| 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 | 64.6 | Low | 86.8 | Confident | 210 Ų | 210 | 118 Ų | 118 | 100% | 1.034 | 60% | 0.596 | S | S | * | * | 0 | 132.3 | 0 | -82.6 | 175.9 | 75.6 | 0 | 0 | 108.4 | T3 V6 | M1-T3 PolarHBondContact O-N 2.85Å; M1-V6 HydrophobicContact CE-CG2 4.42Å | |||
| 2 | N | 81.5 | Confident | 87.1 | Confident | 116 Ų | 116 | 113.8 Ų | 113.8 | 62% | 0.62 | 58% | 0.581 | S | S | * | * | trans | -65.8 | 124.4 | 179.3 | -104.5 | -19.1 | 0 | 0 | 0 | 109.8 | Y4 V5 | N2-Y4 PolarHBondContact O-N 3.31Å; N2-Y4 VanDerWaalsContact O-N 3.13Å; N2-V5 HydrophobicContact CB-CG2 4.02Å; N2-V5 WeakPolarHBondContact O-CB 3.28Å; N2-V5 PolarHBondContact O-N 3.02Å | ||
| 3 | T | 87.7 | Confident | 87.4 | Confident | 99 Ų | 99 | 112.4 Ų | 112.4 | 61% | 0.607 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -52 | -34.2 | 176.7 | 47.8 | 0 | 0 | 0 | 0 | 112.2 | M1 V5 V6 L7 | M1-T3 PolarHBondContact O-N 2.85Å; T3-V5 VanDerWaalsContact C-N 3.34Å; T3-V5 PolarHBondContact O-N 3.17Å; T3-V6 PolarHBondContact O-N 3.23Å; T3-L7 PolarHBondContact O-N 2.85Å |
| 4 | Y | 87.1 | Confident | 87.5 | Confident | 178 Ų | 178 | 109.9 Ų | 109.9 | 70% | 0.698 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -56.8 | -40.4 | 172.9 | -68.1 | -77.8 | 0 | 0 | 0 | 113.9 | N2 V6 L7 M8 | N2-Y4 PolarHBondContact O-N 3.31Å; N2-Y4 VanDerWaalsContact O-N 3.13Å; Y4-V6 VanDerWaalsContact C-N 3.34Å; Y4-L7 PolarHBondContact O-N 2.94Å; Y4-M8 VanDerWaalsContact O-CG 3.31Å; Y4-M8 WeakPolarHBondContact O-CG 3.44Å; Y4-M8 PolarHBondContact O-N 3.22Å |
| 5 | V | 90 | Very high | 87.3 | Confident | 84 Ų | 84 | 107.8 Ų | 107.8 | 51% | 0.509 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -67.5 | -39.4 | 179.9 | 179.1 | 0 | 0 | 0 | 0 | 110.5 | N2 T3 M8 F9 | N2-V5 HydrophobicContact CB-CG2 4.02Å; N2-V5 WeakPolarHBondContact O-CB 3.28Å; N2-V5 PolarHBondContact O-N 3.02Å; T3-V5 VanDerWaalsContact C-N 3.34Å; T3-V5 PolarHBondContact O-N 3.17Å; V5-M8 PolarHBondContact O-N 3.03Å; V5-F9 PolarHBondContact O-N 3.16Å |
| 6 | V | 90.6 | Very high | 87.1 | Confident | 69 Ų | 69 | 106.6 Ų | 106.6 | 42% | 0.418 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -65.2 | -44.1 | 176.9 | -179.4 | 0 | 0 | 0 | 0 | 110.8 | M1 T3 Y4 M8 F9 I10 | M1-V6 HydrophobicContact CE-CG2 4.42Å; T3-V6 PolarHBondContact O-N 3.23Å; Y4-V6 VanDerWaalsContact C-N 3.34Å; V6-M8 PolarHBondContact O-N 2.94Å; V6-F9 PolarHBondContact O-N 3.47Å; V6-I10 HydrophobicContact CG1-CD1 4.08Å; V6-I10 WeakPolarHBondContact O-CG1 3.48Å; V6-I10 PolarHBondContact O-N 3.27Å |
| 7 | L | 91.8 | Very high | 86.6 | Confident | 100 Ų | 100 | 107.8 Ų | 107.8 | 52% | 0.524 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -59.5 | -45.4 | 175.4 | -98.9 | 158.6 | 0 | 0 | 0 | 112.4 | T3 Y4 F9 I10 L11 | T3-L7 PolarHBondContact O-N 2.85Å; Y4-L7 PolarHBondContact O-N 2.94Å; L7-F9 VanDerWaalsContact C-N 3.28Å; L7-F9 PolarHBondContact O-N 3.45Å; L7-I10 PolarHBondContact O-N 3.25Å; L7-L11 WeakPolarHBondContact O-CG 3.44Å; L7-L11 PolarHBondContact O-N 3.3Å |
| 8 | M | 90.3 | Very high | 86 | Confident | 121 Ų | 121 | 108.9 Ų | 108.9 | 60% | 0.596 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -61.2 | -38.7 | 176.5 | -71.3 | -61.6 | -67 | 0 | 0 | 111.9 | Y4 V5 V6 L11 T12 | Y4-M8 VanDerWaalsContact O-CG 3.31Å; Y4-M8 WeakPolarHBondContact O-CG 3.44Å; Y4-M8 PolarHBondContact O-N 3.22Å; V5-M8 PolarHBondContact O-N 3.03Å; V6-M8 PolarHBondContact O-N 2.94Å; M8-L11 PolarHBondContact O-N 2.88Å; M8-T12 WeakPolarHBondContact O-CG2 3.49Å; M8-T12 PolarHBondContact O-N 3.28Å; M8-T12 VanDerWaalsContact O-N 3.08Å; M8-T12 PolarHBondContact O-OG1 3.41Å |
| 9 | F | 90.6 | Very high | 85.5 | Confident | 141 Ų | 141 | 110.4 Ų | 110.4 | 62% | 0.618 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -67.8 | -36.6 | 178.3 | -148.3 | -91.9 | 0 | 0 | 0 | 112.7 | V5 V6 L7 T12 I13 | V5-F9 PolarHBondContact O-N 3.16Å; V6-F9 PolarHBondContact O-N 3.47Å; L7-F9 VanDerWaalsContact C-N 3.28Å; L7-F9 PolarHBondContact O-N 3.45Å; F9-T12 PolarHBondContact O-OG1 2.89Å; F9-I13 HydrophobicContact CD1-CD1 3.71Å; F9-I13 HydrophobicContact CD1-CG1 4.44Å; F9-I13 HydrophobicContact CE1-CD1 3.9Å; F9-I13 WeakPolarHBondContact O-CD1 3.42Å; F9-I13 VanDerWaalsContact O-CG1 3.28Å; F9-I13 WeakPolarHBondContact O-CG1 3.36Å; F9-I13 PolarHBondContact O-N 2.92Å |
