| 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 | 68 | Low | 81 | Confident | 215 Ų | 215 | 113.5 Ų | 113.5 | 100% | 1.059 | 60% | 0.604 | S | S | * | * | 0 | -40.2 | 0 | -158 | 176.3 | -77.2 | 0 | 0 | 110.7 | F5 | M1-F5 PolarHBondContact O-N 3.31Š| |||
| 2 | E | 73.3 | Confident | 81.7 | Confident | 176 Ų | 176 | 111 Ų | 111 | 82% | 0.822 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -63.6 | -42.6 | 175.5 | -71.8 | 178.9 | 153.4 | 0 | 0 | 114.5 | S4 F5 S6 | E2-S4 PolarHBondContact O-N 2.75Å; E2-F5 PolarHBondContact O-N 3.1Å; E2-S6 PolarHBondContact O-N 3.41Å; E2-S6 VanDerWaalsContact O-N 3.13Å |
| 3 | E | 76.4 | Confident | 82.4 | Confident | 165 Ų | 165 | 109.8 Ų | 109.8 | 77% | 0.771 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -59.8 | -43.2 | 179.1 | -73.8 | -172.6 | 161.4 | 0 | 0 | 112.8 | F5 S6 V7 | E3-F5 VanDerWaalsContact C-N 3.27Å; E3-F5 PolarHBondContact O-N 3.18Å; E3-S6 PolarHBondContact O-N 3.49Å; E3-V7 WeakPolarHBondContact O-CG2 3.39Å; E3-V7 PolarHBondContact O-N 3.38Å; E3-V7 VanDerWaalsContact O-N 3.1Å |
| 4 | S | 80 | Confident | 83.2 | Confident | 77 Ų | 77 | 108.1 Ų | 108.1 | 54% | 0.538 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -62 | -35.9 | 178.5 | -46.9 | 0 | 0 | 0 | 0 | 112.1 | E2 I8 | E2-S4 PolarHBondContact O-N 2.75Å; S4-I8 WeakPolarHBondContact O-CD1 3.27Å; S4-I8 VanDerWaalsContact O-CG1 3.28Å; S4-I8 WeakPolarHBondContact O-CG1 3.25Å; S4-I8 PolarHBondContact O-N 3.4Å |
| 5 | F | 80.8 | Confident | 83.8 | Confident | 138 Ų | 138 | 106.5 Ų | 106.5 | 61% | 0.605 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -71.1 | -39.7 | 178.6 | -162.7 | -94.6 | 0 | 0 | 0 | 111.8 | M1 E2 E3 V7 I8 M9 | M1-F5 PolarHBondContact O-N 3.31Å; E2-F5 PolarHBondContact O-N 3.1Å; E3-F5 VanDerWaalsContact C-N 3.27Å; E3-F5 PolarHBondContact O-N 3.18Å; F5-V7 PolarHBondContact O-N 2.9Å; F5-I8 PolarHBondContact O-N 3.2Å; F5-M9 HydrophobicContact CD1-CG 3.9Å; F5-M9 HydrophobicContact CE1-CE 4.49Å; F5-M9 HydrophobicContact CE1-CG 3.69Å; F5-M9 HydrophobicContact CE1-SD 4.07Å; F5-M9 HydrophobicContact CZ-CG 4.37Å; F5-M9 HydrophobicContact CZ-SD 4.44Å; F5-M9 WeakPolarHBondContact O-CB 3.38Å; F5-M9 VanDerWaalsContact O-CG 3.29Å; F5-M9 WeakPolarHBondContact O-CG 3.35Å; F5-M9 PolarHBondContact O-N 3.13Å |
| 6 | S | 83.9 | Confident | 84.2 | Confident | 84 Ų | 84 | 104 Ų | 104 | 59% | 0.587 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -62.6 | -40.6 | 175.4 | -173.9 | 0 | 0 | 0 | 0 | 112.4 | E2 E3 G10 | E2-S6 PolarHBondContact O-N 3.41Å; E2-S6 VanDerWaalsContact O-N 3.13Å; E3-S6 PolarHBondContact O-N 3.49Å; S6-G10 PolarHBondContact O-N 3.35Å |
| 7 | V | 84 | Confident | 84.7 | Confident | 88 Ų | 88 | 105.6 Ų | 105.6 | 53% | 0.533 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -64 | -48.2 | 176.9 | 174.8 | 0 | 0 | 0 | 0 | 110.4 | E3 F5 M9 G10 D11 | E3-V7 WeakPolarHBondContact O-CG2 3.39Å; E3-V7 PolarHBondContact O-N 3.38Å; E3-V7 VanDerWaalsContact O-N 3.1Å; F5-V7 PolarHBondContact O-N 2.9Å; V7-M9 VanDerWaalsContact C-N 3.34Å; V7-M9 PolarHBondContact O-N 3.47Å; V7-G10 PolarHBondContact O-N 2.95Å; V7-G10 VanDerWaalsContact O-N 3.12Å; V7-D11 PolarHBondContact O-N 2.87Å |
| 8 | I | 85.6 | Confident | 85.2 | Confident | 93 Ų | 93 | 105.8 Ų | 105.8 | 48% | 0.477 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -60.9 | -42.1 | 178.8 | -67.1 | 166.1 | 0 | 0 | 0 | 111.6 | S4 F5 G10 D11 N12 | S4-I8 WeakPolarHBondContact O-CD1 3.27Å; S4-I8 VanDerWaalsContact O-CG1 3.28Å; S4-I8 WeakPolarHBondContact O-CG1 3.25Å; S4-I8 PolarHBondContact O-N 3.4Å; F5-I8 PolarHBondContact O-N 3.2Å; I8-G10 VanDerWaalsContact C-N 3.35Å; I8-D11 PolarHBondContact O-N 3.26Å; I8-N12 WeakPolarHBondContact O-CB 3.29Å; I8-N12 PolarHBondContact O-N 2.91Å; I8-N12 PolarHBondContact O-ND2 3.08Å |
| 9 | M | 82 | Confident | 85.6 | Confident | 98 Ų | 98 | 106.4 Ų | 106.4 | 48% | 0.483 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -64.6 | -39.5 | 175.9 | -73.2 | -83.4 | -78.7 | 0 | 0 | 111.8 | F5 V7 N13 | F5-M9 HydrophobicContact CD1-CG 3.9Å; F5-M9 HydrophobicContact CE1-CE 4.49Å; F5-M9 HydrophobicContact CE1-CG 3.69Å; F5-M9 HydrophobicContact CE1-SD 4.07Å; F5-M9 HydrophobicContact CZ-CG 4.37Å; F5-M9 HydrophobicContact CZ-SD 4.44Å; F5-M9 WeakPolarHBondContact O-CB 3.38Å; F5-M9 VanDerWaalsContact O-CG 3.29Å; F5-M9 WeakPolarHBondContact O-CG 3.35Å; F5-M9 PolarHBondContact O-N 3.13Å; V7-M9 VanDerWaalsContact C-N 3.34Å; V7-M9 PolarHBondContact O-N 3.47Å; M9-N13 WeakPolarHBondContact O-CB 3.27Å; M9-N13 PolarHBondContact O-N 2.79Å; M9-N13 PolarHBondContact O-ND2 3.01Å |
| 10 | G | 87.1 | Confident | 86 | Confident | 30 Ų | 30 | 107.8 Ų | 107.8 | 31% | 0.309 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -62.4 | -47.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | S6 V7 I8 N13 N14 | S6-G10 PolarHBondContact O-N 3.35Å; V7-G10 PolarHBondContact O-N 2.95Å; V7-G10 VanDerWaalsContact O-N 3.12Å; I8-G10 VanDerWaalsContact C-N 3.35Å; G10-N13 PolarHBondContact O-N 3.49Å; G10-N14 VanDerWaalsContact O-CG 3.25Å; G10-N14 PolarHBondContact O-N 3.22Å; G10-N14 PolarHBondContact O-ND2 2.91Å |
| 11 | D | 89.7 | Confident | 86.4 | Confident | 85 Ų | 85 | 105.5 Ų | 105.5 | 46% | 0.455 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -62.9 | -43.2 | 177.1 | -71.3 | -17.2 | 0 | 0 | 0 | 111.4 | V7 I8 N13 N14 I15 | V7-D11 PolarHBondContact O-N 2.87Å; I8-D11 PolarHBondContact O-N 3.26Å; D11-N13 PolarHBondContact O-N 2.94Å; D11-N14 PolarHBondContact O-N 3.46Å; D11-I15 WeakPolarHBondContact O-CB 3.47Å; D11-I15 WeakPolarHBondContact O-CD1 3.47Å; D11-I15 WeakPolarHBondContact O-CG1 3.42Å; D11-I15 PolarHBondContact O-N 3.32Å |
| 12 | N | 89.1 | Confident | 87.7 | Confident | 83 Ų | 83 | 100.2 Ų | 100.2 | 44% | 0.444 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -62 | -42 | 175.5 | -75.5 | -19.1 | 0 | 0 | 0 | 111.8 | I8 I15 S16 | I8-N12 WeakPolarHBondContact O-CB 3.29Å; I8-N12 PolarHBondContact O-N 2.91Å; I8-N12 PolarHBondContact O-ND2 3.08Å; N12-I15 PolarHBondContact O-N 3.11Å; N12-S16 PolarHBondContact O-N 3.11Å; N12-S16 PolarHBondContact O-OG 2.91Å |
| 13 | N | 90.8 | Very high | 88.7 | Confident | 95 Ų | 95 | 95.5 Ų | 95.5 | 51% | 0.508 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63.6 | -41.4 | 174.7 | -79.5 | -21.2 | 0 | 0 | 0 | 111.8 | M9 G10 D11 S16 Q17 | M9-N13 WeakPolarHBondContact O-CB 3.27Å; M9-N13 PolarHBondContact O-N 2.79Å; M9-N13 PolarHBondContact O-ND2 3.01Å; G10-N13 PolarHBondContact O-N 3.49Å; D11-N13 PolarHBondContact O-N 2.94Å; N13-S16 PolarHBondContact O-N 3.44Å; N13-Q17 WeakPolarHBondContact O-CB 3.34Å; N13-Q17 VanDerWaalsContact O-CG 3.32Å; N13-Q17 WeakPolarHBondContact O-CG 3.33Å; N13-Q17 PolarHBondContact O-N 3.31Å |
| 14 | N | 93.3 | Very high | 89.6 | Confident | 87 Ų | 87 | 91 Ų | 91 | 47% | 0.465 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.5 | -41.8 | 175.7 | -70.3 | -23.4 | 0 | 0 | 0 | 111.4 | G10 D11 Q17 L18 | G10-N14 VanDerWaalsContact O-CG 3.25Å; G10-N14 PolarHBondContact O-N 3.22Å; G10-N14 PolarHBondContact O-ND2 2.91Å; D11-N14 PolarHBondContact O-N 3.46Å; N14-Q17 PolarHBondContact O-N 3.25Å; N14-L18 WeakPolarHBondContact O-CB 3.42Å; N14-L18 VanDerWaalsContact O-CG 3.29Å; N14-L18 WeakPolarHBondContact O-CG 3.36Å; N14-L18 PolarHBondContact O-N 2.93Å |
| 15 | I | 92.2 | Very high | 90.3 | Very high | 83 Ų | 83 | 91.6 Ų | 91.6 | 43% | 0.426 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.9 | -46.3 | 175.9 | -69.6 | 163.5 | 0 | 0 | 0 | 110.3 | D11 N12 Q17 L18 Q19 | D11-I15 WeakPolarHBondContact O-CB 3.47Å; D11-I15 WeakPolarHBondContact O-CD1 3.47Å; D11-I15 WeakPolarHBondContact O-CG1 3.42Å; D11-I15 PolarHBondContact O-N 3.32Å; N12-I15 PolarHBondContact O-N 3.11Å; I15-Q17 VanDerWaalsContact C-N 3.33Å; I15-Q17 PolarHBondContact O-N 3.38Å; I15-L18 PolarHBondContact O-N 3.38Å; I15-Q19 HydrophobicContact CG2-CG 4.37Å; I15-Q19 WeakPolarHBondContact O-CB 3.47Å; I15-Q19 VanDerWaalsContact O-CG 3.3Å; I15-Q19 WeakPolarHBondContact O-CG 3.45Å; I15-Q19 PolarHBondContact O-N 2.98Å |
| 16 | S | 91.3 | Very high | 91 | Very high | 67 Ų | 67 | 90.5 Ų | 90.5 | 47% | 0.469 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.2 | -39.4 | 176.9 | -65.9 | 0 | 0 | 0 | 0 | 112.4 | N12 N13 Q19 H20 | N12-S16 PolarHBondContact O-N 3.11Å; N12-S16 PolarHBondContact O-OG 2.91Å; N13-S16 PolarHBondContact O-N 3.44Å; S16-Q19 PolarHBondContact O-N 3.16Å; S16-H20 WeakPolarHBondContact O-CB 3.47Å; S16-H20 PolarHBondContact O-N 3.29Å |
| 17 | Q | 92.5 | Very high | 91.6 | Very high | 131 Ų | 131 | 90.6 Ų | 90.6 | 61% | 0.612 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -66.1 | -43.2 | 174.7 | -74.3 | -179.9 | 46.8 | 0 | 0 | 112.2 | N13 N14 I15 H20 S21 | N13-Q17 WeakPolarHBondContact O-CB 3.34Å; N13-Q17 VanDerWaalsContact O-CG 3.32Å; N13-Q17 WeakPolarHBondContact O-CG 3.33Å; N13-Q17 PolarHBondContact O-N 3.31Å; N14-Q17 PolarHBondContact O-N 3.25Å; I15-Q17 VanDerWaalsContact C-N 3.33Å; I15-Q17 PolarHBondContact O-N 3.38Å; Q17-H20 PolarHBondContact O-N 3.15Å; Q17-S21 WeakPolarHBondContact O-CB 3.47Å; Q17-S21 PolarHBondContact O-N 2.78Å |
| 18 | L | 93.2 | Very high | 92.2 | Very high | 109 Ų | 109 | 94.9 Ų | 94.9 | 57% | 0.571 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -62.7 | -42 | 175.3 | -76.3 | 168.9 | 0 | 0 | 0 | 111.6 | N14 I15 S21 N22 | N14-L18 WeakPolarHBondContact O-CB 3.42Å; N14-L18 VanDerWaalsContact O-CG 3.29Å; N14-L18 WeakPolarHBondContact O-CG 3.36Å; N14-L18 PolarHBondContact O-N 2.93Å; I15-L18 PolarHBondContact O-N 3.38Å; L18-S21 PolarHBondContact O-N 3.02Å; L18-N22 WeakPolarHBondContact O-CB 3.46Å; L18-N22 PolarHBondContact O-N 3.46Å; L18-N22 PolarHBondContact O-ND2 3.41Å |
| 19 | Q | 93.2 | Very high | 92.6 | Very high | 118 Ų | 118 | 96 Ų | 96 | 55% | 0.551 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -60.8 | -45.4 | 174.5 | -76.4 | 178.5 | -26.8 | 0 | 0 | 111.2 | I15 S16 N22 T23 | I15-Q19 HydrophobicContact CG2-CG 4.37Å; I15-Q19 WeakPolarHBondContact O-CB 3.47Å; I15-Q19 VanDerWaalsContact O-CG 3.3Å; I15-Q19 WeakPolarHBondContact O-CG 3.45Å; I15-Q19 PolarHBondContact O-N 2.98Å; S16-Q19 PolarHBondContact O-N 3.16Å; Q19-N22 PolarHBondContact O-N 2.94Å; Q19-T23 PolarHBondContact O-N 3.01Å; Q19-T23 PolarHBondContact O-OG1 2.8Å; Q19-T23 VanDerWaalsContact O-OG1 3.05Å |
| 20 | H | 94.2 | Very high | 93.2 | Very high | 134 Ų | 134 | 96.3 Ų | 96.3 | 62% | 0.62 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -62.5 | -46.1 | 177.2 | -168.2 | 65.6 | 0 | 0 | 0 | 111.9 | S16 Q17 N22 T23 T24 | S16-H20 WeakPolarHBondContact O-CB 3.47Å; S16-H20 PolarHBondContact O-N 3.29Å; Q17-H20 PolarHBondContact O-N 3.15Å; H20-N22 PolarHBondContact O-N 3.1Å; H20-T23 PolarHBondContact O-N 3.4Å; H20-T24 PolarHBondContact O-N 2.92Å; H20-T24 PolarHBondContact O-OG1 2.82Å; H20-T24 VanDerWaalsContact O-OG1 3.1Å |
| 21 | S | 94.3 | Very high | 93.5 | Very high | 59 Ų | 59 | 100.6 Ų | 100.6 | 41% | 0.413 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -58.4 | -47.9 | 176.2 | -166.8 | 0 | 0 | 0 | 0 | 111.6 | Q17 L18 T23 T24 D25 | Q17-S21 WeakPolarHBondContact O-CB 3.47Å; Q17-S21 PolarHBondContact O-N 2.78Å; L18-S21 PolarHBondContact O-N 3.02Å; S21-T23 VanDerWaalsContact C-N 3.31Å; S21-T23 PolarHBondContact O-N 3.35Å; S21-T24 PolarHBondContact O-N 2.95Å; S21-T24 VanDerWaalsContact O-N 3.17Å; S21-D25 PolarHBondContact O-N 2.99Å |
| 22 | N | 94.3 | Very high | 93.7 | Very high | 104 Ų | 104 | 99.9 Ų | 99.9 | 56% | 0.556 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -61.9 | -39.2 | 178.5 | -73.3 | -15.8 | 0 | 0 | 0 | 112 | L18 Q19 H20 F26 | L18-N22 WeakPolarHBondContact O-CB 3.46Å; L18-N22 PolarHBondContact O-N 3.46Å; L18-N22 PolarHBondContact O-ND2 3.41Å; Q19-N22 PolarHBondContact O-N 2.94Å; H20-N22 PolarHBondContact O-N 3.1Å; N22-F26 VanDerWaalsContact O-CB 3.28Å; N22-F26 WeakPolarHBondContact O-CB 3.28Å; N22-F26 PolarHBondContact O-N 3.49Å |
| 23 | T | 95.1 | Very high | 93.8 | Very high | 77 Ų | 77 | 100.5 Ų | 100.5 | 47% | 0.472 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -65 | -42.6 | 174.8 | -60.9 | 0 | 0 | 0 | 0 | 111.5 | Q19 H20 S21 F26 N27 | Q19-T23 PolarHBondContact O-N 3.01Å; Q19-T23 PolarHBondContact O-OG1 2.8Å; Q19-T23 VanDerWaalsContact O-OG1 3.05Å; H20-T23 PolarHBondContact O-N 3.4Å; S21-T23 VanDerWaalsContact C-N 3.31Å; S21-T23 PolarHBondContact O-N 3.35Å; T23-F26 PolarHBondContact O-N 3.33Å; T23-N27 WeakPolarHBondContact O-CB 3.39Å; T23-N27 PolarHBondContact O-N 3.19Å; T23-N27 PolarHBondContact O-ND2 3.37Å |
| 24 | T | 94.9 | Very high | 93.7 | Very high | 70 Ų | 70 | 98.9 Ų | 98.9 | 43% | 0.429 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.3 | -43.9 | 176.4 | -57.2 | 0 | 0 | 0 | 0 | 111.9 | H20 S21 N27 R28 | H20-T24 PolarHBondContact O-N 2.92Å; H20-T24 PolarHBondContact O-OG1 2.82Å; H20-T24 VanDerWaalsContact O-OG1 3.1Å; S21-T24 PolarHBondContact O-N 2.95Å; S21-T24 VanDerWaalsContact O-N 3.17Å; T24-N27 PolarHBondContact O-N 2.73Å; T24-R28 WeakPolarHBondContact O-CB 3.41Å; T24-R28 PolarHBondContact O-N 3.36Å |
| 25 | D | 95.4 | Very high | 93.6 | Very high | 90 Ų | 90 | 99.1 Ų | 99.1 | 48% | 0.481 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -65.7 | -39.8 | 178.5 | -71.7 | -25.9 | 0 | 0 | 0 | 111.8 | S21 R28 M29 | S21-D25 PolarHBondContact O-N 2.99Å; D25-R28 PolarHBondContact O-N 2.99Å; D25-M29 WeakPolarHBondContact O-CB 3.46Å; D25-M29 PolarHBondContact O-N 3.24Å |
| 26 | F | 95.5 | Very high | 93.4 | Very high | 116 Ų | 116 | 100 Ų | 100 | 51% | 0.509 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61.7 | -48.3 | 174.3 | -175.5 | -95.6 | 0 | 0 | 0 | 111.7 | N22 T23 R28 M29 E30 | N22-F26 VanDerWaalsContact O-CB 3.28Å; N22-F26 WeakPolarHBondContact O-CB 3.28Å; N22-F26 PolarHBondContact O-N 3.49Å; T23-F26 PolarHBondContact O-N 3.33Å; F26-R28 VanDerWaalsContact C-N 3.3Å; F26-R28 PolarHBondContact O-N 3.44Å; F26-M29 WeakPolarHBondContact O-CB 3.43Å; F26-M29 PolarHBondContact O-N 2.98Å; F26-M29 VanDerWaalsContact O-N 3.1Å; F26-E30 HydrophobicContact CD1-CG 4.28Å; F26-E30 HydrophobicContact CE1-CG 3.83Å; F26-E30 WeakPolarHBondContact CE1-OE1 3.25Å; F26-E30 HydrophobicContact CZ-CG 4.12Å; F26-E30 WeakPolarHBondContact CZ-OE1 3.41Å; F26-E30 PolarHBondContact O-N 3.4Å |
| 27 | N | 95.8 | Very high | 93 | Very high | 85 Ų | 85 | 99.9 Ų | 99.9 | 46% | 0.455 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.7 | -39.4 | 177.9 | -68.4 | -14 | 0 | 0 | 0 | 111.8 | T23 T24 M29 E30 E31 | T23-N27 WeakPolarHBondContact O-CB 3.39Å; T23-N27 PolarHBondContact O-N 3.19Å; T23-N27 PolarHBondContact O-ND2 3.37Å; T24-N27 PolarHBondContact O-N 2.73Å; N27-M29 VanDerWaalsContact C-N 3.31Å; N27-M29 PolarHBondContact O-N 2.9Å; N27-E30 PolarHBondContact O-N 3.49Å; N27-E31 PolarHBondContact O-N 2.92Å |
| 28 | R | 95.7 | Very high | 92.4 | Very high | 178 Ų | 178 | 100 Ų | 100 | 67% | 0.672 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -65.3 | -35.8 | 175.6 | -172.4 | 175.8 | -175.2 | 145.9 | 3.9 | 112.1 | T24 D25 F26 T32 | T24-R28 WeakPolarHBondContact O-CB 3.41Å; T24-R28 PolarHBondContact O-N 3.36Å; D25-R28 PolarHBondContact O-N 2.99Å; F26-R28 VanDerWaalsContact C-N 3.3Å; F26-R28 PolarHBondContact O-N 3.44Å; R28-T32 WeakPolarHBondContact O-CB 3.36Å; R28-T32 PolarHBondContact O-N 2.91Å; R28-T32 PolarHBondContact O-OG1 3.37Å |
| 29 | M | 95.1 | Very high | 91.9 | Very high | 116 Ų | 116 | 97.6 Ų | 97.6 | 57% | 0.571 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -67.3 | -45.3 | 175 | -170.8 | -179 | -58.4 | 0 | 0 | 111.3 | D25 F26 N27 E31 T32 I33 | D25-M29 WeakPolarHBondContact O-CB 3.46Å; D25-M29 PolarHBondContact O-N 3.24Å; F26-M29 WeakPolarHBondContact O-CB 3.43Å; F26-M29 PolarHBondContact O-N 2.98Å; F26-M29 VanDerWaalsContact O-N 3.1Å; N27-M29 VanDerWaalsContact C-N 3.31Å; N27-M29 PolarHBondContact O-N 2.9Å; M29-E31 VanDerWaalsContact C-N 3.35Å; M29-E31 PolarHBondContact O-N 2.65Å; M29-T32 PolarHBondContact O-N 3.17Å; M29-I33 HydrophobicContact CG-CD1 4.01Å; M29-I33 VanDerWaalsContact O-CG1 3.31Å; M29-I33 WeakPolarHBondContact O-CG1 3.43Å; M29-I33 PolarHBondContact O-N 2.67Å |
