| 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 | 38.8 | Very low | 48.2 | Very low | 248 Ų | 248 | 148.8 Ų | 148.8 | 100% | 1.222 | 85% | 0.849 | S | S | * | * | 0 | 92.7 | 0 | -72.7 | 173.5 | 179.2 | 0 | 0 | 106.9 | |||||
| 2 | S | 55.2 | Low | 48.3 | Very low | 115 Ų | 115 | 145.5 Ų | 145.5 | 80% | 0.804 | 84% | 0.838 | S | S | * | * | trans | -89.4 | 123.7 | 178.9 | -46.7 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 3 | Q | 40.5 | Very low | 48.7 | Very low | 194 Ų | 194 | 148 Ų | 148 | 91% | 0.907 | 85% | 0.845 | S | S | * | * | trans | 175.6 | 128.1 | 144.9 | -99.8 | 174.5 | 62.4 | 0 | 0 | 110.5 | ||||
| 4 | A | 41.2 | Very low | 49.7 | Very low | 98 Ų | 98 | 144.2 Ų | 144.2 | 81% | 0.81 | 83% | 0.832 | S | S | * | * | -166.7 | 102.5 | 115.5 | 0 | 0 | 0 | 0 | 0 | 108.8 | |||||
| 5 | V | 57.4 | Low | 51.5 | Low | 140 Ų | 140 | 144.6 Ų | 144.6 | 85% | 0.848 | 82% | 0.82 | S | S | * | * | trans | -77.5 | 120.6 | 153.2 | 164 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 6 | Q | 48.8 | Very low | 53.7 | Low | 174 Ų | 174 | 141.5 Ų | 141.5 | 81% | 0.813 | 81% | 0.805 | S | S | * | * | trans | -172.3 | 114 | 157.1 | -105.7 | 166.6 | 53.4 | 0 | 0 | 109.7 | ||||
| 7 | T | 46.9 | Very low | 55.9 | Low | 143 Ų | 143 | 144.6 Ų | 144.6 | 88% | 0.877 | 80% | 0.801 | S | S | * | * | trans | -131.4 | 76.5 | 153.1 | 51.6 | 0 | 0 | 0 | 0 | 108.9 | G9 | T7-G9 PolarHBondContact O-N 3.45Š| ||
| 8 | N | 56.9 | Low | 58.1 | Low | 167 Ų | 167 | 145.4 Ų | 145.4 | 89% | 0.893 | 80% | 0.798 | S | S | * | * | trans | -72.6 | 111.9 | 149.3 | -94.6 | -10.2 | 0 | 0 | 0 | 106.7 | ||||
| 9 | G | 43 | Very low | 60 | Low | 52 Ų | 52 | 143.5 Ų | 143.5 | 54% | 0.536 | 79% | 0.786 | S | S | . | * | trans | -170.7 | 107.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113 | T7 Q11 | T7-G9 PolarHBondContact O-N 3.45Å; G9-Q11 PolarHBondContact O-N 3.37Å; G9-Q11 VanDerWaalsContact O-N 3.16Å | ||
| 10 | T | 51.3 | Low | 61.8 | Low | 139 Ų | 139 | 139 Ų | 139 | 85% | 0.853 | 77% | 0.765 | S | S | * | * | trans | -42.5 | 112.4 | 156 | -54.8 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 11 | Q | 49.8 | Very low | 63.4 | Low | 167 Ų | 167 | 139.8 Ų | 139.8 | 78% | 0.78 | 77% | 0.768 | S | S | * | * | trans | -108.3 | 109 | 174.2 | -71.6 | -69.5 | -30.8 | 0 | 0 | 109.8 | G9 | G9-Q11 PolarHBondContact O-N 3.37Å; G9-Q11 VanDerWaalsContact O-N 3.16Å | ||
| 12 | P | 50.1 | Low | 66.2 | Low | 109 Ų | 109 | 135.2 Ų | 135.2 | 71% | 0.708 | 74% | 0.738 | S | S | * | * | trans | -93.6 | 113.4 | 159.4 | 15.9 | 1.8 | 0 | 0 | 0 | 111.1 | ||||
| 13 | L | 53.3 | Low | 68.2 | Low | 178 Ų | 178 | 134 Ų | 134 | 93% | 0.932 | 72% | 0.719 | S | S | * | * | S | Bend | trans | 55.9 | 60.5 | 141.4 | -150 | 72 | 0 | 0 | 0 | 120.6 | ||
| 14 | S | 62.1 | Low | 70.9 | Confident | 95 Ų | 95 | 130.1 Ų | 130.1 | 66% | 0.664 | 70% | 0.704 | S | S | * | * | trans | -140.6 | 112.6 | 130.2 | 61 | 0 | 0 | 0 | 0 | 108.1 | T16 | S14-T16 PolarHBondContact O-N 3.48Å; S14-T16 VanDerWaalsContact O-N 3.08Å | ||
| 15 | K | 77.5 | Confident | 73.6 | Confident | 150 Ų | 150 | 132.9 Ų | 132.9 | 65% | 0.652 | 70% | 0.7 | S | S | * | * | trans | -72.5 | 105.1 | 176.9 | -173.7 | 170.5 | -179.9 | 176.4 | 0 | 107.3 | W17 | K15-W17 HydrophobicContact CD-CD2 4.13Å; K15-W17 HydrophobicContact CD-CE3 3.84Å; K15-W17 HydrophobicContact CD-CH2 3.72Å; K15-W17 HydrophobicContact CD-CZ2 3.98Å; K15-W17 HydrophobicContact CD-CZ3 3.65Å; K15-W17 VanDerWaalsContact CE-CE3 3.49Å; K15-W17 HydrophobicContact CG-CD2 4.02Å; K15-W17 HydrophobicContact CG-CE3 4.16Å; K15-W17 HydrophobicContact CG-CG 4.5Å; K15-W17 HydrophobicContact CG-CZ2 4.39Å; K15-W17 HydrophobicContact CG-CZ3 4.44Å; K15-W17 PolarHBondContact O-N 3.2Å; K15-W17 PolarHBondContact O-NE1 3.22Å | ||