| 10 | I | 90.9 | Very high | 84.9 | Confident | 86 Ų | 86 | 112 Ų | 112 | 44% | 0.441 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -68.1 | -44.6 | 175.8 | -67.5 | 166.8 | 0 | 0 | 0 | 110.4 | V6 L7 T12 I13 I14 | V6-I10 HydrophobicContact CG1-CD1 4.08Å; V6-I10 WeakPolarHBondContact O-CG1 3.48Å; V6-I10 PolarHBondContact O-N 3.27Å; L7-I10 PolarHBondContact O-N 3.25Å; I10-T12 PolarHBondContact O-N 3.42Å; I10-I13 PolarHBondContact O-N 2.9Å; I10-I14 HydrophobicContact CG2-CD1 3.77Å; I10-I14 HydrophobicContact CG2-CG1 4.49Å; I10-I14 VanDerWaalsContact O-CG1 3.32Å; I10-I14 WeakPolarHBondContact O-CG1 3.47Å; I10-I14 PolarHBondContact O-N 3.44Å |
| 11 | L | 89.7 | Confident | 84.3 | Confident | 94 Ų | 94 | 109.7 Ų | 109.7 | 49% | 0.492 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -63 | -40.5 | -179.9 | -70.1 | 172.5 | 0 | 0 | 0 | 112.1 | L7 M8 I14 S15 | L7-L11 WeakPolarHBondContact O-CG 3.44Å; L7-L11 PolarHBondContact O-N 3.3Å; M8-L11 PolarHBondContact O-N 2.88Å; L11-I14 PolarHBondContact O-N 3.5Å; L11-S15 PolarHBondContact O-N 2.95Å; L11-S15 PolarHBondContact O-OG 3.47Å |
| 12 | T | 90.5 | Very high | 84.2 | Confident | 67 Ų | 67 | 103.6 Ų | 103.6 | 41% | 0.411 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -65.7 | -40.1 | 177.2 | 51.2 | 0 | 0 | 0 | 0 | 112.5 | M8 F9 I10 I14 S15 I16 | M8-T12 WeakPolarHBondContact O-CG2 3.49Å; M8-T12 PolarHBondContact O-N 3.28Å; M8-T12 VanDerWaalsContact O-N 3.08Å; M8-T12 PolarHBondContact O-OG1 3.41Å; F9-T12 PolarHBondContact O-OG1 2.89Å; I10-T12 PolarHBondContact O-N 3.42Å; T12-I14 VanDerWaalsContact C-N 3.34Å; T12-I14 PolarHBondContact O-N 3.38Å; T12-S15 PolarHBondContact O-N 3.46Å; T12-I16 WeakPolarHBondContact O-CB 3.32Å; T12-I16 VanDerWaalsContact O-CG1 3.25Å; T12-I16 WeakPolarHBondContact O-CG1 3.38Å; T12-I16 PolarHBondContact O-N 3.33Å |
| 13 | I | 91.1 | Very high | 83.1 | Confident | 96 Ų | 96 | 100.4 Ų | 100.4 | 49% | 0.492 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.7 | -43.9 | 175.4 | -68.6 | 167.5 | 0 | 0 | 0 | 110.7 | F9 I10 I16 H17 | F9-I13 HydrophobicContact CD1-CD1 3.71Å; F9-I13 HydrophobicContact CD1-CG1 4.44Å; F9-I13 HydrophobicContact CE1-CD1 3.9Å; F9-I13 WeakPolarHBondContact O-CD1 3.42Å; F9-I13 VanDerWaalsContact O-CG1 3.28Å; F9-I13 WeakPolarHBondContact O-CG1 3.36Å; F9-I13 PolarHBondContact O-N 2.92Å; I10-I13 PolarHBondContact O-N 2.9Å; I13-I16 PolarHBondContact O-N 2.88Å; I13-H17 WeakPolarHBondContact O-CB 3.4Å; I13-H17 PolarHBondContact O-N 2.85Å |
| 14 | I | 87.9 | Confident | 81.6 | Confident | 78 Ų | 78 | 103 Ų | 103 | 40% | 0.4 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.2 | -47.5 | 177.8 | -68.6 | 168.6 | 0 | 0 | 0 | 110.3 | I10 L11 T12 I16 H17 F18 | I10-I14 HydrophobicContact CG2-CD1 3.77Å; I10-I14 HydrophobicContact CG2-CG1 4.49Å; I10-I14 VanDerWaalsContact O-CG1 3.32Å; I10-I14 WeakPolarHBondContact O-CG1 3.47Å; I10-I14 PolarHBondContact O-N 3.44Å; L11-I14 PolarHBondContact O-N 3.5Å; T12-I14 VanDerWaalsContact C-N 3.34Å; T12-I14 PolarHBondContact O-N 3.38Å; I14-I16 PolarHBondContact O-N 3.3Å; I14-H17 PolarHBondContact O-N 2.89Å; I14-F18 HydrophobicContact CG2-CD2 3.57Å; I14-F18 HydrophobicContact CG2-CE2 3.57Å; I14-F18 VanDerWaalsContact O-CD2 3.3Å; I14-F18 WeakPolarHBondContact O-CD2 3.17Å; I14-F18 PolarHBondContact O-N 2.81Å |
| 15 | S | 85.6 | Confident | 80.2 | Confident | 78 Ų | 78 | 97.9 Ų | 97.9 | 55% | 0.545 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.3 | -42.9 | 178.1 | -64.9 | 0 | 0 | 0 | 0 | 112.8 | L11 T12 H17 F18 Q19 | L11-S15 PolarHBondContact O-N 2.95Å; L11-S15 PolarHBondContact O-OG 3.47Å; T12-S15 PolarHBondContact O-N 3.46Å; S15-H17 VanDerWaalsContact C-N 3.34Å; S15-F18 PolarHBondContact O-N 2.99Å; S15-Q19 WeakPolarHBondContact O-CB 3.37Å; S15-Q19 PolarHBondContact O-N 2.82Å |
| 16 | I | 83.1 | Confident | 78.6 | Confident | 89 Ų | 89 | 99.9 Ų | 99.9 | 46% | 0.456 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.1 | -44.5 | 176.2 | -70.2 | 166.6 | 0 | 0 | 0 | 110.3 | T12 I13 I14 Q19 Y20 | T12-I16 WeakPolarHBondContact O-CB 3.32Å; T12-I16 VanDerWaalsContact O-CG1 3.25Å; T12-I16 WeakPolarHBondContact O-CG1 3.38Å; T12-I16 PolarHBondContact O-N 3.33Å; I13-I16 PolarHBondContact O-N 2.88Å; I14-I16 PolarHBondContact O-N 3.3Å; I16-Q19 PolarHBondContact O-N 3.29Å; I16-Y20 HydrophobicContact CG2-CD2 3.59Å; I16-Y20 HydrophobicContact CG2-CE2 3.4Å; I16-Y20 WeakPolarHBondContact O-CD2 3.33Å; I16-Y20 PolarHBondContact O-N 3.33Å |
| 17 | H | 78.8 | Confident | 76.8 | Confident | 127 Ų | 127 | 102 Ų | 102 | 59% | 0.588 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -61.2 | -48.1 | 178.4 | -168.6 | 70.2 | 0 | 0 | 0 | 111.6 | I13 I14 S15 Q19 Y20 T21 | I13-H17 WeakPolarHBondContact O-CB 3.4Å; I13-H17 PolarHBondContact O-N 2.85Å; I14-H17 PolarHBondContact O-N 2.89Å; S15-H17 VanDerWaalsContact C-N 3.34Å; H17-Q19 VanDerWaalsContact C-N 3.34Å; H17-Q19 PolarHBondContact O-N 2.87Å; H17-Y20 PolarHBondContact O-N 3.38Å; H17-T21 WeakPolarHBondContact O-CB 3.33Å; H17-T21 PolarHBondContact O-N 2.85Å; H17-T21 PolarHBondContact O-OG1 2.9Å |
