| 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 | 36 | Very low | 40.3 | Very low | 248 Ų | 248 | 125 Ų | 125 | 100% | 1.222 | 72% | 0.722 | S | S | * | * | 0 | 99.1 | 0 | -76.4 | 159.9 | 153 | 0 | 0 | 108 | S3 | M1-S3 PolarHBondContact O-N 3.11Š| |||
| 2 | K | 35.3 | Very low | 40.5 | Very low | 202 Ų | 202 | 123.8 Ų | 123.8 | 88% | 0.878 | 71% | 0.711 | S | S | * | * | trans | -79.5 | 114.6 | 174.9 | -91.7 | 179.3 | 173.2 | 178.5 | 0 | 107.9 | C4 | K2-C4 PolarHBondContact O-N 2.95Š| ||
| 3 | S | 35.3 | Very low | 40.8 | Very low | 115 Ų | 115 | 123.2 Ų | 123.2 | 80% | 0.804 | 70% | 0.702 | S | S | * | * | trans | -72.3 | 103 | 172.5 | -172.4 | 0 | 0 | 0 | 0 | 108.4 | M1 | M1-S3 PolarHBondContact O-N 3.11Š| ||
| 4 | C | 40 | Very low | 40.9 | Very low | 108 Ų | 108 | 124.9 Ų | 124.9 | 73% | 0.73 | 70% | 0.701 | S | S | * | * | trans | -107.5 | 52.7 | 174 | -74.7 | 0 | 0 | 0 | 0 | 110.3 | K2 | K2-C4 PolarHBondContact O-N 2.95Š| ||
| 5 | C | 41.1 | Very low | 41.5 | Very low | 123 Ų | 123 | 121.7 Ų | 121.7 | 83% | 0.831 | 69% | 0.69 | S | S | * | * | trans | -112 | 25.8 | 175.7 | -78.1 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 6 | G | 37.2 | Very low | 42 | Very low | 50 Ų | 50 | 118.3 Ų | 118.3 | 52% | 0.515 | 68% | 0.676 | S | S | . | * | S | Bend | trans | -105.5 | -32.8 | -178.5 | 0 | 0 | 0 | 0 | 0 | 116 | ||
| 7 | E | 39.7 | Very low | 42.2 | Very low | 169 Ų | 169 | 114.2 Ų | 114.2 | 79% | 0.79 | 66% | 0.661 | S | S | * | * | S | Bend | trans | -93.4 | -18.8 | -166.8 | -82.8 | 165.2 | 97 | 0 | 0 | 115 | ||
| 8 | N | 45.3 | Very low | 42.2 | Very low | 125 Ų | 125 | 110 Ų | 110 | 67% | 0.668 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -84.6 | -19.2 | -177.6 | -70.7 | 7.6 | 0 | 0 | 0 | 114 | S11 | N8-S11 PolarHBondContact O-OG 2.8Å; N8-S11 VanDerWaalsContact O-OG 3.09Å |
| 9 | A | 47 | Very low | 41.9 | Very low | 57 Ų | 57 | 109.6 Ų | 109.6 | 47% | 0.471 | 64% | 0.64 | S | S | . | * | H | α-helix | trans | -77.9 | -26.2 | -177.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | I13 | A9-I13 WeakPolarHBondContact O-CD1 2.93Å; A9-I13 VanDerWaalsContact O-CG1 3.3Å; A9-I13 WeakPolarHBondContact O-CG1 3.43Å; A9-I13 PolarHBondContact O-N 3.24Å |
| 10 | I | 42.2 | Very low | 41.8 | Very low | 114 Ų | 114 | 109.7 Ų | 109.7 | 59% | 0.585 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -76.3 | -38.9 | -177.5 | -57.4 | 175.7 | 0 | 0 | 0 | 110.4 | I13 E14 | I10-I13 PolarHBondContact O-N 2.95Å; I10-E14 PolarHBondContact O-N 2.79Å; I10-E14 VanDerWaalsContact O-N 3.09Å |
| 11 | S | 44.5 | Very low | 41.8 | Very low | 64 Ų | 64 | 110.5 Ų | 110.5 | 45% | 0.448 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -67.2 | -36.2 | 175.3 | 48.8 | 0 | 0 | 0 | 0 | 112.9 | N8 S15 | N8-S11 PolarHBondContact O-OG 2.8Å; N8-S11 VanDerWaalsContact O-OG 3.09Å; S11-S15 WeakPolarHBondContact O-CB 3.27Å; S11-S15 PolarHBondContact O-N 3.14Å |