| 16 | T | 86.9 | Confident | 75.5 | Confident | 95 Ų | 95 | 133 Ų | 133 | 58% | 0.583 | 69% | 0.686 | S | S | * | * | trans | -72 | -4.3 | -178.2 | -45.6 | 0 | 0 | 0 | 0 | 113.4 | S14 E18 | S14-T16 PolarHBondContact O-N 3.48Å; S14-T16 VanDerWaalsContact O-N 3.08Å; T16-E18 HydrophobicContact CG2-CG 3.79Å; T16-E18 WeakPolarHBondContact CG2-OE1 3.43Å; T16-E18 PolarHBondContact O-N 3.23Å; T16-E18 VanDerWaalsContact O-N 3.1Å | ||
| 17 | W | 91.1 | Very high | 77.8 | Confident | 195 Ų | 195 | 129.6 Ų | 129.6 | 74% | 0.739 | 68% | 0.677 | S | S | * | * | trans | 53.1 | 28.1 | -179.6 | -52.1 | 102.6 | 0 | 0 | 0 | 114 | K15 | K15-W17 HydrophobicContact CD-CD2 4.13Å; K15-W17 HydrophobicContact CD-CE3 3.84Å; K15-W17 HydrophobicContact CD-CH2 3.72Å; K15-W17 HydrophobicContact CD-CZ2 3.98Å; K15-W17 HydrophobicContact CD-CZ3 3.65Å; K15-W17 VanDerWaalsContact CE-CE3 3.49Å; K15-W17 HydrophobicContact CG-CD2 4.02Å; K15-W17 HydrophobicContact CG-CE3 4.16Å; K15-W17 HydrophobicContact CG-CG 4.5Å; K15-W17 HydrophobicContact CG-CZ2 4.39Å; K15-W17 HydrophobicContact CG-CZ3 4.44Å; K15-W17 PolarHBondContact O-N 3.2Å; K15-W17 PolarHBondContact O-NE1 3.22Å | ||
| 18 | E | 94.6 | Very high | 80.2 | Confident | 158 Ų | 158 | 127.5 Ų | 127.5 | 74% | 0.738 | 67% | 0.666 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 139.8 | 174.2 | -65.7 | 179.5 | -178.9 | 0 | 0 | 110.2 | T16 | T16-E18 HydrophobicContact CG2-CG 3.79Å; T16-E18 WeakPolarHBondContact CG2-OE1 3.43Å; T16-E18 PolarHBondContact O-N 3.23Å; T16-E18 VanDerWaalsContact O-N 3.1Å |
| 19 | L | 95.3 | Very high | 82.1 | Confident | 110 Ų | 110 | 126.7 Ų | 126.7 | 58% | 0.576 | 66% | 0.656 | S | S | * | * | P | Polyproline II helix | trans | -88.1 | 132.3 | 179.4 | -58.3 | -179.2 | 0 | 0 | 0 | 110.3 | E23 L24 | L19-E23 HydrophobicContact CB-CB 4.17Å; L19-E23 HydrophobicContact CD2-CB 4.19Å; L19-L24 HydrophobicContact CB-CD2 4.01Å; L19-L24 HydrophobicContact CB-CG 3.99Å; L19-L24 HydrophobicContact CD1-CD2 3.8Å |
| 20 | S | 95 | Very high | 84.7 | Confident | 53 Ų | 53 | 132 Ų | 132 | 37% | 0.371 | 67% | 0.667 | S | S | . | * | P | Polyproline II helix | trans | -68.3 | 162.9 | 166.1 | 65.5 | 0 | 0 | 0 | 0 | 111.6 | Y22 E23 L24 | S20-Y22 PolarHBondContact O-N 3.34Å; S20-E23 VanDerWaalsContact CB-OE2 3.27Å; S20-E23 WeakPolarHBondContact CB-OE2 3.45Å; S20-E23 PolarHBondContact N-OE2 3.48Å; S20-E23 PolarHBondContact O-N 3.19Å; S20-E23 WeakPolarHBondContact OG-CG 3.43Å; S20-E23 PolarHBondContact OG-N 3.36Å; S20-E23 PolarHBondContact OG-OE2 2.87Å; S20-L24 WeakPolarHBondContact O-CG 3.03Å; S20-L24 PolarHBondContact O-N 3.42Å |
| 21 | L | 96.4 | Very high | 86.8 | Confident | 155 Ų | 155 | 129.1 Ų | 129.1 | 81% | 0.812 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -57.1 | -33.6 | 174.6 | -65.1 | 178.5 | 0 | 0 | 0 | 112.7 | L24 | L21-L24 HydrophobicContact CD2-CD1 4.36Å |
| 22 | Y | 96.6 | Very high | 89 | Confident | 153 Ų | 153 | 127.1 Ų | 127.1 | 60% | 0.6 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -66.3 | -46.8 | 173.8 | 168.9 | -103.4 | 0 | 0 | 0 | 111.3 | S20 L24 Q25 R26 | S20-Y22 PolarHBondContact O-N 3.34Å; Y22-L24 VanDerWaalsContact C-N 3.29Å; Y22-L24 PolarHBondContact O-N 2.81Å; Y22-Q25 CarbonylContact O-C 3.59Å; Y22-Q25 PolarHBondContact O-N 3.15Å; Y22-Q25 VanDerWaalsContact O-N 3.15Å; Y22-R26 HydrophobicContact CE1-CB 4.39Å; Y22-R26 HydrophobicContact CE2-CB 4.48Å; Y22-R26 WeakPolarHBondContact O-CB 3.27Å; Y22-R26 PolarHBondContact O-N 2.67Å |
