| 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 | 41.8 | Very low | 63.7 | Low | 240 Ų | 240 | 143.9 Ų | 143.9 | 100% | 1.182 | 74% | 0.743 | S | S | * | * | 0 | 112.8 | 0 | -78.7 | 166.8 | 66 | 0 | 0 | 106.8 | E3 | M1-E3 PolarHBondContact O-N 3.11Š| |||
| 2 | V | 43 | Very low | 66.1 | Low | 140 Ų | 140 | 134.7 Ų | 134.7 | 85% | 0.848 | 71% | 0.71 | S | S | * | * | trans | -71.7 | 110.5 | 175.4 | 174.7 | 0 | 0 | 0 | 0 | 106 | S4 | V2-S4 PolarHBondContact O-N 3.14Š| ||
| 3 | E | 45.8 | Very low | 68.1 | Low | 165 Ų | 165 | 127.6 Ų | 127.6 | 77% | 0.771 | 68% | 0.675 | S | S | * | * | trans | -59.4 | 110.6 | 167 | -75.4 | 179.3 | 157.8 | 0 | 0 | 107.4 | M1 R5 | M1-E3 PolarHBondContact O-N 3.11Å; E3-R5 PolarHBondContact O-N 3.32Å | ||
| 4 | S | 47.7 | Very low | 69.9 | Low | 114 Ų | 114 | 129.1 Ų | 129.1 | 80% | 0.797 | 67% | 0.669 | S | S | * | * | trans | -62.7 | 86.8 | 171.3 | -60.7 | 0 | 0 | 0 | 0 | 108.5 | V2 S6 | V2-S4 PolarHBondContact O-N 3.14Å; S4-S6 VanDerWaalsContact C-N 3.25Å; S4-S6 PolarHBondContact O-N 2.9Å | ||
| 5 | R | 52.4 | Low | 71.6 | Confident | 227 Ų | 227 | 132.9 Ų | 132.9 | 86% | 0.857 | 67% | 0.671 | S | S | * | * | trans | -65.4 | 91.9 | 164.4 | -74.5 | -176.3 | 176.8 | -172.3 | -1.3 | 107.2 | E3 C7 | E3-R5 PolarHBondContact O-N 3.32Å; R5-C7 PolarHBondContact O-N 2.8Å | ||
| 6 | S | 59.9 | Low | 73.1 | Confident | 99 Ų | 99 | 132 Ų | 132 | 69% | 0.692 | 66% | 0.657 | S | S | * | * | trans | -62.7 | 104.1 | 165.9 | 56.6 | 0 | 0 | 0 | 0 | 107.4 | S4 V8 | S4-S6 VanDerWaalsContact C-N 3.25Å; S4-S6 PolarHBondContact O-N 2.9Å; S6-V8 VanDerWaalsContact C-N 3.31Å; S6-V8 PolarHBondContact O-N 3.33Å | ||
| 7 | C | 70 | Confident | 74.5 | Confident | 113 Ų | 113 | 127.2 Ų | 127.2 | 76% | 0.764 | 63% | 0.631 | S | S | * | * | trans | -72.2 | 90.2 | 174 | -174 | 0 | 0 | 0 | 0 | 108.2 | R5 Q9 | R5-C7 PolarHBondContact O-N 2.8Å; C7-Q9 PolarHBondContact O-N 3.49Å | ||
| 8 | V | 75.9 | Confident | 75.7 | Confident | 100 Ų | 100 | 124.8 Ų | 124.8 | 61% | 0.606 | 63% | 0.629 | S | S | * | * | trans | -75 | 113.7 | 171.2 | 177.7 | 0 | 0 | 0 | 0 | 107.4 | S6 R10 V13 | S6-V8 VanDerWaalsContact C-N 3.31Å; S6-V8 PolarHBondContact O-N 3.33Å; V8-R10 PolarHBondContact O-N 3.13Å; V8-V13 HydrophobicContact CG1-CG2 3.15Å | ||
| 9 | Q | 87.1 | Confident | 76.8 | Confident | 139 Ų | 139 | 123.9 Ų | 123.9 | 65% | 0.65 | 63% | 0.63 | S | S | * | * | trans | -74.6 | 121.8 | 176.6 | -65.8 | -167.6 | -6.6 | 0 | 0 | 109.7 | C7 E11 G12 V13 | C7-Q9 PolarHBondContact O-N 3.49Å; Q9-E11 VanDerWaalsContact C-N 3.27Å; Q9-E11 PolarHBondContact O-N 2.89Å; Q9-G12 WeakPolarHBondContact O-CA 3.18Å; Q9-G12 PolarHBondContact O-N 3.48Å; Q9-V13 PolarHBondContact O-N 3.4Å | ||
| 10 | R | 86.8 | Confident | 77.8 | Confident | 157 Ų | 157 | 118.8 Ų | 118.8 | 59% | 0.592 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -51.5 | -46 | -179 | 179.5 | -177 | 63.4 | -174.5 | -1.3 | 112.3 | V8 G12 V13 Y14 | V8-R10 PolarHBondContact O-N 3.13Å; R10-G12 VanDerWaalsContact C-N 3.27Å; R10-G12 PolarHBondContact O-N 3.22Å; R10-V13 WeakPolarHBondContact O-CB 3.48Å; R10-V13 PolarHBondContact O-N 3.39Å; R10-V13 VanDerWaalsContact O-N 3.16Å; R10-Y14 HydrophobicContact CG-CD2 4.26Å; R10-Y14 HydrophobicContact CG-CE1 4.46Å; R10-Y14 HydrophobicContact CG-CE2 3.59Å; R10-Y14 PolarHBondContact O-N 2.95Å; R10-Y14 VanDerWaalsContact O-N 3.08Å |
| 11 | E | 89.9 | Confident | 78.6 | Confident | 89 Ų | 89 | 115 Ų | 115 | 42% | 0.416 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -64.9 | -33.6 | 178.9 | -67.4 | 68 | -149.2 | 0 | 0 | 111.7 | Q9 Y14 R15 | Q9-E11 VanDerWaalsContact C-N 3.27Å; Q9-E11 PolarHBondContact O-N 2.89Å; E11-Y14 PolarHBondContact O-N 3.3Å; E11-R15 WeakPolarHBondContact O-CG 3.48Å; E11-R15 PolarHBondContact O-N 3.28Å; E11-R15 VanDerWaalsContact O-N 3.08Å |
| 12 | G | 92.6 | Very high | 81.2 | Confident | 33 Ų | 33 | 106 Ų | 106 | 34% | 0.34 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -64.3 | -41.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q9 R10 R15 W16 | Q9-G12 WeakPolarHBondContact O-CA 3.18Å; Q9-G12 PolarHBondContact O-N 3.48Å; R10-G12 VanDerWaalsContact C-N 3.27Å; R10-G12 PolarHBondContact O-N 3.22Å; G12-R15 PolarHBondContact O-N 2.76Å; G12-W16 WeakPolarHBondContact O-CB 3.26Å; G12-W16 PolarHBondContact O-N 2.77Å |
| 13 | V | 92.8 | Very high | 83.7 | Confident | 43 Ų | 43 | 99.6 Ų | 99.6 | 26% | 0.261 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.2 | -44.4 | 176.1 | -179 | 0 | 0 | 0 | 0 | 111.1 | V8 Q9 R10 R15 W16 F17 | V8-V13 HydrophobicContact CG1-CG2 3.15Å; Q9-V13 PolarHBondContact O-N 3.4Å; R10-V13 WeakPolarHBondContact O-CB 3.48Å; R10-V13 PolarHBondContact O-N 3.39Å; R10-V13 VanDerWaalsContact O-N 3.16Å; V13-R15 PolarHBondContact O-N 3.02Å; V13-W16 HydrophobicContact CG1-CE3 4.43Å; V13-W16 PolarHBondContact O-N 3.46Å; V13-F17 VanDerWaalsContact O-CB 3.26Å; V13-F17 WeakPolarHBondContact O-CB 3.3Å; V13-F17 PolarHBondContact O-N 3.15Å |
| 14 | Y | 93.4 | Very high | 86.1 | Confident | 149 Ų | 149 | 96.1 Ų | 96.1 | 58% | 0.584 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -64.5 | -41.1 | 178.8 | -63.8 | -26.8 | 0 | 0 | 0 | 112.6 | R10 E11 F17 S18 | R10-Y14 HydrophobicContact CG-CD2 4.26Å; R10-Y14 HydrophobicContact CG-CE1 4.46Å; R10-Y14 HydrophobicContact CG-CE2 3.59Å; R10-Y14 PolarHBondContact O-N 2.95Å; R10-Y14 VanDerWaalsContact O-N 3.08Å; E11-Y14 PolarHBondContact O-N 3.3Å; Y14-F17 PolarHBondContact O-N 2.92Å; Y14-S18 WeakPolarHBondContact O-CB 3.2Å; Y14-S18 PolarHBondContact O-N 3.47Å |
| 15 | R | 94.8 | Very high | 88.5 | Confident | 186 Ų | 186 | 94.4 Ų | 94.4 | 70% | 0.702 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -61.5 | -49.4 | 174.2 | -74.2 | -178.3 | -168.5 | 158.8 | 4.6 | 111.1 | E11 G12 V13 F17 S18 T19 | E11-R15 WeakPolarHBondContact O-CG 3.48Å; E11-R15 PolarHBondContact O-N 3.28Å; E11-R15 VanDerWaalsContact O-N 3.08Å; G12-R15 PolarHBondContact O-N 2.76Å; V13-R15 PolarHBondContact O-N 3.02Å; R15-F17 PolarHBondContact O-N 2.71Å; R15-S18 PolarHBondContact O-N 2.78Å; R15-S18 PolarHBondContact O-OG 3.16Å; R15-T19 PolarHBondContact O-N 3.39Å |
| 16 | W | 96.2 | Very high | 90.7 | Very high | 118 Ų | 118 | 84.9 Ų | 84.9 | 45% | 0.447 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -60.2 | -45.8 | 177.3 | 166.9 | 76.5 | 0 | 0 | 0 | 112.4 | G12 V13 S18 T19 L20 F28 | G12-W16 WeakPolarHBondContact O-CB 3.26Å; G12-W16 PolarHBondContact O-N 2.77Å; V13-W16 HydrophobicContact CG1-CE3 4.43Å; V13-W16 PolarHBondContact O-N 3.46Å; W16-S18 PolarHBondContact O-N 3.4Å; W16-T19 PolarHBondContact O-N 3.04Å; W16-T19 PolarHBondContact O-OG1 3.02Å; W16-L20 HydrophobicContact CE3-CD1 4.47Å; W16-L20 HydrophobicContact CH2-CD1 3.74Å; W16-L20 HydrophobicContact CZ2-CD1 3.83Å; W16-L20 HydrophobicContact CZ2-CD2 3.9Å; W16-L20 HydrophobicContact CZ2-CG 4.31Å; W16-L20 HydrophobicContact CZ3-CD1 4.07Å; W16-F28 AromaticContact CH2-CD2 3.72Å; W16-F28 HydrophobicContact CH2-CD2 3.72Å; W16-F28 HydrophobicContact CH2-CE1 4.41Å; W16-F28 AromaticContact CH2-CE2 3.63Å; W16-F28 HydrophobicContact CH2-CE2 3.63Å; W16-F28 HydrophobicContact CH2-CG 4.17Å; W16-F28 AromaticContact CH2-CZ 4Å; W16-F28 HydrophobicContact CH2-CZ 4Å; W16-F28 HydrophobicContact CZ3-CD1 4.28Å; W16-F28 HydrophobicContact CZ3-CD2 4.18Å; W16-F28 AromaticContact CZ3-CE1 3.9Å; W16-F28 HydrophobicContact CZ3-CE1 3.9Å; W16-F28 AromaticContact CZ3-CE2 3.81Å; W16-F28 HydrophobicContact CZ3-CE2 3.81Å; W16-F28 HydrophobicContact CZ3-CG 4.4Å; W16-F28 AromaticContact CZ3-CZ 3.65Å; W16-F28 HydrophobicContact CZ3-CZ 3.65Å |
| 17 | F | 96.9 | Very high | 92.4 | Very high | 51 Ų | 51 | 83 Ų | 83 | 22% | 0.224 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -60.3 | -35.6 | 178.6 | -176.8 | -99.3 | 0 | 0 | 0 | 111.9 | V13 Y14 R15 T19 L20 R25 F28 L29 | V13-F17 VanDerWaalsContact O-CB 3.26Å; V13-F17 WeakPolarHBondContact O-CB 3.3Å; V13-F17 PolarHBondContact O-N 3.15Å; Y14-F17 PolarHBondContact O-N 2.92Å; R15-F17 PolarHBondContact O-N 2.71Å; F17-T19 PolarHBondContact O-N 2.75Å; F17-L20 HydrophobicContact CD2-CD1 3.94Å; F17-L20 WeakPolarHBondContact O-CB 3.36Å; F17-L20 PolarHBondContact O-N 2.89Å; F17-R25 HydrophobicContact CD1-CG 4.46Å; F17-R25 HydrophobicContact CD2-CG 4.25Å; F17-R25 HydrophobicContact CE1-CB 4.43Å; F17-R25 HydrophobicContact CE1-CG 3.97Å; F17-R25 HydrophobicContact CE2-CB 3.84Å; F17-R25 HydrophobicContact CE2-CG 3.72Å; F17-R25 HydrophobicContact CZ-CB 3.64Å; F17-R25 HydrophobicContact CZ-CG 3.57Å; F17-F28 AromaticContact CD2-CD1 3.8Å; F17-F28 HydrophobicContact CD2-CD1 3.8Å; F17-F28 HydrophobicContact CD2-CE1 4.24Å; F17-F28 AromaticContact CE2-CD1 3.81Å; F17-F28 HydrophobicContact CE2-CD1 3.81Å; F17-L29 HydrophobicContact CE2-CD2 4.42Å; F17-L29 HydrophobicContact CE2-CG 4.14Å; F17-L29 HydrophobicContact CZ-CD1 3.99Å; F17-L29 HydrophobicContact CZ-CD2 4.24Å; F17-L29 HydrophobicContact CZ-CG 3.97Å |
| 18 | S | 95.6 | Very high | 93.7 | Very high | 83 Ų | 83 | 81 Ų | 81 | 58% | 0.58 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -67.3 | -21.7 | 176.7 | 75.8 | 0 | 0 | 0 | 0 | 114.1 | Y14 R15 W16 | Y14-S18 WeakPolarHBondContact O-CB 3.2Å; Y14-S18 PolarHBondContact O-N 3.47Å; R15-S18 PolarHBondContact O-N 2.78Å; R15-S18 PolarHBondContact O-OG 3.16Å; W16-S18 PolarHBondContact O-N 3.4Å |
| 19 | T | 96.8 | Very high | 94.7 | Very high | 108 Ų | 108 | 80.2 Ų | 80.2 | 66% | 0.663 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -87.2 | -9.7 | 177 | 64.8 | 0 | 0 | 0 | 0 | 113.6 | R15 W16 F17 | R15-T19 PolarHBondContact O-N 3.39Å; W16-T19 PolarHBondContact O-N 3.04Å; W16-T19 PolarHBondContact O-OG1 3.02Å; F17-T19 PolarHBondContact O-N 2.75Å |
| 20 | L | 96.9 | Very high | 95.1 | Very high | 21 Ų | 21 | 75.6 Ų | 75.6 | 11% | 0.11 | 37% | 0.372 | C | S | . | . | S | Bend | trans | -73.5 | 151.5 | 179.5 | -62.8 | -179.3 | 0 | 0 | 0 | 111.5 | W16 F17 Q24 R25 | W16-L20 HydrophobicContact CE3-CD1 4.47Å; W16-L20 HydrophobicContact CH2-CD1 3.74Å; W16-L20 HydrophobicContact CZ2-CD1 3.83Å; W16-L20 HydrophobicContact CZ2-CD2 3.9Å; W16-L20 HydrophobicContact CZ2-CG 4.31Å; W16-L20 HydrophobicContact CZ3-CD1 4.07Å; F17-L20 HydrophobicContact CD2-CD1 3.94Å; F17-L20 WeakPolarHBondContact O-CB 3.36Å; F17-L20 PolarHBondContact O-N 2.89Å; L20-Q24 HydrophobicContact CB-CB 3.87Å; L20-Q24 HydrophobicContact CD1-CB 4.37Å; L20-Q24 HydrophobicContact CD2-CB 4.29Å; L20-Q24 HydrophobicContact CG-CB 4.41Å; L20-R25 HydrophobicContact CB-CG 3.75Å; L20-R25 HydrophobicContact CD1-CG 4.45Å; L20-R25 PolarHBondContact O-NH1 3.3Å |
| 21 | T | 95.3 | Very high | 95.6 | Very high | 41 Ų | 41 | 69.8 Ų | 69.8 | 25% | 0.252 | 36% | 0.362 | S | S | . | . | trans | -69 | 165.9 | 170.6 | 70.2 | 0 | 0 | 0 | 0 | 111.3 | A23 Q24 R25 | T21-A23 VanDerWaalsContact C-N 3.28Å; T21-A23 PolarHBondContact O-N 3.1Å; T21-Q24 PolarHBondContact O-N 3.26Å; T21-Q24 WeakPolarHBondContact OG1-CG 3.25Å; T21-Q24 PolarHBondContact OG1-N 3.26Å; T21-Q24 PolarHBondContact OG1-OE1 3.37Å; T21-R25 WeakPolarHBondContact O-CG 2.98Å; T21-R25 PolarHBondContact O-N 3.14Å | ||
| 22 | S | 95.6 | Very high | 95.9 | Very high | 50 Ų | 50 | 69.3 Ų | 69.3 | 35% | 0.35 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -57.5 | -40.3 | 177.4 | -64.8 | 0 | 0 | 0 | 0 | 112.9 | R25 A26 | S22-R25 PolarHBondContact O-N 3.44Å; S22-R25 PolarHBondContact OG-NH2 3Å; S22-A26 WeakPolarHBondContact O-CB 3.15Å; S22-A26 PolarHBondContact O-N 3.35Å |
| 23 | A | 95.7 | Very high | 96.1 | Very high | 6 Ų | 6 | 70.5 Ų | 70.5 | 5% | 0.05 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -63.3 | -47 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | T21 R25 A26 E27 L133 L134 | T21-A23 VanDerWaalsContact C-N 3.28Å; T21-A23 PolarHBondContact O-N 3.1Å; A23-R25 PolarHBondContact O-N 3.26Å; A23-A26 PolarHBondContact O-N 3.07Å; A23-E27 PolarHBondContact O-N 2.91Å; A23-L133 HydrophobicContact CB-CB 3.77Å; A23-L134 HydrophobicContact CB-CB 4.18Å |
| 24 | Q | 96.6 | Very high | 96.3 | Very high | 91 Ų | 91 | 74.8 Ų | 74.8 | 43% | 0.425 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -63.8 | -40.4 | 178.4 | -72.2 | 172.5 | -29.9 | 0 | 0 | 112.2 | L20 T21 F28 | L20-Q24 HydrophobicContact CB-CB 3.87Å; L20-Q24 HydrophobicContact CD1-CB 4.37Å; L20-Q24 HydrophobicContact CD2-CB 4.29Å; L20-Q24 HydrophobicContact CG-CB 4.41Å; T21-Q24 PolarHBondContact O-N 3.26Å; T21-Q24 WeakPolarHBondContact OG1-CG 3.25Å; T21-Q24 PolarHBondContact OG1-N 3.26Å; T21-Q24 PolarHBondContact OG1-OE1 3.37Å; Q24-F28 WeakPolarHBondContact O-CB 3.3Å; Q24-F28 PolarHBondContact O-N 3.29Å |
| 25 | R | 98.1 | Very high | 96.5 | Very high | 78 Ų | 78 | 74.4 Ų | 74.4 | 29% | 0.294 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -62.2 | -44.9 | 175 | -71.8 | -169.9 | -61.9 | -103.7 | 0.8 | 111.7 | F17 L20 T21 S22 A23 F28 L29 | F17-R25 HydrophobicContact CD1-CG 4.46Å; F17-R25 HydrophobicContact CD2-CG 4.25Å; F17-R25 HydrophobicContact CE1-CB 4.43Å; F17-R25 HydrophobicContact CE1-CG 3.97Å; F17-R25 HydrophobicContact CE2-CB 3.84Å; F17-R25 HydrophobicContact CE2-CG 3.72Å; F17-R25 HydrophobicContact CZ-CB 3.64Å; F17-R25 HydrophobicContact CZ-CG 3.57Å; L20-R25 HydrophobicContact CB-CG 3.75Å; L20-R25 HydrophobicContact CD1-CG 4.45Å; L20-R25 PolarHBondContact O-NH1 3.3Å; T21-R25 WeakPolarHBondContact O-CG 2.98Å; T21-R25 PolarHBondContact O-N 3.14Å; S22-R25 PolarHBondContact O-N 3.44Å; S22-R25 PolarHBondContact OG-NH2 3Å; A23-R25 PolarHBondContact O-N 3.26Å; R25-F28 PolarHBondContact O-N 3.44Å; R25-L29 WeakPolarHBondContact O-CB 2.91Å; R25-L29 VanDerWaalsContact O-CG 3.26Å; R25-L29 WeakPolarHBondContact O-CG 3.32Å; R25-L29 PolarHBondContact O-N 2.93Å |
| 26 | A | 97 | Very high | 96.6 | Very high | 27 Ų | 27 | 67.3 Ų | 67.3 | 22% | 0.223 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -62.7 | -48.5 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | S22 A23 F28 L29 C30 L134 T137 | S22-A26 WeakPolarHBondContact O-CB 3.15Å; S22-A26 PolarHBondContact O-N 3.35Å; A23-A26 PolarHBondContact O-N 3.07Å; A26-F28 PolarHBondContact O-N 3.39Å; A26-L29 PolarHBondContact O-N 3.23Å; A26-C30 PolarHBondContact O-N 3.28Å; A26-C30 PolarHBondContact O-SG 3.06Å; A26-C30 VanDerWaalsContact O-SG 3.33Å; A26-L134 HydrophobicContact CB-CD1 4.19Å; A26-T137 HydrophobicContact CB-CG2 4.19Å |