| 12 | D | 42.7 | Very low | 42.1 | Very low | 110 Ų | 110 | 102.6 Ų | 102.6 | 59% | 0.588 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -68.2 | -35 | 175.7 | -85.7 | -41.3 | 0 | 0 | 0 | 112.6 | S16 | D12-S16 WeakPolarHBondContact O-CB 3.19Å; D12-S16 PolarHBondContact O-N 3.32Å; D12-S16 PolarHBondContact O-OG 3.38Å |
| 13 | I | 44.2 | Very low | 42.7 | Very low | 116 Ų | 116 | 96.5 Ų | 96.5 | 60% | 0.595 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -72.8 | -41.7 | 176.7 | -65.7 | 162.4 | 0 | 0 | 0 | 111.2 | A9 I10 S15 S16 A17 | A9-I13 WeakPolarHBondContact O-CD1 2.93Å; A9-I13 VanDerWaalsContact O-CG1 3.3Å; A9-I13 WeakPolarHBondContact O-CG1 3.43Å; A9-I13 PolarHBondContact O-N 3.24Å; I10-I13 PolarHBondContact O-N 2.95Å; I13-S15 VanDerWaalsContact C-N 3.31Å; I13-S15 PolarHBondContact O-N 3.16Å; I13-S16 PolarHBondContact O-N 3.45Å; I13-A17 WeakPolarHBondContact O-CB 3.02Å; I13-A17 PolarHBondContact O-N 3.09Å |
| 14 | E | 42.4 | Very low | 43.1 | Very low | 147 Ų | 147 | 94.3 Ų | 94.3 | 69% | 0.687 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -61.5 | -40.7 | 174.8 | -79.6 | -163.9 | 123.6 | 0 | 0 | 111.8 | I10 S16 A17 G18 | I10-E14 PolarHBondContact O-N 2.79Å; I10-E14 VanDerWaalsContact O-N 3.09Å; E14-S16 VanDerWaalsContact C-N 3.34Å; E14-S16 PolarHBondContact O-N 2.99Å; E14-A17 PolarHBondContact O-N 3.34Å; E14-G18 PolarHBondContact O-N 3.02Å |
| 15 | S | 50.2 | Low | 43.1 | Very low | 78 Ų | 78 | 94 Ų | 94 | 55% | 0.545 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -62.5 | -41.9 | 175.1 | -164.8 | 0 | 0 | 0 | 0 | 111.7 | S11 I13 G18 L19 | S11-S15 WeakPolarHBondContact O-CB 3.27Å; S11-S15 PolarHBondContact O-N 3.14Å; I13-S15 VanDerWaalsContact C-N 3.31Å; I13-S15 PolarHBondContact O-N 3.16Å; S15-G18 PolarHBondContact O-N 3.35Å; S15-L19 WeakPolarHBondContact O-CB 3.39Å; S15-L19 PolarHBondContact O-N 2.88Å |
| 16 | S | 48.6 | Very low | 43.4 | Very low | 66 Ų | 66 | 91 Ų | 91 | 46% | 0.462 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -67.7 | -41 | 179.1 | -57.1 | 0 | 0 | 0 | 0 | 113 | D12 I13 E14 L19 L20 | D12-S16 WeakPolarHBondContact O-CB 3.19Å; D12-S16 PolarHBondContact O-N 3.32Å; D12-S16 PolarHBondContact O-OG 3.38Å; I13-S16 PolarHBondContact O-N 3.45Å; E14-S16 VanDerWaalsContact C-N 3.34Å; E14-S16 PolarHBondContact O-N 2.99Å; S16-L19 PolarHBondContact O-N 3.25Å; S16-L20 WeakPolarHBondContact O-CG 3.4Å; S16-L20 PolarHBondContact O-N 3.48Å |