| 23 | E | 96.7 | Very high | 91.2 | Very high | 89 Ų | 89 | 128.1 Ų | 128.1 | 42% | 0.416 | 66% | 0.655 | S | S | . | * | H | α-helix | trans | -66.3 | -30.6 | -179.1 | -71.5 | 161.2 | 129.8 | 0 | 0 | 113.1 | L19 S20 Q25 R26 | L19-E23 HydrophobicContact CB-CB 4.17Å; L19-E23 HydrophobicContact CD2-CB 4.19Å; S20-E23 VanDerWaalsContact CB-OE2 3.27Å; S20-E23 WeakPolarHBondContact CB-OE2 3.45Å; S20-E23 PolarHBondContact N-OE2 3.48Å; S20-E23 PolarHBondContact O-N 3.19Å; S20-E23 WeakPolarHBondContact OG-CG 3.43Å; S20-E23 PolarHBondContact OG-N 3.36Å; S20-E23 PolarHBondContact OG-OE2 2.87Å; E23-Q25 VanDerWaalsContact C-N 3.26Å; E23-Q25 PolarHBondContact O-N 3.38Å; E23-R26 WeakPolarHBondContact O-CG 3.36Å |
| 24 | L | 97.3 | Very high | 93.2 | Very high | 112 Ų | 112 | 125.8 Ų | 125.8 | 59% | 0.586 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -65.3 | -29.3 | 174.2 | -73.3 | 170 | 0 | 0 | 0 | 113 | L19 S20 L21 Y22 | L19-L24 HydrophobicContact CB-CD2 4.01Å; L19-L24 HydrophobicContact CB-CG 3.99Å; L19-L24 HydrophobicContact CD1-CD2 3.8Å; S20-L24 WeakPolarHBondContact O-CG 3.03Å; S20-L24 PolarHBondContact O-N 3.42Å; L21-L24 HydrophobicContact CD2-CD1 4.36Å; Y22-L24 VanDerWaalsContact C-N 3.29Å; Y22-L24 PolarHBondContact O-N 2.81Å |
| 25 | Q | 97.8 | Very high | 94.7 | Very high | 156 Ų | 156 | 124.5 Ų | 124.5 | 73% | 0.729 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -115.5 | 0.8 | -172.7 | -162.7 | 56.3 | 65.6 | 0 | 0 | 113.4 | Y22 E23 | Y22-Q25 CarbonylContact O-C 3.59Å; Y22-Q25 PolarHBondContact O-N 3.15Å; Y22-Q25 VanDerWaalsContact O-N 3.15Å; E23-Q25 VanDerWaalsContact C-N 3.26Å; E23-Q25 PolarHBondContact O-N 3.38Å |
| 26 | R | 97.4 | Very high | 95.5 | Very high | 144 Ų | 144 | 122.4 Ų | 122.4 | 54% | 0.543 | 64% | 0.641 | S | S | . | * | P | Polyproline II helix | trans | -62 | 138.5 | -177 | 69.3 | -174.4 | -71.6 | -107.5 | -2.7 | 111.1 | Y22 E23 | Y22-R26 HydrophobicContact CE1-CB 4.39Å; Y22-R26 HydrophobicContact CE2-CB 4.48Å; Y22-R26 WeakPolarHBondContact O-CB 3.27Å; Y22-R26 PolarHBondContact O-N 2.67Å; E23-R26 WeakPolarHBondContact O-CG 3.36Å |
| 27 | T | 97.8 | Very high | 95.9 | Very high | 101 Ų | 101 | 126.1 Ų | 126.1 | 62% | 0.62 | 65% | 0.652 | S | S | * | * | P | Polyproline II helix | trans | -91.6 | 159.4 | 170.8 | 57.4 | 0 | 0 | 0 | 0 | 110.8 | ||
| 28 | P | 98 | Very high | 95.8 | Very high | 100 Ų | 100 | 123.2 Ų | 123.2 | 65% | 0.649 | 65% | 0.649 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 148.7 | 170.5 | -25.2 | 35.6 | 0 | 0 | 0 | 112.1 | ||
| 29 | Q | 97.1 | Very high | 95.6 | Very high | 149 Ų | 149 | 122.5 Ų | 122.5 | 70% | 0.696 | 66% | 0.655 | S | S | * | * | P | Polyproline II helix | trans | -91 | 116.6 | 168.7 | -68.2 | -67.5 | -27.2 | 0 | 0 | 107.4 | ||
| 30 | E | 97.3 | Very high | 95.3 | Very high | 164 Ų | 164 | 120.7 Ų | 120.7 | 77% | 0.766 | 65% | 0.649 | S | S | * | * | P | Polyproline II helix | trans | -67 | 141.3 | -178.4 | -64.2 | -57.4 | 137.2 | 0 | 0 | 111.1 | ||
| 31 | A | 95.2 | Very high | 94.9 | Very high | 79 Ų | 79 | 120.6 Ų | 120.6 | 65% | 0.653 | 65% | 0.648 | S | S | * | * | P | Polyproline II helix | trans | -75 | 139.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111 | T33 | A31-T33 HydrophobicContact CB-CG2 4.27Å; A31-T33 PolarHBondContact O-N 2.77Å |
| 32 | I | 95.8 | Very high | 94 | Very high | 125 Ų | 125 | 117.9 Ų | 117.9 | 64% | 0.641 | 64% | 0.639 | S | S | * | * | trans | -74.2 | 115.6 | 170 | -58.7 | 172.4 | 0 | 0 | 0 | 107.6 | D34 L36 | I32-D34 WeakPolarHBondContact CG2-OD1 3.48Å; I32-L36 HydrophobicContact CD1-CD2 4.39Å; I32-L36 HydrophobicContact CG2-CB 3.91Å; I32-L36 HydrophobicContact CG2-CD2 4.06Å | ||
| 33 | T | 96.2 | Very high | 93.4 | Very high | 130 Ų | 130 | 120.7 Ų | 120.7 | 80% | 0.798 | 65% | 0.649 | S | S | * | * | trans | -123 | 3.4 | -172.3 | 50.8 | 0 | 0 | 0 | 0 | 113.8 | A31 G35 | A31-T33 HydrophobicContact CB-CG2 4.27Å; A31-T33 PolarHBondContact O-N 2.77Å; T33-G35 PolarHBondContact O-N 3.05Å | ||