| 27 | E | 96.3 | Very high | 96.7 | Very high | 59 Ų | 59 | 65.2 Ų | 65.2 | 28% | 0.276 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -59.9 | -46.5 | 177.1 | -176.3 | 171.7 | -150.1 | 0 | 0 | 111.8 | A23 L29 C30 G31 T137 R154 | A23-E27 PolarHBondContact O-N 2.91Å; E27-L29 PolarHBondContact O-N 3.4Å; E27-C30 PolarHBondContact O-N 3.17Å; E27-G31 PolarHBondContact O-N 3.36Å; E27-T137 HydrophobicContact CB-CG2 3.8Å; E27-R154 IonicContact OE1-NH1 3.96Å; E27-R154 IonicContact OE1-NH2 3.61Å |
| 28 | F | 97.1 | Very high | 96.8 | Very high | 71 Ų | 71 | 67.8 Ų | 67.8 | 31% | 0.311 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -62.3 | -44.4 | 179.5 | -176.6 | -102.6 | 0 | 0 | 0 | 112 | W16 F17 Q24 R25 A26 G31 L32 | W16-F28 AromaticContact CH2-CD2 3.72Å; W16-F28 HydrophobicContact CH2-CD2 3.72Å; W16-F28 HydrophobicContact CH2-CE1 4.41Å; W16-F28 AromaticContact CH2-CE2 3.63Å; W16-F28 HydrophobicContact CH2-CE2 3.63Å; W16-F28 HydrophobicContact CH2-CG 4.17Å; W16-F28 AromaticContact CH2-CZ 4Å; W16-F28 HydrophobicContact CH2-CZ 4Å; W16-F28 HydrophobicContact CZ3-CD1 4.28Å; W16-F28 HydrophobicContact CZ3-CD2 4.18Å; W16-F28 AromaticContact CZ3-CE1 3.9Å; W16-F28 HydrophobicContact CZ3-CE1 3.9Å; W16-F28 AromaticContact CZ3-CE2 3.81Å; W16-F28 HydrophobicContact CZ3-CE2 3.81Å; W16-F28 HydrophobicContact CZ3-CG 4.4Å; W16-F28 AromaticContact CZ3-CZ 3.65Å; W16-F28 HydrophobicContact CZ3-CZ 3.65Å; F17-F28 AromaticContact CD2-CD1 3.8Å; F17-F28 HydrophobicContact CD2-CD1 3.8Å; F17-F28 HydrophobicContact CD2-CE1 4.24Å; F17-F28 AromaticContact CE2-CD1 3.81Å; F17-F28 HydrophobicContact CE2-CD1 3.81Å; Q24-F28 WeakPolarHBondContact O-CB 3.3Å; Q24-F28 PolarHBondContact O-N 3.29Å; R25-F28 PolarHBondContact O-N 3.44Å; A26-F28 PolarHBondContact O-N 3.39Å; F28-G31 PolarHBondContact O-N 3.34Å; F28-L32 HydrophobicContact CD1-CD1 3.97Å; F28-L32 HydrophobicContact CD1-CG 4.27Å; F28-L32 HydrophobicContact CE1-CD1 3.43Å; F28-L32 VanDerWaalsContact CE1-CD1 3.43Å; F28-L32 HydrophobicContact CE1-CD2 4.4Å; F28-L32 HydrophobicContact CE1-CG 3.91Å; F28-L32 HydrophobicContact CZ-CD1 3.98Å; F28-L32 HydrophobicContact CZ-CD2 4.12Å; F28-L32 HydrophobicContact CZ-CG 4.11Å; F28-L32 WeakPolarHBondContact O-CG 3.11Å; F28-L32 PolarHBondContact O-N 2.93Å |
| 29 | L | 97.4 | Very high | 96.9 | Very high | 85 Ų | 85 | 70 Ų | 70 | 45% | 0.445 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -63.3 | -43.1 | 176.5 | -73.8 | 172.7 | 0 | 0 | 0 | 111.8 | F17 R25 A26 E27 G31 L32 L33 | F17-L29 HydrophobicContact CE2-CD2 4.42Å; F17-L29 HydrophobicContact CE2-CG 4.14Å; F17-L29 HydrophobicContact CZ-CD1 3.99Å; F17-L29 HydrophobicContact CZ-CD2 4.24Å; F17-L29 HydrophobicContact CZ-CG 3.97Å; R25-L29 WeakPolarHBondContact O-CB 2.91Å; R25-L29 VanDerWaalsContact O-CG 3.26Å; R25-L29 WeakPolarHBondContact O-CG 3.32Å; R25-L29 PolarHBondContact O-N 2.93Å; A26-L29 PolarHBondContact O-N 3.23Å; E27-L29 PolarHBondContact O-N 3.4Å; L29-G31 VanDerWaalsContact C-N 3.32Å; L29-G31 PolarHBondContact O-N 2.92Å; L29-L32 PolarHBondContact O-N 3.37Å; L29-L33 VanDerWaalsContact O-CG 3.29Å; L29-L33 WeakPolarHBondContact O-CG 3.33Å; L29-L33 PolarHBondContact O-N 3.22Å |
| 30 | C | 96.1 | Very high | 97 | Very high | 41 Ų | 41 | 69.3 Ų | 69.3 | 28% | 0.277 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -57 | -46.7 | 173.3 | -72.3 | 0 | 0 | 0 | 0 | 111.2 | A26 E27 L32 L33 D34 | A26-C30 PolarHBondContact O-N 3.28Å; A26-C30 PolarHBondContact O-SG 3.06Å; A26-C30 VanDerWaalsContact O-SG 3.33Å; E27-C30 PolarHBondContact O-N 3.17Å; C30-L32 VanDerWaalsContact C-N 3.33Å; C30-L32 PolarHBondContact O-N 3.21Å; C30-L33 PolarHBondContact O-N 2.79Å; C30-D34 PolarHBondContact O-N 3.01Å |
| 31 | G | 96.6 | Very high | 97 | Very high | 36 Ų | 36 | 71.8 Ų | 71.8 | 37% | 0.371 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -61.6 | -36.8 | 177 | 0 | 0 | 0 | 0 | 0 | 113.6 | E27 F28 L29 L35 | E27-G31 PolarHBondContact O-N 3.36Å; F28-G31 PolarHBondContact O-N 3.34Å; L29-G31 VanDerWaalsContact C-N 3.32Å; L29-G31 PolarHBondContact O-N 2.92Å; G31-L35 WeakPolarHBondContact O-CG 3.48Å |
| 32 | L | 96.6 | Very high | 97.2 | Very high | 78 Ų | 78 | 79.5 Ų | 79.5 | 41% | 0.408 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -67.8 | -41.5 | 173.7 | -71.2 | -175.5 | 0 | 0 | 0 | 112.3 | F28 L29 C30 D34 L35 | F28-L32 HydrophobicContact CD1-CD1 3.97Å; F28-L32 HydrophobicContact CD1-CG 4.27Å; F28-L32 HydrophobicContact CE1-CD1 3.43Å; F28-L32 VanDerWaalsContact CE1-CD1 3.43Å; F28-L32 HydrophobicContact CE1-CD2 4.4Å; F28-L32 HydrophobicContact CE1-CG 3.91Å; F28-L32 HydrophobicContact CZ-CD1 3.98Å; F28-L32 HydrophobicContact CZ-CD2 4.12Å; F28-L32 HydrophobicContact CZ-CG 4.11Å; F28-L32 WeakPolarHBondContact O-CG 3.11Å; F28-L32 PolarHBondContact O-N 2.93Å; L29-L32 PolarHBondContact O-N 3.37Å; C30-L32 VanDerWaalsContact C-N 3.33Å; C30-L32 PolarHBondContact O-N 3.21Å; L32-D34 VanDerWaalsContact C-N 3.3Å; L32-D34 PolarHBondContact O-N 3.32Å; L32-L35 WeakPolarHBondContact O-CB 3.44Å; L32-L35 PolarHBondContact O-N 3.4Å; L32-L35 VanDerWaalsContact O-N 3.14Å |
| 33 | L | 96.9 | Very high | 97.3 | Very high | 58 Ų | 58 | 83.6 Ų | 83.6 | 30% | 0.304 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -63.8 | -36.3 | 178.5 | -69.4 | 170.6 | 0 | 0 | 0 | 111.5 | L29 C30 L35 C36 L41 L44 | L29-L33 VanDerWaalsContact O-CG 3.29Å; L29-L33 WeakPolarHBondContact O-CG 3.33Å; L29-L33 PolarHBondContact O-N 3.22Å; C30-L33 PolarHBondContact O-N 2.79Å; L33-L35 PolarHBondContact O-N 3.34Å; L33-C36 WeakPolarHBondContact O-CB 3.34Å; L33-C36 PolarHBondContact O-N 3.25Å; L33-L41 HydrophobicContact CB-CD2 4.14Å; L33-L41 HydrophobicContact CD2-CD2 3.97Å; L33-L41 WeakPolarHBondContact O-CD2 3.28Å; L33-L44 HydrophobicContact CD2-CD1 3.72Å |
| 34 | D | 96.1 | Very high | 97.4 | Very high | 134 Ų | 134 | 86.1 Ų | 86.1 | 72% | 0.717 | 44% | 0.444 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.8 | -18.5 | 175.9 | -74.4 | -18.9 | 0 | 0 | 0 | 113.5 | C30 L32 | C30-D34 PolarHBondContact O-N 3.01Å; L32-D34 VanDerWaalsContact C-N 3.3Å; L32-D34 PolarHBondContact O-N 3.32Å |
| 35 | L | 97.5 | Very high | 97.4 | Very high | 141 Ų | 141 | 83 Ų | 83 | 74% | 0.738 | 44% | 0.436 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.4 | -11.8 | 176.2 | -59.2 | 174.3 | 0 | 0 | 0 | 113.2 | G31 L32 L33 | G31-L35 WeakPolarHBondContact O-CG 3.48Å; L32-L35 WeakPolarHBondContact O-CB 3.44Å; L32-L35 PolarHBondContact O-N 3.4Å; L32-L35 VanDerWaalsContact O-N 3.14Å; L33-L35 PolarHBondContact O-N 3.34Å |
| 36 | C | 98.1 | Very high | 97.4 | Very high | 36 Ų | 36 | 82.7 Ų | 82.7 | 24% | 0.243 | 45% | 0.446 | C | S | . | . | S | Bend | trans | -78.3 | 148.7 | -178.4 | -71.5 | 0 | 0 | 0 | 0 | 112.3 | L33 E40 L41 | L33-C36 WeakPolarHBondContact O-CB 3.34Å; L33-C36 PolarHBondContact O-N 3.25Å; C36-E40 WeakPolarHBondContact CA-OE2 3.42Å; C36-E40 HydrophobicContact CB-CB 4.07Å; C36-L41 HydrophobicContact CB-CD2 3.81Å; C36-L41 HydrophobicContact CB-CG 3.83Å |
| 37 | V | 98.2 | Very high | 97.4 | Very high | 75 Ų | 75 | 83.8 Ų | 83.8 | 46% | 0.455 | 45% | 0.451 | S | S | . | . | trans | -80.9 | 161.9 | 171.9 | -61.4 | 0 | 0 | 0 | 0 | 111.5 | I39 E40 L41 | V37-I39 VanDerWaalsContact C-N 3.3Å; V37-I39 HydrophobicContact CG2-CG2 3.92Å; V37-I39 PolarHBondContact O-N 2.69Å; V37-I39 VanDerWaalsContact O-N 3.11Å; V37-E40 HydrophobicContact CG2-CB 4.25Å; V37-E40 HydrophobicContact CG2-CG 3.65Å; V37-E40 WeakPolarHBondContact CG2-OE2 3.41Å; V37-E40 PolarHBondContact N-OE2 3.24Å; V37-E40 WeakPolarHBondContact O-CB 3.41Å; V37-E40 PolarHBondContact O-N 2.98Å; V37-L41 PolarHBondContact O-N 3.49Å | ||
| 38 | P | 98 | Very high | 97.4 | Very high | 104 Ų | 104 | 85.7 Ų | 85.7 | 68% | 0.675 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -55.7 | -36.1 | -172.6 | -30.4 | 36.9 | 0 | 0 | 0 | 115.8 | R42 | P38-R42 WeakPolarHBondContact O-CG 3.38Å; P38-R42 PolarHBondContact O-N 2.64Å; P38-R42 VanDerWaalsContact O-N 3.07Å |
| 39 | I | 98.2 | Very high | 97.2 | Very high | 130 Ų | 130 | 87.8 Ų | 87.8 | 67% | 0.667 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -71.1 | -35.1 | 179.1 | -170.4 | 60.9 | 0 | 0 | 0 | 112.1 | V37 R42 F43 | V37-I39 VanDerWaalsContact C-N 3.3Å; V37-I39 HydrophobicContact CG2-CG2 3.92Å; V37-I39 PolarHBondContact O-N 2.69Å; V37-I39 VanDerWaalsContact O-N 3.11Å; I39-R42 PolarHBondContact O-N 3.27Å; I39-F43 PolarHBondContact O-N 3.34Å |
| 40 | E | 98.4 | Very high | 97.2 | Very high | 93 Ų | 93 | 87.9 Ų | 87.9 | 44% | 0.435 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -67.1 | -44.8 | 175 | -66 | 171.6 | 158.9 | 0 | 0 | 110.2 | C36 V37 R42 F43 L44 | C36-E40 WeakPolarHBondContact CA-OE2 3.42Å; C36-E40 HydrophobicContact CB-CB 4.07Å; V37-E40 HydrophobicContact CG2-CB 4.25Å; V37-E40 HydrophobicContact CG2-CG 3.65Å; V37-E40 WeakPolarHBondContact CG2-OE2 3.41Å; V37-E40 PolarHBondContact N-OE2 3.24Å; V37-E40 WeakPolarHBondContact O-CB 3.41Å; V37-E40 PolarHBondContact O-N 2.98Å; E40-R42 VanDerWaalsContact C-N 3.3Å; E40-R42 PolarHBondContact O-N 3.46Å; E40-F43 PolarHBondContact O-N 2.86Å; E40-L44 WeakPolarHBondContact O-CB 3.23Å; E40-L44 VanDerWaalsContact O-CG 3.3Å; E40-L44 WeakPolarHBondContact O-CG 3.32Å; E40-L44 PolarHBondContact O-N 2.86Å |
| 41 | L | 98 | Very high | 97.1 | Very high | 73 Ų | 73 | 91.5 Ų | 91.5 | 38% | 0.382 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -58 | -41.8 | 175.1 | -72.4 | 175 | 0 | 0 | 0 | 112.1 | L33 C36 V37 L44 G45 | L33-L41 HydrophobicContact CB-CD2 4.14Å; L33-L41 HydrophobicContact CD2-CD2 3.97Å; L33-L41 WeakPolarHBondContact O-CD2 3.28Å; C36-L41 HydrophobicContact CB-CD2 3.81Å; C36-L41 HydrophobicContact CB-CG 3.83Å; V37-L41 PolarHBondContact O-N 3.49Å; L41-L44 PolarHBondContact O-N 2.9Å; L41-G45 PolarHBondContact O-N 3.06Å |
| 42 | R | 98.1 | Very high | 97 | Very high | 203 Ų | 203 | 92 Ų | 92 | 77% | 0.766 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -63.7 | -44.2 | 176.2 | -72.5 | -65.6 | -178 | 171.1 | -1.1 | 112.1 | P38 I39 E40 G45 S46 | P38-R42 WeakPolarHBondContact O-CG 3.38Å; P38-R42 PolarHBondContact O-N 2.64Å; P38-R42 VanDerWaalsContact O-N 3.07Å; I39-R42 PolarHBondContact O-N 3.27Å; E40-R42 VanDerWaalsContact C-N 3.3Å; E40-R42 PolarHBondContact O-N 3.46Å; R42-G45 PolarHBondContact O-N 3.21Å; R42-S46 PolarHBondContact O-N 3.36Å; R42-S46 PolarHBondContact O-OG 3.35Å |
| 43 | F | 98.4 | Very high | 96.8 | Very high | 136 Ų | 136 | 94.3 Ų | 94.3 | 60% | 0.596 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -63.1 | -47.8 | 176 | 170.9 | -105.6 | 0 | 0 | 0 | 112.1 | I39 E40 G45 S46 C47 | I39-F43 PolarHBondContact O-N 3.34Å; E40-F43 PolarHBondContact O-N 2.86Å; F43-G45 VanDerWaalsContact C-N 3.28Å; F43-G45 PolarHBondContact O-N 2.95Å; F43-S46 WeakPolarHBondContact O-CB 3.3Å; F43-S46 PolarHBondContact O-N 2.96Å; F43-S46 VanDerWaalsContact O-N 3.1Å; F43-C47 PolarHBondContact O-N 3.42Å; F43-C47 VanDerWaalsContact O-N 3.1Å |
| 44 | L | 98.2 | Very high | 96.6 | Very high | 60 Ų | 60 | 99.9 Ų | 99.9 | 31% | 0.314 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -60.8 | -38 | 177.4 | -70.6 | 172.3 | 0 | 0 | 0 | 111.6 | L33 E40 L41 S46 C47 L48 | L33-L44 HydrophobicContact CD2-CD1 3.72Å; E40-L44 WeakPolarHBondContact O-CB 3.23Å; E40-L44 VanDerWaalsContact O-CG 3.3Å; E40-L44 WeakPolarHBondContact O-CG 3.32Å; E40-L44 PolarHBondContact O-N 2.86Å; L41-L44 PolarHBondContact O-N 2.9Å; L44-S46 VanDerWaalsContact C-N 3.34Å; L44-S46 PolarHBondContact O-N 2.8Å; L44-C47 WeakPolarHBondContact O-CB 3.41Å; L44-C47 PolarHBondContact O-N 2.69Å; L44-L48 WeakPolarHBondContact O-CB 3.25Å; L44-L48 VanDerWaalsContact O-CG 3.29Å; L44-L48 WeakPolarHBondContact O-CG 3.28Å; L44-L48 PolarHBondContact O-N 3.43Å |
| 45 | G | 96.4 | Very high | 96.4 | Very high | 26 Ų | 26 | 97.6 Ų | 97.6 | 27% | 0.268 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -54.5 | -48 | 171.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | L41 R42 F43 C47 L48 E49 | L41-G45 PolarHBondContact O-N 3.06Å; R42-G45 PolarHBondContact O-N 3.21Å; F43-G45 VanDerWaalsContact C-N 3.28Å; F43-G45 PolarHBondContact O-N 2.95Å; G45-C47 VanDerWaalsContact C-N 3.35Å; G45-C47 PolarHBondContact O-N 2.88Å; G45-L48 PolarHBondContact O-N 3Å; G45-E49 WeakPolarHBondContact O-CG 3.26Å; G45-E49 PolarHBondContact O-N 2.9Å |
| 46 | S | 97.6 | Very high | 96 | Very high | 71 Ų | 71 | 96.2 Ų | 96.2 | 50% | 0.497 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.9 | -38.1 | 176.1 | -59.4 | 0 | 0 | 0 | 0 | 113.1 | R42 F43 L44 D50 | R42-S46 PolarHBondContact O-N 3.36Å; R42-S46 PolarHBondContact O-OG 3.35Å; F43-S46 WeakPolarHBondContact O-CB 3.3Å; F43-S46 PolarHBondContact O-N 2.96Å; F43-S46 VanDerWaalsContact O-N 3.1Å; L44-S46 VanDerWaalsContact C-N 3.34Å; L44-S46 PolarHBondContact O-N 2.8Å; S46-D50 WeakPolarHBondContact O-CB 3.43Å; S46-D50 PolarHBondContact O-N 3.42Å; S46-D50 VanDerWaalsContact O-N 3.08Å |
| 47 | C | 97.8 | Very high | 95.8 | Very high | 49 Ų | 49 | 102.7 Ų | 102.7 | 33% | 0.331 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.9 | -42.5 | 174.8 | -65.2 | 0 | 0 | 0 | 0 | 112 | F43 L44 G45 D50 L51 | F43-C47 PolarHBondContact O-N 3.42Å; F43-C47 VanDerWaalsContact O-N 3.1Å; L44-C47 WeakPolarHBondContact O-CB 3.41Å; L44-C47 PolarHBondContact O-N 2.69Å; G45-C47 VanDerWaalsContact C-N 3.35Å; G45-C47 PolarHBondContact O-N 2.88Å; C47-D50 PolarHBondContact O-N 3.35Å; C47-L51 WeakPolarHBondContact O-CG 3.43Å; C47-L51 PolarHBondContact O-N 2.86Å; C47-L51 VanDerWaalsContact O-N 3.08Å |
| 48 | L | 95.2 | Very high | 95.7 | Very high | 100 Ų | 100 | 103.2 Ų | 103.2 | 52% | 0.524 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -66.2 | -44.1 | 178.6 | -70.6 | 170.8 | 0 | 0 | 0 | 111.5 | L44 G45 D50 L51 A52 | L44-L48 WeakPolarHBondContact O-CB 3.25Å; L44-L48 VanDerWaalsContact O-CG 3.29Å; L44-L48 WeakPolarHBondContact O-CG 3.28Å; L44-L48 PolarHBondContact O-N 3.43Å; G45-L48 PolarHBondContact O-N 3Å; L48-D50 VanDerWaalsContact C-N 3.27Å; L48-D50 PolarHBondContact O-N 3.21Å; L48-L51 PolarHBondContact O-N 2.96Å; L48-A52 VanDerWaalsContact O-CB 3.27Å; L48-A52 WeakPolarHBondContact O-CB 3.49Å; L48-A52 PolarHBondContact O-N 2.99Å |