| 17 | A | 46.3 | Very low | 43.5 | Very low | 50 Ų | 50 | 95.8 Ų | 95.8 | 41% | 0.413 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -67.5 | -41.6 | 177 | 0 | 0 | 0 | 0 | 0 | 111.1 | I13 E14 L19 L20 M21 | I13-A17 WeakPolarHBondContact O-CB 3.02Å; I13-A17 PolarHBondContact O-N 3.09Å; E14-A17 PolarHBondContact O-N 3.34Å; A17-L19 VanDerWaalsContact C-N 3.31Å; A17-L19 PolarHBondContact O-N 3.36Å; A17-L20 PolarHBondContact O-N 2.91Å; A17-M21 WeakPolarHBondContact O-CB 3.28Å; A17-M21 VanDerWaalsContact O-CG 3.23Å; A17-M21 WeakPolarHBondContact O-CG 3.24Å; A17-M21 PolarHBondContact O-N 2.71Å |
| 18 | G | 42 | Very low | 43.8 | Very low | 38 Ų | 38 | 90.9 Ų | 90.9 | 39% | 0.392 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -60.7 | -39.1 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | E14 S15 T22 | E14-G18 PolarHBondContact O-N 3.02Å; S15-G18 PolarHBondContact O-N 3.35Å; G18-T22 WeakPolarHBondContact O-CB 2.99Å; G18-T22 WeakPolarHBondContact O-CG2 3.37Å; G18-T22 PolarHBondContact O-N 3.35Å; G18-T22 PolarHBondContact O-OG1 3.46Å |
| 19 | L | 36.6 | Very low | 43.9 | Very low | 103 Ų | 103 | 91.2 Ų | 91.2 | 54% | 0.539 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -69.4 | -39.4 | 177.5 | -158 | 120.4 | 0 | 0 | 0 | 112.5 | S15 S16 A17 T22 I23 | S15-L19 WeakPolarHBondContact O-CB 3.39Å; S15-L19 PolarHBondContact O-N 2.88Å; S16-L19 PolarHBondContact O-N 3.25Å; A17-L19 VanDerWaalsContact C-N 3.31Å; A17-L19 PolarHBondContact O-N 3.36Å; L19-T22 WeakPolarHBondContact CA-OG1 3.44Å; L19-T22 PolarHBondContact O-N 3.38Å; L19-T22 PolarHBondContact O-OG1 3.46Å; L19-I23 HydrophobicContact CD2-CD1 3.66Å; L19-I23 HydrophobicContact CG-CD1 4.33Å; L19-I23 WeakPolarHBondContact O-CB 3.48Å; L19-I23 WeakPolarHBondContact O-CD1 3.25Å; L19-I23 WeakPolarHBondContact O-CG1 3.45Å; L19-I23 PolarHBondContact O-N 3.17Å |
| 20 | L | 39.7 | Very low | 44.1 | Very low | 110 Ų | 110 | 92.3 Ų | 92.3 | 58% | 0.576 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -68.7 | -39.4 | 175.1 | -78.6 | 164.9 | 0 | 0 | 0 | 112.4 | S16 A17 I23 S24 | S16-L20 WeakPolarHBondContact O-CG 3.4Å; S16-L20 PolarHBondContact O-N 3.48Å; A17-L20 PolarHBondContact O-N 2.91Å; L20-I23 PolarHBondContact O-N 3.45Å; L20-S24 VanDerWaalsContact O-CB 3.3Å; L20-S24 WeakPolarHBondContact O-CB 3.5Å; L20-S24 PolarHBondContact O-N 3.19Å; L20-S24 PolarHBondContact O-OG 2.76Å |
| 21 | M | 40.8 | Very low | 44.4 | Very low | 127 Ų | 127 | 93.9 Ų | 93.9 | 63% | 0.626 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -65.5 | -40.6 | 175.1 | -70.4 | -67 | -79 | 0 | 0 | 111.1 | A17 S24 L25 | A17-M21 WeakPolarHBondContact O-CB 3.28Å; A17-M21 VanDerWaalsContact O-CG 3.23Å; A17-M21 WeakPolarHBondContact O-CG 3.24Å; A17-M21 PolarHBondContact O-N 2.71Å; M21-S24 PolarHBondContact O-N 2.79Å; M21-L25 VanDerWaalsContact O-CB 3.31Å; M21-L25 WeakPolarHBondContact O-CB 3.13Å; M21-L25 WeakPolarHBondContact O-CD1 3.13Å; M21-L25 WeakPolarHBondContact O-CG 3.49Å; M21-L25 PolarHBondContact O-N 3.38Å |
