| 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 | 40.2 | Very low | 48.9 | Very low | 225 Ų | 225 | 154.3 Ų | 154.3 | 100% | 1.108 | 79% | 0.79 | S | S | * | * | 0 | 92.7 | 0 | -177.9 | 169.6 | 53.2 | 0 | 0 | 107.3 | V3 | M1-V3 PolarHBondContact O-N 3.23Š| |||
| 2 | V | 39.8 | Very low | 49.5 | Very low | 136 Ų | 136 | 148.2 Ų | 148.2 | 82% | 0.824 | 77% | 0.768 | S | S | * | * | trans | -85.9 | 108.1 | 175.9 | -179.8 | 0 | 0 | 0 | 0 | 105.6 | E4 | V2-E4 VanDerWaalsContact C-N 3.29Å; V2-E4 PolarHBondContact O-N 2.95Å | ||
| 3 | V | 45.4 | Very low | 50.2 | Low | 98 Ų | 98 | 143.8 Ų | 143.8 | 59% | 0.594 | 75% | 0.752 | S | S | * | * | trans | -72.7 | 94 | 171.9 | -179.4 | 0 | 0 | 0 | 0 | 105.6 | M1 F5 | M1-V3 PolarHBondContact O-N 3.23Å; V3-F5 VanDerWaalsContact C-N 3.27Å; V3-F5 WeakPolarHBondContact O-CD2 3.37Å; V3-F5 PolarHBondContact O-N 3.07Å | ||
| 4 | E | 44.9 | Very low | 51.7 | Low | 166 Ų | 166 | 139.8 Ų | 139.8 | 78% | 0.776 | 74% | 0.738 | S | S | * | * | trans | -62 | 99.3 | 165.1 | -78 | -175.9 | 161.7 | 0 | 0 | 106.5 | V2 N6 | V2-E4 VanDerWaalsContact C-N 3.29Å; V2-E4 PolarHBondContact O-N 2.95Å; E4-N6 PolarHBondContact O-N 3.17Å | ||
| 5 | F | 51 | Low | 52.9 | Low | 166 Ų | 166 | 138.5 Ų | 138.5 | 73% | 0.728 | 73% | 0.731 | S | S | * | * | trans | -56 | 110.4 | 166.5 | -78.4 | -91.2 | 0 | 0 | 0 | 105.8 | V3 K7 | V3-F5 VanDerWaalsContact C-N 3.27Å; V3-F5 WeakPolarHBondContact O-CD2 3.37Å; V3-F5 PolarHBondContact O-N 3.07Å; F5-K7 HydrophobicContact CB-CG 4.12Å; F5-K7 PolarHBondContact O-N 3.26Å | ||
| 6 | N | 50.3 | Low | 54.4 | Low | 158 Ų | 158 | 135.9 Ų | 135.9 | 85% | 0.845 | 73% | 0.728 | S | S | * | * | trans | -56.9 | 73.4 | 164.9 | -88.1 | -45.2 | 0 | 0 | 0 | 108.5 | E4 K8 | E4-N6 PolarHBondContact O-N 3.17Å; N6-K8 PolarHBondContact O-N 3.47Å | ||
| 7 | K | 52.8 | Low | 55.6 | Low | 182 Ų | 182 | 130.6 Ų | 130.6 | 79% | 0.791 | 71% | 0.707 | S | S | * | * | trans | -75.8 | 80.7 | 171.5 | -72.7 | -174.5 | -179.5 | -179.6 | 0 | 105.1 | F5 | F5-K7 HydrophobicContact CB-CG 4.12Å; F5-K7 PolarHBondContact O-N 3.26Å | ||
| 8 | K | 53.9 | Low | 56.8 | Low | 178 Ų | 178 | 126.7 Ų | 126.7 | 77% | 0.774 | 69% | 0.688 | S | S | * | * | trans | -50.3 | 136.2 | 161.9 | -70.4 | -176.4 | 178.8 | -178.6 | 0 | 106.9 | N6 I10 | N6-K8 PolarHBondContact O-N 3.47Å; K8-I10 PolarHBondContact O-N 3.28Å; K8-I10 VanDerWaalsContact O-N 3.11Å | ||
| 9 | P | 48.8 | Very low | 58.1 | Low | 115 Ų | 115 | 126.3 Ų | 126.3 | 75% | 0.747 | 68% | 0.681 | S | S | * | * | trans | -55.7 | 123.3 | -179.9 | 22.4 | -31.7 | 0 | 0 | 0 | 108 | V11 | P9-V11 VanDerWaalsContact C-N 3.31Å; P9-V11 PolarHBondContact O-N 3.12Å | ||
| 10 | I | 57.1 | Low | 59.2 | Low | 164 Ų | 164 | 122.7 Ų | 122.7 | 84% | 0.841 | 67% | 0.669 | S | S | * | * | trans | -67.4 | 100.9 | 171 | -63.8 | 166.1 | 0 | 0 | 0 | 104.2 | K8 P12 | K8-I10 PolarHBondContact O-N 3.28Å; K8-I10 VanDerWaalsContact O-N 3.11Å; I10-P12 WeakPolarHBondContact O-CD 3.33Å | ||
| 11 | V | 53.5 | Low | 60.4 | Low | 109 Ų | 109 | 121.6 Ų | 121.6 | 66% | 0.661 | 66% | 0.662 | S | S | * | * | trans | -61.3 | 120.4 | 176.1 | 179.6 | 0 | 0 | 0 | 0 | 106.6 | P9 V13 | P9-V11 VanDerWaalsContact C-N 3.31Å; P9-V11 PolarHBondContact O-N 3.12Å; V11-V13 PolarHBondContact O-N 3.04Å | ||
| 12 | P | 56.3 | Low | 62.6 | Low | 81 Ų | 81 | 115.1 Ų | 115.1 | 53% | 0.526 | 63% | 0.632 | S | S | . | * | trans | -63.4 | 113.6 | 177.1 | 23.2 | -28.9 | 0 | 0 | 0 | 107.9 | I10 E59 | I10-P12 WeakPolarHBondContact O-CD 3.33Å; P12-E59 WeakPolarHBondContact CG-OE1 3.22Å | ||
| 13 | V | 59.1 | Low | 64.6 | Low | 92 Ų | 92 | 114 Ų | 114 | 56% | 0.558 | 62% | 0.617 | S | S | * | * | trans | -81.8 | 120.6 | 172 | -178.4 | 0 | 0 | 0 | 0 | 106.3 | V11 L15 A17 V18 | V11-V13 PolarHBondContact O-N 3.04Å; V13-L15 PolarHBondContact O-N 3.37Å; V13-A17 HydrophobicContact CG1-CB 3.74Å; V13-V18 HydrophobicContact CB-CG2 4.16Å; V13-V18 HydrophobicContact CG1-CG2 3.72Å | ||
| 14 | P | 70.9 | Confident | 66.4 | Low | 87 Ų | 87 | 114 Ų | 114 | 57% | 0.565 | 61% | 0.613 | S | S | * | * | trans | -57.5 | 139.5 | 178.4 | 20.4 | -29.5 | 0 | 0 | 0 | 109.5 | S16 A17 V18 | P14-S16 PolarHBondContact O-N 3.23Å; P14-A17 HydrophobicContact CG-CB 3.93Å; P14-A17 WeakPolarHBondContact O-CA 3.34Å; P14-A17 WeakPolarHBondContact O-CB 3.25Å; P14-A17 PolarHBondContact O-N 3.39Å; P14-V18 PolarHBondContact O-N 3.2Å | ||
| 15 | L | 69 | Low | 68.3 | Low | 121 Ų | 121 | 110.5 Ų | 110.5 | 63% | 0.634 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -51.8 | -31.9 | 179.4 | -78.6 | 158.1 | 0 | 0 | 0 | 112 | V13 A17 V18 Q19 F52 | V13-L15 PolarHBondContact O-N 3.37Å; L15-A17 PolarHBondContact O-N 3.34Å; L15-V18 PolarHBondContact O-N 3.39Å; L15-Q19 WeakPolarHBondContact O-CB 2.94Å; L15-Q19 PolarHBondContact O-N 3.12Å; L15-F52 HydrophobicContact CD2-CE2 4.46Å; L15-F52 HydrophobicContact CD2-CZ 4.21Å |
| 16 | S | 77.3 | Confident | 69.6 | Low | 97 Ų | 97 | 107.7 Ų | 107.7 | 68% | 0.678 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -62.7 | -37.3 | 174 | -176.5 | 0 | 0 | 0 | 0 | 113.4 | P14 A20 | P14-S16 PolarHBondContact O-N 3.23Å; S16-A20 VanDerWaalsContact O-CB 3.29Å; S16-A20 WeakPolarHBondContact O-CB 3.47Å; S16-A20 PolarHBondContact O-N 3.35Å |
| 17 | A | 74.3 | Confident | 71 | Confident | 45 Ų | 45 | 106.7 Ų | 106.7 | 37% | 0.372 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -74 | -36.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | V13 P14 L15 A20 L21 | V13-A17 HydrophobicContact CG1-CB 3.74Å; P14-A17 HydrophobicContact CG-CB 3.93Å; P14-A17 WeakPolarHBondContact O-CA 3.34Å; P14-A17 WeakPolarHBondContact O-CB 3.25Å; P14-A17 PolarHBondContact O-N 3.39Å; L15-A17 PolarHBondContact O-N 3.34Å; A17-A20 PolarHBondContact O-N 3.45Å; A17-L21 WeakPolarHBondContact O-CB 3.37Å; A17-L21 PolarHBondContact O-N 3.05Å |
| 18 | V | 77.6 | Confident | 72.2 | Confident | 60 Ų | 60 | 101.3 Ų | 101.3 | 36% | 0.364 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -62.2 | -45.2 | 171.8 | -178.5 | 0 | 0 | 0 | 0 | 110.5 | V13 P14 L15 L21 I22 | V13-V18 HydrophobicContact CB-CG2 4.16Å; V13-V18 HydrophobicContact CG1-CG2 3.72Å; P14-V18 PolarHBondContact O-N 3.2Å; L15-V18 PolarHBondContact O-N 3.39Å; V18-L21 WeakPolarHBondContact O-CB 3.49Å; V18-L21 PolarHBondContact O-N 3.25Å; V18-I22 HydrophobicContact CG1-CD1 3.96Å; V18-I22 VanDerWaalsContact O-CG1 3.29Å; V18-I22 WeakPolarHBondContact O-CG1 3.46Å; V18-I22 PolarHBondContact O-N 2.9Å |
| 19 | Q | 82.5 | Confident | 73.2 | Confident | 119 Ų | 119 | 96.2 Ų | 96.2 | 56% | 0.556 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -65.9 | -42.6 | 178 | -174.5 | 155.3 | -27.7 | 0 | 0 | 112.1 | L15 L21 I22 E23 | L15-Q19 WeakPolarHBondContact O-CB 2.94Å; L15-Q19 PolarHBondContact O-N 3.12Å; Q19-L21 VanDerWaalsContact C-N 3.3Å; Q19-L21 PolarHBondContact O-N 3.46Å; Q19-I22 PolarHBondContact O-N 3.44Å; Q19-E23 PolarHBondContact NE2-OE1 2.74Å; Q19-E23 WeakPolarHBondContact O-CG 3.44Å; Q19-E23 PolarHBondContact O-N 3.44Å |
| 20 | A | 79.2 | Confident | 74.1 | Confident | 54 Ų | 54 | 98.3 Ų | 98.3 | 45% | 0.446 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -60.6 | -38.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | S16 A17 E23 L24 | S16-A20 VanDerWaalsContact O-CB 3.29Å; S16-A20 WeakPolarHBondContact O-CB 3.47Å; S16-A20 PolarHBondContact O-N 3.35Å; A17-A20 PolarHBondContact O-N 3.45Å; A20-E23 PolarHBondContact O-N 3.45Å; A20-L24 VanDerWaalsContact O-CB 3.29Å; A20-L24 WeakPolarHBondContact O-CB 3.48Å; A20-L24 PolarHBondContact O-N 3.17Å |
| 21 | L | 85 | Confident | 74.3 | Confident | 100 Ų | 100 | 95.1 Ų | 95.1 | 52% | 0.524 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -65.9 | -42 | 175 | -178.6 | 66.2 | 0 | 0 | 0 | 111.6 | A17 V18 Q19 L24 I25 | A17-L21 WeakPolarHBondContact O-CB 3.37Å; A17-L21 PolarHBondContact O-N 3.05Å; V18-L21 WeakPolarHBondContact O-CB 3.49Å; V18-L21 PolarHBondContact O-N 3.25Å; Q19-L21 VanDerWaalsContact C-N 3.3Å; Q19-L21 PolarHBondContact O-N 3.46Å; L21-L24 PolarHBondContact O-N 3.2Å; L21-I25 HydrophobicContact CD1-CD1 4.32Å; L21-I25 HydrophobicContact CG-CD1 4.02Å; L21-I25 VanDerWaalsContact O-CG1 3.26Å; L21-I25 WeakPolarHBondContact O-CG1 3.35Å; L21-I25 PolarHBondContact O-N 3.49Å |
| 22 | I | 85 | Confident | 74.2 | Confident | 90 Ų | 90 | 92.3 Ų | 92.3 | 46% | 0.462 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.6 | -46.7 | 175.7 | -69.8 | 165.4 | 0 | 0 | 0 | 110.4 | V18 Q19 L24 I25 L26 | V18-I22 HydrophobicContact CG1-CD1 3.96Å; V18-I22 VanDerWaalsContact O-CG1 3.29Å; V18-I22 WeakPolarHBondContact O-CG1 3.46Å; V18-I22 PolarHBondContact O-N 2.9Å; Q19-I22 PolarHBondContact O-N 3.44Å; I22-L24 VanDerWaalsContact C-N 3.32Å; I22-L24 PolarHBondContact O-N 2.76Å; I22-I25 PolarHBondContact O-N 2.84Å; I22-L26 HydrophobicContact CG2-CD1 3.9Å; I22-L26 HydrophobicContact CG2-CG 4.43Å; I22-L26 WeakPolarHBondContact O-CB 3.43Å; I22-L26 WeakPolarHBondContact O-CG 3.5Å; I22-L26 PolarHBondContact O-N 3.36Å |
| 23 | E | 82.1 | Confident | 74 | Confident | 112 Ų | 112 | 96.5 Ų | 96.5 | 52% | 0.523 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.3 | -40.6 | 176.8 | -74.3 | 175.9 | -165.1 | 0 | 0 | 111.5 | Q19 A20 L26 Y27 | Q19-E23 PolarHBondContact NE2-OE1 2.74Å; Q19-E23 WeakPolarHBondContact O-CG 3.44Å; Q19-E23 PolarHBondContact O-N 3.44Å; A20-E23 PolarHBondContact O-N 3.45Å; E23-L26 PolarHBondContact O-N 2.88Å; E23-Y27 VanDerWaalsContact O-CB 3.28Å; E23-Y27 WeakPolarHBondContact O-CB 3.38Å; E23-Y27 PolarHBondContact O-N 3.14Å |
| 24 | L | 84.6 | Confident | 73.5 | Confident | 98 Ų | 98 | 97.9 Ų | 97.9 | 51% | 0.513 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -63.8 | -44.9 | 174.9 | -177.1 | 64.7 | 0 | 0 | 0 | 111.9 | A20 L21 I22 L26 Y27 C28 | A20-L24 VanDerWaalsContact O-CB 3.29Å; A20-L24 WeakPolarHBondContact O-CB 3.48Å; A20-L24 PolarHBondContact O-N 3.17Å; L21-L24 PolarHBondContact O-N 3.2Å; I22-L24 VanDerWaalsContact C-N 3.32Å; I22-L24 PolarHBondContact O-N 2.76Å; L24-L26 VanDerWaalsContact C-N 3.34Å; L24-L26 PolarHBondContact O-N 2.91Å; L24-Y27 PolarHBondContact O-N 3.46Å; L24-C28 WeakPolarHBondContact O-CB 3.24Å; L24-C28 PolarHBondContact O-N 3.46Å; L24-C28 PolarHBondContact O-SG 3.4Å |
| 25 | I | 83.5 | Confident | 72.1 | Confident | 93 Ų | 93 | 100.8 Ų | 100.8 | 48% | 0.477 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.3 | -42 | 176.5 | -69.3 | 166.2 | 0 | 0 | 0 | 110.5 | L21 I22 Y27 C28 T29 | L21-I25 HydrophobicContact CD1-CD1 4.32Å; L21-I25 HydrophobicContact CG-CD1 4.02Å; L21-I25 VanDerWaalsContact O-CG1 3.26Å; L21-I25 WeakPolarHBondContact O-CG1 3.35Å; L21-I25 PolarHBondContact O-N 3.49Å; I22-I25 PolarHBondContact O-N 2.84Å; I25-Y27 VanDerWaalsContact C-N 3.34Å; I25-C28 PolarHBondContact O-N 3.43Å; I25-T29 HydrophobicContact CG2-CG2 4.42Å; I25-T29 WeakPolarHBondContact O-CB 3.47Å; I25-T29 WeakPolarHBondContact O-CG2 3.34Å; I25-T29 PolarHBondContact O-N 2.9Å; I25-T29 PolarHBondContact O-OG1 3.01Å |
| 26 | L | 78.7 | Confident | 70.8 | Confident | 106 Ų | 106 | 101.3 Ų | 101.3 | 56% | 0.555 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -63.9 | -40.9 | 175.9 | -75.2 | 170.8 | 0 | 0 | 0 | 111.5 | I22 E23 L24 T29 K30 | I22-L26 HydrophobicContact CG2-CD1 3.9Å; I22-L26 HydrophobicContact CG2-CG 4.43Å; I22-L26 WeakPolarHBondContact O-CB 3.43Å; I22-L26 WeakPolarHBondContact O-CG 3.5Å; I22-L26 PolarHBondContact O-N 3.36Å; E23-L26 PolarHBondContact O-N 2.88Å; L24-L26 VanDerWaalsContact C-N 3.34Å; L24-L26 PolarHBondContact O-N 2.91Å; L26-T29 WeakPolarHBondContact CA-OG1 3.49Å; L26-T29 PolarHBondContact O-N 2.84Å; L26-T29 PolarHBondContact O-OG1 3.15Å; L26-K30 VanDerWaalsContact O-CB 3.26Å; L26-K30 WeakPolarHBondContact O-CB 3.45Å; L26-K30 PolarHBondContact O-N 2.96Å |
| 27 | Y | 80.1 | Confident | 69 | Low | 138 Ų | 138 | 106.1 Ų | 106.1 | 54% | 0.541 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -63.8 | -49.4 | 175.3 | -177 | -100.3 | 0 | 0 | 0 | 111.4 | E23 L24 I25 T29 K30 M31 | E23-Y27 VanDerWaalsContact O-CB 3.28Å; E23-Y27 WeakPolarHBondContact O-CB 3.38Å; E23-Y27 PolarHBondContact O-N 3.14Å; L24-Y27 PolarHBondContact O-N 3.46Å; I25-Y27 VanDerWaalsContact C-N 3.34Å; Y27-T29 VanDerWaalsContact C-N 3.33Å; Y27-T29 PolarHBondContact O-N 2.86Å; Y27-K30 PolarHBondContact O-N 3.24Å; Y27-M31 HydrophobicContact CD1-CG 4.33Å; Y27-M31 HydrophobicContact CE1-CE 4.29Å; Y27-M31 HydrophobicContact CE1-CG 4.01Å; Y27-M31 HydrophobicContact CE2-CE 3.59Å; Y27-M31 HydrophobicContact CE2-CG 4.39Å; Y27-M31 VanDerWaalsContact CZ-CE 3.42Å; Y27-M31 WeakPolarHBondContact O-CG 3.4Å; Y27-M31 PolarHBondContact O-N 2.93Å; Y27-M31 WeakPolarHBondContact OH-CE 3.5Å |
| 28 | C | 77 | Confident | 67.2 | Low | 69 Ų | 69 | 111 Ų | 111 | 47% | 0.466 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -61.7 | -38.2 | 177.4 | -70.2 | 0 | 0 | 0 | 0 | 112.3 | L24 I25 S32 | L24-C28 WeakPolarHBondContact O-CB 3.24Å; L24-C28 PolarHBondContact O-N 3.46Å; L24-C28 PolarHBondContact O-SG 3.4Å; I25-C28 PolarHBondContact O-N 3.43Å; C28-S32 WeakPolarHBondContact O-CB 3.47Å; C28-S32 PolarHBondContact O-N 3.4Å |
| 29 | T | 74.5 | Confident | 65.3 | Low | 70 Ų | 70 | 114.2 Ų | 114.2 | 43% | 0.429 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -73.1 | -34.8 | 176.4 | 50.3 | 0 | 0 | 0 | 0 | 112.4 | I25 L26 Y27 S32 K33 | I25-T29 HydrophobicContact CG2-CG2 4.42Å; I25-T29 WeakPolarHBondContact O-CB 3.47Å; I25-T29 WeakPolarHBondContact O-CG2 3.34Å; I25-T29 PolarHBondContact O-N 2.9Å; I25-T29 PolarHBondContact O-OG1 3.01Å; L26-T29 WeakPolarHBondContact CA-OG1 3.49Å; L26-T29 PolarHBondContact O-N 2.84Å; L26-T29 PolarHBondContact O-OG1 3.15Å; Y27-T29 VanDerWaalsContact C-N 3.33Å; Y27-T29 PolarHBondContact O-N 2.86Å; T29-S32 PolarHBondContact O-N 2.98Å; T29-K33 WeakPolarHBondContact O-CG 3.36Å; T29-K33 PolarHBondContact O-N 3.4Å |
| 30 | K | 69.5 | Low | 63 | Low | 159 Ų | 159 | 117.9 Ų | 117.9 | 69% | 0.691 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -65.1 | -43.2 | 172.6 | -165.7 | 176.4 | -177.7 | -177.9 | 0 | 111.1 | L26 Y27 K33 | L26-K30 VanDerWaalsContact O-CB 3.26Å; L26-K30 WeakPolarHBondContact O-CB 3.45Å; L26-K30 PolarHBondContact O-N 2.96Å; Y27-K30 PolarHBondContact O-N 3.24Å; K30-K33 PolarHBondContact O-N 2.93Å |