| 30 | E | 94.3 | Very high | 91.2 | Very high | 105 Ų | 105 | 97.9 Ų | 97.9 | 49% | 0.491 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59.5 | -44.4 | 174.9 | -73.5 | -166.3 | 148.7 | 0 | 0 | 111.9 | F26 N27 T32 I33 S34 | F26-E30 HydrophobicContact CD1-CG 4.28Å; F26-E30 HydrophobicContact CE1-CG 3.83Å; F26-E30 WeakPolarHBondContact CE1-OE1 3.25Å; F26-E30 HydrophobicContact CZ-CG 4.12Å; F26-E30 WeakPolarHBondContact CZ-OE1 3.41Å; F26-E30 PolarHBondContact O-N 3.4Å; N27-E30 PolarHBondContact O-N 3.49Å; E30-T32 VanDerWaalsContact C-N 3.32Å; E30-T32 PolarHBondContact O-N 3.48Å; E30-I33 PolarHBondContact O-N 2.94Å; E30-S34 WeakPolarHBondContact O-CB 3.34Å; E30-S34 PolarHBondContact O-N 2.99Å |
| 31 | E | 93.8 | Very high | 90.6 | Very high | 121 Ų | 121 | 98 Ų | 98 | 57% | 0.565 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60.1 | -43.1 | 175 | -171.1 | -175.2 | 173.8 | 0 | 0 | 111.3 | N27 M29 I33 S34 N35 | N27-E31 PolarHBondContact O-N 2.92Å; M29-E31 VanDerWaalsContact C-N 3.35Å; M29-E31 PolarHBondContact O-N 2.65Å; E31-I33 PolarHBondContact O-N 2.95Å; E31-S34 PolarHBondContact O-N 3.44Å; E31-N35 VanDerWaalsContact O-CB 3.31Å; E31-N35 WeakPolarHBondContact O-CB 3.5Å; E31-N35 PolarHBondContact O-N 3.34Å; E31-N35 PolarHBondContact O-ND2 2.78Å |
| 32 | T | 92.8 | Very high | 90.1 | Very high | 70 Ų | 70 | 98.1 Ų | 98.1 | 43% | 0.429 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.7 | -42.5 | 177.7 | -56.7 | 0 | 0 | 0 | 0 | 111.7 | R28 M29 E30 N35 I36 | R28-T32 WeakPolarHBondContact O-CB 3.36Å; R28-T32 PolarHBondContact O-N 2.91Å; R28-T32 PolarHBondContact O-OG1 3.37Å; M29-T32 PolarHBondContact O-N 3.17Å; E30-T32 VanDerWaalsContact C-N 3.32Å; E30-T32 PolarHBondContact O-N 3.48Å; T32-N35 PolarHBondContact O-N 3.29Å; T32-I36 HydrophobicContact CG2-CD1 3.93Å; T32-I36 VanDerWaalsContact O-CG1 3.28Å; T32-I36 WeakPolarHBondContact O-CG1 3.43Å; T32-I36 PolarHBondContact O-N 3.14Å |
| 33 | I | 92.1 | Very high | 89.8 | Confident | 96 Ų | 96 | 97.6 Ų | 97.6 | 49% | 0.492 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.4 | -43.2 | 177.3 | -69 | 165.9 | 0 | 0 | 0 | 110.5 | M29 E30 E31 I36 S37 | M29-I33 HydrophobicContact CG-CD1 4.01Å; M29-I33 VanDerWaalsContact O-CG1 3.31Å; M29-I33 WeakPolarHBondContact O-CG1 3.43Å; M29-I33 PolarHBondContact O-N 2.67Å; E30-I33 PolarHBondContact O-N 2.94Å; E31-I33 PolarHBondContact O-N 2.95Å; I33-I36 PolarHBondContact O-N 2.68Å; I33-S37 WeakPolarHBondContact O-CB 3.26Å; I33-S37 PolarHBondContact O-N 3Å; I33-S37 PolarHBondContact O-OG 3.25Å |
| 34 | S | 89.2 | Confident | 89.4 | Confident | 60 Ų | 60 | 97.1 Ų | 97.1 | 42% | 0.42 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.2 | -47 | 175.3 | -172.2 | 0 | 0 | 0 | 0 | 111.5 | E30 E31 I36 S37 Q38 | E30-S34 WeakPolarHBondContact O-CB 3.34Å; E30-S34 PolarHBondContact O-N 2.99Å; E31-S34 PolarHBondContact O-N 3.44Å; S34-I36 VanDerWaalsContact C-N 3.27Å; S34-I36 PolarHBondContact O-N 3.27Å; S34-S37 PolarHBondContact O-N 3.35Å; S34-Q38 PolarHBondContact O-N 2.99Å; S34-Q38 VanDerWaalsContact O-N 3.13Å |
| 35 | N | 90 | Very high | 89.2 | Confident | 93 Ų | 93 | 96 Ų | 96 | 50% | 0.497 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.9 | -25.8 | 178.4 | -72.7 | -18.8 | 0 | 0 | 0 | 113.6 | E31 T32 P39 | E31-N35 VanDerWaalsContact O-CB 3.31Å; E31-N35 WeakPolarHBondContact O-CB 3.5Å; E31-N35 PolarHBondContact O-N 3.34Å; E31-N35 PolarHBondContact O-ND2 2.78Å; T32-N35 PolarHBondContact O-N 3.29Å; N35-P39 WeakPolarHBondContact O-CD 3.4Å; N35-P39 VanDerWaalsContact O-CG 3.25Å; N35-P39 WeakPolarHBondContact O-CG 3.5Å |
| 36 | I | 87.7 | Confident | 89 | Confident | 100 Ų | 100 | 95.8 Ų | 95.8 | 51% | 0.513 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -83.8 | -36.4 | 174.1 | -68.1 | 165.5 | 0 | 0 | 0 | 111.2 | T32 I33 S34 P39 Q40 | T32-I36 HydrophobicContact CG2-CD1 3.93Å; T32-I36 VanDerWaalsContact O-CG1 3.28Å; T32-I36 WeakPolarHBondContact O-CG1 3.43Å; T32-I36 PolarHBondContact O-N 3.14Å; I33-I36 PolarHBondContact O-N 2.68Å; S34-I36 VanDerWaalsContact C-N 3.27Å; S34-I36 PolarHBondContact O-N 3.27Å; I36-P39 WeakPolarHBondContact O-CD 3.49Å; I36-Q40 VanDerWaalsContact O-CG 3.29Å; I36-Q40 WeakPolarHBondContact O-CG 3.44Å; I36-Q40 PolarHBondContact O-N 3.19Å |
| 37 | S | 83.7 | Confident | 88.9 | Confident | 66 Ų | 66 | 95.8 Ų | 95.8 | 46% | 0.462 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -71.2 | -34.7 | -175.5 | -58.4 | 0 | 0 | 0 | 0 | 112.5 | I33 S34 Q40 H41 | I33-S37 WeakPolarHBondContact O-CB 3.26Å; I33-S37 PolarHBondContact O-N 3Å; I33-S37 PolarHBondContact O-OG 3.25Å; S34-S37 PolarHBondContact O-N 3.35Å; S37-Q40 PolarHBondContact O-N 3.01Å; S37-H41 PolarHBondContact O-N 3.45Å |
| 38 | Q | 80.8 | Confident | 88.8 | Confident | 132 Ų | 132 | 96.1 Ų | 96.1 | 62% | 0.617 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.4 | -51.5 | 178.1 | -72.4 | -157.5 | -8.4 | 0 | 0 | 113.4 | S34 Q40 H41 S42 | S34-Q38 PolarHBondContact O-N 2.99Å; S34-Q38 VanDerWaalsContact O-N 3.13Å; Q38-Q40 VanDerWaalsContact C-N 3.27Å; Q38-Q40 PolarHBondContact O-N 3.33Å; Q38-H41 PolarHBondContact O-N 2.93Å; Q38-S42 PolarHBondContact O-N 3.44Å; Q38-S42 PolarHBondContact O-OG 3.16Å |
| 39 | P | 82.2 | Confident | 88.7 | Confident | 59 Ų | 59 | 94.9 Ų | 94.9 | 38% | 0.383 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -58.1 | -34.6 | 174.2 | -25.5 | 32.8 | 0 | 0 | 0 | 113.8 | N35 I36 S42 N43 | N35-P39 WeakPolarHBondContact O-CD 3.4Å; N35-P39 VanDerWaalsContact O-CG 3.25Å; N35-P39 WeakPolarHBondContact O-CG 3.5Å; I36-P39 WeakPolarHBondContact O-CD 3.49Å; P39-S42 PolarHBondContact O-N 2.91Å; P39-N43 VanDerWaalsContact O-CB 3.26Å; P39-N43 WeakPolarHBondContact O-CB 3.39Å; P39-N43 PolarHBondContact O-N 3.05Å; P39-N43 PolarHBondContact O-ND2 3.1Å; P39-N43 PolarHBondContact O-OD1 3.05Å |
| 40 | Q | 79.1 | Confident | 88.6 | Confident | 124 Ų | 124 | 95.8 Ų | 95.8 | 58% | 0.579 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -64.4 | -42.8 | 177.8 | -67.6 | -69.7 | -27.8 | 0 | 0 | 111.6 | I36 S37 Q38 S44 | I36-Q40 VanDerWaalsContact O-CG 3.29Å; I36-Q40 WeakPolarHBondContact O-CG 3.44Å; I36-Q40 PolarHBondContact O-N 3.19Å; S37-Q40 PolarHBondContact O-N 3.01Å; Q38-Q40 VanDerWaalsContact C-N 3.27Å; Q38-Q40 PolarHBondContact O-N 3.33Å; Q40-S44 PolarHBondContact O-N 3.37Å |
| 41 | H | 81 | Confident | 88.6 | Confident | 137 Ų | 137 | 96 Ų | 96 | 63% | 0.634 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -67.5 | -41.5 | 175.2 | -172.3 | -70 | 0 | 0 | 0 | 112 | S37 Q38 S44 T45 | S37-H41 PolarHBondContact O-N 3.45Å; Q38-H41 PolarHBondContact O-N 2.93Å; H41-S44 PolarHBondContact O-N 3.37Å; H41-T45 PolarHBondContact O-N 2.93Å; H41-T45 PolarHBondContact O-OG1 3.45Å |
| 42 | S | 83.2 | Confident | 88.6 | Confident | 61 Ų | 61 | 96.7 Ų | 96.7 | 43% | 0.427 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60 | -48.2 | 174.6 | -64.2 | 0 | 0 | 0 | 0 | 111.5 | Q38 P39 S44 T45 D46 | Q38-S42 PolarHBondContact O-N 3.44Å; Q38-S42 PolarHBondContact O-OG 3.16Å; P39-S42 PolarHBondContact O-N 2.91Å; S42-S44 VanDerWaalsContact C-N 3.33Å; S42-S44 PolarHBondContact O-N 3.21Å; S42-T45 WeakPolarHBondContact O-CB 3.42Å; S42-T45 PolarHBondContact O-N 2.97Å; S42-T45 VanDerWaalsContact O-N 3.11Å; S42-D46 PolarHBondContact O-N 2.87Å |
| 43 | N | 88.4 | Confident | 88.6 | Confident | 94 Ų | 94 | 96.5 Ų | 96.5 | 50% | 0.503 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.6 | -40.4 | 178.1 | -70 | -11.5 | 0 | 0 | 0 | 112.2 | P39 D46 F47 | P39-N43 VanDerWaalsContact O-CB 3.26Å; P39-N43 WeakPolarHBondContact O-CB 3.39Å; P39-N43 PolarHBondContact O-N 3.05Å; P39-N43 PolarHBondContact O-ND2 3.1Å; P39-N43 PolarHBondContact O-OD1 3.05Å; N43-D46 PolarHBondContact O-N 3.47Å; N43-F47 WeakPolarHBondContact O-CB 3.43Å; N43-F47 PolarHBondContact O-N 3.27Å |
| 44 | S | 87.5 | Confident | 88.6 | Confident | 67 Ų | 67 | 98.4 Ų | 98.4 | 47% | 0.469 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.1 | -39.4 | 175.5 | 177.5 | 0 | 0 | 0 | 0 | 112.1 | Q40 H41 S42 F47 N48 | Q40-S44 PolarHBondContact O-N 3.37Å; H41-S44 PolarHBondContact O-N 3.37Å; S42-S44 VanDerWaalsContact C-N 3.33Å; S42-S44 PolarHBondContact O-N 3.21Å; S44-F47 PolarHBondContact O-N 2.79Å; S44-N48 VanDerWaalsContact O-CG 3.29Å; S44-N48 PolarHBondContact O-N 3.11Å; S44-N48 VanDerWaalsContact O-N 3.1Å; S44-N48 PolarHBondContact O-ND2 3.03Å |
| 45 | T | 90 | Very high | 88.8 | Confident | 46 Ų | 46 | 99.5 Ų | 99.5 | 28% | 0.282 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -67.4 | -41.7 | 177.5 | -53.8 | 0 | 0 | 0 | 0 | 111.3 | H41 S42 N48 R49 | H41-T45 PolarHBondContact O-N 2.93Å; H41-T45 PolarHBondContact O-OG1 3.45Å; S42-T45 WeakPolarHBondContact O-CB 3.42Å; S42-T45 PolarHBondContact O-N 2.97Å; S42-T45 VanDerWaalsContact O-N 3.11Å; T45-N48 PolarHBondContact O-N 3.31Å; T45-R49 WeakPolarHBondContact O-CG 3.26Å; T45-R49 PolarHBondContact O-N 2.93Å |
| 46 | D | 92.1 | Very high | 89 | Confident | 85 Ų | 85 | 98.9 Ų | 98.9 | 46% | 0.455 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -67.7 | -37.3 | 178.2 | -70.8 | -20.7 | 0 | 0 | 0 | 111.8 | S42 N43 R49 M50 | S42-D46 PolarHBondContact O-N 2.87Å; N43-D46 PolarHBondContact O-N 3.47Å; D46-R49 PolarHBondContact O-N 2.92Å; D46-M50 WeakPolarHBondContact O-CB 3.34Å; D46-M50 PolarHBondContact O-N 3.47Å |
| 47 | F | 92.9 | Very high | 89.3 | Confident | 117 Ų | 117 | 98.4 Ų | 98.4 | 51% | 0.513 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62 | -47.5 | 173.6 | -173.6 | -95.7 | 0 | 0 | 0 | 111.8 | N43 S44 R49 M50 E51 | N43-F47 WeakPolarHBondContact O-CB 3.43Å; N43-F47 PolarHBondContact O-N 3.27Å; S44-F47 PolarHBondContact O-N 2.79Å; F47-R49 VanDerWaalsContact C-N 3.33Å; F47-R49 PolarHBondContact O-N 2.97Å; F47-M50 WeakPolarHBondContact O-CB 3.28Å; F47-M50 PolarHBondContact O-N 3.42Å; F47-M50 VanDerWaalsContact O-N 3.1Å; F47-E51 HydrophobicContact CD1-CG 4.3Å; F47-E51 HydrophobicContact CE1-CG 3.87Å; F47-E51 WeakPolarHBondContact CE1-OE1 3.17Å; F47-E51 HydrophobicContact CZ-CG 4.17Å; F47-E51 WeakPolarHBondContact CZ-OE1 3.39Å; F47-E51 PolarHBondContact O-N 3.22Å |
| 48 | N | 93.4 | Very high | 89.7 | Confident | 91 Ų | 91 | 100.4 Ų | 100.4 | 49% | 0.487 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.6 | -40.2 | 177.4 | -68.4 | -17 | 0 | 0 | 0 | 112.1 | S44 T45 M50 E51 E52 | S44-N48 VanDerWaalsContact O-CG 3.29Å; S44-N48 PolarHBondContact O-N 3.11Å; S44-N48 VanDerWaalsContact O-N 3.1Å; S44-N48 PolarHBondContact O-ND2 3.03Å; T45-N48 PolarHBondContact O-N 3.31Å; N48-M50 VanDerWaalsContact C-N 3.31Å; N48-M50 PolarHBondContact O-N 3.49Å; N48-E51 PolarHBondContact O-N 3.19Å; N48-E52 PolarHBondContact O-N 3.39Å |
| 49 | R | 92.9 | Very high | 90.3 | Very high | 153 Ų | 153 | 95.7 Ų | 95.7 | 58% | 0.577 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -64.3 | -35.9 | 174.5 | -75.4 | 176 | 175 | 171.3 | -2.2 | 112.5 | T45 D46 F47 S53 | T45-R49 WeakPolarHBondContact O-CG 3.26Å; T45-R49 PolarHBondContact O-N 2.93Å; D46-R49 PolarHBondContact O-N 2.92Å; F47-R49 VanDerWaalsContact C-N 3.33Å; F47-R49 PolarHBondContact O-N 2.97Å; R49-S53 WeakPolarHBondContact O-CB 3.43Å; R49-S53 PolarHBondContact O-N 2.92Å; R49-S53 PolarHBondContact O-OG 3.01Å |
| 50 | M | 93 | Very high | 90.9 | Very high | 134 Ų | 134 | 96.9 Ų | 96.9 | 66% | 0.66 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -67.5 | -43.6 | 176.1 | -172.9 | 178.8 | -67.9 | 0 | 0 | 111.3 | D46 F47 N48 S53 F54 | D46-M50 WeakPolarHBondContact O-CB 3.34Å; D46-M50 PolarHBondContact O-N 3.47Å; F47-M50 WeakPolarHBondContact O-CB 3.28Å; F47-M50 PolarHBondContact O-N 3.42Å; F47-M50 VanDerWaalsContact O-N 3.1Å; N48-M50 VanDerWaalsContact C-N 3.31Å; N48-M50 PolarHBondContact O-N 3.49Å; M50-S53 PolarHBondContact O-N 2.97Å; M50-F54 WeakPolarHBondContact O-CB 3.4Å; M50-F54 PolarHBondContact O-N 3.44Å |
| 51 | E | 94 | Very high | 91.5 | Very high | 110 Ų | 110 | 95 Ų | 95 | 51% | 0.514 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.5 | -43.4 | 174.8 | -73.5 | -167.2 | 154.2 | 0 | 0 | 112.1 | F47 N48 F54 S55 | F47-E51 HydrophobicContact CD1-CG 4.3Å; F47-E51 HydrophobicContact CE1-CG 3.87Å; F47-E51 WeakPolarHBondContact CE1-OE1 3.17Å; F47-E51 HydrophobicContact CZ-CG 4.17Å; F47-E51 WeakPolarHBondContact CZ-OE1 3.39Å; F47-E51 PolarHBondContact O-N 3.22Å; N48-E51 PolarHBondContact O-N 3.19Å; E51-F54 PolarHBondContact O-N 3.44Å; E51-S55 PolarHBondContact O-N 3.41Å |
| 52 | E | 94 | Very high | 92.1 | Very high | 135 Ų | 135 | 92.8 Ų | 92.8 | 63% | 0.631 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -60.8 | -46.1 | 175.2 | -173.5 | 177.6 | -170.8 | 0 | 0 | 111.2 | N48 F54 S55 V56 | N48-E52 PolarHBondContact O-N 3.39Å; E52-F54 VanDerWaalsContact C-N 3.32Å; E52-F54 PolarHBondContact O-N 3.25Å; E52-S55 WeakPolarHBondContact O-CB 3.44Å; E52-S55 PolarHBondContact O-N 2.97Å; E52-V56 WeakPolarHBondContact O-CG2 3.21Å; E52-V56 PolarHBondContact O-N 3.35Å |
| 53 | S | 93.1 | Very high | 92.6 | Very high | 67 Ų | 67 | 94 Ų | 94 | 47% | 0.469 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.2 | -40.7 | 176.8 | -59.2 | 0 | 0 | 0 | 0 | 111.9 | R49 M50 V56 I57 | R49-S53 WeakPolarHBondContact O-CB 3.43Å; R49-S53 PolarHBondContact O-N 2.92Å; R49-S53 PolarHBondContact O-OG 3.01Å; M50-S53 PolarHBondContact O-N 2.97Å; S53-V56 PolarHBondContact O-N 3.32Å; S53-I57 WeakPolarHBondContact O-CD1 3.34Å; S53-I57 VanDerWaalsContact O-CG1 3.25Å; S53-I57 WeakPolarHBondContact O-CG1 3.4Å; S53-I57 PolarHBondContact O-N 3Å |
| 54 | F | 93.3 | Very high | 92.8 | Very high | 135 Ų | 135 | 93.5 Ų | 93.5 | 59% | 0.592 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -65.8 | -40 | 177.2 | -169.7 | -98.1 | 0 | 0 | 0 | 111.9 | M50 E51 E52 I57 M58 | M50-F54 WeakPolarHBondContact O-CB 3.4Å; M50-F54 PolarHBondContact O-N 3.44Å; E51-F54 PolarHBondContact O-N 3.44Å; E52-F54 VanDerWaalsContact C-N 3.32Å; E52-F54 PolarHBondContact O-N 3.25Å; F54-I57 PolarHBondContact O-N 3.02Å; F54-M58 HydrophobicContact CD1-CG 4.03Å; F54-M58 HydrophobicContact CE1-CG 3.71Å; F54-M58 HydrophobicContact CE1-SD 4.27Å; F54-M58 HydrophobicContact CZ-CG 4.13Å; F54-M58 HydrophobicContact CZ-SD 4.22Å; F54-M58 WeakPolarHBondContact O-CB 3.44Å; F54-M58 VanDerWaalsContact O-CG 3.3Å; F54-M58 WeakPolarHBondContact O-CG 3.23Å; F54-M58 PolarHBondContact O-N 3.38Å |
| 55 | S | 93.4 | Very high | 93 | Very high | 84 Ų | 84 | 93.5 Ų | 93.5 | 59% | 0.587 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -61.4 | -44.2 | 175 | -171.6 | 0 | 0 | 0 | 0 | 112 | E51 E52 M58 G59 | E51-S55 PolarHBondContact O-N 3.41Å; E52-S55 WeakPolarHBondContact O-CB 3.44Å; E52-S55 PolarHBondContact O-N 2.97Å; S55-M58 PolarHBondContact O-N 3.18Å; S55-G59 PolarHBondContact O-N 2.92Å |
| 56 | V | 93.8 | Very high | 93.1 | Very high | 80 Ų | 80 | 96.6 Ų | 96.6 | 49% | 0.485 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.7 | -47.8 | 175.5 | 173.7 | 0 | 0 | 0 | 0 | 111.1 | E52 S53 M58 G59 D60 | E52-V56 WeakPolarHBondContact O-CG2 3.21Å; E52-V56 PolarHBondContact O-N 3.35Å; S53-V56 PolarHBondContact O-N 3.32Å; V56-M58 VanDerWaalsContact C-N 3.3Å; V56-M58 PolarHBondContact O-N 3.19Å; V56-G59 PolarHBondContact O-N 3.5Å; V56-G59 VanDerWaalsContact O-N 3.11Å; V56-D60 PolarHBondContact O-N 3.42Å |
| 57 | I | 94 | Very high | 93 | Very high | 90 Ų | 90 | 97.8 Ų | 97.8 | 46% | 0.462 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -59.1 | -41.5 | 177.9 | -69.5 | 164.9 | 0 | 0 | 0 | 111.4 | S53 F54 D60 N61 | S53-I57 WeakPolarHBondContact O-CD1 3.34Å; S53-I57 VanDerWaalsContact O-CG1 3.25Å; S53-I57 WeakPolarHBondContact O-CG1 3.4Å; S53-I57 PolarHBondContact O-N 3Å; F54-I57 PolarHBondContact O-N 3.02Å; I57-D60 PolarHBondContact O-N 2.99Å; I57-N61 WeakPolarHBondContact O-CB 3.3Å; I57-N61 VanDerWaalsContact O-CG 3.29Å; I57-N61 PolarHBondContact O-N 3.4Å; I57-N61 PolarHBondContact O-ND2 2.83Å |