| 18 | F | 77 | Confident | 75 | Confident | 127 Ų | 127 | 103.4 Ų | 103.4 | 56% | 0.557 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -59.9 | -42.3 | 176.2 | -88.2 | -74.4 | 0 | 0 | 0 | 112.4 | I14 S15 Y20 T21 I22 | I14-F18 HydrophobicContact CG2-CD2 3.57Å; I14-F18 HydrophobicContact CG2-CE2 3.57Å; I14-F18 VanDerWaalsContact O-CD2 3.3Å; I14-F18 WeakPolarHBondContact O-CD2 3.17Å; I14-F18 PolarHBondContact O-N 2.81Å; S15-F18 PolarHBondContact O-N 2.99Å; F18-Y20 PolarHBondContact O-N 3.48Å; F18-T21 PolarHBondContact O-N 3.44Å; F18-I22 WeakPolarHBondContact O-CB 3.37Å; F18-I22 WeakPolarHBondContact O-CD1 3.48Å; F18-I22 WeakPolarHBondContact O-CG1 3.27Å; F18-I22 PolarHBondContact O-N 3.22Å |
| 19 | Q | 75.6 | Confident | 73.2 | Confident | 137 Ų | 137 | 103.3 Ų | 103.3 | 64% | 0.64 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -62.3 | -44.7 | 178.2 | -173.1 | 174.6 | -7.6 | 0 | 0 | 111.4 | S15 I16 H17 S23 | S15-Q19 WeakPolarHBondContact O-CB 3.37Å; S15-Q19 PolarHBondContact O-N 2.82Å; I16-Q19 PolarHBondContact O-N 3.29Å; H17-Q19 VanDerWaalsContact C-N 3.34Å; H17-Q19 PolarHBondContact O-N 2.87Å; Q19-S23 VanDerWaalsContact O-CB 3.3Å; Q19-S23 WeakPolarHBondContact O-CB 3.49Å; Q19-S23 PolarHBondContact O-N 3.02Å; Q19-S23 PolarHBondContact O-OG 2.78Å |
| 20 | Y | 73.8 | Confident | 71.3 | Confident | 143 Ų | 143 | 101.9 Ų | 101.9 | 56% | 0.561 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -64.4 | -46.7 | 176.1 | -78.5 | -63.7 | 0 | 0 | 0 | 111.9 | I16 H17 F18 I22 S23 Y24 | I16-Y20 HydrophobicContact CG2-CD2 3.59Å; I16-Y20 HydrophobicContact CG2-CE2 3.4Å; I16-Y20 WeakPolarHBondContact O-CD2 3.33Å; I16-Y20 PolarHBondContact O-N 3.33Å; H17-Y20 PolarHBondContact O-N 3.38Å; F18-Y20 PolarHBondContact O-N 3.48Å; Y20-I22 PolarHBondContact O-N 2.83Å; Y20-S23 PolarHBondContact O-N 2.71Å; Y20-Y24 WeakPolarHBondContact O-CD2 3.13Å; Y20-Y24 PolarHBondContact O-N 2.97Å |
| 21 | T | 71.9 | Confident | 69.6 | Low | 63 Ų | 63 | 100.9 Ų | 100.9 | 39% | 0.387 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.2 | -45.1 | 179.2 | -55.8 | 0 | 0 | 0 | 0 | 111.8 | H17 F18 Y24 T25 | H17-T21 WeakPolarHBondContact O-CB 3.33Å; H17-T21 PolarHBondContact O-N 2.85Å; H17-T21 PolarHBondContact O-OG1 2.9Å; F18-T21 PolarHBondContact O-N 3.44Å; T21-Y24 PolarHBondContact O-N 3.36Å; T21-T25 PolarHBondContact O-N 3.47Å; T21-T25 PolarHBondContact O-OG1 3.44Å |
| 22 | I | 63 | Low | 67.6 | Low | 82 Ų | 82 | 99.9 Ų | 99.9 | 42% | 0.421 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64 | -44.3 | 177.3 | -67.4 | 166.3 | 0 | 0 | 0 | 110.5 | F18 Y20 Y24 T25 E26 | F18-I22 WeakPolarHBondContact O-CB 3.37Å; F18-I22 WeakPolarHBondContact O-CD1 3.48Å; F18-I22 WeakPolarHBondContact O-CG1 3.27Å; F18-I22 PolarHBondContact O-N 3.22Å; Y20-I22 PolarHBondContact O-N 2.83Å; I22-Y24 VanDerWaalsContact C-N 3.29Å; I22-Y24 PolarHBondContact O-N 3.18Å; I22-T25 VanDerWaalsContact CA-OG1 3.27Å; I22-T25 WeakPolarHBondContact CA-OG1 3.31Å; I22-T25 PolarHBondContact O-N 3.09Å; I22-T25 VanDerWaalsContact O-N 3.1Å; I22-T25 PolarHBondContact O-OG1 3.37Å; I22-E26 HydrophobicContact CG2-CG 4.25Å; I22-E26 WeakPolarHBondContact O-CG 3.33Å; I22-E26 PolarHBondContact O-N 3.02Å |
| 23 | S | 57.2 | Low | 65.7 | Low | 49 Ų | 49 | 104.2 Ų | 104.2 | 34% | 0.343 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -59.9 | -39.7 | 178.5 | -55.7 | 0 | 0 | 0 | 0 | 112 | Q19 Y20 L27 | Q19-S23 VanDerWaalsContact O-CB 3.3Å; Q19-S23 WeakPolarHBondContact O-CB 3.49Å; Q19-S23 PolarHBondContact O-N 3.02Å; Q19-S23 PolarHBondContact O-OG 2.78Å; Y20-S23 PolarHBondContact O-N 2.71Å; S23-L27 WeakPolarHBondContact O-CG 3.26Å; S23-L27 PolarHBondContact O-N 3.33Å; S23-L27 VanDerWaalsContact O-N 3.16Å |
| 24 | Y | 58 | Low | 63.8 | Low | 154 Ų | 154 | 105.3 Ų | 105.3 | 60% | 0.604 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -67.4 | -40.9 | 174.5 | -75.4 | -63.6 | 0 | 0 | 0 | 112 | Y20 T21 I22 L27 D28 | Y20-Y24 WeakPolarHBondContact O-CD2 3.13Å; Y20-Y24 PolarHBondContact O-N 2.97Å; T21-Y24 PolarHBondContact O-N 3.36Å; I22-Y24 VanDerWaalsContact C-N 3.29Å; I22-Y24 PolarHBondContact O-N 3.18Å; Y24-L27 PolarHBondContact O-N 3.49Å; Y24-D28 PolarHBondContact O-N 3.38Å |