| 34 | D | 95.1 | Very high | 92.7 | Very high | 128 Ų | 128 | 119.8 Ų | 119.8 | 68% | 0.684 | 65% | 0.652 | S | S | * | * | S | Bend | trans | -84 | 17.1 | -174.5 | 63.2 | -15.2 | 0 | 0 | 0 | 114.2 | I32 L36 | I32-D34 WeakPolarHBondContact CG2-OD1 3.48Å; D34-L36 PolarHBondContact O-N 3.25Å; D34-L36 WeakPolarHBondContact OD1-CB 3.48Å; D34-L36 PolarHBondContact OD1-N 3.01Å |
| 35 | G | 93 | Very high | 91.9 | Very high | 68 Ų | 68 | 117.3 Ų | 117.3 | 70% | 0.701 | 64% | 0.639 | S | S | * | * | trans | 69.6 | 20.2 | 179.7 | 0 | 0 | 0 | 0 | 0 | 114 | T33 E37 | T33-G35 PolarHBondContact O-N 3.05Å; G35-E37 PolarHBondContact O-N 3.16Å | ||
| 36 | L | 95.4 | Very high | 90.9 | Very high | 106 Ų | 106 | 114.3 Ų | 114.3 | 56% | 0.555 | 63% | 0.625 | S | S | * | * | trans | -54.8 | 120.1 | 176 | 179.6 | 64.4 | 0 | 0 | 0 | 111.7 | I32 D34 | I32-L36 HydrophobicContact CD1-CD2 4.39Å; I32-L36 HydrophobicContact CG2-CB 3.91Å; I32-L36 HydrophobicContact CG2-CD2 4.06Å; D34-L36 PolarHBondContact O-N 3.25Å; D34-L36 WeakPolarHBondContact OD1-CB 3.48Å; D34-L36 PolarHBondContact OD1-N 3.01Å | ||
| 37 | E | 94.4 | Very high | 90 | Very high | 173 Ų | 173 | 112 Ų | 112 | 81% | 0.808 | 63% | 0.631 | S | S | * | * | trans | -82.3 | 125.6 | 171.7 | -65.7 | -171.2 | 164.3 | 0 | 0 | 110.6 | G35 | G35-E37 PolarHBondContact O-N 3.16Š| ||
| 38 | I | 90.1 | Very high | 89.4 | Confident | 135 Ų | 135 | 113 Ų | 113 | 69% | 0.692 | 63% | 0.629 | S | S | * | * | trans | -98.9 | 111.8 | 176.3 | -54.6 | 176.3 | 0 | 0 | 0 | 108.2 | V40 | I38-V40 HydrophobicContact CG2-CG2 3.87Å; I38-V40 PolarHBondContact O-N 2.86Å | ||
| 39 | V | 90.8 | Very high | 89.1 | Confident | 142 Ų | 142 | 112.1 Ų | 112.1 | 86% | 0.861 | 62% | 0.618 | S | S | * | * | trans | -77.6 | 114.8 | 172.9 | -178.9 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 40 | V | 88.8 | Confident | 89 | Confident | 73 Ų | 73 | 107.6 Ų | 107.6 | 44% | 0.442 | 60% | 0.598 | S | S | . | * | trans | -111 | 117.2 | -179.1 | -167.2 | 0 | 0 | 0 | 0 | 109.6 | I38 L45 | I38-V40 HydrophobicContact CG2-CG2 3.87Å; I38-V40 PolarHBondContact O-N 2.86Å; V40-L45 HydrophobicContact CG1-CD1 3.95Å; V40-L45 HydrophobicContact CG1-CD2 3.49Å; V40-L45 VanDerWaalsContact CG1-CD2 3.49Å; V40-L45 HydrophobicContact CG1-CG 3.51Å | ||
| 41 | S | 86.3 | Confident | 88.9 | Confident | 50 Ų | 50 | 99.9 Ų | 99.9 | 35% | 0.35 | 56% | 0.562 | S | S | . | * | trans | -73.7 | 147.9 | 171.4 | 85.2 | 0 | 0 | 0 | 0 | 109.7 | R43 S44 | S41-R43 PolarHBondContact O-N 3.11Å; S41-R43 VanDerWaalsContact O-N 3.11Å; S41-R43 PolarHBondContact OG-N 3.37Å; S41-S44 WeakPolarHBondContact O-CA 3.25Å; S41-S44 VanDerWaalsContact O-CB 3.25Å; S41-S44 WeakPolarHBondContact O-CB 3.4Å; S41-S44 PolarHBondContact O-N 3.27Å; S41-S44 PolarHBondContact OG-N 3.1Å; S41-S44 PolarHBondContact OG-OG 3.1Å | ||
| 42 | P | 77.4 | Confident | 88.8 | Confident | 98 Ų | 98 | 100 Ų | 100 | 64% | 0.636 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -53.1 | -36 | 174.3 | -28.2 | 35.3 | 0 | 0 | 0 | 112.6 | S44 L45 H46 | P42-S44 VanDerWaalsContact C-N 3.26Å; P42-S44 PolarHBondContact O-N 3.14Å; P42-L45 PolarHBondContact O-N 3.13Å; P42-L45 VanDerWaalsContact O-N 3.1Å; P42-H46 PolarHBondContact O-CD2 3.3Å; P42-H46 PolarHBondContact O-NE2 3.23Å |
| 43 | R | 83.2 | Confident | 88.7 | Confident | 212 Ų | 212 | 100 Ų | 100 | 80% | 0.8 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -60.9 | -31.5 | 174.7 | -88.5 | -175.3 | -81.1 | -146.3 | -3.8 | 114.5 | S41 L45 H46 | S41-R43 PolarHBondContact O-N 3.11Å; S41-R43 VanDerWaalsContact O-N 3.11Å; S41-R43 PolarHBondContact OG-N 3.37Å; R43-L45 PolarHBondContact O-N 2.94Å; R43-H46 WeakPolarHBondContact CA-ND1 3.45Å |