| 58 | M | 92.2 | Very high | 92.9 | Very high | 108 Ų | 108 | 98.3 Ų | 98.3 | 53% | 0.532 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.4 | -40.2 | 176.8 | -74.3 | -68.4 | -72.7 | 0 | 0 | 112 | F54 S55 V56 N62 | F54-M58 HydrophobicContact CD1-CG 4.03Å; F54-M58 HydrophobicContact CE1-CG 3.71Å; F54-M58 HydrophobicContact CE1-SD 4.27Å; F54-M58 HydrophobicContact CZ-CG 4.13Å; F54-M58 HydrophobicContact CZ-SD 4.22Å; F54-M58 WeakPolarHBondContact O-CB 3.44Å; F54-M58 VanDerWaalsContact O-CG 3.3Å; F54-M58 WeakPolarHBondContact O-CG 3.23Å; F54-M58 PolarHBondContact O-N 3.38Å; S55-M58 PolarHBondContact O-N 3.18Å; V56-M58 VanDerWaalsContact C-N 3.3Å; V56-M58 PolarHBondContact O-N 3.19Å; M58-N62 PolarHBondContact O-N 3.49Å; M58-N62 VanDerWaalsContact O-N 3.11Å |
| 59 | G | 93.8 | Very high | 92.7 | Very high | 33 Ų | 33 | 100.3 Ų | 100.3 | 34% | 0.34 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -61.2 | -47.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | S55 V56 N62 N63 | S55-G59 PolarHBondContact O-N 2.92Å; V56-G59 PolarHBondContact O-N 3.5Å; V56-G59 VanDerWaalsContact O-N 3.11Å; G59-N62 PolarHBondContact O-N 2.78Å; G59-N63 PolarHBondContact O-N 3.18Å; G59-N63 PolarHBondContact O-ND2 3.4Å |
| 60 | D | 94.4 | Very high | 92.4 | Very high | 84 Ų | 84 | 95.9 Ų | 95.9 | 45% | 0.449 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.8 | -42.6 | 178.9 | -72.6 | -16.8 | 0 | 0 | 0 | 111.8 | V56 I57 N62 N63 I64 | V56-D60 PolarHBondContact O-N 3.42Å; I57-D60 PolarHBondContact O-N 2.99Å; D60-N62 VanDerWaalsContact C-N 3.31Å; D60-N62 PolarHBondContact O-N 3.26Å; D60-N63 PolarHBondContact O-N 2.87Å; D60-I64 VanDerWaalsContact O-CG1 3.27Å; D60-I64 WeakPolarHBondContact O-CG1 3.33Å; D60-I64 PolarHBondContact O-N 2.79Å |
| 61 | N | 92.1 | Very high | 92.1 | Very high | 84 Ų | 84 | 94.5 Ų | 94.5 | 45% | 0.449 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.1 | -38 | 176.2 | -78.3 | -18.7 | 0 | 0 | 0 | 112.6 | I57 S65 | I57-N61 WeakPolarHBondContact O-CB 3.3Å; I57-N61 VanDerWaalsContact O-CG 3.29Å; I57-N61 PolarHBondContact O-N 3.4Å; I57-N61 PolarHBondContact O-ND2 2.83Å; N61-S65 WeakPolarHBondContact O-CB 3.31Å; N61-S65 PolarHBondContact O-N 3.29Å; N61-S65 PolarHBondContact O-OG 3.44Å |
| 62 | N | 93.1 | Very high | 91.8 | Very high | 91 Ų | 91 | 92 Ų | 92 | 49% | 0.487 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -66.3 | -43.6 | 175 | -171.9 | 26.1 | 0 | 0 | 0 | 111.1 | M58 G59 D60 S65 Q66 | M58-N62 PolarHBondContact O-N 3.49Å; M58-N62 VanDerWaalsContact O-N 3.11Å; G59-N62 PolarHBondContact O-N 2.78Å; D60-N62 VanDerWaalsContact C-N 3.31Å; D60-N62 PolarHBondContact O-N 3.26Å; N62-S65 PolarHBondContact O-N 2.83Å; N62-Q66 PolarHBondContact ND2-NE2 2.98Å; N62-Q66 WeakPolarHBondContact O-CG 3.37Å; N62-Q66 PolarHBondContact O-N 2.89Å; N62-Q66 PolarHBondContact OD1-NE2 3.25Å |
| 63 | N | 94 | Very high | 91.6 | Very high | 85 Ų | 85 | 88.3 Ų | 88.3 | 46% | 0.455 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.4 | -43.9 | 177 | -70 | -22.4 | 0 | 0 | 0 | 112 | G59 D60 S65 Q66 L67 | G59-N63 PolarHBondContact O-N 3.18Å; G59-N63 PolarHBondContact O-ND2 3.4Å; D60-N63 PolarHBondContact O-N 2.87Å; N63-S65 VanDerWaalsContact C-N 3.32Å; N63-S65 PolarHBondContact O-N 2.93Å; N63-Q66 PolarHBondContact O-N 3.41Å; N63-L67 WeakPolarHBondContact O-CG 3.48Å; N63-L67 PolarHBondContact O-N 2.88Å |
| 64 | I | 91.1 | Very high | 91.3 | Very high | 85 Ų | 85 | 89 Ų | 89 | 44% | 0.436 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -59.2 | -45.1 | 175.2 | -69.8 | 165.4 | 0 | 0 | 0 | 110.4 | D60 Q66 L67 Q68 | D60-I64 VanDerWaalsContact O-CG1 3.27Å; D60-I64 WeakPolarHBondContact O-CG1 3.33Å; D60-I64 PolarHBondContact O-N 2.79Å; I64-Q66 VanDerWaalsContact C-N 3.33Å; I64-Q66 PolarHBondContact O-N 3.5Å; I64-L67 PolarHBondContact O-N 2.93Å; I64-Q68 HydrophobicContact CG2-CG 4.45Å; I64-Q68 WeakPolarHBondContact O-CG 3.31Å; I64-Q68 PolarHBondContact O-N 3.49Å |
| 65 | S | 91.8 | Very high | 90.8 | Very high | 66 Ų | 66 | 85.5 Ų | 85.5 | 46% | 0.462 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62.1 | -40.9 | 179.1 | -58 | 0 | 0 | 0 | 0 | 111.9 | N61 N62 N63 Q68 H69 | N61-S65 WeakPolarHBondContact O-CB 3.31Å; N61-S65 PolarHBondContact O-N 3.29Å; N61-S65 PolarHBondContact O-OG 3.44Å; N62-S65 PolarHBondContact O-N 2.83Å; N63-S65 VanDerWaalsContact C-N 3.32Å; N63-S65 PolarHBondContact O-N 2.93Å; S65-Q68 PolarHBondContact O-N 2.88Å; S65-H69 PolarHBondContact O-N 3.28Å |
| 66 | Q | 92.4 | Very high | 90.7 | Very high | 112 Ų | 112 | 87.2 Ų | 87.2 | 52% | 0.523 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -66.1 | -42.2 | 176.4 | -71.2 | 177.4 | 28.1 | 0 | 0 | 112.3 | N62 N63 I64 H69 S70 | N62-Q66 PolarHBondContact ND2-NE2 2.98Å; N62-Q66 WeakPolarHBondContact O-CG 3.37Å; N62-Q66 PolarHBondContact O-N 2.89Å; N62-Q66 PolarHBondContact OD1-NE2 3.25Å; N63-Q66 PolarHBondContact O-N 3.41Å; I64-Q66 VanDerWaalsContact C-N 3.33Å; I64-Q66 PolarHBondContact O-N 3.5Å; Q66-H69 PolarHBondContact O-N 2.98Å; Q66-S70 PolarHBondContact O-N 2.92Å |
| 67 | L | 90.2 | Very high | 90.3 | Very high | 110 Ų | 110 | 90.7 Ų | 90.7 | 58% | 0.576 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -64.1 | -40.6 | 176.2 | -73.2 | 173 | 0 | 0 | 0 | 112 | N63 I64 H69 S70 N71 | N63-L67 WeakPolarHBondContact O-CG 3.48Å; N63-L67 PolarHBondContact O-N 2.88Å; I64-L67 PolarHBondContact O-N 2.93Å; L67-H69 VanDerWaalsContact C-N 3.34Å; L67-H69 PolarHBondContact O-N 3.31Å; L67-S70 PolarHBondContact O-N 3.37Å; L67-N71 WeakPolarHBondContact O-CB 3.47Å; L67-N71 VanDerWaalsContact O-CG 3.29Å; L67-N71 PolarHBondContact O-N 3.01Å |
| 68 | Q | 90.2 | Very high | 89.7 | Confident | 127 Ų | 127 | 90.7 Ų | 90.7 | 59% | 0.593 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -61.7 | -42.6 | 174.7 | -76 | 180 | -18.8 | 0 | 0 | 111.7 | I64 S65 N71 S72 | I64-Q68 HydrophobicContact CG2-CG 4.45Å; I64-Q68 WeakPolarHBondContact O-CG 3.31Å; I64-Q68 PolarHBondContact O-N 3.49Å; S65-Q68 PolarHBondContact O-N 2.88Å; Q68-N71 PolarHBondContact O-N 3.38Å; Q68-S72 PolarHBondContact O-N 2.87Å |
| 69 | H | 90.2 | Very high | 89.5 | Confident | 134 Ų | 134 | 91.6 Ų | 91.6 | 62% | 0.62 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -63.8 | -46.7 | 176.4 | -172.2 | 55.5 | 0 | 0 | 0 | 112 | S65 Q66 L67 N71 S72 T73 | S65-H69 PolarHBondContact O-N 3.28Å; Q66-H69 PolarHBondContact O-N 2.98Å; L67-H69 VanDerWaalsContact C-N 3.34Å; L67-H69 PolarHBondContact O-N 3.31Å; H69-N71 PolarHBondContact O-N 3.18Å; H69-S72 WeakPolarHBondContact O-CB 3.48Å; H69-S72 PolarHBondContact O-N 3.32Å; H69-T73 PolarHBondContact O-N 3.35Å; H69-T73 PolarHBondContact O-OG1 3.49Å |
| 70 | S | 86.3 | Confident | 89 | Confident | 59 Ų | 59 | 96.2 Ų | 96.2 | 41% | 0.413 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -58.3 | -46.3 | 176.6 | -168.1 | 0 | 0 | 0 | 0 | 111.9 | Q66 L67 S72 T73 D74 | Q66-S70 PolarHBondContact O-N 2.92Å; L67-S70 PolarHBondContact O-N 3.37Å; S70-S72 VanDerWaalsContact C-N 3.29Å; S70-S72 PolarHBondContact O-N 3.48Å; S70-T73 PolarHBondContact O-N 3Å; S70-D74 PolarHBondContact O-N 3.43Å |
| 71 | N | 85.8 | Confident | 88.4 | Confident | 105 Ų | 105 | 96 Ų | 96 | 56% | 0.561 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.2 | -36.1 | 178.4 | -74.9 | -10.4 | 0 | 0 | 0 | 112.3 | L67 Q68 H69 S75 | L67-N71 WeakPolarHBondContact O-CB 3.47Å; L67-N71 VanDerWaalsContact O-CG 3.29Å; L67-N71 PolarHBondContact O-N 3.01Å; Q68-N71 PolarHBondContact O-N 3.38Å; H69-N71 PolarHBondContact O-N 3.18Å; N71-S75 WeakPolarHBondContact O-CB 3.26Å; N71-S75 PolarHBondContact O-N 3.44Å |
| 72 | S | 89 | Confident | 87.6 | Confident | 59 Ų | 59 | 95.3 Ų | 95.3 | 41% | 0.413 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.4 | -47.7 | 174.9 | -166.2 | 0 | 0 | 0 | 0 | 111 | Q68 H69 S70 D74 S75 E76 | Q68-S72 PolarHBondContact O-N 2.87Å; H69-S72 WeakPolarHBondContact O-CB 3.48Å; H69-S72 PolarHBondContact O-N 3.32Å; S70-S72 VanDerWaalsContact C-N 3.29Å; S70-S72 PolarHBondContact O-N 3.48Å; S72-D74 VanDerWaalsContact C-N 3.34Å; S72-D74 PolarHBondContact O-N 3.26Å; S72-S75 WeakPolarHBondContact O-CB 3.33Å; S72-S75 PolarHBondContact O-N 3.04Å; S72-E76 WeakPolarHBondContact O-CG 3.43Å; S72-E76 PolarHBondContact O-N 3.41Å |
| 73 | T | 89.5 | Confident | 87.1 | Confident | 56 Ų | 56 | 94.1 Ų | 94.1 | 34% | 0.344 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.5 | -40.9 | 177.6 | -58.7 | 0 | 0 | 0 | 0 | 111.9 | H69 S70 S75 E76 R77 | H69-T73 PolarHBondContact O-N 3.35Å; H69-T73 PolarHBondContact O-OG1 3.49Å; S70-T73 PolarHBondContact O-N 3Å; T73-S75 VanDerWaalsContact C-N 3.34Å; T73-E76 PolarHBondContact O-N 3.49Å; T73-R77 VanDerWaalsContact O-CG 3.27Å; T73-R77 WeakPolarHBondContact O-CG 3.4Å; T73-R77 PolarHBondContact O-N 2.98Å |
| 74 | D | 86.7 | Confident | 86.4 | Confident | 82 Ų | 82 | 93.5 Ų | 93.5 | 44% | 0.439 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.3 | -39 | 176.5 | -73.6 | -24.5 | 0 | 0 | 0 | 111.8 | S70 S72 R77 V78 | S70-D74 PolarHBondContact O-N 3.43Å; S72-D74 VanDerWaalsContact C-N 3.34Å; S72-D74 PolarHBondContact O-N 3.26Å; D74-R77 PolarHBondContact O-N 3.25Å; D74-V78 WeakPolarHBondContact O-CG2 3.45Å; D74-V78 PolarHBondContact O-N 3.46Å |
| 75 | S | 83.6 | Confident | 85.5 | Confident | 62 Ų | 62 | 93.8 Ų | 93.8 | 43% | 0.434 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.1 | -46.1 | 174.9 | -165.1 | 0 | 0 | 0 | 0 | 111.8 | N71 S72 T73 R77 V78 E79 | N71-S75 WeakPolarHBondContact O-CB 3.26Å; N71-S75 PolarHBondContact O-N 3.44Å; S72-S75 WeakPolarHBondContact O-CB 3.33Å; S72-S75 PolarHBondContact O-N 3.04Å; T73-S75 VanDerWaalsContact C-N 3.34Å; S75-R77 VanDerWaalsContact C-N 3.33Å; S75-R77 PolarHBondContact O-N 3.46Å; S75-V78 PolarHBondContact O-N 2.91Å; S75-E79 PolarHBondContact O-N 3.47Å |
| 76 | E | 90 | Very high | 84.5 | Confident | 119 Ų | 119 | 95.6 Ų | 95.6 | 56% | 0.556 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -60.1 | -42.2 | 176.7 | -72.4 | 171.9 | -167.4 | 0 | 0 | 111.7 | S72 T73 V78 E79 E80 | S72-E76 WeakPolarHBondContact O-CG 3.43Å; S72-E76 PolarHBondContact O-N 3.41Å; T73-E76 PolarHBondContact O-N 3.49Å; E76-V78 VanDerWaalsContact C-N 3.33Å; E76-V78 PolarHBondContact O-N 3.21Å; E76-E79 PolarHBondContact O-N 3.44Å; E76-E80 PolarHBondContact O-N 2.92Å |
| 77 | R | 86.5 | Confident | 83.7 | Confident | 154 Ų | 154 | 96 Ų | 96 | 58% | 0.581 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -64.6 | -36.9 | 176.9 | -69.5 | 174.2 | 69.3 | 75.5 | 7 | 112.6 | T73 D74 S75 T81 | T73-R77 VanDerWaalsContact O-CG 3.27Å; T73-R77 WeakPolarHBondContact O-CG 3.4Å; T73-R77 PolarHBondContact O-N 2.98Å; D74-R77 PolarHBondContact O-N 3.25Å; S75-R77 VanDerWaalsContact C-N 3.33Å; S75-R77 PolarHBondContact O-N 3.46Å; R77-T81 WeakPolarHBondContact O-CB 3.46Å; R77-T81 PolarHBondContact O-N 2.96Å; R77-T81 PolarHBondContact O-OG1 2.96Å |
| 78 | V | 81.4 | Confident | 82.5 | Confident | 90 Ų | 90 | 94.8 Ų | 94.8 | 55% | 0.545 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -66.7 | -44.7 | 175.4 | 169.8 | 0 | 0 | 0 | 0 | 110.4 | D74 S75 E76 E80 T81 V82 | D74-V78 WeakPolarHBondContact O-CG2 3.45Å; D74-V78 PolarHBondContact O-N 3.46Å; S75-V78 PolarHBondContact O-N 2.91Å; E76-V78 VanDerWaalsContact C-N 3.33Å; E76-V78 PolarHBondContact O-N 3.21Å; V78-E80 PolarHBondContact O-N 2.97Å; V78-T81 PolarHBondContact O-N 3.34Å; V78-V82 HydrophobicContact CG1-CG2 4.38Å; V78-V82 WeakPolarHBondContact O-CG2 3.48Å; V78-V82 PolarHBondContact O-N 3.35Å |
| 79 | E | 86.9 | Confident | 81.1 | Confident | 127 Ų | 127 | 93 Ų | 93 | 59% | 0.593 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -61.6 | -41.8 | 176.8 | -73 | -179.2 | -176.4 | 0 | 0 | 112.4 | S75 E76 V82 S83 | S75-E79 PolarHBondContact O-N 3.47Å; E76-E79 PolarHBondContact O-N 3.44Å; E79-V82 PolarHBondContact O-N 3.3Å; E79-S83 WeakPolarHBondContact O-CB 3.34Å; E79-S83 PolarHBondContact O-N 2.96Å; E79-S83 PolarHBondContact O-OG 2.94Å |
| 80 | E | 85 | Confident | 79.8 | Confident | 129 Ų | 129 | 91.6 Ų | 91.6 | 60% | 0.603 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -61.1 | -46.8 | 174 | -173.5 | 178.5 | -164.2 | 0 | 0 | 111 | E76 V78 V82 S83 V84 | E76-E80 PolarHBondContact O-N 2.92Å; V78-E80 PolarHBondContact O-N 2.97Å; E80-V82 PolarHBondContact O-N 3.48Å; E80-S83 WeakPolarHBondContact O-CB 3.39Å; E80-S83 PolarHBondContact O-N 3.43Å; E80-V84 WeakPolarHBondContact O-CG2 3.38Å; E80-V84 PolarHBondContact O-N 3.25Å |
| 81 | T | 80.3 | Confident | 78.7 | Confident | 80 Ų | 80 | 93.2 Ų | 93.2 | 49% | 0.491 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62 | -43.5 | 178.8 | -57.3 | 0 | 0 | 0 | 0 | 111.8 | R77 V78 S83 V84 I85 | R77-T81 WeakPolarHBondContact O-CB 3.46Å; R77-T81 PolarHBondContact O-N 2.96Å; R77-T81 PolarHBondContact O-OG1 2.96Å; V78-T81 PolarHBondContact O-N 3.34Å; T81-S83 VanDerWaalsContact C-N 3.31Å; T81-S83 PolarHBondContact O-N 3.44Å; T81-V84 PolarHBondContact O-N 3.41Å; T81-I85 HydrophobicContact CG2-CD1 3.99Å; T81-I85 VanDerWaalsContact O-CG1 3.3Å; T81-I85 WeakPolarHBondContact O-CG1 3.47Å; T81-I85 PolarHBondContact O-N 3.37Å |
| 82 | V | 76.4 | Confident | 77.5 | Confident | 70 Ų | 70 | 93.1 Ų | 93.1 | 42% | 0.424 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63.3 | -39.3 | 177.1 | 169.2 | 0 | 0 | 0 | 0 | 110.9 | V78 E79 E80 I85 M86 | V78-V82 HydrophobicContact CG1-CG2 4.38Å; V78-V82 WeakPolarHBondContact O-CG2 3.48Å; V78-V82 PolarHBondContact O-N 3.35Å; E79-V82 PolarHBondContact O-N 3.3Å; E80-V82 PolarHBondContact O-N 3.48Å; V82-I85 PolarHBondContact O-N 2.94Å; V82-M86 HydrophobicContact CG1-CE 3.91Å; V82-M86 WeakPolarHBondContact O-CG 3.45Å; V82-M86 PolarHBondContact O-N 3.19Å |
| 83 | S | 82.5 | Confident | 76 | Confident | 66 Ų | 66 | 93 Ų | 93 | 46% | 0.462 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.6 | -45.3 | 176.9 | -59.7 | 0 | 0 | 0 | 0 | 112 | E79 E80 T81 I85 M86 E87 | E79-S83 WeakPolarHBondContact O-CB 3.34Å; E79-S83 PolarHBondContact O-N 2.96Å; E79-S83 PolarHBondContact O-OG 2.94Å; E80-S83 WeakPolarHBondContact O-CB 3.39Å; E80-S83 PolarHBondContact O-N 3.43Å; T81-S83 VanDerWaalsContact C-N 3.31Å; T81-S83 PolarHBondContact O-N 3.44Å; S83-I85 PolarHBondContact O-N 3.02Å; S83-M86 PolarHBondContact O-N 3.48Å; S83-E87 PolarHBondContact O-N 3.01Å |
| 84 | V | 79.2 | Confident | 74.6 | Confident | 72 Ų | 72 | 96.8 Ų | 96.8 | 44% | 0.436 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.2 | -44.7 | 175.8 | 173.1 | 0 | 0 | 0 | 0 | 111.3 | E80 T81 M86 E87 D88 | E80-V84 WeakPolarHBondContact O-CG2 3.38Å; E80-V84 PolarHBondContact O-N 3.25Å; T81-V84 PolarHBondContact O-N 3.41Å; V84-M86 VanDerWaalsContact C-N 3.3Å; V84-M86 PolarHBondContact O-N 3.29Å; V84-E87 PolarHBondContact O-N 3.01Å; V84-D88 PolarHBondContact O-N 2.96Å |
| 85 | I | 72.4 | Confident | 73.5 | Confident | 90 Ų | 90 | 95.6 Ų | 95.6 | 46% | 0.462 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.9 | -39.3 | 177.5 | -69 | 166.9 | 0 | 0 | 0 | 111.5 | T81 V82 S83 N89 | T81-I85 HydrophobicContact CG2-CD1 3.99Å; T81-I85 VanDerWaalsContact O-CG1 3.3Å; T81-I85 WeakPolarHBondContact O-CG1 3.47Å; T81-I85 PolarHBondContact O-N 3.37Å; V82-I85 PolarHBondContact O-N 2.94Å; S83-I85 PolarHBondContact O-N 3.02Å; I85-N89 WeakPolarHBondContact O-CB 3.38Å; I85-N89 PolarHBondContact O-N 2.96Å; I85-N89 PolarHBondContact O-ND2 3.32Å |
| 86 | M | 71.3 | Confident | 72.6 | Confident | 105 Ų | 105 | 98.7 Ų | 98.7 | 52% | 0.517 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -66.9 | -40.7 | 176.5 | -73.9 | -170.6 | -67.4 | 0 | 0 | 112 | V82 S83 V84 N89 N90 | V82-M86 HydrophobicContact CG1-CE 3.91Å; V82-M86 WeakPolarHBondContact O-CG 3.45Å; V82-M86 PolarHBondContact O-N 3.19Å; S83-M86 PolarHBondContact O-N 3.48Å; V84-M86 VanDerWaalsContact C-N 3.3Å; V84-M86 PolarHBondContact O-N 3.29Å; M86-N89 PolarHBondContact O-N 3.31Å; M86-N90 WeakPolarHBondContact O-CB 3.37Å; M86-N90 VanDerWaalsContact O-CG 3.25Å; M86-N90 PolarHBondContact O-N 3.18Å; M86-N90 PolarHBondContact O-ND2 3.42Å |
