 171.6 | -75.5 | 173.4 | -178.6 | 0 | 0 | 112.3 | K70 I78 | K70-E74 WeakPolarHBondContact O-CG 3.49Å; K70-E74 PolarHBondContact O-N 2.83Å; K70-E74 VanDerWaalsContact O-N 3.13Å; E74-I78 VanDerWaalsContact O-CD1 3.31Å; E74-I78 WeakPolarHBondContact O-CD1 3.48Å; E74-I78 WeakPolarHBondContact O-CG1 3.48Å; E74-I78 PolarHBondContact O-N 3.41Å |
| 75 | Q | 53.2 | Low | 58.9 | Low | 126 Ų | 126 | 113.4 Ų | 113.4 | 59% | 0.589 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -70.5 | -40.4 | 173.7 | -82 | -176.4 | -16.7 | 0 | 0 | 112.6 | R71 D72 Q73 I78 E79 | R71-Q75 PolarHBondContact O-N 3.15Å; D72-Q75 PolarHBondContact O-N 3.04Å; Q73-Q75 VanDerWaalsContact C-N 3.34Å; Q73-Q75 PolarHBondContact O-N 3.21Å; Q75-I78 PolarHBondContact O-N 3.15Å; Q75-E79 PolarHBondContact O-N 3.43Å; Q75-E79 VanDerWaalsContact O-N 3.15Å |
| 76 | V | 51.9 | Low | 57.3 | Low | 100 Ų | 100 | 113 Ų | 113 | 61% | 0.606 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -71.7 | -31.8 | 179 | 174.5 | 0 | 0 | 0 | 0 | 112 | D72 Q73 G80 | D72-V76 WeakPolarHBondContact O-CG2 3.37Å; D72-V76 PolarHBondContact O-N 2.89Å; Q73-V76 PolarHBondContact O-N 3.38Å; V76-G80 WeakPolarHBondContact O-CA 3.36Å; V76-G80 PolarHBondContact O-N 2.68Å |
| 77 | E | 51.5 | Low | 55.9 | Low | 113 Ų | 113 | 122.3 Ų | 122.3 | 53% | 0.528 | 64% | 0.643 | S | S | . | * | H | α-helix | trans | -68.1 | -39.7 | 173.4 | -79.4 | 177.6 | 178.9 | 0 | 0 | 111.5 | Q73 E79 G80 E81 | Q73-E77 WeakPolarHBondContact O-CB 3.47Å; Q73-E77 WeakPolarHBondContact O-CG 3.39Å; Q73-E77 PolarHBondContact O-N 3.26Å; E77-E79 PolarHBondContact O-N 3.29Å; E77-G80 PolarHBondContact O-N 3.3Å; E77-E81 WeakPolarHBondContact O-CG 3.36Å; E77-E81 PolarHBondContact O-N 3.15Å; E77-E81 VanDerWaalsContact O-N 3.1Å |
| 78 | I | 54.7 | Low | 54.7 | Low | 132 Ų | 132 | 129.4 Ų | 129.4 | 68% | 0.677 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -65.9 | -36.5 | 176.1 | -64.4 | 165.3 | 0 | 0 | 0 | 111.8 | E74 Q75 | E74-I78 VanDerWaalsContact O-CD1 3.31Å; E74-I78 WeakPolarHBondContact O-CD1 3.48Å; E74-I78 WeakPolarHBondContact O-CG1 3.48Å; E74-I78 PolarHBondContact O-N 3.41Å; Q75-I78 PolarHBondContact O-N 3.15Å |
| 79 | E | 49.5 | Very low | 54.3 | Low | 160 Ų | 160 | 134.4 Ų | 134.4 | 75% | 0.748 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -81.1 | -25.7 | 176.2 | -67.7 | -174.6 | 169.6 | 0 | 0 | 113 | Q75 E77 | Q75-E79 PolarHBondContact O-N 3.43Å; Q75-E79 VanDerWaalsContact O-N 3.15Å; E77-E79 PolarHBondContact O-N 3.29Å |