| 25 | T | 56.6 | Low | 62.1 | Low | 71 Ų | 71 | 108.9 Ų | 108.9 | 44% | 0.436 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -66.9 | -37 | 176.7 | 49.3 | 0 | 0 | 0 | 0 | 112.9 | T21 I22 L27 D28 D29 | T21-T25 PolarHBondContact O-N 3.47Å; T21-T25 PolarHBondContact O-OG1 3.44Å; I22-T25 VanDerWaalsContact CA-OG1 3.27Å; I22-T25 WeakPolarHBondContact CA-OG1 3.31Å; I22-T25 PolarHBondContact O-N 3.09Å; I22-T25 VanDerWaalsContact O-N 3.1Å; I22-T25 PolarHBondContact O-OG1 3.37Å; T25-L27 VanDerWaalsContact C-N 3.31Å; T25-L27 PolarHBondContact O-N 2.86Å; T25-D28 PolarHBondContact O-N 3.24Å; T25-D29 WeakPolarHBondContact O-CB 3.15Å; T25-D29 PolarHBondContact O-N 2.74Å |
| 26 | E | 55.6 | Low | 60.4 | Low | 126 Ų | 126 | 111.3 Ų | 111.3 | 59% | 0.589 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -66.1 | -35.2 | 175.7 | -73.9 | -177.7 | -176 | 0 | 0 | 111.8 | I22 L30 | I22-E26 HydrophobicContact CG2-CG 4.25Å; I22-E26 WeakPolarHBondContact O-CG 3.33Å; I22-E26 PolarHBondContact O-N 3.02Å; E26-L30 WeakPolarHBondContact O-CG 3.16Å; E26-L30 PolarHBondContact O-N 3.34Å |
| 27 | L | 53.9 | Low | 58.8 | Low | 114 Ų | 114 | 112.1 Ų | 112.1 | 60% | 0.597 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -70.8 | -35.8 | 174.4 | -72.3 | 172.5 | 0 | 0 | 0 | 112.7 | S23 Y24 T25 | S23-L27 WeakPolarHBondContact O-CG 3.26Å; S23-L27 PolarHBondContact O-N 3.33Å; S23-L27 VanDerWaalsContact O-N 3.16Å; Y24-L27 PolarHBondContact O-N 3.49Å; T25-L27 VanDerWaalsContact C-N 3.31Å; T25-L27 PolarHBondContact O-N 2.86Å |
| 28 | D | 53.3 | Low | 57.6 | Low | 129 Ų | 129 | 113.5 Ų | 113.5 | 69% | 0.69 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -73.5 | -33.6 | 175.9 | -82.2 | -12.7 | 0 | 0 | 0 | 112.3 | Y24 T25 L30 | Y24-D28 PolarHBondContact O-N 3.38Å; T25-D28 PolarHBondContact O-N 3.24Å; D28-L30 VanDerWaalsContact C-N 3.29Å; D28-L30 PolarHBondContact O-N 3.03Å |
| 29 | D | 52 | Low | 56.2 | Low | 118 Ų | 118 | 115 Ų | 115 | 63% | 0.631 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -71.5 | -23.4 | 175.3 | -87.8 | -17.1 | 0 | 0 | 0 | 112.5 | T25 D31 | T25-D29 WeakPolarHBondContact O-CB 3.15Å; T25-D29 PolarHBondContact O-N 2.74Å; D29-D31 PolarHBondContact O-N 2.84Å |
| 30 | L | 52.4 | Low | 55 | Low | 112 Ų | 112 | 116.1 Ų | 116.1 | 59% | 0.586 | 57% | 0.571 | S | S | * | * | S | Bend | trans | -73.7 | 63.7 | 162.2 | -69.3 | 172.9 | 0 | 0 | 0 | 109.5 | E26 D28 P32 | E26-L30 WeakPolarHBondContact O-CG 3.16Å; E26-L30 PolarHBondContact O-N 3.34Å; D28-L30 VanDerWaalsContact C-N 3.29Å; D28-L30 PolarHBondContact O-N 3.03Å; L30-P32 WeakPolarHBondContact O-CD 3.46Å; L30-P32 VanDerWaalsContact O-N 3.08Å |
| 31 | D | 54 | Low | 53.7 | Low | 64 Ų | 64 | 116.9 Ų | 116.9 | 34% | 0.342 | 57% | 0.574 | S | S | . | * | trans | -40.9 | 117.3 | 172.4 | -122 | -33 | 0 | 0 | 0 | 108.3 | D29 W33 Q34 | D29-D31 PolarHBondContact O-N 2.84Å; D31-W33 HydrophobicContact CB-CD2 4.45Å; D31-W33 HydrophobicContact CB-CG 4.21Å; D31-W33 HydrophobicContact CB-CZ2 4.45Å; D31-W33 PolarHBondContact O-N 3.1Å; D31-W33 VanDerWaalsContact OD1-CD1 3.29Å; D31-W33 PolarHBondContact OD1-NE1 3.31Å; D31-W33 PolarHBondContact OD2-NE1 3.48Å; D31-Q34 WeakPolarHBondContact O-CB 3.37Å; D31-Q34 PolarHBondContact O-N 2.9Å | ||
| 32 | P | 48.1 | Very low | 52.5 | Low | 74 Ų | 74 | 117.8 Ų | 117.8 | 48% | 0.481 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -54.5 | -24.9 | -172.1 | -29 | 33.2 | 0 | 0 | 0 | 113.6 | L30 Q34 K35 Y36 | L30-P32 WeakPolarHBondContact O-CD 3.46Å; L30-P32 VanDerWaalsContact O-N 3.08Å; P32-Q34 VanDerWaalsContact C-N 3.31Å; P32-Q34 PolarHBondContact O-N 3.5Å; P32-K35 PolarHBondContact O-N 3.22Å; P32-Y36 PolarHBondContact O-N 2.83Å |
| 33 | W | 50.7 | Low | 51.7 | Low | 157 Ų | 157 | 119.9 Ų | 119.9 | 60% | 0.595 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -66.8 | -26.1 | 175.9 | 70.6 | -98.8 | 0 | 0 | 0 | 113.7 | D31 Y36 P37 | D31-W33 HydrophobicContact CB-CD2 4.45Å; D31-W33 HydrophobicContact CB-CG 4.21Å; D31-W33 HydrophobicContact CB-CZ2 4.45Å; D31-W33 PolarHBondContact O-N 3.1Å; D31-W33 VanDerWaalsContact OD1-CD1 3.29Å; D31-W33 PolarHBondContact OD1-NE1 3.31Å; D31-W33 PolarHBondContact OD2-NE1 3.48Å; W33-Y36 CarbonylContact O-C 3.56Å; W33-P37 WeakPolarHBondContact O-CA 3.11Å |
| 34 | Q | 50.7 | Low | 51 | Low | 119 Ų | 119 | 124.2 Ų | 124.2 | 56% | 0.556 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -74.2 | -36.3 | 172.2 | -75.4 | -171.2 | -29.3 | 0 | 0 | 111.8 | D31 P32 | D31-Q34 WeakPolarHBondContact O-CB 3.37Å; D31-Q34 PolarHBondContact O-N 2.9Å; P32-Q34 VanDerWaalsContact C-N 3.31Å; P32-Q34 PolarHBondContact O-N 3.5Å |