| 31 | M | 59.7 | Low | 60.7 | Low | 97 Ų | 97 | 123 Ų | 123 | 48% | 0.478 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -68.6 | -38.2 | 174.3 | -68.6 | -56.1 | -169.7 | 0 | 0 | 112.3 | Y27 K33 V34 | Y27-M31 HydrophobicContact CD1-CG 4.33Å; Y27-M31 HydrophobicContact CE1-CE 4.29Å; Y27-M31 HydrophobicContact CE1-CG 4.01Å; Y27-M31 HydrophobicContact CE2-CE 3.59Å; Y27-M31 HydrophobicContact CE2-CG 4.39Å; Y27-M31 VanDerWaalsContact CZ-CE 3.42Å; Y27-M31 WeakPolarHBondContact O-CG 3.4Å; Y27-M31 PolarHBondContact O-N 2.93Å; Y27-M31 WeakPolarHBondContact OH-CE 3.5Å; M31-K33 VanDerWaalsContact C-N 3.26Å; M31-K33 PolarHBondContact O-N 2.87Å; M31-V34 WeakPolarHBondContact O-CB 3.39Å; M31-V34 PolarHBondContact O-N 3.49Å |
| 32 | S | 52.6 | Low | 58.4 | Low | 51 Ų | 51 | 127.1 Ų | 127.1 | 36% | 0.357 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -64.7 | -29.1 | 176.2 | -177.7 | 0 | 0 | 0 | 0 | 112.7 | C28 T29 V34 N35 K36 | C28-S32 WeakPolarHBondContact O-CB 3.47Å; C28-S32 PolarHBondContact O-N 3.4Å; T29-S32 PolarHBondContact O-N 2.98Å; S32-V34 PolarHBondContact O-N 3.48Å; S32-N35 PolarHBondContact O-N 3.29Å; S32-K36 PolarHBondContact O-N 2.93Å |
| 33 | K | 50.7 | Low | 55.8 | Low | 168 Ų | 168 | 134.1 Ų | 134.1 | 73% | 0.73 | 66% | 0.655 | S | S | * | * | G | 310 helix | trans | -65.7 | -21.4 | 173.6 | -79 | -179.5 | -179.6 | -180 | 0 | 113.3 | T29 K30 M31 N35 | T29-K33 WeakPolarHBondContact O-CG 3.36Å; T29-K33 PolarHBondContact O-N 3.4Å; K30-K33 PolarHBondContact O-N 2.93Å; M31-K33 VanDerWaalsContact C-N 3.26Å; M31-K33 PolarHBondContact O-N 2.87Å; K33-N35 PolarHBondContact O-N 3.48Å |
| 34 | V | 50.2 | Low | 53.6 | Low | 122 Ų | 122 | 134 Ų | 134 | 74% | 0.739 | 67% | 0.667 | S | S | * | * | G | 310 helix | trans | -72.6 | -19.7 | 173.2 | -162.8 | 0 | 0 | 0 | 0 | 111 | M31 S32 | M31-V34 WeakPolarHBondContact O-CB 3.39Å; M31-V34 PolarHBondContact O-N 3.49Å; S32-V34 PolarHBondContact O-N 3.48Å |
| 35 | N | 41.9 | Very low | 51.1 | Low | 147 Ų | 147 | 134.3 Ų | 134.3 | 79% | 0.786 | 68% | 0.677 | S | S | * | * | G | 310 helix | trans | -108.3 | 14.9 | -179 | -141 | 4.1 | 0 | 0 | 0 | 115 | S32 K33 | S32-N35 PolarHBondContact O-N 3.29Å; K33-N35 PolarHBondContact O-N 3.48Å |
| 36 | K | 41 | Very low | 48.8 | Very low | 133 Ų | 133 | 136.3 Ų | 136.3 | 58% | 0.578 | 69% | 0.694 | S | S | * | * | trans | -113.2 | 54.3 | 176.8 | -73.5 | -175.7 | 179.6 | 177.7 | 0 | 112.6 | S32 N38 | S32-K36 PolarHBondContact O-N 2.93Å; K36-N38 PolarHBondContact O-N 3.32Å | ||
| 37 | K | 39.7 | Very low | 46.6 | Very low | 197 Ų | 197 | 137.3 Ų | 137.3 | 86% | 0.857 | 71% | 0.709 | S | S | * | * | S | Bend | trans | -69.6 | 106.9 | 141.9 | -67.2 | -178.8 | -176.2 | 174.4 | 0 | 105 | ||
| 38 | N | 35.3 | Very low | 44.3 | Very low | 148 Ų | 148 | 134 Ų | 134 | 79% | 0.791 | 72% | 0.717 | S | S | * | * | S | Bend | trans | 90.6 | 94.2 | -169.6 | -57.7 | -26.3 | 0 | 0 | 0 | 114.3 | K36 | K36-N38 PolarHBondContact O-N 3.32Š|
| 39 | V | 38.3 | Very low | 42.2 | Very low | 127 Ų | 127 | 138.1 Ų | 138.1 | 77% | 0.77 | 73% | 0.734 | S | S | * | * | 179.5 | 128.8 | 117.7 | 162.6 | 0 | 0 | 0 | 0 | 107 | |||||
| 40 | K | 34.4 | Very low | 40.4 | Very low | 197 Ų | 197 | 142.5 Ų | 142.5 | 86% | 0.857 | 75% | 0.754 | S | S | * | * | trans | -57.5 | 144.6 | -173.5 | -72.3 | 168 | 174.8 | 172.5 | 0 | 113.4 | ||||
| 41 | N | 31.3 | Very low | 38.7 | Very low | 160 Ų | 160 | 143.3 Ų | 143.3 | 86% | 0.856 | 76% | 0.761 | S | S | * | * | trans | -50.9 | 126.1 | 176.4 | -67.6 | -43.1 | 0 | 0 | 0 | 113.6 | ||||
| 42 | H | 35.6 | Very low | 37.5 | Very low | 188 Ų | 188 | 146.1 Ų | 146.1 | 87% | 0.87 | 77% | 0.77 | S | S | * | * | trans | -122.8 | 116 | 150.5 | -86.7 | -75 | 0 | 0 | 0 | 109.2 | ||||
| 43 | R | 30.8 | Very low | 36.5 | Very low | 237 Ų | 237 | 150.8 Ų | 150.8 | 89% | 0.894 | 79% | 0.791 | S | S | * | * | trans | -86.5 | 103.2 | 178.5 | -168 | -177.5 | -165.8 | 177.7 | 3.7 | 106.9 | ||||
| 44 | S | 36.8 | Very low | 35.7 | Very low | 109 Ų | 109 | 148.5 Ų | 148.5 | 76% | 0.762 | 79% | 0.791 | S | S | * | * | trans | -110.7 | 101.5 | 168 | 51 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 45 | S | 31.6 | Very low | 35 | Very low | 104 Ų | 104 | 150.4 Ų | 150.4 | 73% | 0.727 | 79% | 0.789 | S | S | * | * | trans | -83.3 | 117.1 | 168.9 | -52.7 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 46 | T | 35.4 | Very low | 34.6 | Very low | 136 Ų | 136 | 149.1 Ų | 149.1 | 83% | 0.834 | 79% | 0.791 | S | S | * | * | trans | -137.6 | 89.8 | 166.7 | -4.3 | 0 | 0 | 0 | 0 | 108.2 | G48 | T46-G48 PolarHBondContact O-N 2.91Š| ||
| 47 | S | 32.2 | Very low | 34.6 | Very low | 126 Ų | 126 | 150.3 Ų | 150.3 | 88% | 0.881 | 80% | 0.799 | S | S | * | * | trans | -81.3 | 92.4 | 172.2 | 53.3 | 0 | 0 | 0 | 0 | 109 | ||||
| 48 | G | 33 | Very low | 34.4 | Very low | 68 Ų | 68 | 148.1 Ų | 148.1 | 70% | 0.701 | 80% | 0.802 | S | S | * | * | trans | -96.8 | 113 | 171.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | T46 L50 | T46-G48 PolarHBondContact O-N 2.91Å; G48-L50 PolarHBondContact O-N 3.22Å | ||
| 49 | N | 31.8 | Very low | 34.9 | Very low | 156 Ų | 156 | 147.9 Ų | 147.9 | 83% | 0.834 | 80% | 0.797 | S | S | * | * | trans | -75.3 | 102.6 | 176.4 | -173.6 | -1.3 | 0 | 0 | 0 | 109.6 | ||||
| 50 | L | 36.8 | Very low | 35 | Very low | 162 Ų | 162 | 147.1 Ų | 147.1 | 85% | 0.848 | 80% | 0.797 | S | S | * | * | trans | -99.9 | 104.2 | -178.4 | -113.9 | 150.4 | 0 | 0 | 0 | 109.3 | G48 F52 | G48-L50 PolarHBondContact O-N 3.22Å; L50-F52 PolarHBondContact O-N 3.07Å | ||
| 51 | Q | 34.4 | Very low | 36 | Very low | 176 Ų | 176 | 146.7 Ų | 146.7 | 82% | 0.822 | 80% | 0.798 | S | S | * | * | trans | -66.4 | 121.5 | 174.9 | -68.1 | -175 | 3.7 | 0 | 0 | 110.2 | ||||
| 52 | F | 33.6 | Very low | 36.8 | Very low | 156 Ų | 156 | 149.9 Ų | 149.9 | 68% | 0.684 | 80% | 0.798 | S | S | * | * | trans | -88.8 | 106.9 | -178.1 | -158.4 | -97.5 | 0 | 0 | 0 | 109.6 | L15 L50 V54 | L15-F52 HydrophobicContact CD2-CE2 4.46Å; L15-F52 HydrophobicContact CD2-CZ 4.21Å; L50-F52 PolarHBondContact O-N 3.07Å; F52-V54 HydrophobicContact CD1-CG2 3.88Å; F52-V54 HydrophobicContact CE1-CG2 4.37Å; F52-V54 PolarHBondContact O-N 3.34Å | ||
| 53 | L | 32.9 | Very low | 37.9 | Very low | 149 Ų | 149 | 147.1 Ų | 147.1 | 78% | 0.78 | 79% | 0.79 | S | S | * | * | trans | -80.9 | 103.7 | 174.2 | -168.4 | 82.5 | 0 | 0 | 0 | 108.8 | K55 | L53-K55 PolarHBondContact O-N 2.85Š| ||
| 54 | V | 33.1 | Very low | 39.4 | Very low | 120 Ų | 120 | 140.9 Ų | 140.9 | 73% | 0.727 | 77% | 0.774 | S | S | * | * | trans | -75.8 | 109 | 177.9 | 178.9 | 0 | 0 | 0 | 0 | 108.9 | F52 | F52-V54 HydrophobicContact CD1-CG2 3.88Å; F52-V54 HydrophobicContact CE1-CG2 4.37Å; F52-V54 PolarHBondContact O-N 3.34Å | ||
| 55 | K | 35.5 | Very low | 40.3 | Very low | 162 Ų | 162 | 137.1 Ų | 137.1 | 70% | 0.704 | 75% | 0.752 | S | S | * | * | trans | -109.7 | 120.4 | 163.6 | -81.2 | -174.5 | 173.8 | -172.8 | 0 | 109 | L53 E57 | L53-K55 PolarHBondContact O-N 2.85Å; K55-E57 PolarHBondContact O-N 2.86Å | ||
| 56 | S | 33.3 | Very low | 41.7 | Very low | 120 Ų | 120 | 135.5 Ų | 135.5 | 84% | 0.839 | 75% | 0.745 | S | S | * | * | trans | -82 | 102.5 | 173.8 | 51.9 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 57 | E | 40.3 | Very low | 43 | Very low | 159 Ų | 159 | 136.5 Ų | 136.5 | 74% | 0.743 | 74% | 0.738 | S | S | * | * | trans | -118.6 | 133.9 | 168 | -79.5 | 178.1 | -177.6 | 0 | 0 | 109.1 | K55 E59 | K55-E57 PolarHBondContact O-N 2.86Å; E57-E59 PolarHBondContact O-N 2.99Å | ||
| 58 | T | 36.9 | Very low | 44.4 | Very low | 150 Ų | 150 | 137.5 Ų | 137.5 | 92% | 0.92 | 73% | 0.733 | S | S | * | * | trans | -74.3 | 101.6 | -175.9 | 46.8 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 59 | E | 45 | Very low | 45.7 | Very low | 144 Ų | 144 | 140.8 Ų | 140.8 | 67% | 0.673 | 73% | 0.728 | S | S | * | * | trans | -82.6 | 116.5 | -176.4 | -68.3 | 179.8 | -178.8 | 0 | 0 | 111.6 | P12 E57 E61 | P12-E59 WeakPolarHBondContact CG-OE1 3.22Å; E57-E59 PolarHBondContact O-N 2.99Å; E59-E61 PolarHBondContact O-N 3.35Å | ||
| 60 | S | 40.6 | Very low | 46.9 | Very low | 111 Ų | 111 | 142.5 Ų | 142.5 | 78% | 0.776 | 73% | 0.728 | S | S | * | * | trans | -78.2 | 94.2 | 166.2 | 69.9 | 0 | 0 | 0 | 0 | 108.7 | R62 | S60-R62 PolarHBondContact O-N 3.5Š| ||
| 61 | E | 54.3 | Low | 48.1 | Very low | 188 Ų | 188 | 143.2 Ų | 143.2 | 88% | 0.879 | 73% | 0.725 | S | S | * | * | trans | -67 | 98.8 | -178.3 | -164.2 | 168.6 | -162.3 | 0 | 0 | 110.5 | E59 | E59-E61 PolarHBondContact O-N 3.35Š| ||
| 62 | R | 49.1 | Very low | 49.1 | Very low | 227 Ų | 227 | 140.4 Ų | 140.4 | 86% | 0.857 | 72% | 0.72 | S | S | * | * | trans | -88.9 | 105.6 | 164 | -78.2 | -173.8 | 176.4 | 164.6 | 0.3 | 107.6 | S60 D64 | S60-R62 PolarHBondContact O-N 3.5Å; R62-D64 PolarHBondContact O-N 2.99Å; R62-D64 VanDerWaalsContact O-N 3.08Å | ||
| 63 | D | 59.4 | Low | 49.9 | Very low | 130 Ų | 130 | 142.1 Ų | 142.1 | 70% | 0.695 | 73% | 0.73 | S | S | * | * | trans | -68.2 | 96.5 | 177 | 179.3 | 13.8 | 0 | 0 | 0 | 111.1 | G65 | D63-G65 PolarHBondContact O-N 2.91Å; D63-G65 WeakPolarHBondContact OD1-CA 3.37Å; D63-G65 PolarHBondContact OD1-N 3.2Å | ||
| 64 | D | 61.6 | Low | 50.6 | Low | 106 Ų | 106 | 145.8 Ų | 145.8 | 57% | 0.567 | 73% | 0.733 | S | S | * | * | G | 310 helix | trans | -77 | -1.8 | 172.1 | -89.3 | -46.7 | 0 | 0 | 0 | 112.9 | R62 A66 K67 | R62-D64 PolarHBondContact O-N 2.99Å; R62-D64 VanDerWaalsContact O-N 3.08Å; D64-A66 VanDerWaalsContact C-N 3.27Å; D64-A66 PolarHBondContact O-N 2.91Å; D64-K67 PolarHBondContact O-N 2.91Å; D64-K67 IonicContact OD1-NZ 3.98Å; D64-K67 PolarHBondContact OD1-NZ 3.3Å |
| 65 | G | 56.3 | Low | 51.3 | Low | 30 Ų | 30 | 142.6 Ų | 142.6 | 31% | 0.309 | 72% | 0.724 | S | S | . | * | G | 310 helix | trans | -64.4 | -28.3 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | D63 K67 L68 | D63-G65 PolarHBondContact O-N 2.91Å; D63-G65 WeakPolarHBondContact OD1-CA 3.37Å; D63-G65 PolarHBondContact OD1-N 3.2Å; G65-K67 PolarHBondContact O-N 2.86Å; G65-L68 WeakPolarHBondContact O-CB 3.45Å; G65-L68 PolarHBondContact O-N 3.47Å; G65-L68 VanDerWaalsContact O-N 3.17Å |
| 66 | A | 61 | Low | 52 | Low | 70 Ų | 70 | 143 Ų | 143 | 58% | 0.579 | 73% | 0.734 | S | S | * | * | G | 310 helix | trans | -63.1 | -24.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | D64 L68 F69 | D64-A66 VanDerWaalsContact C-N 3.27Å; D64-A66 PolarHBondContact O-N 2.91Å; A66-L68 VanDerWaalsContact C-N 3.28Å; A66-L68 PolarHBondContact O-N 3.48Å; A66-F69 PolarHBondContact O-N 3.42Å |
| 67 | K | 61.1 | Low | 52.7 | Low | 156 Ų | 156 | 148.4 Ų | 148.4 | 68% | 0.678 | 74% | 0.736 | S | S | * | * | G | 310 helix | trans | -70.9 | -21.4 | 177.8 | -76.2 | 175.1 | -173 | 146.8 | 0 | 113.5 | D64 G65 F69 | D64-K67 PolarHBondContact O-N 2.91Å; D64-K67 IonicContact OD1-NZ 3.98Å; D64-K67 PolarHBondContact OD1-NZ 3.3Å; G65-K67 PolarHBondContact O-N 2.86Å; K67-F69 PolarHBondContact O-N 2.87Å |
| 68 | L | 63.3 | Low | 53.1 | Low | 148 Ų | 148 | 151.8 Ų | 151.8 | 78% | 0.775 | 74% | 0.742 | S | S | * | * | G | 310 helix | trans | -70.5 | -25 | 177.9 | -65.5 | 174.4 | 0 | 0 | 0 | 111.9 | G65 A66 | G65-L68 WeakPolarHBondContact O-CB 3.45Å; G65-L68 PolarHBondContact O-N 3.47Å; G65-L68 VanDerWaalsContact O-N 3.17Å; A66-L68 VanDerWaalsContact C-N 3.28Å; A66-L68 PolarHBondContact O-N 3.48Å |
| 69 | F | 60.3 | Low | 53.8 | Low | 137 Ų | 137 | 150.2 Ų | 150.2 | 60% | 0.601 | 73% | 0.734 | S | S | * | * | trans | -112.8 | 88.1 | 177.2 | -58 | -81.2 | 0 | 0 | 0 | 109 | A66 K67 F71 | A66-F69 PolarHBondContact O-N 3.42Å; K67-F69 PolarHBondContact O-N 2.87Å; F69-F71 HydrophobicContact CB-CD2 3.87Å; F69-F71 HydrophobicContact CB-CE2 3.46Å; F69-F71 VanDerWaalsContact CB-CE2 3.46Å; F69-F71 HydrophobicContact CB-CZ 3.98Å; F69-F71 HydrophobicContact CG-CE2 4.28Å; F69-F71 HydrophobicContact CG-CZ 4.43Å; F69-F71 WeakPolarHBondContact O-CD2 3.47Å; F69-F71 PolarHBondContact O-N 2.91Å | ||
| 70 | K | 56.9 | Low | 53.9 | Low | 192 Ų | 192 | 148.4 Ų | 148.4 | 84% | 0.835 | 74% | 0.738 | S | S | * | * | trans | -68.9 | 85.5 | 157.2 | -69.1 | -164.6 | -179.3 | -174.7 | 0 | 107 | T72 | K70-T72 PolarHBondContact O-N 3.24Š| ||
| 71 | F | 60.4 | Low | 54.4 | Low | 177 Ų | 177 | 151.5 Ų | 151.5 | 78% | 0.776 | 75% | 0.745 | S | S | * | * | trans | -59.1 | 97.2 | 158.4 | -66.6 | -79.4 | 0 | 0 | 0 | 105 | F69 E73 | F69-F71 HydrophobicContact CB-CD2 3.87Å; F69-F71 HydrophobicContact CB-CE2 3.46Å; F69-F71 VanDerWaalsContact CB-CE2 3.46Å; F69-F71 HydrophobicContact CB-CZ 3.98Å; F69-F71 HydrophobicContact CG-CE2 4.28Å; F69-F71 HydrophobicContact CG-CZ 4.43Å; F69-F71 WeakPolarHBondContact O-CD2 3.47Å; F69-F71 PolarHBondContact O-N 2.91Å; F71-E73 VanDerWaalsContact C-N 3.31Å; F71-E73 PolarHBondContact O-N 3.15Å | ||
| 72 | T | 55.5 | Low | 53.6 | Low | 117 Ų | 117 | 144.7 Ų | 144.7 | 72% | 0.718 | 73% | 0.725 | S | S | * | * | trans | -57.6 | 111.7 | 161.7 | 35.6 | 0 | 0 | 0 | 0 | 103.9 | K70 R74 | K70-T72 PolarHBondContact O-N 3.24Å; T72-R74 PolarHBondContact O-N 3.41Å | ||
| 73 | E | 50.8 | Low | 53.5 | Low | 192 Ų | 192 | 139.8 Ų | 139.8 | 90% | 0.897 | 72% | 0.723 | S | S | * | * | trans | -63.5 | 75.2 | 174.2 | -158.9 | 175.5 | -155.2 | 0 | 0 | 106 | F71 G75 | F71-E73 VanDerWaalsContact C-N 3.31Å; F71-E73 PolarHBondContact O-N 3.15Å; E73-G75 PolarHBondContact O-N 3.13Å | ||
| 74 | R | 47.4 | Very low | 52.8 | Low | 226 Ų | 226 | 139.8 Ų | 139.8 | 85% | 0.853 | 73% | 0.727 | S | S | * | * | trans | -66.2 | 94.7 | 165.7 | -96.8 | -174.4 | 174.3 | 149 | -1.2 | 103.2 | T72 N76 | T72-R74 PolarHBondContact O-N 3.41Å; R74-N76 PolarHBondContact O-N 2.88Å | ||
| 75 | G | 48.1 | Very low | 51.8 | Low | 52 Ų | 52 | 140.2 Ų | 140.2 | 54% | 0.536 | 73% | 0.734 | S | S | . | * | trans | -44.3 | 141.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 109 | E73 R77 | E73-G75 PolarHBondContact O-N 3.13Å; G75-R77 PolarHBondContact O-N 3.39Å | ||
| 76 | N | 51 | Low | 51.1 | Low | 170 Ų | 170 | 142.2 Ų | 142.2 | 91% | 0.909 | 74% | 0.743 | S | S | * | * | S | Bend | trans | -50.9 | 44.3 | -170.5 | -65.8 | -28.6 | 0 | 0 | 0 | 116.6 | R74 R78 | R74-N76 PolarHBondContact O-N 2.88Å; N76-R78 PolarHBondContact O-N 3.48Å |
| 77 | R | 48.2 | Very low | 50.3 | Low | 235 Ų | 235 | 148 Ų | 148 | 89% | 0.887 | 76% | 0.755 | S | S | * | * | trans | -76.6 | 88.1 | 163.4 | -66.2 | -168.3 | 179.4 | -179.3 | 1.2 | 104.6 | G75 P79 | G75-R77 PolarHBondContact O-N 3.39Å; R77-P79 VanDerWaalsContact O-N 3.12Å | ||
| 78 | R | 48 | Very low | 49.5 | Very low | 230 Ų | 230 | 145.8 Ų | 145.8 | 87% | 0.868 | 76% | 0.759 | S | S | * | * | trans | -35.3 | 121.2 | 152.4 | -152.4 | 178.5 | -164.1 | -177.1 | 2.7 | 105.5 | N76 S80 | N76-R78 PolarHBondContact O-N 3.48Å; R78-S80 VanDerWaalsContact C-N 3.33Å; R78-S80 PolarHBondContact O-N 3.3Å | ||