| 80 | G | 47.4 | Very low | 53.6 | Low | 38 Ų | 38 | 132.9 Ų | 132.9 | 39% | 0.392 | 69% | 0.69 | S | S | . | * | H | α-helix | trans | -84.9 | -20.2 | -177.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | V76 E77 N82 S83 | V76-G80 WeakPolarHBondContact O-CA 3.36Å; V76-G80 PolarHBondContact O-N 2.68Å; E77-G80 PolarHBondContact O-N 3.3Å; G80-N82 PolarHBondContact O-N 2.69Å; G80-S83 PolarHBondContact O-N 3Å |
| 81 | E | 45.9 | Very low | 53.1 | Low | 173 Ų | 173 | 137.8 Ų | 137.8 | 81% | 0.808 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.1 | -12 | 176.9 | -81.9 | -173.5 | 162.1 | 0 | 0 | 113.9 | E77 | E77-E81 WeakPolarHBondContact O-CG 3.36Å; E77-E81 PolarHBondContact O-N 3.15Å; E77-E81 VanDerWaalsContact O-N 3.1Å |
| 82 | N | 46.7 | Very low | 52.8 | Low | 163 Ų | 163 | 134.7 Ų | 134.7 | 87% | 0.872 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.2 | 7.3 | 176.4 | -130.7 | -11.5 | 0 | 0 | 0 | 114.4 | G80 | G80-N82 PolarHBondContact O-N 2.69Š|
| 83 | S | 47.8 | Very low | 52.3 | Low | 91 Ų | 91 | 137.1 Ų | 137.1 | 64% | 0.636 | 72% | 0.719 | S | S | * | * | S | Bend | trans | -126.4 | 112.2 | 168.5 | 84 | 0 | 0 | 0 | 0 | 110.3 | G80 | G80-S83 PolarHBondContact O-N 3Š|
| 84 | A | 43.1 | Very low | 52.3 | Low | 92 Ų | 92 | 137.1 Ų | 137.1 | 76% | 0.76 | 73% | 0.732 | S | S | * | * | trans | -54.4 | 143.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 85 | P | 48.4 | Very low | 52.1 | Low | 113 Ų | 113 | 138.4 Ų | 138.4 | 73% | 0.734 | 74% | 0.738 | S | S | * | * | trans | -67.8 | 138.5 | -174.6 | -10.3 | 23.8 | 0 | 0 | 0 | 111.2 | R87 | P85-R87 PolarHBondContact O-N 3.19Å; P85-R87 VanDerWaalsContact O-N 3.11Å | ||
| 86 | P | 57.9 | Low | 51.6 | Low | 124 Ų | 124 | 137.6 Ų | 137.6 | 81% | 0.805 | 74% | 0.738 | S | S | * | * | trans | -70.3 | 110.9 | 176.3 | 28 | -31.2 | 0 | 0 | 0 | 109.5 | K88 | P86-K88 PolarHBondContact O-N 2.69Š| ||
| 87 | R | 60 | Low | 51.4 | Low | 238 Ų | 238 | 140.1 Ų | 140.1 | 90% | 0.898 | 75% | 0.745 | S | S | * | * | trans | -66.5 | 113.3 | 171.9 | -74.3 | -175.9 | -96.1 | -170.8 | -5.4 | 109.1 | P85 I89 | P85-R87 PolarHBondContact O-N 3.19Å; P85-R87 VanDerWaalsContact O-N 3.11Å; R87-I89 PolarHBondContact O-N 3.36Å | ||
| 88 | K | 58.8 | Low | 51.1 | Low | 211 Ų | 211 | 143 Ų | 143 | 92% | 0.917 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 122.5 | 171.9 | -73.9 | -175.2 | 176.5 | -178.8 | 0 | 109.7 | P86 | P86-K88 PolarHBondContact O-N 2.69Š|
| 89 | I | 63.3 | Low | 50.9 | Low | 160 Ų | 160 | 144.7 Ų | 144.7 | 82% | 0.821 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -93.5 | 128.5 | 170.9 | -54.5 | 169 | 0 | 0 | 0 | 107.6 | R87 | R87-I89 PolarHBondContact O-N 3.36Š|