| 35 | K | 52.6 | Low | 50.3 | Low | 153 Ų | 153 | 127.5 Ų | 127.5 | 67% | 0.665 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -76.9 | -31.2 | -179.9 | -167 | 172.1 | -178.7 | 175.9 | 0 | 112.5 | P32 | P32-K35 PolarHBondContact O-N 3.22Å |
| 36 | Y | 49.4 | Very low | 49.7 | Very low | 129 Ų | 129 | 128.2 Ų | 128.2 | 51% | 0.506 | 62% | 0.624 | S | S | . | * | trans | -134.8 | 80.4 | 178.4 | -56.2 | -79.7 | 0 | 0 | 0 | 111.6 | P32 W33 N38 Y39 | P32-Y36 PolarHBondContact O-N 2.83Å; W33-Y36 CarbonylContact O-C 3.56Å; Y36-N38 PolarHBondContact O-N 2.81Å; Y36-N38 VanDerWaalsContact O-N 3.09Å; Y36-Y39 PolarHBondContact O-N 2.89Å | ||
| 37 | P | 50.9 | Low | 49.3 | Very low | 107 Ų | 107 | 133 Ų | 133 | 70% | 0.695 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.8 | -22.3 | -176.8 | 22.1 | -32.3 | 0 | 0 | 0 | 113.9 | W33 | W33-P37 WeakPolarHBondContact O-CA 3.11Š|
| 38 | N | 52.3 | Low | 49.2 | Very low | 156 Ų | 156 | 138.7 Ų | 138.7 | 83% | 0.834 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.2 | 14.4 | -176.3 | -66.3 | -16.4 | 0 | 0 | 0 | 113.8 | Y36 D40 | Y36-N38 PolarHBondContact O-N 2.81Å; Y36-N38 VanDerWaalsContact O-N 3.09Å; N38-D40 PolarHBondContact O-N 3.45Å |
| 39 | Y | 48.8 | Very low | 49 | Very low | 157 Ų | 157 | 140.6 Ų | 140.6 | 62% | 0.616 | 65% | 0.649 | S | S | * | * | trans | -89.4 | 107 | 173.8 | -153.1 | -97.6 | 0 | 0 | 0 | 108.2 | Y36 Y41 | Y36-Y39 PolarHBondContact O-N 2.89Å; Y39-Y41 HydrophobicContact CD1-CD2 4.08Å; Y39-Y41 PolarHBondContact O-N 3.13Å | ||
| 40 | D | 49.9 | Very low | 49.1 | Very low | 161 Ų | 161 | 136.8 Ų | 136.8 | 86% | 0.861 | 63% | 0.632 | S | S | * | * | trans | -61.1 | 85.3 | 165.3 | -78.5 | -32.5 | 0 | 0 | 0 | 107.7 | N38 P42 | N38-D40 PolarHBondContact O-N 3.45Å; D40-P42 VanDerWaalsContact O-CD 3.3Å; D40-P42 WeakPolarHBondContact O-CD 3.32Å; D40-P42 VanDerWaalsContact O-N 3.17Å | ||
| 41 | Y | 47.1 | Very low | 49.3 | Very low | 159 Ų | 159 | 135.7 Ų | 135.7 | 62% | 0.624 | 63% | 0.626 | S | S | * | * | trans | -60.9 | 122.7 | 178.7 | -143.9 | -89.5 | 0 | 0 | 0 | 107 | Y39 I43 | Y39-Y41 HydrophobicContact CD1-CD2 4.08Å; Y39-Y41 PolarHBondContact O-N 3.13Å; Y41-I43 WeakPolarHBondContact O-CG1 3.3Å; Y41-I43 PolarHBondContact O-N 3.36Å | ||
| 42 | P | 45.6 | Very low | 49.3 | Very low | 83 Ų | 83 | 140.7 Ų | 140.7 | 54% | 0.539 | 64% | 0.642 | S | S | . | * | trans | -64.2 | 104.6 | 175.8 | 22.5 | -29.2 | 0 | 0 | 0 | 108.1 | D40 N44 | D40-P42 VanDerWaalsContact O-CD 3.3Å; D40-P42 WeakPolarHBondContact O-CD 3.32Å; D40-P42 VanDerWaalsContact O-N 3.17Å; P42-N44 PolarHBondContact O-N 3.4Å | ||
| 43 | I | 46.9 | Very low | 49.7 | Very low | 125 Ų | 125 | 142.7 Ų | 142.7 | 64% | 0.641 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.8 | 54.5 | 177.5 | -49.7 | 170.2 | 0 | 0 | 0 | 109.3 | Y41 I46 | Y41-I43 WeakPolarHBondContact O-CG1 3.3Å; Y41-I43 PolarHBondContact O-N 3.36Å; I43-I46 HydrophobicContact CG2-CB 4.26Å |
| 44 | N | 41.1 | Very low | 50.4 | Low | 140 Ų | 140 | 142.2 Ų | 142.2 | 75% | 0.749 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.4 | -15.6 | 174.3 | -84.5 | -13 | 0 | 0 | 0 | 112.6 | P42 | P42-N44 PolarHBondContact O-N 3.4Š|
| 45 | Y | 44.2 | Very low | 51.1 | Low | 224 Ų | 224 | 143.4 Ų | 143.4 | 88% | 0.878 | 65% | 0.646 | S | S | * | * | S | Bend | trans | -89.3 | -5.3 | 174.7 | -79.4 | -79.7 | 0 | 0 | 0 | 114.9 | ||
| 46 | I | 43.8 | Very low | 51.8 | Low | 85 Ų | 85 | 137.4 Ų | 137.4 | 44% | 0.436 | 63% | 0.627 | S | S | . | * | trans | -119.7 | 45.6 | -175.5 | -41.2 | 174.9 | 0 | 0 | 0 | 111.8 | I43 | I43-I46 HydrophobicContact CG2-CB 4.26Š| ||
| 47 | R | 48.1 | Very low | 52.6 | Low | 228 Ų | 228 | 135.5 Ų | 135.5 | 86% | 0.86 | 63% | 0.625 | S | S | * | * | S | Bend | trans | -91.9 | -20.1 | 167.6 | -109.8 | -174.7 | -173.3 | -165.3 | 3.2 | 114.3 | ||
| 48 | R | 51.6 | Low | 53.6 | Low | 233 Ų | 233 | 138.7 Ų | 138.7 | 88% | 0.879 | 62% | 0.624 | S | S | * | * | S | Bend | trans | -92 | -23.2 | -178.9 | -73.5 | -171 | 179.9 | -167.6 | 0.9 | 114.8 | ||
| 49 | Y | 48.5 | Very low | 54.4 | Low | 169 Ų | 169 | 136.5 Ų | 136.5 | 66% | 0.663 | 61% | 0.612 | S | S | * | * | S | Bend | trans | -127.7 | 16.1 | -175.1 | -62.4 | -72.7 | 0 | 0 | 0 | 114.6 | D51 Y52 H53 | Y49-D51 PolarHBondContact O-N 2.99Å; Y49-D51 VanDerWaalsContact O-N 3.09Å; Y49-Y52 PolarHBondContact O-N 3.4Å; Y49-H53 PolarHBondContact O-N 3.02Å |