| 49 | E | 94.4 | Very high | 95.6 | Very high | 115 Ų | 115 | 101.5 Ų | 101.5 | 54% | 0.537 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -58 | -41 | 173.9 | -76 | 173.9 | -167.1 | 0 | 0 | 111.6 | G45 A52 R53 | G45-E49 WeakPolarHBondContact O-CG 3.26Å; G45-E49 PolarHBondContact O-N 2.9Å; E49-A52 PolarHBondContact O-N 2.95Å; E49-R53 WeakPolarHBondContact O-CB 3.36Å; E49-R53 PolarHBondContact O-N 3.37Å |
| 50 | D | 96.3 | Very high | 95.5 | Very high | 86 Ų | 86 | 102.8 Ų | 102.8 | 46% | 0.46 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.5 | -44.4 | 178 | -169.3 | 69 | 0 | 0 | 0 | 113.1 | S46 C47 L48 R53 | S46-D50 WeakPolarHBondContact O-CB 3.43Å; S46-D50 PolarHBondContact O-N 3.42Å; S46-D50 VanDerWaalsContact O-N 3.08Å; C47-D50 PolarHBondContact O-N 3.35Å; L48-D50 VanDerWaalsContact C-N 3.27Å; L48-D50 PolarHBondContact O-N 3.21Å; D50-R53 IonicContact OD1-CZ 3.18Å; D50-R53 IonicContact OD1-NH1 2.66Å; D50-R53 PolarHBondContact OD1-NH1 3.45Å; D50-R53 IonicContact OD1-NH2 2.8Å; D50-R53 PolarHBondContact OD1-NH2 3.19Å |
| 51 | L | 95.2 | Very high | 95.4 | Very high | 117 Ų | 117 | 103.8 Ų | 103.8 | 61% | 0.613 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -64.2 | -43.4 | 176.5 | -70.5 | 169.5 | 0 | 0 | 0 | 111.7 | C47 L48 | C47-L51 WeakPolarHBondContact O-CG 3.43Å; C47-L51 PolarHBondContact O-N 2.86Å; C47-L51 VanDerWaalsContact O-N 3.08Å; L48-L51 PolarHBondContact O-N 2.96Å |
| 52 | A | 92.5 | Very high | 95.4 | Very high | 46 Ų | 46 | 101.8 Ų | 101.8 | 38% | 0.38 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -78.2 | -21.2 | -175.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | L48 E49 K54 D55 Y56 | L48-A52 VanDerWaalsContact O-CB 3.27Å; L48-A52 WeakPolarHBondContact O-CB 3.49Å; L48-A52 PolarHBondContact O-N 2.99Å; E49-A52 PolarHBondContact O-N 2.95Å; A52-K54 PolarHBondContact O-N 2.95Å; A52-D55 PolarHBondContact O-N 2.88Å; A52-Y56 VanDerWaalsContact C-CE1 3.45Å; A52-Y56 HydrophobicContact CB-CE1 3.91Å; A52-Y56 WeakPolarHBondContact O-CD1 3.47Å; A52-Y56 WeakPolarHBondContact O-CE1 3.29Å |
| 53 | R | 92.5 | Very high | 95.4 | Very high | 128 Ų | 128 | 96.7 Ų | 96.7 | 48% | 0.483 | 49% | 0.492 | S | S | . | . | G | 310 helix | trans | -52.2 | -29.5 | -174.8 | -161.7 | -177.3 | -54.1 | 103 | -5 | 114.4 | E49 D50 D55 Y56 | E49-R53 WeakPolarHBondContact O-CB 3.36Å; E49-R53 PolarHBondContact O-N 3.37Å; D50-R53 IonicContact OD1-CZ 3.18Å; D50-R53 IonicContact OD1-NH1 2.66Å; D50-R53 PolarHBondContact OD1-NH1 3.45Å; D50-R53 IonicContact OD1-NH2 2.8Å; D50-R53 PolarHBondContact OD1-NH2 3.19Å; R53-D55 PolarHBondContact O-N 2.95Å; R53-Y56 HydrophobicContact CB-CE2 4.41Å; R53-Y56 HydrophobicContact CG-CD2 4.06Å; R53-Y56 HydrophobicContact CG-CE2 4.07Å; R53-Y56 PolarHBondContact O-N 3.45Å |
| 54 | K | 92.7 | Very high | 95.4 | Very high | 175 Ų | 175 | 95 Ų | 95 | 76% | 0.761 | 49% | 0.487 | S | S | * | . | G | 310 helix | trans | -62.1 | -29.8 | -178 | -62.5 | 178.2 | -176 | 173.2 | 0 | 112.7 | A52 | A52-K54 PolarHBondContact O-N 2.95Š|
| 55 | D | 92.4 | Very high | 95.4 | Very high | 86 Ų | 86 | 97.7 Ų | 97.7 | 46% | 0.46 | 50% | 0.497 | S | S | . | . | G | 310 helix | trans | -100.9 | 3.3 | -174.8 | -60.1 | -57.2 | 0 | 0 | 0 | 113.1 | A52 R53 H57 S58 L59 | A52-D55 PolarHBondContact O-N 2.88Å; R53-D55 PolarHBondContact O-N 2.95Å; D55-H57 VanDerWaalsContact C-N 3.35Å; D55-H57 PolarHBondContact O-N 3.48Å; D55-S58 PolarHBondContact O-N 3.01Å; D55-S58 PolarHBondContact O-OG 3.49Å; D55-L59 HydrophobicContact CB-CD1 3.81Å; D55-L59 HydrophobicContact CB-CG 4.27Å; D55-L59 WeakPolarHBondContact O-CB 3.41Å; D55-L59 WeakPolarHBondContact O-CG 3.35Å; D55-L59 PolarHBondContact O-N 2.92Å |
| 56 | Y | 89.7 | Confident | 95.4 | Very high | 111 Ų | 111 | 96.5 Ų | 96.5 | 44% | 0.435 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60.8 | -43 | -175.2 | -76.6 | 11.4 | 0 | 0 | 0 | 112.5 | A52 R53 R60 | A52-Y56 VanDerWaalsContact C-CE1 3.45Å; A52-Y56 HydrophobicContact CB-CE1 3.91Å; A52-Y56 WeakPolarHBondContact O-CD1 3.47Å; A52-Y56 WeakPolarHBondContact O-CE1 3.29Å; R53-Y56 HydrophobicContact CB-CE2 4.41Å; R53-Y56 HydrophobicContact CG-CD2 4.06Å; R53-Y56 HydrophobicContact CG-CE2 4.07Å; R53-Y56 PolarHBondContact O-N 3.45Å; Y56-R60 PolarHBondContact O-N 3.34Å; Y56-R60 VanDerWaalsContact O-N 3.12Å |
| 57 | H | 93.9 | Very high | 95.5 | Very high | 173 Ų | 173 | 95.3 Ų | 95.3 | 80% | 0.801 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -68.4 | -38.5 | -179.3 | -69.8 | -59.9 | 0 | 0 | 0 | 112.6 | D55 | D55-H57 VanDerWaalsContact C-N 3.35Å; D55-H57 PolarHBondContact O-N 3.48Å |
| 58 | S | 95.2 | Very high | 95.5 | Very high | 86 Ų | 86 | 95.9 Ų | 95.9 | 60% | 0.601 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -74.4 | -28.8 | -179.4 | 52 | 0 | 0 | 0 | 0 | 112.4 | D55 | D55-S58 PolarHBondContact O-N 3.01Å; D55-S58 PolarHBondContact O-OG 3.49Å |
| 59 | L | 96.1 | Very high | 95.6 | Very high | 68 Ų | 68 | 92.2 Ų | 92.2 | 36% | 0.356 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -94.3 | -9.8 | -177.6 | -63.4 | 176.1 | 0 | 0 | 0 | 114.3 | D55 D61 A62 E63 L93 | D55-L59 HydrophobicContact CB-CD1 3.81Å; D55-L59 HydrophobicContact CB-CG 4.27Å; D55-L59 WeakPolarHBondContact O-CB 3.41Å; D55-L59 WeakPolarHBondContact O-CG 3.35Å; D55-L59 PolarHBondContact O-N 2.92Å; L59-D61 PolarHBondContact O-N 3.25Å; L59-A62 CarbonylContact O-C 3.6Å; L59-A62 WeakPolarHBondContact O-CA 3.28Å; L59-A62 WeakPolarHBondContact O-CB 3.35Å; L59-A62 PolarHBondContact O-N 2.91Å; L59-E63 PolarHBondContact O-N 2.93Å; L59-L93 HydrophobicContact CB-CD1 4.11Å; L59-L93 HydrophobicContact CB-CD2 4.34Å; L59-L93 HydrophobicContact CD1-CD2 4.26Å; L59-L93 HydrophobicContact CD2-CD1 4.49Å |
| 60 | R | 96.2 | Very high | 95.7 | Very high | 157 Ų | 157 | 89.9 Ų | 89.9 | 59% | 0.592 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -52.5 | -47.5 | -174.8 | -172.8 | 177.7 | -176.5 | -174.3 | 1.2 | 114.1 | Y56 A62 E63 I64 | Y56-R60 PolarHBondContact O-N 3.34Å; Y56-R60 VanDerWaalsContact O-N 3.12Å; R60-A62 VanDerWaalsContact C-N 3.29Å; R60-A62 PolarHBondContact O-N 3.04Å; R60-E63 PolarHBondContact O-N 3.24Å; R60-I64 HydrophobicContact CG-CD1 4.28Å; R60-I64 WeakPolarHBondContact O-CG1 3.41Å; R60-I64 PolarHBondContact O-N 3.32Å |
| 61 | D | 97.5 | Very high | 95.7 | Very high | 114 Ų | 114 | 89.4 Ų | 89.4 | 61% | 0.61 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -67.4 | -33.1 | -179.6 | -72.4 | -16.1 | 0 | 0 | 0 | 112.1 | L59 K65 | L59-D61 PolarHBondContact O-N 3.25Å; D61-K65 WeakPolarHBondContact O-CG 3.5Å; D61-K65 PolarHBondContact O-N 3.03Å |
| 62 | A | 97.3 | Very high | 95.8 | Very high | 31 Ų | 31 | 84 Ų | 84 | 26% | 0.256 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -71.5 | -38.1 | 176 | 0 | 0 | 0 | 0 | 0 | 111.2 | L59 R60 K65 A66 V89 L93 | L59-A62 CarbonylContact O-C 3.6Å; L59-A62 WeakPolarHBondContact O-CA 3.28Å; L59-A62 WeakPolarHBondContact O-CB 3.35Å; L59-A62 PolarHBondContact O-N 2.91Å; R60-A62 VanDerWaalsContact C-N 3.29Å; R60-A62 PolarHBondContact O-N 3.04Å; A62-K65 PolarHBondContact O-N 3.47Å; A62-A66 VanDerWaalsContact O-CB 3.3Å; A62-A66 WeakPolarHBondContact O-CB 3Å; A62-A66 PolarHBondContact O-N 3.46Å; A62-V89 HydrophobicContact CB-CG1 3.81Å; A62-L93 HydrophobicContact CB-CD1 3.68Å |
| 63 | E | 97.7 | Very high | 95.8 | Very high | 96 Ų | 96 | 85.2 Ų | 85.2 | 45% | 0.449 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -64.1 | -42.7 | 175.5 | -177.2 | 177.4 | -158.5 | 0 | 0 | 112 | L59 R60 K65 A66 N67 L93 | L59-E63 PolarHBondContact O-N 2.93Å; R60-E63 PolarHBondContact O-N 3.24Å; E63-K65 VanDerWaalsContact C-N 3.31Å; E63-K65 PolarHBondContact O-N 3.28Å; E63-A66 WeakPolarHBondContact O-CB 3.34Å; E63-A66 PolarHBondContact O-N 3.4Å; E63-N67 PolarHBondContact O-N 3.5Å; E63-N67 VanDerWaalsContact O-N 3.11Å; E63-N67 PolarHBondContact O-ND2 3.3Å; E63-L93 HydrophobicContact CB-CB 4.08Å; E63-L93 HydrophobicContact CB-CD1 4.14Å; E63-L93 HydrophobicContact CG-CB 4.24Å |
| 64 | I | 98 | Very high | 95.8 | Very high | 99 Ų | 99 | 81.8 Ų | 81.8 | 51% | 0.508 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -57.4 | -47.2 | 174.9 | -69.5 | 166.1 | 0 | 0 | 0 | 110.3 | R60 N67 N68 | R60-I64 HydrophobicContact CG-CD1 4.28Å; R60-I64 WeakPolarHBondContact O-CG1 3.41Å; R60-I64 PolarHBondContact O-N 3.32Å; I64-N67 PolarHBondContact O-N 3.23Å; I64-N68 PolarHBondContact O-N 3.39Å |
| 65 | K | 98 | Very high | 95.7 | Very high | 118 Ų | 118 | 74.2 Ų | 74.2 | 51% | 0.513 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -66.8 | -39.2 | 178.2 | -69.1 | 170.2 | -175.9 | 172.4 | 0 | 112.3 | D61 A62 E63 N67 N68 D71 | D61-K65 WeakPolarHBondContact O-CG 3.5Å; D61-K65 PolarHBondContact O-N 3.03Å; A62-K65 PolarHBondContact O-N 3.47Å; E63-K65 VanDerWaalsContact C-N 3.31Å; E63-K65 PolarHBondContact O-N 3.28Å; K65-N67 PolarHBondContact O-N 2.9Å; K65-N68 PolarHBondContact O-N 3.35Å; K65-N68 VanDerWaalsContact O-N 3.15Å; K65-D71 HydrophobicContact CB-CB 4.21Å; K65-D71 HydrophobicContact CG-CB 4.41Å |
| 66 | A | 98.1 | Very high | 95.5 | Very high | 0 Ų | 0 | 74.9 Ų | 74.9 | 0% | 0 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -60.2 | -28.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | A62 E63 L72 L93 | A62-A66 VanDerWaalsContact O-CB 3.3Å; A62-A66 WeakPolarHBondContact O-CB 3Å; A62-A66 PolarHBondContact O-N 3.46Å; E63-A66 WeakPolarHBondContact O-CB 3.34Å; E63-A66 PolarHBondContact O-N 3.4Å; A66-L72 VanDerWaalsContact O-CD1 3.24Å; A66-L72 WeakPolarHBondContact O-CD1 3.47Å; A66-L93 HydrophobicContact CB-CB 3.97Å |
| 67 | N | 98.4 | Very high | 95.3 | Very high | 46 Ų | 46 | 73.3 Ų | 73.3 | 25% | 0.246 | 41% | 0.408 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -99.2 | 5.1 | -179.2 | -74.1 | -76.7 | 0 | 0 | 0 | 114 | E63 I64 K65 L93 G95 N98 | E63-N67 PolarHBondContact O-N 3.5Å; E63-N67 VanDerWaalsContact O-N 3.11Å; E63-N67 PolarHBondContact O-ND2 3.3Å; I64-N67 PolarHBondContact O-N 3.23Å; K65-N67 PolarHBondContact O-N 2.9Å; N67-L93 PolarHBondContact ND2-O 3.31Å; N67-G95 WeakPolarHBondContact OD1-CA 3.48Å; N67-G95 PolarHBondContact OD1-N 3.41Å; N67-N98 WeakPolarHBondContact CA-ND2 3.2Å; N67-N98 WeakPolarHBondContact CB-ND2 3.3Å; N67-N98 PolarHBondContact O-ND2 2.79Å; N67-N98 PolarHBondContact OD1-ND2 3.36Å; N67-N98 VanDerWaalsContact OD1-ND2 3.09Å |
| 68 | N | 98.1 | Very high | 95 | Very high | 61 Ų | 61 | 65.3 Ų | 65.3 | 33% | 0.326 | 37% | 0.372 | S | S | . | . | trans | -109.3 | 109.8 | 177 | -175.7 | -11.2 | 0 | 0 | 0 | 110.9 | I64 K65 A70 D71 L72 | I64-N68 PolarHBondContact O-N 3.39Å; K65-N68 PolarHBondContact O-N 3.35Å; K65-N68 VanDerWaalsContact O-N 3.15Å; N68-A70 PolarHBondContact O-N 2.94Å; N68-A70 VanDerWaalsContact O-N 3.16Å; N68-A70 WeakPolarHBondContact OD1-CB 3.21Å; N68-A70 PolarHBondContact OD1-N 3.49Å; N68-D71 HydrophobicContact CB-CB 4.14Å; N68-D71 VanDerWaalsContact CB-OD2 3.27Å; N68-D71 WeakPolarHBondContact CB-OD2 3.48Å; N68-D71 VanDerWaalsContact CG-OD2 3.26Å; N68-D71 PolarHBondContact ND2-OD2 3.08Å; N68-D71 PolarHBondContact O-N 3.42Å; N68-D71 VanDerWaalsContact O-N 3.12Å; N68-L72 WeakPolarHBondContact O-CG 3.45Å; N68-L72 PolarHBondContact O-N 3.48Å; N68-L72 VanDerWaalsContact O-N 3.13Å | ||
| 69 | P | 97.1 | Very high | 94.4 | Very high | 24 Ų | 24 | 63.5 Ų | 63.5 | 16% | 0.156 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -54.5 | -34.3 | 179.1 | -26.7 | 34.4 | 0 | 0 | 0 | 114.3 | L72 S73 E100 A101 V104 | P69-L72 PolarHBondContact O-N 3.08Å; P69-S73 PolarHBondContact O-N 3.47Å; P69-E100 HydrophobicContact CB-CG 4.18Å; P69-E100 HydrophobicContact CG-CB 4.02Å; P69-E100 HydrophobicContact CG-CG 3.56Å; P69-A101 HydrophobicContact CG-CB 4.4Å; P69-V104 HydrophobicContact CB-CG2 3.85Å |
| 70 | A | 97.1 | Very high | 93.9 | Very high | 66 Ų | 66 | 63.4 Ų | 63.4 | 55% | 0.545 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -67.4 | -43.4 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | N68 L72 S73 | N68-A70 PolarHBondContact O-N 2.94Å; N68-A70 VanDerWaalsContact O-N 3.16Å; N68-A70 WeakPolarHBondContact OD1-CB 3.21Å; N68-A70 PolarHBondContact OD1-N 3.49Å; A70-L72 VanDerWaalsContact C-N 3.32Å; A70-L72 PolarHBondContact O-N 2.79Å; A70-S73 PolarHBondContact O-N 2.95Å; A70-S73 PolarHBondContact O-OG 3.46Å |
| 71 | D | 96.8 | Very high | 93.5 | Very high | 76 Ų | 76 | 59.9 Ų | 59.9 | 41% | 0.406 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -65.9 | -37.6 | 177.5 | -69.2 | -45.1 | 0 | 0 | 0 | 111.4 | K65 N68 S73 | K65-D71 HydrophobicContact CB-CB 4.21Å; K65-D71 HydrophobicContact CG-CB 4.41Å; N68-D71 HydrophobicContact CB-CB 4.14Å; N68-D71 VanDerWaalsContact CB-OD2 3.27Å; N68-D71 WeakPolarHBondContact CB-OD2 3.48Å; N68-D71 VanDerWaalsContact CG-OD2 3.26Å; N68-D71 PolarHBondContact ND2-OD2 3.08Å; N68-D71 PolarHBondContact O-N 3.42Å; N68-D71 VanDerWaalsContact O-N 3.12Å; D71-S73 VanDerWaalsContact C-N 3.35Å |
| 72 | L | 96.3 | Very high | 93.3 | Very high | 2 Ų | 2 | 58.6 Ų | 58.6 | 1% | 0.01 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -69.5 | -30.2 | 177 | -67.2 | 175 | 0 | 0 | 0 | 113.4 | A66 N68 P69 A70 G74 L75 S90 A101 V104 L105 | A66-L72 VanDerWaalsContact O-CD1 3.24Å; A66-L72 WeakPolarHBondContact O-CD1 3.47Å; N68-L72 WeakPolarHBondContact O-CG 3.45Å; N68-L72 PolarHBondContact O-N 3.48Å; N68-L72 VanDerWaalsContact O-N 3.13Å; P69-L72 PolarHBondContact O-N 3.08Å; A70-L72 VanDerWaalsContact C-N 3.32Å; A70-L72 PolarHBondContact O-N 2.79Å; L72-G74 PolarHBondContact O-N 3.16Å; L72-G74 VanDerWaalsContact O-N 3.11Å; L72-L75 HydrophobicContact CD2-CD1 4Å; L72-L75 WeakPolarHBondContact O-CB 3.3Å; L72-L75 PolarHBondContact O-N 3.02Å; L72-S90 WeakPolarHBondContact CD2-OG 3.42Å; L72-A101 HydrophobicContact CD1-CB 3.62Å; L72-V104 HydrophobicContact CB-CB 4.26Å; L72-V104 HydrophobicContact CB-CG1 3.76Å; L72-L105 HydrophobicContact CD1-CD1 4.15Å; L72-L105 HydrophobicContact CD1-CD2 4.45Å; L72-L105 HydrophobicContact CD1-CG 3.97Å; L72-L105 HydrophobicContact CD2-CD2 4.01Å; L72-L105 HydrophobicContact CD2-CG 4.43Å |