| 79 | P | 52.6 | Low | 48.5 | Very low | 116 Ų | 116 | 146.7 Ų | 146.7 | 75% | 0.753 | 76% | 0.76 | S | S | * | * | trans | -52.6 | 109.7 | 174.3 | -20.7 | 30.2 | 0 | 0 | 0 | 105.1 | R77 L81 | R77-P79 VanDerWaalsContact O-N 3.12Å; P79-L81 VanDerWaalsContact C-N 3.32Å; P79-L81 PolarHBondContact O-N 2.99Å | ||
| 80 | S | 46.8 | Very low | 47.6 | Very low | 107 Ų | 107 | 148.5 Ų | 148.5 | 75% | 0.748 | 78% | 0.775 | S | S | * | * | trans | -59.7 | 113.5 | 166.4 | 54.1 | 0 | 0 | 0 | 0 | 102.5 | R78 G82 | R78-S80 VanDerWaalsContact C-N 3.33Å; R78-S80 PolarHBondContact O-N 3.3Å; S80-G82 PolarHBondContact O-N 2.91Å | ||
| 81 | L | 49.7 | Very low | 46.8 | Very low | 176 Ų | 176 | 143.8 Ų | 143.8 | 92% | 0.921 | 77% | 0.766 | S | S | * | * | trans | -52.8 | 92.6 | 161.4 | -78.8 | 145.7 | 0 | 0 | 0 | 104.2 | P79 | P79-L81 VanDerWaalsContact C-N 3.32Å; P79-L81 PolarHBondContact O-N 2.99Å | ||
| 82 | G | 38.6 | Very low | 46 | Very low | 45 Ų | 45 | 140.8 Ų | 140.8 | 46% | 0.464 | 77% | 0.767 | S | S | . | * | trans | -55.7 | 154 | 173.2 | 0 | 0 | 0 | 0 | 0 | 107.3 | S80 T84 | S80-G82 PolarHBondContact O-N 2.91Å; G82-T84 PolarHBondContact O-N 3.3Å | ||
| 83 | P | 47.5 | Very low | 45.1 | Very low | 124 Ų | 124 | 143.8 Ų | 143.8 | 81% | 0.805 | 77% | 0.77 | S | S | * | * | S | Bend | trans | -52.1 | 123.1 | -175.1 | -7.4 | 16 | 0 | 0 | 0 | 108.2 | V85 | P83-V85 PolarHBondContact O-N 3.35Å; P83-V85 VanDerWaalsContact O-N 3.09Å |
| 84 | T | 42.9 | Very low | 44.6 | Very low | 129 Ų | 129 | 144.5 Ų | 144.5 | 79% | 0.791 | 77% | 0.771 | S | S | * | * | trans | -10 | 103.7 | 172.4 | 49.6 | 0 | 0 | 0 | 0 | 112.2 | G82 S86 | G82-T84 PolarHBondContact O-N 3.3Å; T84-S86 VanDerWaalsContact C-N 3.28Å; T84-S86 PolarHBondContact O-N 2.9Å | ||
| 85 | V | 41.4 | Very low | 44.2 | Very low | 116 Ų | 116 | 141.7 Ų | 141.7 | 70% | 0.703 | 77% | 0.767 | S | S | * | * | trans | -60.6 | 98.1 | 170.7 | -176.2 | 0 | 0 | 0 | 0 | 106 | P83 F87 | P83-V85 PolarHBondContact O-N 3.35Å; P83-V85 VanDerWaalsContact O-N 3.09Å; V85-F87 PolarHBondContact O-N 3.24Å | ||
| 86 | S | 42.2 | Very low | 43.6 | Very low | 72 Ų | 72 | 146.6 Ų | 146.6 | 50% | 0.503 | 78% | 0.781 | S | S | . | * | trans | -71.9 | 113.4 | 173.6 | 58.5 | 0 | 0 | 0 | 0 | 107 | T84 S88 | T84-S86 VanDerWaalsContact C-N 3.28Å; T84-S86 PolarHBondContact O-N 2.9Å; S86-S88 PolarHBondContact O-N 2.91Å | ||
| 87 | F | 43.4 | Very low | 43.1 | Very low | 190 Ų | 190 | 146 Ų | 146 | 83% | 0.833 | 78% | 0.776 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.3 | 18 | 178.7 | -74.8 | -84.4 | 0 | 0 | 0 | 114.6 | V85 | V85-F87 PolarHBondContact O-N 3.24Š|
| 88 | S | 44 | Very low | 42.4 | Very low | 110 Ų | 110 | 142.9 Ų | 142.9 | 77% | 0.769 | 78% | 0.777 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.9 | 5.9 | -171.6 | -46.1 | 0 | 0 | 0 | 0 | 114.3 | S86 | S86-S88 PolarHBondContact O-N 2.91Š|
| 89 | Q | 43.2 | Very low | 42.1 | Very low | 168 Ų | 168 | 138.9 Ų | 138.9 | 79% | 0.785 | 77% | 0.772 | S | S | * | * | trans | -116 | 37.6 | -177 | -65.3 | -174.8 | -20.4 | 0 | 0 | 113.4 | S91 | Q89-S91 PolarHBondContact O-N 3.33Š| ||
| 90 | L | 40.9 | Very low | 41.4 | Very low | 174 Ų | 174 | 141 Ų | 141 | 91% | 0.911 | 77% | 0.774 | S | S | * | * | trans | -87.1 | 71.1 | 157.8 | -65.9 | 175.1 | 0 | 0 | 0 | 108.3 | ||||
| 91 | S | 41 | Very low | 41 | Very low | 93 Ų | 93 | 144.6 Ų | 144.6 | 65% | 0.65 | 78% | 0.779 | S | S | * | * | trans | -83.4 | 125.6 | 165.4 | 178.6 | 0 | 0 | 0 | 0 | 107.9 | Q89 K93 | Q89-S91 PolarHBondContact O-N 3.33Å; S91-K93 PolarHBondContact O-N 3.39Å | ||
| 92 | S | 42 | Very low | 40.6 | Very low | 115 Ų | 115 | 140.5 Ų | 140.5 | 80% | 0.804 | 77% | 0.765 | S | S | * | * | trans | -73.6 | 38.7 | -170.5 | 78.2 | 0 | 0 | 0 | 0 | 114.9 | F94 | S92-F94 PolarHBondContact O-N 3.44Š| ||
| 93 | K | 37.9 | Very low | 40.8 | Very low | 179 Ų | 179 | 144.7 Ų | 144.7 | 78% | 0.778 | 78% | 0.782 | S | S | * | * | trans | -94.9 | 71.2 | 177.6 | -65.4 | -165.7 | 176.5 | -168.6 | 0 | 110.3 | S91 E95 | S91-K93 PolarHBondContact O-N 3.39Å; K93-E95 PolarHBondContact O-N 2.93Å | ||
| 94 | F | 40.7 | Very low | 40.4 | Very low | 208 Ų | 208 | 144.1 Ų | 144.1 | 91% | 0.912 | 77% | 0.77 | S | S | * | * | trans | -86.3 | 84.6 | 160.5 | -80.9 | -89.1 | 0 | 0 | 0 | 107.7 | S92 | S92-F94 PolarHBondContact O-N 3.44Š| ||
| 95 | E | 37.5 | Very low | 40.1 | Very low | 167 Ų | 167 | 142 Ų | 142 | 78% | 0.78 | 76% | 0.759 | S | S | * | * | trans | -124.5 | 125.6 | 162.2 | -75.8 | 178.8 | 170.3 | 0 | 0 | 107.1 | K93 | K93-E95 PolarHBondContact O-N 2.93Š| ||
| 96 | D | 36.7 | Very low | 40.2 | Very low | 154 Ų | 154 | 144.2 Ų | 144.2 | 82% | 0.824 | 76% | 0.762 | S | S | * | * | trans | 73.3 | 52.6 | 158.6 | -55.7 | -16.6 | 0 | 0 | 0 | 120.3 | ||||
| 97 | I | 39.8 | Very low | 40.3 | Very low | 157 Ų | 157 | 145 Ų | 145 | 81% | 0.805 | 77% | 0.767 | S | S | * | * | trans | -112.6 | 91.3 | 153.3 | -57.7 | -178.6 | 0 | 0 | 0 | 109.1 | L99 | I97-L99 HydrophobicContact CG2-CB 3.87Å; I97-L99 PolarHBondContact O-N 3.38Å | ||
| 98 | D | 34.5 | Very low | 40.2 | Very low | 170 Ų | 170 | 142.2 Ų | 142.2 | 91% | 0.909 | 76% | 0.76 | S | S | * | * | trans | -68.6 | 41.1 | 177.7 | -140.4 | 5.3 | 0 | 0 | 0 | 112.6 | M100 | D98-M100 PolarHBondContact O-N 3.02Å; D98-M100 VanDerWaalsContact O-N 3.1Å | ||
| 99 | L | 41 | Very low | 40 | Very low | 147 Ų | 147 | 144 Ų | 144 | 77% | 0.77 | 76% | 0.756 | S | S | * | * | trans | -88.9 | 83.1 | -176 | -153.5 | 82.1 | 0 | 0 | 0 | 109.7 | I97 E101 | I97-L99 HydrophobicContact CG2-CB 3.87Å; I97-L99 PolarHBondContact O-N 3.38Å; L99-E101 PolarHBondContact O-N 3.48Å | ||
| 100 | M | 37.3 | Very low | 39.9 | Very low | 159 Ų | 159 | 144 Ų | 144 | 78% | 0.783 | 76% | 0.756 | S | S | * | * | trans | 25.7 | 85 | 146.9 | -67 | -107.2 | 73.8 | 0 | 0 | 113.3 | D98 S102 | D98-M100 PolarHBondContact O-N 3.02Å; D98-M100 VanDerWaalsContact O-N 3.1Å; M100-S102 PolarHBondContact O-N 2.94Å | ||
| 101 | E | 39.5 | Very low | 39.9 | Very low | 184 Ų | 184 | 142.4 Ų | 142.4 | 86% | 0.86 | 75% | 0.748 | S | S | * | * | trans | 14.4 | 62.4 | 138.4 | -156.7 | 170.8 | -172 | 0 | 0 | 114.2 | L99 V103 | L99-E101 PolarHBondContact O-N 3.48Å; E101-V103 PolarHBondContact O-N 3.09Å | ||
| 102 | S | 40.8 | Very low | 39.8 | Very low | 90 Ų | 90 | 143.8 Ų | 143.8 | 63% | 0.629 | 76% | 0.758 | S | S | * | * | trans | -67.4 | 109.2 | 166.3 | 152.1 | 0 | 0 | 0 | 0 | 102.7 | M100 I104 | M100-S102 PolarHBondContact O-N 2.94Å; S102-I104 PolarHBondContact O-N 3.23Å | ||
| 103 | V | 43.4 | Very low | 39.7 | Very low | 133 Ų | 133 | 146.2 Ų | 146.2 | 81% | 0.806 | 75% | 0.754 | S | S | * | * | trans | -50.2 | 75 | 171.2 | -177.3 | 0 | 0 | 0 | 0 | 109 | E101 P105 | E101-V103 PolarHBondContact O-N 3.09Å; V103-P105 WeakPolarHBondContact O-CD 3.26Å | ||
| 104 | I | 38.1 | Very low | 39.9 | Very low | 111 Ų | 111 | 146.2 Ų | 146.2 | 57% | 0.569 | 76% | 0.757 | S | S | * | * | trans | -79.6 | 114.9 | 163.7 | -64.2 | 172.2 | 0 | 0 | 0 | 102.6 | S102 E106 L108 | S102-I104 PolarHBondContact O-N 3.23Å; I104-E106 PolarHBondContact O-N 3.34Å; I104-L108 HydrophobicContact CG2-CB 4.49Å; I104-L108 HydrophobicContact CG2-CD1 4.45Å | ||
| 105 | P | 35.9 | Very low | 39.9 | Very low | 84 Ų | 84 | 143.7 Ų | 143.7 | 55% | 0.545 | 75% | 0.748 | S | S | . | * | trans | -52.7 | 131.5 | -178.8 | 19.3 | -30.2 | 0 | 0 | 0 | 109.3 | V103 S107 L108 | V103-P105 WeakPolarHBondContact O-CD 3.26Å; P105-S107 PolarHBondContact O-N 3.37Å; P105-L108 PolarHBondContact O-N 2.89Å | ||
| 106 | E | 45.1 | Very low | 40.1 | Very low | 164 Ų | 164 | 145.7 Ų | 145.7 | 77% | 0.766 | 76% | 0.757 | S | S | * | * | G | 310 helix | trans | -48.2 | -13 | -179.1 | -86.2 | 170.6 | 140.9 | 0 | 0 | 114.6 | I104 L108 Q109 | I104-E106 PolarHBondContact O-N 3.34Å; E106-L108 PolarHBondContact O-N 2.9Å; E106-L108 VanDerWaalsContact O-N 3.07Å; E106-Q109 PolarHBondContact O-N 3.03Å; E106-Q109 VanDerWaalsContact O-N 3.11Å |
| 107 | S | 44 | Very low | 40.6 | Very low | 87 Ų | 87 | 142.2 Ų | 142.2 | 61% | 0.608 | 75% | 0.749 | S | S | * | * | G | 310 helix | trans | -62.9 | -9.3 | 174.7 | 63.5 | 0 | 0 | 0 | 0 | 114.9 | P105 | P105-S107 PolarHBondContact O-N 3.37Š|
| 108 | L | 42 | Very low | 41.1 | Very low | 133 Ų | 133 | 141.5 Ų | 141.5 | 70% | 0.696 | 74% | 0.743 | S | S | * | * | G | 310 helix | trans | -107.9 | -0.1 | 173.9 | -70.9 | 177.4 | 0 | 0 | 0 | 114.2 | I104 P105 E106 H110 | I104-L108 HydrophobicContact CG2-CB 4.49Å; I104-L108 HydrophobicContact CG2-CD1 4.45Å; P105-L108 PolarHBondContact O-N 2.89Å; E106-L108 PolarHBondContact O-N 2.9Å; E106-L108 VanDerWaalsContact O-N 3.07Å; L108-H110 PolarHBondContact O-N 3.4Å |
| 109 | Q | 38 | Very low | 42 | Very low | 146 Ų | 146 | 139.8 Ų | 139.8 | 68% | 0.682 | 73% | 0.734 | S | S | * | * | trans | -83.5 | 67.4 | 168.8 | -68.1 | -169.1 | 3.4 | 0 | 0 | 109.5 | E106 N111 | E106-Q109 PolarHBondContact O-N 3.03Å; E106-Q109 VanDerWaalsContact O-N 3.11Å; Q109-N111 VanDerWaalsContact C-N 3.29Å; Q109-N111 PolarHBondContact O-N 2.99Å | ||
| 110 | H | 41.7 | Very low | 42.7 | Very low | 168 Ų | 168 | 139 Ų | 139 | 78% | 0.778 | 73% | 0.73 | S | S | * | * | trans | -66.1 | 97.2 | 163.6 | -85.9 | -80.3 | 0 | 0 | 0 | 107.7 | L108 S112 | L108-H110 PolarHBondContact O-N 3.4Å; H110-S112 PolarHBondContact O-N 3.26Å | ||
| 111 | N | 42 | Very low | 43.9 | Very low | 142 Ų | 142 | 136.6 Ų | 136.6 | 76% | 0.759 | 72% | 0.721 | S | S | * | * | trans | -49.5 | 112.2 | 166.5 | -91.2 | -59.4 | 0 | 0 | 0 | 108.6 | Q109 K113 | Q109-N111 VanDerWaalsContact C-N 3.29Å; Q109-N111 PolarHBondContact O-N 2.99Å; N111-K113 PolarHBondContact O-N 3.12Å | ||
| 112 | S | 37.7 | Very low | 45.3 | Very low | 121 Ų | 121 | 132.6 Ų | 132.6 | 85% | 0.846 | 71% | 0.705 | S | S | * | * | trans | -74.1 | 56.6 | 179.2 | 59.7 | 0 | 0 | 0 | 0 | 111.6 | H110 | H110-S112 PolarHBondContact O-N 3.26Š| ||
| 113 | K | 40.9 | Very low | 46.9 | Very low | 166 Ų | 166 | 133.6 Ų | 133.6 | 72% | 0.722 | 70% | 0.7 | S | S | * | * | trans | -122.6 | 106.2 | 173.2 | -76.6 | -176 | 176.7 | 177.9 | 0 | 109.6 | N111 | N111-K113 PolarHBondContact O-N 3.12Š| ||
| 114 | E | 41.3 | Very low | 48.7 | Very low | 179 Ų | 179 | 131.5 Ų | 131.5 | 84% | 0.836 | 68% | 0.684 | S | S | * | * | trans | 63.5 | 74.1 | 140 | -60.9 | 168.4 | 172.3 | 0 | 0 | 116 | ||||
| 115 | Q | 41.3 | Very low | 50.8 | Low | 155 Ų | 155 | 129.6 Ų | 129.6 | 72% | 0.724 | 68% | 0.675 | S | S | * | * | trans | -150 | 78.8 | 147.8 | -148 | 150.8 | -20.9 | 0 | 0 | 110.8 | A117 | Q115-A117 HydrophobicContact CG-CB 4.48Å; Q115-A117 PolarHBondContact O-N 3.4Å | ||
| 116 | E | 40.9 | Very low | 53.1 | Low | 210 Ų | 210 | 129.8 Ų | 129.8 | 98% | 0.981 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.8 | 45.9 | 172.8 | -65.2 | -164.3 | 157.8 | 0 | 0 | 112.8 | ||
| 117 | A | 47.7 | Very low | 55 | Low | 80 Ų | 80 | 126.5 Ų | 126.5 | 66% | 0.661 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -135.8 | -2.6 | -171.2 | 0 | 0 | 0 | 0 | 0 | 117.6 | Q115 | Q115-A117 HydrophobicContact CG-CB 4.48Å; Q115-A117 PolarHBondContact O-N 3.4Å |
| 118 | E | 49.3 | Very low | 57.1 | Low | 143 Ų | 143 | 129 Ų | 129 | 67% | 0.668 | 65% | 0.654 | S | S | * | * | trans | -129.5 | 15 | -173.8 | -71 | -178.5 | -179.3 | 0 | 0 | 115.3 | N120 | E118-N120 VanDerWaalsContact C-N 3.28Å; E118-N120 PolarHBondContact O-N 3.49Å | ||
| 119 | D | 54.2 | Low | 59.2 | Low | 133 Ų | 133 | 127 Ų | 127 | 71% | 0.711 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.8 | 9.4 | -172 | -133.3 | 16.2 | 0 | 0 | 0 | 115.2 | ||
| 120 | N | 56.2 | Low | 61.7 | Low | 132 Ų | 132 | 127.7 Ų | 127.7 | 71% | 0.706 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93 | -25.6 | 175.4 | -95.1 | -40.5 | 0 | 0 | 0 | 113.5 | E118 D124 | E118-N120 VanDerWaalsContact C-N 3.28Å; E118-N120 PolarHBondContact O-N 3.49Å; N120-D124 PolarHBondContact O-N 3.34Å |
| 121 | D | 62.2 | Low | 64.1 | Low | 108 Ų | 108 | 123.2 Ų | 123.2 | 58% | 0.578 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -71.3 | -37.4 | -178.4 | -78.6 | -13.5 | 0 | 0 | 0 | 110.6 | E123 D124 D125 | D121-E123 PolarHBondContact O-N 3.38Å; D121-D124 PolarHBondContact O-N 3.03Å; D121-D125 WeakPolarHBondContact O-CB 3.38Å; D121-D125 PolarHBondContact O-N 2.97Å |
| 122 | D | 69 | Low | 66.3 | Low | 99 Ų | 99 | 123.7 Ų | 123.7 | 53% | 0.529 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -63.4 | -38.8 | 179.8 | -77.9 | -24.5 | 0 | 0 | 0 | 112.8 | D125 L126 | D122-D125 PolarHBondContact O-N 3.15Å; D122-L126 WeakPolarHBondContact O-CB 3.34Å; D122-L126 WeakPolarHBondContact O-CG 3.33Å; D122-L126 PolarHBondContact O-N 2.96Å |
| 123 | E | 73.3 | Confident | 68.9 | Low | 111 Ų | 111 | 122.3 Ų | 122.3 | 52% | 0.519 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -67.4 | -40.9 | 175.9 | -74.4 | -60.8 | 137.9 | 0 | 0 | 111.7 | D121 D125 L126 L127 | D121-E123 PolarHBondContact O-N 3.38Å; E123-D125 VanDerWaalsContact C-N 3.35Å; E123-L126 PolarHBondContact O-N 3.35Å; E123-L127 WeakPolarHBondContact O-CB 3.44Å; E123-L127 PolarHBondContact O-N 3.49Å |
| 124 | D | 81.2 | Confident | 71.4 | Confident | 90 Ų | 90 | 117 Ų | 117 | 48% | 0.481 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -64.6 | -39.6 | 174.6 | -85.7 | -14.6 | 0 | 0 | 0 | 111.5 | N120 D121 L127 R128 | N120-D124 PolarHBondContact O-N 3.34Å; D121-D124 PolarHBondContact O-N 3.03Å; D124-L127 PolarHBondContact O-N 3.24Å; D124-R128 WeakPolarHBondContact O-CB 3.44Å; D124-R128 VanDerWaalsContact O-CG 3.27Å; D124-R128 WeakPolarHBondContact O-CG 3.45Å; D124-R128 PolarHBondContact O-N 2.98Å |
| 125 | D | 82.9 | Confident | 73.8 | Confident | 70 Ų | 70 | 112.5 Ų | 112.5 | 37% | 0.374 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -62.2 | -46.4 | 173.8 | -83 | 54.6 | 0 | 0 | 0 | 111.4 | D121 D122 E123 L127 R128 V129 | D121-D125 WeakPolarHBondContact O-CB 3.38Å; D121-D125 PolarHBondContact O-N 2.97Å; D122-D125 PolarHBondContact O-N 3.15Å; E123-D125 VanDerWaalsContact C-N 3.35Å; D125-L127 VanDerWaalsContact C-N 3.31Å; D125-L127 PolarHBondContact O-N 3.35Å; D125-R128 PolarHBondContact O-N 3.48Å; D125-R128 IonicContact OD1-CZ 3.97Å; D125-R128 IonicContact OD1-NH1 3.05Å; D125-R128 PolarHBondContact OD1-NH1 2.99Å; D125-R128 IonicContact OD1-NH2 3.35Å; D125-R128 PolarHBondContact OD1-NH2 2.91Å; D125-R128 IonicContact OD2-CZ 2.84Å; D125-R128 IonicContact OD2-NH2 3.03Å; D125-R128 PolarHBondContact OD2-NH2 3.48Å; D125-V129 VanDerWaalsContact O-CG2 3.32Å; D125-V129 WeakPolarHBondContact O-CG2 3.41Å; D125-V129 PolarHBondContact O-N 3.42Å |