| 50 | S | 53.9 | Low | 55.4 | Low | 37 Ų | 37 | 135.1 Ų | 135.1 | 26% | 0.259 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -50.7 | -40.2 | -177.5 | 61 | 0 | 0 | 0 | 0 | 112.6 | K54 | S50-K54 WeakPolarHBondContact O-CB 3.48Å; S50-K54 WeakPolarHBondContact O-CD 3.47Å; S50-K54 WeakPolarHBondContact O-CG 3.27Å; S50-K54 PolarHBondContact O-N 3.22Å |
| 51 | D | 57 | Low | 56.5 | Low | 89 Ų | 89 | 136.9 Ų | 136.9 | 48% | 0.476 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -80.4 | -37 | -173.7 | -71.7 | 7.2 | 0 | 0 | 0 | 112 | Y49 R55 | Y49-D51 PolarHBondContact O-N 2.99Å; Y49-D51 VanDerWaalsContact O-N 3.09Å; D51-R55 WeakPolarHBondContact O-CB 3.5Å; D51-R55 WeakPolarHBondContact O-CG 3.19Å; D51-R55 PolarHBondContact O-N 3.25Å; D51-R55 PolarHBondContact O-NE 3.08Å |
| 52 | Y | 53.5 | Low | 57.6 | Low | 169 Ų | 169 | 134.9 Ų | 134.9 | 66% | 0.663 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -68.7 | -44.4 | 177.5 | -172.1 | -96.4 | 0 | 0 | 0 | 111.1 | Y49 R55 G56 | Y49-Y52 PolarHBondContact O-N 3.4Å; Y52-R55 PolarHBondContact O-N 3.49Å; Y52-G56 PolarHBondContact O-N 3.45Å |
| 53 | H | 56.1 | Low | 58.8 | Low | 116 Ų | 116 | 132.5 Ų | 132.5 | 54% | 0.537 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -67.1 | -43.2 | 177.7 | -126.1 | -122 | 0 | 0 | 0 | 111.8 | Y49 R55 G56 L57 | Y49-H53 PolarHBondContact O-N 3.02Å; H53-R55 PolarHBondContact O-N 3.27Å; H53-G56 PolarHBondContact O-N 3.39Å; H53-L57 VanDerWaalsContact O-CB 3.31Å; H53-L57 WeakPolarHBondContact O-CB 3.43Å; H53-L57 VanDerWaalsContact O-CG 3.26Å; H53-L57 WeakPolarHBondContact O-CG 3.34Å; H53-L57 PolarHBondContact O-N 3.07Å |
| 54 | K | 66.8 | Low | 60 | Low | 148 Ų | 148 | 133.5 Ų | 133.5 | 64% | 0.643 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -63.5 | -39.8 | 174.5 | -74 | 176.1 | -178.5 | -176.4 | 0 | 112.1 | S50 R58 | S50-K54 WeakPolarHBondContact O-CB 3.48Å; S50-K54 WeakPolarHBondContact O-CD 3.47Å; S50-K54 WeakPolarHBondContact O-CG 3.27Å; S50-K54 PolarHBondContact O-N 3.22Å; K54-R58 WeakPolarHBondContact O-CB 3.47Å; K54-R58 PolarHBondContact O-N 3.03Å |
| 55 | R | 64.4 | Low | 61.4 | Low | 144 Ų | 144 | 134.5 Ų | 134.5 | 54% | 0.543 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -65.6 | -44.7 | 174.4 | -77.2 | -175.1 | -71.3 | -114.7 | 4.6 | 111.6 | D51 Y52 H53 R58 N59 | D51-R55 WeakPolarHBondContact O-CB 3.5Å; D51-R55 WeakPolarHBondContact O-CG 3.19Å; D51-R55 PolarHBondContact O-N 3.25Å; D51-R55 PolarHBondContact O-NE 3.08Å; Y52-R55 PolarHBondContact O-N 3.49Å; H53-R55 PolarHBondContact O-N 3.27Å; R55-R58 PolarHBondContact O-N 3.2Å; R55-N59 WeakPolarHBondContact O-CB 3.44Å; R55-N59 PolarHBondContact O-N 3.34Å; R55-N59 PolarHBondContact O-ND2 2.96Å; R55-N59 PolarHBondContact O-OD1 3.18Å |
| 56 | G | 67.6 | Low | 62.9 | Low | 26 Ų | 26 | 127.4 Ų | 127.4 | 27% | 0.268 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -59.8 | -51.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112 | Y52 H53 R58 N59 M60 | Y52-G56 PolarHBondContact O-N 3.45Å; H53-G56 PolarHBondContact O-N 3.39Å; G56-R58 PolarHBondContact O-N 3.03Å; G56-N59 PolarHBondContact O-N 3.35Å; G56-M60 WeakPolarHBondContact O-CB 3.48Å; G56-M60 WeakPolarHBondContact O-CG 3.41Å; G56-M60 PolarHBondContact O-N 2.95Å |
| 57 | L | 67.1 | Low | 64 | Low | 90 Ų | 90 | 129.7 Ų | 129.7 | 47% | 0.471 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -62.1 | -41 | 176.7 | -72 | 170.9 | 0 | 0 | 0 | 112.2 | H53 M60 R61 | H53-L57 VanDerWaalsContact O-CB 3.31Å; H53-L57 WeakPolarHBondContact O-CB 3.43Å; H53-L57 VanDerWaalsContact O-CG 3.26Å; H53-L57 WeakPolarHBondContact O-CG 3.34Å; H53-L57 PolarHBondContact O-N 3.07Å; L57-M60 PolarHBondContact O-N 3.21Å; L57-R61 WeakPolarHBondContact O-CB 3.31Å; L57-R61 PolarHBondContact O-N 2.96Å |
| 58 | R | 72 | Confident | 65.1 | Low | 174 Ų | 174 | 126.7 Ų | 126.7 | 66% | 0.657 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -63.2 | -44.7 | 174.9 | -177.1 | 179.3 | 174.1 | -154.2 | -2.4 | 111.2 | K54 R55 G56 R61 M62 | K54-R58 WeakPolarHBondContact O-CB 3.47Å; K54-R58 PolarHBondContact O-N 3.03Å; R55-R58 PolarHBondContact O-N 3.2Å; G56-R58 PolarHBondContact O-N 3.03Å; R58-R61 PolarHBondContact O-N 3.43Å; R58-M62 HydrophobicContact CG-CG 4.47Å; R58-M62 WeakPolarHBondContact O-CB 3.4Å; R58-M62 VanDerWaalsContact O-CG 3.27Å; R58-M62 WeakPolarHBondContact O-CG 3.41Å; R58-M62 PolarHBondContact O-N 3.49Å |
| 59 | N | 69.1 | Low | 66.1 | Low | 110 Ų | 110 | 120.4 Ų | 120.4 | 59% | 0.588 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -65 | -42.1 | 178.6 | -72.1 | -8.4 | 0 | 0 | 0 | 111.4 | R55 G56 M62 G63 | R55-N59 WeakPolarHBondContact O-CB 3.44Å; R55-N59 PolarHBondContact O-N 3.34Å; R55-N59 PolarHBondContact O-ND2 2.96Å; R55-N59 PolarHBondContact O-OD1 3.18Å; G56-N59 PolarHBondContact O-N 3.35Å; N59-M62 PolarHBondContact O-N 3.29Å; N59-G63 PolarHBondContact O-N 3.46Å |