| 73 | S | 93.5 | Very high | 93 | Very high | 73 Ų | 73 | 58.2 Ų | 58.2 | 51% | 0.51 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -61.7 | -21.6 | -177.5 | 73.6 | 0 | 0 | 0 | 0 | 113.7 | P69 A70 D71 L75 T76 | P69-S73 PolarHBondContact O-N 3.47Å; A70-S73 PolarHBondContact O-N 2.95Å; A70-S73 PolarHBondContact O-OG 3.46Å; D71-S73 VanDerWaalsContact C-N 3.35Å; S73-L75 VanDerWaalsContact C-N 3.31Å; S73-T76 WeakPolarHBondContact O-CG2 3.43Å |
| 74 | G | 90.8 | Very high | 92.8 | Very high | 55 Ų | 55 | 54 Ų | 54 | 57% | 0.567 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.8 | -10.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | L72 T76 | L72-G74 PolarHBondContact O-N 3.16Å; L72-G74 VanDerWaalsContact O-N 3.11Å; G74-T76 PolarHBondContact O-N 2.89Å |
| 75 | L | 91.9 | Very high | 92.6 | Very high | 16 Ų | 16 | 51.3 Ų | 51.3 | 8% | 0.084 | 31% | 0.307 | C | S | . | . | trans | -91.8 | 80 | 179.8 | -55.9 | -178.5 | 0 | 0 | 0 | 110 | L72 S73 V83 K86 L87 T108 | L72-L75 HydrophobicContact CD2-CD1 4Å; L72-L75 WeakPolarHBondContact O-CB 3.3Å; L72-L75 PolarHBondContact O-N 3.02Å; S73-L75 VanDerWaalsContact C-N 3.31Å; L75-V83 HydrophobicContact CB-CG1 4.04Å; L75-V83 HydrophobicContact CD2-CG1 4.32Å; L75-K86 HydrophobicContact CD1-CB 4.07Å; L75-K86 HydrophobicContact CD2-CB 3.98Å; L75-K86 HydrophobicContact CD2-CD 3.75Å; L75-L87 HydrophobicContact CB-CD2 3.78Å; L75-L87 HydrophobicContact CB-CG 4.23Å; L75-L87 HydrophobicContact CD1-CD2 3.81Å; L75-L87 HydrophobicContact CD1-CG 4.22Å; L75-L87 HydrophobicContact CG-CD2 4.46Å; L75-T108 WeakPolarHBondContact O-CG2 3.38Å; L75-T108 PolarHBondContact O-OG1 3.17Å; L75-T108 VanDerWaalsContact O-OG1 3.09Å | ||
| 76 | T | 87.7 | Confident | 92.6 | Very high | 100 Ų | 100 | 51 Ų | 51 | 61% | 0.613 | 31% | 0.306 | S | S | * | . | trans | -106.5 | -37.5 | -172.4 | 55.7 | 0 | 0 | 0 | 0 | 114 | S73 G74 V78 | S73-T76 WeakPolarHBondContact O-CG2 3.43Å; G74-T76 PolarHBondContact O-N 2.89Å; T76-V78 PolarHBondContact O-N 2.99Å | ||
| 77 | N | 86.2 | Confident | 92.5 | Very high | 79 Ų | 79 | 51.1 Ų | 51.1 | 42% | 0.422 | 31% | 0.306 | S | S | . | . | trans | -91.2 | 90.9 | -175.2 | -172.8 | 12.5 | 0 | 0 | 0 | 112.3 | T79 D80 V83 | N77-T79 PolarHBondContact O-N 3.46Å; N77-T79 PolarHBondContact OD1-N 2.86Å; N77-T79 PolarHBondContact OD1-OG1 3.15Å; N77-D80 HydrophobicContact CB-CB 4.4Å; N77-D80 WeakPolarHBondContact O-CB 3.19Å; N77-D80 PolarHBondContact O-N 3.44Å; N77-V83 VanDerWaalsContact O-CB 3.3Å; N77-V83 WeakPolarHBondContact O-CB 3.41Å; N77-V83 WeakPolarHBondContact O-CG1 3.26Å | ||
| 78 | V | 86.1 | Confident | 92.4 | Very high | 5 Ų | 5 | 50 Ų | 50 | 3% | 0.03 | 30% | 0.3 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66 | -18.4 | -177.7 | -58.9 | 0 | 0 | 0 | 0 | 114.4 | T76 D80 R84 L87 T108 V115 Y119 F132 | T76-V78 PolarHBondContact O-N 2.99Å; V78-D80 VanDerWaalsContact C-N 3.32Å; V78-R84 PolarHBondContact O-NE 3.24Å; V78-L87 HydrophobicContact CG1-CD1 3.83Å; V78-T108 HydrophobicContact CG1-CG2 3.72Å; V78-V115 HydrophobicContact CG2-CG1 4.04Å; V78-V115 HydrophobicContact CG2-CG2 3.82Å; V78-Y119 HydrophobicContact CG2-CE1 4.35Å; V78-F132 HydrophobicContact CB-CE1 4.21Å; V78-F132 HydrophobicContact CG2-CE1 4.31Å; V78-F132 VanDerWaalsContact O-CZ 3.25Å; V78-F132 WeakPolarHBondContact O-CZ 3.4Å |
| 79 | T | 82.8 | Confident | 92.4 | Very high | 47 Ų | 47 | 50 Ų | 50 | 29% | 0.288 | 30% | 0.302 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.3 | -25.9 | 177.8 | 70.1 | 0 | 0 | 0 | 0 | 111.9 | N77 E81 R84 V115 | N77-T79 PolarHBondContact O-N 3.46Å; N77-T79 PolarHBondContact OD1-N 2.86Å; N77-T79 PolarHBondContact OD1-OG1 3.15Å; T79-E81 PolarHBondContact O-N 3.2Å; T79-R84 PolarHBondContact O-NH2 2.77Å; T79-V115 HydrophobicContact CG2-CG1 4.27Å |
| 80 | D | 86.3 | Confident | 92.5 | Very high | 67 Ų | 67 | 49.3 Ų | 49.3 | 36% | 0.358 | 30% | 0.298 | S | S | . | . | S | Bend | trans | -67.2 | 126.1 | 175.3 | 180 | -77.2 | 0 | 0 | 0 | 110.8 | N77 V78 V82 V83 R84 | N77-D80 HydrophobicContact CB-CB 4.4Å; N77-D80 WeakPolarHBondContact O-CB 3.19Å; N77-D80 PolarHBondContact O-N 3.44Å; V78-D80 VanDerWaalsContact C-N 3.32Å; D80-V82 VanDerWaalsContact C-N 3.29Å; D80-V82 PolarHBondContact O-N 2.77Å; D80-V82 WeakPolarHBondContact OD1-CA 3.46Å; D80-V82 VanDerWaalsContact OD1-CB 3.28Å; D80-V82 WeakPolarHBondContact OD1-CB 3.43Å; D80-V82 PolarHBondContact OD1-N 3.06Å; D80-V83 HydrophobicContact CB-CB 4.06Å; D80-V83 HydrophobicContact CB-CG2 3.95Å; D80-V83 PolarHBondContact O-N 3Å; D80-V83 PolarHBondContact OD1-N 3.3Å; D80-R84 VanDerWaalsContact O-CB 3.26Å; D80-R84 WeakPolarHBondContact O-CB 3.42Å; D80-R84 PolarHBondContact O-N 3.24Å |
| 81 | E | 88.1 | Confident | 92.5 | Very high | 83 Ų | 83 | 46.2 Ų | 46.2 | 39% | 0.388 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -61.3 | -37 | -176.2 | -172.4 | -170.7 | 159 | 0 | 0 | 112.4 | T79 S85 R127 | T79-E81 PolarHBondContact O-N 3.2Å; E81-S85 VanDerWaalsContact O-CB 3.32Å; E81-S85 WeakPolarHBondContact O-CB 3.32Å; E81-S85 PolarHBondContact O-N 3.46Å; E81-S85 PolarHBondContact O-OG 2.99Å; E81-R127 IonicContact OE1-CZ 3.01Å; E81-R127 IonicContact OE1-NH1 2.69Å; E81-R127 PolarHBondContact OE1-NH1 3.1Å; E81-R127 IonicContact OE1-NH2 2.8Å; E81-R127 PolarHBondContact OE1-NH2 3.15Å; E81-R127 IonicContact OE2-NH1 3.87Å |
| 82 | V | 92.5 | Very high | 92.5 | Very high | 87 Ų | 87 | 45.6 Ų | 45.6 | 53% | 0.527 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -71.7 | -44.4 | -178.7 | -179.9 | 0 | 0 | 0 | 0 | 109.9 | D80 S85 K86 | D80-V82 VanDerWaalsContact C-N 3.29Å; D80-V82 PolarHBondContact O-N 2.77Å; D80-V82 WeakPolarHBondContact OD1-CA 3.46Å; D80-V82 VanDerWaalsContact OD1-CB 3.28Å; D80-V82 WeakPolarHBondContact OD1-CB 3.43Å; D80-V82 PolarHBondContact OD1-N 3.06Å; V82-S85 PolarHBondContact O-N 3.24Å; V82-K86 HydrophobicContact CG1-CD 4.48Å; V82-K86 WeakPolarHBondContact O-CG 3.34Å; V82-K86 PolarHBondContact O-N 3.4Å |
| 83 | V | 92.4 | Very high | 92.6 | Very high | 23 Ų | 23 | 47 Ų | 47 | 14% | 0.139 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -61.8 | -46.7 | 175.4 | 175.6 | 0 | 0 | 0 | 0 | 110.3 | L75 N77 D80 S85 K86 L87 | L75-V83 HydrophobicContact CB-CG1 4.04Å; L75-V83 HydrophobicContact CD2-CG1 4.32Å; N77-V83 VanDerWaalsContact O-CB 3.3Å; N77-V83 WeakPolarHBondContact O-CB 3.41Å; N77-V83 WeakPolarHBondContact O-CG1 3.26Å; D80-V83 HydrophobicContact CB-CB 4.06Å; D80-V83 HydrophobicContact CB-CG2 3.95Å; D80-V83 PolarHBondContact O-N 3Å; D80-V83 PolarHBondContact OD1-N 3.3Å; V83-S85 PolarHBondContact O-N 2.64Å; V83-K86 WeakPolarHBondContact O-CB 3.49Å; V83-K86 PolarHBondContact O-N 3.43Å; V83-K86 VanDerWaalsContact O-N 3.15Å; V83-L87 HydrophobicContact CG1-CD1 4.02Å; V83-L87 HydrophobicContact CG1-CG 4.36Å; V83-L87 WeakPolarHBondContact O-CG 3.32Å; V83-L87 PolarHBondContact O-N 3.37Å |
| 84 | R | 92.4 | Very high | 92.8 | Very high | 7 Ų | 7 | 43.9 Ų | 43.9 | 3% | 0.026 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -61.3 | -42.1 | 177.6 | 177.5 | 164 | 24 | 118.6 | -11.4 | 113 | V78 T79 D80 K86 L87 L88 T128 Q131 | V78-R84 PolarHBondContact O-NE 3.24Å; T79-R84 PolarHBondContact O-NH2 2.77Å; D80-R84 VanDerWaalsContact O-CB 3.26Å; D80-R84 WeakPolarHBondContact O-CB 3.42Å; D80-R84 PolarHBondContact O-N 3.24Å; R84-K86 VanDerWaalsContact C-N 3.33Å; R84-K86 PolarHBondContact O-N 2.96Å; R84-L87 PolarHBondContact O-N 2.79Å; R84-L88 PolarHBondContact O-N 3.13Å; R84-T128 VanDerWaalsContact NH1-CA 3.28Å; R84-T128 VanDerWaalsContact NH1-CG2 3.34Å; R84-T128 PolarHBondContact NH1-OG1 3.24Å; R84-T128 PolarHBondContact NH2-OG1 3.18Å; R84-Q131 HydrophobicContact CG-CB 4.14Å |
| 85 | S | 94.6 | Very high | 93.2 | Very high | 42 Ų | 42 | 42.3 Ų | 42.3 | 29% | 0.294 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -61.6 | -41.2 | 173.6 | -60.9 | 0 | 0 | 0 | 0 | 111.7 | E81 V82 V83 L88 V89 | E81-S85 VanDerWaalsContact O-CB 3.32Å; E81-S85 WeakPolarHBondContact O-CB 3.32Å; E81-S85 PolarHBondContact O-N 3.46Å; E81-S85 PolarHBondContact O-OG 2.99Å; V82-S85 PolarHBondContact O-N 3.24Å; V83-S85 PolarHBondContact O-N 2.64Å; S85-L88 PolarHBondContact O-N 2.94Å; S85-V89 WeakPolarHBondContact O-CG2 3.45Å; S85-V89 PolarHBondContact O-N 3.32Å; S85-V89 VanDerWaalsContact O-N 3.16Å |
| 86 | K | 96.6 | Very high | 93.4 | Very high | 113 Ų | 113 | 46.1 Ų | 46.1 | 49% | 0.491 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -64.4 | -41.9 | 174.2 | -72.2 | 173 | -177.8 | 175.3 | 0 | 111.9 | L75 V82 V83 R84 L88 V89 S90 | L75-K86 HydrophobicContact CD1-CB 4.07Å; L75-K86 HydrophobicContact CD2-CB 3.98Å; L75-K86 HydrophobicContact CD2-CD 3.75Å; V82-K86 HydrophobicContact CG1-CD 4.48Å; V82-K86 WeakPolarHBondContact O-CG 3.34Å; V82-K86 PolarHBondContact O-N 3.4Å; V83-K86 WeakPolarHBondContact O-CB 3.49Å; V83-K86 PolarHBondContact O-N 3.43Å; V83-K86 VanDerWaalsContact O-N 3.15Å; R84-K86 VanDerWaalsContact C-N 3.33Å; R84-K86 PolarHBondContact O-N 2.96Å; K86-L88 VanDerWaalsContact C-N 3.35Å; K86-L88 PolarHBondContact O-N 3.45Å; K86-V89 PolarHBondContact O-N 2.96Å; K86-S90 WeakPolarHBondContact O-CB 3.27Å; K86-S90 PolarHBondContact O-N 3.13Å; K86-S90 PolarHBondContact O-OG 3.14Å |
| 87 | L | 96.5 | Very high | 93.8 | Very high | 1 Ų | 1 | 47.7 Ų | 47.7 | 1% | 0.005 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -62.3 | -40.4 | 177.7 | -71.4 | 169 | 0 | 0 | 0 | 112.2 | L75 V78 V83 R84 S90 L91 L105 T108 L135 | L75-L87 HydrophobicContact CB-CD2 3.78Å; L75-L87 HydrophobicContact CB-CG 4.23Å; L75-L87 HydrophobicContact CD1-CD2 3.81Å; L75-L87 HydrophobicContact CD1-CG 4.22Å; L75-L87 HydrophobicContact CG-CD2 4.46Å; V78-L87 HydrophobicContact CG1-CD1 3.83Å; V83-L87 HydrophobicContact CG1-CD1 4.02Å; V83-L87 HydrophobicContact CG1-CG 4.36Å; V83-L87 WeakPolarHBondContact O-CG 3.32Å; V83-L87 PolarHBondContact O-N 3.37Å; R84-L87 PolarHBondContact O-N 2.79Å; L87-S90 PolarHBondContact O-N 3.43Å; L87-L91 WeakPolarHBondContact O-CG 3.46Å; L87-L91 PolarHBondContact O-N 3.27Å; L87-L105 HydrophobicContact CD2-CD2 3.47Å; L87-L105 VanDerWaalsContact CD2-CD2 3.47Å; L87-T108 HydrophobicContact CD1-CG2 4.06Å; L87-T108 HydrophobicContact CD2-CG2 4.2Å; L87-L135 HydrophobicContact CB-CD1 3.71Å |
| 88 | L | 97.3 | Very high | 94.3 | Very high | 23 Ų | 23 | 45.5 Ų | 45.5 | 12% | 0.12 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -59.7 | -48.5 | 173.5 | -79.9 | 168 | 0 | 0 | 0 | 111.6 | R84 S85 K86 S90 L91 A92 Q131 L134 L135 M138 | R84-L88 PolarHBondContact O-N 3.13Å; S85-L88 PolarHBondContact O-N 2.94Å; K86-L88 VanDerWaalsContact C-N 3.35Å; K86-L88 PolarHBondContact O-N 3.45Å; L88-S90 VanDerWaalsContact C-N 3.34Å; L88-L91 PolarHBondContact O-N 2.91Å; L88-A92 PolarHBondContact O-N 2.94Å; L88-Q131 HydrophobicContact CD1-CB 4.1Å; L88-Q131 HydrophobicContact CD1-CG 3.98Å; L88-L134 HydrophobicContact CD2-CB 4.1Å; L88-L134 HydrophobicContact CD2-CD2 3.86Å; L88-L134 HydrophobicContact CD2-CG 3.72Å; L88-L135 HydrophobicContact CD2-CB 3.93Å; L88-L135 HydrophobicContact CD2-CD1 3.91Å; L88-L135 HydrophobicContact CG-CB 4.46Å; L88-L135 HydrophobicContact CG-CD1 3.89Å; L88-M138 HydrophobicContact CD2-SD 4.12Å |
| 89 | V | 97.6 | Very high | 94.9 | Very high | 60 Ų | 60 | 54.5 Ų | 54.5 | 36% | 0.364 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -63 | -42.4 | 176.6 | 174.1 | 0 | 0 | 0 | 0 | 110.9 | A62 S85 K86 L91 A92 L93 | A62-V89 HydrophobicContact CB-CG1 3.81Å; S85-V89 WeakPolarHBondContact O-CG2 3.45Å; S85-V89 PolarHBondContact O-N 3.32Å; S85-V89 VanDerWaalsContact O-N 3.16Å; K86-V89 PolarHBondContact O-N 2.96Å; V89-L91 PolarHBondContact O-N 3.47Å; V89-A92 WeakPolarHBondContact O-CB 3.24Å; V89-A92 PolarHBondContact O-N 2.8Å; V89-L93 HydrophobicContact CG1-CD1 3.68Å; V89-L93 HydrophobicContact CG1-CG 4.43Å; V89-L93 WeakPolarHBondContact O-CG 3.26Å; V89-L93 PolarHBondContact O-N 3.19Å; V89-L93 VanDerWaalsContact O-N 3.09Å |
| 90 | S | 98.3 | Very high | 95.6 | Very high | 10 Ų | 10 | 58.9 Ų | 58.9 | 7% | 0.07 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -62 | -42.3 | 177.7 | -66.3 | 0 | 0 | 0 | 0 | 112.1 | L72 K86 L87 L88 A92 L93 L94 | L72-S90 WeakPolarHBondContact CD2-OG 3.42Å; K86-S90 WeakPolarHBondContact O-CB 3.27Å; K86-S90 PolarHBondContact O-N 3.13Å; K86-S90 PolarHBondContact O-OG 3.14Å; L87-S90 PolarHBondContact O-N 3.43Å; L88-S90 VanDerWaalsContact C-N 3.34Å; S90-A92 VanDerWaalsContact C-N 3.34Å; S90-L93 PolarHBondContact O-N 2.94Å; S90-L94 VanDerWaalsContact O-CB 3.28Å; S90-L94 WeakPolarHBondContact O-CB 3.4Å; S90-L94 PolarHBondContact O-N 3.49Å |
| 91 | L | 98 | Very high | 96.2 | Very high | 1 Ų | 1 | 55.7 Ų | 55.7 | 1% | 0.005 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -66.6 | -34 | 174.4 | -77.6 | 170.7 | 0 | 0 | 0 | 112.9 | L87 L88 V89 L93 L105 L135 M138 A139 H142 F145 | L87-L91 WeakPolarHBondContact O-CG 3.46Å; L87-L91 PolarHBondContact O-N 3.27Å; L88-L91 PolarHBondContact O-N 2.91Å; V89-L91 PolarHBondContact O-N 3.47Å; L91-L93 VanDerWaalsContact C-N 3.29Å; L91-L93 PolarHBondContact O-N 3.49Å; L91-L105 HydrophobicContact CD2-CD1 4.01Å; L91-L105 HydrophobicContact CG-CD1 4.44Å; L91-L135 HydrophobicContact CD1-CD1 3.52Å; L91-L135 HydrophobicContact CD1-CG 4.15Å; L91-M138 HydrophobicContact CB-CB 4.48Å; L91-M138 HydrophobicContact CB-CE 4.01Å; L91-M138 HydrophobicContact CD1-CB 4.36Å; L91-A139 HydrophobicContact CD1-CB 3.92Å; L91-A139 HydrophobicContact CD2-CB 4.1Å; L91-H142 PolarHBondContact O-CD2 3.33Å; L91-H142 VanDerWaalsContact O-CD2 3.24Å; L91-H142 PolarHBondContact O-NE2 3.32Å; L91-F145 HydrophobicContact CD2-CE2 3.61Å; L91-F145 HydrophobicContact CD2-CZ 3.7Å |