| 126 | L | 84.8 | Confident | 76.3 | Confident | 89 Ų | 89 | 107.7 Ų | 107.7 | 47% | 0.466 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -62.4 | -38.4 | 174.5 | -73.8 | 171.7 | 0 | 0 | 0 | 111.7 | D122 E123 V129 R130 | D122-L126 WeakPolarHBondContact O-CB 3.34Å; D122-L126 WeakPolarHBondContact O-CG 3.33Å; D122-L126 PolarHBondContact O-N 2.96Å; E123-L126 PolarHBondContact O-N 3.35Å; L126-V129 PolarHBondContact O-N 2.99Å; L126-R130 VanDerWaalsContact O-CB 3.31Å; L126-R130 WeakPolarHBondContact O-CB 3.36Å; L126-R130 PolarHBondContact O-N 3.38Å |
| 127 | L | 85.5 | Confident | 78.9 | Confident | 94 Ų | 94 | 103.6 Ų | 103.6 | 49% | 0.492 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.3 | -43.8 | 176.3 | -140.7 | 127.2 | 0 | 0 | 0 | 110.6 | E123 D124 D125 R130 V131 | E123-L127 WeakPolarHBondContact O-CB 3.44Å; E123-L127 PolarHBondContact O-N 3.49Å; D124-L127 PolarHBondContact O-N 3.24Å; D125-L127 VanDerWaalsContact C-N 3.31Å; D125-L127 PolarHBondContact O-N 3.35Å; L127-R130 PolarHBondContact O-N 2.83Å; L127-V131 VanDerWaalsContact O-CG2 3.29Å; L127-V131 WeakPolarHBondContact O-CG2 3.01Å; L127-V131 PolarHBondContact O-N 2.94Å |
| 128 | R | 86.8 | Confident | 80.9 | Confident | 141 Ų | 141 | 107.4 Ų | 107.4 | 53% | 0.532 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62 | -43.7 | 174.5 | -72.4 | -171.1 | -52.8 | -99.4 | 20.3 | 112 | D124 D125 V131 F132 | D124-R128 WeakPolarHBondContact O-CB 3.44Å; D124-R128 VanDerWaalsContact O-CG 3.27Å; D124-R128 WeakPolarHBondContact O-CG 3.45Å; D124-R128 PolarHBondContact O-N 2.98Å; D125-R128 PolarHBondContact O-N 3.48Å; D125-R128 IonicContact OD1-CZ 3.97Å; D125-R128 IonicContact OD1-NH1 3.05Å; D125-R128 PolarHBondContact OD1-NH1 2.99Å; D125-R128 IonicContact OD1-NH2 3.35Å; D125-R128 PolarHBondContact OD1-NH2 2.91Å; D125-R128 IonicContact OD2-CZ 2.84Å; D125-R128 IonicContact OD2-NH2 3.03Å; D125-R128 PolarHBondContact OD2-NH2 3.48Å; R128-V131 PolarHBondContact O-N 3.21Å; R128-F132 WeakPolarHBondContact O-CB 3.34Å; R128-F132 PolarHBondContact O-N 3.41Å |
| 129 | V | 87.3 | Confident | 83 | Confident | 91 Ų | 91 | 105.3 Ų | 105.3 | 55% | 0.552 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -62 | -44.1 | 175.7 | 170.9 | 0 | 0 | 0 | 0 | 110.8 | D125 L126 V131 F132 E133 | D125-V129 VanDerWaalsContact O-CG2 3.32Å; D125-V129 WeakPolarHBondContact O-CG2 3.41Å; D125-V129 PolarHBondContact O-N 3.42Å; L126-V129 PolarHBondContact O-N 2.99Å; V129-V131 PolarHBondContact O-N 3.02Å; V129-F132 WeakPolarHBondContact O-CB 3.39Å; V129-F132 PolarHBondContact O-N 3.3Å; V129-E133 WeakPolarHBondContact O-CB 3.47Å; V129-E133 PolarHBondContact O-N 2.89Å |
| 130 | R | 89.5 | Confident | 84.8 | Confident | 159 Ų | 159 | 103.5 Ų | 103.5 | 60% | 0.6 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -63.3 | -42.9 | 178.4 | -170.2 | -179.1 | -60.7 | 160.6 | 6.1 | 112.1 | L126 L127 E133 A134 | L126-R130 VanDerWaalsContact O-CB 3.31Å; L126-R130 WeakPolarHBondContact O-CB 3.36Å; L126-R130 PolarHBondContact O-N 3.38Å; L127-R130 PolarHBondContact O-N 2.83Å; R130-E133 PolarHBondContact O-N 2.9Å; R130-A134 WeakPolarHBondContact O-CB 3.4Å; R130-A134 PolarHBondContact O-N 2.85Å |
| 131 | V | 91.5 | Very high | 86.4 | Confident | 75 Ų | 75 | 101.8 Ų | 101.8 | 46% | 0.455 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.2 | -43.4 | 175 | 170.2 | 0 | 0 | 0 | 0 | 110.7 | L127 R128 V129 A134 N135 | L127-V131 VanDerWaalsContact O-CG2 3.29Å; L127-V131 WeakPolarHBondContact O-CG2 3.01Å; L127-V131 PolarHBondContact O-N 2.94Å; R128-V131 PolarHBondContact O-N 3.21Å; V129-V131 PolarHBondContact O-N 3.02Å; V131-A134 PolarHBondContact O-N 3.49Å; V131-N135 WeakPolarHBondContact O-CB 3.49Å; V131-N135 VanDerWaalsContact O-CG 3.27Å; V131-N135 PolarHBondContact O-N 3.43Å; V131-N135 PolarHBondContact O-ND2 2.94Å |
| 132 | F | 89.8 | Confident | 87.8 | Confident | 151 Ų | 151 | 102 Ų | 102 | 66% | 0.662 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -60.6 | -45.1 | 175.7 | 178.7 | -98.4 | 0 | 0 | 0 | 111.7 | R128 V129 N135 C136 | R128-F132 WeakPolarHBondContact O-CB 3.34Å; R128-F132 PolarHBondContact O-N 3.41Å; V129-F132 WeakPolarHBondContact O-CB 3.39Å; V129-F132 PolarHBondContact O-N 3.3Å; F132-N135 PolarHBondContact O-N 2.93Å; F132-C136 WeakPolarHBondContact O-CB 3.4Å; F132-C136 PolarHBondContact O-N 3.44Å |
| 133 | E | 92.2 | Very high | 88.9 | Confident | 93 Ų | 93 | 104.1 Ų | 104.1 | 44% | 0.435 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.9 | -46.4 | 177.4 | -168.2 | -168.3 | 166.2 | 0 | 0 | 111.6 | V129 R130 N135 C136 K137 | V129-E133 WeakPolarHBondContact O-CB 3.47Å; V129-E133 PolarHBondContact O-N 2.89Å; R130-E133 PolarHBondContact O-N 2.9Å; E133-N135 VanDerWaalsContact C-N 3.34Å; E133-N135 PolarHBondContact O-N 2.84Å; E133-C136 WeakPolarHBondContact O-CB 3.35Å; E133-C136 PolarHBondContact O-N 3.04Å; E133-K137 WeakPolarHBondContact O-CG 3.39Å; E133-K137 PolarHBondContact O-N 3.46Å; E133-K137 WeakPolarHBondContact OE1-CE 3.49Å; E133-K137 IonicContact OE1-NZ 3.72Å; E133-K137 PolarHBondContact OE1-NZ 3.18Å |
| 134 | A | 91.8 | Very high | 89.6 | Confident | 55 Ų | 55 | 104.7 Ų | 104.7 | 46% | 0.455 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.9 | -42.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | R130 V131 K137 R138 | R130-A134 WeakPolarHBondContact O-CB 3.4Å; R130-A134 PolarHBondContact O-N 2.85Å; V131-A134 PolarHBondContact O-N 3.49Å; A134-K137 PolarHBondContact O-N 3.11Å; A134-R138 WeakPolarHBondContact O-CB 3.41Å; A134-R138 PolarHBondContact O-N 2.86Å |
| 135 | N | 92.7 | Very high | 90.1 | Very high | 83 Ų | 83 | 106.3 Ų | 106.3 | 44% | 0.444 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -65.3 | -40.8 | 176.1 | -77.4 | -29.5 | 0 | 0 | 0 | 112.1 | V131 F132 E133 R138 N139 | V131-N135 WeakPolarHBondContact O-CB 3.49Å; V131-N135 VanDerWaalsContact O-CG 3.27Å; V131-N135 PolarHBondContact O-N 3.43Å; V131-N135 PolarHBondContact O-ND2 2.94Å; F132-N135 PolarHBondContact O-N 2.93Å; E133-N135 VanDerWaalsContact C-N 3.34Å; E133-N135 PolarHBondContact O-N 2.84Å; N135-R138 PolarHBondContact O-N 2.89Å; N135-N139 WeakPolarHBondContact O-CB 3.45Å; N135-N139 PolarHBondContact O-N 3.1Å; N135-N139 PolarHBondContact O-ND2 3.36Å |
| 136 | C | 93 | Very high | 90.2 | Very high | 55 Ų | 55 | 107 Ų | 107 | 37% | 0.372 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.1 | -49.3 | 175 | -171.6 | 0 | 0 | 0 | 0 | 111 | F132 E133 R138 N139 I140 | F132-C136 WeakPolarHBondContact O-CB 3.4Å; F132-C136 PolarHBondContact O-N 3.44Å; E133-C136 WeakPolarHBondContact O-CB 3.35Å; E133-C136 PolarHBondContact O-N 3.04Å; C136-R138 VanDerWaalsContact C-N 3.34Å; C136-R138 PolarHBondContact O-N 3.18Å; C136-N139 PolarHBondContact O-N 3.21Å; C136-N139 VanDerWaalsContact O-N 3.15Å; C136-I140 WeakPolarHBondContact O-CG1 3.33Å; C136-I140 PolarHBondContact O-N 3.25Å |
| 137 | K | 95.1 | Very high | 90.2 | Very high | 124 Ų | 124 | 105.8 Ų | 105.8 | 54% | 0.539 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -56.3 | -45.6 | 175 | -73.5 | 174.5 | -177.2 | 168.4 | 0 | 111.9 | E133 A134 N139 I140 L141 | E133-K137 WeakPolarHBondContact O-CG 3.39Å; E133-K137 PolarHBondContact O-N 3.46Å; E133-K137 WeakPolarHBondContact OE1-CE 3.49Å; E133-K137 IonicContact OE1-NZ 3.72Å; E133-K137 PolarHBondContact OE1-NZ 3.18Å; A134-K137 PolarHBondContact O-N 3.11Å; K137-N139 PolarHBondContact O-N 3.33Å; K137-I140 PolarHBondContact O-N 3.06Å; K137-L141 WeakPolarHBondContact O-CB 3.48Å; K137-L141 PolarHBondContact O-N 2.72Å |
| 138 | R | 91 | Very high | 90.2 | Very high | 159 Ų | 159 | 110.2 Ų | 110.2 | 60% | 0.6 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -61.3 | -42.4 | 176.9 | -175 | 179.8 | 177.2 | 102.6 | -2.8 | 111.9 | A134 N135 C136 L141 K142 | A134-R138 WeakPolarHBondContact O-CB 3.41Å; A134-R138 PolarHBondContact O-N 2.86Å; N135-R138 PolarHBondContact O-N 2.89Å; C136-R138 VanDerWaalsContact C-N 3.34Å; C136-R138 PolarHBondContact O-N 3.18Å; R138-L141 PolarHBondContact O-N 2.95Å; R138-K142 WeakPolarHBondContact O-CG 3.46Å; R138-K142 PolarHBondContact O-N 3.02Å |
| 139 | N | 92.9 | Very high | 90.2 | Very high | 99 Ų | 99 | 109.3 Ų | 109.3 | 53% | 0.529 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -68 | -41.3 | 179 | -78.9 | -27.4 | 0 | 0 | 0 | 112.5 | N135 C136 K137 L141 K142 K143 | N135-N139 WeakPolarHBondContact O-CB 3.45Å; N135-N139 PolarHBondContact O-N 3.1Å; N135-N139 PolarHBondContact O-ND2 3.36Å; C136-N139 PolarHBondContact O-N 3.21Å; C136-N139 VanDerWaalsContact O-N 3.15Å; K137-N139 PolarHBondContact O-N 3.33Å; N139-L141 VanDerWaalsContact C-N 3.34Å; N139-L141 PolarHBondContact O-N 3.38Å; N139-K142 PolarHBondContact O-N 3.08Å; N139-K143 PolarHBondContact O-N 2.88Å |
| 140 | I | 92.8 | Very high | 90.1 | Very high | 95 Ų | 95 | 110.8 Ų | 110.8 | 49% | 0.487 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -59.9 | -47.6 | 174 | -67.4 | 165.8 | 0 | 0 | 0 | 110 | C136 K137 K142 K143 M144 | C136-I140 WeakPolarHBondContact O-CG1 3.33Å; C136-I140 PolarHBondContact O-N 3.25Å; K137-I140 PolarHBondContact O-N 3.06Å; I140-K142 VanDerWaalsContact C-N 3.35Å; I140-K142 PolarHBondContact O-N 3.44Å; I140-K143 PolarHBondContact O-N 2.84Å; I140-M144 HydrophobicContact CG2-CG 4.49Å; I140-M144 HydrophobicContact CG2-SD 4.19Å; I140-M144 WeakPolarHBondContact O-CG 3.36Å; I140-M144 PolarHBondContact O-N 3.11Å |
| 141 | L | 89.5 | Confident | 89.9 | Confident | 96 Ų | 96 | 108.2 Ų | 108.2 | 50% | 0.503 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62.4 | -41 | 178.9 | -175.6 | 61.7 | 0 | 0 | 0 | 112.3 | K137 R138 N139 M144 K145 | K137-L141 WeakPolarHBondContact O-CB 3.48Å; K137-L141 PolarHBondContact O-N 2.72Å; R138-L141 PolarHBondContact O-N 2.95Å; N139-L141 VanDerWaalsContact C-N 3.34Å; N139-L141 PolarHBondContact O-N 3.38Å; L141-M144 PolarHBondContact O-N 2.85Å; L141-K145 WeakPolarHBondContact O-CG 3.29Å; L141-K145 PolarHBondContact O-N 3.2Å |
| 142 | K | 92.1 | Very high | 89.8 | Confident | 113 Ų | 113 | 108.9 Ų | 108.9 | 49% | 0.491 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -59.9 | -45.1 | 173.6 | -79.2 | 179.5 | 174.6 | -173.4 | 0 | 111.7 | R138 N139 I140 K145 L146 | R138-K142 WeakPolarHBondContact O-CG 3.46Å; R138-K142 PolarHBondContact O-N 3.02Å; N139-K142 PolarHBondContact O-N 3.08Å; I140-K142 VanDerWaalsContact C-N 3.35Å; I140-K142 PolarHBondContact O-N 3.44Å; K142-K145 PolarHBondContact O-N 2.9Å; K142-L146 WeakPolarHBondContact O-CB 3.12Å; K142-L146 PolarHBondContact O-N 2.64Å |
| 143 | K | 90.6 | Very high | 89.8 | Confident | 143 Ų | 143 | 106.3 Ų | 106.3 | 62% | 0.622 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -61.2 | -46.6 | 177.4 | -172.4 | -179.4 | 177.2 | -175.2 | 0 | 111.3 | N139 I140 K145 L146 D147 | N139-K143 PolarHBondContact O-N 2.88Å; I140-K143 PolarHBondContact O-N 2.84Å; K143-K145 VanDerWaalsContact C-N 3.34Å; K143-K145 PolarHBondContact O-N 2.92Å; K143-L146 PolarHBondContact O-N 2.95Å; K143-D147 PolarHBondContact O-N 3.33Å |
| 144 | M | 89.4 | Confident | 89.6 | Confident | 124 Ų | 124 | 104.7 Ų | 104.7 | 61% | 0.611 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -59.9 | -41.5 | 176.4 | -69.8 | 179.2 | 72.5 | 0 | 0 | 112.7 | I140 L141 R148 | I140-M144 HydrophobicContact CG2-CG 4.49Å; I140-M144 HydrophobicContact CG2-SD 4.19Å; I140-M144 WeakPolarHBondContact O-CG 3.36Å; I140-M144 PolarHBondContact O-N 3.11Å; L141-M144 PolarHBondContact O-N 2.85Å; M144-R148 WeakPolarHBondContact O-CB 3.42Å; M144-R148 PolarHBondContact O-N 3.45Å |
| 145 | K | 90.1 | Very high | 89.6 | Confident | 124 Ų | 124 | 103.7 Ų | 103.7 | 54% | 0.539 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.5 | -47 | 175.3 | -76.2 | -176.8 | 175.7 | -170.5 | 0 | 111.5 | L141 K142 K143 D147 R148 E149 | L141-K145 WeakPolarHBondContact O-CG 3.29Å; L141-K145 PolarHBondContact O-N 3.2Å; K142-K145 PolarHBondContact O-N 2.9Å; K143-K145 VanDerWaalsContact C-N 3.34Å; K143-K145 PolarHBondContact O-N 2.92Å; K145-D147 PolarHBondContact O-N 3Å; K145-R148 WeakPolarHBondContact O-CB 3.37Å; K145-R148 PolarHBondContact O-N 2.59Å; K145-E149 WeakPolarHBondContact O-CG 3.44Å; K145-E149 PolarHBondContact O-N 2.98Å |
| 146 | L | 86.4 | Confident | 89.7 | Confident | 84 Ų | 84 | 104.4 Ų | 104.4 | 44% | 0.44 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.9 | -38.6 | 179.9 | -176.2 | 138 | 0 | 0 | 0 | 112.3 | K142 K143 E149 K150 | K142-L146 WeakPolarHBondContact O-CB 3.12Å; K142-L146 PolarHBondContact O-N 2.64Å; K143-L146 PolarHBondContact O-N 2.95Å; L146-E149 PolarHBondContact O-N 3.2Å; L146-K150 HydrophobicContact CD2-CD 4.22Å; L146-K150 WeakPolarHBondContact O-CG 3.41Å; L146-K150 PolarHBondContact O-N 3.03Å |
| 147 | D | 84.6 | Confident | 89.7 | Confident | 64 Ų | 64 | 109.1 Ų | 109.1 | 34% | 0.342 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -70.2 | -34.3 | 175.4 | -70 | -24.3 | 0 | 0 | 0 | 112.2 | K143 K145 K150 T151 | K143-D147 PolarHBondContact O-N 3.33Å; K145-D147 PolarHBondContact O-N 3Å; D147-K150 IonicContact OD1-NZ 3.19Å; D147-K150 PolarHBondContact OD1-NZ 2.89Å; D147-T151 PolarHBondContact O-N 2.84Å; D147-T151 VanDerWaalsContact O-N 3.1Å; D147-T151 PolarHBondContact O-OG1 2.84Å |
| 148 | R | 85.9 | Confident | 89.7 | Confident | 186 Ų | 186 | 110.3 Ų | 110.3 | 70% | 0.702 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -64.9 | -44.1 | 170.4 | -171.7 | 178.5 | -177.1 | 165.5 | 1 | 111.7 | M144 K145 T151 I152 | M144-R148 WeakPolarHBondContact O-CB 3.42Å; M144-R148 PolarHBondContact O-N 3.45Å; K145-R148 WeakPolarHBondContact O-CB 3.37Å; K145-R148 PolarHBondContact O-N 2.59Å; R148-T151 WeakPolarHBondContact O-CB 3.29Å; R148-T151 PolarHBondContact O-N 3.45Å; R148-I152 HydrophobicContact CG-CD1 4.11Å; R148-I152 WeakPolarHBondContact O-CG1 3.42Å; R148-I152 PolarHBondContact O-N 3.4Å |
| 149 | E | 85.1 | Confident | 89.9 | Confident | 122 Ų | 122 | 107.7 Ų | 107.7 | 57% | 0.57 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -60.6 | -43.7 | 176.1 | -76.2 | 167.7 | -164.9 | 0 | 0 | 111.7 | K145 L146 T151 I152 E153 | K145-E149 WeakPolarHBondContact O-CG 3.44Å; K145-E149 PolarHBondContact O-N 2.98Å; L146-E149 PolarHBondContact O-N 3.2Å; E149-T151 VanDerWaalsContact C-N 3.29Å; E149-T151 PolarHBondContact O-N 2.66Å; E149-I152 PolarHBondContact O-N 3.32Å; E149-E153 WeakPolarHBondContact O-CB 3.49Å; E149-E153 PolarHBondContact O-N 2.9Å |