| 87 | E | 74.1 | Confident | 71.5 | Confident | 120 Ų | 120 | 99.1 Ų | 99.1 | 56% | 0.561 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -63.4 | -45.9 | 175.3 | -171.9 | 175 | 176.5 | 0 | 0 | 111.7 | S83 V84 N89 N90 N91 | S83-E87 PolarHBondContact O-N 3.01Å; V84-E87 PolarHBondContact O-N 3.01Å; E87-N89 PolarHBondContact O-N 3.49Å; E87-N90 WeakPolarHBondContact O-CB 3.49Å; E87-N90 PolarHBondContact O-N 2.91Å; E87-N91 WeakPolarHBondContact O-CB 3.4Å; E87-N91 VanDerWaalsContact O-CG 3.28Å; E87-N91 PolarHBondContact O-N 3.35Å; E87-N91 PolarHBondContact O-ND2 3.44Å |
| 88 | D | 66.4 | Low | 70.6 | Confident | 85 Ų | 85 | 94.7 Ų | 94.7 | 46% | 0.455 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.1 | -43.9 | 176.9 | -77 | -18 | 0 | 0 | 0 | 111.9 | V84 N90 N91 I92 | V84-D88 PolarHBondContact O-N 2.96Å; D88-N90 VanDerWaalsContact C-N 3.32Å; D88-N90 PolarHBondContact O-N 2.94Å; D88-N91 PolarHBondContact O-N 2.91Å; D88-I92 WeakPolarHBondContact O-CD1 3.33Å; D88-I92 VanDerWaalsContact O-CG1 3.29Å; D88-I92 WeakPolarHBondContact O-CG1 3.37Å; D88-I92 PolarHBondContact O-N 3.27Å |
| 89 | N | 60.4 | Low | 70.2 | Confident | 89 Ų | 89 | 94.8 Ų | 94.8 | 48% | 0.476 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.5 | -38.8 | 175.8 | -80.2 | -26.9 | 0 | 0 | 0 | 112.4 | I85 M86 E87 I92 S93 | I85-N89 WeakPolarHBondContact O-CB 3.38Å; I85-N89 PolarHBondContact O-N 2.96Å; I85-N89 PolarHBondContact O-ND2 3.32Å; M86-N89 PolarHBondContact O-N 3.31Å; E87-N89 PolarHBondContact O-N 3.49Å; N89-I92 PolarHBondContact O-N 3.46Å; N89-S93 WeakPolarHBondContact O-CB 3.48Å; N89-S93 PolarHBondContact O-N 2.95Å; N89-S93 PolarHBondContact O-OG 2.92Å |
| 90 | N | 62.2 | Low | 69.6 | Low | 104 Ų | 104 | 91.9 Ų | 91.9 | 56% | 0.556 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -65.9 | -43.5 | 174.4 | -73.4 | -24.8 | 0 | 0 | 0 | 111.1 | M86 E87 D88 I92 S93 Q94 | M86-N90 WeakPolarHBondContact O-CB 3.37Å; M86-N90 VanDerWaalsContact O-CG 3.25Å; M86-N90 PolarHBondContact O-N 3.18Å; M86-N90 PolarHBondContact O-ND2 3.42Å; E87-N90 WeakPolarHBondContact O-CB 3.49Å; E87-N90 PolarHBondContact O-N 2.91Å; D88-N90 VanDerWaalsContact C-N 3.32Å; D88-N90 PolarHBondContact O-N 2.94Å; N90-I92 VanDerWaalsContact C-N 3.28Å; N90-I92 PolarHBondContact O-N 2.99Å; N90-S93 PolarHBondContact O-N 3.29Å; N90-Q94 WeakPolarHBondContact O-CG 3.48Å; N90-Q94 PolarHBondContact O-N 3.43Å; N90-Q94 VanDerWaalsContact O-N 3.1Å |
| 91 | N | 63 | Low | 69.3 | Low | 94 Ų | 94 | 88.6 Ų | 88.6 | 50% | 0.503 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -64.8 | -29.3 | 177.6 | -73.5 | -23.6 | 0 | 0 | 0 | 112.9 | E87 D88 P95 | E87-N91 WeakPolarHBondContact O-CB 3.4Å; E87-N91 VanDerWaalsContact O-CG 3.28Å; E87-N91 PolarHBondContact O-N 3.35Å; E87-N91 PolarHBondContact O-ND2 3.44Å; D88-N91 PolarHBondContact O-N 2.91Å; N91-P95 WeakPolarHBondContact O-CD 3.44Å; N91-P95 VanDerWaalsContact O-CG 3.32Å; N91-P95 WeakPolarHBondContact O-CG 3.3Å |
| 92 | I | 60.6 | Low | 69.2 | Low | 102 Ų | 102 | 88.3 Ų | 88.3 | 52% | 0.523 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -78 | -36.8 | 173 | -68.3 | 161 | 0 | 0 | 0 | 111.6 | D88 N89 N90 P95 Q96 | D88-I92 WeakPolarHBondContact O-CD1 3.33Å; D88-I92 VanDerWaalsContact O-CG1 3.29Å; D88-I92 WeakPolarHBondContact O-CG1 3.37Å; D88-I92 PolarHBondContact O-N 3.27Å; N89-I92 PolarHBondContact O-N 3.46Å; N90-I92 VanDerWaalsContact C-N 3.28Å; N90-I92 PolarHBondContact O-N 2.99Å; I92-P95 WeakPolarHBondContact O-CD 3.45Å; I92-Q96 WeakPolarHBondContact O-CG 3.39Å |
| 93 | S | 57.4 | Low | 69.2 | Low | 57 Ų | 57 | 91.1 Ų | 91.1 | 40% | 0.399 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -72.2 | -33.8 | -176.6 | -59.6 | 0 | 0 | 0 | 0 | 112.9 | N89 N90 Q96 H97 | N89-S93 WeakPolarHBondContact O-CB 3.48Å; N89-S93 PolarHBondContact O-N 2.95Å; N89-S93 PolarHBondContact O-OG 2.92Å; N90-S93 PolarHBondContact O-N 3.29Å; S93-Q96 PolarHBondContact O-N 2.96Å; S93-H97 PolarHBondContact O-CD2 3.48Å; S93-H97 VanDerWaalsContact O-CD2 3.28Å; S93-H97 PolarHBondContact O-N 3.19Å |
| 94 | Q | 61.2 | Low | 69.2 | Low | 135 Ų | 135 | 92.2 Ų | 92.2 | 63% | 0.631 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -60.6 | -48.6 | 178.8 | -71.8 | -69.7 | -28.9 | 0 | 0 | 113.3 | N90 Q96 H97 S98 | N90-Q94 WeakPolarHBondContact O-CG 3.48Å; N90-Q94 PolarHBondContact O-N 3.43Å; N90-Q94 VanDerWaalsContact O-N 3.1Å; Q94-Q96 VanDerWaalsContact C-N 3.3Å; Q94-Q96 PolarHBondContact O-N 3.29Å; Q94-H97 PolarHBondContact O-N 3.31Å; Q94-S98 PolarHBondContact O-N 3.47Å |
| 95 | P | 62.8 | Low | 69.2 | Low | 58 Ų | 58 | 95.8 Ų | 95.8 | 38% | 0.377 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -58.9 | -35.4 | 172.7 | -25.7 | 31.3 | 0 | 0 | 0 | 114 | N91 I92 H97 S98 N99 | N91-P95 WeakPolarHBondContact O-CD 3.44Å; N91-P95 VanDerWaalsContact O-CG 3.32Å; N91-P95 WeakPolarHBondContact O-CG 3.3Å; I92-P95 WeakPolarHBondContact O-CD 3.45Å; P95-H97 VanDerWaalsContact C-N 3.33Å; P95-H97 PolarHBondContact O-N 2.92Å; P95-S98 PolarHBondContact O-N 2.89Å; P95-N99 VanDerWaalsContact O-CB 3.3Å; P95-N99 WeakPolarHBondContact O-CB 3.45Å; P95-N99 PolarHBondContact O-N 3.4Å; P95-N99 PolarHBondContact O-ND2 2.95Å |
| 96 | Q | 64.8 | Low | 69.4 | Low | 127 Ų | 127 | 96.8 Ų | 96.8 | 59% | 0.593 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -64 | -40.8 | 178.6 | -65 | -66.6 | -38.8 | 0 | 0 | 111.1 | I92 S93 Q94 S100 | I92-Q96 WeakPolarHBondContact O-CG 3.39Å; S93-Q96 PolarHBondContact O-N 2.96Å; Q94-Q96 VanDerWaalsContact C-N 3.3Å; Q94-Q96 PolarHBondContact O-N 3.29Å; Q96-S100 WeakPolarHBondContact O-CB 3.48Å; Q96-S100 PolarHBondContact O-N 3.34Å |
| 97 | H | 67.3 | Low | 69.9 | Low | 127 Ų | 127 | 97.5 Ų | 97.5 | 59% | 0.588 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -67.1 | -40.1 | 173.8 | -74.7 | -65.1 | 0 | 0 | 0 | 112.7 | S93 Q94 P95 S100 T101 | S93-H97 PolarHBondContact O-CD2 3.48Å; S93-H97 VanDerWaalsContact O-CD2 3.28Å; S93-H97 PolarHBondContact O-N 3.19Å; Q94-H97 PolarHBondContact O-N 3.31Å; P95-H97 VanDerWaalsContact C-N 3.33Å; P95-H97 PolarHBondContact O-N 2.92Å; H97-S100 PolarHBondContact O-N 3.31Å; H97-T101 WeakPolarHBondContact O-CB 3.21Å; H97-T101 PolarHBondContact O-N 3.33Å; H97-T101 PolarHBondContact O-OG1 3.5Å |
| 98 | S | 68.3 | Low | 70.2 | Confident | 61 Ų | 61 | 98.2 Ų | 98.2 | 43% | 0.427 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.8 | -48.4 | 174.2 | -166.7 | 0 | 0 | 0 | 0 | 111.2 | Q94 P95 S100 T101 D102 | Q94-S98 PolarHBondContact O-N 3.47Å; P95-S98 PolarHBondContact O-N 2.89Å; S98-S100 VanDerWaalsContact C-N 3.34Å; S98-S100 PolarHBondContact O-N 3.01Å; S98-T101 WeakPolarHBondContact O-CB 3.31Å; S98-T101 PolarHBondContact O-N 3.2Å; S98-T101 VanDerWaalsContact O-N 3.11Å; S98-D102 PolarHBondContact O-N 3.43Å |
| 99 | N | 73 | Confident | 70.8 | Confident | 93 Ų | 93 | 97.4 Ų | 97.4 | 50% | 0.497 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.9 | -40.3 | 179.6 | -70.4 | -15.1 | 0 | 0 | 0 | 112 | P95 D102 F103 | P95-N99 VanDerWaalsContact O-CB 3.3Å; P95-N99 WeakPolarHBondContact O-CB 3.45Å; P95-N99 PolarHBondContact O-N 3.4Å; P95-N99 PolarHBondContact O-ND2 2.95Å; N99-D102 PolarHBondContact O-N 3.38Å; N99-F103 WeakPolarHBondContact O-CB 3.42Å; N99-F103 PolarHBondContact O-N 3.06Å |
| 100 | S | 73.4 | Confident | 71.5 | Confident | 65 Ų | 65 | 99.1 Ų | 99.1 | 46% | 0.455 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65 | -40.2 | 174.5 | 176.4 | 0 | 0 | 0 | 0 | 111.9 | Q96 H97 S98 F103 N104 | Q96-S100 WeakPolarHBondContact O-CB 3.48Å; Q96-S100 PolarHBondContact O-N 3.34Å; H97-S100 PolarHBondContact O-N 3.31Å; S98-S100 VanDerWaalsContact C-N 3.34Å; S98-S100 PolarHBondContact O-N 3.01Å; S100-F103 PolarHBondContact O-N 2.89Å; S100-N104 PolarHBondContact O-N 2.96Å; S100-N104 PolarHBondContact O-ND2 3.35Å; S100-N104 PolarHBondContact O-OD1 3.36Å |
| 101 | T | 78.2 | Confident | 72.4 | Confident | 61 Ų | 61 | 98.1 Ų | 98.1 | 37% | 0.374 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64.9 | -42.3 | 176.5 | -56.3 | 0 | 0 | 0 | 0 | 111.3 | H97 S98 N104 R105 | H97-T101 WeakPolarHBondContact O-CB 3.21Å; H97-T101 PolarHBondContact O-N 3.33Å; H97-T101 PolarHBondContact O-OG1 3.5Å; S98-T101 WeakPolarHBondContact O-CB 3.31Å; S98-T101 PolarHBondContact O-N 3.2Å; S98-T101 VanDerWaalsContact O-N 3.11Å; T101-N104 PolarHBondContact O-N 3.37Å; T101-R105 WeakPolarHBondContact O-CG 3.37Å; T101-R105 PolarHBondContact O-N 3.49Å |
| 102 | D | 77.6 | Confident | 73.2 | Confident | 73 Ų | 73 | 97.5 Ų | 97.5 | 39% | 0.39 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -69.6 | -36.7 | 178.9 | -68.3 | -26.6 | 0 | 0 | 0 | 111.9 | S98 N99 R105 M106 | S98-D102 PolarHBondContact O-N 3.43Å; N99-D102 PolarHBondContact O-N 3.38Å; D102-R105 PolarHBondContact O-N 2.94Å; D102-R105 IonicContact OD1-NH1 3.19Å; D102-R105 PolarHBondContact OD1-NH1 3.44Å; D102-M106 WeakPolarHBondContact O-CB 3.36Å; D102-M106 PolarHBondContact O-N 3.02Å |
| 103 | F | 77.5 | Confident | 73.9 | Confident | 130 Ų | 130 | 96.9 Ų | 96.9 | 57% | 0.57 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.8 | -46.4 | 171.8 | -173.5 | -91.4 | 0 | 0 | 0 | 111.7 | N99 S100 R105 M106 E107 | N99-F103 WeakPolarHBondContact O-CB 3.42Å; N99-F103 PolarHBondContact O-N 3.06Å; S100-F103 PolarHBondContact O-N 2.89Å; F103-R105 VanDerWaalsContact C-N 3.35Å; F103-R105 PolarHBondContact O-N 3.21Å; F103-M106 WeakPolarHBondContact O-CB 3.39Å; F103-M106 PolarHBondContact O-N 3.5Å; F103-M106 VanDerWaalsContact O-N 3.16Å; F103-E107 PolarHBondContact O-N 2.89Å |
| 104 | N | 83.1 | Confident | 74.9 | Confident | 89 Ų | 89 | 100.2 Ų | 100.2 | 48% | 0.476 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.2 | -41.3 | 177.6 | -68.2 | -15.6 | 0 | 0 | 0 | 111.8 | S100 T101 M106 E107 E108 | S100-N104 PolarHBondContact O-N 2.96Å; S100-N104 PolarHBondContact O-ND2 3.35Å; S100-N104 PolarHBondContact O-OD1 3.36Å; T101-N104 PolarHBondContact O-N 3.37Å; N104-M106 VanDerWaalsContact C-N 3.32Å; N104-M106 PolarHBondContact O-N 3.31Å; N104-E107 PolarHBondContact O-N 3.42Å; N104-E108 WeakPolarHBondContact O-CB 3.45Å; N104-E108 PolarHBondContact O-N 3.07Å |
| 105 | R | 78.7 | Confident | 76 | Confident | 147 Ų | 147 | 95.2 Ų | 95.2 | 56% | 0.555 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.7 | -37.5 | 174.3 | -75.8 | 177.3 | 179.1 | 149.9 | -2.3 | 112.6 | T101 D102 F103 S109 | T101-R105 WeakPolarHBondContact O-CG 3.37Å; T101-R105 PolarHBondContact O-N 3.49Å; D102-R105 PolarHBondContact O-N 2.94Å; D102-R105 IonicContact OD1-NH1 3.19Å; D102-R105 PolarHBondContact OD1-NH1 3.44Å; F103-R105 VanDerWaalsContact C-N 3.35Å; F103-R105 PolarHBondContact O-N 3.21Å; R105-S109 WeakPolarHBondContact O-CB 3.46Å; R105-S109 PolarHBondContact O-N 3.36Å; R105-S109 PolarHBondContact O-OG 3.05Å |
| 106 | M | 76.9 | Confident | 76.9 | Confident | 110 Ų | 110 | 96.5 Ų | 96.5 | 54% | 0.542 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65.6 | -45.7 | 175.9 | -176.4 | 179.3 | -68.7 | 0 | 0 | 110.7 | D102 F103 N104 S109 F110 | D102-M106 WeakPolarHBondContact O-CB 3.36Å; D102-M106 PolarHBondContact O-N 3.02Å; F103-M106 WeakPolarHBondContact O-CB 3.39Å; F103-M106 PolarHBondContact O-N 3.5Å; F103-M106 VanDerWaalsContact O-N 3.16Å; N104-M106 VanDerWaalsContact C-N 3.32Å; N104-M106 PolarHBondContact O-N 3.31Å; M106-S109 PolarHBondContact O-N 3.49Å; M106-F110 HydrophobicContact CG-CD2 3.76Å; M106-F110 HydrophobicContact CG-CE2 3.55Å; M106-F110 WeakPolarHBondContact O-CD2 3.41Å; M106-F110 PolarHBondContact O-N 3.01Å; M106-F110 HydrophobicContact SD-CE2 4.01Å |
| 107 | E | 81 | Confident | 77.5 | Confident | 120 Ų | 120 | 94.7 Ų | 94.7 | 56% | 0.561 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -61.2 | -43.8 | 176.7 | -169.1 | 176.2 | -174.5 | 0 | 0 | 112 | F103 N104 S109 F110 S111 | F103-E107 PolarHBondContact O-N 2.89Å; N104-E107 PolarHBondContact O-N 3.42Å; E107-S109 PolarHBondContact O-N 2.96Å; E107-F110 PolarHBondContact O-N 3.49Å; E107-S111 PolarHBondContact O-N 3.45Å |
| 108 | E | 81.4 | Confident | 78.3 | Confident | 135 Ų | 135 | 93.5 Ų | 93.5 | 63% | 0.631 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -60.7 | -44.8 | 174.6 | -172.7 | 176.5 | -166.2 | 0 | 0 | 111.5 | N104 F110 S111 V112 | N104-E108 WeakPolarHBondContact O-CB 3.45Å; N104-E108 PolarHBondContact O-N 3.07Å; E108-F110 PolarHBondContact O-N 3.33Å; E108-S111 WeakPolarHBondContact O-CB 3.42Å; E108-S111 PolarHBondContact O-N 2.98Å; E108-V112 WeakPolarHBondContact O-CG2 3.3Å; E108-V112 PolarHBondContact O-N 3.3Å |
| 109 | S | 77.1 | Confident | 79.2 | Confident | 68 Ų | 68 | 94.7 Ų | 94.7 | 48% | 0.476 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.7 | -42.1 | 177 | -60 | 0 | 0 | 0 | 0 | 112 | R105 M106 E107 V112 I113 | R105-S109 WeakPolarHBondContact O-CB 3.46Å; R105-S109 PolarHBondContact O-N 3.36Å; R105-S109 PolarHBondContact O-OG 3.05Å; M106-S109 PolarHBondContact O-N 3.49Å; E107-S109 PolarHBondContact O-N 2.96Å; S109-V112 PolarHBondContact O-N 2.92Å; S109-I113 VanDerWaalsContact O-CG1 3.31Å; S109-I113 WeakPolarHBondContact O-CG1 3.48Å; S109-I113 PolarHBondContact O-N 2.98Å |
| 110 | F | 75.1 | Confident | 79.7 | Confident | 126 Ų | 126 | 94.3 Ų | 94.3 | 55% | 0.553 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -63 | -40.9 | 174.6 | -86.4 | -66.4 | 0 | 0 | 0 | 112.2 | M106 E107 E108 V112 I113 M114 | M106-F110 HydrophobicContact CG-CD2 3.76Å; M106-F110 HydrophobicContact CG-CE2 3.55Å; M106-F110 WeakPolarHBondContact O-CD2 3.41Å; M106-F110 PolarHBondContact O-N 3.01Å; M106-F110 HydrophobicContact SD-CE2 4.01Å; E107-F110 PolarHBondContact O-N 3.49Å; E108-F110 PolarHBondContact O-N 3.33Å; F110-V112 VanDerWaalsContact C-N 3.35Å; F110-V112 PolarHBondContact O-N 3.48Å; F110-I113 PolarHBondContact O-N 3.37Å; F110-M114 WeakPolarHBondContact O-CG 3.37Å; F110-M114 PolarHBondContact O-N 3.19Å |
| 111 | S | 82.3 | Confident | 80.3 | Confident | 83 Ų | 83 | 94.5 Ų | 94.5 | 58% | 0.58 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.7 | -40.9 | 177 | -172.2 | 0 | 0 | 0 | 0 | 112.1 | E107 E108 M114 G115 | E107-S111 PolarHBondContact O-N 3.45Å; E108-S111 WeakPolarHBondContact O-CB 3.42Å; E108-S111 PolarHBondContact O-N 2.98Å; S111-M114 PolarHBondContact O-N 2.96Å; S111-G115 PolarHBondContact O-N 2.96Å |
| 112 | V | 78.9 | Confident | 80.7 | Confident | 80 Ų | 80 | 97.9 Ų | 97.9 | 49% | 0.485 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.2 | -47.7 | 175.5 | 172.9 | 0 | 0 | 0 | 0 | 110.9 | E108 S109 F110 M114 G115 D116 | E108-V112 WeakPolarHBondContact O-CG2 3.3Å; E108-V112 PolarHBondContact O-N 3.3Å; S109-V112 PolarHBondContact O-N 2.92Å; F110-V112 VanDerWaalsContact C-N 3.35Å; F110-V112 PolarHBondContact O-N 3.48Å; V112-M114 VanDerWaalsContact C-N 3.29Å; V112-M114 PolarHBondContact O-N 3.26Å; V112-G115 WeakPolarHBondContact O-CA 3.38Å; V112-G115 PolarHBondContact O-N 2.9Å; V112-G115 VanDerWaalsContact O-N 3.07Å; V112-D116 PolarHBondContact O-N 2.99Å |
| 113 | I | 76.8 | Confident | 81.2 | Confident | 90 Ų | 90 | 99.7 Ų | 99.7 | 46% | 0.462 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -58.9 | -41.3 | 178.3 | -68.5 | 165.6 | 0 | 0 | 0 | 111.4 | S109 F110 D116 N117 | S109-I113 VanDerWaalsContact O-CG1 3.31Å; S109-I113 WeakPolarHBondContact O-CG1 3.48Å; S109-I113 PolarHBondContact O-N 2.98Å; F110-I113 PolarHBondContact O-N 3.37Å; I113-D116 PolarHBondContact O-N 3.48Å; I113-N117 WeakPolarHBondContact O-CB 3.37Å; I113-N117 PolarHBondContact O-N 3.36Å; I113-N117 PolarHBondContact O-ND2 3.49Å |
| 114 | M | 77.8 | Confident | 81.6 | Confident | 127 Ų | 127 | 99.5 Ų | 99.5 | 63% | 0.626 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -65.3 | -40.2 | 175.9 | -71.3 | -133.2 | -69.4 | 0 | 0 | 112.3 | F110 S111 V112 N117 N118 | F110-M114 WeakPolarHBondContact O-CG 3.37Å; F110-M114 PolarHBondContact O-N 3.19Å; S111-M114 PolarHBondContact O-N 2.96Å; V112-M114 VanDerWaalsContact C-N 3.29Å; V112-M114 PolarHBondContact O-N 3.26Å; M114-N117 PolarHBondContact O-N 3.36Å; M114-N118 PolarHBondContact O-N 3Å; M114-N118 PolarHBondContact O-ND2 2.79Å |