| 92 | A | 97.4 | Very high | 96.6 | Very high | 64 Ų | 64 | 51.8 Ų | 51.8 | 53% | 0.529 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -67.5 | -31.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | L88 V89 S90 M138 | L88-A92 PolarHBondContact O-N 2.94Å; V89-A92 WeakPolarHBondContact O-CB 3.24Å; V89-A92 PolarHBondContact O-N 2.8Å; S90-A92 VanDerWaalsContact C-N 3.34Å; A92-M138 HydrophobicContact CB-CE 3.72Å |
| 93 | L | 97.8 | Very high | 96.8 | Very high | 31 Ų | 31 | 48 Ų | 48 | 16% | 0.162 | 26% | 0.258 | C | S | . | . | S | Bend | trans | -109.4 | 5.6 | -172.7 | -58 | 175.6 | 0 | 0 | 0 | 113.2 | L59 A62 E63 A66 N67 V89 S90 L91 G95 | L59-L93 HydrophobicContact CB-CD1 4.11Å; L59-L93 HydrophobicContact CB-CD2 4.34Å; L59-L93 HydrophobicContact CD1-CD2 4.26Å; L59-L93 HydrophobicContact CD2-CD1 4.49Å; A62-L93 HydrophobicContact CB-CD1 3.68Å; E63-L93 HydrophobicContact CB-CB 4.08Å; E63-L93 HydrophobicContact CB-CD1 4.14Å; E63-L93 HydrophobicContact CG-CB 4.24Å; A66-L93 HydrophobicContact CB-CB 3.97Å; N67-L93 PolarHBondContact ND2-O 3.31Å; V89-L93 HydrophobicContact CG1-CD1 3.68Å; V89-L93 HydrophobicContact CG1-CG 4.43Å; V89-L93 WeakPolarHBondContact O-CG 3.26Å; V89-L93 PolarHBondContact O-N 3.19Å; V89-L93 VanDerWaalsContact O-N 3.09Å; S90-L93 PolarHBondContact O-N 2.94Å; L91-L93 VanDerWaalsContact C-N 3.29Å; L91-L93 PolarHBondContact O-N 3.49Å; L93-G95 PolarHBondContact O-N 2.87Å |
| 94 | L | 98.4 | Very high | 97.1 | Very high | 8 Ų | 8 | 47.5 Ų | 47.5 | 4% | 0.042 | 26% | 0.255 | C | S | . | . | trans | -70.2 | 128.6 | 179.4 | 176.9 | 65.6 | 0 | 0 | 0 | 109.9 | S90 T96 N98 A101 A102 L105 H142 A144 F145 | S90-L94 VanDerWaalsContact O-CB 3.28Å; S90-L94 WeakPolarHBondContact O-CB 3.4Å; S90-L94 PolarHBondContact O-N 3.49Å; L94-T96 PolarHBondContact O-N 3.49Å; L94-N98 HydrophobicContact CD1-CB 4.1Å; L94-A101 HydrophobicContact CD1-CB 3.57Å; L94-A102 HydrophobicContact CD2-CB 3.99Å; L94-L105 HydrophobicContact CD2-CD1 3.86Å; L94-H142 PolarHBondContact O-CE1 3.16Å; L94-H142 PolarHBondContact O-NE2 3.15Å; L94-A144 HydrophobicContact CD2-CB 3.85Å; L94-A144 HydrophobicContact CG-CB 4.18Å; L94-F145 HydrophobicContact CD2-CE2 4.27Å | ||
| 95 | G | 97.8 | Very high | 97.3 | Very high | 22 Ų | 22 | 47.2 Ų | 47.2 | 23% | 0.227 | 25% | 0.254 | C | S | . | . | trans | -59.8 | 136.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | N67 L93 D97 N98 A144 | N67-G95 WeakPolarHBondContact OD1-CA 3.48Å; N67-G95 PolarHBondContact OD1-N 3.41Å; L93-G95 PolarHBondContact O-N 2.87Å; G95-D97 PolarHBondContact O-N 3.37Å; G95-N98 PolarHBondContact O-N 2.86Å; G95-N98 VanDerWaalsContact O-N 3.09Å; G95-A144 WeakPolarHBondContact O-CB 3.37Å | ||
| 96 | T | 96.2 | Very high | 97.3 | Very high | 96 Ų | 96 | 47 Ų | 47 | 59% | 0.589 | 25% | 0.247 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -62.1 | -21.3 | -170.4 | 55.6 | 0 | 0 | 0 | 0 | 114.5 | L94 P143 A144 | L94-T96 PolarHBondContact O-N 3.49Å; T96-P143 HydrophobicContact CG2-CG 3.59Å; T96-P143 CarbonylContact O-C 3.44Å; T96-A144 WeakPolarHBondContact O-CA 3.17Å; T96-A144 PolarHBondContact O-N 3.03Å |
| 97 | D | 96.2 | Very high | 97.2 | Very high | 132 Ų | 132 | 48.6 Ų | 48.6 | 71% | 0.706 | 25% | 0.25 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -112 | 0.7 | -178.7 | 63.6 | -21.8 | 0 | 0 | 0 | 113.4 | G95 R99 | G95-D97 PolarHBondContact O-N 3.37Å; D97-R99 VanDerWaalsContact C-N 3.28Å; D97-R99 PolarHBondContact O-N 3.38Å |
| 98 | N | 97.9 | Very high | 97 | Very high | 34 Ų | 34 | 49.5 Ų | 49.5 | 18% | 0.182 | 26% | 0.255 | C | S | . | . | trans | -79.3 | 74 | -177.7 | -166.4 | -16.4 | 0 | 0 | 0 | 112 | N67 L94 G95 E100 A101 A102 | N67-N98 WeakPolarHBondContact CA-ND2 3.2Å; N67-N98 WeakPolarHBondContact CB-ND2 3.3Å; N67-N98 PolarHBondContact O-ND2 2.79Å; N67-N98 PolarHBondContact OD1-ND2 3.36Å; N67-N98 VanDerWaalsContact OD1-ND2 3.09Å; L94-N98 HydrophobicContact CD1-CB 4.1Å; G95-N98 PolarHBondContact O-N 2.86Å; G95-N98 VanDerWaalsContact O-N 3.09Å; N98-E100 PolarHBondContact O-N 2.98Å; N98-A101 HydrophobicContact CB-CB 4.41Å; N98-A101 WeakPolarHBondContact OD1-CB 3.34Å; N98-A101 PolarHBondContact OD1-N 3.24Å; N98-A102 WeakPolarHBondContact O-CB 3.24Å; N98-A102 PolarHBondContact O-N 2.99Å | ||
| 99 | R | 97.3 | Very high | 96.7 | Very high | 193 Ų | 193 | 48.6 Ų | 48.6 | 73% | 0.728 | 25% | 0.251 | S | S | * | . | H | α-helix | trans | -65.2 | -25.9 | -177.3 | -65.1 | -176.1 | -178.4 | -173 | 1.3 | 113.6 | D97 G103 | D97-R99 VanDerWaalsContact C-N 3.28Å; D97-R99 PolarHBondContact O-N 3.38Å; R99-G103 PolarHBondContact O-N 3.09Å |
| 100 | E | 98 | Very high | 96.2 | Very high | 140 Ų | 140 | 46.8 Ų | 46.8 | 65% | 0.654 | 24% | 0.24 | S | C | * | . | H | α-helix | trans | -70.6 | -52.2 | 179.8 | -167.8 | -177.3 | 171.9 | 0 | 0 | 110.7 | P69 N98 G103 V104 | P69-E100 HydrophobicContact CB-CG 4.18Å; P69-E100 HydrophobicContact CG-CB 4.02Å; P69-E100 HydrophobicContact CG-CG 3.56Å; N98-E100 PolarHBondContact O-N 2.98Å; E100-G103 WeakPolarHBondContact O-CA 3.48Å; E100-G103 PolarHBondContact O-N 3.38Å; E100-G103 VanDerWaalsContact O-N 3.1Å; E100-V104 PolarHBondContact O-N 2.89Å; E100-V104 VanDerWaalsContact O-N 3.15Å |
| 101 | A | 98.1 | Very high | 95.3 | Very high | 0 Ų | 0 | 52.4 Ų | 52.4 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -61.4 | -43.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | P69 L72 L94 N98 G103 V104 L105 | P69-A101 HydrophobicContact CG-CB 4.4Å; L72-A101 HydrophobicContact CD1-CB 3.62Å; L94-A101 HydrophobicContact CD1-CB 3.57Å; N98-A101 HydrophobicContact CB-CB 4.41Å; N98-A101 WeakPolarHBondContact OD1-CB 3.34Å; N98-A101 PolarHBondContact OD1-N 3.24Å; A101-G103 PolarHBondContact O-N 3.34Å; A101-V104 WeakPolarHBondContact O-CB 3.26Å; A101-V104 PolarHBondContact O-N 2.93Å; A101-V104 VanDerWaalsContact O-N 3.1Å; A101-L105 PolarHBondContact O-N 3.11Å |
| 102 | A | 98.2 | Very high | 93.1 | Very high | 0 Ų | 0 | 59 Ų | 59 | 0% | 0 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -57.3 | -38.4 | 173 | 0 | 0 | 0 | 0 | 0 | 111.9 | L94 N98 V104 L105 Y106 A144 F145 | L94-A102 HydrophobicContact CD2-CB 3.99Å; N98-A102 WeakPolarHBondContact O-CB 3.24Å; N98-A102 PolarHBondContact O-N 2.99Å; A102-V104 PolarHBondContact O-N 3.41Å; A102-L105 PolarHBondContact O-N 2.95Å; A102-Y106 VanDerWaalsContact O-CB 3.26Å; A102-Y106 WeakPolarHBondContact O-CB 3.5Å; A102-Y106 PolarHBondContact O-N 3.16Å; A102-A144 HydrophobicContact CB-CB 3.79Å; A102-F145 HydrophobicContact CB-CD1 4.2Å; A102-F145 HydrophobicContact CB-CE1 4.13Å; A102-F145 HydrophobicContact CB-CG 4.46Å; A102-F145 HydrophobicContact CB-CZ 4.32Å; A102-F145 WeakPolarHBondContact O-CE1 3.43Å |
| 103 | G | 97.1 | Very high | 90.9 | Very high | 8 Ų | 8 | 62.6 Ų | 62.6 | 8% | 0.082 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -63.5 | -38 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | R99 E100 A101 R107 | R99-G103 PolarHBondContact O-N 3.09Å; E100-G103 WeakPolarHBondContact O-CA 3.48Å; E100-G103 PolarHBondContact O-N 3.38Å; E100-G103 VanDerWaalsContact O-N 3.1Å; A101-G103 PolarHBondContact O-N 3.34Å; G103-R107 WeakPolarHBondContact O-CG 3.35Å; G103-R107 PolarHBondContact O-N 2.94Å; G103-R107 VanDerWaalsContact O-N 3.13Å; G103-R107 PolarHBondContact O-NH1 3.26Å |
| 104 | V | 96.9 | Very high | 88.8 | Confident | 12 Ų | 12 | 64.8 Ų | 64.8 | 7% | 0.073 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -64.6 | -52 | 173.5 | -179.9 | 0 | 0 | 0 | 0 | 110.2 | P69 L72 E100 A101 A102 Y106 R107 T108 | P69-V104 HydrophobicContact CB-CG2 3.85Å; L72-V104 HydrophobicContact CB-CB 4.26Å; L72-V104 HydrophobicContact CB-CG1 3.76Å; E100-V104 PolarHBondContact O-N 2.89Å; E100-V104 VanDerWaalsContact O-N 3.15Å; A101-V104 WeakPolarHBondContact O-CB 3.26Å; A101-V104 PolarHBondContact O-N 2.93Å; A101-V104 VanDerWaalsContact O-N 3.1Å; A102-V104 PolarHBondContact O-N 3.41Å; V104-Y106 VanDerWaalsContact C-N 3.3Å; V104-Y106 PolarHBondContact O-N 3.47Å; V104-R107 PolarHBondContact O-N 3.17Å; V104-R107 VanDerWaalsContact O-N 3.14Å; V104-T108 PolarHBondContact O-N 3.17Å; V104-T108 PolarHBondContact O-OG1 3.14Å |
| 105 | L | 96.4 | Very high | 86.7 | Confident | 1 Ų | 1 | 64.9 Ų | 64.9 | 1% | 0.005 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -58.1 | -43 | 178.1 | -70.8 | 169.2 | 0 | 0 | 0 | 111.8 | L72 L87 L91 L94 A101 A102 R107 T108 L109 F145 | L72-L105 HydrophobicContact CD1-CD1 4.15Å; L72-L105 HydrophobicContact CD1-CD2 4.45Å; L72-L105 HydrophobicContact CD1-CG 3.97Å; L72-L105 HydrophobicContact CD2-CD2 4.01Å; L72-L105 HydrophobicContact CD2-CG 4.43Å; L87-L105 HydrophobicContact CD2-CD2 3.47Å; L87-L105 VanDerWaalsContact CD2-CD2 3.47Å; L91-L105 HydrophobicContact CD2-CD1 4.01Å; L91-L105 HydrophobicContact CG-CD1 4.44Å; L94-L105 HydrophobicContact CD2-CD1 3.86Å; A101-L105 PolarHBondContact O-N 3.11Å; A102-L105 PolarHBondContact O-N 2.95Å; L105-R107 PolarHBondContact O-N 3.03Å; L105-T108 WeakPolarHBondContact O-CB 3.38Å; L105-T108 PolarHBondContact O-N 3.27Å; L105-L109 WeakPolarHBondContact O-CB 3.42Å; L105-L109 VanDerWaalsContact O-CG 3.24Å; L105-L109 WeakPolarHBondContact O-CG 3.43Å; L105-L109 PolarHBondContact O-N 3.16Å; L105-F145 HydrophobicContact CB-CE1 4.44Å; L105-F145 HydrophobicContact CB-CZ 4.11Å |
| 106 | Y | 95.9 | Very high | 84.6 | Confident | 38 Ų | 38 | 69.5 Ų | 69.5 | 15% | 0.149 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -56.6 | -49.3 | 175.9 | 177.3 | -105.1 | 0 | 0 | 0 | 111.2 | A102 V104 T108 L109 T110 F145 Q149 V152 L153 | A102-Y106 VanDerWaalsContact O-CB 3.26Å; A102-Y106 WeakPolarHBondContact O-CB 3.5Å; A102-Y106 PolarHBondContact O-N 3.16Å; V104-Y106 VanDerWaalsContact C-N 3.3Å; V104-Y106 PolarHBondContact O-N 3.47Å; Y106-T108 VanDerWaalsContact C-N 3.34Å; Y106-T108 PolarHBondContact O-N 3.45Å; Y106-L109 PolarHBondContact O-N 3.03Å; Y106-T110 HydrophobicContact CD2-CG2 3.83Å; Y106-T110 HydrophobicContact CE1-CG2 4.3Å; Y106-T110 HydrophobicContact CE2-CG2 3.43Å; Y106-T110 VanDerWaalsContact CE2-CG2 3.43Å; Y106-T110 HydrophobicContact CG-CG2 4.42Å; Y106-T110 WeakPolarHBondContact O-CB 3.49Å; Y106-T110 WeakPolarHBondContact O-CG2 3.41Å; Y106-T110 PolarHBondContact O-N 3.35Å; Y106-T110 PolarHBondContact O-OG1 2.79Å; Y106-F145 HydrophobicContact CD2-CD1 4.45Å; Y106-Q149 HydrophobicContact CD1-CG 4.05Å; Y106-Q149 HydrophobicContact CD2-CB 3.61Å; Y106-Q149 HydrophobicContact CD2-CG 3.63Å; Y106-Q149 HydrophobicContact CE1-CG 4.11Å; Y106-Q149 VanDerWaalsContact CE2-CA 3.5Å; Y106-Q149 HydrophobicContact CE2-CB 3.63Å; Y106-Q149 HydrophobicContact CE2-CG 3.69Å; Y106-Q149 HydrophobicContact CG-CB 4.26Å; Y106-Q149 HydrophobicContact CG-CG 3.81Å; Y106-V152 HydrophobicContact CE2-CB 4.21Å; Y106-V152 HydrophobicContact CE2-CG1 4.34Å; Y106-L153 HydrophobicContact CD2-CD1 4.11Å; Y106-L153 HydrophobicContact CD2-CD2 4.32Å; Y106-L153 HydrophobicContact CD2-CG 4.12Å; Y106-L153 HydrophobicContact CE2-CG 4.22Å |
| 107 | R | 93.5 | Very high | 82.7 | Confident | 146 Ų | 146 | 71.5 Ų | 71.5 | 55% | 0.551 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -62.9 | -39.9 | 178.8 | -73 | -173.7 | -61 | -90.2 | 4.6 | 112 | G103 V104 L105 T110 H111 | G103-R107 WeakPolarHBondContact O-CG 3.35Å; G103-R107 PolarHBondContact O-N 2.94Å; G103-R107 VanDerWaalsContact O-N 3.13Å; G103-R107 PolarHBondContact O-NH1 3.26Å; V104-R107 PolarHBondContact O-N 3.17Å; V104-R107 VanDerWaalsContact O-N 3.14Å; L105-R107 PolarHBondContact O-N 3.03Å; R107-T110 PolarHBondContact O-N 3.29Å; R107-H111 WeakPolarHBondContact O-CB 3.44Å; R107-H111 PolarHBondContact O-N 3.23Å |
| 108 | T | 92.3 | Very high | 80.8 | Confident | 20 Ų | 20 | 68.7 Ų | 68.7 | 12% | 0.123 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -59.5 | -46.5 | 173.8 | -66.1 | 0 | 0 | 0 | 0 | 111.5 | L75 V78 L87 V104 L105 Y106 | L75-T108 WeakPolarHBondContact O-CG2 3.38Å; L75-T108 PolarHBondContact O-OG1 3.17Å; L75-T108 VanDerWaalsContact O-OG1 3.09Å; V78-T108 HydrophobicContact CG1-CG2 3.72Å; L87-T108 HydrophobicContact CD1-CG2 4.06Å; L87-T108 HydrophobicContact CD2-CG2 4.2Å; V104-T108 PolarHBondContact O-N 3.17Å; V104-T108 PolarHBondContact O-OG1 3.14Å; L105-T108 WeakPolarHBondContact O-CB 3.38Å; L105-T108 PolarHBondContact O-N 3.27Å; Y106-T108 VanDerWaalsContact C-N 3.34Å; Y106-T108 PolarHBondContact O-N 3.45Å |
| 109 | L | 91.1 | Very high | 79.1 | Confident | 4 Ų | 4 | 67.5 Ų | 67.5 | 2% | 0.021 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -73.9 | -24.8 | -177.4 | -64.4 | 172.2 | 0 | 0 | 0 | 113.4 | L105 Y106 L135 F136 A139 L153 Q156 | L105-L109 WeakPolarHBondContact O-CB 3.42Å; L105-L109 VanDerWaalsContact O-CG 3.24Å; L105-L109 WeakPolarHBondContact O-CG 3.43Å; L105-L109 PolarHBondContact O-N 3.16Å; Y106-L109 PolarHBondContact O-N 3.03Å; L109-L135 HydrophobicContact CD2-CD2 3.44Å; L109-L135 VanDerWaalsContact CD2-CD2 3.44Å; L109-L135 HydrophobicContact CD2-CG 3.84Å; L109-F136 HydrophobicContact CB-CE1 4.24Å; L109-F136 HydrophobicContact CB-CZ 4.4Å; L109-F136 HydrophobicContact CD2-CZ 4.39Å; L109-A139 HydrophobicContact CD1-CB 3.65Å; L109-L153 HydrophobicContact CB-CD2 3.8Å; L109-L153 HydrophobicContact CD1-CD2 3.93Å; L109-Q156 PolarHBondContact O-NE2 3.28Å |
| 110 | T | 86.6 | Confident | 77.4 | Confident | 23 Ų | 23 | 59.9 Ų | 59.9 | 14% | 0.141 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -109.8 | 4.7 | -175.3 | 59.7 | 0 | 0 | 0 | 0 | 114.8 | Y106 R107 I112 V152 L153 | Y106-T110 HydrophobicContact CD2-CG2 3.83Å; Y106-T110 HydrophobicContact CE1-CG2 4.3Å; Y106-T110 HydrophobicContact CE2-CG2 3.43Å; Y106-T110 VanDerWaalsContact CE2-CG2 3.43Å; Y106-T110 HydrophobicContact CG-CG2 4.42Å; Y106-T110 WeakPolarHBondContact O-CB 3.49Å; Y106-T110 WeakPolarHBondContact O-CG2 3.41Å; Y106-T110 PolarHBondContact O-N 3.35Å; Y106-T110 PolarHBondContact O-OG1 2.79Å; R107-T110 PolarHBondContact O-N 3.29Å; T110-I112 PolarHBondContact O-N 3.27Å; T110-V152 HydrophobicContact CG2-CG1 3.87Å; T110-L153 HydrophobicContact CG2-CD2 4.06Å |
| 111 | H | 80.1 | Confident | 75.6 | Confident | 128 Ų | 128 | 59 Ų | 59 | 59% | 0.593 | 31% | 0.309 | S | S | * | . | trans | -58.6 | 125.8 | -179.5 | -153.1 | -58.7 | 0 | 0 | 0 | 110.8 | R107 D113 | R107-H111 WeakPolarHBondContact O-CB 3.44Å; R107-H111 PolarHBondContact O-N 3.23Å; H111-D113 PolarHBondContact O-N 3.45Å | ||