| 44 | S | 82.3 | Confident | 88.7 | Confident | 70 Ų | 70 | 97.1 Ų | 97.1 | 49% | 0.49 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -72.2 | -14.7 | 178.4 | -53.4 | 0 | 0 | 0 | 0 | 112.9 | S41 P42 | S41-S44 WeakPolarHBondContact O-CA 3.25Å; S41-S44 VanDerWaalsContact O-CB 3.25Å; S41-S44 WeakPolarHBondContact O-CB 3.4Å; S41-S44 PolarHBondContact O-N 3.27Å; S41-S44 PolarHBondContact OG-N 3.1Å; S41-S44 PolarHBondContact OG-OG 3.1Å; P42-S44 VanDerWaalsContact C-N 3.26Å; P42-S44 PolarHBondContact O-N 3.14Å |
| 45 | L | 79.9 | Confident | 88.6 | Confident | 60 Ų | 60 | 97.2 Ų | 97.2 | 31% | 0.314 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -102.4 | -9.4 | -178.6 | -63.6 | -179.6 | 0 | 0 | 0 | 113.4 | V40 P42 R43 S47 L49 | V40-L45 HydrophobicContact CG1-CD1 3.95Å; V40-L45 HydrophobicContact CG1-CD2 3.49Å; V40-L45 VanDerWaalsContact CG1-CD2 3.49Å; V40-L45 HydrophobicContact CG1-CG 3.51Å; P42-L45 PolarHBondContact O-N 3.13Å; P42-L45 VanDerWaalsContact O-N 3.1Å; R43-L45 PolarHBondContact O-N 2.94Å; L45-S47 PolarHBondContact O-N 3.45Å; L45-L49 HydrophobicContact CB-CB 4.45Å; L45-L49 HydrophobicContact CB-CD1 4.37Å; L45-L49 HydrophobicContact CD1-CD1 4.4Å; L45-L49 HydrophobicContact CD2-CD1 3.71Å; L45-L49 HydrophobicContact CD2-CG 4.45Å; L45-L49 HydrophobicContact CG-CD1 4.37Å; L45-L49 WeakPolarHBondContact O-CB 3.45Å; L45-L49 PolarHBondContact O-N 3.08Å |
| 46 | H | 78.4 | Confident | 88.5 | Confident | 93 Ų | 93 | 97.7 Ų | 97.7 | 43% | 0.431 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -68.6 | -35.6 | -167.5 | -72.1 | 159.3 | 0 | 0 | 0 | 113.8 | P42 R43 M50 | P42-H46 PolarHBondContact O-CD2 3.3Å; P42-H46 PolarHBondContact O-NE2 3.23Å; R43-H46 WeakPolarHBondContact CA-ND1 3.45Å; H46-M50 VanDerWaalsContact CA-SD 3.53Å; H46-M50 HydrophobicContact CB-CG 4.35Å; H46-M50 HydrophobicContact CB-SD 3.45Å; H46-M50 WeakPolarHBondContact CB-SD 3.45Å; H46-M50 PolarHBondContact CD2-SD 3.21Å; H46-M50 VanDerWaalsContact O-CB 3.32Å; H46-M50 WeakPolarHBondContact O-CB 3.23Å; H46-M50 WeakPolarHBondContact O-CG 3.32Å |
| 47 | S | 78.7 | Confident | 88.3 | Confident | 95 Ų | 95 | 97.6 Ų | 97.6 | 66% | 0.664 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -73.8 | -27.9 | -176.6 | 28.5 | 0 | 0 | 0 | 0 | 113.4 | L45 | L45-S47 PolarHBondContact O-N 3.45Å |
| 48 | E | 84.6 | Confident | 88.4 | Confident | 124 Ų | 124 | 90.8 Ų | 90.8 | 58% | 0.579 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -113.2 | -32.6 | -171.6 | -67.5 | 71.7 | -153.7 | 0 | 0 | 113.8 | ||
| 49 | L | 91.8 | Very high | 88.6 | Confident | 80 Ų | 80 | 89.9 Ų | 89.9 | 42% | 0.419 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -109.2 | 3.2 | -172.2 | -58.7 | -172.8 | 0 | 0 | 0 | 114.1 | L45 M57 L58 | L45-L49 HydrophobicContact CB-CB 4.45Å; L45-L49 HydrophobicContact CB-CD1 4.37Å; L45-L49 HydrophobicContact CD1-CD1 4.4Å; L45-L49 HydrophobicContact CD2-CD1 3.71Å; L45-L49 HydrophobicContact CD2-CG 4.45Å; L45-L49 HydrophobicContact CG-CD1 4.37Å; L45-L49 WeakPolarHBondContact O-CB 3.45Å; L45-L49 PolarHBondContact O-N 3.08Å; L49-M57 WeakPolarHBondContact O-CA 3.4Å; L49-L58 WeakPolarHBondContact O-CG 3.31Å; L49-L58 PolarHBondContact O-N 3.14Å |
| 50 | M | 93.8 | Very high | 89 | Confident | 54 Ų | 54 | 89.8 Ų | 89.8 | 27% | 0.266 | 48% | 0.479 | S | S | . | . | B | Isolated β-bridge | trans | -92.3 | 141.4 | 172.1 | -71 | 179 | 63.3 | 0 | 0 | 112 | H46 P52 L55 D56 | H46-M50 VanDerWaalsContact CA-SD 3.53Å; H46-M50 HydrophobicContact CB-CG 4.35Å; H46-M50 HydrophobicContact CB-SD 3.45Å; H46-M50 WeakPolarHBondContact CB-SD 3.45Å; H46-M50 PolarHBondContact CD2-SD 3.21Å; H46-M50 VanDerWaalsContact O-CB 3.32Å; H46-M50 WeakPolarHBondContact O-CB 3.23Å; H46-M50 WeakPolarHBondContact O-CG 3.32Å; M50-P52 WeakPolarHBondContact O-CD 3.46Å; M50-L55 HydrophobicContact CE-CB 4.43Å; M50-L55 VanDerWaalsContact CE-O 3.23Å; M50-L55 WeakPolarHBondContact CE-O 3.42Å; M50-D56 CarbonylContact C-O 3.56Å; M50-D56 WeakPolarHBondContact CA-O 3.39Å |