| 150 | K | 85.8 | Confident | 90.1 | Very high | 123 Ų | 123 | 108.9 Ų | 108.9 | 54% | 0.535 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -57.7 | -41.4 | 172.7 | -73.4 | 172 | -174 | 159.4 | 0 | 112.6 | L146 D147 E153 A154 | L146-K150 HydrophobicContact CD2-CD 4.22Å; L146-K150 WeakPolarHBondContact O-CG 3.41Å; L146-K150 PolarHBondContact O-N 3.03Å; D147-K150 IonicContact OD1-NZ 3.19Å; D147-K150 PolarHBondContact OD1-NZ 2.89Å; K150-E153 PolarHBondContact O-N 3.23Å; K150-A154 WeakPolarHBondContact O-CB 3.37Å; K150-A154 PolarHBondContact O-N 3.45Å |
| 151 | T | 85 | Confident | 90.2 | Very high | 105 Ų | 105 | 108.8 Ų | 108.8 | 64% | 0.644 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -66.5 | -40.7 | 178.7 | -55 | 0 | 0 | 0 | 0 | 111.1 | D147 R148 E149 G155 | D147-T151 PolarHBondContact O-N 2.84Å; D147-T151 VanDerWaalsContact O-N 3.1Å; D147-T151 PolarHBondContact O-OG1 2.84Å; R148-T151 WeakPolarHBondContact O-CB 3.29Å; R148-T151 PolarHBondContact O-N 3.45Å; E149-T151 VanDerWaalsContact C-N 3.29Å; E149-T151 PolarHBondContact O-N 2.66Å; T151-G155 PolarHBondContact O-N 2.94Å |
| 152 | I | 89 | Confident | 90.5 | Very high | 88 Ų | 88 | 111.8 Ų | 111.8 | 45% | 0.451 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -63.6 | -47.6 | 175 | -68.4 | 165.8 | 0 | 0 | 0 | 110.4 | R148 E149 A154 G155 I156 | R148-I152 HydrophobicContact CG-CD1 4.11Å; R148-I152 WeakPolarHBondContact O-CG1 3.42Å; R148-I152 PolarHBondContact O-N 3.4Å; E149-I152 PolarHBondContact O-N 3.32Å; I152-A154 VanDerWaalsContact C-N 3.34Å; I152-A154 PolarHBondContact O-N 2.96Å; I152-G155 PolarHBondContact O-N 3.39Å; I152-G155 VanDerWaalsContact O-N 3.11Å; I152-I156 HydrophobicContact CG2-CD1 3.77Å; I152-I156 HydrophobicContact CG2-CG1 4.33Å; I152-I156 WeakPolarHBondContact O-CG1 3.39Å; I152-I156 PolarHBondContact O-N 3.17Å |
| 153 | E | 90.7 | Very high | 90.7 | Very high | 97 Ų | 97 | 110 Ų | 110 | 45% | 0.453 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -60.6 | -42 | 178.8 | 179.5 | 57.6 | -152.7 | 0 | 0 | 111.9 | E149 K150 G155 I156 R157 | E149-E153 WeakPolarHBondContact O-CB 3.49Å; E149-E153 PolarHBondContact O-N 2.9Å; K150-E153 PolarHBondContact O-N 3.23Å; E153-G155 VanDerWaalsContact C-N 3.35Å; E153-G155 PolarHBondContact O-N 3.32Å; E153-I156 PolarHBondContact O-N 3.21Å; E153-R157 WeakPolarHBondContact O-CB 3.29Å; E153-R157 PolarHBondContact O-N 3.03Å; E153-R157 IonicContact OE1-NH2 2.53Å |
| 154 | A | 88.2 | Confident | 91 | Very high | 59 Ų | 59 | 108.6 Ų | 108.6 | 49% | 0.488 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -61.3 | -42.6 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | K150 I152 R157 Q158 | K150-A154 WeakPolarHBondContact O-CB 3.37Å; K150-A154 PolarHBondContact O-N 3.45Å; I152-A154 VanDerWaalsContact C-N 3.34Å; I152-A154 PolarHBondContact O-N 2.96Å; A154-R157 PolarHBondContact O-N 3.36Å; A154-Q158 PolarHBondContact O-N 3.01Å |
| 155 | G | 92 | Very high | 91.2 | Very high | 35 Ų | 35 | 109.3 Ų | 109.3 | 36% | 0.361 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64 | -43.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | T151 I152 E153 R157 Q158 L159 | T151-G155 PolarHBondContact O-N 2.94Å; I152-G155 PolarHBondContact O-N 3.39Å; I152-G155 VanDerWaalsContact O-N 3.11Å; E153-G155 VanDerWaalsContact C-N 3.35Å; E153-G155 PolarHBondContact O-N 3.32Å; G155-R157 VanDerWaalsContact C-N 3.35Å; G155-Q158 PolarHBondContact O-N 3.05Å; G155-L159 PolarHBondContact O-N 2.78Å |
| 156 | I | 94.6 | Very high | 91.5 | Very high | 98 Ų | 98 | 107.8 Ų | 107.8 | 50% | 0.503 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62 | -44.4 | 175.8 | -68.6 | 170.1 | 0 | 0 | 0 | 110.3 | I152 E153 Q158 L159 K160 | I152-I156 HydrophobicContact CG2-CD1 3.77Å; I152-I156 HydrophobicContact CG2-CG1 4.33Å; I152-I156 WeakPolarHBondContact O-CG1 3.39Å; I152-I156 PolarHBondContact O-N 3.17Å; E153-I156 PolarHBondContact O-N 3.21Å; I156-Q158 PolarHBondContact O-N 3.4Å; I156-L159 PolarHBondContact O-N 3.31Å; I156-K160 PolarHBondContact O-N 3.4Å |
| 157 | R | 93.4 | Very high | 91.9 | Very high | 153 Ų | 153 | 110.1 Ų | 110.1 | 58% | 0.577 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -61.6 | -43.4 | 177.4 | -172.6 | 178.4 | -61.1 | -139.7 | -2.9 | 112.2 | E153 A154 G155 L159 K160 N161 | E153-R157 WeakPolarHBondContact O-CB 3.29Å; E153-R157 PolarHBondContact O-N 3.03Å; E153-R157 IonicContact OE1-NH2 2.53Å; A154-R157 PolarHBondContact O-N 3.36Å; G155-R157 VanDerWaalsContact C-N 3.35Å; R157-L159 VanDerWaalsContact C-N 3.33Å; R157-L159 PolarHBondContact O-N 3.09Å; R157-K160 PolarHBondContact O-N 2.96Å; R157-N161 PolarHBondContact O-N 2.93Å; R157-N161 PolarHBondContact O-OD1 3.29Å |
| 158 | Q | 93.8 | Very high | 92.4 | Very high | 149 Ų | 149 | 109.1 Ų | 109.1 | 70% | 0.696 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -61.5 | -43.2 | 175.6 | -174.1 | -179.1 | 7.4 | 0 | 0 | 111.5 | A154 G155 I156 K160 N161 R162 | A154-Q158 PolarHBondContact O-N 3.01Å; G155-Q158 PolarHBondContact O-N 3.05Å; I156-Q158 PolarHBondContact O-N 3.4Å; Q158-K160 VanDerWaalsContact C-N 3.34Å; Q158-N161 PolarHBondContact O-N 3.21Å; Q158-R162 PolarHBondContact O-N 3.39Å; Q158-R162 VanDerWaalsContact O-N 3.12Å |
| 159 | L | 96.9 | Very high | 92.9 | Very high | 105 Ų | 105 | 103.4 Ų | 103.4 | 55% | 0.55 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.2 | -41.3 | 176.9 | -177.4 | 60.4 | 0 | 0 | 0 | 111.7 | G155 I156 R157 R162 L163 | G155-L159 PolarHBondContact O-N 2.78Å; I156-L159 PolarHBondContact O-N 3.31Å; R157-L159 VanDerWaalsContact C-N 3.33Å; R157-L159 PolarHBondContact O-N 3.09Å; L159-R162 PolarHBondContact O-N 2.95Å; L159-L163 HydrophobicContact CG-CD1 4.29Å; L159-L163 WeakPolarHBondContact O-CG 3.5Å; L159-L163 PolarHBondContact O-N 3.33Å |
| 160 | K | 96.8 | Very high | 93.3 | Very high | 123 Ų | 123 | 103 Ų | 103 | 54% | 0.535 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -59.7 | -48.2 | 175.9 | -175.5 | -176.7 | 173.1 | -173.3 | 0 | 111.8 | I156 R157 Q158 R162 L163 E164 | I156-K160 PolarHBondContact O-N 3.4Å; R157-K160 PolarHBondContact O-N 2.96Å; Q158-K160 VanDerWaalsContact C-N 3.34Å; K160-R162 VanDerWaalsContact C-N 3.3Å; K160-R162 PolarHBondContact O-N 3.42Å; K160-L163 WeakPolarHBondContact O-CB 3.43Å; K160-L163 PolarHBondContact O-N 2.95Å; K160-L163 VanDerWaalsContact O-N 3.15Å; K160-E164 VanDerWaalsContact CE-OE1 3.26Å; K160-E164 WeakPolarHBondContact CE-OE1 3.37Å; K160-E164 IonicContact NZ-OE1 2.64Å; K160-E164 PolarHBondContact O-N 2.82Å |
| 161 | N | 94.8 | Very high | 93.7 | Very high | 93 Ų | 93 | 102.9 Ų | 102.9 | 50% | 0.497 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -60.1 | -42.1 | 178.9 | -68.8 | -1.5 | 0 | 0 | 0 | 111.6 | R157 Q158 L163 E164 E165 | R157-N161 PolarHBondContact O-N 2.93Å; R157-N161 PolarHBondContact O-OD1 3.29Å; Q158-N161 PolarHBondContact O-N 3.21Å; N161-L163 VanDerWaalsContact C-N 3.34Å; N161-L163 PolarHBondContact O-N 3.5Å; N161-E164 PolarHBondContact O-N 3.18Å; N161-E165 PolarHBondContact O-N 3.45Å |
| 162 | R | 95.9 | Very high | 94.1 | Very high | 159 Ų | 159 | 100.2 Ų | 100.2 | 60% | 0.6 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -64.7 | -37.8 | 176.7 | -176.2 | 179.2 | 168.2 | -171.5 | -2.8 | 112.3 | Q158 L159 K160 M166 | Q158-R162 PolarHBondContact O-N 3.39Å; Q158-R162 VanDerWaalsContact O-N 3.12Å; L159-R162 PolarHBondContact O-N 2.95Å; K160-R162 VanDerWaalsContact C-N 3.3Å; K160-R162 PolarHBondContact O-N 3.42Å; R162-M166 HydrophobicContact CG-CE 4.39Å; R162-M166 WeakPolarHBondContact O-CG 3.33Å; R162-M166 PolarHBondContact O-N 2.85Å; R162-M166 VanDerWaalsContact O-N 3.09Å |
| 163 | L | 96.4 | Very high | 94.4 | Very high | 77 Ų | 77 | 99.9 Ų | 99.9 | 40% | 0.403 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.7 | -46.6 | 174.4 | -77.7 | 166.1 | 0 | 0 | 0 | 111.2 | L159 K160 N161 E165 M166 F167 | L159-L163 HydrophobicContact CG-CD1 4.29Å; L159-L163 WeakPolarHBondContact O-CG 3.5Å; L159-L163 PolarHBondContact O-N 3.33Å; K160-L163 WeakPolarHBondContact O-CB 3.43Å; K160-L163 PolarHBondContact O-N 2.95Å; K160-L163 VanDerWaalsContact O-N 3.15Å; N161-L163 VanDerWaalsContact C-N 3.34Å; N161-L163 PolarHBondContact O-N 3.5Å; L163-E165 VanDerWaalsContact C-N 3.32Å; L163-E165 PolarHBondContact O-N 3.46Å; L163-M166 HydrophobicContact CD2-CE 3.71Å; L163-M166 HydrophobicContact CG-CE 4.33Å; L163-M166 PolarHBondContact O-N 2.89Å; L163-F167 VanDerWaalsContact O-CD2 3.22Å; L163-F167 WeakPolarHBondContact O-CD2 3.37Å; L163-F167 PolarHBondContact O-N 3.46Å |
| 164 | E | 95.5 | Very high | 94.4 | Very high | 112 Ų | 112 | 97.1 Ų | 97.1 | 52% | 0.523 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -58.1 | -42.2 | 176.4 | -84 | 172 | -174.1 | 0 | 0 | 112.2 | K160 N161 F167 G168 | K160-E164 VanDerWaalsContact CE-OE1 3.26Å; K160-E164 WeakPolarHBondContact CE-OE1 3.37Å; K160-E164 IonicContact NZ-OE1 2.64Å; K160-E164 PolarHBondContact O-N 2.82Å; N161-E164 PolarHBondContact O-N 3.18Å; E164-F167 PolarHBondContact O-N 2.79Å; E164-G168 PolarHBondContact O-N 3.48Å |
| 165 | E | 95.1 | Very high | 94.6 | Very high | 139 Ų | 139 | 100 Ų | 100 | 65% | 0.65 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -62.8 | -44.1 | 175.9 | -174.1 | -177.4 | 179.9 | 0 | 0 | 112.6 | N161 L163 G168 S169 | N161-E165 PolarHBondContact O-N 3.45Å; L163-E165 VanDerWaalsContact C-N 3.32Å; L163-E165 PolarHBondContact O-N 3.46Å; E165-G168 PolarHBondContact O-N 2.9Å; E165-S169 WeakPolarHBondContact O-CB 3.28Å; E165-S169 PolarHBondContact O-N 3.5Å; E165-S169 PolarHBondContact O-OG 2.68Å |
| 166 | M | 96.4 | Very high | 94.7 | Very high | 92 Ų | 92 | 104.6 Ų | 104.6 | 45% | 0.453 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -64.7 | -39.9 | 176.2 | -71.5 | -173.9 | -56.6 | 0 | 0 | 111.7 | R162 L163 S169 L170 | R162-M166 HydrophobicContact CG-CE 4.39Å; R162-M166 WeakPolarHBondContact O-CG 3.33Å; R162-M166 PolarHBondContact O-N 2.85Å; R162-M166 VanDerWaalsContact O-N 3.09Å; L163-M166 HydrophobicContact CD2-CE 3.71Å; L163-M166 HydrophobicContact CG-CE 4.33Å; L163-M166 PolarHBondContact O-N 2.89Å; M166-S169 PolarHBondContact O-N 3.34Å; M166-L170 WeakPolarHBondContact O-CB 3.41Å; M166-L170 PolarHBondContact O-N 2.93Å |
| 167 | F | 95.1 | Very high | 94.5 | Very high | 133 Ų | 133 | 104.3 Ų | 104.3 | 58% | 0.583 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -63.5 | -44.6 | 174.5 | -88.5 | -70.1 | 0 | 0 | 0 | 111.8 | L163 E164 S169 L170 M171 | L163-F167 VanDerWaalsContact O-CD2 3.22Å; L163-F167 WeakPolarHBondContact O-CD2 3.37Å; L163-F167 PolarHBondContact O-N 3.46Å; E164-F167 PolarHBondContact O-N 2.79Å; F167-S169 VanDerWaalsContact C-N 3.32Å; F167-S169 PolarHBondContact O-N 3.32Å; F167-L170 PolarHBondContact O-N 3.42Å; F167-M171 WeakPolarHBondContact O-CG 3.26Å; F167-M171 PolarHBondContact O-N 3.47Å |
| 168 | G | 95 | Very high | 94.4 | Very high | 43 Ų | 43 | 102.6 Ų | 102.6 | 44% | 0.443 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -60.4 | -42.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | E164 E165 M171 S172 | E164-G168 PolarHBondContact O-N 3.48Å; E165-G168 PolarHBondContact O-N 2.9Å; G168-M171 PolarHBondContact O-N 3Å; G168-S172 PolarHBondContact O-N 3.36Å |
| 169 | S | 95 | Very high | 94.2 | Very high | 67 Ų | 67 | 97.5 Ų | 97.5 | 47% | 0.469 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63 | -42.8 | 175.5 | -59.2 | 0 | 0 | 0 | 0 | 112 | E165 M166 F167 S172 V173 | E165-S169 WeakPolarHBondContact O-CB 3.28Å; E165-S169 PolarHBondContact O-N 3.5Å; E165-S169 PolarHBondContact O-OG 2.68Å; M166-S169 PolarHBondContact O-N 3.34Å; F167-S169 VanDerWaalsContact C-N 3.32Å; F167-S169 PolarHBondContact O-N 3.32Å; S169-S172 PolarHBondContact O-N 3.09Å; S169-V173 WeakPolarHBondContact O-CG2 3.31Å; S169-V173 PolarHBondContact O-N 2.93Å |
| 170 | L | 94 | Very high | 93.9 | Very high | 112 Ų | 112 | 96.2 Ų | 96.2 | 59% | 0.586 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -62.7 | -43.5 | 177.1 | -179.5 | 61.5 | 0 | 0 | 0 | 111.7 | M166 F167 V173 G174 | M166-L170 WeakPolarHBondContact O-CB 3.41Å; M166-L170 PolarHBondContact O-N 2.93Å; F167-L170 PolarHBondContact O-N 3.42Å; L170-V173 PolarHBondContact O-N 3.38Å; L170-G174 PolarHBondContact O-N 3.15Å |
| 171 | M | 94 | Very high | 93.5 | Very high | 121 Ų | 121 | 93.1 Ų | 93.1 | 60% | 0.596 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -60.7 | -45 | 175.5 | -70.3 | -58.6 | -61.8 | 0 | 0 | 111.4 | F167 G168 V173 G174 E175 | F167-M171 WeakPolarHBondContact O-CG 3.26Å; F167-M171 PolarHBondContact O-N 3.47Å; G168-M171 PolarHBondContact O-N 3Å; M171-V173 VanDerWaalsContact C-N 3.33Å; M171-V173 PolarHBondContact O-N 2.92Å; M171-G174 WeakPolarHBondContact O-CA 3.5Å; M171-G174 PolarHBondContact O-N 2.92Å; M171-G174 VanDerWaalsContact O-N 3.13Å; M171-E175 WeakPolarHBondContact O-CG 3.35Å; M171-E175 PolarHBondContact O-N 3.27Å |
| 172 | S | 93.7 | Very high | 93.1 | Very high | 49 Ų | 49 | 95.5 Ų | 95.5 | 34% | 0.343 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.8 | -38.8 | 176.8 | -178.1 | 0 | 0 | 0 | 0 | 112.9 | G168 S169 K176 | G168-S172 PolarHBondContact O-N 3.36Å; S169-S172 PolarHBondContact O-N 3.09Å; S172-K176 WeakPolarHBondContact O-CG 3.32Å; S172-K176 PolarHBondContact O-N 3.4Å; S172-K176 VanDerWaalsContact O-N 3.15Å |
| 173 | V | 94.2 | Very high | 92.7 | Very high | 82 Ų | 82 | 92 Ų | 92 | 50% | 0.497 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -67 | -41.5 | 174 | 172.6 | 0 | 0 | 0 | 0 | 110.7 | S169 L170 M171 E175 K176 V177 | S169-V173 WeakPolarHBondContact O-CG2 3.31Å; S169-V173 PolarHBondContact O-N 2.93Å; L170-V173 PolarHBondContact O-N 3.38Å; M171-V173 VanDerWaalsContact C-N 3.33Å; M171-V173 PolarHBondContact O-N 2.92Å; V173-E175 PolarHBondContact O-N 2.93Å; V173-K176 PolarHBondContact O-N 2.89Å; V173-V177 HydrophobicContact CG1-CG2 4.32Å; V173-V177 WeakPolarHBondContact O-CG2 3.4Å; V173-V177 PolarHBondContact O-N 3.3Å |
| 174 | G | 92.6 | Very high | 92.1 | Very high | 38 Ų | 38 | 93.1 Ų | 93.1 | 39% | 0.392 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -56.9 | -47.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | L170 M171 K176 V177 E178 | L170-G174 PolarHBondContact O-N 3.15Å; M171-G174 WeakPolarHBondContact O-CA 3.5Å; M171-G174 PolarHBondContact O-N 2.92Å; M171-G174 VanDerWaalsContact O-N 3.13Å; G174-K176 VanDerWaalsContact C-N 3.33Å; G174-K176 PolarHBondContact O-N 3.47Å; G174-V177 PolarHBondContact O-N 3.03Å; G174-E178 WeakPolarHBondContact O-CB 3.26Å; G174-E178 PolarHBondContact O-N 3.17Å |