| 112 | I | 52.6 | Low | 73.8 | Confident | 140 Ų | 140 | 60.4 Ų | 60.4 | 72% | 0.718 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.7 | -21.7 | -147.7 | -71.8 | 172.3 | 0 | 0 | 0 | 116.1 | T110 | T110-I112 PolarHBondContact O-N 3.27Š|
| 113 | D | 51.5 | Low | 72.3 | Confident | 138 Ų | 138 | 60.6 Ų | 60.6 | 74% | 0.738 | 32% | 0.321 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -118.1 | -13 | -167.4 | -68.5 | -60.1 | 0 | 0 | 0 | 116.2 | H111 | H111-D113 PolarHBondContact O-N 3.45Š|
| 114 | T | 53.7 | Low | 70.6 | Confident | 78 Ų | 78 | 66.4 Ų | 66.4 | 48% | 0.479 | 35% | 0.351 | S | S | . | . | S | Bend | trans | -93.9 | -9.4 | -163.7 | 42.5 | 0 | 0 | 0 | 0 | 115.4 | N118 | T114-N118 VanDerWaalsContact O-CB 3.32Å; T114-N118 WeakPolarHBondContact O-CB 2.84Å; T114-N118 PolarHBondContact O-ND2 3.39Å |
| 115 | V | 53 | Low | 69.2 | Low | 9 Ų | 9 | 72.2 Ų | 72.2 | 6% | 0.055 | 38% | 0.377 | C | S | . | . | S | Bend | trans | -138.9 | -18.6 | -162.5 | -133.1 | 0 | 0 | 0 | 0 | 118.6 | V78 T79 N117 N118 Y119 | V78-V115 HydrophobicContact CG2-CG1 4.04Å; V78-V115 HydrophobicContact CG2-CG2 3.82Å; T79-V115 HydrophobicContact CG2-CG1 4.27Å; V115-N117 VanDerWaalsContact C-N 3.26Å; V115-N117 PolarHBondContact O-N 3.18Å; V115-N118 HydrophobicContact CG1-CB 4.32Å; V115-N118 PolarHBondContact O-N 3.01Å; V115-N118 VanDerWaalsContact O-N 3.16Å; V115-Y119 VanDerWaalsContact C-CD2 3.44Å; V115-Y119 HydrophobicContact CB-CD1 4.25Å; V115-Y119 HydrophobicContact CB-CD2 3.7Å; V115-Y119 HydrophobicContact CB-CE1 3.85Å; V115-Y119 HydrophobicContact CB-CE2 3.29Å; V115-Y119 HydrophobicContact CB-CG 4.14Å; V115-Y119 HydrophobicContact CG1-CD1 3.29Å; V115-Y119 HydrophobicContact CG1-CD2 3.62Å; V115-Y119 HydrophobicContact CG1-CE1 3.06Å; V115-Y119 HydrophobicContact CG1-CE2 3.46Å; V115-Y119 VanDerWaalsContact CG1-CE2 3.46Å; V115-Y119 HydrophobicContact CG1-CG 3.52Å; V115-Y119 HydrophobicContact CG2-CE2 4.31Å; V115-Y119 VanDerWaalsContact O-CB 3.3Å; V115-Y119 WeakPolarHBondContact O-CB 3.48Å; V115-Y119 WeakPolarHBondContact O-CD2 3.47Å; V115-Y119 PolarHBondContact O-N 3.22Å |
| 116 | I | 53.3 | Low | 68 | Low | 119 Ų | 119 | 74.2 Ų | 74.2 | 61% | 0.61 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -64.2 | -34.6 | 173.2 | -66.5 | 167.4 | 0 | 0 | 0 | 111.5 | ||
| 117 | N | 56.8 | Low | 67.2 | Low | 139 Ų | 139 | 79.6 Ų | 79.6 | 74% | 0.743 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -84.6 | -23.9 | 171.9 | -70.1 | -30.9 | 0 | 0 | 0 | 113.8 | V115 | V115-N117 VanDerWaalsContact C-N 3.26Å; V115-N117 PolarHBondContact O-N 3.18Å |
| 118 | N | 55.9 | Low | 66.8 | Low | 72 Ų | 72 | 73 Ų | 73 | 39% | 0.385 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -96.5 | -23.4 | -177 | -75.7 | -31 | 0 | 0 | 0 | 114.3 | T114 V115 G120 L121 A122 | T114-N118 VanDerWaalsContact O-CB 3.32Å; T114-N118 WeakPolarHBondContact O-CB 2.84Å; T114-N118 PolarHBondContact O-ND2 3.39Å; V115-N118 HydrophobicContact CG1-CB 4.32Å; V115-N118 PolarHBondContact O-N 3.01Å; V115-N118 VanDerWaalsContact O-N 3.16Å; N118-G120 VanDerWaalsContact C-N 3.33Å; N118-L121 CarbonylContact O-C 3.57Å; N118-L121 PolarHBondContact O-N 3.22Å; N118-L121 VanDerWaalsContact O-N 3.14Å; N118-A122 VanDerWaalsContact O-CB 3.25Å; N118-A122 WeakPolarHBondContact O-CB 3.26Å; N118-A122 PolarHBondContact O-N 2.94Å |
| 119 | Y | 63 | Low | 66.5 | Low | 9 Ų | 9 | 75.2 Ų | 75.2 | 4% | 0.035 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -58.6 | -50.3 | 173.3 | -74 | -51.5 | 0 | 0 | 0 | 108.1 | V78 V115 L121 A122 L123 F132 F136 I160 | V78-Y119 HydrophobicContact CG2-CE1 4.35Å; V115-Y119 VanDerWaalsContact C-CD2 3.44Å; V115-Y119 HydrophobicContact CB-CD1 4.25Å; V115-Y119 HydrophobicContact CB-CD2 3.7Å; V115-Y119 HydrophobicContact CB-CE1 3.85Å; V115-Y119 HydrophobicContact CB-CE2 3.29Å; V115-Y119 HydrophobicContact CB-CG 4.14Å; V115-Y119 HydrophobicContact CG1-CD1 3.29Å; V115-Y119 HydrophobicContact CG1-CD2 3.62Å; V115-Y119 HydrophobicContact CG1-CE1 3.06Å; V115-Y119 HydrophobicContact CG1-CE2 3.46Å; V115-Y119 VanDerWaalsContact CG1-CE2 3.46Å; V115-Y119 HydrophobicContact CG1-CG 3.52Å; V115-Y119 HydrophobicContact CG2-CE2 4.31Å; V115-Y119 VanDerWaalsContact O-CB 3.3Å; V115-Y119 WeakPolarHBondContact O-CB 3.48Å; V115-Y119 WeakPolarHBondContact O-CD2 3.47Å; V115-Y119 PolarHBondContact O-N 3.22Å; Y119-L121 PolarHBondContact O-N 3.1Å; Y119-L121 VanDerWaalsContact O-N 3.11Å; Y119-A122 CarbonylContact O-C 3.6Å; Y119-A122 PolarHBondContact O-N 3.33Å; Y119-L123 WeakPolarHBondContact O-CB 3.29Å; Y119-L123 WeakPolarHBondContact O-CD1 3.36Å; Y119-L123 WeakPolarHBondContact O-CG 3.4Å; Y119-L123 PolarHBondContact O-N 3.13Å; Y119-F132 HydrophobicContact CD1-CD1 4.05Å; Y119-F132 HydrophobicContact CD1-CD2 4.12Å; Y119-F132 AromaticContact CD1-CE1 3.93Å; Y119-F132 HydrophobicContact CD1-CE1 3.93Å; Y119-F132 AromaticContact CD1-CE2 3.92Å; Y119-F132 HydrophobicContact CD1-CE2 3.92Å; Y119-F132 HydrophobicContact CD1-CG 4.17Å; Y119-F132 AromaticContact CD1-CZ 3.82Å; Y119-F132 HydrophobicContact CD1-CZ 3.82Å; Y119-F132 AromaticContact CE1-CD1 3.53Å; Y119-F132 HydrophobicContact CE1-CD1 3.53Å; Y119-F132 HydrophobicContact CE1-CD2 4.39Å; Y119-F132 AromaticContact CE1-CE1 3.28Å; Y119-F132 HydrophobicContact CE1-CE1 3.28Å; Y119-F132 HydrophobicContact CE1-CE2 4.12Å; Y119-F132 HydrophobicContact CE1-CG 4.12Å; Y119-F132 AromaticContact CE1-CZ 3.57Å; Y119-F132 HydrophobicContact CE1-CZ 3.57Å; Y119-F136 HydrophobicContact CE1-CE2 4.5Å; Y119-I160 HydrophobicContact CD2-CG1 4.36Å; Y119-I160 HydrophobicContact CE2-CD1 4.42Å |
| 120 | G | 62.2 | Low | 66.4 | Low | 34 Ų | 34 | 79.5 Ų | 79.5 | 35% | 0.351 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -53.8 | -35 | 175.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | N118 | N118-G120 VanDerWaalsContact C-N 3.33Å |
| 121 | L | 58.9 | Low | 66.6 | Low | 121 Ų | 121 | 79.6 Ų | 79.6 | 63% | 0.634 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -81.3 | -29.5 | 176.4 | -69.3 | 171.7 | 0 | 0 | 0 | 114 | N118 Y119 N124 | N118-L121 CarbonylContact O-C 3.57Å; N118-L121 PolarHBondContact O-N 3.22Å; N118-L121 VanDerWaalsContact O-N 3.14Å; Y119-L121 PolarHBondContact O-N 3.1Å; Y119-L121 VanDerWaalsContact O-N 3.11Å; L121-N124 PolarHBondContact O-ND2 3.5Å |
| 122 | A | 61.3 | Low | 67.1 | Low | 29 Ų | 29 | 73.5 Ų | 73.5 | 24% | 0.24 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -90.2 | -20.6 | -178.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | N118 Y119 N124 T128 | N118-A122 VanDerWaalsContact O-CB 3.25Å; N118-A122 WeakPolarHBondContact O-CB 3.26Å; N118-A122 PolarHBondContact O-N 2.94Å; Y119-A122 CarbonylContact O-C 3.6Å; Y119-A122 PolarHBondContact O-N 3.33Å; A122-N124 PolarHBondContact O-N 3.4Å; A122-T128 WeakPolarHBondContact O-CG2 3.39Å |
| 123 | L | 65.6 | Low | 69 | Low | 5 Ų | 5 | 68.2 Ų | 68.2 | 3% | 0.026 | 37% | 0.366 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -75.5 | -1.1 | 177.9 | -70.7 | 169.5 | 0 | 0 | 0 | 112.7 | Y119 E125 T128 E129 F132 I160 I163 L164 | Y119-L123 WeakPolarHBondContact O-CB 3.29Å; Y119-L123 WeakPolarHBondContact O-CD1 3.36Å; Y119-L123 WeakPolarHBondContact O-CG 3.4Å; Y119-L123 PolarHBondContact O-N 3.13Å; L123-E125 PolarHBondContact O-N 3.3Å; L123-T128 HydrophobicContact CD2-CG2 4.47Å; L123-E129 HydrophobicContact CB-CG 3.94Å; L123-E129 VanDerWaalsContact CD2-CA 3.4Å; L123-E129 HydrophobicContact CD2-CB 3.93Å; L123-E129 HydrophobicContact CD2-CG 3.74Å; L123-E129 HydrophobicContact CG-CG 4.41Å; L123-E129 WeakPolarHBondContact O-CG 3.18Å; L123-F132 HydrophobicContact CD2-CB 4.35Å; L123-F132 HydrophobicContact CD2-CD2 3.76Å; L123-F132 HydrophobicContact CD2-CG 4.47Å; L123-I160 HydrophobicContact CD1-CG2 4.43Å; L123-I163 HydrophobicContact CD1-CG2 4.21Å; L123-L164 HydrophobicContact CB-CD2 4.15Å; L123-L164 HydrophobicContact CD1-CD2 3.92Å; L123-L164 HydrophobicContact CD1-CG 4.3Å; L123-L164 HydrophobicContact CD2-CD2 4.36Å; L123-L164 HydrophobicContact CG-CD2 4.36Å |
| 124 | N | 62.2 | Low | 71.1 | Confident | 130 Ų | 130 | 63.3 Ų | 63.3 | 70% | 0.695 | 34% | 0.34 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.2 | -6.9 | 178.8 | -73.5 | -43.1 | 0 | 0 | 0 | 115.5 | L121 A122 | L121-N124 PolarHBondContact O-ND2 3.5Å; A122-N124 PolarHBondContact O-N 3.4Å |
| 125 | E | 68.2 | Low | 73.1 | Confident | 133 Ų | 133 | 59.6 Ų | 59.6 | 62% | 0.621 | 32% | 0.317 | S | S | * | . | S | Bend | trans | -119 | 116 | 174.2 | -63.1 | 179.7 | 179.9 | 0 | 0 | 108.8 | L123 R127 T128 E129 | L123-E125 PolarHBondContact O-N 3.3Å; E125-R127 PolarHBondContact O-N 3.04Å; E125-T128 WeakPolarHBondContact O-CA 3.5Å; E125-T128 WeakPolarHBondContact O-CB 3.28Å; E125-T128 PolarHBondContact O-N 3.44Å; E125-E129 PolarHBondContact O-N 3.01Å |
| 126 | G | 71.3 | Confident | 75.1 | Confident | 43 Ų | 43 | 59.2 Ų | 59.2 | 44% | 0.443 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -53.1 | -25.5 | -173.7 | 0 | 0 | 0 | 0 | 0 | 115.6 | T128 E129 E130 | G126-T128 VanDerWaalsContact C-N 3.32Å; G126-T128 PolarHBondContact O-N 3.01Å; G126-E129 PolarHBondContact O-N 3.49Å; G126-E130 PolarHBondContact O-N 2.97Å |
| 127 | R | 79.2 | Confident | 77.2 | Confident | 151 Ų | 151 | 53.7 Ų | 53.7 | 57% | 0.57 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -65.9 | -33.7 | 172.7 | -173 | 176.2 | 177.2 | -136.4 | -13 | 112.7 | E81 E125 Q131 | E81-R127 IonicContact OE1-CZ 3.01Å; E81-R127 IonicContact OE1-NH1 2.69Å; E81-R127 PolarHBondContact OE1-NH1 3.1Å; E81-R127 IonicContact OE1-NH2 2.8Å; E81-R127 PolarHBondContact OE1-NH2 3.15Å; E81-R127 IonicContact OE2-NH1 3.87Å; E125-R127 PolarHBondContact O-N 3.04Å; R127-Q131 WeakPolarHBondContact O-CG 3.24Å; R127-Q131 PolarHBondContact O-N 3.13Å |
| 128 | T | 83.9 | Confident | 79.1 | Confident | 9 Ų | 9 | 49.1 Ų | 49.1 | 6% | 0.055 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -72.4 | -37.4 | 177.3 | -70 | 0 | 0 | 0 | 0 | 111.6 | R84 A122 L123 E125 G126 Q131 F132 | R84-T128 VanDerWaalsContact NH1-CA 3.28Å; R84-T128 VanDerWaalsContact NH1-CG2 3.34Å; R84-T128 PolarHBondContact NH1-OG1 3.24Å; R84-T128 PolarHBondContact NH2-OG1 3.18Å; A122-T128 WeakPolarHBondContact O-CG2 3.39Å; L123-T128 HydrophobicContact CD2-CG2 4.47Å; E125-T128 WeakPolarHBondContact O-CA 3.5Å; E125-T128 WeakPolarHBondContact O-CB 3.28Å; E125-T128 PolarHBondContact O-N 3.44Å; G126-T128 VanDerWaalsContact C-N 3.32Å; G126-T128 PolarHBondContact O-N 3.01Å; T128-Q131 PolarHBondContact O-N 3.18Å; T128-F132 HydrophobicContact CG2-CD2 3.58Å; T128-F132 HydrophobicContact CG2-CE2 3.4Å; T128-F132 VanDerWaalsContact CG2-CE2 3.4Å; T128-F132 VanDerWaalsContact O-CD2 3.23Å; T128-F132 WeakPolarHBondContact O-CD2 3.49Å; T128-F132 PolarHBondContact O-N 3.47Å |
| 129 | E | 85.9 | Confident | 81.1 | Confident | 65 Ų | 65 | 45.7 Ų | 45.7 | 30% | 0.304 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -58.3 | -52.8 | 173.8 | -50 | -179.1 | 156.1 | 0 | 0 | 112.2 | L123 E125 G126 Q131 F132 L133 L164 | L123-E129 HydrophobicContact CB-CG 3.94Å; L123-E129 VanDerWaalsContact CD2-CA 3.4Å; L123-E129 HydrophobicContact CD2-CB 3.93Å; L123-E129 HydrophobicContact CD2-CG 3.74Å; L123-E129 HydrophobicContact CG-CG 4.41Å; L123-E129 WeakPolarHBondContact O-CG 3.18Å; E125-E129 PolarHBondContact O-N 3.01Å; G126-E129 PolarHBondContact O-N 3.49Å; E129-Q131 VanDerWaalsContact C-N 3.27Å; E129-Q131 PolarHBondContact O-N 3.47Å; E129-F132 PolarHBondContact O-N 3.37Å; E129-L133 WeakPolarHBondContact O-CG 3.49Å; E129-L133 PolarHBondContact O-N 3.47Å; E129-L164 HydrophobicContact CB-CD1 4.07Å; E129-L164 HydrophobicContact CB-CD2 4.12Å; E129-L164 HydrophobicContact CG-CD2 3.67Å; E129-L164 WeakPolarHBondContact OE1-CD2 3.39Å |
| 130 | E | 88.6 | Confident | 82.7 | Confident | 95 Ų | 95 | 45.6 Ų | 45.6 | 44% | 0.444 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -60.1 | -38 | -179.8 | -71.4 | -165.9 | 153.7 | 0 | 0 | 112.6 | G126 L134 | G126-E130 PolarHBondContact O-N 2.97Å; E130-L134 VanDerWaalsContact O-CB 3.28Å; E130-L134 WeakPolarHBondContact O-CB 3.44Å; E130-L134 PolarHBondContact O-N 3.39Å |
| 131 | Q | 90.9 | Very high | 84.4 | Confident | 25 Ų | 25 | 46.1 Ų | 46.1 | 12% | 0.117 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -67.5 | -41.1 | 178 | -75.5 | -173.8 | -5.4 | 0 | 0 | 112.1 | R84 L88 R127 T128 E129 L134 L135 | R84-Q131 HydrophobicContact CG-CB 4.14Å; L88-Q131 HydrophobicContact CD1-CB 4.1Å; L88-Q131 HydrophobicContact CD1-CG 3.98Å; R127-Q131 WeakPolarHBondContact O-CG 3.24Å; R127-Q131 PolarHBondContact O-N 3.13Å; T128-Q131 PolarHBondContact O-N 3.18Å; E129-Q131 VanDerWaalsContact C-N 3.27Å; E129-Q131 PolarHBondContact O-N 3.47Å; Q131-L134 PolarHBondContact O-N 3.01Å; Q131-L135 WeakPolarHBondContact O-CB 3.34Å; Q131-L135 PolarHBondContact O-N 3.09Å |
| 132 | F | 91 | Very high | 86.2 | Confident | 0 Ų | 0 | 41.5 Ų | 41.5 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -67.1 | -45.4 | 176.3 | -81.7 | -59.1 | 0 | 0 | 0 | 112 | V78 Y119 L123 T128 E129 L134 L135 F136 | V78-F132 HydrophobicContact CB-CE1 4.21Å; V78-F132 HydrophobicContact CG2-CE1 4.31Å; V78-F132 VanDerWaalsContact O-CZ 3.25Å; V78-F132 WeakPolarHBondContact O-CZ 3.4Å; Y119-F132 HydrophobicContact CD1-CD1 4.05Å; Y119-F132 HydrophobicContact CD1-CD2 4.12Å; Y119-F132 AromaticContact CD1-CE1 3.93Å; Y119-F132 HydrophobicContact CD1-CE1 3.93Å; Y119-F132 AromaticContact CD1-CE2 3.92Å; Y119-F132 HydrophobicContact CD1-CE2 3.92Å; Y119-F132 HydrophobicContact CD1-CG 4.17Å; Y119-F132 AromaticContact CD1-CZ 3.82Å; Y119-F132 HydrophobicContact CD1-CZ 3.82Å; Y119-F132 AromaticContact CE1-CD1 3.53Å; Y119-F132 HydrophobicContact CE1-CD1 3.53Å; Y119-F132 HydrophobicContact CE1-CD2 4.39Å; Y119-F132 AromaticContact CE1-CE1 3.28Å; Y119-F132 HydrophobicContact CE1-CE1 3.28Å; Y119-F132 HydrophobicContact CE1-CE2 4.12Å; Y119-F132 HydrophobicContact CE1-CG 4.12Å; Y119-F132 AromaticContact CE1-CZ 3.57Å; Y119-F132 HydrophobicContact CE1-CZ 3.57Å; L123-F132 HydrophobicContact CD2-CB 4.35Å; L123-F132 HydrophobicContact CD2-CD2 3.76Å; L123-F132 HydrophobicContact CD2-CG 4.47Å; T128-F132 HydrophobicContact CG2-CD2 3.58Å; T128-F132 HydrophobicContact CG2-CE2 3.4Å; T128-F132 VanDerWaalsContact CG2-CE2 3.4Å; T128-F132 VanDerWaalsContact O-CD2 3.23Å; T128-F132 WeakPolarHBondContact O-CD2 3.49Å; T128-F132 PolarHBondContact O-N 3.47Å; E129-F132 PolarHBondContact O-N 3.37Å; F132-L134 VanDerWaalsContact C-N 3.32Å; F132-L134 PolarHBondContact O-N 3.12Å; F132-L135 HydrophobicContact CD1-CD2 4.39Å; F132-L135 PolarHBondContact O-N 2.83Å; F132-F136 HydrophobicContact CD1-CE2 4.25Å; F132-F136 WeakPolarHBondContact O-CD2 3.41Å; F132-F136 PolarHBondContact O-N 3.34Å |