| 60 | M | 69.5 | Low | 67.5 | Low | 127 Ų | 127 | 120.5 Ų | 120.5 | 63% | 0.626 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -62.5 | -42.5 | 173.7 | -72.4 | 177.4 | 176 | 0 | 0 | 111.6 | G56 L57 G63 K64 | G56-M60 WeakPolarHBondContact O-CB 3.48Å; G56-M60 WeakPolarHBondContact O-CG 3.41Å; G56-M60 PolarHBondContact O-N 2.95Å; L57-M60 PolarHBondContact O-N 3.21Å; M60-G63 PolarHBondContact O-N 2.98Å; M60-K64 WeakPolarHBondContact O-CB 3.44Å; M60-K64 WeakPolarHBondContact O-CG 3.42Å; M60-K64 PolarHBondContact O-N 2.95Å |
| 61 | R | 72.7 | Confident | 68.4 | Low | 199 Ų | 199 | 124 Ų | 124 | 75% | 0.751 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -64 | -43.1 | 176.6 | -171.1 | 179.6 | -69 | -177.6 | -2.4 | 111.8 | L57 R58 R65 | L57-R61 WeakPolarHBondContact O-CB 3.31Å; L57-R61 PolarHBondContact O-N 2.96Å; R58-R61 PolarHBondContact O-N 3.43Å; R61-R65 WeakPolarHBondContact O-CB 3.28Å; R61-R65 PolarHBondContact O-N 3.42Å |
| 62 | M | 69.2 | Low | 69.1 | Low | 116 Ų | 116 | 128 Ų | 128 | 57% | 0.571 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -65.8 | -40.3 | 175.1 | -68.6 | -66.8 | -69.6 | 0 | 0 | 111.6 | R58 N59 R65 S66 | R58-M62 HydrophobicContact CG-CG 4.47Å; R58-M62 WeakPolarHBondContact O-CB 3.4Å; R58-M62 VanDerWaalsContact O-CG 3.27Å; R58-M62 WeakPolarHBondContact O-CG 3.41Å; R58-M62 PolarHBondContact O-N 3.49Å; N59-M62 PolarHBondContact O-N 3.29Å; M62-R65 PolarHBondContact O-N 3.42Å; M62-S66 WeakPolarHBondContact O-CB 3.45Å; M62-S66 PolarHBondContact O-N 2.92Å |
| 63 | G | 70.9 | Confident | 70.3 | Confident | 34 Ų | 34 | 124 Ų | 124 | 35% | 0.351 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -64.8 | -46.4 | 176 | 0 | 0 | 0 | 0 | 0 | 112.8 | N59 M60 R65 S66 M67 | N59-G63 PolarHBondContact O-N 3.46Å; M60-G63 PolarHBondContact O-N 2.98Å; G63-R65 VanDerWaalsContact C-N 3.34Å; G63-R65 PolarHBondContact O-N 3.37Å; G63-S66 PolarHBondContact O-N 3.28Å; G63-M67 PolarHBondContact O-N 3.02Å |
| 64 | K | 73.1 | Confident | 71.3 | Confident | 146 Ų | 146 | 122.8 Ų | 122.8 | 64% | 0.635 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -60.2 | -42.7 | 174 | -74.5 | -175.3 | 179.5 | -175.6 | 0 | 111.2 | M60 M67 Y68 | M60-K64 WeakPolarHBondContact O-CB 3.44Å; M60-K64 WeakPolarHBondContact O-CG 3.42Å; M60-K64 PolarHBondContact O-N 2.95Å; K64-M67 PolarHBondContact O-N 3.41Å; K64-Y68 WeakPolarHBondContact O-CB 3.25Å; K64-Y68 PolarHBondContact O-N 3.26Å |
| 65 | R | 70.4 | Confident | 71.5 | Confident | 160 Ų | 160 | 120.1 Ų | 120.1 | 60% | 0.604 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -63.1 | -45.2 | 175.5 | -176.9 | 174.5 | 176.4 | 162.2 | 2.7 | 112.2 | R61 M62 G63 M67 Y68 E69 | R61-R65 WeakPolarHBondContact O-CB 3.28Å; R61-R65 PolarHBondContact O-N 3.42Å; M62-R65 PolarHBondContact O-N 3.42Å; G63-R65 VanDerWaalsContact C-N 3.34Å; G63-R65 PolarHBondContact O-N 3.37Å; R65-M67 VanDerWaalsContact C-N 3.34Å; R65-M67 PolarHBondContact O-N 3.31Å; R65-Y68 PolarHBondContact O-N 2.93Å; R65-E69 HydrophobicContact CG-CG 4.46Å; R65-E69 IonicContact CZ-OE1 3.69Å; R65-E69 IonicContact NE-OE1 2.9Å; R65-E69 PolarHBondContact NE-OE1 3Å; R65-E69 IonicContact NH2-OE1 3.57Å; R65-E69 WeakPolarHBondContact O-CB 3.5Å; R65-E69 WeakPolarHBondContact O-CG 3.16Å; R65-E69 PolarHBondContact O-N 2.62Å |
| 66 | S | 74.7 | Confident | 71.8 | Confident | 75 Ų | 75 | 120.1 Ų | 120.1 | 52% | 0.524 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -61.1 | -42.1 | 177 | 175.5 | 0 | 0 | 0 | 0 | 112 | M62 G63 R70 | M62-S66 WeakPolarHBondContact O-CB 3.45Å; M62-S66 PolarHBondContact O-N 2.92Å; G63-S66 PolarHBondContact O-N 3.28Å; S66-R70 WeakPolarHBondContact O-CB 3Å; S66-R70 PolarHBondContact O-N 3.33Å |
| 67 | M | 68.6 | Low | 71.4 | Confident | 133 Ų | 133 | 130.8 Ų | 130.8 | 66% | 0.655 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -63.8 | -43.8 | 174.2 | -78.5 | -174.7 | 166.6 | 0 | 0 | 112.2 | G63 K64 R65 R70 I71 | G63-M67 PolarHBondContact O-N 3.02Å; K64-M67 PolarHBondContact O-N 3.41Å; R65-M67 VanDerWaalsContact C-N 3.34Å; R65-M67 PolarHBondContact O-N 3.31Å; M67-R70 WeakPolarHBondContact O-CB 3.3Å; M67-R70 PolarHBondContact O-N 2.9Å; M67-I71 VanDerWaalsContact O-CG1 3.32Å; M67-I71 WeakPolarHBondContact O-CG1 3.47Å; M67-I71 PolarHBondContact O-N 2.96Å |