| 51 | C | 94.9 | Very high | 89.3 | Confident | 2 Ų | 2 | 89.5 Ų | 89.5 | 1% | 0.014 | 48% | 0.478 | C | S | . | . | trans | -73.5 | 121.8 | 168.2 | -177.7 | 0 | 0 | 0 | 0 | 109.7 | I53 C54 L55 D56 L58 C72 | C51-I53 PolarHBondContact O-N 3.47Å; C51-I53 VanDerWaalsContact O-N 3.14Å; C51-C54 WeakPolarHBondContact CB-SG 3.41Å; C51-C54 VanDerWaalsContact SG-SG 3.68Å; C51-L55 WeakPolarHBondContact O-CA 3.49Å; C51-L55 PolarHBondContact O-N 3.31Å; C51-D56 PolarHBondContact N-O 3.17Å; C51-L58 HydrophobicContact CB-CD2 3.74Å; C51-L58 HydrophobicContact CB-CG 4.41Å; C51-C72 VanDerWaalsContact CB-SG 3.56Å; C51-C72 PolarHBondContact SG-N 2.85Å; C51-C72 VanDerWaalsContact SG-SG 3.66Å | ||
| 52 | P | 93.5 | Very high | 89.9 | Confident | 81 Ų | 81 | 92.6 Ų | 92.6 | 53% | 0.526 | 49% | 0.488 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70 | -8.6 | 179.2 | 30.4 | -37.3 | 0 | 0 | 0 | 113.4 | M50 R70 F71 | M50-P52 WeakPolarHBondContact O-CD 3.46Å; P52-R70 VanDerWaalsContact CD-O 3.31Å; P52-R70 WeakPolarHBondContact CD-O 3.35Å; P52-F71 HydrophobicContact CG-CD1 3.54Å; P52-F71 HydrophobicContact CG-CE1 3.41Å; P52-F71 VanDerWaalsContact CG-CE1 3.41Å; P52-F71 HydrophobicContact CG-CZ 4.44Å |
| 53 | I | 94.9 | Very high | 90.8 | Very high | 125 Ų | 125 | 90.9 Ų | 90.9 | 64% | 0.641 | 48% | 0.476 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.5 | -54.6 | 177.3 | -64 | 169.5 | 0 | 0 | 0 | 111.3 | C51 F71 | C51-I53 PolarHBondContact O-N 3.47Å; C51-I53 VanDerWaalsContact O-N 3.14Å; I53-F71 HydrophobicContact CD1-CB 4.07Å; I53-F71 HydrophobicContact CD1-CD1 3.29Å; I53-F71 HydrophobicContact CD1-CE1 3.9Å; I53-F71 HydrophobicContact CD1-CG 3.87Å; I53-F71 HydrophobicContact CG1-CD1 3.59Å; I53-F71 HydrophobicContact CG1-CE1 4.02Å |
| 54 | C | 95.1 | Very high | 91.5 | Very high | 70 Ų | 70 | 83.3 Ų | 83.3 | 47% | 0.473 | 45% | 0.454 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.9 | -5.9 | -176 | 69.5 | 0 | 0 | 0 | 0 | 114.3 | C51 D56 | C51-C54 WeakPolarHBondContact CB-SG 3.41Å; C51-C54 VanDerWaalsContact SG-SG 3.68Å; C54-D56 PolarHBondContact O-N 2.79Å |
| 55 | L | 92.3 | Very high | 92.2 | Very high | 130 Ų | 130 | 89.1 Ų | 89.1 | 68% | 0.681 | 47% | 0.47 | S | S | * | . | S | Bend | trans | 57.3 | 27 | 179.8 | -49.2 | -179.4 | 0 | 0 | 0 | 113.8 | M50 C51 | M50-L55 HydrophobicContact CE-CB 4.43Å; M50-L55 VanDerWaalsContact CE-O 3.23Å; M50-L55 WeakPolarHBondContact CE-O 3.42Å; C51-L55 WeakPolarHBondContact O-CA 3.49Å; C51-L55 PolarHBondContact O-N 3.31Å |
| 56 | D | 92.1 | Very high | 93 | Very high | 78 Ų | 78 | 95 Ų | 95 | 42% | 0.417 | 50% | 0.496 | S | S | . | . | S | Bend | trans | -124 | 172.9 | 174.9 | -168.7 | 10 | 0 | 0 | 0 | 109 | M50 C51 C54 L58 K59 | M50-D56 CarbonylContact C-O 3.56Å; M50-D56 WeakPolarHBondContact CA-O 3.39Å; C51-D56 PolarHBondContact N-O 3.17Å; C54-D56 PolarHBondContact O-N 2.79Å; D56-L58 PolarHBondContact O-N 2.98Å; D56-K59 IonicContact OD2-NZ 2.69Å; D56-K59 PolarHBondContact OD2-NZ 3.05Å |
| 57 | M | 91.9 | Very high | 93.7 | Very high | 104 Ų | 104 | 93.9 Ų | 93.9 | 51% | 0.512 | 50% | 0.498 | S | S | . | . | B | Isolated β-bridge | trans | -55 | 138.9 | 173.8 | -69.3 | -175.1 | 70.5 | 0 | 0 | 111.2 | L49 K59 | L49-M57 WeakPolarHBondContact O-CA 3.4Å; M57-K59 PolarHBondContact O-N 2.96Å |