| 133 | L | 92.6 | Very high | 87.9 | Confident | 29 Ų | 29 | 43.7 Ų | 43.7 | 15% | 0.152 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -55.9 | -48.8 | 174.6 | -71.5 | 173.2 | 0 | 0 | 0 | 110.8 | A23 E129 L135 F136 T137 L157 I160 Q161 L164 | A23-L133 HydrophobicContact CB-CB 3.77Å; E129-L133 WeakPolarHBondContact O-CG 3.49Å; E129-L133 PolarHBondContact O-N 3.47Å; L133-L135 PolarHBondContact O-N 2.66Å; L133-F136 PolarHBondContact O-N 3.3Å; L133-T137 VanDerWaalsContact O-CB 3.28Å; L133-T137 WeakPolarHBondContact O-CB 3.47Å; L133-T137 PolarHBondContact O-N 3.06Å; L133-T137 PolarHBondContact O-OG1 3.17Å; L133-L157 HydrophobicContact CD2-CD1 3.88Å; L133-I160 HydrophobicContact CD2-CG2 3.95Å; L133-I160 HydrophobicContact CG-CG2 4.48Å; L133-Q161 HydrophobicContact CD2-CG 3.65Å; L133-L164 HydrophobicContact CD1-CD1 3.9Å; L133-L164 HydrophobicContact CD2-CD1 4.16Å; L133-L164 HydrophobicContact CG-CD1 4.05Å |
| 134 | L | 95.8 | Very high | 89.5 | Confident | 35 Ų | 35 | 43.6 Ų | 43.6 | 18% | 0.183 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -62.9 | -42.8 | 178.9 | -179.7 | 61 | 0 | 0 | 0 | 112.1 | A23 A26 L88 E130 Q131 F132 F136 T137 M138 | A23-L134 HydrophobicContact CB-CB 4.18Å; A26-L134 HydrophobicContact CB-CD1 4.19Å; L88-L134 HydrophobicContact CD2-CB 4.1Å; L88-L134 HydrophobicContact CD2-CD2 3.86Å; L88-L134 HydrophobicContact CD2-CG 3.72Å; E130-L134 VanDerWaalsContact O-CB 3.28Å; E130-L134 WeakPolarHBondContact O-CB 3.44Å; E130-L134 PolarHBondContact O-N 3.39Å; Q131-L134 PolarHBondContact O-N 3.01Å; F132-L134 VanDerWaalsContact C-N 3.32Å; F132-L134 PolarHBondContact O-N 3.12Å; L134-F136 PolarHBondContact O-N 2.91Å; L134-T137 PolarHBondContact O-N 2.9Å; L134-M138 HydrophobicContact CD1-CG 3.97Å; L134-M138 HydrophobicContact CD1-SD 3.95Å; L134-M138 HydrophobicContact CG-CG 4.38Å; L134-M138 HydrophobicContact CG-SD 3.93Å; L134-M138 WeakPolarHBondContact O-CB 3.3Å; L134-M138 VanDerWaalsContact O-CG 3.3Å; L134-M138 WeakPolarHBondContact O-CG 3.46Å; L134-M138 PolarHBondContact O-N 3.45Å |
| 135 | L | 95.1 | Very high | 91.2 | Very high | 0 Ų | 0 | 37.7 Ų | 37.7 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -59.2 | -49.2 | -179.3 | -171.6 | 73.5 | 0 | 0 | 0 | 111.2 | L87 L88 L91 L109 Q131 F132 L133 A139 | L87-L135 HydrophobicContact CB-CD1 3.71Å; L88-L135 HydrophobicContact CD2-CB 3.93Å; L88-L135 HydrophobicContact CD2-CD1 3.91Å; L88-L135 HydrophobicContact CG-CB 4.46Å; L88-L135 HydrophobicContact CG-CD1 3.89Å; L91-L135 HydrophobicContact CD1-CD1 3.52Å; L91-L135 HydrophobicContact CD1-CG 4.15Å; L109-L135 HydrophobicContact CD2-CD2 3.44Å; L109-L135 VanDerWaalsContact CD2-CD2 3.44Å; L109-L135 HydrophobicContact CD2-CG 3.84Å; Q131-L135 WeakPolarHBondContact O-CB 3.34Å; Q131-L135 PolarHBondContact O-N 3.09Å; F132-L135 HydrophobicContact CD1-CD2 4.39Å; F132-L135 PolarHBondContact O-N 2.83Å; L133-L135 PolarHBondContact O-N 2.66Å; L135-A139 WeakPolarHBondContact O-CB 3.35Å; L135-A139 PolarHBondContact O-N 2.86Å |
| 136 | F | 95 | Very high | 92.6 | Very high | 0 Ų | 0 | 34.9 Ų | 34.9 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -74.1 | -33.4 | 179.4 | -79.6 | -81.8 | 0 | 0 | 0 | 112.8 | L109 Y119 F132 L133 L134 S140 L153 Q156 L157 I160 | L109-F136 HydrophobicContact CB-CE1 4.24Å; L109-F136 HydrophobicContact CB-CZ 4.4Å; L109-F136 HydrophobicContact CD2-CZ 4.39Å; Y119-F136 HydrophobicContact CE1-CE2 4.5Å; F132-F136 HydrophobicContact CD1-CE2 4.25Å; F132-F136 WeakPolarHBondContact O-CD2 3.41Å; F132-F136 PolarHBondContact O-N 3.34Å; L133-F136 PolarHBondContact O-N 3.3Å; L134-F136 PolarHBondContact O-N 2.91Å; F136-S140 VanDerWaalsContact O-CB 3.27Å; F136-S140 WeakPolarHBondContact O-CB 3.4Å; F136-S140 PolarHBondContact O-N 2.91Å; F136-S140 PolarHBondContact O-OG 3.31Å; F136-L153 HydrophobicContact CD1-CD2 4.15Å; F136-L153 HydrophobicContact CE1-CD2 4.04Å; F136-Q156 HydrophobicContact CD1-CB 4.01Å; F136-Q156 HydrophobicContact CE1-CB 3.8Å; F136-Q156 HydrophobicContact CE1-CG 4.47Å; F136-Q156 VanDerWaalsContact CE1-OE1 3.28Å; F136-L157 HydrophobicContact CB-CB 4.01Å; F136-L157 HydrophobicContact CB-CD1 3.86Å; F136-L157 HydrophobicContact CB-CG 4.42Å; F136-I160 HydrophobicContact CD2-CD1 3.34Å; F136-I160 HydrophobicContact CE2-CD1 3.47Å; F136-I160 VanDerWaalsContact CE2-CD1 3.47Å; F136-I160 HydrophobicContact CG-CD1 4Å; F136-I160 HydrophobicContact CZ-CD1 4.22Å |
| 137 | T | 97.1 | Very high | 93.8 | Very high | 3 Ų | 3 | 40.8 Ų | 40.8 | 2% | 0.018 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -60.8 | -48.3 | 170.6 | -67.3 | 0 | 0 | 0 | 0 | 111 | A26 E27 L133 L134 S140 N141 | A26-T137 HydrophobicContact CB-CG2 4.19Å; E27-T137 HydrophobicContact CB-CG2 3.8Å; L133-T137 VanDerWaalsContact O-CB 3.28Å; L133-T137 WeakPolarHBondContact O-CB 3.47Å; L133-T137 PolarHBondContact O-N 3.06Å; L133-T137 PolarHBondContact O-OG1 3.17Å; L134-T137 PolarHBondContact O-N 2.9Å; T137-S140 PolarHBondContact O-OG 3.48Å; T137-S140 VanDerWaalsContact O-OG 3.13Å; T137-N141 PolarHBondContact O-N 3.45Å; T137-N141 PolarHBondContact O-ND2 2.95Å |
| 138 | M | 98 | Very high | 94.6 | Very high | 43 Ų | 43 | 39 Ų | 39 | 21% | 0.212 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -62.7 | -50.5 | 177.9 | -71.8 | 176.1 | 70.3 | 0 | 0 | 110.9 | L88 L91 A92 L134 S140 N141 H142 | L88-M138 HydrophobicContact CD2-SD 4.12Å; L91-M138 HydrophobicContact CB-CB 4.48Å; L91-M138 HydrophobicContact CB-CE 4.01Å; L91-M138 HydrophobicContact CD1-CB 4.36Å; A92-M138 HydrophobicContact CB-CE 3.72Å; L134-M138 HydrophobicContact CD1-CG 3.97Å; L134-M138 HydrophobicContact CD1-SD 3.95Å; L134-M138 HydrophobicContact CG-CG 4.38Å; L134-M138 HydrophobicContact CG-SD 3.93Å; L134-M138 WeakPolarHBondContact O-CB 3.3Å; L134-M138 VanDerWaalsContact O-CG 3.3Å; L134-M138 WeakPolarHBondContact O-CG 3.46Å; L134-M138 PolarHBondContact O-N 3.45Å; M138-S140 PolarHBondContact O-N 3.05Å; M138-N141 PolarHBondContact O-N 2.79Å; M138-H142 WeakPolarHBondContact O-CB 3.36Å; M138-H142 PolarHBondContact O-N 3.09Å |
| 139 | A | 97.2 | Very high | 95.3 | Very high | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -62.6 | -39.9 | -176.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | L91 L109 L135 N141 H142 F145 L153 | L91-A139 HydrophobicContact CD1-CB 3.92Å; L91-A139 HydrophobicContact CD2-CB 4.1Å; L109-A139 HydrophobicContact CD1-CB 3.65Å; L135-A139 WeakPolarHBondContact O-CB 3.35Å; L135-A139 PolarHBondContact O-N 2.86Å; A139-N141 VanDerWaalsContact C-N 3.3Å; A139-N141 PolarHBondContact O-N 3.09Å; A139-H142 PolarHBondContact O-N 3.18Å; A139-F145 HydrophobicContact CB-CE2 4.32Å; A139-F145 HydrophobicContact CB-CZ 4.38Å; A139-F145 VanDerWaalsContact O-CD2 3.3Å; A139-F145 WeakPolarHBondContact O-CD2 3.44Å; A139-L153 HydrophobicContact CB-CD1 3.77Å; A139-L153 HydrophobicContact CB-CD2 4.32Å |
| 140 | S | 97 | Very high | 95.8 | Very high | 8 Ų | 8 | 39.4 Ų | 39.4 | 6% | 0.056 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -70.2 | -23.1 | 178.9 | 59.7 | 0 | 0 | 0 | 0 | 113.9 | F136 T137 M138 K150 | F136-S140 VanDerWaalsContact O-CB 3.27Å; F136-S140 WeakPolarHBondContact O-CB 3.4Å; F136-S140 PolarHBondContact O-N 2.91Å; F136-S140 PolarHBondContact O-OG 3.31Å; T137-S140 PolarHBondContact O-OG 3.48Å; T137-S140 VanDerWaalsContact O-OG 3.13Å; M138-S140 PolarHBondContact O-N 3.05Å; S140-K150 WeakPolarHBondContact O-CB 3.45Å; S140-K150 VanDerWaalsContact O-CG 3.32Å; S140-K150 WeakPolarHBondContact O-CG 3.47Å |
| 141 | N | 97.3 | Very high | 96.2 | Very high | 45 Ų | 45 | 40.3 Ų | 40.3 | 24% | 0.241 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -96.9 | -21.5 | 176.7 | -71.1 | -75.5 | 0 | 0 | 0 | 113.1 | T137 M138 A139 K150 | T137-N141 PolarHBondContact O-N 3.45Å; T137-N141 PolarHBondContact O-ND2 2.95Å; M138-N141 PolarHBondContact O-N 2.79Å; A139-N141 VanDerWaalsContact C-N 3.3Å; A139-N141 PolarHBondContact O-N 3.09Å; N141-K150 PolarHBondContact O-NZ 2.8Å; N141-K150 VanDerWaalsContact O-NZ 3.16Å |
| 142 | H | 97.9 | Very high | 96.3 | Very high | 23 Ų | 23 | 41.1 Ų | 41.1 | 11% | 0.106 | 21% | 0.206 | C | C | . | . | trans | -65.9 | 129.9 | -168.3 | -173.8 | -70.3 | 0 | 0 | 0 | 113.7 | L91 L94 M138 A139 A144 F145 K150 | L91-H142 PolarHBondContact O-CD2 3.33Å; L91-H142 VanDerWaalsContact O-CD2 3.24Å; L91-H142 PolarHBondContact O-NE2 3.32Å; L94-H142 PolarHBondContact O-CE1 3.16Å; L94-H142 PolarHBondContact O-NE2 3.15Å; M138-H142 WeakPolarHBondContact O-CB 3.36Å; M138-H142 PolarHBondContact O-N 3.09Å; A139-H142 PolarHBondContact O-N 3.18Å; H142-A144 VanDerWaalsContact C-N 3.32Å; H142-A144 VanDerWaalsContact CE1-CB 3.47Å; H142-A144 WeakPolarHBondContact CE1-CB 3.3Å; H142-A144 WeakPolarHBondContact ND1-CB 3.43Å; H142-A144 PolarHBondContact ND1-N 3.24Å; H142-A144 VanDerWaalsContact ND1-N 3.13Å; H142-A144 PolarHBondContact O-N 3.11Å; H142-F145 HydrophobicContact CB-CD2 3.74Å; H142-F145 HydrophobicContact CB-CE2 3.88Å; H142-F145 PolarHBondContact O-N 2.88Å; H142-K150 WeakPolarHBondContact O-CE 3.29Å; H142-K150 PolarHBondContact O-NZ 3.35Å | ||
| 143 | P | 97.2 | Very high | 96.5 | Very high | 75 Ų | 75 | 41.1 Ų | 41.1 | 49% | 0.487 | 21% | 0.206 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -63.9 | -26.6 | -170.8 | 24 | -34.9 | 0 | 0 | 0 | 115.5 | T96 F145 | T96-P143 HydrophobicContact CG2-CG 3.59Å; T96-P143 CarbonylContact O-C 3.44Å; P143-F145 PolarHBondContact O-N 3.24Å |
| 144 | A | 98.3 | Very high | 96.6 | Very high | 4 Ų | 4 | 46.1 Ų | 46.1 | 3% | 0.033 | 22% | 0.222 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -67.5 | -20.4 | 179.2 | 0 | 0 | 0 | 0 | 0 | 114 | L94 G95 T96 A102 H142 | L94-A144 HydrophobicContact CD2-CB 3.85Å; L94-A144 HydrophobicContact CG-CB 4.18Å; G95-A144 WeakPolarHBondContact O-CB 3.37Å; T96-A144 WeakPolarHBondContact O-CA 3.17Å; T96-A144 PolarHBondContact O-N 3.03Å; A102-A144 HydrophobicContact CB-CB 3.79Å; H142-A144 VanDerWaalsContact C-N 3.32Å; H142-A144 VanDerWaalsContact CE1-CB 3.47Å; H142-A144 WeakPolarHBondContact CE1-CB 3.3Å; H142-A144 WeakPolarHBondContact ND1-CB 3.43Å; H142-A144 PolarHBondContact ND1-N 3.24Å; H142-A144 VanDerWaalsContact ND1-N 3.13Å; H142-A144 PolarHBondContact O-N 3.11Å |
| 145 | F | 98.3 | Very high | 96.4 | Very high | 5 Ų | 5 | 50.1 Ų | 50.1 | 2% | 0.022 | 24% | 0.24 | C | C | . | . | S | Bend | trans | -82.5 | 138.3 | 173.8 | -62.5 | -88 | 0 | 0 | 0 | 110.5 | L91 L94 A102 L105 Y106 A139 H142 P143 Q149 K150 L153 | L91-F145 HydrophobicContact CD2-CE2 3.61Å; L91-F145 HydrophobicContact CD2-CZ 3.7Å; L94-F145 HydrophobicContact CD2-CE2 4.27Å; A102-F145 HydrophobicContact CB-CD1 4.2Å; A102-F145 HydrophobicContact CB-CE1 4.13Å; A102-F145 HydrophobicContact CB-CG 4.46Å; A102-F145 HydrophobicContact CB-CZ 4.32Å; A102-F145 WeakPolarHBondContact O-CE1 3.43Å; L105-F145 HydrophobicContact CB-CE1 4.44Å; L105-F145 HydrophobicContact CB-CZ 4.11Å; Y106-F145 HydrophobicContact CD2-CD1 4.45Å; A139-F145 HydrophobicContact CB-CE2 4.32Å; A139-F145 HydrophobicContact CB-CZ 4.38Å; A139-F145 VanDerWaalsContact O-CD2 3.3Å; A139-F145 WeakPolarHBondContact O-CD2 3.44Å; H142-F145 HydrophobicContact CB-CD2 3.74Å; H142-F145 HydrophobicContact CB-CE2 3.88Å; H142-F145 PolarHBondContact O-N 2.88Å; P143-F145 PolarHBondContact O-N 3.24Å; F145-Q149 HydrophobicContact CB-CB 4.03Å; F145-Q149 HydrophobicContact CD1-CB 4.15Å; F145-K150 HydrophobicContact CB-CG 3.83Å; F145-K150 VanDerWaalsContact O-CE 3.26Å; F145-K150 WeakPolarHBondContact O-CE 3.5Å; F145-L153 HydrophobicContact CD1-CD1 4Å; F145-L153 HydrophobicContact CE1-CD1 4.19Å; F145-L153 HydrophobicContact CG-CD1 4.28Å |
| 146 | N | 97.1 | Very high | 96.1 | Very high | 75 Ų | 75 | 51.8 Ų | 51.8 | 40% | 0.401 | 25% | 0.248 | S | C | . | . | trans | -73.4 | 167.7 | 173.9 | 71.1 | 53.4 | 0 | 0 | 0 | 111.5 | H148 Q149 K150 | N146-H148 VanDerWaalsContact C-N 3.31Å; N146-H148 PolarHBondContact O-N 3.45Å; N146-H148 WeakPolarHBondContact OD1-CB 3.39Å; N146-H148 PolarHBondContact OD1-N 2.9Å; N146-Q149 VanDerWaalsContact ND2-CD 3.31Å; N146-Q149 PolarHBondContact ND2-OE1 3.18Å; N146-Q149 VanDerWaalsContact ND2-OE1 3.17Å; N146-Q149 PolarHBondContact O-N 2.9Å; N146-Q149 VanDerWaalsContact O-N 3.17Å; N146-Q149 WeakPolarHBondContact OD1-CG 3.48Å; N146-Q149 PolarHBondContact OD1-N 3.23Å; N146-K150 WeakPolarHBondContact O-CG 3.4Å; N146-K150 PolarHBondContact O-N 3.03Å | ||
| 147 | F | 96.6 | Very high | 96 | Very high | 166 Ų | 166 | 52 Ų | 52 | 73% | 0.728 | 25% | 0.249 | S | C | * | . | H | α-helix | trans | -52.9 | -45.7 | -177.7 | 179 | -95 | 0 | 0 | 0 | 113.4 | K150 Q151 | F147-K150 PolarHBondContact O-N 3.41Å; F147-Q151 PolarHBondContact O-N 3.08Å |
| 148 | H | 96.6 | Very high | 95.6 | Very high | 113 Ų | 113 | 52.9 Ų | 52.9 | 52% | 0.523 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -64.2 | -45.7 | -179.8 | 177 | 65.5 | 0 | 0 | 0 | 111.6 | N146 K150 Q151 V152 | N146-H148 VanDerWaalsContact C-N 3.31Å; N146-H148 PolarHBondContact O-N 3.45Å; N146-H148 WeakPolarHBondContact OD1-CB 3.39Å; N146-H148 PolarHBondContact OD1-N 2.9Å; H148-K150 VanDerWaalsContact C-N 3.34Å; H148-K150 PolarHBondContact O-N 3.3Å; H148-Q151 PolarHBondContact O-N 2.96Å; H148-V152 WeakPolarHBondContact O-CG2 3.42Å; H148-V152 PolarHBondContact O-N 3.3Å |