| 115 | G | 84.2 | Confident | 81.8 | Confident | 29 Ų | 29 | 101.7 Ų | 101.7 | 30% | 0.299 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -60.4 | -45.9 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | S111 V112 N118 N119 | S111-G115 PolarHBondContact O-N 2.96Å; V112-G115 WeakPolarHBondContact O-CA 3.38Å; V112-G115 PolarHBondContact O-N 2.9Å; V112-G115 VanDerWaalsContact O-N 3.07Å; G115-N118 PolarHBondContact O-N 3.43Å; G115-N119 VanDerWaalsContact O-CG 3.32Å; G115-N119 PolarHBondContact O-N 3.41Å; G115-N119 PolarHBondContact O-ND2 2.99Å |
| 116 | D | 81.6 | Confident | 82.1 | Confident | 86 Ų | 86 | 97.4 Ų | 97.4 | 46% | 0.46 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.1 | -42.4 | 178.8 | -73 | -17.3 | 0 | 0 | 0 | 112 | V112 I113 N118 N119 I120 | V112-D116 PolarHBondContact O-N 2.99Å; I113-D116 PolarHBondContact O-N 3.48Å; D116-N118 VanDerWaalsContact C-N 3.33Å; D116-N118 PolarHBondContact O-N 3.39Å; D116-N119 PolarHBondContact O-N 2.92Å; D116-I120 VanDerWaalsContact O-CG1 3.3Å; D116-I120 WeakPolarHBondContact O-CG1 3.4Å; D116-I120 PolarHBondContact O-N 3.11Å |
| 117 | N | 76.8 | Confident | 82.4 | Confident | 89 Ų | 89 | 97.2 Ų | 97.2 | 48% | 0.476 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.5 | -42.2 | 174.9 | -77.2 | -18.5 | 0 | 0 | 0 | 112 | I113 M114 N119 I120 S121 | I113-N117 WeakPolarHBondContact O-CB 3.37Å; I113-N117 PolarHBondContact O-N 3.36Å; I113-N117 PolarHBondContact O-ND2 3.49Å; M114-N117 PolarHBondContact O-N 3.36Å; N117-N119 PolarHBondContact O-N 2.82Å; N117-I120 PolarHBondContact O-N 3.45Å; N117-S121 PolarHBondContact O-N 3.48Å; N117-S121 PolarHBondContact O-OG 2.96Å |
| 118 | N | 84.5 | Confident | 82.7 | Confident | 102 Ų | 102 | 94.4 Ų | 94.4 | 55% | 0.545 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.6 | -42.2 | 175.5 | -74.4 | -22.5 | 0 | 0 | 0 | 111.8 | M114 G115 D116 S121 Q122 | M114-N118 PolarHBondContact O-N 3Å; M114-N118 PolarHBondContact O-ND2 2.79Å; G115-N118 PolarHBondContact O-N 3.43Å; D116-N118 VanDerWaalsContact C-N 3.33Å; D116-N118 PolarHBondContact O-N 3.39Å; N118-S121 PolarHBondContact O-N 3.16Å; N118-Q122 WeakPolarHBondContact O-CG 3.32Å; N118-Q122 PolarHBondContact O-N 3.39Å |
| 119 | N | 86.7 | Confident | 83 | Confident | 85 Ų | 85 | 90 Ų | 90 | 46% | 0.455 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.4 | -42.4 | 176.5 | -70.3 | -26.1 | 0 | 0 | 0 | 111.7 | G115 D116 N117 Q122 L123 | G115-N119 VanDerWaalsContact O-CG 3.32Å; G115-N119 PolarHBondContact O-N 3.41Å; G115-N119 PolarHBondContact O-ND2 2.99Å; D116-N119 PolarHBondContact O-N 2.92Å; N117-N119 PolarHBondContact O-N 2.82Å; N119-Q122 PolarHBondContact O-N 2.89Å; N119-L123 WeakPolarHBondContact O-CG 3.49Å; N119-L123 PolarHBondContact O-N 3.43Å |
| 120 | I | 83.4 | Confident | 83.5 | Confident | 86 Ų | 86 | 90.8 Ų | 90.8 | 44% | 0.441 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.8 | -46.1 | 175.8 | -69.3 | 165.2 | 0 | 0 | 0 | 110.5 | D116 N117 Q122 L123 Q124 | D116-I120 VanDerWaalsContact O-CG1 3.3Å; D116-I120 WeakPolarHBondContact O-CG1 3.4Å; D116-I120 PolarHBondContact O-N 3.11Å; N117-I120 PolarHBondContact O-N 3.45Å; I120-Q122 VanDerWaalsContact C-N 3.33Å; I120-Q122 PolarHBondContact O-N 2.86Å; I120-L123 PolarHBondContact O-N 3.38Å; I120-Q124 HydrophobicContact CG2-CG 4.45Å; I120-Q124 WeakPolarHBondContact O-CG 2.87Å; I120-Q124 PolarHBondContact O-N 3.28Å |
| 121 | S | 85.7 | Confident | 83.9 | Confident | 68 Ų | 68 | 87.8 Ų | 87.8 | 48% | 0.476 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.3 | -40 | 177.2 | -64.3 | 0 | 0 | 0 | 0 | 112.5 | N117 N118 Q124 H125 | N117-S121 PolarHBondContact O-N 3.48Å; N117-S121 PolarHBondContact O-OG 2.96Å; N118-S121 PolarHBondContact O-N 3.16Å; S121-Q124 PolarHBondContact O-N 3.25Å; S121-H125 PolarHBondContact O-N 2.81Å |
| 122 | Q | 87.7 | Confident | 84.2 | Confident | 133 Ų | 133 | 89.4 Ų | 89.4 | 62% | 0.621 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -64.9 | -42.7 | 175.6 | -72.9 | -180 | 10.7 | 0 | 0 | 112.3 | N118 N119 I120 H125 S126 | N118-Q122 WeakPolarHBondContact O-CG 3.32Å; N118-Q122 PolarHBondContact O-N 3.39Å; N119-Q122 PolarHBondContact O-N 2.89Å; I120-Q122 VanDerWaalsContact C-N 3.33Å; I120-Q122 PolarHBondContact O-N 2.86Å; Q122-H125 PolarHBondContact O-N 3.05Å; Q122-S126 PolarHBondContact O-N 3.35Å |
| 123 | L | 87.9 | Confident | 84.7 | Confident | 110 Ų | 110 | 93 Ų | 93 | 58% | 0.576 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -64.2 | -41 | 176.5 | -73 | 173.4 | 0 | 0 | 0 | 112 | N119 I120 H125 S126 N127 | N119-L123 WeakPolarHBondContact O-CG 3.49Å; N119-L123 PolarHBondContact O-N 3.43Å; I120-L123 PolarHBondContact O-N 3.38Å; L123-H125 VanDerWaalsContact C-N 3.32Å; L123-H125 PolarHBondContact O-N 3.28Å; L123-S126 PolarHBondContact O-N 3.36Å; L123-N127 WeakPolarHBondContact O-CB 3.41Å; L123-N127 VanDerWaalsContact O-CG 3.28Å; L123-N127 PolarHBondContact O-N 3.38Å |
| 124 | Q | 86 | Confident | 85.2 | Confident | 126 Ų | 126 | 93 Ų | 93 | 59% | 0.589 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -61.1 | -42.7 | 174.5 | -75.4 | 179 | -25.1 | 0 | 0 | 111.6 | I120 S121 N127 S128 | I120-Q124 HydrophobicContact CG2-CG 4.45Å; I120-Q124 WeakPolarHBondContact O-CG 2.87Å; I120-Q124 PolarHBondContact O-N 3.28Å; S121-Q124 PolarHBondContact O-N 3.25Å; Q124-N127 PolarHBondContact O-N 2.77Å; Q124-S128 PolarHBondContact O-N 3.24Å |
| 125 | H | 87.5 | Confident | 85.8 | Confident | 135 Ų | 135 | 93 Ų | 93 | 63% | 0.625 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63.6 | -46.3 | 176.7 | -170.6 | 56.3 | 0 | 0 | 0 | 111.9 | S121 Q122 L123 N127 S128 T129 | S121-H125 PolarHBondContact O-N 2.81Å; Q122-H125 PolarHBondContact O-N 3.05Å; L123-H125 VanDerWaalsContact C-N 3.32Å; L123-H125 PolarHBondContact O-N 3.28Å; H125-N127 PolarHBondContact O-N 3Å; H125-S128 WeakPolarHBondContact O-CB 3.48Å; H125-S128 PolarHBondContact O-N 3.25Å; H125-T129 PolarHBondContact O-N 3.48Å; H125-T129 PolarHBondContact O-OG1 3.27Å |
| 126 | S | 84.9 | Confident | 86.1 | Confident | 58 Ų | 58 | 97.7 Ų | 97.7 | 41% | 0.406 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -58.1 | -46.1 | 176.2 | -168.4 | 0 | 0 | 0 | 0 | 111.9 | Q122 L123 S128 T129 D130 | Q122-S126 PolarHBondContact O-N 3.35Å; L123-S126 PolarHBondContact O-N 3.36Å; S126-S128 VanDerWaalsContact C-N 3.31Å; S126-S128 PolarHBondContact O-N 3.1Å; S126-T129 PolarHBondContact O-N 3.2Å; S126-D130 PolarHBondContact O-N 3.33Å |
| 127 | N | 83.3 | Confident | 86.4 | Confident | 106 Ų | 106 | 97.5 Ų | 97.5 | 57% | 0.567 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -63.6 | -36.5 | 178.5 | -73.2 | -13 | 0 | 0 | 0 | 112.3 | L123 Q124 H125 D130 S131 | L123-N127 WeakPolarHBondContact O-CB 3.41Å; L123-N127 VanDerWaalsContact O-CG 3.28Å; L123-N127 PolarHBondContact O-N 3.38Å; Q124-N127 PolarHBondContact O-N 2.77Å; H125-N127 PolarHBondContact O-N 3Å; N127-D130 PolarHBondContact O-N 3.04Å; N127-S131 WeakPolarHBondContact O-CB 3.43Å; N127-S131 PolarHBondContact O-N 3.03Å |
| 128 | S | 86.3 | Confident | 86.9 | Confident | 60 Ų | 60 | 96.3 Ų | 96.3 | 42% | 0.42 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.6 | -48 | 174.5 | -166.9 | 0 | 0 | 0 | 0 | 111 | Q124 H125 S126 D130 S131 E132 | Q124-S128 PolarHBondContact O-N 3.24Å; H125-S128 WeakPolarHBondContact O-CB 3.48Å; H125-S128 PolarHBondContact O-N 3.25Å; S126-S128 VanDerWaalsContact C-N 3.31Å; S126-S128 PolarHBondContact O-N 3.1Å; S128-D130 VanDerWaalsContact C-N 3.33Å; S128-D130 PolarHBondContact O-N 3.35Å; S128-S131 WeakPolarHBondContact O-CB 3.49Å; S128-S131 PolarHBondContact O-N 3.45Å; S128-E132 WeakPolarHBondContact O-CG 3.29Å; S128-E132 PolarHBondContact O-N 3.43Å |
| 129 | T | 88.9 | Confident | 87.2 | Confident | 44 Ų | 44 | 94.8 Ų | 94.8 | 27% | 0.27 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.4 | -41.8 | 177.3 | -58.4 | 0 | 0 | 0 | 0 | 111.7 | H125 S126 S131 E132 R133 | H125-T129 PolarHBondContact O-N 3.48Å; H125-T129 PolarHBondContact O-OG1 3.27Å; S126-T129 PolarHBondContact O-N 3.2Å; T129-S131 VanDerWaalsContact C-N 3.33Å; T129-S131 PolarHBondContact O-N 2.89Å; T129-E132 PolarHBondContact O-N 3.19Å; T129-R133 VanDerWaalsContact O-CG 3.31Å; T129-R133 WeakPolarHBondContact O-CG 3.33Å; T129-R133 PolarHBondContact O-N 3Å |
| 130 | D | 87.5 | Confident | 87.4 | Confident | 84 Ų | 84 | 94 Ų | 94 | 45% | 0.449 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.7 | -38.8 | 176.9 | -73.8 | -22.9 | 0 | 0 | 0 | 111.9 | S126 N127 S128 R133 V134 | S126-D130 PolarHBondContact O-N 3.33Å; N127-D130 PolarHBondContact O-N 3.04Å; S128-D130 VanDerWaalsContact C-N 3.33Å; S128-D130 PolarHBondContact O-N 3.35Å; D130-R133 PolarHBondContact O-N 3.25Å; D130-V134 WeakPolarHBondContact O-CG2 3.46Å; D130-V134 PolarHBondContact O-N 2.89Å |
| 131 | S | 83.6 | Confident | 87.6 | Confident | 62 Ų | 62 | 94.1 Ų | 94.1 | 43% | 0.434 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.2 | -46.2 | 174.5 | -165.5 | 0 | 0 | 0 | 0 | 111.7 | N127 S128 T129 R133 V134 E135 | N127-S131 WeakPolarHBondContact O-CB 3.43Å; N127-S131 PolarHBondContact O-N 3.03Å; S128-S131 WeakPolarHBondContact O-CB 3.49Å; S128-S131 PolarHBondContact O-N 3.45Å; T129-S131 VanDerWaalsContact C-N 3.33Å; T129-S131 PolarHBondContact O-N 2.89Å; S131-R133 VanDerWaalsContact C-N 3.32Å; S131-R133 PolarHBondContact O-N 3.45Å; S131-V134 PolarHBondContact O-N 3.38Å; S131-E135 PolarHBondContact O-N 3.41Å |
| 132 | E | 89.2 | Confident | 87.8 | Confident | 118 Ų | 118 | 96.7 Ų | 96.7 | 55% | 0.551 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -59.3 | -42 | 176.3 | -72.4 | 170.9 | -165 | 0 | 0 | 111.7 | S128 T129 V134 E135 E136 | S128-E132 WeakPolarHBondContact O-CG 3.29Å; S128-E132 PolarHBondContact O-N 3.43Å; T129-E132 PolarHBondContact O-N 3.19Å; E132-V134 VanDerWaalsContact C-N 3.33Å; E132-V134 PolarHBondContact O-N 3.23Å; E132-E135 PolarHBondContact O-N 3.49Å; E132-E136 PolarHBondContact O-N 3.02Å |
| 133 | R | 88.2 | Confident | 87.9 | Confident | 155 Ų | 155 | 96.9 Ų | 96.9 | 59% | 0.585 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -64.8 | -36.6 | 176.9 | -68.7 | 179.4 | 106 | 78.2 | 9.6 | 112.7 | T129 D130 S131 T137 | T129-R133 VanDerWaalsContact O-CG 3.31Å; T129-R133 WeakPolarHBondContact O-CG 3.33Å; T129-R133 PolarHBondContact O-N 3Å; D130-R133 PolarHBondContact O-N 3.25Å; S131-R133 VanDerWaalsContact C-N 3.32Å; S131-R133 PolarHBondContact O-N 3.45Å; R133-T137 WeakPolarHBondContact O-CB 3.42Å; R133-T137 PolarHBondContact O-N 2.99Å; R133-T137 PolarHBondContact O-OG1 2.98Å |
| 134 | V | 87.6 | Confident | 87.9 | Confident | 91 Ų | 91 | 96.1 Ų | 96.1 | 55% | 0.552 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -66.5 | -44.6 | 175.4 | 170.2 | 0 | 0 | 0 | 0 | 110.2 | D130 S131 E132 E136 T137 V138 | D130-V134 WeakPolarHBondContact O-CG2 3.46Å; D130-V134 PolarHBondContact O-N 2.89Å; S131-V134 PolarHBondContact O-N 3.38Å; E132-V134 VanDerWaalsContact C-N 3.33Å; E132-V134 PolarHBondContact O-N 3.23Å; V134-E136 PolarHBondContact O-N 2.85Å; V134-T137 PolarHBondContact O-N 3.46Å; V134-V138 HydrophobicContact CG1-CG2 4.37Å; V134-V138 WeakPolarHBondContact O-CB 3.3Å; V134-V138 VanDerWaalsContact O-CG2 3.31Å; V134-V138 WeakPolarHBondContact O-CG2 3.42Å; V134-V138 PolarHBondContact O-N 3.44Å |
| 135 | E | 90.5 | Very high | 87.9 | Confident | 127 Ų | 127 | 94.2 Ų | 94.2 | 59% | 0.593 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -61.2 | -42.4 | 176.4 | -72.8 | -178 | -176.8 | 0 | 0 | 112.4 | S131 E132 V138 S139 | S131-E135 PolarHBondContact O-N 3.41Å; E132-E135 PolarHBondContact O-N 3.49Å; E135-V138 PolarHBondContact O-N 3.44Å; E135-S139 WeakPolarHBondContact O-CB 3.46Å; E135-S139 PolarHBondContact O-N 2.89Å; E135-S139 PolarHBondContact O-OG 3.19Å |
| 136 | E | 90 | Very high | 88 | Confident | 127 Ų | 127 | 92.2 Ų | 92.2 | 59% | 0.593 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -60.8 | -47.1 | 174.1 | -173.8 | 179.6 | -166.4 | 0 | 0 | 111 | E132 V134 V138 S139 V140 | E132-E136 PolarHBondContact O-N 3.02Å; V134-E136 PolarHBondContact O-N 2.85Å; E136-V138 VanDerWaalsContact C-N 3.35Å; E136-V138 PolarHBondContact O-N 3.5Å; E136-S139 WeakPolarHBondContact O-CB 3.45Å; E136-S139 PolarHBondContact O-N 3.38Å; E136-V140 WeakPolarHBondContact O-CG2 3.43Å; E136-V140 PolarHBondContact O-N 3Å |
| 137 | T | 88.3 | Confident | 88.3 | Confident | 81 Ų | 81 | 92 Ų | 92 | 50% | 0.497 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.1 | -43.3 | 178.7 | -58.9 | 0 | 0 | 0 | 0 | 111.8 | R133 V134 S139 V140 I141 | R133-T137 WeakPolarHBondContact O-CB 3.42Å; R133-T137 PolarHBondContact O-N 2.99Å; R133-T137 PolarHBondContact O-OG1 2.98Å; V134-T137 PolarHBondContact O-N 3.46Å; T137-S139 VanDerWaalsContact C-N 3.32Å; T137-S139 PolarHBondContact O-N 3.2Å; T137-V140 PolarHBondContact O-N 2.84Å; T137-I141 HydrophobicContact CG2-CD1 4Å; T137-I141 VanDerWaalsContact O-CG1 3.28Å; T137-I141 WeakPolarHBondContact O-CG1 3.41Å; T137-I141 PolarHBondContact O-N 3.25Å |
| 138 | V | 87.9 | Confident | 88.5 | Confident | 65 Ų | 65 | 90.9 Ų | 90.9 | 39% | 0.394 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -63.8 | -40.5 | 177.3 | 166.7 | 0 | 0 | 0 | 0 | 110.7 | V134 E135 E136 I141 M142 | V134-V138 HydrophobicContact CG1-CG2 4.37Å; V134-V138 WeakPolarHBondContact O-CB 3.3Å; V134-V138 VanDerWaalsContact O-CG2 3.31Å; V134-V138 WeakPolarHBondContact O-CG2 3.42Å; V134-V138 PolarHBondContact O-N 3.44Å; E135-V138 PolarHBondContact O-N 3.44Å; E136-V138 VanDerWaalsContact C-N 3.35Å; E136-V138 PolarHBondContact O-N 3.5Å; V138-I141 PolarHBondContact O-N 3.48Å; V138-M142 HydrophobicContact CG1-CE 3.44Å; V138-M142 VanDerWaalsContact CG1-CE 3.44Å; V138-M142 WeakPolarHBondContact O-CG 3.34Å; V138-M142 PolarHBondContact O-N 3Å |
| 139 | S | 90.6 | Very high | 88.6 | Confident | 69 Ų | 69 | 91.1 Ų | 91.1 | 48% | 0.483 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -61.9 | -46.3 | 176.8 | -60.1 | 0 | 0 | 0 | 0 | 111.7 | E135 E136 T137 I141 M142 E143 | E135-S139 WeakPolarHBondContact O-CB 3.46Å; E135-S139 PolarHBondContact O-N 2.89Å; E135-S139 PolarHBondContact O-OG 3.19Å; E136-S139 WeakPolarHBondContact O-CB 3.45Å; E136-S139 PolarHBondContact O-N 3.38Å; T137-S139 VanDerWaalsContact C-N 3.32Å; T137-S139 PolarHBondContact O-N 3.2Å; S139-I141 VanDerWaalsContact C-N 3.35Å; S139-I141 PolarHBondContact O-N 3.43Å; S139-M142 PolarHBondContact O-N 2.95Å; S139-E143 PolarHBondContact O-N 2.99Å |
| 140 | V | 89.8 | Confident | 88.7 | Confident | 70 Ų | 70 | 94.8 Ų | 94.8 | 42% | 0.424 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.4 | -43.6 | 175.6 | 172.8 | 0 | 0 | 0 | 0 | 111.4 | E136 T137 M142 E143 D144 | E136-V140 WeakPolarHBondContact O-CG2 3.43Å; E136-V140 PolarHBondContact O-N 3Å; T137-V140 PolarHBondContact O-N 2.84Å; V140-M142 VanDerWaalsContact C-N 3.3Å; V140-M142 PolarHBondContact O-N 2.99Å; V140-E143 PolarHBondContact O-N 3.3Å; V140-D144 WeakPolarHBondContact O-CB 3.27Å; V140-D144 PolarHBondContact O-N 3.46Å |
| 141 | I | 87.9 | Confident | 88.8 | Confident | 87 Ų | 87 | 96 Ų | 96 | 45% | 0.446 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.9 | -38.9 | 177.3 | -70.2 | 166.6 | 0 | 0 | 0 | 111.4 | T137 V138 S139 N145 | T137-I141 HydrophobicContact CG2-CD1 4Å; T137-I141 VanDerWaalsContact O-CG1 3.28Å; T137-I141 WeakPolarHBondContact O-CG1 3.41Å; T137-I141 PolarHBondContact O-N 3.25Å; V138-I141 PolarHBondContact O-N 3.48Å; S139-I141 VanDerWaalsContact C-N 3.35Å; S139-I141 PolarHBondContact O-N 3.43Å; I141-N145 WeakPolarHBondContact O-CB 3.48Å; I141-N145 VanDerWaalsContact O-CG 3.3Å; I141-N145 PolarHBondContact O-N 3.33Å; I141-N145 PolarHBondContact O-ND2 3.21Å |
| 142 | M | 89.1 | Confident | 89 | Confident | 122 Ų | 122 | 98.5 Ų | 98.5 | 60% | 0.601 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -65.7 | -42.9 | 176.6 | -74.3 | -162 | -113.5 | 0 | 0 | 111.8 | V138 S139 V140 N145 N146 | V138-M142 HydrophobicContact CG1-CE 3.44Å; V138-M142 VanDerWaalsContact CG1-CE 3.44Å; V138-M142 WeakPolarHBondContact O-CG 3.34Å; V138-M142 PolarHBondContact O-N 3Å; S139-M142 PolarHBondContact O-N 2.95Å; V140-M142 VanDerWaalsContact C-N 3.3Å; V140-M142 PolarHBondContact O-N 2.99Å; M142-N145 PolarHBondContact O-N 3.06Å; M142-N146 PolarHBondContact O-N 3.45Å |