| 22 | T | 43.8 | Very low | 44.6 | Very low | 82 Ų | 82 | 92.9 Ų | 92.9 | 50% | 0.503 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -68.9 | -38.7 | 175.8 | 42.3 | 0 | 0 | 0 | 0 | 112.9 | G18 L19 L25 A26 | G18-T22 WeakPolarHBondContact O-CB 2.99Å; G18-T22 WeakPolarHBondContact O-CG2 3.37Å; G18-T22 PolarHBondContact O-N 3.35Å; G18-T22 PolarHBondContact O-OG1 3.46Å; L19-T22 WeakPolarHBondContact CA-OG1 3.44Å; L19-T22 PolarHBondContact O-N 3.38Å; L19-T22 PolarHBondContact O-OG1 3.46Å; T22-L25 PolarHBondContact O-N 3.38Å; T22-A26 VanDerWaalsContact O-CB 3.29Å; T22-A26 WeakPolarHBondContact O-CB 3.1Å; T22-A26 PolarHBondContact O-N 2.89Å |
| 23 | I | 46.1 | Very low | 44.9 | Very low | 74 Ų | 74 | 90.1 Ų | 90.1 | 38% | 0.379 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -66 | -39.9 | 173.1 | -67.3 | 164.6 | 0 | 0 | 0 | 111.1 | L19 L20 A26 K27 | L19-I23 HydrophobicContact CD2-CD1 3.66Å; L19-I23 HydrophobicContact CG-CD1 4.33Å; L19-I23 WeakPolarHBondContact O-CB 3.48Å; L19-I23 WeakPolarHBondContact O-CD1 3.25Å; L19-I23 WeakPolarHBondContact O-CG1 3.45Å; L19-I23 PolarHBondContact O-N 3.17Å; L20-I23 PolarHBondContact O-N 3.45Å; I23-A26 PolarHBondContact O-N 2.69Å; I23-K27 HydrophobicContact CG2-CD 4.49Å; I23-K27 PolarHBondContact O-N 3.07Å |
| 24 | S | 44.1 | Very low | 45.1 | Very low | 69 Ų | 69 | 87.7 Ų | 87.7 | 48% | 0.483 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66.8 | -40.2 | 177.8 | -59.5 | 0 | 0 | 0 | 0 | 111.5 | L20 M21 S28 | L20-S24 VanDerWaalsContact O-CB 3.3Å; L20-S24 WeakPolarHBondContact O-CB 3.5Å; L20-S24 PolarHBondContact O-N 3.19Å; L20-S24 PolarHBondContact O-OG 2.76Å; M21-S24 PolarHBondContact O-N 2.79Å; S24-S28 PolarHBondContact O-N 2.92Å; S24-S28 PolarHBondContact O-OG 3.41Å |
| 25 | L | 41.1 | Very low | 45.6 | Very low | 101 Ų | 101 | 83.2 Ų | 83.2 | 53% | 0.529 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.8 | -43.6 | 170.8 | -81.5 | 160.2 | 0 | 0 | 0 | 111.5 | M21 T22 K27 S28 F29 | M21-L25 VanDerWaalsContact O-CB 3.31Å; M21-L25 WeakPolarHBondContact O-CB 3.13Å; M21-L25 WeakPolarHBondContact O-CD1 3.13Å; M21-L25 WeakPolarHBondContact O-CG 3.49Å; M21-L25 PolarHBondContact O-N 3.38Å; T22-L25 PolarHBondContact O-N 3.38Å; L25-K27 PolarHBondContact O-N 3.48Å; L25-S28 WeakPolarHBondContact CA-OG 3.17Å; L25-S28 PolarHBondContact O-N 3.23Å; L25-S28 PolarHBondContact O-OG 2.97Å; L25-F29 WeakPolarHBondContact O-CB 3.2Å; L25-F29 PolarHBondContact O-N 2.79Å |
| 26 | A | 46.1 | Very low | 45.7 | Very low | 60 Ų | 60 | 85.1 Ų | 85.1 | 50% | 0.496 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.1 | -39.6 | 178 | 0 | 0 | 0 | 0 | 0 | 112.5 | T22 I23 F29 S30 | T22-A26 VanDerWaalsContact O-CB 3.29Å; T22-A26 WeakPolarHBondContact O-CB 3.1Å; T22-A26 PolarHBondContact O-N 2.89Å; I23-A26 PolarHBondContact O-N 2.69Å; A26-F29 PolarHBondContact O-N 3.41Å; A26-S30 VanDerWaalsContact O-CB 3.3Å; A26-S30 WeakPolarHBondContact O-CB 3.47Å; A26-S30 PolarHBondContact O-N 3.44Å |