| 149 | Q | 97 | Very high | 95 | Very high | 24 Ų | 24 | 54.8 Ų | 54.8 | 11% | 0.112 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -58.8 | -46.2 | 176.7 | -70.3 | 173.5 | -41.7 | 0 | 0 | 111.4 | Y106 F145 N146 Q151 V152 L153 | Y106-Q149 HydrophobicContact CD1-CG 4.05Å; Y106-Q149 HydrophobicContact CD2-CB 3.61Å; Y106-Q149 HydrophobicContact CD2-CG 3.63Å; Y106-Q149 HydrophobicContact CE1-CG 4.11Å; Y106-Q149 VanDerWaalsContact CE2-CA 3.5Å; Y106-Q149 HydrophobicContact CE2-CB 3.63Å; Y106-Q149 HydrophobicContact CE2-CG 3.69Å; Y106-Q149 HydrophobicContact CG-CB 4.26Å; Y106-Q149 HydrophobicContact CG-CG 3.81Å; F145-Q149 HydrophobicContact CB-CB 4.03Å; F145-Q149 HydrophobicContact CD1-CB 4.15Å; N146-Q149 VanDerWaalsContact ND2-CD 3.31Å; N146-Q149 PolarHBondContact ND2-OE1 3.18Å; N146-Q149 VanDerWaalsContact ND2-OE1 3.17Å; N146-Q149 PolarHBondContact O-N 2.9Å; N146-Q149 VanDerWaalsContact O-N 3.17Å; N146-Q149 WeakPolarHBondContact OD1-CG 3.48Å; N146-Q149 PolarHBondContact OD1-N 3.23Å; Q149-Q151 VanDerWaalsContact C-N 3.31Å; Q149-Q151 PolarHBondContact O-N 2.89Å; Q149-V152 PolarHBondContact O-N 3.39Å; Q149-L153 WeakPolarHBondContact O-CD1 3.27Å; Q149-L153 VanDerWaalsContact O-CG 3.24Å; Q149-L153 WeakPolarHBondContact O-CG 3.5Å; Q149-L153 PolarHBondContact O-N 3.3Å |
| 150 | K | 97.3 | Very high | 94.5 | Very high | 59 Ų | 59 | 54.9 Ų | 54.9 | 26% | 0.257 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -58.4 | -42.8 | 176.3 | -70.7 | -177.7 | 170.5 | -166.8 | 0 | 112.2 | S140 N141 H142 F145 N146 F147 H148 L153 R154 | S140-K150 WeakPolarHBondContact O-CB 3.45Å; S140-K150 VanDerWaalsContact O-CG 3.32Å; S140-K150 WeakPolarHBondContact O-CG 3.47Å; N141-K150 PolarHBondContact O-NZ 2.8Å; N141-K150 VanDerWaalsContact O-NZ 3.16Å; H142-K150 WeakPolarHBondContact O-CE 3.29Å; H142-K150 PolarHBondContact O-NZ 3.35Å; F145-K150 HydrophobicContact CB-CG 3.83Å; F145-K150 VanDerWaalsContact O-CE 3.26Å; F145-K150 WeakPolarHBondContact O-CE 3.5Å; N146-K150 WeakPolarHBondContact O-CG 3.4Å; N146-K150 PolarHBondContact O-N 3.03Å; F147-K150 PolarHBondContact O-N 3.41Å; H148-K150 VanDerWaalsContact C-N 3.34Å; H148-K150 PolarHBondContact O-N 3.3Å; K150-L153 PolarHBondContact O-N 2.87Å; K150-R154 VanDerWaalsContact O-CB 3.29Å; K150-R154 WeakPolarHBondContact O-CB 3.33Å; K150-R154 PolarHBondContact O-N 3.43Å |
| 151 | Q | 96 | Very high | 94 | Very high | 114 Ų | 114 | 58.1 Ų | 58.1 | 53% | 0.533 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -63.5 | -43 | 179.2 | -171.4 | -179.8 | 2.4 | 0 | 0 | 112.1 | F147 H148 Q149 R154 H155 | F147-Q151 PolarHBondContact O-N 3.08Å; H148-Q151 PolarHBondContact O-N 2.96Å; Q149-Q151 VanDerWaalsContact C-N 3.31Å; Q149-Q151 PolarHBondContact O-N 2.89Å; Q151-R154 PolarHBondContact O-N 3.47Å; Q151-H155 WeakPolarHBondContact O-CB 3.27Å; Q151-H155 PolarHBondContact O-N 3Å |
| 152 | V | 94.7 | Very high | 93.4 | Very high | 42 Ų | 42 | 60.9 Ų | 60.9 | 26% | 0.255 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -64.1 | -46.8 | 176.7 | 173.9 | 0 | 0 | 0 | 0 | 111.1 | Y106 T110 H148 Q149 R154 H155 Q156 | Y106-V152 HydrophobicContact CE2-CB 4.21Å; Y106-V152 HydrophobicContact CE2-CG1 4.34Å; T110-V152 HydrophobicContact CG2-CG1 3.87Å; H148-V152 WeakPolarHBondContact O-CG2 3.42Å; H148-V152 PolarHBondContact O-N 3.3Å; Q149-V152 PolarHBondContact O-N 3.39Å; V152-R154 VanDerWaalsContact C-N 3.31Å; V152-R154 PolarHBondContact O-N 3.02Å; V152-H155 WeakPolarHBondContact O-CB 3.36Å; V152-H155 PolarHBondContact O-N 3.26Å; V152-Q156 PolarHBondContact O-N 2.95Å |
| 153 | L | 94.5 | Very high | 92.6 | Very high | 0 Ų | 0 | 63.5 Ų | 63.5 | 0% | 0 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -62.9 | -38.2 | 178.1 | -66.2 | 164.1 | 0 | 0 | 0 | 111.8 | Y106 L109 T110 F136 A139 F145 Q149 K150 Q156 L157 | Y106-L153 HydrophobicContact CD2-CD1 4.11Å; Y106-L153 HydrophobicContact CD2-CD2 4.32Å; Y106-L153 HydrophobicContact CD2-CG 4.12Å; Y106-L153 HydrophobicContact CE2-CG 4.22Å; L109-L153 HydrophobicContact CB-CD2 3.8Å; L109-L153 HydrophobicContact CD1-CD2 3.93Å; T110-L153 HydrophobicContact CG2-CD2 4.06Å; F136-L153 HydrophobicContact CD1-CD2 4.15Å; F136-L153 HydrophobicContact CE1-CD2 4.04Å; A139-L153 HydrophobicContact CB-CD1 3.77Å; A139-L153 HydrophobicContact CB-CD2 4.32Å; F145-L153 HydrophobicContact CD1-CD1 4Å; F145-L153 HydrophobicContact CE1-CD1 4.19Å; F145-L153 HydrophobicContact CG-CD1 4.28Å; Q149-L153 WeakPolarHBondContact O-CD1 3.27Å; Q149-L153 VanDerWaalsContact O-CG 3.24Å; Q149-L153 WeakPolarHBondContact O-CG 3.5Å; Q149-L153 PolarHBondContact O-N 3.3Å; K150-L153 PolarHBondContact O-N 2.87Å; L153-Q156 PolarHBondContact O-N 3Å; L153-L157 PolarHBondContact O-N 3.33Å |
| 154 | R | 94.6 | Very high | 91.5 | Very high | 134 Ų | 134 | 62.4 Ų | 62.4 | 51% | 0.506 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -67.3 | -37.7 | 175.8 | -169.9 | 170.6 | -176.6 | 94.4 | 10.3 | 111.9 | E27 K150 Q151 V152 L157 G158 | E27-R154 IonicContact OE1-NH1 3.96Å; E27-R154 IonicContact OE1-NH2 3.61Å; K150-R154 VanDerWaalsContact O-CB 3.29Å; K150-R154 WeakPolarHBondContact O-CB 3.33Å; K150-R154 PolarHBondContact O-N 3.43Å; Q151-R154 PolarHBondContact O-N 3.47Å; V152-R154 VanDerWaalsContact C-N 3.31Å; V152-R154 PolarHBondContact O-N 3.02Å; R154-L157 WeakPolarHBondContact O-CB 3.38Å; R154-L157 PolarHBondContact O-N 3.02Å; R154-G158 PolarHBondContact O-N 3.05Å; R154-G158 VanDerWaalsContact O-N 3.14Å |
| 155 | H | 91.8 | Very high | 90 | Very high | 119 Ų | 119 | 72.3 Ų | 72.3 | 55% | 0.551 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -62 | -48.3 | 172.2 | 176.7 | -98.1 | 0 | 0 | 0 | 110.5 | Q151 V152 L157 G158 H159 | Q151-H155 WeakPolarHBondContact O-CB 3.27Å; Q151-H155 PolarHBondContact O-N 3Å; V152-H155 WeakPolarHBondContact O-CB 3.36Å; V152-H155 PolarHBondContact O-N 3.26Å; H155-L157 VanDerWaalsContact C-N 3.31Å; H155-L157 PolarHBondContact O-N 3.12Å; H155-G158 PolarHBondContact O-N 3.35Å; H155-G158 VanDerWaalsContact O-N 3.07Å; H155-H159 AromaticContact CD2-NE2 3.84Å; H155-H159 AromaticContact CE1-CD2 3.3Å; H155-H159 PolarHBondContact CE1-CD2 3.06Å; H155-H159 AromaticContact CE1-NE2 2.89Å; H155-H159 PolarHBondContact CE1-NE2 3.42Å; H155-H159 AromaticContact ND1-CD2 3.51Å; H155-H159 AromaticContact ND1-NE2 3.61Å; H155-H159 AromaticContact NE2-CD2 3.65Å; H155-H159 AromaticContact NE2-NE2 3.02Å; H155-H159 PolarHBondContact NE2-NE2 3.42Å; H155-H159 PolarHBondContact O-CD2 3.37Å; H155-H159 VanDerWaalsContact O-CD2 3.26Å; H155-H159 PolarHBondContact O-N 3.29Å; H155-H159 VanDerWaalsContact O-N 3.1Å |
| 156 | Q | 89.5 | Confident | 89.6 | Confident | 36 Ų | 36 | 75.7 Ų | 75.7 | 17% | 0.168 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -59.3 | -38.7 | 175.9 | -70 | 178.2 | -56.1 | 0 | 0 | 113.1 | L109 F136 V152 L153 G158 H159 I160 | L109-Q156 PolarHBondContact O-NE2 3.28Å; F136-Q156 HydrophobicContact CD1-CB 4.01Å; F136-Q156 HydrophobicContact CE1-CB 3.8Å; F136-Q156 HydrophobicContact CE1-CG 4.47Å; F136-Q156 VanDerWaalsContact CE1-OE1 3.28Å; V152-Q156 PolarHBondContact O-N 2.95Å; L153-Q156 PolarHBondContact O-N 3Å; Q156-G158 VanDerWaalsContact C-N 3.31Å; Q156-G158 PolarHBondContact O-N 3.07Å; Q156-H159 PolarHBondContact O-N 3.19Å; Q156-I160 WeakPolarHBondContact O-CG1 3.21Å; Q156-I160 PolarHBondContact O-N 2.89Å |
| 157 | L | 91.2 | Very high | 89.2 | Confident | 4 Ų | 4 | 75.7 Ų | 75.7 | 2% | 0.021 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -57.4 | -44.5 | 173.3 | -179.8 | 58.8 | 0 | 0 | 0 | 111.7 | L133 F136 L153 R154 H155 I160 Q161 | L133-L157 HydrophobicContact CD2-CD1 3.88Å; F136-L157 HydrophobicContact CB-CB 4.01Å; F136-L157 HydrophobicContact CB-CD1 3.86Å; F136-L157 HydrophobicContact CB-CG 4.42Å; L153-L157 PolarHBondContact O-N 3.33Å; R154-L157 WeakPolarHBondContact O-CB 3.38Å; R154-L157 PolarHBondContact O-N 3.02Å; H155-L157 VanDerWaalsContact C-N 3.31Å; H155-L157 PolarHBondContact O-N 3.12Å; L157-I160 PolarHBondContact O-N 3.11Å; L157-Q161 HydrophobicContact CD1-CG 4.46Å; L157-Q161 WeakPolarHBondContact O-CG 3.35Å; L157-Q161 PolarHBondContact O-N 3.37Å |
| 158 | G | 89.8 | Confident | 88.8 | Confident | 21 Ų | 21 | 70.7 Ų | 70.7 | 22% | 0.216 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -60.3 | -45.3 | 176 | 0 | 0 | 0 | 0 | 0 | 112.5 | R154 H155 Q156 I160 Q161 D162 | R154-G158 PolarHBondContact O-N 3.05Å; R154-G158 VanDerWaalsContact O-N 3.14Å; H155-G158 PolarHBondContact O-N 3.35Å; H155-G158 VanDerWaalsContact O-N 3.07Å; Q156-G158 VanDerWaalsContact C-N 3.31Å; Q156-G158 PolarHBondContact O-N 3.07Å; G158-I160 VanDerWaalsContact C-N 3.32Å; G158-I160 PolarHBondContact O-N 2.82Å; G158-Q161 WeakPolarHBondContact O-CB 3.43Å; G158-Q161 PolarHBondContact O-N 3.49Å; G158-Q161 VanDerWaalsContact O-N 3.15Å; G158-D162 VanDerWaalsContact O-CG 3.26Å; G158-D162 PolarHBondContact O-N 3.1Å |
| 159 | H | 86.1 | Confident | 88.3 | Confident | 83 Ų | 83 | 68.2 Ų | 68.2 | 38% | 0.384 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -59.2 | -41.4 | 174.9 | -79.9 | -88.1 | 0 | 0 | 0 | 112.7 | H155 Q156 D162 I163 | H155-H159 AromaticContact CD2-NE2 3.84Å; H155-H159 AromaticContact CE1-CD2 3.3Å; H155-H159 PolarHBondContact CE1-CD2 3.06Å; H155-H159 AromaticContact CE1-NE2 2.89Å; H155-H159 PolarHBondContact CE1-NE2 3.42Å; H155-H159 AromaticContact ND1-CD2 3.51Å; H155-H159 AromaticContact ND1-NE2 3.61Å; H155-H159 AromaticContact NE2-CD2 3.65Å; H155-H159 AromaticContact NE2-NE2 3.02Å; H155-H159 PolarHBondContact NE2-NE2 3.42Å; H155-H159 PolarHBondContact O-CD2 3.37Å; H155-H159 VanDerWaalsContact O-CD2 3.26Å; H155-H159 PolarHBondContact O-N 3.29Å; H155-H159 VanDerWaalsContact O-N 3.1Å; Q156-H159 PolarHBondContact O-N 3.19Å; H159-D162 PolarHBondContact O-N 3.43Å; H159-I163 WeakPolarHBondContact O-CD1 3.48Å; H159-I163 VanDerWaalsContact O-CG1 3.3Å; H159-I163 WeakPolarHBondContact O-CG1 3.33Å; H159-I163 PolarHBondContact O-N 3.1Å; H159-I163 VanDerWaalsContact O-N 3.13Å |
| 160 | I | 85.1 | Confident | 87.8 | Confident | 3 Ų | 3 | 71 Ų | 71 | 2% | 0.015 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -64.5 | -42.9 | 176.5 | -67 | 165.8 | 0 | 0 | 0 | 110.3 | Y119 L123 L133 F136 Q156 L157 G158 D162 I163 L164 | Y119-I160 HydrophobicContact CD2-CG1 4.36Å; Y119-I160 HydrophobicContact CE2-CD1 4.42Å; L123-I160 HydrophobicContact CD1-CG2 4.43Å; L133-I160 HydrophobicContact CD2-CG2 3.95Å; L133-I160 HydrophobicContact CG-CG2 4.48Å; F136-I160 HydrophobicContact CD2-CD1 3.34Å; F136-I160 HydrophobicContact CE2-CD1 3.47Å; F136-I160 VanDerWaalsContact CE2-CD1 3.47Å; F136-I160 HydrophobicContact CG-CD1 4Å; F136-I160 HydrophobicContact CZ-CD1 4.22Å; Q156-I160 WeakPolarHBondContact O-CG1 3.21Å; Q156-I160 PolarHBondContact O-N 2.89Å; L157-I160 PolarHBondContact O-N 3.11Å; G158-I160 VanDerWaalsContact C-N 3.32Å; G158-I160 PolarHBondContact O-N 2.82Å; I160-D162 VanDerWaalsContact C-N 3.33Å; I160-D162 PolarHBondContact O-N 3.08Å; I160-I163 PolarHBondContact O-N 2.9Å; I160-L164 HydrophobicContact CG2-CD1 3.96Å; I160-L164 VanDerWaalsContact O-CG 3.26Å; I160-L164 WeakPolarHBondContact O-CG 3.45Å; I160-L164 PolarHBondContact O-N 2.8Å |
| 161 | Q | 87.1 | Confident | 87.2 | Confident | 75 Ų | 75 | 71.8 Ų | 71.8 | 35% | 0.35 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -62.7 | -39.9 | 177.1 | -72.3 | 172 | -29.3 | 0 | 0 | 112.1 | L133 L157 G158 I163 L164 Q165 | L133-Q161 HydrophobicContact CD2-CG 3.65Å; L157-Q161 HydrophobicContact CD1-CG 4.46Å; L157-Q161 WeakPolarHBondContact O-CG 3.35Å; L157-Q161 PolarHBondContact O-N 3.37Å; G158-Q161 WeakPolarHBondContact O-CB 3.43Å; G158-Q161 PolarHBondContact O-N 3.49Å; G158-Q161 VanDerWaalsContact O-N 3.15Å; Q161-I163 VanDerWaalsContact C-N 3.34Å; Q161-I163 PolarHBondContact O-N 2.66Å; Q161-L164 PolarHBondContact O-N 3.48Å; Q161-Q165 WeakPolarHBondContact O-CG 3.38Å; Q161-Q165 PolarHBondContact O-N 3.25Å |
| 162 | D | 85.1 | Confident | 86.5 | Confident | 104 Ų | 104 | 68.8 Ų | 68.8 | 56% | 0.556 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -66.8 | -33.5 | 178.4 | -68.1 | -18.2 | 0 | 0 | 0 | 112.3 | G158 H159 I160 L164 | G158-D162 VanDerWaalsContact O-CG 3.26Å; G158-D162 PolarHBondContact O-N 3.1Å; H159-D162 PolarHBondContact O-N 3.43Å; I160-D162 VanDerWaalsContact C-N 3.33Å; I160-D162 PolarHBondContact O-N 3.08Å; D162-L164 VanDerWaalsContact C-N 3.29Å |
| 163 | I | 80.6 | Confident | 85.9 | Confident | 77 Ų | 77 | 70.8 Ų | 70.8 | 40% | 0.395 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -69.2 | -28.5 | 175 | -69.1 | 163.5 | 0 | 0 | 0 | 111.9 | L123 H159 I160 Q161 | L123-I163 HydrophobicContact CD1-CG2 4.21Å; H159-I163 WeakPolarHBondContact O-CD1 3.48Å; H159-I163 VanDerWaalsContact O-CG1 3.3Å; H159-I163 WeakPolarHBondContact O-CG1 3.33Å; H159-I163 PolarHBondContact O-N 3.1Å; H159-I163 VanDerWaalsContact O-N 3.13Å; I160-I163 PolarHBondContact O-N 2.9Å; Q161-I163 VanDerWaalsContact C-N 3.34Å; Q161-I163 PolarHBondContact O-N 2.66Å |
| 164 | L | 74.8 | Confident | 85.2 | Confident | 52 Ų | 52 | 76.8 Ų | 76.8 | 27% | 0.272 | 37% | 0.369 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.2 | -3.6 | -175.3 | -67.8 | 176.1 | 0 | 0 | 0 | 114.1 | L123 E129 L133 I160 Q161 D162 | L123-L164 HydrophobicContact CB-CD2 4.15Å; L123-L164 HydrophobicContact CD1-CD2 3.92Å; L123-L164 HydrophobicContact CD1-CG 4.3Å; L123-L164 HydrophobicContact CD2-CD2 4.36Å; L123-L164 HydrophobicContact CG-CD2 4.36Å; E129-L164 HydrophobicContact CB-CD1 4.07Å; E129-L164 HydrophobicContact CB-CD2 4.12Å; E129-L164 HydrophobicContact CG-CD2 3.67Å; E129-L164 WeakPolarHBondContact OE1-CD2 3.39Å; L133-L164 HydrophobicContact CD1-CD1 3.9Å; L133-L164 HydrophobicContact CD2-CD1 4.16Å; L133-L164 HydrophobicContact CG-CD1 4.05Å; I160-L164 HydrophobicContact CG2-CD1 3.96Å; I160-L164 VanDerWaalsContact O-CG 3.26Å; I160-L164 WeakPolarHBondContact O-CG 3.45Å; I160-L164 PolarHBondContact O-N 2.8Å; Q161-L164 PolarHBondContact O-N 3.48Å; D162-L164 VanDerWaalsContact C-N 3.29Å |
| 165 | Q | 66.8 | Low | 84.4 | Confident | 213 Ų | 213 | 71.5 Ų | 71.5 | 100% | 0.995 | 36% | 0.357 | S | S | * | . | trans | -88.4 | 0 | 176.4 | -75.2 | -179.1 | 7.7 | 0 | 0 | 112.1 | Q161 | Q161-Q165 WeakPolarHBondContact O-CG 3.38Å; Q161-Q165 PolarHBondContact O-N 3.25Å |
Retrieved 165 of 165 residues in 194 ms
(Link to these results)