| 58 | L | 94.9 | Very high | 94.5 | Very high | 31 Ų | 31 | 94.4 Ų | 94.4 | 16% | 0.162 | 49% | 0.493 | C | S | . | . | trans | -55.7 | 127 | 174.8 | -72.2 | 167 | 0 | 0 | 0 | 110.3 | L49 C51 D56 T61 R70 | L49-L58 WeakPolarHBondContact O-CG 3.31Å; L49-L58 PolarHBondContact O-N 3.14Å; C51-L58 HydrophobicContact CB-CD2 3.74Å; C51-L58 HydrophobicContact CB-CG 4.41Å; D56-L58 PolarHBondContact O-N 2.98Å; L58-T61 HydrophobicContact CD1-CG2 4.2Å; L58-T61 HydrophobicContact CD2-CG2 4.29Å; L58-R70 HydrophobicContact CD1-CB 4.08Å; L58-R70 HydrophobicContact CD2-CB 4.33Å | ||
| 59 | K | 95.8 | Very high | 95 | Very high | 116 Ų | 116 | 94 Ų | 94 | 50% | 0.504 | 49% | 0.49 | S | S | . | . | trans | -129.4 | 137.9 | 175.9 | -65.1 | 166.6 | -162.8 | 167.9 | 0 | 107.6 | D56 M57 T61 C72 | D56-K59 IonicContact OD2-NZ 2.69Å; D56-K59 PolarHBondContact OD2-NZ 3.05Å; M57-K59 PolarHBondContact O-N 2.96Å; K59-T61 VanDerWaalsContact C-N 3.3Å; K59-T61 PolarHBondContact O-N 3.3Å; K59-C72 PolarHBondContact N-SG 3.23Å; K59-C72 VanDerWaalsContact N-SG 3.4Å; K59-C72 WeakPolarHBondContact O-CA 3.48Å | ||
| 60 | N | 97.4 | Very high | 95.2 | Very high | 139 Ų | 139 | 96.7 Ų | 96.7 | 74% | 0.743 | 50% | 0.495 | S | S | * | . | S | Bend | trans | 47.9 | 52.9 | -176.2 | -56.5 | -48 | 0 | 0 | 0 | 111.9 | M62 A73 | N60-M62 PolarHBondContact O-N 2.85Å; N60-A73 HydrophobicContact CB-CB 3.99Å; N60-A73 PolarHBondContact O-N 3.34Å |
| 61 | T | 96.8 | Very high | 95.4 | Very high | 68 Ų | 68 | 96.6 Ų | 96.6 | 42% | 0.417 | 49% | 0.493 | S | S | . | . | trans | -58.1 | 119.5 | -166.5 | -51.5 | 0 | 0 | 0 | 0 | 113.3 | L58 K59 R70 F71 | L58-T61 HydrophobicContact CD1-CG2 4.2Å; L58-T61 HydrophobicContact CD2-CG2 4.29Å; K59-T61 VanDerWaalsContact C-N 3.3Å; K59-T61 PolarHBondContact O-N 3.3Å; T61-R70 HydrophobicContact CG2-CB 3.88Å; T61-R70 HydrophobicContact CG2-CG 4.09Å; T61-F71 CarbonylContact C-O 3.54Å; T61-F71 WeakPolarHBondContact CA-O 3.3Å | ||
| 62 | M | 97.4 | Very high | 95.5 | Very high | 114 Ų | 114 | 98.1 Ų | 98.1 | 56% | 0.562 | 50% | 0.504 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -97.5 | 144.8 | 170.4 | -67.5 | -63.2 | -72.8 | 0 | 0 | 110.3 | N60 R70 F71 A73 | N60-M62 PolarHBondContact O-N 2.85Å; M62-R70 VanDerWaalsContact O-CA 3.3Å; M62-R70 WeakPolarHBondContact O-CA 3.36Å; M62-F71 PolarHBondContact N-O 3.28Å; M62-F71 PolarHBondContact O-N 3.37Å; M62-A73 HydrophobicContact CG-CB 3.88Å |
| 63 | T | 97.4 | Very high | 95.5 | Very high | 63 Ų | 63 | 100.2 Ų | 100.2 | 39% | 0.387 | 53% | 0.527 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.1 | 126.9 | -179.6 | -57.2 | 0 | 0 | 0 | 0 | 110.7 | K65 L68 H69 R70 | T63-K65 PolarHBondContact O-N 2.69Å; T63-L68 HydrophobicContact CG2-CB 4.19Å; T63-L68 HydrophobicContact CG2-CD2 4Å; T63-H69 WeakPolarHBondContact CA-O 3.22Å; T63-R70 HydrophobicContact CG2-CG 4.49Å |
| 64 | T | 97.5 | Very high | 95.5 | Very high | 53 Ų | 53 | 99 Ų | 99 | 33% | 0.325 | 52% | 0.522 | S | S | . | . | trans | -67.6 | 128.1 | 174.1 | 53.5 | 0 | 0 | 0 | 0 | 110 | E66 C67 L68 H69 F71 | T64-E66 PolarHBondContact O-N 3.4Å; T64-C67 PolarHBondContact OG1-SG 3.34Å; T64-L68 WeakPolarHBondContact O-CA 3.39Å; T64-L68 PolarHBondContact O-N 3.32Å; T64-L68 PolarHBondContact OG1-N 2.79Å; T64-H69 PolarHBondContact N-O 3.02Å; T64-H69 PolarHBondContact OG1-N 2.95Å; T64-H69 PolarHBondContact OG1-O 3.07Å; T64-F71 HydrophobicContact CG2-CD2 4.44Å; T64-F71 HydrophobicContact CG2-CE2 3.9Å | ||
| 65 | K | 96.5 | Very high | 95.5 | Very high | 191 Ų | 191 | 100.5 Ų | 100.5 | 83% | 0.83 | 52% | 0.524 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.8 | -41.7 | -175 | -68 | -177.9 | 177.5 | 179.9 | 0 | 113.7 | T63 | T63-K65 PolarHBondContact O-N 2.69Š|
| 66 | E | 96.4 | Very high | 95.7 | Very high | 183 Ų | 183 | 98.8 Ų | 98.8 | 86% | 0.855 | 52% | 0.516 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.1 | -38.6 | -173 | -57.6 | -51.3 | 124.9 | 0 | 0 | 113.5 | T64 | T64-E66 PolarHBondContact O-N 3.4Š|