| 175 | E | 92.6 | Very high | 91.5 | Very high | 120 Ų | 120 | 93.5 Ų | 93.5 | 56% | 0.561 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -59.9 | -41.7 | 176.4 | -71.7 | 173.4 | -179.5 | 0 | 0 | 112.3 | M171 V173 E178 S179 | M171-E175 WeakPolarHBondContact O-CG 3.35Å; M171-E175 PolarHBondContact O-N 3.27Å; V173-E175 PolarHBondContact O-N 2.93Å; E175-E178 PolarHBondContact O-N 2.64Å; E175-S179 PolarHBondContact O-N 2.93Å |
| 176 | K | 92.3 | Very high | 90.9 | Very high | 131 Ų | 131 | 93.6 Ų | 93.6 | 57% | 0.57 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -66 | -39.3 | 176 | -72.5 | 172.9 | -177.5 | 177.9 | 0 | 112.4 | S172 V173 G174 S179 V180 | S172-K176 WeakPolarHBondContact O-CG 3.32Å; S172-K176 PolarHBondContact O-N 3.4Å; S172-K176 VanDerWaalsContact O-N 3.15Å; V173-K176 PolarHBondContact O-N 2.89Å; G174-K176 VanDerWaalsContact C-N 3.33Å; G174-K176 PolarHBondContact O-N 3.47Å; K176-S179 WeakPolarHBondContact CA-OG 3.15Å; K176-S179 PolarHBondContact O-N 2.86Å; K176-S179 PolarHBondContact O-OG 3.2Å; K176-V180 WeakPolarHBondContact O-CB 3.34Å; K176-V180 VanDerWaalsContact O-CG2 3.24Å; K176-V180 WeakPolarHBondContact O-CG2 3.41Å; K176-V180 PolarHBondContact O-N 2.91Å |
| 177 | V | 91.5 | Very high | 90.1 | Very high | 93 Ų | 93 | 95.7 Ų | 95.7 | 56% | 0.564 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -66.6 | -42.2 | 176.7 | 170.4 | 0 | 0 | 0 | 0 | 110.2 | V173 G174 S179 V180 S181 | V173-V177 HydrophobicContact CG1-CG2 4.32Å; V173-V177 WeakPolarHBondContact O-CG2 3.4Å; V173-V177 PolarHBondContact O-N 3.3Å; G174-V177 PolarHBondContact O-N 3.03Å; V177-S179 PolarHBondContact O-N 3.09Å; V177-V180 PolarHBondContact O-N 2.81Å; V177-S181 WeakPolarHBondContact O-CB 3.35Å; V177-S181 PolarHBondContact O-N 3.32Å |
| 178 | E | 90.5 | Very high | 89.3 | Confident | 116 Ų | 116 | 92.2 Ų | 92.2 | 54% | 0.542 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.1 | -37.8 | 176.7 | -172.1 | 178.8 | -173.8 | 0 | 0 | 112.3 | G174 E175 S181 R182 | G174-E178 WeakPolarHBondContact O-CB 3.26Å; G174-E178 PolarHBondContact O-N 3.17Å; E175-E178 PolarHBondContact O-N 2.64Å; E178-S181 PolarHBondContact O-N 2.9Å; E178-R182 PolarHBondContact O-N 3.27Å; E178-R182 VanDerWaalsContact O-N 3.07Å; E178-R182 PolarHBondContact O-NE 3.42Å |
| 179 | S | 89.9 | Confident | 88.3 | Confident | 43 Ų | 43 | 93.4 Ų | 93.4 | 30% | 0.301 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65.8 | -45.7 | 174 | 69.8 | 0 | 0 | 0 | 0 | 111.6 | E175 K176 V177 S181 R182 D183 | E175-S179 PolarHBondContact O-N 2.93Å; K176-S179 WeakPolarHBondContact CA-OG 3.15Å; K176-S179 PolarHBondContact O-N 2.86Å; K176-S179 PolarHBondContact O-OG 3.2Å; V177-S179 PolarHBondContact O-N 3.09Å; S179-S181 VanDerWaalsContact C-N 3.3Å; S179-S181 PolarHBondContact O-N 3.38Å; S179-R182 PolarHBondContact O-N 3.4Å; S179-D183 VanDerWaalsContact O-CG 3.29Å; S179-D183 PolarHBondContact O-N 3.26Å |
| 180 | V | 90.4 | Very high | 87 | Confident | 78 Ų | 78 | 92 Ų | 92 | 47% | 0.473 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.2 | -39.1 | 177.1 | 170.3 | 0 | 0 | 0 | 0 | 111.2 | K176 V177 D183 I184 | K176-V180 WeakPolarHBondContact O-CB 3.34Å; K176-V180 VanDerWaalsContact O-CG2 3.24Å; K176-V180 WeakPolarHBondContact O-CG2 3.41Å; K176-V180 PolarHBondContact O-N 2.91Å; V177-V180 PolarHBondContact O-N 2.81Å; V180-D183 PolarHBondContact O-N 2.85Å; V180-I184 HydrophobicContact CG1-CD1 3.82Å; V180-I184 HydrophobicContact CG1-CG1 4.41Å; V180-I184 VanDerWaalsContact O-CG1 3.25Å; V180-I184 WeakPolarHBondContact O-CG1 3.1Å; V180-I184 PolarHBondContact O-N 3.45Å |
| 181 | S | 89.9 | Confident | 85.5 | Confident | 57 Ų | 57 | 90 Ų | 90 | 40% | 0.399 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -61.6 | -45.5 | 175.7 | -163.4 | 0 | 0 | 0 | 0 | 111.5 | V177 E178 S179 D183 I184 E185 | V177-S181 WeakPolarHBondContact O-CB 3.35Å; V177-S181 PolarHBondContact O-N 3.32Å; E178-S181 PolarHBondContact O-N 2.9Å; S179-S181 VanDerWaalsContact C-N 3.3Å; S179-S181 PolarHBondContact O-N 3.38Å; S181-D183 VanDerWaalsContact C-N 3.34Å; S181-D183 PolarHBondContact O-N 2.83Å; S181-I184 PolarHBondContact O-N 3.23Å; S181-E185 WeakPolarHBondContact O-CG 3.21Å; S181-E185 PolarHBondContact O-N 3.45Å |
| 182 | R | 85 | Confident | 83.7 | Confident | 144 Ų | 144 | 90.7 Ų | 90.7 | 54% | 0.543 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.2 | -39.6 | 175.9 | -78.9 | -175.7 | -79.5 | 158.9 | -10.5 | 112.4 | E178 S179 E185 F186 | E178-R182 PolarHBondContact O-N 3.27Å; E178-R182 VanDerWaalsContact O-N 3.07Å; E178-R182 PolarHBondContact O-NE 3.42Å; S179-R182 PolarHBondContact O-N 3.4Å; R182-E185 PolarHBondContact O-N 2.81Å; R182-F186 WeakPolarHBondContact O-CB 3.36Å; R182-F186 PolarHBondContact O-N 2.89Å |
| 183 | D | 86.8 | Confident | 81.9 | Confident | 86 Ų | 86 | 93.9 Ų | 93.9 | 46% | 0.46 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.3 | -44.2 | 175.9 | -69.1 | -18.6 | 0 | 0 | 0 | 110.8 | S179 V180 S181 E185 F186 F187 | S179-D183 VanDerWaalsContact O-CG 3.29Å; S179-D183 PolarHBondContact O-N 3.26Å; V180-D183 PolarHBondContact O-N 2.85Å; S181-D183 VanDerWaalsContact C-N 3.34Å; S181-D183 PolarHBondContact O-N 2.83Å; D183-E185 PolarHBondContact O-N 3.37Å; D183-F186 WeakPolarHBondContact O-CB 3.29Å; D183-F186 PolarHBondContact O-N 3.27Å; D183-F187 HydrophobicContact CB-CD2 4.36Å; D183-F187 HydrophobicContact CB-CE2 4.12Å; D183-F187 WeakPolarHBondContact O-CD2 3.32Å; D183-F187 WeakPolarHBondContact O-CG 3.33Å; D183-F187 PolarHBondContact O-N 2.87Å |
| 184 | I | 84.1 | Confident | 79.9 | Confident | 99 Ų | 99 | 98.2 Ų | 98.2 | 51% | 0.508 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.4 | -44 | 176.6 | -68.8 | 164.8 | 0 | 0 | 0 | 111.3 | V180 S181 F186 F187 S188 | V180-I184 HydrophobicContact CG1-CD1 3.82Å; V180-I184 HydrophobicContact CG1-CG1 4.41Å; V180-I184 VanDerWaalsContact O-CG1 3.25Å; V180-I184 WeakPolarHBondContact O-CG1 3.1Å; V180-I184 PolarHBondContact O-N 3.45Å; S181-I184 PolarHBondContact O-N 3.23Å; I184-F186 VanDerWaalsContact C-N 3.33Å; I184-F186 PolarHBondContact O-N 3.48Å; I184-F187 PolarHBondContact O-N 3.36Å; I184-S188 WeakPolarHBondContact O-CB 3.27Å; I184-S188 PolarHBondContact O-N 2.83Å; I184-S188 PolarHBondContact O-OG 2.86Å |
| 185 | E | 83.8 | Confident | 77.8 | Confident | 121 Ų | 121 | 99.6 Ų | 99.6 | 57% | 0.565 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -62.3 | -40.9 | 176.1 | -74.3 | 174.6 | -167.7 | 0 | 0 | 111.7 | S181 R182 D183 S188 S189 | S181-E185 WeakPolarHBondContact O-CG 3.21Å; S181-E185 PolarHBondContact O-N 3.45Å; R182-E185 PolarHBondContact O-N 2.81Å; D183-E185 PolarHBondContact O-N 3.37Å; E185-S188 PolarHBondContact O-N 2.96Å; E185-S189 WeakPolarHBondContact O-CB 3.49Å; E185-S189 PolarHBondContact O-N 2.88Å; E185-S189 PolarHBondContact O-OG 2.92Å |
| 186 | F | 81.6 | Confident | 75.6 | Confident | 140 Ų | 140 | 98.6 Ų | 98.6 | 61% | 0.614 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -64.3 | -46.6 | 175.7 | -178.1 | -97.3 | 0 | 0 | 0 | 112.1 | R182 D183 I184 S188 S189 A190 | R182-F186 WeakPolarHBondContact O-CB 3.36Å; R182-F186 PolarHBondContact O-N 2.89Å; D183-F186 WeakPolarHBondContact O-CB 3.29Å; D183-F186 PolarHBondContact O-N 3.27Å; I184-F186 VanDerWaalsContact C-N 3.33Å; I184-F186 PolarHBondContact O-N 3.48Å; F186-S188 VanDerWaalsContact C-N 3.33Å; F186-S188 PolarHBondContact O-N 3.25Å; F186-S189 PolarHBondContact O-N 3.3Å; F186-A190 WeakPolarHBondContact O-CB 3.45Å; F186-A190 PolarHBondContact O-N 3.43Å |
| 187 | F | 80.9 | Confident | 73.1 | Confident | 136 Ų | 136 | 99.7 Ų | 99.7 | 60% | 0.596 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -65.4 | -36.3 | 177.6 | -73 | -60 | 0 | 0 | 0 | 112.4 | D183 I184 A190 S191 | D183-F187 HydrophobicContact CB-CD2 4.36Å; D183-F187 HydrophobicContact CB-CE2 4.12Å; D183-F187 WeakPolarHBondContact O-CD2 3.32Å; D183-F187 WeakPolarHBondContact O-CG 3.33Å; D183-F187 PolarHBondContact O-N 2.87Å; I184-F187 PolarHBondContact O-N 3.36Å; F187-A190 PolarHBondContact O-N 3.31Å; F187-S191 WeakPolarHBondContact O-CB 3.15Å; F187-S191 PolarHBondContact O-N 2.81Å; F187-S191 PolarHBondContact O-OG 2.84Å |
| 188 | S | 76.8 | Confident | 70.7 | Confident | 61 Ų | 61 | 103.9 Ų | 103.9 | 43% | 0.427 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -63.4 | -48 | 175.7 | -58.2 | 0 | 0 | 0 | 0 | 110.5 | I184 E185 F186 A190 S191 E192 | I184-S188 WeakPolarHBondContact O-CB 3.27Å; I184-S188 PolarHBondContact O-N 2.83Å; I184-S188 PolarHBondContact O-OG 2.86Å; E185-S188 PolarHBondContact O-N 2.96Å; F186-S188 VanDerWaalsContact C-N 3.33Å; F186-S188 PolarHBondContact O-N 3.25Å; S188-A190 PolarHBondContact O-N 2.9Å; S188-S191 PolarHBondContact O-N 2.63Å; S188-S191 PolarHBondContact O-OG 3.26Å; S188-E192 PolarHBondContact O-N 2.89Å |
| 189 | S | 75.5 | Confident | 68.2 | Low | 67 Ų | 67 | 105.5 Ų | 105.5 | 47% | 0.469 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -62.9 | -40.7 | 176.9 | -54.6 | 0 | 0 | 0 | 0 | 112.4 | E185 F186 E192 I193 | E185-S189 WeakPolarHBondContact O-CB 3.49Å; E185-S189 PolarHBondContact O-N 2.88Å; E185-S189 PolarHBondContact O-OG 2.92Å; F186-S189 PolarHBondContact O-N 3.3Å; S189-E192 PolarHBondContact O-N 3.23Å; S189-I193 WeakPolarHBondContact O-CG1 3.44Å |
| 190 | A | 68.2 | Low | 66 | Low | 37 Ų | 37 | 109.2 Ų | 109.2 | 31% | 0.306 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -69.6 | -31.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | F186 F187 S188 | F186-A190 WeakPolarHBondContact O-CB 3.45Å; F186-A190 PolarHBondContact O-N 3.43Å; F187-A190 PolarHBondContact O-N 3.31Å; S188-A190 PolarHBondContact O-N 2.9Å |
| 191 | S | 61.3 | Low | 63.5 | Low | 72 Ų | 72 | 113.6 Ų | 113.6 | 50% | 0.503 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -69.6 | -35.8 | 176.5 | 75.2 | 0 | 0 | 0 | 0 | 112.2 | F187 S188 I193 K194 S195 | F187-S191 WeakPolarHBondContact O-CB 3.15Å; F187-S191 PolarHBondContact O-N 2.81Å; F187-S191 PolarHBondContact O-OG 2.84Å; S188-S191 PolarHBondContact O-N 2.63Å; S188-S191 PolarHBondContact O-OG 3.26Å; S191-I193 VanDerWaalsContact C-N 3.31Å; S191-I193 PolarHBondContact O-N 3.5Å; S191-K194 PolarHBondContact O-N 3.4Å; S191-S195 PolarHBondContact O-N 2.86Å; S191-S195 PolarHBondContact O-OG 3.21Å |
| 192 | E | 56.9 | Low | 61.1 | Low | 135 Ų | 135 | 115.9 Ų | 115.9 | 63% | 0.631 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -61.6 | -39.7 | 178.9 | -121.3 | 176.6 | 177.5 | 0 | 0 | 111.9 | S188 S189 K194 S195 T196 | S188-E192 PolarHBondContact O-N 2.89Å; S189-E192 PolarHBondContact O-N 3.23Å; E192-K194 VanDerWaalsContact C-N 3.35Å; E192-K194 PolarHBondContact O-N 3.44Å; E192-S195 PolarHBondContact O-N 3.38Å; E192-S195 PolarHBondContact O-OG 2.89Å; E192-S195 VanDerWaalsContact O-OG 3.04Å; E192-T196 PolarHBondContact O-N 3.01Å; E192-T196 PolarHBondContact O-OG1 3.49Å |
| 193 | I | 54.8 | Low | 58.9 | Low | 116 Ų | 116 | 115.2 Ų | 115.2 | 60% | 0.595 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -66 | -37.3 | 179.6 | -55.2 | 165.4 | 0 | 0 | 0 | 111.1 | S189 S191 T196 | S189-I193 WeakPolarHBondContact O-CG1 3.44Å; S191-I193 VanDerWaalsContact C-N 3.31Å; S191-I193 PolarHBondContact O-N 3.5Å; I193-T196 PolarHBondContact O-OG1 2.85Å |
| 194 | K | 52 | Low | 56.4 | Low | 172 Ų | 172 | 118.5 Ų | 118.5 | 75% | 0.748 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -76.2 | -27.3 | 179.7 | -73.4 | -175.7 | 179.3 | 178.7 | 0 | 113.4 | S191 E192 | S191-K194 PolarHBondContact O-N 3.4Å; E192-K194 VanDerWaalsContact C-N 3.35Å; E192-K194 PolarHBondContact O-N 3.44Å |
| 195 | S | 49.3 | Very low | 54.2 | Low | 68 Ų | 68 | 121 Ų | 121 | 48% | 0.476 | 64% | 0.643 | S | S | . | * | H | α-helix | trans | -80.2 | -27.4 | -179.7 | 50.3 | 0 | 0 | 0 | 0 | 114.1 | S191 E192 | S191-S195 PolarHBondContact O-N 2.86Å; S191-S195 PolarHBondContact O-OG 3.21Å; E192-S195 PolarHBondContact O-N 3.38Å; E192-S195 PolarHBondContact O-OG 2.89Å; E192-S195 VanDerWaalsContact O-OG 3.04Å |
| 196 | T | 45.7 | Very low | 51.8 | Low | 98 Ų | 98 | 122.3 Ų | 122.3 | 60% | 0.601 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -78.6 | -27.9 | -179.9 | 50.4 | 0 | 0 | 0 | 0 | 113 | E192 I193 K198 | E192-T196 PolarHBondContact O-N 3.01Å; E192-T196 PolarHBondContact O-OG1 3.49Å; I193-T196 PolarHBondContact O-OG1 2.85Å; T196-K198 VanDerWaalsContact C-N 3.35Å; T196-K198 PolarHBondContact O-N 2.82Å |
| 197 | E | 40.6 | Very low | 49.5 | Very low | 155 Ų | 155 | 121.1 Ų | 121.1 | 72% | 0.724 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -73.4 | -24.2 | 178.7 | -117.2 | 177 | -179.2 | 0 | 0 | 113.6 | ||
| 198 | K | 40.7 | Very low | 47.2 | Very low | 180 Ų | 180 | 123.3 Ų | 123.3 | 78% | 0.783 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.7 | -7.8 | -175.4 | -140.5 | -178.4 | -176.5 | -173.9 | 0 | 114.8 | T196 | T196-K198 VanDerWaalsContact C-N 3.35Å; T196-K198 PolarHBondContact O-N 2.82Å |
| 199 | L | 38.5 | Very low | 45.2 | Very low | 150 Ų | 150 | 127.6 Ų | 127.6 | 79% | 0.785 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -92.3 | -9.8 | -175.2 | -120.4 | 129.9 | 0 | 0 | 0 | 114.2 | ||
| 200 | T | 42.5 | Very low | 43.1 | Very low | 122 Ų | 122 | 130.9 Ų | 130.9 | 75% | 0.748 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -99.3 | -6.5 | 179.7 | 42.2 | 0 | 0 | 0 | 0 | 114.9 | ||
| 201 | E | 39.1 | Very low | 41.5 | Very low | 170 Ų | 170 | 134.4 Ų | 134.4 | 79% | 0.794 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -109.5 | 16.6 | -171.5 | -146.2 | 177 | -174.2 | 0 | 0 | 115.7 | ||
| 202 | S | 39.5 | Very low | 40 | Very low | 104 Ų | 104 | 139.7 Ų | 139.7 | 73% | 0.727 | 74% | 0.739 | S | S | * | * | trans | -146.4 | 62.9 | -178.6 | -57.4 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 203 | T | 37.9 | Very low | 39 | Very low | 130 Ų | 130 | 139 Ų | 139 | 80% | 0.798 | 75% | 0.746 | S | S | * | * | trans | -138.3 | 70.2 | 168.3 | 47.6 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 204 | N | 34.3 | Very low | 37.9 | Very low | 155 Ų | 155 | 142.1 Ų | 142.1 | 83% | 0.829 | 76% | 0.758 | S | S | * | * | trans | -155.8 | 53.4 | 161 | -148.9 | -33.2 | 0 | 0 | 0 | 112.8 | ||||
| 205 | I | 38.1 | Very low | 37 | Very low | 152 Ų | 152 | 142.3 Ų | 142.3 | 78% | 0.779 | 76% | 0.759 | S | S | * | * | trans | -133.6 | 97.3 | 164.9 | -46.8 | 176 | 0 | 0 | 0 | 108.2 | T207 | I205-T207 PolarHBondContact O-N 3.3Å; I205-T207 VanDerWaalsContact O-N 3.07Å | ||
| 206 | D | 33 | Very low | 36.2 | Very low | 149 Ų | 149 | 146.8 Ų | 146.8 | 80% | 0.797 | 78% | 0.777 | S | S | * | * | trans | -58.3 | 96.3 | 174.1 | -141.5 | -12.1 | 0 | 0 | 0 | 109.8 | ||||