| 143 | E | 90.6 | Very high | 88.9 | Confident | 137 Ų | 137 | 99.1 Ų | 99.1 | 64% | 0.64 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -63.1 | -44.1 | 176.8 | -172.4 | 174.2 | -171.8 | 0 | 0 | 112.1 | S139 V140 N145 N146 S147 | S139-E143 PolarHBondContact O-N 2.99Å; V140-E143 PolarHBondContact O-N 3.3Å; E143-N145 PolarHBondContact O-N 2.77Å; E143-N146 PolarHBondContact O-N 3.24Å; E143-S147 PolarHBondContact O-N 3.39Å; E143-S147 PolarHBondContact O-OG 3.03Å |
| 144 | D | 88.9 | Confident | 88.9 | Confident | 94 Ų | 94 | 94.5 Ų | 94.5 | 50% | 0.503 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.4 | -44.3 | 175 | -85.6 | -10.6 | 0 | 0 | 0 | 111.7 | V140 N146 S147 I148 | V140-D144 WeakPolarHBondContact O-CB 3.27Å; V140-D144 PolarHBondContact O-N 3.46Å; D144-N146 VanDerWaalsContact C-N 3.34Å; D144-N146 PolarHBondContact O-N 3.02Å; D144-S147 PolarHBondContact O-N 2.92Å; D144-I148 VanDerWaalsContact O-CG1 3.26Å; D144-I148 WeakPolarHBondContact O-CG1 3.41Å; D144-I148 PolarHBondContact O-N 2.97Å |
| 145 | N | 86 | Confident | 88.9 | Confident | 87 Ų | 87 | 95.2 Ų | 95.2 | 47% | 0.465 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.1 | -37.5 | 177.9 | -79.6 | -31.7 | 0 | 0 | 0 | 112.4 | I141 M142 E143 I148 S149 | I141-N145 WeakPolarHBondContact O-CB 3.48Å; I141-N145 VanDerWaalsContact O-CG 3.3Å; I141-N145 PolarHBondContact O-N 3.33Å; I141-N145 PolarHBondContact O-ND2 3.21Å; M142-N145 PolarHBondContact O-N 3.06Å; E143-N145 PolarHBondContact O-N 2.77Å; N145-I148 PolarHBondContact O-N 3.25Å; N145-S149 WeakPolarHBondContact O-CB 3.37Å; N145-S149 PolarHBondContact O-N 3.18Å; N145-S149 PolarHBondContact O-OG 3.43Å |
| 146 | N | 89.5 | Confident | 88.7 | Confident | 93 Ų | 93 | 92.1 Ų | 92.1 | 50% | 0.497 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.5 | -46.1 | 174.6 | -170.4 | 21.1 | 0 | 0 | 0 | 110.5 | M142 E143 D144 I148 S149 Q150 | M142-N146 PolarHBondContact O-N 3.45Å; E143-N146 PolarHBondContact O-N 3.24Å; D144-N146 VanDerWaalsContact C-N 3.34Å; D144-N146 PolarHBondContact O-N 3.02Å; N146-I148 PolarHBondContact O-N 3.04Å; N146-S149 WeakPolarHBondContact O-CB 3.4Å; N146-S149 PolarHBondContact O-N 2.93Å; N146-S149 VanDerWaalsContact O-N 3.11Å; N146-Q150 WeakPolarHBondContact O-CG 3.41Å; N146-Q150 PolarHBondContact O-N 3.5Å |
| 147 | S | 89.9 | Confident | 88.7 | Confident | 52 Ų | 52 | 88.2 Ų | 88.2 | 36% | 0.364 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -59.6 | -43.7 | 176.3 | -62.1 | 0 | 0 | 0 | 0 | 112.2 | E143 D144 S149 Q150 L151 | E143-S147 PolarHBondContact O-N 3.39Å; E143-S147 PolarHBondContact O-OG 3.03Å; D144-S147 PolarHBondContact O-N 2.92Å; S147-S149 VanDerWaalsContact C-N 3.33Å; S147-S149 PolarHBondContact O-N 3.48Å; S147-Q150 PolarHBondContact O-N 3.29Å; S147-L151 WeakPolarHBondContact O-CG 3.45Å; S147-L151 PolarHBondContact O-N 3.03Å |
| 148 | I | 88.4 | Confident | 88.8 | Confident | 83 Ų | 83 | 88 Ų | 88 | 43% | 0.426 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -61 | -42.7 | 174.5 | -70.5 | 165.5 | 0 | 0 | 0 | 111.1 | D144 N145 N146 L151 Q152 | D144-I148 VanDerWaalsContact O-CG1 3.26Å; D144-I148 WeakPolarHBondContact O-CG1 3.41Å; D144-I148 PolarHBondContact O-N 2.97Å; N145-I148 PolarHBondContact O-N 3.25Å; N146-I148 PolarHBondContact O-N 3.04Å; I148-L151 PolarHBondContact O-N 3.39Å; I148-Q152 HydrophobicContact CG2-CG 4.47Å; I148-Q152 WeakPolarHBondContact O-CG 3.27Å; I148-Q152 PolarHBondContact O-N 2.91Å |
| 149 | S | 88.8 | Confident | 88.8 | Confident | 66 Ų | 66 | 89.3 Ų | 89.3 | 46% | 0.462 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -64.3 | -41.8 | 179.6 | -59.2 | 0 | 0 | 0 | 0 | 111.6 | N145 N146 S147 Q152 H153 | N145-S149 WeakPolarHBondContact O-CB 3.37Å; N145-S149 PolarHBondContact O-N 3.18Å; N145-S149 PolarHBondContact O-OG 3.43Å; N146-S149 WeakPolarHBondContact O-CB 3.4Å; N146-S149 PolarHBondContact O-N 2.93Å; N146-S149 VanDerWaalsContact O-N 3.11Å; S147-S149 VanDerWaalsContact C-N 3.33Å; S147-S149 PolarHBondContact O-N 3.48Å; S149-Q152 PolarHBondContact O-N 3.4Å; S149-H153 PolarHBondContact O-N 3.2Å |
| 150 | Q | 89.8 | Confident | 88.8 | Confident | 120 Ų | 120 | 90.2 Ų | 90.2 | 56% | 0.561 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -62.8 | -44.4 | 174.9 | -70.1 | 179.3 | 5.7 | 0 | 0 | 112.1 | N146 S147 Q152 H153 S154 | N146-Q150 WeakPolarHBondContact O-CG 3.41Å; N146-Q150 PolarHBondContact O-N 3.5Å; S147-Q150 PolarHBondContact O-N 3.29Å; Q150-Q152 VanDerWaalsContact C-N 3.34Å; Q150-Q152 PolarHBondContact O-N 2.93Å; Q150-H153 WeakPolarHBondContact O-CB 3.25Å; Q150-H153 PolarHBondContact O-N 3.39Å; Q150-S154 PolarHBondContact O-N 2.86Å |
| 151 | L | 89.3 | Confident | 88.6 | Confident | 109 Ų | 109 | 93.8 Ų | 93.8 | 57% | 0.571 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -62.5 | -40.1 | 175.8 | -73.4 | 173.5 | 0 | 0 | 0 | 112.2 | S147 I148 H153 S154 N155 | S147-L151 WeakPolarHBondContact O-CG 3.45Å; S147-L151 PolarHBondContact O-N 3.03Å; I148-L151 PolarHBondContact O-N 3.39Å; L151-H153 VanDerWaalsContact C-N 3.33Å; L151-S154 PolarHBondContact O-N 3.45Å; L151-N155 WeakPolarHBondContact O-CB 3.38Å; L151-N155 VanDerWaalsContact O-CG 3.24Å; L151-N155 PolarHBondContact O-N 3.29Å; L151-N155 PolarHBondContact O-ND2 2.97Å |
| 152 | Q | 87.9 | Confident | 88.7 | Confident | 115 Ų | 115 | 93.7 Ų | 93.7 | 54% | 0.537 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.1 | -41 | 174.9 | -75.6 | 178.5 | 1 | 0 | 0 | 111.8 | I148 S149 Q150 S156 | I148-Q152 HydrophobicContact CG2-CG 4.47Å; I148-Q152 WeakPolarHBondContact O-CG 3.27Å; I148-Q152 PolarHBondContact O-N 2.91Å; S149-Q152 PolarHBondContact O-N 3.4Å; Q150-Q152 VanDerWaalsContact C-N 3.34Å; Q150-Q152 PolarHBondContact O-N 2.93Å; Q152-S156 WeakPolarHBondContact O-CB 3.48Å; Q152-S156 PolarHBondContact O-N 3.29Å |
| 153 | H | 88.7 | Confident | 88.6 | Confident | 132 Ų | 132 | 93.4 Ų | 93.4 | 61% | 0.611 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -63.4 | -47.8 | 175.7 | -171.4 | 69.7 | 0 | 0 | 0 | 111.7 | S149 Q150 L151 N155 S156 T157 | S149-H153 PolarHBondContact O-N 3.2Å; Q150-H153 WeakPolarHBondContact O-CB 3.25Å; Q150-H153 PolarHBondContact O-N 3.39Å; L151-H153 VanDerWaalsContact C-N 3.33Å; H153-N155 PolarHBondContact O-N 3.43Å; H153-S156 WeakPolarHBondContact O-CB 3.42Å; H153-S156 PolarHBondContact O-N 3.28Å; H153-T157 PolarHBondContact O-N 3.44Å; H153-T157 PolarHBondContact O-OG1 3.38Å |
| 154 | S | 87.2 | Confident | 88.6 | Confident | 58 Ų | 58 | 93.3 Ų | 93.3 | 41% | 0.406 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -57.1 | -48.8 | 176.2 | -167.6 | 0 | 0 | 0 | 0 | 111.8 | Q150 L151 S156 T157 D158 | Q150-S154 PolarHBondContact O-N 2.86Å; L151-S154 PolarHBondContact O-N 3.45Å; S154-S156 VanDerWaalsContact C-N 3.29Å; S154-S156 PolarHBondContact O-N 3.45Å; S154-T157 PolarHBondContact O-N 3.25Å; S154-T157 VanDerWaalsContact O-N 3.17Å; S154-D158 PolarHBondContact O-N 3.02Å |
| 155 | N | 86.9 | Confident | 88.5 | Confident | 105 Ų | 105 | 92.7 Ų | 92.7 | 56% | 0.561 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -61.8 | -36.7 | 178.9 | -73.5 | -23.8 | 0 | 0 | 0 | 112.5 | L151 H153 F159 | L151-N155 WeakPolarHBondContact O-CB 3.38Å; L151-N155 VanDerWaalsContact O-CG 3.24Å; L151-N155 PolarHBondContact O-N 3.29Å; L151-N155 PolarHBondContact O-ND2 2.97Å; H153-N155 PolarHBondContact O-N 3.43Å; N155-F159 VanDerWaalsContact O-CB 3.28Å; N155-F159 WeakPolarHBondContact O-CB 3.43Å; N155-F159 PolarHBondContact O-N 3.01Å |
| 156 | S | 88 | Confident | 88.5 | Confident | 62 Ų | 62 | 92.2 Ų | 92.2 | 43% | 0.434 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -65.1 | -44.2 | 175.5 | -171.7 | 0 | 0 | 0 | 0 | 111.4 | Q152 H153 S154 F159 N160 | Q152-S156 WeakPolarHBondContact O-CB 3.48Å; Q152-S156 PolarHBondContact O-N 3.29Å; H153-S156 WeakPolarHBondContact O-CB 3.42Å; H153-S156 PolarHBondContact O-N 3.28Å; S154-S156 VanDerWaalsContact C-N 3.29Å; S154-S156 PolarHBondContact O-N 3.45Å; S156-F159 PolarHBondContact O-N 3.27Å; S156-N160 PolarHBondContact O-N 2.99Å; S156-N160 PolarHBondContact O-ND2 3.42Å |
| 157 | T | 90.1 | Very high | 88.4 | Confident | 46 Ų | 46 | 91.4 Ų | 91.4 | 28% | 0.282 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -62.4 | -44.7 | 175.9 | -62.4 | 0 | 0 | 0 | 0 | 111.4 | H153 S154 F159 N160 R161 | H153-T157 PolarHBondContact O-N 3.44Å; H153-T157 PolarHBondContact O-OG1 3.38Å; S154-T157 PolarHBondContact O-N 3.25Å; S154-T157 VanDerWaalsContact O-N 3.17Å; T157-F159 VanDerWaalsContact C-N 3.34Å; T157-F159 PolarHBondContact O-N 3.34Å; T157-N160 PolarHBondContact O-N 2.79Å; T157-R161 PolarHBondContact O-N 3.11Å |
| 158 | D | 88.9 | Confident | 88.3 | Confident | 75 Ų | 75 | 92.4 Ų | 92.4 | 40% | 0.401 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -65.8 | -38.2 | 178.4 | -68 | -23.8 | 0 | 0 | 0 | 112 | S154 N160 R161 M162 | S154-D158 PolarHBondContact O-N 3.02Å; D158-N160 PolarHBondContact O-N 3Å; D158-R161 PolarHBondContact O-N 2.94Å; D158-R161 IonicContact OD1-NH1 3.38Å; D158-R161 PolarHBondContact OD1-NH1 3.45Å; D158-M162 WeakPolarHBondContact O-CB 3.3Å; D158-M162 PolarHBondContact O-N 3.11Å |
| 159 | F | 88.8 | Confident | 88.1 | Confident | 93 Ų | 93 | 92.5 Ų | 92.5 | 41% | 0.408 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.7 | -40.3 | 173.5 | -177.2 | -107 | 0 | 0 | 0 | 112.6 | N155 S156 T157 M162 K163 | N155-F159 VanDerWaalsContact O-CB 3.28Å; N155-F159 WeakPolarHBondContact O-CB 3.43Å; N155-F159 PolarHBondContact O-N 3.01Å; S156-F159 PolarHBondContact O-N 3.27Å; T157-F159 VanDerWaalsContact C-N 3.34Å; T157-F159 PolarHBondContact O-N 3.34Å; F159-M162 HydrophobicContact CD2-CE 3.59Å; F159-M162 HydrophobicContact CE2-CE 3.91Å; F159-M162 PolarHBondContact O-N 2.89Å; F159-K163 HydrophobicContact CD1-CD 4.36Å; F159-K163 HydrophobicContact CE1-CD 3.95Å; F159-K163 HydrophobicContact CE1-CG 4.46Å; F159-K163 HydrophobicContact CZ-CD 4.39Å; F159-K163 VanDerWaalsContact CZ-CE 3.46Å; F159-K163 PolarHBondContact O-N 2.89Å |
| 160 | N | 89.7 | Confident | 87.8 | Confident | 88 Ų | 88 | 94.5 Ų | 94.5 | 47% | 0.471 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -66.6 | -42.5 | 176 | -72.1 | -26.4 | 0 | 0 | 0 | 112 | S156 T157 D158 M162 K163 E164 | S156-N160 PolarHBondContact O-N 2.99Å; S156-N160 PolarHBondContact O-ND2 3.42Å; T157-N160 PolarHBondContact O-N 2.79Å; D158-N160 PolarHBondContact O-N 3Å; N160-M162 VanDerWaalsContact C-N 3.31Å; N160-M162 PolarHBondContact O-N 2.96Å; N160-K163 WeakPolarHBondContact O-CB 3.47Å; N160-K163 PolarHBondContact O-N 2.95Å; N160-E164 PolarHBondContact O-N 3.28Å |
| 161 | R | 87.4 | Confident | 87.5 | Confident | 146 Ų | 146 | 94.7 Ų | 94.7 | 55% | 0.551 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -60.2 | -41.4 | 173.3 | -73.5 | 179.8 | 179.4 | 134.9 | -3.3 | 112.2 | T157 D158 E164 T165 | T157-R161 PolarHBondContact O-N 3.11Å; D158-R161 PolarHBondContact O-N 2.94Å; D158-R161 IonicContact OD1-NH1 3.38Å; D158-R161 PolarHBondContact OD1-NH1 3.45Å; R161-E164 PolarHBondContact O-N 3.4Å; R161-T165 WeakPolarHBondContact O-CB 3.4Å; R161-T165 PolarHBondContact O-N 3.4Å; R161-T165 PolarHBondContact O-OG1 3.34Å |
| 162 | M | 88.6 | Confident | 87.1 | Confident | 84 Ų | 84 | 93.4 Ų | 93.4 | 41% | 0.414 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -62.8 | -43.8 | 176.5 | -176.6 | 178.3 | 63.7 | 0 | 0 | 111.1 | D158 F159 N160 E164 T165 V166 | D158-M162 WeakPolarHBondContact O-CB 3.3Å; D158-M162 PolarHBondContact O-N 3.11Å; F159-M162 HydrophobicContact CD2-CE 3.59Å; F159-M162 HydrophobicContact CE2-CE 3.91Å; F159-M162 PolarHBondContact O-N 2.89Å; N160-M162 VanDerWaalsContact C-N 3.31Å; N160-M162 PolarHBondContact O-N 2.96Å; M162-E164 PolarHBondContact O-N 3.49Å; M162-T165 PolarHBondContact O-N 3.35Å; M162-V166 WeakPolarHBondContact O-CG2 3.35Å; M162-V166 PolarHBondContact O-N 3.34Å |
| 163 | K | 88.3 | Confident | 86.5 | Confident | 117 Ų | 117 | 91.9 Ų | 91.9 | 51% | 0.509 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -59 | -45.3 | 174.4 | -81.5 | -176.3 | 170.3 | 176.9 | 0 | 112.7 | F159 N160 V166 S167 | F159-K163 HydrophobicContact CD1-CD 4.36Å; F159-K163 HydrophobicContact CE1-CD 3.95Å; F159-K163 HydrophobicContact CE1-CG 4.46Å; F159-K163 HydrophobicContact CZ-CD 4.39Å; F159-K163 VanDerWaalsContact CZ-CE 3.46Å; F159-K163 PolarHBondContact O-N 2.89Å; N160-K163 WeakPolarHBondContact O-CB 3.47Å; N160-K163 PolarHBondContact O-N 2.95Å; K163-V166 PolarHBondContact O-N 2.76Å; K163-S167 PolarHBondContact O-N 3Å |
| 164 | E | 89.6 | Confident | 85.9 | Confident | 134 Ų | 134 | 90.4 Ų | 90.4 | 63% | 0.626 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -61.3 | -46.3 | 177.3 | -174.2 | 176.4 | -167.8 | 0 | 0 | 111.1 | N160 R161 M162 V166 S167 V168 | N160-E164 PolarHBondContact O-N 3.28Å; R161-E164 PolarHBondContact O-N 3.4Å; M162-E164 PolarHBondContact O-N 3.49Å; E164-V166 PolarHBondContact O-N 2.95Å; E164-S167 WeakPolarHBondContact O-CB 3.44Å; E164-S167 PolarHBondContact O-N 3.22Å; E164-S167 VanDerWaalsContact O-N 3.1Å; E164-V168 WeakPolarHBondContact O-CG2 3.41Å; E164-V168 PolarHBondContact O-N 3.49Å |
| 165 | T | 86.4 | Confident | 85.4 | Confident | 82 Ų | 82 | 91.3 Ų | 91.3 | 50% | 0.503 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -58.8 | -45.3 | 176.7 | -53.4 | 0 | 0 | 0 | 0 | 111.7 | R161 M162 S167 V168 I169 | R161-T165 WeakPolarHBondContact O-CB 3.4Å; R161-T165 PolarHBondContact O-N 3.4Å; R161-T165 PolarHBondContact O-OG1 3.34Å; M162-T165 PolarHBondContact O-N 3.35Å; T165-S167 VanDerWaalsContact C-N 3.32Å; T165-S167 PolarHBondContact O-N 2.93Å; T165-V168 PolarHBondContact O-N 2.93Å; T165-I169 HydrophobicContact CG2-CD1 4.03Å; T165-I169 VanDerWaalsContact O-CG1 3.29Å; T165-I169 WeakPolarHBondContact O-CG1 3.26Å; T165-I169 PolarHBondContact O-N 2.89Å |
| 166 | V | 87.3 | Confident | 84.8 | Confident | 77 Ų | 77 | 91.5 Ų | 91.5 | 47% | 0.467 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -62.9 | -39.6 | 176.2 | 170.8 | 0 | 0 | 0 | 0 | 111.1 | M162 K163 E164 I169 M170 | M162-V166 WeakPolarHBondContact O-CG2 3.35Å; M162-V166 PolarHBondContact O-N 3.34Å; K163-V166 PolarHBondContact O-N 2.76Å; E164-V166 PolarHBondContact O-N 2.95Å; V166-I169 PolarHBondContact O-N 3.05Å; V166-M170 HydrophobicContact CG1-CG 4.43Å; V166-M170 VanDerWaalsContact O-CG 3.27Å; V166-M170 WeakPolarHBondContact O-CG 3.4Å; V166-M170 PolarHBondContact O-N 2.98Å |
| 167 | S | 86.4 | Confident | 83.8 | Confident | 76 Ų | 76 | 91.6 Ų | 91.6 | 53% | 0.531 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -62.2 | -44.4 | 176.8 | -165 | 0 | 0 | 0 | 0 | 112 | K163 E164 T165 M170 E171 | K163-S167 PolarHBondContact O-N 3Å; E164-S167 WeakPolarHBondContact O-CB 3.44Å; E164-S167 PolarHBondContact O-N 3.22Å; E164-S167 VanDerWaalsContact O-N 3.1Å; T165-S167 VanDerWaalsContact C-N 3.32Å; T165-S167 PolarHBondContact O-N 2.93Å; S167-M170 PolarHBondContact O-N 3.37Å; S167-E171 PolarHBondContact O-N 2.94Å |
| 168 | V | 86.9 | Confident | 82.6 | Confident | 73 Ų | 73 | 97 Ų | 97 | 44% | 0.442 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.8 | -46.5 | 176.5 | 173.1 | 0 | 0 | 0 | 0 | 110.9 | E164 T165 M170 E171 D172 | E164-V168 WeakPolarHBondContact O-CG2 3.41Å; E164-V168 PolarHBondContact O-N 3.49Å; T165-V168 PolarHBondContact O-N 2.93Å; V168-M170 VanDerWaalsContact C-N 3.28Å; V168-M170 PolarHBondContact O-N 2.93Å; V168-E171 PolarHBondContact O-N 3.4Å; V168-E171 VanDerWaalsContact O-N 3.16Å; V168-D172 PolarHBondContact O-N 3.46Å |
| 169 | I | 84.8 | Confident | 81.1 | Confident | 85 Ų | 85 | 99.8 Ų | 99.8 | 44% | 0.436 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -59.3 | -40.1 | 177.2 | -68 | 166 | 0 | 0 | 0 | 111.4 | T165 V166 N173 | T165-I169 HydrophobicContact CG2-CD1 4.03Å; T165-I169 VanDerWaalsContact O-CG1 3.29Å; T165-I169 WeakPolarHBondContact O-CG1 3.26Å; T165-I169 PolarHBondContact O-N 2.89Å; V166-I169 PolarHBondContact O-N 3.05Å; I169-N173 WeakPolarHBondContact O-CB 3.43Å; I169-N173 PolarHBondContact O-N 3.43Å |