| 27 | K | 39.2 | Very low | 45.9 | Very low | 152 Ų | 152 | 85.3 Ų | 85.3 | 66% | 0.661 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -66.9 | -41.9 | 174.9 | -79.2 | -177.2 | 175.8 | 175.9 | 0 | 112.4 | I23 L25 S30 F31 | I23-K27 HydrophobicContact CG2-CD 4.49Å; I23-K27 PolarHBondContact O-N 3.07Å; L25-K27 PolarHBondContact O-N 3.48Å; K27-S30 PolarHBondContact O-N 3.36Å; K27-F31 PolarHBondContact O-N 2.96Å |
| 28 | S | 47.8 | Very low | 46.2 | Very low | 65 Ų | 65 | 85.8 Ų | 85.8 | 46% | 0.455 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -68.6 | -35.2 | 176.1 | 42.2 | 0 | 0 | 0 | 0 | 111.9 | S24 L25 F31 A32 | S24-S28 PolarHBondContact O-N 2.92Å; S24-S28 PolarHBondContact O-OG 3.41Å; L25-S28 WeakPolarHBondContact CA-OG 3.17Å; L25-S28 PolarHBondContact O-N 3.23Å; L25-S28 PolarHBondContact O-OG 2.97Å; S28-F31 PolarHBondContact O-N 2.78Å; S28-A32 WeakPolarHBondContact O-CB 3.15Å; S28-A32 PolarHBondContact O-N 3.43Å |
| 29 | F | 47.2 | Very low | 46.8 | Very low | 133 Ų | 133 | 90.8 Ų | 90.8 | 58% | 0.583 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -68.5 | -40.3 | 172.3 | -120 | -96.5 | 0 | 0 | 0 | 112.6 | L25 A26 F31 A32 I33 | L25-F29 WeakPolarHBondContact O-CB 3.2Å; L25-F29 PolarHBondContact O-N 2.79Å; A26-F29 PolarHBondContact O-N 3.41Å; F29-F31 VanDerWaalsContact C-N 3.32Å; F29-F31 PolarHBondContact O-N 3.25Å; F29-A32 PolarHBondContact O-N 3.24Å; F29-I33 HydrophobicContact CD1-CD1 4.01Å; F29-I33 HydrophobicContact CD1-CG1 4.39Å; F29-I33 WeakPolarHBondContact O-CB 3.44Å; F29-I33 WeakPolarHBondContact O-CG1 3.28Å; F29-I33 PolarHBondContact O-N 3.46Å |
| 30 | S | 50.9 | Low | 47.6 | Very low | 80 Ų | 80 | 87.5 Ų | 87.5 | 56% | 0.559 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -61.4 | -40.9 | 175.8 | -175.9 | 0 | 0 | 0 | 0 | 111.5 | A26 K27 A34 | A26-S30 VanDerWaalsContact O-CB 3.3Å; A26-S30 WeakPolarHBondContact O-CB 3.47Å; A26-S30 PolarHBondContact O-N 3.44Å; K27-S30 PolarHBondContact O-N 3.36Å; S30-A34 VanDerWaalsContact O-CB 3.32Å; S30-A34 WeakPolarHBondContact O-CB 3.41Å; S30-A34 PolarHBondContact O-N 3.5Å |
| 31 | F | 47.6 | Very low | 48.4 | Very low | 146 Ų | 146 | 88 Ų | 88 | 64% | 0.64 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -68.8 | -43.1 | 173.9 | -168.6 | -99.2 | 0 | 0 | 0 | 112.2 | K27 S28 F29 I33 A34 V35 | K27-F31 PolarHBondContact O-N 2.96Å; S28-F31 PolarHBondContact O-N 2.78Å; F29-F31 VanDerWaalsContact C-N 3.32Å; F29-F31 PolarHBondContact O-N 3.25Å; F31-I33 VanDerWaalsContact C-N 3.29Å; F31-I33 PolarHBondContact O-N 3.28Å; F31-A34 PolarHBondContact O-N 3.36Å; F31-V35 HydrophobicContact CD1-CG2 4.08Å; F31-V35 HydrophobicContact CE1-CG2 3.74Å; F31-V35 HydrophobicContact CZ-CG2 3.99Å; F31-V35 WeakPolarHBondContact O-CG2 2.92Å; F31-V35 PolarHBondContact O-N 3.49Å |