| 207 | T | 34.6 | Very low | 35.8 | Very low | 114 Ų | 114 | 149 Ų | 149 | 70% | 0.699 | 78% | 0.78 | S | S | * | * | trans | -134.6 | 98.1 | 165.9 | 35.2 | 0 | 0 | 0 | 0 | 109 | I205 L209 | I205-T207 PolarHBondContact O-N 3.3Å; I205-T207 VanDerWaalsContact O-N 3.07Å; T207-L209 PolarHBondContact O-N 2.96Å | ||
| 208 | Q | 32.5 | Very low | 35.6 | Very low | 182 Ų | 182 | 147.1 Ų | 147.1 | 85% | 0.85 | 78% | 0.779 | S | S | * | * | trans | -58.3 | 98.7 | 164.7 | -70.1 | -176.2 | 36.4 | 0 | 0 | 108.8 | ||||
| 209 | L | 35.5 | Very low | 35.5 | Very low | 152 Ų | 152 | 147.1 Ų | 147.1 | 80% | 0.796 | 78% | 0.782 | S | S | * | * | trans | -114.5 | 91.8 | 167.4 | -145 | 111.8 | 0 | 0 | 0 | 108.5 | T207 T211 | T207-L209 PolarHBondContact O-N 2.96Å; L209-T211 PolarHBondContact O-N 3.26Å | ||
| 210 | V | 31.4 | Very low | 35.5 | Very low | 136 Ų | 136 | 145.8 Ų | 145.8 | 82% | 0.824 | 78% | 0.78 | S | S | * | * | trans | -72.6 | 98.5 | 163.9 | 173.9 | 0 | 0 | 0 | 0 | 107 | ||||
| 211 | T | 33.9 | Very low | 35.5 | Very low | 111 Ų | 111 | 145.2 Ų | 145.2 | 68% | 0.681 | 78% | 0.779 | S | S | * | * | trans | -154.3 | 115.1 | 148.8 | -46.5 | 0 | 0 | 0 | 0 | 108.8 | L209 P213 | L209-T211 PolarHBondContact O-N 3.26Å; T211-P213 WeakPolarHBondContact O-CD 3.45Å | ||
| 212 | E | 29.1 | Very low | 35.7 | Very low | 183 Ų | 183 | 142.9 Ų | 142.9 | 86% | 0.855 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 123.7 | 174.5 | -177.5 | -173.5 | 169.4 | 0 | 0 | 111.2 | ||
| 213 | P | 36.1 | Very low | 35.7 | Very low | 119 Ų | 119 | 144.6 Ų | 144.6 | 77% | 0.773 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -101.3 | 133.8 | 161.7 | 11.8 | 8.8 | 0 | 0 | 0 | 110.3 | T211 | T211-P213 WeakPolarHBondContact O-CD 3.45Š|
| 214 | Q | 31.4 | Very low | 36.1 | Very low | 183 Ų | 183 | 142.2 Ų | 142.2 | 86% | 0.855 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -51.1 | 137.8 | -175.7 | -72.6 | 167.9 | -24.5 | 0 | 0 | 114.8 | L216 | Q214-L216 PolarHBondContact O-N 2.84Å; Q214-L216 VanDerWaalsContact O-N 3.17Å |
| 215 | K | 32.5 | Very low | 36.8 | Very low | 176 Ų | 176 | 141.2 Ų | 141.2 | 77% | 0.765 | 76% | 0.762 | S | S | * | * | trans | -45.6 | 109.5 | 160.5 | -89.8 | 170.7 | 161.8 | 178.8 | 0 | 111.7 | ||||
| 216 | L | 34.1 | Very low | 37.1 | Very low | 162 Ų | 162 | 140 Ų | 140 | 85% | 0.848 | 76% | 0.757 | S | S | * | * | trans | -90.9 | 102.8 | 155.8 | -97.5 | 159.1 | 0 | 0 | 0 | 107.8 | Q214 T218 | Q214-L216 PolarHBondContact O-N 2.84Å; Q214-L216 VanDerWaalsContact O-N 3.17Å; L216-T218 PolarHBondContact O-N 3.08Å | ||
| 217 | H | 36.5 | Very low | 37.7 | Very low | 145 Ų | 145 | 138.9 Ų | 138.9 | 67% | 0.671 | 75% | 0.751 | S | S | * | * | trans | -69 | 106.4 | 169.7 | -75.4 | -93.8 | 0 | 0 | 0 | 108.9 | ||||
| 218 | T | 36.9 | Very low | 38 | Very low | 115 Ų | 115 | 141 Ų | 141 | 71% | 0.706 | 75% | 0.753 | S | S | * | * | trans | -113.4 | 93.7 | 163.6 | -49 | 0 | 0 | 0 | 0 | 107.2 | L216 T220 | L216-T218 PolarHBondContact O-N 3.08Å; T218-T220 PolarHBondContact O-N 2.92Å; T218-T220 VanDerWaalsContact O-N 3.12Å | ||
| 219 | E | 38.4 | Very low | 38.5 | Very low | 180 Ų | 180 | 137.2 Ų | 137.2 | 84% | 0.841 | 74% | 0.738 | S | S | * | * | trans | -68.8 | 97.4 | 168.6 | -73.3 | -179.4 | 161.8 | 0 | 0 | 108.5 | ||||
| 220 | T | 38 | Very low | 39 | Very low | 121 Ų | 121 | 134.1 Ų | 134.1 | 74% | 0.742 | 73% | 0.729 | S | S | * | * | trans | -80 | 123.7 | 163.5 | 18.3 | 0 | 0 | 0 | 0 | 108.8 | T218 S222 | T218-T220 PolarHBondContact O-N 2.92Å; T218-T220 VanDerWaalsContact O-N 3.12Å; T220-S222 PolarHBondContact O-N 3.49Å; T220-S222 VanDerWaalsContact O-N 3.12Å | ||
| 221 | P | 42.9 | Very low | 39.7 | Very low | 111 Ų | 111 | 132.6 Ų | 132.6 | 72% | 0.721 | 72% | 0.72 | S | S | * | * | trans | -69.4 | 111.2 | 178.4 | 25.8 | -30.8 | 0 | 0 | 0 | 110 | I223 | P221-I223 PolarHBondContact O-N 3.07Š| ||
| 222 | S | 43.2 | Very low | 40.2 | Very low | 120 Ų | 120 | 132.3 Ų | 132.3 | 84% | 0.839 | 72% | 0.718 | S | S | * | * | trans | -72.8 | 88.7 | 172 | 58 | 0 | 0 | 0 | 0 | 110 | T220 | T220-S222 PolarHBondContact O-N 3.49Å; T220-S222 VanDerWaalsContact O-N 3.12Å | ||
| 223 | I | 40.6 | Very low | 40.8 | Very low | 141 Ų | 141 | 129.9 Ų | 129.9 | 72% | 0.723 | 71% | 0.711 | S | S | * | * | trans | -92.9 | 101.2 | 167.1 | -59.3 | 172.8 | 0 | 0 | 0 | 106.9 | P221 I225 | P221-I223 PolarHBondContact O-N 3.07Å; I223-I225 PolarHBondContact O-N 2.92Å | ||
| 224 | S | 45.6 | Very low | 41.2 | Very low | 80 Ų | 80 | 132.2 Ų | 132.2 | 56% | 0.559 | 71% | 0.711 | S | S | * | * | trans | -67.1 | 106.5 | 174.1 | 179 | 0 | 0 | 0 | 0 | 109.5 | N226 | S224-N226 PolarHBondContact O-N 2.86Š| ||
| 225 | I | 48.1 | Very low | 41.6 | Very low | 133 Ų | 133 | 128.2 Ų | 128.2 | 68% | 0.682 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.8 | -10.4 | 176.3 | -63.5 | 170.7 | 0 | 0 | 0 | 111.2 | I223 D227 | I223-I225 PolarHBondContact O-N 2.92Å; I225-D227 PolarHBondContact O-N 2.81Å |
| 226 | N | 44.2 | Very low | 41.9 | Very low | 126 Ų | 126 | 129 Ų | 129 | 67% | 0.674 | 71% | 0.707 | S | S | * | * | H | α-helix | trans | -75.4 | -18.9 | -168.7 | -132.2 | 24.1 | 0 | 0 | 0 | 114.5 | S224 | S224-N226 PolarHBondContact O-N 2.86Å |
| 227 | D | 45.7 | Very low | 42 | Very low | 126 Ų | 126 | 129.5 Ų | 129.5 | 67% | 0.674 | 71% | 0.705 | S | S | * | * | H | α-helix | trans | -84.6 | -12.9 | -177.7 | -71.2 | -24.5 | 0 | 0 | 0 | 114.2 | I225 | I225-D227 PolarHBondContact O-N 2.81Å |
| 228 | Q | 40.7 | Very low | 41.8 | Very low | 159 Ų | 159 | 130.7 Ų | 130.7 | 74% | 0.743 | 71% | 0.71 | S | S | * | * | H | α-helix | trans | -86.7 | -21.5 | -179.5 | -74.5 | -173 | 37 | 0 | 0 | 114.2 | ||
| 229 | I | 44.7 | Very low | 41.9 | Very low | 102 Ų | 102 | 130.5 Ų | 130.5 | 52% | 0.523 | 71% | 0.711 | S | S | . | * | H | α-helix | trans | -82.5 | -32.9 | -176 | -58 | 177 | 0 | 0 | 0 | 111.2 | T231 V232 L233 | I229-T231 VanDerWaalsContact C-N 3.3Å; I229-T231 PolarHBondContact O-N 3.33Å; I229-V232 PolarHBondContact O-N 3.44Å; I229-L233 HydrophobicContact CG2-CD1 4.37Å |
| 230 | S | 46.1 | Very low | 41.8 | Very low | 88 Ų | 88 | 127.9 Ų | 127.9 | 62% | 0.615 | 71% | 0.707 | S | S | * | * | H | α-helix | trans | -67.2 | -26.2 | -178.3 | -78.8 | 0 | 0 | 0 | 0 | 114.1 | ||
| 231 | T | 45.3 | Very low | 42 | Very low | 103 Ų | 103 | 130.1 Ų | 130.1 | 63% | 0.632 | 71% | 0.709 | S | S | * | * | H | α-helix | trans | -79 | -26.1 | 179.9 | -22.4 | 0 | 0 | 0 | 0 | 113 | I229 | I229-T231 VanDerWaalsContact C-N 3.3Å; I229-T231 PolarHBondContact O-N 3.33Å |
| 232 | V | 44.9 | Very low | 42.1 | Very low | 106 Ų | 106 | 130.9 Ų | 130.9 | 64% | 0.642 | 71% | 0.712 | S | S | * | * | H | α-helix | trans | -80 | -26.3 | -176.1 | -179.8 | 0 | 0 | 0 | 0 | 112.3 | I229 | I229-V232 PolarHBondContact O-N 3.44Å |
| 233 | L | 41.7 | Very low | 42.1 | Very low | 132 Ų | 132 | 129.9 Ų | 129.9 | 69% | 0.691 | 71% | 0.705 | S | S | * | * | H | α-helix | trans | -85 | -18.7 | -178.2 | -75.8 | 165.6 | 0 | 0 | 0 | 114.3 | I229 | I229-L233 HydrophobicContact CG2-CD1 4.37Å |
| 234 | Q | 44.2 | Very low | 42.2 | Very low | 168 Ų | 168 | 132.4 Ų | 132.4 | 79% | 0.785 | 71% | 0.71 | S | S | * | * | H | α-helix | trans | -89 | -18.9 | 178.9 | -79.1 | -177.2 | -1.2 | 0 | 0 | 114.5 | K236 | Q234-K236 PolarHBondContact O-N 3.41Å |
| 235 | S | 40.1 | Very low | 42 | Very low | 99 Ų | 99 | 136.5 Ų | 136.5 | 69% | 0.692 | 73% | 0.725 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.4 | 13.4 | -175.3 | 78.2 | 0 | 0 | 0 | 0 | 115.2 | ||
| 236 | K | 37.7 | Very low | 42 | Very low | 192 Ų | 192 | 136.6 Ų | 136.6 | 84% | 0.835 | 73% | 0.727 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -128.9 | 14.9 | -177.2 | -115.6 | -178.8 | -177.2 | -179.6 | 0 | 116.2 | Q234 H238 | Q234-K236 PolarHBondContact O-N 3.41Å; K236-H238 VanDerWaalsContact C-N 3.32Å; K236-H238 PolarHBondContact O-N 3.1Å |
| 237 | Q | 36 | Very low | 42.4 | Very low | 172 Ų | 172 | 136 Ų | 136 | 80% | 0.804 | 73% | 0.731 | S | S | * | * | trans | -88.2 | 70 | 165.2 | -76.6 | -178.6 | -25.2 | 0 | 0 | 110.3 | ||||
| 238 | H | 32.4 | Very low | 42.7 | Very low | 170 Ų | 170 | 135.4 Ų | 135.4 | 79% | 0.787 | 73% | 0.731 | S | S | * | * | trans | -104.9 | 111.6 | 154.2 | -99.6 | -67.2 | 0 | 0 | 0 | 107.4 | K236 V240 | K236-H238 VanDerWaalsContact C-N 3.32Å; K236-H238 PolarHBondContact O-N 3.1Å; H238-V240 PolarHBondContact O-N 3.2Å | ||
| 239 | P | 38.9 | Very low | 42.9 | Very low | 112 Ų | 112 | 136.6 Ų | 136.6 | 73% | 0.727 | 74% | 0.736 | S | S | * | * | trans | -63.5 | 107.3 | 171.6 | 24.9 | -29.7 | 0 | 0 | 0 | 107.4 | E241 | P239-E241 VanDerWaalsContact C-N 3.31Å; P239-E241 PolarHBondContact O-N 2.65Å | ||
| 240 | V | 37.8 | Very low | 43 | Very low | 124 Ų | 124 | 141.1 Ų | 141.1 | 75% | 0.752 | 75% | 0.748 | S | S | * | * | trans | -69.9 | 98.2 | 168.6 | 177.5 | 0 | 0 | 0 | 0 | 105.3 | H238 T242 | H238-V240 PolarHBondContact O-N 3.2Å; V240-T242 PolarHBondContact O-N 2.88Å | ||
| 241 | E | 41 | Very low | 43.1 | Very low | 169 Ų | 169 | 142.1 Ų | 142.1 | 79% | 0.79 | 75% | 0.753 | S | S | * | * | trans | -56.4 | 104.5 | 166.7 | -69.7 | -169.2 | 162.9 | 0 | 0 | 107.4 | P239 S243 | P239-E241 VanDerWaalsContact C-N 3.31Å; P239-E241 PolarHBondContact O-N 2.65Å; E241-S243 PolarHBondContact O-N 3.26Å | ||
| 242 | T | 44.7 | Very low | 43 | Very low | 126 Ų | 126 | 146.3 Ų | 146.3 | 77% | 0.773 | 77% | 0.765 | S | S | * | * | trans | -69.4 | 84.4 | 169.5 | 54.3 | 0 | 0 | 0 | 0 | 106.6 | V240 K244 | V240-T242 PolarHBondContact O-N 2.88Å; T242-K244 PolarHBondContact O-N 2.88Å | ||
| 243 | S | 43.7 | Very low | 43.1 | Very low | 100 Ų | 100 | 148.5 Ų | 148.5 | 70% | 0.699 | 77% | 0.772 | S | S | * | * | trans | -52.8 | 108.7 | 164 | -73.4 | 0 | 0 | 0 | 0 | 106.8 | E241 L245 | E241-S243 PolarHBondContact O-N 3.26Å; S243-L245 VanDerWaalsContact C-N 3.33Å; S243-L245 PolarHBondContact O-N 3.04Å | ||
| 244 | K | 41.9 | Very low | 42.9 | Very low | 193 Ų | 193 | 147.6 Ų | 147.6 | 84% | 0.839 | 78% | 0.776 | S | S | * | * | trans | -51.4 | 102.2 | 166.4 | -97.1 | 173.3 | 170.4 | 176 | 0 | 106.7 | T242 N246 | T242-K244 PolarHBondContact O-N 2.88Å; K244-N246 PolarHBondContact O-N 2.62Å | ||
| 245 | L | 43.2 | Very low | 42.8 | Very low | 166 Ų | 166 | 143 Ų | 143 | 87% | 0.869 | 76% | 0.763 | S | S | * | * | trans | -63.6 | 107.5 | 166.4 | -70.3 | 168.8 | 0 | 0 | 0 | 105.5 | S243 | S243-L245 VanDerWaalsContact C-N 3.33Å; S243-L245 PolarHBondContact O-N 3.04Å | ||
| 246 | N | 48.3 | Very low | 42.6 | Very low | 135 Ų | 135 | 141.7 Ų | 141.7 | 72% | 0.722 | 77% | 0.765 | S | S | * | * | trans | -57.7 | 137.5 | 170.7 | -74.7 | -28.2 | 0 | 0 | 0 | 108.1 | K244 V248 | K244-N246 PolarHBondContact O-N 2.62Å; N246-V248 PolarHBondContact O-N 2.78Å | ||
| 247 | P | 51.8 | Low | 42.7 | Very low | 115 Ų | 115 | 140.7 Ų | 140.7 | 75% | 0.747 | 76% | 0.764 | S | S | * | * | trans | -56.3 | 125.9 | 175.7 | 20.5 | -28.8 | 0 | 0 | 0 | 109.1 | E249 | P247-E249 PolarHBondContact O-N 3.45Å; P247-E249 VanDerWaalsContact O-N 3.09Å | ||
| 248 | V | 52.2 | Low | 42.9 | Very low | 113 Ų | 113 | 137 Ų | 137 | 69% | 0.685 | 76% | 0.757 | S | S | * | * | trans | -66.3 | 107.4 | 173.7 | 175.7 | 0 | 0 | 0 | 0 | 107 | N246 Y250 | N246-V248 PolarHBondContact O-N 2.78Å; V248-Y250 PolarHBondContact O-N 3.32Å | ||
| 249 | E | 43.9 | Very low | 43.1 | Very low | 183 Ų | 183 | 138.3 Ų | 138.3 | 86% | 0.855 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -68 | 116.2 | 169.6 | -74.8 | 179.2 | 178.3 | 0 | 0 | 108.3 | P247 | P247-E249 PolarHBondContact O-N 3.45Å; P247-E249 VanDerWaalsContact O-N 3.09Å |
| 250 | Y | 48 | Very low | 43.3 | Very low | 197 Ų | 197 | 138.1 Ų | 138.1 | 77% | 0.773 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -74.9 | 132.9 | 172.9 | -67.6 | -87.9 | 0 | 0 | 0 | 108.5 | V248 E252 | V248-Y250 PolarHBondContact O-N 3.32Å; Y250-E252 PolarHBondContact O-N 3.41Å |
| 251 | P | 46.8 | Very low | 43.4 | Very low | 109 Ų | 109 | 140.9 Ų | 140.9 | 71% | 0.708 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 124 | 169.5 | -16.4 | 27.5 | 0 | 0 | 0 | 108.7 | I253 | P251-I253 PolarHBondContact O-N 3.06Š|
| 252 | E | 43.4 | Very low | 43.6 | Very low | 191 Ų | 191 | 138.6 Ų | 138.6 | 89% | 0.893 | 76% | 0.757 | S | S | * | * | trans | -61.9 | 91.7 | 163.7 | -68.9 | -170.8 | 179.9 | 0 | 0 | 107.2 | Y250 S254 | Y250-E252 PolarHBondContact O-N 3.41Å; E252-S254 PolarHBondContact O-N 3.06Å | ||
| 253 | I | 48.2 | Very low | 43.2 | Very low | 152 Ų | 152 | 139.9 Ų | 139.9 | 78% | 0.779 | 76% | 0.758 | S | S | * | * | trans | -69.2 | 92.4 | 167.5 | 44.9 | 158 | 0 | 0 | 0 | 107 | P251 S255 | P251-I253 PolarHBondContact O-N 3.06Å; I253-S255 PolarHBondContact O-N 3.27Å | ||
| 254 | S | 36.4 | Very low | 43.2 | Very low | 113 Ų | 113 | 143.7 Ų | 143.7 | 79% | 0.79 | 76% | 0.758 | S | S | * | * | trans | -60.7 | 92.5 | 161.5 | 63.4 | 0 | 0 | 0 | 0 | 107 | E252 G256 | E252-S254 PolarHBondContact O-N 3.06Å; S254-G256 VanDerWaalsContact C-N 3.3Å; S254-G256 PolarHBondContact O-N 3.43Å | ||
| 255 | S | 41.5 | Very low | 43.2 | Very low | 71 Ų | 71 | 141.6 Ų | 141.6 | 50% | 0.497 | 76% | 0.756 | S | S | . | * | trans | -75.7 | 88.9 | 177.5 | -169.1 | 0 | 0 | 0 | 0 | 109.1 | I253 E257 | I253-S255 PolarHBondContact O-N 3.27Å; S255-E257 VanDerWaalsContact C-N 3.29Å; S255-E257 PolarHBondContact O-N 2.98Å; S255-E257 WeakPolarHBondContact OG-CG 3.42Å; S255-E257 PolarHBondContact OG-OE1 3.39Å | ||
| 256 | G | 37.1 | Very low | 43.2 | Very low | 73 Ų | 73 | 139.7 Ų | 139.7 | 75% | 0.753 | 75% | 0.751 | S | S | * | * | trans | -83.8 | 80.2 | 150.2 | 0 | 0 | 0 | 0 | 0 | 107.4 | S254 S258 | S254-G256 VanDerWaalsContact C-N 3.3Å; S254-G256 PolarHBondContact O-N 3.43Å; G256-S258 PolarHBondContact O-N 2.83Å | ||
| 257 | E | 39.8 | Very low | 43 | Very low | 171 Ų | 171 | 138.3 Ų | 138.3 | 80% | 0.799 | 75% | 0.752 | S | S | * | * | trans | -74.3 | 95.7 | 176 | -95.8 | 156.9 | -138.9 | 0 | 0 | 109.2 | S255 | S255-E257 VanDerWaalsContact C-N 3.29Å; S255-E257 PolarHBondContact O-N 2.98Å; S255-E257 WeakPolarHBondContact OG-CG 3.42Å; S255-E257 PolarHBondContact OG-OE1 3.39Å | ||
| 258 | S | 39.1 | Very low | 42.3 | Very low | 94 Ų | 94 | 140.6 Ų | 140.6 | 66% | 0.657 | 75% | 0.753 | S | S | * | * | trans | -71 | 120.5 | 155 | 52.5 | 0 | 0 | 0 | 0 | 108.4 | G256 T260 | G256-S258 PolarHBondContact O-N 2.83Å; S258-T260 PolarHBondContact O-N 2.85Å | ||
| 259 | E | 37 | Very low | 41.8 | Very low | 197 Ų | 197 | 140 Ų | 140 | 92% | 0.921 | 75% | 0.751 | S | S | * | * | trans | -51.9 | 103.7 | 171.3 | -64.5 | 174 | 157.4 | 0 | 0 | 110 | ||||