| 170 | M | 82.2 | Confident | 79 | Confident | 107 Ų | 107 | 97.4 Ų | 97.4 | 53% | 0.527 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -66.4 | -40 | 177.5 | -73.9 | -69.5 | -140.6 | 0 | 0 | 112.3 | V166 S167 V168 N174 | V166-M170 HydrophobicContact CG1-CG 4.43Å; V166-M170 VanDerWaalsContact O-CG 3.27Å; V166-M170 WeakPolarHBondContact O-CG 3.4Å; V166-M170 PolarHBondContact O-N 2.98Å; S167-M170 PolarHBondContact O-N 3.37Å; V168-M170 VanDerWaalsContact C-N 3.28Å; V168-M170 PolarHBondContact O-N 2.93Å; M170-N174 WeakPolarHBondContact O-CB 3.12Å; M170-N174 PolarHBondContact O-N 3.1Å |
| 171 | E | 84.1 | Confident | 77 | Confident | 124 Ų | 124 | 98.9 Ų | 98.9 | 58% | 0.579 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -65.8 | -45.2 | 176 | -170.3 | 170.7 | -175.5 | 0 | 0 | 111.5 | S167 V168 N173 N174 N175 | S167-E171 PolarHBondContact O-N 2.94Å; V168-E171 PolarHBondContact O-N 3.4Å; V168-E171 VanDerWaalsContact O-N 3.16Å; E171-N173 PolarHBondContact O-N 3.39Å; E171-N174 PolarHBondContact O-N 3.33Å; E171-N175 VanDerWaalsContact O-CG 3.27Å; E171-N175 PolarHBondContact O-N 3.26Å; E171-N175 PolarHBondContact O-ND2 3.47Å |
| 172 | D | 81.1 | Confident | 75.2 | Confident | 83 Ų | 83 | 97.4 Ų | 97.4 | 44% | 0.444 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -59.6 | -45.2 | 174.9 | -75.4 | -17.3 | 0 | 0 | 0 | 111.6 | V168 N174 N175 I176 | V168-D172 PolarHBondContact O-N 3.46Å; D172-N174 VanDerWaalsContact C-N 3.34Å; D172-N174 PolarHBondContact O-N 3.32Å; D172-N175 PolarHBondContact O-N 3.1Å; D172-I176 VanDerWaalsContact O-CG1 3.25Å; D172-I176 WeakPolarHBondContact O-CG1 2.91Å; D172-I176 PolarHBondContact O-N 3.29Å |
| 173 | N | 75.6 | Confident | 73.2 | Confident | 82 Ų | 82 | 100.8 Ų | 100.8 | 44% | 0.439 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -63.1 | -38.5 | 176.8 | -81.3 | -12.6 | 0 | 0 | 0 | 112.7 | I169 E171 I176 S177 | I169-N173 WeakPolarHBondContact O-CB 3.43Å; I169-N173 PolarHBondContact O-N 3.43Å; E171-N173 PolarHBondContact O-N 3.39Å; N173-I176 PolarHBondContact O-N 3.2Å; N173-S177 WeakPolarHBondContact O-CB 3.25Å; N173-S177 PolarHBondContact O-N 2.99Å; N173-S177 PolarHBondContact O-OG 2.89Å |
| 174 | N | 75.8 | Confident | 71.1 | Confident | 102 Ų | 102 | 100.1 Ų | 100.1 | 55% | 0.545 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -66 | -42.3 | 174.8 | -81.9 | -22.2 | 0 | 0 | 0 | 111.4 | M170 E171 D172 S177 Q178 | M170-N174 WeakPolarHBondContact O-CB 3.12Å; M170-N174 PolarHBondContact O-N 3.1Å; E171-N174 PolarHBondContact O-N 3.33Å; D172-N174 VanDerWaalsContact C-N 3.34Å; D172-N174 PolarHBondContact O-N 3.32Å; N174-S177 PolarHBondContact O-N 2.82Å; N174-Q178 WeakPolarHBondContact O-CG 3.41Å; N174-Q178 PolarHBondContact O-N 3.02Å |
| 175 | N | 77.5 | Confident | 68.9 | Low | 77 Ų | 77 | 98.4 Ų | 98.4 | 41% | 0.412 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -62.6 | -43.2 | 175.9 | -70.1 | -25.9 | 0 | 0 | 0 | 111.3 | E171 D172 S177 Q178 L179 | E171-N175 VanDerWaalsContact O-CG 3.27Å; E171-N175 PolarHBondContact O-N 3.26Å; E171-N175 PolarHBondContact O-ND2 3.47Å; D172-N175 PolarHBondContact O-N 3.1Å; N175-S177 PolarHBondContact O-N 3.11Å; N175-Q178 PolarHBondContact O-N 3.4Å; N175-L179 VanDerWaalsContact O-CG 3.27Å; N175-L179 WeakPolarHBondContact O-CG 3.35Å; N175-L179 PolarHBondContact O-N 3.04Å; N175-L179 VanDerWaalsContact O-N 3.13Å |
| 176 | I | 73.1 | Confident | 67.4 | Low | 108 Ų | 108 | 99.3 Ų | 99.3 | 55% | 0.554 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -61.8 | -42.6 | 174 | -68.2 | 164.8 | 0 | 0 | 0 | 111.2 | D172 N173 Q178 L179 | D172-I176 VanDerWaalsContact O-CG1 3.25Å; D172-I176 WeakPolarHBondContact O-CG1 2.91Å; D172-I176 PolarHBondContact O-N 3.29Å; N173-I176 PolarHBondContact O-N 3.2Å; I176-Q178 VanDerWaalsContact C-N 3.34Å; I176-Q178 PolarHBondContact O-N 3.41Å; I176-L179 WeakPolarHBondContact O-CB 3.5Å; I176-L179 PolarHBondContact O-N 3.31Å; I176-L179 VanDerWaalsContact O-N 3.08Å |
| 177 | S | 67.1 | Low | 65.7 | Low | 65 Ų | 65 | 103.1 Ų | 103.1 | 46% | 0.455 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -65.9 | -36.8 | 179.4 | -59.6 | 0 | 0 | 0 | 0 | 112 | N173 N174 N175 L179 G180 | N173-S177 WeakPolarHBondContact O-CB 3.25Å; N173-S177 PolarHBondContact O-N 2.99Å; N173-S177 PolarHBondContact O-OG 2.89Å; N174-S177 PolarHBondContact O-N 2.82Å; N175-S177 PolarHBondContact O-N 3.11Å; S177-L179 PolarHBondContact O-N 3.37Å; S177-G180 PolarHBondContact O-N 3.4Å |
| 178 | Q | 64.5 | Low | 63.9 | Low | 158 Ų | 158 | 103.7 Ų | 103.7 | 74% | 0.738 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -68.7 | -22 | 172.8 | -72 | -173.5 | 43.5 | 0 | 0 | 113.1 | N174 N175 I176 G180 | N174-Q178 WeakPolarHBondContact O-CG 3.41Å; N174-Q178 PolarHBondContact O-N 3.02Å; N175-Q178 PolarHBondContact O-N 3.4Å; I176-Q178 VanDerWaalsContact C-N 3.34Å; I176-Q178 PolarHBondContact O-N 3.41Å; Q178-G180 PolarHBondContact O-N 3.34Å |
| 179 | L | 57.3 | Low | 62 | Low | 135 Ų | 135 | 109.2 Ų | 109.2 | 71% | 0.707 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.4 | 2.9 | 173.4 | -68.7 | 165.3 | 0 | 0 | 0 | 113.3 | N175 I176 S177 | N175-L179 VanDerWaalsContact O-CG 3.27Å; N175-L179 WeakPolarHBondContact O-CG 3.35Å; N175-L179 PolarHBondContact O-N 3.04Å; N175-L179 VanDerWaalsContact O-N 3.13Å; I176-L179 WeakPolarHBondContact O-CB 3.5Å; I176-L179 PolarHBondContact O-N 3.31Å; I176-L179 VanDerWaalsContact O-N 3.08Å; S177-L179 PolarHBondContact O-N 3.37Å |
| 180 | G | 44.9 | Very low | 60.2 | Low | 42 Ų | 42 | 109.6 Ų | 109.6 | 43% | 0.433 | 62% | 0.621 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -101.9 | 140.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | S177 Q178 | S177-G180 PolarHBondContact O-N 3.4Å; Q178-G180 PolarHBondContact O-N 3.34Å |
| 181 | P | 49 | Very low | 58.3 | Low | 119 Ų | 119 | 112.5 Ų | 112.5 | 77% | 0.773 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | cis | -118.3 | 94.4 | -4.4 | 35.6 | -17 | 0 | 0 | 0 | 111.1 | ||
| 182 | S | 49.7 | Very low | 56.4 | Low | 115 Ų | 115 | 111.9 Ų | 111.9 | 80% | 0.804 | 63% | 0.632 | S | S | * | * | S | Bend | trans | -110.6 | -9.8 | 162.7 | -146.7 | 0 | 0 | 0 | 0 | 112.8 | ||
| 183 | I | 45.9 | Very low | 54.4 | Low | 156 Ų | 156 | 111.8 Ų | 111.8 | 80% | 0.8 | 64% | 0.637 | S | S | * | * | S | Bend | trans | -141.9 | 28.4 | -175.9 | -36 | 178.5 | 0 | 0 | 0 | 113.2 | ||
| 184 | L | 43.4 | Very low | 52.8 | Low | 102 Ų | 102 | 111.4 Ų | 111.4 | 53% | 0.534 | 64% | 0.641 | S | S | . | * | trans | -115.2 | 117.2 | 169 | -71.8 | 173.6 | 0 | 0 | 0 | 110.1 | V190 | L184-V190 HydrophobicContact CD1-CG2 4.41Š| ||
| 185 | P | 43.7 | Very low | 51.6 | Low | 99 Ų | 99 | 113 Ų | 113 | 64% | 0.643 | 66% | 0.657 | S | S | * | * | trans | -62.1 | 143.2 | 171 | 25.4 | -30.3 | 0 | 0 | 0 | 109.2 | D187 V188 | P185-D187 PolarHBondContact O-N 3.5Å; P185-V188 PolarHBondContact O-N 3.3Å | ||
| 186 | A | 54.6 | Low | 50.1 | Low | 100 Ų | 100 | 114.3 Ų | 114.3 | 83% | 0.826 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.6 | -2.9 | -161.1 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||
| 187 | D | 51.8 | Low | 48.5 | Very low | 157 Ų | 157 | 113.6 Ų | 113.6 | 84% | 0.84 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.2 | 0 | -173.4 | -58.7 | -26.8 | 0 | 0 | 0 | 114.1 | P185 Q189 | P185-D187 PolarHBondContact O-N 3.5Å; D187-Q189 PolarHBondContact O-N 2.86Å |
| 188 | V | 48.2 | Very low | 47.3 | Very low | 88 Ų | 88 | 116.1 Ų | 116.1 | 53% | 0.533 | 68% | 0.684 | S | S | . | * | trans | -94 | 89.7 | 173.2 | -173.7 | 0 | 0 | 0 | 0 | 109.9 | P185 V190 | P185-V188 PolarHBondContact O-N 3.3Å; V188-V190 HydrophobicContact CG1-CG2 4.26Å; V188-V190 PolarHBondContact O-N 3.29Å; V188-V190 VanDerWaalsContact O-N 3.1Å | ||
| 189 | Q | 46.9 | Very low | 46.5 | Very low | 189 Ų | 189 | 114.8 Ų | 114.8 | 88% | 0.883 | 69% | 0.686 | S | S | * | * | trans | -71.9 | 98.1 | 167.1 | -73.1 | -173.9 | 87.4 | 0 | 0 | 109.3 | D187 H191 | D187-Q189 PolarHBondContact O-N 2.86Å; Q189-H191 PolarHBondContact O-N 3.37Å | ||
| 190 | V | 48.1 | Very low | 45.7 | Very low | 94 Ų | 94 | 111.2 Ų | 111.2 | 57% | 0.57 | 68% | 0.682 | S | S | * | * | trans | -70.7 | 108.2 | 166.2 | -177.1 | 0 | 0 | 0 | 0 | 106.9 | L184 V188 I192 | L184-V190 HydrophobicContact CD1-CG2 4.41Å; V188-V190 HydrophobicContact CG1-CG2 4.26Å; V188-V190 PolarHBondContact O-N 3.29Å; V188-V190 VanDerWaalsContact O-N 3.1Å; V190-I192 VanDerWaalsContact C-N 3.25Å; V190-I192 HydrophobicContact CB-CG1 4.39Å; V190-I192 HydrophobicContact CG1-CG1 3.89Å; V190-I192 PolarHBondContact O-N 3.01Å | ||
| 191 | H | 42.7 | Very low | 45.2 | Very low | 167 Ų | 167 | 117 Ų | 117 | 77% | 0.773 | 70% | 0.698 | S | S | * | * | trans | -70.1 | 88.2 | 170.4 | -172.5 | 71.1 | 0 | 0 | 0 | 108.1 | Q189 C193 | Q189-H191 PolarHBondContact O-N 3.37Å; H191-C193 PolarHBondContact O-N 3.13Å; H191-C193 VanDerWaalsContact O-N 3.11Å | ||
| 192 | I | 44.7 | Very low | 44.8 | Very low | 112 Ų | 112 | 117 Ų | 117 | 57% | 0.574 | 69% | 0.691 | S | S | * | * | trans | -74.4 | 97.6 | 172.2 | -54.3 | 177 | 0 | 0 | 0 | 105.9 | V190 S194 | V190-I192 VanDerWaalsContact C-N 3.25Å; V190-I192 HydrophobicContact CB-CG1 4.39Å; V190-I192 HydrophobicContact CG1-CG1 3.89Å; V190-I192 PolarHBondContact O-N 3.01Å; I192-S194 PolarHBondContact O-N 3.19Å; I192-S194 VanDerWaalsContact O-N 3.11Å | ||
| 193 | C | 38.8 | Very low | 44.3 | Very low | 80 Ų | 80 | 116.7 Ų | 116.7 | 54% | 0.541 | 69% | 0.686 | S | S | . | * | trans | -53.6 | 120.1 | 166.5 | -107 | 0 | 0 | 0 | 0 | 107.6 | H191 D197 | H191-C193 PolarHBondContact O-N 3.13Å; H191-C193 VanDerWaalsContact O-N 3.11Å; C193-D197 PolarHBondContact SG-OD2 3.2Å; C193-D197 VanDerWaalsContact SG-OD2 3.38Å | ||
| 194 | S | 41.8 | Very low | 44.1 | Very low | 75 Ų | 75 | 113.6 Ų | 113.6 | 52% | 0.524 | 67% | 0.674 | S | S | . | * | trans | -67.7 | 145.7 | -177.2 | -74.9 | 0 | 0 | 0 | 0 | 109.8 | I192 S196 D197 | I192-S194 PolarHBondContact O-N 3.19Å; I192-S194 VanDerWaalsContact O-N 3.11Å; S194-S196 PolarHBondContact O-N 3.39Å; S194-D197 PolarHBondContact O-N 3.47Å; S194-D197 VanDerWaalsContact O-N 3.15Å | ||
| 195 | P | 49.8 | Very low | 44.2 | Very low | 135 Ų | 135 | 114.4 Ų | 114.4 | 88% | 0.877 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.5 | 13.1 | -175.3 | 27.1 | -34.8 | 0 | 0 | 0 | 114.9 | ||
| 196 | S | 45.7 | Very low | 44.1 | Very low | 105 Ų | 105 | 115.1 Ų | 115.1 | 73% | 0.734 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.7 | -11.4 | 176.7 | -39.1 | 0 | 0 | 0 | 0 | 113 | S194 P198 | S194-S196 PolarHBondContact O-N 3.39Å; S196-P198 WeakPolarHBondContact O-CD 3.31Å |
| 197 | D | 39.9 | Very low | 43.5 | Very low | 93 Ų | 93 | 114 Ų | 114 | 50% | 0.497 | 67% | 0.672 | S | S | . | * | S | Bend | trans | -65.8 | 120 | 169.9 | -67.1 | -31.5 | 0 | 0 | 0 | 106.3 | C193 S194 V199 | C193-D197 PolarHBondContact SG-OD2 3.2Å; C193-D197 VanDerWaalsContact SG-OD2 3.38Å; S194-D197 PolarHBondContact O-N 3.47Å; S194-D197 VanDerWaalsContact O-N 3.15Å; D197-V199 PolarHBondContact O-N 2.95Å |
| 198 | P | 41.2 | Very low | 43.3 | Very low | 117 Ų | 117 | 113.1 Ų | 113.1 | 76% | 0.76 | 67% | 0.667 | S | S | * | * | trans | -56.5 | 113 | -178 | 22.8 | -31.2 | 0 | 0 | 0 | 106.1 | S196 G200 | S196-P198 WeakPolarHBondContact O-CD 3.31Å; P198-G200 VanDerWaalsContact C-N 3.26Å; P198-G200 WeakPolarHBondContact O-CA 3.29Å; P198-G200 PolarHBondContact O-N 2.74Å | ||
| 199 | V | 48.1 | Very low | 43.5 | Very low | 130 Ų | 130 | 116.5 Ų | 116.5 | 79% | 0.788 | 67% | 0.674 | S | S | * | * | trans | -48.2 | 105.2 | 169.5 | 179.1 | 0 | 0 | 0 | 0 | 103.8 | D197 E201 | D197-V199 PolarHBondContact O-N 2.95Å; V199-E201 PolarHBondContact O-N 3.38Å | ||
| 200 | G | 41 | Very low | 43.8 | Very low | 60 Ų | 60 | 110.2 Ų | 110.2 | 62% | 0.619 | 65% | 0.651 | S | S | * | * | trans | -45.2 | 115.2 | -162.2 | 0 | 0 | 0 | 0 | 0 | 106.8 | P198 L202 | P198-G200 VanDerWaalsContact C-N 3.26Å; P198-G200 WeakPolarHBondContact O-CA 3.29Å; P198-G200 PolarHBondContact O-N 2.74Å; G200-L202 PolarHBondContact O-N 2.96Å | ||
| 201 | E | 35.4 | Very low | 44.1 | Very low | 163 Ų | 163 | 113 Ų | 113 | 76% | 0.762 | 66% | 0.655 | S | S | * | * | trans | -43 | 98.9 | -177.3 | -166.8 | 175.4 | -167.5 | 0 | 0 | 105.9 | V199 P203 | V199-E201 PolarHBondContact O-N 3.38Å; E201-P203 WeakPolarHBondContact O-CA 3.28Å; E201-P203 WeakPolarHBondContact O-CD 3.42Å | ||
| 202 | L | 40 | Very low | 44.8 | Very low | 121 Ų | 121 | 113.5 Ų | 113.5 | 63% | 0.634 | 66% | 0.656 | S | S | * | * | trans | -48.7 | 114 | 177.1 | -97.2 | 156.8 | 0 | 0 | 0 | 102.4 | G200 V204 | G200-L202 PolarHBondContact O-N 2.96Å; L202-V204 VanDerWaalsContact C-N 3.29Å; L202-V204 WeakPolarHBondContact O-CA 3.41Å; L202-V204 PolarHBondContact O-N 3.37Å | ||
| 203 | P | 38.9 | Very low | 45.6 | Very low | 107 Ų | 107 | 117 Ų | 117 | 70% | 0.695 | 66% | 0.662 | S | S | * | * | trans | -52.9 | 107.9 | -162.8 | 17.8 | -31.1 | 0 | 0 | 0 | 104.7 | E201 V205 | E201-P203 WeakPolarHBondContact O-CA 3.28Å; E201-P203 WeakPolarHBondContact O-CD 3.42Å; P203-V205 VanDerWaalsContact C-N 3.31Å; P203-V205 VanDerWaalsContact O-CG2 3.25Å; P203-V205 WeakPolarHBondContact O-CG2 3.43Å; P203-V205 PolarHBondContact O-N 3.44Å | ||
| 204 | V | 42.2 | Very low | 46.9 | Very low | 91 Ų | 91 | 120.3 Ų | 120.3 | 55% | 0.552 | 67% | 0.667 | S | S | * | * | trans | -57.6 | 114.2 | -178.3 | 178.3 | 0 | 0 | 0 | 0 | 100.7 | L202 T206 | L202-V204 VanDerWaalsContact C-N 3.29Å; L202-V204 WeakPolarHBondContact O-CA 3.41Å; L202-V204 PolarHBondContact O-N 3.37Å; V204-T206 HydrophobicContact CB-CG2 4.49Å; V204-T206 HydrophobicContact CG1-CG2 3.36Å; V204-T206 WeakPolarHBondContact CG1-OG1 3.31Å; V204-T206 PolarHBondContact O-N 3.18Å; V204-T206 PolarHBondContact O-OG1 2.98Å | ||
| 205 | V | 45.8 | Very low | 48.5 | Very low | 120 Ų | 120 | 126.1 Ų | 126.1 | 73% | 0.727 | 68% | 0.677 | S | S | * | * | trans | -74.8 | 43.7 | -177 | -161.3 | 0 | 0 | 0 | 0 | 107.6 | P203 S207 L208 | P203-V205 VanDerWaalsContact C-N 3.31Å; P203-V205 VanDerWaalsContact O-CG2 3.25Å; P203-V205 WeakPolarHBondContact O-CG2 3.43Å; P203-V205 PolarHBondContact O-N 3.44Å; V205-S207 PolarHBondContact O-N 3.47Å; V205-L208 HydrophobicContact CG1-CD1 4.42Å | ||
| 206 | T | 40 | Very low | 49.7 | Very low | 113 Ų | 113 | 127 Ų | 127 | 69% | 0.693 | 67% | 0.667 | S | S | * | * | trans | -76.5 | 60.4 | 165.4 | 41.2 | 0 | 0 | 0 | 0 | 108.5 | V204 | V204-T206 HydrophobicContact CB-CG2 4.49Å; V204-T206 HydrophobicContact CG1-CG2 3.36Å; V204-T206 WeakPolarHBondContact CG1-OG1 3.31Å; V204-T206 PolarHBondContact O-N 3.18Å; V204-T206 PolarHBondContact O-OG1 2.98Å | ||
| 207 | S | 41.6 | Very low | 51.3 | Low | 78 Ų | 78 | 127 Ų | 127 | 55% | 0.545 | 66% | 0.658 | S | S | . | * | S | Bend | trans | -161 | -14.3 | 155.5 | -147.6 | 0 | 0 | 0 | 0 | 118.8 | V205 K209 S210 | V205-S207 PolarHBondContact O-N 3.47Å; S207-K209 PolarHBondContact O-N 2.89Å; S207-K209 VanDerWaalsContact O-N 3.1Å; S207-S210 PolarHBondContact O-N 2.91Å; S207-S210 PolarHBondContact O-OG 2.76Å |
| 208 | L | 47.9 | Very low | 53.3 | Low | 137 Ų | 137 | 127 Ų | 127 | 72% | 0.717 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -69.5 | -13.3 | 179.5 | -79.4 | 164.6 | 0 | 0 | 0 | 113.5 | V205 S210 | V205-L208 HydrophobicContact CG1-CD1 4.42Å; L208-S210 VanDerWaalsContact C-N 3.28Å; L208-S210 PolarHBondContact O-N 3.29Å |
| 209 | K | 52.1 | Low | 55.4 | Low | 160 Ų | 160 | 123.3 Ų | 123.3 | 70% | 0.696 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -70.5 | -14.5 | 170 | -79 | -173.2 | 176.9 | 177.4 | 0 | 114.5 | S207 R213 | S207-K209 PolarHBondContact O-N 2.89Å; S207-K209 VanDerWaalsContact O-N 3.1Å; K209-R213 WeakPolarHBondContact O-CG 3.48Å |
| 210 | S | 53.7 | Low | 57.3 | Low | 57 Ų | 57 | 121 Ų | 121 | 40% | 0.399 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -90.8 | -30.1 | -177.5 | 76.7 | 0 | 0 | 0 | 0 | 114.2 | S207 L208 K214 | S207-S210 PolarHBondContact O-N 2.91Å; S207-S210 PolarHBondContact O-OG 2.76Å; L208-S210 VanDerWaalsContact C-N 3.28Å; L208-S210 PolarHBondContact O-N 3.29Å; S210-K214 WeakPolarHBondContact O-CG 3.38Å; S210-K214 PolarHBondContact O-N 3.39Å |