| 32 | A | 48.1 | Very low | 49.5 | Very low | 44 Ų | 44 | 86 Ų | 86 | 36% | 0.364 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -59.7 | -41 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | S28 F29 V35 L36 | S28-A32 WeakPolarHBondContact O-CB 3.15Å; S28-A32 PolarHBondContact O-N 3.43Å; F29-A32 PolarHBondContact O-N 3.24Å; A32-V35 PolarHBondContact O-N 2.71Å; A32-L36 VanDerWaalsContact O-CB 3.31Å; A32-L36 WeakPolarHBondContact O-CB 3.29Å; A32-L36 PolarHBondContact O-N 2.74Å |
| 33 | I | 50 | Low | 50.3 | Low | 52 Ų | 52 | 86.2 Ų | 86.2 | 27% | 0.267 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -67.3 | -45.4 | 174.1 | -66.5 | 165.9 | 0 | 0 | 0 | 110.6 | F29 F31 V35 L36 V37 I74 | F29-I33 HydrophobicContact CD1-CD1 4.01Å; F29-I33 HydrophobicContact CD1-CG1 4.39Å; F29-I33 WeakPolarHBondContact O-CB 3.44Å; F29-I33 WeakPolarHBondContact O-CG1 3.28Å; F29-I33 PolarHBondContact O-N 3.46Å; F31-I33 VanDerWaalsContact C-N 3.29Å; F31-I33 PolarHBondContact O-N 3.28Å; I33-V35 PolarHBondContact O-N 3.28Å; I33-L36 PolarHBondContact O-N 3.16Å; I33-L36 VanDerWaalsContact O-N 3.16Å; I33-V37 HydrophobicContact CG2-CG2 3.61Å; I33-V37 WeakPolarHBondContact O-CB 3.12Å; I33-V37 WeakPolarHBondContact O-CG2 3.33Å; I33-V37 PolarHBondContact O-N 3.01Å; I33-I74 HydrophobicContact CD1-CD1 4.06Å; I33-I74 HydrophobicContact CD1-CG1 4.29Å; I33-I74 HydrophobicContact CD1-CG2 4.35Å |
| 34 | A | 49.4 | Very low | 50.8 | Low | 64 Ų | 64 | 86.4 Ų | 86.4 | 53% | 0.529 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61 | -25.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | S30 F31 P38 | S30-A34 VanDerWaalsContact O-CB 3.32Å; S30-A34 WeakPolarHBondContact O-CB 3.41Å; S30-A34 PolarHBondContact O-N 3.5Å; F31-A34 PolarHBondContact O-N 3.36Å; A34-P38 WeakPolarHBondContact O-CD 3.16Å; A34-P38 WeakPolarHBondContact O-CG 3.34Å |
| 35 | V | 51.9 | Low | 51.5 | Low | 54 Ų | 54 | 88.6 Ų | 88.6 | 33% | 0.327 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -89 | -36.1 | 173.7 | 176.5 | 0 | 0 | 0 | 0 | 112.1 | F31 A32 I33 K39 | F31-V35 HydrophobicContact CD1-CG2 4.08Å; F31-V35 HydrophobicContact CE1-CG2 3.74Å; F31-V35 HydrophobicContact CZ-CG2 3.99Å; F31-V35 WeakPolarHBondContact O-CG2 2.92Å; F31-V35 PolarHBondContact O-N 3.49Å; A32-V35 PolarHBondContact O-N 2.71Å; I33-V35 PolarHBondContact O-N 3.28Å; V35-K39 HydrophobicContact CG1-CD 4.47Å; V35-K39 WeakPolarHBondContact O-CG 3.25Å |