| 260 | T | 44.5 | Very low | 41.9 | Very low | 109 Ų | 109 | 137.1 Ų | 137.1 | 67% | 0.669 | 75% | 0.748 | S | S | * | * | trans | -118 | 110.9 | 161.6 | 43.5 | 0 | 0 | 0 | 0 | 106.7 | S258 L262 | S258-T260 PolarHBondContact O-N 2.85Å; T260-L262 PolarHBondContact O-N 3.38Å | ||
| 261 | E | 40 | Very low | 41.9 | Very low | 182 Ų | 182 | 135.6 Ų | 135.6 | 85% | 0.85 | 75% | 0.748 | S | S | * | * | trans | -61.3 | 94.4 | 174.2 | -66.6 | -179.3 | 157.1 | 0 | 0 | 108.8 | I263 | E261-I263 PolarHBondContact O-N 3.24Å; E261-I263 VanDerWaalsContact O-N 3.08Å | ||
| 262 | L | 43.5 | Very low | 41.7 | Very low | 120 Ų | 120 | 138.5 Ų | 138.5 | 63% | 0.628 | 75% | 0.753 | S | S | * | * | trans | -74.1 | 98.4 | 165.9 | -114.3 | 90.9 | 0 | 0 | 0 | 107.8 | T260 Y264 | T260-L262 PolarHBondContact O-N 3.38Å; L262-Y264 VanDerWaalsContact C-N 3.32Å; L262-Y264 HydrophobicContact CB-CD2 4.17Å; L262-Y264 HydrophobicContact CB-CE2 3.97Å; L262-Y264 HydrophobicContact CD2-CD2 4.35Å; L262-Y264 HydrophobicContact CD2-CE2 3.56Å; L262-Y264 HydrophobicContact CG-CE2 4.4Å; L262-Y264 PolarHBondContact O-N 3.34Å | ||
| 263 | I | 38 | Very low | 41.7 | Very low | 153 Ų | 153 | 136.2 Ų | 136.2 | 79% | 0.785 | 75% | 0.751 | S | S | * | * | trans | -66.6 | 94.1 | 166.8 | -59.3 | 164.4 | 0 | 0 | 0 | 106.5 | E261 D265 | E261-I263 PolarHBondContact O-N 3.24Å; E261-I263 VanDerWaalsContact O-N 3.08Å; I263-D265 PolarHBondContact O-N 3.41Å | ||
| 264 | Y | 43 | Very low | 41.5 | Very low | 180 Ų | 180 | 135.5 Ų | 135.5 | 71% | 0.706 | 75% | 0.748 | S | S | * | * | trans | -73.8 | 111.8 | 165.3 | -84 | -89.2 | 0 | 0 | 0 | 107.4 | L262 V266 | L262-Y264 VanDerWaalsContact C-N 3.32Å; L262-Y264 HydrophobicContact CB-CD2 4.17Å; L262-Y264 HydrophobicContact CB-CE2 3.97Å; L262-Y264 HydrophobicContact CD2-CD2 4.35Å; L262-Y264 HydrophobicContact CD2-CE2 3.56Å; L262-Y264 HydrophobicContact CG-CE2 4.4Å; L262-Y264 PolarHBondContact O-N 3.34Å; Y264-V266 VanDerWaalsContact C-N 3.35Å; Y264-V266 PolarHBondContact O-N 3.01Å | ||
| 265 | D | 42.2 | Very low | 41.8 | Very low | 149 Ų | 149 | 134.9 Ų | 134.9 | 80% | 0.797 | 74% | 0.742 | S | S | * | * | trans | -61.8 | 100.1 | 164.9 | -155.2 | -0.2 | 0 | 0 | 0 | 106.8 | I263 S267 | I263-D265 PolarHBondContact O-N 3.41Å; D265-S267 VanDerWaalsContact C-N 3.26Å; D265-S267 PolarHBondContact O-N 2.53Å | ||
| 266 | V | 43.4 | Very low | 41.7 | Very low | 126 Ų | 126 | 137.1 Ų | 137.1 | 76% | 0.764 | 75% | 0.752 | S | S | * | * | trans | -70.1 | 88.8 | -176.4 | 176.9 | 0 | 0 | 0 | 0 | 107.2 | Y264 E268 | Y264-V266 VanDerWaalsContact C-N 3.35Å; Y264-V266 PolarHBondContact O-N 3.01Å; V266-E268 PolarHBondContact O-N 3.35Å | ||
| 267 | S | 44.2 | Very low | 42 | Very low | 106 Ų | 106 | 138.6 Ų | 138.6 | 74% | 0.741 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -61.6 | 123.4 | 164.3 | -62.2 | 0 | 0 | 0 | 0 | 108.1 | D265 | D265-S267 VanDerWaalsContact C-N 3.26Å; D265-S267 PolarHBondContact O-N 2.53Å |
| 268 | E | 36.7 | Very low | 41.9 | Very low | 164 Ų | 164 | 135.6 Ų | 135.6 | 77% | 0.766 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -50.2 | 130.7 | 178.7 | -168 | 167.4 | -158.2 | 0 | 0 | 110.6 | V266 | V266-E268 PolarHBondContact O-N 3.35Š|
| 269 | P | 41.7 | Very low | 41.9 | Very low | 99 Ų | 99 | 138.9 Ų | 138.9 | 64% | 0.643 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 142.5 | -178.9 | 27.6 | -32.8 | 0 | 0 | 0 | 109.4 | E271 | P269-E271 PolarHBondContact O-N 2.85Å; P269-E271 VanDerWaalsContact O-N 3.09Å |
| 270 | P | 45.7 | Very low | 41.9 | Very low | 123 Ų | 123 | 136.9 Ų | 136.9 | 80% | 0.799 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 121.4 | 177.6 | 20.4 | -30 | 0 | 0 | 0 | 110.1 | ||
| 271 | E | 48.2 | Very low | 41.5 | Very low | 165 Ų | 165 | 143.4 Ų | 143.4 | 77% | 0.771 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -55.7 | 151.4 | 164.8 | -63.7 | -169.3 | 152.1 | 0 | 0 | 108.7 | P269 | P269-E271 PolarHBondContact O-N 2.85Å; P269-E271 VanDerWaalsContact O-N 3.09Å |
| 272 | E | 42.5 | Very low | 41.3 | Very low | 171 Ų | 171 | 146.5 Ų | 146.5 | 80% | 0.799 | 77% | 0.765 | S | S | * | * | trans | 88.7 | 54 | 174.6 | -46 | -174.7 | 178.3 | 0 | 0 | 117.9 | ||||
| 273 | V | 44 | Very low | 41 | Very low | 142 Ų | 142 | 145.6 Ų | 145.6 | 86% | 0.861 | 77% | 0.768 | S | S | * | * | trans | -94.6 | 78 | 145 | -170.6 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 274 | L | 42.9 | Very low | 40.9 | Very low | 137 Ų | 137 | 143.6 Ų | 143.6 | 72% | 0.717 | 77% | 0.768 | S | S | * | * | trans | -62.4 | 137.8 | 171.2 | -75.8 | 171.3 | 0 | 0 | 0 | 109.7 | V276 | L274-V276 PolarHBondContact O-N 2.77Š| ||
| 275 | P | 43.2 | Very low | 40.4 | Very low | 101 Ų | 101 | 143.9 Ų | 143.9 | 66% | 0.656 | 78% | 0.776 | S | S | * | * | trans | -64.4 | 120.3 | -177.3 | 23.8 | -31.9 | 0 | 0 | 0 | 110.6 | S277 | P275-S277 PolarHBondContact O-N 3.25Å; P275-S277 PolarHBondContact O-OG 3.22Å; P275-S277 VanDerWaalsContact O-OG 3.06Å | ||
| 276 | V | 39.1 | Very low | 40 | Very low | 118 Ų | 118 | 144.5 Ų | 144.5 | 72% | 0.715 | 78% | 0.777 | S | S | * | * | trans | -65 | 75.3 | 171.4 | -172.6 | 0 | 0 | 0 | 0 | 109.3 | L274 Q279 | L274-V276 PolarHBondContact O-N 2.77Å; V276-Q279 HydrophobicContact CG1-CB 4.48Å; V276-Q279 HydrophobicContact CG1-CG 4.29Å | ||
| 277 | S | 42.5 | Very low | 39.6 | Very low | 103 Ų | 103 | 142.3 Ų | 142.3 | 72% | 0.72 | 77% | 0.768 | S | S | * | * | trans | -109.4 | 4.6 | -178.1 | 44.6 | 0 | 0 | 0 | 0 | 112.8 | P275 | P275-S277 PolarHBondContact O-N 3.25Å; P275-S277 PolarHBondContact O-OG 3.22Å; P275-S277 VanDerWaalsContact O-OG 3.06Å | ||
| 278 | S | 38.8 | Very low | 39.1 | Very low | 108 Ų | 108 | 143.5 Ų | 143.5 | 76% | 0.755 | 77% | 0.773 | S | S | * | * | S | Bend | trans | -102.8 | -7.4 | 179.3 | 57.4 | 0 | 0 | 0 | 0 | 115.8 | ||
| 279 | Q | 38.6 | Very low | 39 | Very low | 164 Ų | 164 | 140 Ų | 140 | 77% | 0.766 | 77% | 0.767 | S | S | * | * | S | Bend | trans | -91.7 | -13.2 | -175.5 | -66.3 | -160.1 | 31.8 | 0 | 0 | 115.8 | V276 R281 | V276-Q279 HydrophobicContact CG1-CB 4.48Å; V276-Q279 HydrophobicContact CG1-CG 4.29Å; Q279-R281 PolarHBondContact O-N 3.11Å |
| 280 | L | 37 | Very low | 38.6 | Very low | 155 Ų | 155 | 142.5 Ų | 142.5 | 81% | 0.812 | 77% | 0.774 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.3 | 5.5 | -174.1 | -105.3 | 151.3 | 0 | 0 | 0 | 115.6 | ||
| 281 | R | 36.2 | Very low | 38 | Very low | 245 Ų | 245 | 143.9 Ų | 143.9 | 93% | 0.925 | 78% | 0.775 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.3 | 7.7 | -176.6 | -92.8 | -155.7 | 179.6 | -179.2 | 2.4 | 117 | Q279 | Q279-R281 PolarHBondContact O-N 3.11Š|
| 282 | R | 35.5 | Very low | 37.4 | Very low | 248 Ų | 248 | 140.8 Ų | 140.8 | 94% | 0.936 | 77% | 0.767 | S | S | * | * | S | Bend | trans | -113 | 2.9 | -177.5 | -80.4 | -167.7 | -166.6 | 163.7 | 5.6 | 118 | ||
| 283 | S | 37.1 | Very low | 37 | Very low | 100 Ų | 100 | 140.1 Ų | 140.1 | 70% | 0.699 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -127.7 | 58.4 | 177.4 | 65 | 0 | 0 | 0 | 0 | 112.4 | ||
| 284 | S | 37.3 | Very low | 36.4 | Very low | 112 Ų | 112 | 140.3 Ų | 140.3 | 78% | 0.783 | 76% | 0.763 | S | S | * | * | trans | -146.7 | 49.9 | 167 | -56.4 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 285 | Q | 32.5 | Very low | 36 | Very low | 186 Ų | 186 | 141 Ų | 141 | 87% | 0.869 | 77% | 0.767 | S | S | * | * | trans | -116.2 | 58.4 | 165.5 | -147.8 | 170.6 | 20.6 | 0 | 0 | 107.3 | S287 | Q285-S287 PolarHBondContact O-N 3.07Š| ||
| 286 | I | 33.8 | Very low | 35.8 | Very low | 161 Ų | 161 | 141.6 Ų | 141.6 | 83% | 0.826 | 77% | 0.769 | S | S | * | * | trans | -83 | 97.9 | 165.7 | -59.7 | 170.9 | 0 | 0 | 0 | 104.8 | ||||
| 287 | S | 33.2 | Very low | 35.3 | Very low | 81 Ų | 81 | 138.6 Ų | 138.6 | 57% | 0.566 | 76% | 0.762 | S | S | * | * | trans | -52.6 | 132.2 | 173.2 | -56.9 | 0 | 0 | 0 | 0 | 109.7 | Q285 S289 | Q285-S287 PolarHBondContact O-N 3.07Å; S287-S289 PolarHBondContact O-N 3.05Å | ||
| 288 | P | 34.6 | Very low | 34.8 | Very low | 131 Ų | 131 | 140.7 Ų | 140.7 | 85% | 0.851 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -75.8 | 27.3 | -171.2 | 29.8 | -34.4 | 0 | 0 | 0 | 114.6 | ||
| 289 | S | 35.4 | Very low | 34.3 | Very low | 91 Ų | 91 | 142.7 Ų | 142.7 | 64% | 0.636 | 77% | 0.767 | S | S | * | * | trans | -111.9 | 68.1 | -176 | 61.6 | 0 | 0 | 0 | 0 | 111.2 | S287 | S287-S289 PolarHBondContact O-N 3.05Š| ||
| 290 | L | 33.2 | Very low | 34 | Very low | 151 Ų | 151 | 143.3 Ų | 143.3 | 79% | 0.791 | 77% | 0.772 | S | S | * | * | trans | -167.2 | 49.1 | 153.3 | -125.8 | 95.4 | 0 | 0 | 0 | 110.8 | V292 | L290-V292 HydrophobicContact CD2-CG2 3.82Å; L290-V292 HydrophobicContact CG-CG2 3.96Å; L290-V292 PolarHBondContact O-N 3.01Å | ||
| 291 | N | 33.1 | Very low | 33.7 | Very low | 152 Ų | 152 | 141.9 Ų | 141.9 | 81% | 0.813 | 77% | 0.765 | S | S | * | * | trans | -71.8 | 84.2 | 157.9 | -78.4 | -31.1 | 0 | 0 | 0 | 106.9 | L293 | N291-L293 PolarHBondContact O-N 3.3Š| ||
| 292 | V | 34.5 | Very low | 33.5 | Very low | 100 Ų | 100 | 135.7 Ų | 135.7 | 61% | 0.606 | 75% | 0.751 | S | S | * | * | trans | -70.1 | 82 | 168.1 | -175.6 | 0 | 0 | 0 | 0 | 106.5 | L290 L294 | L290-V292 HydrophobicContact CD2-CG2 3.82Å; L290-V292 HydrophobicContact CG-CG2 3.96Å; L290-V292 PolarHBondContact O-N 3.01Å; V292-L294 VanDerWaalsContact C-N 3.29Å; V292-L294 HydrophobicContact CG1-CD2 4.5Å; V292-L294 HydrophobicContact CG1-CG 4.2Å; V292-L294 PolarHBondContact O-N 3.42Å | ||
| 293 | L | 33.7 | Very low | 33.3 | Very low | 157 Ų | 157 | 130.2 Ų | 130.2 | 82% | 0.822 | 74% | 0.74 | S | S | * | * | trans | -65.1 | 94.5 | 162.8 | -93.7 | 156.5 | 0 | 0 | 0 | 106.7 | N291 N295 | N291-L293 PolarHBondContact O-N 3.3Å; L293-N295 PolarHBondContact O-N 3.48Å | ||
| 294 | L | 33.1 | Very low | 33.2 | Very low | 146 Ų | 146 | 132.2 Ų | 132.2 | 76% | 0.764 | 74% | 0.743 | S | S | * | * | trans | -66.4 | 85.3 | 164.3 | -77.5 | 166 | 0 | 0 | 0 | 107.6 | V292 V296 | V292-L294 VanDerWaalsContact C-N 3.29Å; V292-L294 HydrophobicContact CG1-CD2 4.5Å; V292-L294 HydrophobicContact CG1-CG 4.2Å; V292-L294 PolarHBondContact O-N 3.42Å; L294-V296 HydrophobicContact CB-CG2 4.49Å; L294-V296 PolarHBondContact O-N 3.2Å | ||
| 295 | N | 33.9 | Very low | 32.9 | Very low | 150 Ų | 150 | 134.3 Ų | 134.3 | 80% | 0.802 | 74% | 0.744 | S | S | * | * | trans | -71.2 | 80.7 | 167.3 | -167.6 | 22.1 | 0 | 0 | 0 | 107.5 | L293 G297 | L293-N295 PolarHBondContact O-N 3.48Å; N295-G297 PolarHBondContact O-N 2.9Å | ||
| 296 | V | 38 | Very low | 33 | Very low | 115 Ų | 115 | 133.1 Ų | 133.1 | 70% | 0.697 | 74% | 0.736 | S | S | * | * | trans | -73.9 | 83.4 | 168.6 | -175.6 | 0 | 0 | 0 | 0 | 106.1 | L294 N298 | L294-V296 HydrophobicContact CB-CG2 4.49Å; L294-V296 PolarHBondContact O-N 3.2Å; V296-N298 PolarHBondContact O-N 3.04Å | ||
| 297 | G | 29.9 | Very low | 33 | Very low | 54 Ų | 54 | 134.6 Ų | 134.6 | 56% | 0.557 | 73% | 0.732 | S | S | * | * | trans | -59.5 | 102.4 | 167.6 | 0 | 0 | 0 | 0 | 0 | 108.3 | N295 N299 | N295-G297 PolarHBondContact O-N 2.9Å; G297-N299 PolarHBondContact O-N 2.89Å | ||
| 298 | N | 32 | Very low | 32.9 | Very low | 148 Ų | 148 | 137 Ų | 137 | 79% | 0.791 | 74% | 0.739 | S | S | * | * | trans | -69.4 | 82.2 | 163.4 | -109.3 | 3.4 | 0 | 0 | 0 | 107.6 | V296 M300 | V296-N298 PolarHBondContact O-N 3.04Å; N298-M300 PolarHBondContact O-N 3.27Å; N298-M300 VanDerWaalsContact O-N 3.15Å | ||
| 299 | N | 28.3 | Very low | 32.7 | Very low | 149 Ų | 149 | 139.2 Ų | 139.2 | 80% | 0.797 | 74% | 0.735 | S | S | * | * | trans | -83.5 | 69.9 | 172 | -153.6 | 3.8 | 0 | 0 | 0 | 107.5 | G297 | G297-N299 PolarHBondContact O-N 2.89Š| ||
| 300 | M | 32.6 | Very low | 32.8 | Very low | 178 Ų | 178 | 143.9 Ų | 143.9 | 88% | 0.877 | 74% | 0.744 | S | S | * | * | trans | -115.1 | 67.3 | 169.6 | -70.5 | -85 | -112.5 | 0 | 0 | 107 | N298 | N298-M300 PolarHBondContact O-N 3.27Å; N298-M300 VanDerWaalsContact O-N 3.15Å | ||
| 301 | N | 30.4 | Very low | 33 | Very low | 124 Ų | 124 | 149.8 Ų | 149.8 | 66% | 0.663 | 76% | 0.764 | S | S | * | * | trans | -82.5 | 140.1 | 163.1 | -161.4 | 14.1 | 0 | 0 | 0 | 107.7 | ||||
| 302 | N | 32.3 | Very low | 33 | Very low | 116 Ų | 116 | 149.7 Ų | 149.7 | 62% | 0.62 | 76% | 0.761 | S | S | * | * | S | Bend | trans | 90.9 | 100 | 166.7 | -52.6 | -32.8 | 0 | 0 | 0 | 118.4 | ||
| 303 | N | 30.5 | Very low | 32.9 | Very low | 132 Ų | 132 | 152.3 Ų | 152.3 | 71% | 0.706 | 77% | 0.77 | S | S | * | * | 57.1 | 85.4 | 121 | -58.9 | -18.6 | 0 | 0 | 0 | 118.4 | |||||
| 304 | D | 34.7 | Very low | 32.9 | Very low | 142 Ų | 142 | 152 Ų | 152 | 76% | 0.759 | 77% | 0.767 | S | S | * | * | trans | -121.3 | 85.4 | 145.1 | -85.7 | -39.2 | 0 | 0 | 0 | 109.2 | F306 | D304-F306 VanDerWaalsContact C-N 3.31Å; D304-F306 HydrophobicContact CB-CD2 4.12Å; D304-F306 PolarHBondContact O-N 2.85Å; D304-F306 VanDerWaalsContact O-N 3.14Å | ||
| 305 | I | 31.6 | Very low | 32.9 | Very low | 156 Ų | 156 | 152.4 Ų | 152.4 | 80% | 0.8 | 77% | 0.767 | S | S | * | * | trans | -70.2 | 91.9 | 159.3 | -62.1 | 168.5 | 0 | 0 | 0 | 105.5 | ||||
| 306 | F | 34.5 | Very low | 32.8 | Very low | 161 Ų | 161 | 152.5 Ų | 152.5 | 71% | 0.706 | 77% | 0.765 | S | S | * | * | trans | -103 | 101.2 | 172 | -104.8 | -98.5 | 0 | 0 | 0 | 110.6 | D304 | D304-F306 VanDerWaalsContact C-N 3.31Å; D304-F306 HydrophobicContact CB-CD2 4.12Å; D304-F306 PolarHBondContact O-N 2.85Å; D304-F306 VanDerWaalsContact O-N 3.14Å | ||
| 307 | Y | 33.1 | Very low | 32.5 | Very low | 193 Ų | 193 | 155 Ų | 155 | 76% | 0.757 | 77% | 0.769 | S | S | * | * | trans | 48.6 | 104.4 | 147 | -62.7 | -86 | 0 | 0 | 0 | 121 | ||||
| 308 | D | 31.7 | Very low | 32.6 | Very low | 130 Ų | 130 | 162.2 Ų | 162.2 | 70% | 0.695 | 78% | 0.784 | S | S | * | * | trans | -8.9 | 135.3 | 131.8 | -108.7 | -29.7 | 0 | 0 | 0 | 117.8 | ||||
| 309 | K | 29.6 | Very low | 32.7 | Very low | 178 Ų | 178 | 163.3 Ų | 163.3 | 77% | 0.774 | 78% | 0.784 | S | S | * | * | trans | 55.8 | 100.6 | 144.7 | -69 | 175 | -176.7 | 175 | 0 | 118.5 | ||||
| 310 | F | 37.5 | Very low | 33.1 | Very low | 190 Ų | 190 | 164.5 Ų | 164.5 | 83% | 0.833 | 78% | 0.783 | S | S | * | * | trans | -126.1 | 113.2 | 144.4 | -85.3 | -90.1 | 0 | 0 | 0 | 109.2 | ||||
| 311 | F | 38.4 | Very low | 33.1 | Very low | 274 Ų | 274 | 163.3 Ų | 163.3 | 100% | 1.202 | 77% | 0.774 | S | S | * | * | trans | 45.7 | 0 | 157.3 | -71.3 | -88.6 | 0 | 0 | 0 | 120.8 |
Retrieved 311 of 311 residues in 197.7 ms
(Link to these results)