| 211 | K | 54 | Low | 59.7 | Low | 151 Ų | 151 | 121.5 Ų | 121.5 | 66% | 0.657 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -77.7 | -33.5 | -174.6 | -151.8 | 166.4 | -168.9 | 174.5 | 0 | 113.4 | R215 | K211-R215 PolarHBondContact O-N 3.1Å |
| 212 | K | 58.4 | Low | 62.4 | Low | 179 Ų | 179 | 117.2 Ų | 117.2 | 78% | 0.778 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -72.4 | -38.1 | 172 | -78.5 | -168.9 | 178.2 | -176.4 | 0 | 112.4 | K214 R215 F216 | K212-K214 VanDerWaalsContact C-N 3.34Å; K212-K214 PolarHBondContact O-N 3.37Å; K212-R215 PolarHBondContact O-N 2.94Å; K212-F216 PolarHBondContact O-N 2.97Å |
| 213 | R | 61.3 | Low | 64.9 | Low | 186 Ų | 186 | 115 Ų | 115 | 70% | 0.702 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -62.4 | -38.5 | 175.9 | -75.6 | -175.4 | 178.8 | -169.4 | -0.7 | 112.7 | K209 F216 L217 | K209-R213 WeakPolarHBondContact O-CG 3.48Å; R213-F216 PolarHBondContact O-N 3.44Å; R213-L217 VanDerWaalsContact O-CB 3.26Å; R213-L217 WeakPolarHBondContact O-CB 3.39Å; R213-L217 PolarHBondContact O-N 2.88Å |
| 214 | K | 66.7 | Low | 67.5 | Low | 149 Ų | 149 | 115.1 Ų | 115.1 | 65% | 0.648 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -63.4 | -42.3 | 174.5 | -73 | -176.1 | -179.7 | -175.1 | 0 | 112.2 | S210 K212 L217 V218 | S210-K214 WeakPolarHBondContact O-CG 3.38Å; S210-K214 PolarHBondContact O-N 3.39Å; K212-K214 VanDerWaalsContact C-N 3.34Å; K212-K214 PolarHBondContact O-N 3.37Å; K214-L217 PolarHBondContact O-N 2.94Å; K214-V218 WeakPolarHBondContact O-CB 3.28Å; K214-V218 WeakPolarHBondContact O-CG2 3.43Å; K214-V218 PolarHBondContact O-N 3.48Å |
| 215 | R | 74.3 | Confident | 69.9 | Low | 197 Ų | 197 | 115.5 Ų | 115.5 | 74% | 0.743 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -67 | -40.3 | 176 | -70.1 | -171.2 | 179.7 | -177.1 | -0.4 | 112.4 | K211 K212 V218 G219 | K211-R215 PolarHBondContact O-N 3.1Å; K212-R215 PolarHBondContact O-N 2.94Å; R215-V218 PolarHBondContact O-N 2.93Å; R215-G219 PolarHBondContact O-N 3.28Å |
| 216 | F | 75.8 | Confident | 72.2 | Confident | 152 Ų | 152 | 115 Ų | 115 | 67% | 0.667 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -65.8 | -43.1 | 176.1 | -171.8 | -96 | 0 | 0 | 0 | 111.8 | K212 R213 G219 L220 | K212-F216 PolarHBondContact O-N 2.97Å; R213-F216 PolarHBondContact O-N 3.44Å; F216-G219 PolarHBondContact O-N 2.87Å; F216-L220 WeakPolarHBondContact O-CB 3.45Å; F216-L220 PolarHBondContact O-N 2.94Å |
| 217 | L | 79 | Confident | 74.8 | Confident | 105 Ų | 105 | 114.2 Ų | 114.2 | 55% | 0.55 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -65.8 | -41.1 | 177.1 | -169.6 | 69.5 | 0 | 0 | 0 | 111.5 | R213 K214 L220 V221 | R213-L217 VanDerWaalsContact O-CB 3.26Å; R213-L217 WeakPolarHBondContact O-CB 3.39Å; R213-L217 PolarHBondContact O-N 2.88Å; K214-L217 PolarHBondContact O-N 2.94Å; L217-L220 PolarHBondContact O-N 3.38Å; L217-V221 WeakPolarHBondContact O-CB 3.32Å; L217-V221 WeakPolarHBondContact O-CG2 3.49Å; L217-V221 PolarHBondContact O-N 3.1Å |
| 218 | V | 82.9 | Confident | 77.2 | Confident | 93 Ų | 93 | 112.5 Ų | 112.5 | 56% | 0.564 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -62.2 | -44.5 | 172.9 | 171.5 | 0 | 0 | 0 | 0 | 110.5 | K214 R215 L220 V221 V222 | K214-V218 WeakPolarHBondContact O-CB 3.28Å; K214-V218 WeakPolarHBondContact O-CG2 3.43Å; K214-V218 PolarHBondContact O-N 3.48Å; R215-V218 PolarHBondContact O-N 2.93Å; V218-L220 PolarHBondContact O-N 3.24Å; V218-V221 PolarHBondContact O-N 2.98Å; V218-V222 HydrophobicContact CG1-CG2 4.37Å; V218-V222 WeakPolarHBondContact O-CB 3.48Å; V218-V222 VanDerWaalsContact O-CG2 3.23Å; V218-V222 WeakPolarHBondContact O-CG2 3.37Å; V218-V222 PolarHBondContact O-N 3.17Å |
| 219 | G | 84.9 | Confident | 79.4 | Confident | 40 Ų | 40 | 110.7 Ų | 110.7 | 41% | 0.412 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -60.7 | -43.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | R215 F216 V222 C223 | R215-G219 PolarHBondContact O-N 3.28Å; F216-G219 PolarHBondContact O-N 2.87Å; G219-V222 PolarHBondContact O-N 3.4Å; G219-C223 VanDerWaalsContact O-CB 3.3Å; G219-C223 WeakPolarHBondContact O-CB 3.46Å; G219-C223 PolarHBondContact O-N 2.94Å |
| 220 | L | 87.4 | Confident | 81.4 | Confident | 81 Ų | 81 | 108 Ų | 108 | 42% | 0.424 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -64.1 | -44.8 | 176.8 | -171.9 | 76.9 | 0 | 0 | 0 | 111.5 | F216 L217 V218 C223 L224 | F216-L220 WeakPolarHBondContact O-CB 3.45Å; F216-L220 PolarHBondContact O-N 2.94Å; L217-L220 PolarHBondContact O-N 3.38Å; V218-L220 PolarHBondContact O-N 3.24Å; L220-C223 WeakPolarHBondContact O-CB 3.41Å; L220-C223 PolarHBondContact O-N 3.47Å; L220-L224 HydrophobicContact CG-CD1 4.41Å; L220-L224 WeakPolarHBondContact O-CG 3.19Å; L220-L224 PolarHBondContact O-N 2.9Å |
| 221 | V | 90.7 | Very high | 83.2 | Confident | 71 Ų | 71 | 110.4 Ų | 110.4 | 43% | 0.43 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -64 | -44 | 177.4 | 170.3 | 0 | 0 | 0 | 0 | 110.8 | L217 V218 C223 L224 I225 | L217-V221 WeakPolarHBondContact O-CB 3.32Å; L217-V221 WeakPolarHBondContact O-CG2 3.49Å; L217-V221 PolarHBondContact O-N 3.1Å; V218-V221 PolarHBondContact O-N 2.98Å; V221-C223 VanDerWaalsContact C-N 3.33Å; V221-C223 PolarHBondContact O-N 3.4Å; V221-L224 PolarHBondContact O-N 3.47Å; V221-I225 HydrophobicContact CG1-CD1 3.85Å; V221-I225 VanDerWaalsContact O-CG1 3.26Å; V221-I225 WeakPolarHBondContact O-CG1 3.39Å; V221-I225 PolarHBondContact O-N 3.39Å |
| 222 | V | 92.6 | Very high | 85 | Confident | 74 Ų | 74 | 105.1 Ų | 105.1 | 45% | 0.448 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -61.2 | -43.2 | 174.8 | 171.4 | 0 | 0 | 0 | 0 | 110.8 | V218 G219 L224 I225 L226 | V218-V222 HydrophobicContact CG1-CG2 4.37Å; V218-V222 WeakPolarHBondContact O-CB 3.48Å; V218-V222 VanDerWaalsContact O-CG2 3.23Å; V218-V222 WeakPolarHBondContact O-CG2 3.37Å; V218-V222 PolarHBondContact O-N 3.17Å; G219-V222 PolarHBondContact O-N 3.4Å; V222-L224 PolarHBondContact O-N 3.43Å; V222-I225 PolarHBondContact O-N 2.96Å; V222-L226 HydrophobicContact CG1-CD1 4.06Å; V222-L226 HydrophobicContact CG1-CG 4.46Å; V222-L226 WeakPolarHBondContact O-CG 3.3Å; V222-L226 PolarHBondContact O-N 3.44Å |
| 223 | C | 92.5 | Very high | 86.6 | Confident | 73 Ų | 73 | 100.2 Ų | 100.2 | 49% | 0.493 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -60.7 | -45.3 | 177.3 | -165.4 | 0 | 0 | 0 | 0 | 111.8 | G219 L220 V221 I225 L226 L227 | G219-C223 VanDerWaalsContact O-CB 3.3Å; G219-C223 WeakPolarHBondContact O-CB 3.46Å; G219-C223 PolarHBondContact O-N 2.94Å; L220-C223 WeakPolarHBondContact O-CB 3.41Å; L220-C223 PolarHBondContact O-N 3.47Å; V221-C223 VanDerWaalsContact C-N 3.33Å; V221-C223 PolarHBondContact O-N 3.4Å; C223-I225 PolarHBondContact O-N 2.96Å; C223-L226 PolarHBondContact O-N 2.86Å; C223-L227 PolarHBondContact O-N 3.46Å |
| 224 | L | 93 | Very high | 88 | Confident | 111 Ų | 111 | 95.3 Ų | 95.3 | 58% | 0.581 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -64.6 | -38.2 | 177.2 | -70.8 | 172.6 | 0 | 0 | 0 | 112.8 | L220 V221 V222 L227 G228 | L220-L224 HydrophobicContact CG-CD1 4.41Å; L220-L224 WeakPolarHBondContact O-CG 3.19Å; L220-L224 PolarHBondContact O-N 2.9Å; V221-L224 PolarHBondContact O-N 3.47Å; V222-L224 PolarHBondContact O-N 3.43Å; L224-L227 PolarHBondContact O-N 3.16Å; L224-G228 PolarHBondContact O-N 3.05Å |
| 225 | I | 93.8 | Very high | 89.1 | Confident | 98 Ų | 98 | 90.6 Ų | 90.6 | 50% | 0.503 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.3 | -46.8 | 174.9 | -69 | 165.1 | 0 | 0 | 0 | 110.2 | V221 V222 C223 L227 G228 I229 | V221-I225 HydrophobicContact CG1-CD1 3.85Å; V221-I225 VanDerWaalsContact O-CG1 3.26Å; V221-I225 WeakPolarHBondContact O-CG1 3.39Å; V221-I225 PolarHBondContact O-N 3.39Å; V222-I225 PolarHBondContact O-N 2.96Å; C223-I225 PolarHBondContact O-N 2.96Å; I225-L227 VanDerWaalsContact C-N 3.33Å; I225-L227 PolarHBondContact O-N 2.83Å; I225-G228 PolarHBondContact O-N 2.9Å; I225-I229 HydrophobicContact CG2-CD1 3.89Å; I225-I229 WeakPolarHBondContact O-CG1 3.29Å; I225-I229 PolarHBondContact O-N 3.22Å |
| 226 | L | 94.6 | Very high | 89.9 | Confident | 110 Ų | 110 | 87.3 Ų | 87.3 | 58% | 0.576 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -62.4 | -41 | 178.1 | -69.9 | 173.5 | 0 | 0 | 0 | 111.7 | V222 C223 I229 L230 | V222-L226 HydrophobicContact CG1-CD1 4.06Å; V222-L226 HydrophobicContact CG1-CG 4.46Å; V222-L226 WeakPolarHBondContact O-CG 3.3Å; V222-L226 PolarHBondContact O-N 3.44Å; C223-L226 PolarHBondContact O-N 2.86Å; L226-I229 PolarHBondContact O-N 3.29Å; L226-L230 WeakPolarHBondContact O-CB 3.44Å; L226-L230 PolarHBondContact O-N 3.35Å |
| 227 | L | 93.2 | Very high | 90.5 | Very high | 97 Ų | 97 | 84.8 Ų | 84.8 | 51% | 0.508 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.7 | -43.9 | 175.4 | -134.8 | 90.9 | 0 | 0 | 0 | 111.6 | C223 L224 I225 L230 L231 | C223-L227 PolarHBondContact O-N 3.46Å; L224-L227 PolarHBondContact O-N 3.16Å; I225-L227 VanDerWaalsContact C-N 3.33Å; I225-L227 PolarHBondContact O-N 2.83Å; L227-L230 PolarHBondContact O-N 2.87Å; L227-L231 WeakPolarHBondContact O-CB 3.46Å; L227-L231 WeakPolarHBondContact O-CG 3.44Å; L227-L231 PolarHBondContact O-N 3.27Å |
| 228 | G | 93.2 | Very high | 90.8 | Very high | 42 Ų | 42 | 87.3 Ų | 87.3 | 43% | 0.433 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.9 | -40.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113 | L224 I225 G232 | L224-G228 PolarHBondContact O-N 3.05Å; I225-G228 PolarHBondContact O-N 2.9Å; G228-G232 PolarHBondContact O-N 3.41Å |
| 229 | I | 93.9 | Very high | 90.7 | Very high | 98 Ų | 98 | 90.1 Ų | 90.1 | 50% | 0.503 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.6 | -46.3 | 174.7 | -66.9 | 165.5 | 0 | 0 | 0 | 110.4 | I225 L226 L231 G232 V233 | I225-I229 HydrophobicContact CG2-CD1 3.89Å; I225-I229 WeakPolarHBondContact O-CG1 3.29Å; I225-I229 PolarHBondContact O-N 3.22Å; L226-I229 PolarHBondContact O-N 3.29Å; I229-L231 PolarHBondContact O-N 3.12Å; I229-G232 PolarHBondContact O-N 3.46Å; I229-V233 HydrophobicContact CG2-CG2 4.46Å; I229-V233 WeakPolarHBondContact O-CG2 3.5Å; I229-V233 PolarHBondContact O-N 2.97Å |
| 230 | L | 93.2 | Very high | 90.1 | Very high | 105 Ų | 105 | 97.7 Ų | 97.7 | 55% | 0.55 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -60.7 | -45.3 | 179.8 | -173.4 | 67.7 | 0 | 0 | 0 | 111.6 | L226 L227 G232 V233 L234 | L226-L230 WeakPolarHBondContact O-CB 3.44Å; L226-L230 PolarHBondContact O-N 3.35Å; L227-L230 PolarHBondContact O-N 2.87Å; L230-G232 VanDerWaalsContact C-N 3.34Å; L230-G232 PolarHBondContact O-N 3.35Å; L230-V233 PolarHBondContact O-N 2.81Å; L230-L234 HydrophobicContact CG-CD1 4.27Å; L230-L234 WeakPolarHBondContact O-CG 3.29Å; L230-L234 PolarHBondContact O-N 3.35Å |
| 231 | L | 92.8 | Very high | 89 | Confident | 107 Ų | 107 | 105.3 Ų | 105.3 | 56% | 0.56 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -62.4 | -39.9 | 174.9 | -72.8 | 169.6 | 0 | 0 | 0 | 112 | L227 I229 L234 A235 | L227-L231 WeakPolarHBondContact O-CB 3.46Å; L227-L231 WeakPolarHBondContact O-CG 3.44Å; L227-L231 PolarHBondContact O-N 3.27Å; I229-L231 PolarHBondContact O-N 3.12Å; L231-L234 PolarHBondContact O-N 2.95Å; L231-A235 WeakPolarHBondContact O-CB 3.33Å; L231-A235 PolarHBondContact O-N 2.97Å |
| 232 | G | 90.9 | Very high | 88.9 | Confident | 40 Ų | 40 | 107 Ų | 107 | 41% | 0.412 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -62.8 | -41.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113 | G228 I229 L230 A235 F236 | G228-G232 PolarHBondContact O-N 3.41Å; I229-G232 PolarHBondContact O-N 3.46Å; L230-G232 VanDerWaalsContact C-N 3.34Å; L230-G232 PolarHBondContact O-N 3.35Å; G232-A235 PolarHBondContact O-N 2.83Å; G232-F236 WeakPolarHBondContact O-CB 3.44Å; G232-F236 PolarHBondContact O-N 3.5Å |
| 233 | V | 92.4 | Very high | 88.7 | Confident | 76 Ų | 76 | 108.7 Ų | 108.7 | 46% | 0.461 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -65.3 | -44.4 | 175.7 | 173.1 | 0 | 0 | 0 | 0 | 111 | I229 L230 F236 L237 | I229-V233 HydrophobicContact CG2-CG2 4.46Å; I229-V233 WeakPolarHBondContact O-CG2 3.5Å; I229-V233 PolarHBondContact O-N 2.97Å; L230-V233 PolarHBondContact O-N 2.81Å; V233-F236 PolarHBondContact O-N 2.87Å; V233-L237 HydrophobicContact CG1-CD1 4.09Å; V233-L237 HydrophobicContact CG1-CG 4.47Å; V233-L237 WeakPolarHBondContact O-CG 3.28Å; V233-L237 PolarHBondContact O-N 3.27Å |
| 234 | L | 90.9 | Very high | 88.5 | Confident | 83 Ų | 83 | 110.7 Ų | 110.7 | 44% | 0.435 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -60.7 | -45.8 | 176.1 | -78.8 | 162.2 | 0 | 0 | 0 | 111.6 | L230 L231 F236 L237 F238 | L230-L234 HydrophobicContact CG-CD1 4.27Å; L230-L234 WeakPolarHBondContact O-CG 3.29Å; L230-L234 PolarHBondContact O-N 3.35Å; L231-L234 PolarHBondContact O-N 2.95Å; L234-F236 PolarHBondContact O-N 3.42Å; L234-L237 PolarHBondContact O-N 3.13Å; L234-F238 WeakPolarHBondContact O-CD2 3.2Å; L234-F238 PolarHBondContact O-N 3.39Å |
| 235 | A | 90.1 | Very high | 88.2 | Confident | 50 Ų | 50 | 110.7 Ų | 110.7 | 41% | 0.413 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -60.8 | -44.7 | 176 | 0 | 0 | 0 | 0 | 0 | 111.6 | L231 G232 L237 F238 L239 | L231-A235 WeakPolarHBondContact O-CB 3.33Å; L231-A235 PolarHBondContact O-N 2.97Å; G232-A235 PolarHBondContact O-N 2.83Å; A235-L237 VanDerWaalsContact C-N 3.33Å; A235-L237 PolarHBondContact O-N 3.34Å; A235-F238 PolarHBondContact O-N 3.41Å; A235-L239 WeakPolarHBondContact O-CD1 3.47Å; A235-L239 PolarHBondContact O-N 3.19Å |
| 236 | F | 90.3 | Very high | 87.8 | Confident | 127 Ų | 127 | 111.5 Ų | 111.5 | 56% | 0.557 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -61.8 | -39.7 | 176.9 | -178 | -97.5 | 0 | 0 | 0 | 112.6 | G232 V233 L234 L239 R240 | G232-F236 WeakPolarHBondContact O-CB 3.44Å; G232-F236 PolarHBondContact O-N 3.5Å; V233-F236 PolarHBondContact O-N 2.87Å; L234-F236 PolarHBondContact O-N 3.42Å; F236-L239 PolarHBondContact O-N 3.39Å; F236-R240 PolarHBondContact O-N 3.5Å |
| 237 | L | 88 | Confident | 87.4 | Confident | 100 Ų | 100 | 111.6 Ų | 111.6 | 52% | 0.524 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -66.7 | -38.1 | 175.3 | -72.2 | 172.8 | 0 | 0 | 0 | 112.2 | V233 L234 A235 R240 K241 | V233-L237 HydrophobicContact CG1-CD1 4.09Å; V233-L237 HydrophobicContact CG1-CG 4.47Å; V233-L237 WeakPolarHBondContact O-CG 3.28Å; V233-L237 PolarHBondContact O-N 3.27Å; L234-L237 PolarHBondContact O-N 3.13Å; A235-L237 VanDerWaalsContact C-N 3.33Å; A235-L237 PolarHBondContact O-N 3.34Å; L237-R240 PolarHBondContact O-N 3.39Å; L237-K241 PolarHBondContact O-N 3.18Å |
| 238 | F | 86.3 | Confident | 87 | Confident | 158 Ų | 158 | 112.6 Ų | 112.6 | 69% | 0.693 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -68 | -37.6 | 176 | -99.9 | -82.3 | 0 | 0 | 0 | 113 | L234 A235 R240 | L234-F238 WeakPolarHBondContact O-CD2 3.2Å; L234-F238 PolarHBondContact O-N 3.39Å; A235-F238 PolarHBondContact O-N 3.41Å; F238-R240 PolarHBondContact O-N 3.1Å |
| 239 | L | 80.5 | Confident | 86.5 | Confident | 152 Ų | 152 | 118.1 Ų | 118.1 | 80% | 0.796 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -70.3 | -16.2 | 176 | -90.3 | 138.9 | 0 | 0 | 0 | 113.8 | A235 F236 | A235-L239 WeakPolarHBondContact O-CD1 3.47Å; A235-L239 PolarHBondContact O-N 3.19Å; F236-L239 PolarHBondContact O-N 3.39Å |
| 240 | R | 72.5 | Confident | 85.9 | Confident | 199 Ų | 199 | 119.8 Ų | 119.8 | 75% | 0.751 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -99.3 | -12.8 | -178.1 | -156.4 | 179.9 | 171.5 | 167.2 | -0.9 | 113.5 | F236 L237 F238 | F236-R240 PolarHBondContact O-N 3.5Å; L237-R240 PolarHBondContact O-N 3.39Å; F238-R240 PolarHBondContact O-N 3.1Å |
| 241 | K | 63 | Low | 85.2 | Confident | 240 Ų | 240 | 121.1 Ų | 121.1 | 100% | 1.043 | 60% | 0.604 | S | S | * | * | trans | -83.7 | 0 | 168.8 | -86.9 | -175.4 | 168.4 | -176.4 | 0 | 109.9 | L237 | L237-K241 PolarHBondContact O-N 3.18Š|
Retrieved 241 of 241 residues in 664 ms
(Link to these results)