| 67 | C | 94.4 | Very high | 95.9 | Very high | 70 Ų | 70 | 100.1 Ų | 100.1 | 47% | 0.473 | 52% | 0.521 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -121.4 | 1.1 | -171.1 | 56.9 | 0 | 0 | 0 | 0 | 114.7 | T64 H69 | T64-C67 PolarHBondContact OG1-SG 3.34Å; C67-H69 PolarHBondContact O-N 3.32Å; C67-H69 PolarHBondContact SG-ND1 3.46Å |
| 68 | L | 95.5 | Very high | 96.2 | Very high | 107 Ų | 107 | 99.8 Ų | 99.8 | 56% | 0.56 | 52% | 0.522 | S | S | * | . | trans | 54.6 | 18.4 | 176.2 | -54.2 | -179.2 | 0 | 0 | 0 | 115.8 | T63 T64 | T63-L68 HydrophobicContact CG2-CB 4.19Å; T63-L68 HydrophobicContact CG2-CD2 4Å; T64-L68 WeakPolarHBondContact O-CA 3.39Å; T64-L68 PolarHBondContact O-N 3.32Å; T64-L68 PolarHBondContact OG1-N 2.79Å | ||
| 69 | H | 95.6 | Very high | 96.3 | Very high | 114 Ų | 114 | 104.4 Ų | 104.4 | 53% | 0.528 | 55% | 0.546 | S | S | . | . | trans | -68.1 | 142.4 | 170.5 | -67.2 | 124.3 | 0 | 0 | 0 | 110.5 | T63 T64 C67 F71 | T63-H69 WeakPolarHBondContact CA-O 3.22Å; T64-H69 PolarHBondContact N-O 3.02Å; T64-H69 PolarHBondContact OG1-N 2.95Å; T64-H69 PolarHBondContact OG1-O 3.07Å; C67-H69 PolarHBondContact O-N 3.32Å; C67-H69 PolarHBondContact SG-ND1 3.46Å; H69-F71 HydrophobicContact CB-CE2 3.64Å; H69-F71 HydrophobicContact CB-CZ 3.8Å | ||
| 70 | R | 96.1 | Very high | 96.3 | Very high | 138 Ų | 138 | 103.6 Ų | 103.6 | 52% | 0.521 | 55% | 0.549 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.4 | 139.5 | -172.1 | -65.5 | 177.9 | -179.6 | 83.7 | -0.7 | 110.9 | P52 L58 T61 M62 T63 | P52-R70 VanDerWaalsContact CD-O 3.31Å; P52-R70 WeakPolarHBondContact CD-O 3.35Å; L58-R70 HydrophobicContact CD1-CB 4.08Å; L58-R70 HydrophobicContact CD2-CB 4.33Å; T61-R70 HydrophobicContact CG2-CB 3.88Å; T61-R70 HydrophobicContact CG2-CG 4.09Å; M62-R70 VanDerWaalsContact O-CA 3.3Å; M62-R70 WeakPolarHBondContact O-CA 3.36Å; T63-R70 HydrophobicContact CG2-CG 4.49Å |
| 71 | F | 96.8 | Very high | 96.2 | Very high | 52 Ų | 52 | 100.8 Ų | 100.8 | 23% | 0.228 | 53% | 0.534 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -145.3 | 166.5 | 179.9 | -51.8 | -83.8 | 0 | 0 | 0 | 110.1 | P52 I53 T61 M62 T64 H69 | P52-F71 HydrophobicContact CG-CD1 3.54Å; P52-F71 HydrophobicContact CG-CE1 3.41Å; P52-F71 VanDerWaalsContact CG-CE1 3.41Å; P52-F71 HydrophobicContact CG-CZ 4.44Å; I53-F71 HydrophobicContact CD1-CB 4.07Å; I53-F71 HydrophobicContact CD1-CD1 3.29Å; I53-F71 HydrophobicContact CD1-CE1 3.9Å; I53-F71 HydrophobicContact CD1-CG 3.87Å; I53-F71 HydrophobicContact CG1-CD1 3.59Å; I53-F71 HydrophobicContact CG1-CE1 4.02Å; T61-F71 CarbonylContact C-O 3.54Å; T61-F71 WeakPolarHBondContact CA-O 3.3Å; M62-F71 PolarHBondContact N-O 3.28Å; M62-F71 PolarHBondContact O-N 3.37Å; T64-F71 HydrophobicContact CG2-CD2 4.44Å; T64-F71 HydrophobicContact CG2-CE2 3.9Å; H69-F71 HydrophobicContact CB-CE2 3.64Å; H69-F71 HydrophobicContact CB-CZ 3.8Å |
| 72 | C | 97.4 | Very high | 96.2 | Very high | 34 Ų | 34 | 103.6 Ų | 103.6 | 23% | 0.23 | 54% | 0.544 | C | S | . | . | trans | -69.5 | 154.7 | 163.2 | -61.9 | 0 | 0 | 0 | 0 | 110.3 | C51 K59 | C51-C72 VanDerWaalsContact CB-SG 3.56Å; C51-C72 PolarHBondContact SG-N 2.85Å; C51-C72 VanDerWaalsContact SG-SG 3.66Å; K59-C72 PolarHBondContact N-SG 3.23Å; K59-C72 VanDerWaalsContact N-SG 3.4Å; K59-C72 WeakPolarHBondContact O-CA 3.48Å | ||
| 73 | A | 93.1 | Very high | 96 | Very high | 124 Ų | 124 | 102.6 Ų | 102.6 | 100% | 1.025 | 54% | 0.542 | S | S | * | . | trans | -64.3 | 0 | 169.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | N60 M62 | N60-A73 HydrophobicContact CB-CB 3.99Å; N60-A73 PolarHBondContact O-N 3.34Å; M62-A73 HydrophobicContact CG-CB 3.88Å |
Retrieved 73 of 73 residues in 210.4 ms
(Link to these results)