| 90 | A | 51.4 | Low | 50.8 | Low | 86 Ų | 86 | 143.8 Ų | 143.8 | 71% | 0.711 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -74.5 | 127.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 110 | T92 | A90-T92 PolarHBondContact O-N 2.75Š|
| 91 | R | 57.2 | Low | 50.5 | Low | 248 Ų | 248 | 152 Ų | 152 | 94% | 0.936 | 81% | 0.812 | S | S | * | * | trans | -82.4 | 105.1 | 168 | -79 | -176.9 | 170.6 | 112.8 | -2.3 | 107.9 | D93 | R91-D93 PolarHBondContact O-N 2.64Š| ||
| 92 | T | 53.6 | Low | 50.7 | Low | 122 Ų | 122 | 151 Ų | 151 | 75% | 0.748 | 81% | 0.813 | S | S | * | * | trans | -76.5 | 114.4 | 165.8 | 50.2 | 0 | 0 | 0 | 0 | 107.9 | A90 | A90-T92 PolarHBondContact O-N 2.75Š| ||
| 93 | D | 45.3 | Very low | 50.9 | Low | 147 Ų | 147 | 150.4 Ų | 150.4 | 79% | 0.786 | 81% | 0.809 | S | S | * | * | trans | -61.1 | 132.3 | 168 | -123.5 | -24.3 | 0 | 0 | 0 | 108.7 | R91 | R91-D93 PolarHBondContact O-N 2.64Š| ||
| 94 | S | 57.9 | Low | 51.1 | Low | 115 Ų | 115 | 153.7 Ų | 153.7 | 80% | 0.804 | 82% | 0.819 | S | S | * | * | trans | -123.9 | 80.6 | 170.9 | -64.7 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 95 | Q | 47.8 | Very low | 51.6 | Low | 155 Ų | 155 | 157.3 Ų | 157.3 | 72% | 0.724 | 82% | 0.822 | S | S | * | * | trans | -107 | 140.9 | 152.2 | -87.4 | -171.3 | -78.2 | 0 | 0 | 105.1 | ||||
| 96 | D | 43.4 | Very low | 51.8 | Low | 109 Ų | 109 | 160.1 Ų | 160.1 | 58% | 0.583 | 83% | 0.828 | S | S | * | * | cis | -173.6 | 162 | 14.6 | -129.6 | -36 | 0 | 0 | 0 | 107.3 | ||||
| 97 | M | 47.3 | Very low | 51.4 | Low | 152 Ų | 152 | 162.5 Ų | 162.5 | 75% | 0.749 | 83% | 0.83 | S | S | * | * | trans | 63.6 | 118.1 | 155.9 | -54.5 | -54.5 | -170.9 | 0 | 0 | 120.8 | ||||
| 98 | N | 45.8 | Very low | 50.8 | Low | 174 Ų | 174 | 157.1 Ų | 157.1 | 93% | 0.93 | 83% | 0.825 | S | S | * | * | trans | -135.1 | 110.6 | 133.4 | -106.6 | 6.2 | 0 | 0 | 0 | 107.9 | ||||
| 99 | E | 50.9 | Low | 50.1 | Low | 167 Ų | 167 | 152.9 Ų | 152.9 | 78% | 0.78 | 82% | 0.817 | S | S | * | * | trans | -84 | 165.2 | 167.8 | -143.4 | 176.2 | -174.9 | 0 | 0 | 109.6 | ||||
| 100 | D | 47.1 | Very low | 49.1 | Very low | 141 Ų | 141 | 152.3 Ų | 152.3 | 75% | 0.754 | 82% | 0.817 | S | S | * | * | trans | 84.5 | 91.4 | 166.5 | -59.8 | -26.6 | 0 | 0 | 0 | 119.9 | ||||
| 101 | T | 40.9 | Very low | 48.8 | Very low | 212 Ų | 212 | 158.4 Ų | 158.4 | 100% | 1.301 | 83% | 0.827 | S | S | * | * | 158.8 | 0 | 104.9 | -51.1 | 0 | 0 | 0 | 0 | 110.5 |
Retrieved 101 of 101 residues in 123.9 ms
(Link to these results)