| 68 | Y | 69.5 | Low | 71.6 | Confident | 166 Ų | 166 | 132.8 Ų | 132.8 | 65% | 0.651 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -64 | -43.2 | 178 | -174.2 | -95.3 | 0 | 0 | 0 | 112.2 | K64 R65 R70 I71 K72 | K64-Y68 WeakPolarHBondContact O-CB 3.25Å; K64-Y68 PolarHBondContact O-N 3.26Å; R65-Y68 PolarHBondContact O-N 2.93Å; Y68-R70 VanDerWaalsContact C-N 3.32Å; Y68-R70 PolarHBondContact O-N 3.16Å; Y68-I71 PolarHBondContact O-N 3Å; Y68-K72 WeakPolarHBondContact O-CB 3.33Å; Y68-K72 PolarHBondContact O-N 3.26Å |
| 69 | E | 72.8 | Confident | 71.6 | Confident | 101 Ų | 101 | 130.6 Ų | 130.6 | 47% | 0.472 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -61.6 | -40.2 | 174 | -74.3 | 173.5 | -176.3 | 0 | 0 | 111.3 | R65 K72 S73 | R65-E69 HydrophobicContact CG-CG 4.46Å; R65-E69 IonicContact CZ-OE1 3.69Å; R65-E69 IonicContact NE-OE1 2.9Å; R65-E69 PolarHBondContact NE-OE1 3Å; R65-E69 IonicContact NH2-OE1 3.57Å; R65-E69 WeakPolarHBondContact O-CB 3.5Å; R65-E69 WeakPolarHBondContact O-CG 3.16Å; R65-E69 PolarHBondContact O-N 2.62Å; E69-K72 PolarHBondContact O-N 2.75Å; E69-S73 PolarHBondContact O-N 2.85Å |
| 70 | R | 77.8 | Confident | 71.7 | Confident | 170 Ų | 170 | 131.8 Ų | 131.8 | 64% | 0.642 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -64.6 | -43.1 | 173.8 | -178.4 | 178.8 | -178.4 | -95.4 | -0.6 | 112.8 | S66 M67 Y68 K72 S73 I74 | S66-R70 WeakPolarHBondContact O-CB 3Å; S66-R70 PolarHBondContact O-N 3.33Å; M67-R70 WeakPolarHBondContact O-CB 3.3Å; M67-R70 PolarHBondContact O-N 2.9Å; Y68-R70 VanDerWaalsContact C-N 3.32Å; Y68-R70 PolarHBondContact O-N 3.16Å; R70-K72 VanDerWaalsContact C-N 3.33Å; R70-S73 PolarHBondContact O-N 2.74Å; R70-S73 PolarHBondContact O-OG 3.3Å; R70-I74 WeakPolarHBondContact O-CG1 3.3Å; R70-I74 PolarHBondContact O-N 3.09Å |
| 71 | I | 72.8 | Confident | 71.9 | Confident | 111 Ų | 111 | 132.1 Ų | 132.1 | 57% | 0.569 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -64.3 | -42.7 | 177.8 | -69.9 | 165.7 | 0 | 0 | 0 | 110 | M67 Y68 S73 I74 | M67-I71 VanDerWaalsContact O-CG1 3.32Å; M67-I71 WeakPolarHBondContact O-CG1 3.47Å; M67-I71 PolarHBondContact O-N 2.96Å; Y68-I71 PolarHBondContact O-N 3Å; I71-S73 PolarHBondContact O-N 3.44Å; I71-I74 PolarHBondContact O-N 2.91Å; I71-I74 VanDerWaalsContact O-N 3.17Å |
| 72 | K | 73.2 | Confident | 71.8 | Confident | 173 Ų | 173 | 127.9 Ų | 127.9 | 75% | 0.752 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -62 | -30.5 | 175.4 | -172 | 179.2 | 178.5 | -176.5 | 0 | 112.7 | Y68 E69 R70 I74 | Y68-K72 WeakPolarHBondContact O-CB 3.33Å; Y68-K72 PolarHBondContact O-N 3.26Å; E69-K72 PolarHBondContact O-N 2.75Å; R70-K72 VanDerWaalsContact C-N 3.33Å; K72-I74 VanDerWaalsContact C-N 3.35Å |
| 73 | S | 78.4 | Confident | 72 | Confident | 86 Ų | 86 | 128.7 Ų | 128.7 | 60% | 0.601 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.9 | -9.9 | 178.8 | 74.4 | 0 | 0 | 0 | 0 | 113.9 | E69 R70 I71 P75 | E69-S73 PolarHBondContact O-N 2.85Å; R70-S73 PolarHBondContact O-N 2.74Å; R70-S73 PolarHBondContact O-OG 3.3Å; I71-S73 PolarHBondContact O-N 3.44Å; S73-P75 VanDerWaalsContact O-CD 3.28Å; S73-P75 WeakPolarHBondContact O-CD 3.46Å |
| 74 | I | 77.1 | Confident | 72.1 | Confident | 89 Ų | 89 | 135.4 Ų | 135.4 | 46% | 0.456 | 66% | 0.658 | S | S | . | * | S | Bend | trans | -72.3 | 116.9 | 173.3 | -69.1 | 165.9 | 0 | 0 | 0 | 106.6 | R70 I71 K72 T76 | R70-I74 WeakPolarHBondContact O-CG1 3.3Å; R70-I74 PolarHBondContact O-N 3.09Å; I71-I74 PolarHBondContact O-N 2.91Å; I71-I74 VanDerWaalsContact O-N 3.17Å; K72-I74 VanDerWaalsContact C-N 3.35Å; I74-T76 PolarHBondContact O-N 3.07Å; I74-T76 VanDerWaalsContact O-N 3.16Å |
| 75 | P | 71.7 | Confident | 72 | Confident | 93 Ų | 93 | 134.6 Ų | 134.6 | 60% | 0.604 | 66% | 0.66 | S | S | * | * | trans | -61.6 | 122.7 | 173.9 | 25.6 | -31.1 | 0 | 0 | 0 | 107.8 | S73 E77 | S73-P75 VanDerWaalsContact O-CD 3.28Å; S73-P75 WeakPolarHBondContact O-CD 3.46Å; P75-E77 HydrophobicContact CB-CG 4.44Å; P75-E77 PolarHBondContact O-N 3.43Å | ||
| 76 | T | 70.7 | Confident | 72.1 | Confident | 143 Ų | 143 | 132.5 Ų | 132.5 | 88% | 0.877 | 66% | 0.664 | S | S | * | * | trans | -74.2 | 86 | 164.8 | 49.8 | 0 | 0 | 0 | 0 | 106.7 | I74 | I74-T76 PolarHBondContact O-N 3.07Å; I74-T76 VanDerWaalsContact O-N 3.16Å | ||
| 77 | E | 58.1 | Low | 71.9 | Confident | 250 Ų | 250 | 137.7 Ų | 137.7 | 100% | 1.168 | 68% | 0.677 | S | S | * | * | trans | -83.6 | 0 | 161 | -69.8 | -177.5 | -173.8 | 0 | 0 | 109.8 | P75 | P75-E77 HydrophobicContact CB-CG 4.44Å; P75-E77 PolarHBondContact O-N 3.43Å |
Retrieved 77 of 77 residues in 14.6 ms
(Link to these results)