| 36 | L | 51.4 | Low | 52.5 | Low | 118 Ų | 118 | 92.4 Ų | 92.4 | 62% | 0.618 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -73.6 | -41.5 | 179.7 | -111.1 | 89.9 | 0 | 0 | 0 | 112.3 | A32 I33 K39 A40 | A32-L36 VanDerWaalsContact O-CB 3.31Å; A32-L36 WeakPolarHBondContact O-CB 3.29Å; A32-L36 PolarHBondContact O-N 2.74Å; I33-L36 PolarHBondContact O-N 3.16Å; I33-L36 VanDerWaalsContact O-N 3.16Å; L36-K39 PolarHBondContact O-N 3.46Å; L36-A40 WeakPolarHBondContact O-CB 3.15Å; L36-A40 PolarHBondContact O-N 3.32Å |
| 37 | V | 54.2 | Low | 52.9 | Low | 70 Ų | 70 | 93.6 Ų | 93.6 | 42% | 0.424 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -56.8 | -51.7 | -178 | 172 | 0 | 0 | 0 | 0 | 112 | I33 K39 A40 E41 | I33-V37 HydrophobicContact CG2-CG2 3.61Å; I33-V37 WeakPolarHBondContact O-CB 3.12Å; I33-V37 WeakPolarHBondContact O-CG2 3.33Å; I33-V37 PolarHBondContact O-N 3.01Å; V37-K39 PolarHBondContact O-N 2.76Å; V37-A40 PolarHBondContact O-N 3.27Å; V37-E41 HydrophobicContact CG1-CG 4.49Å; V37-E41 WeakPolarHBondContact O-CB 3.49Å; V37-E41 WeakPolarHBondContact O-CG 3.49Å; V37-E41 PolarHBondContact O-N 2.83Å |
| 38 | P | 51.5 | Low | 53.7 | Low | 59 Ų | 59 | 92.8 Ų | 92.8 | 38% | 0.383 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -68.2 | -35.7 | 179 | 25.3 | -33.8 | 0 | 0 | 0 | 112.2 | A34 A40 E41 V42 | A34-P38 WeakPolarHBondContact O-CD 3.16Å; A34-P38 WeakPolarHBondContact O-CG 3.34Å; P38-A40 VanDerWaalsContact C-N 3.32Å; P38-A40 PolarHBondContact O-N 3.36Å; P38-E41 PolarHBondContact O-N 3.35Å; P38-V42 WeakPolarHBondContact O-CG2 3.19Å; P38-V42 PolarHBondContact O-N 2.85Å |
| 39 | K | 54.2 | Low | 54.3 | Low | 144 Ų | 144 | 98.1 Ų | 98.1 | 63% | 0.626 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -63.5 | -41.9 | 173.9 | -79.7 | -175.7 | 175.8 | 176.7 | 0 | 111.4 | V35 L36 V37 V42 V43 | V35-K39 HydrophobicContact CG1-CD 4.47Å; V35-K39 WeakPolarHBondContact O-CG 3.25Å; L36-K39 PolarHBondContact O-N 3.46Å; V37-K39 PolarHBondContact O-N 2.76Å; K39-V42 PolarHBondContact O-N 3.3Å; K39-V43 VanDerWaalsContact O-CG2 3.25Å; K39-V43 WeakPolarHBondContact O-CG2 3.47Å; K39-V43 PolarHBondContact O-N 3.29Å |
| 40 | A | 55.3 | Low | 54.7 | Low | 33 Ų | 33 | 97.9 Ų | 97.9 | 27% | 0.273 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -65.5 | -46.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | L36 V37 P38 V42 V43 F44 | L36-A40 WeakPolarHBondContact O-CB 3.15Å; L36-A40 PolarHBondContact O-N 3.32Å; V37-A40 PolarHBondContact O-N 3.27Å; P38-A40 VanDerWaalsContact C-N 3.32Å; P38-A40 PolarHBondContact O-N 3.36Å; A40-V42 VanDerWaalsContact C-N 3.35Å; A40-V42 PolarHBondContact O-N 2.89Å; A40-V43 CarbonylContact O-C 3.58Å; A40-V43 PolarHBondContact O-N 2.88Å; A40-V43 VanDerWaalsContact O-N 3.16Å; A40-F44 HydrophobicContact CB-CD2 3.93Å; A40-F44 HydrophobicContact CB-CE2 3.52Å; A40-F44 HydrophobicContact CB-CZ 4.45Å; A40-F44 VanDerWaalsContact O-CB 3.3Å; A40-F44 WeakPolarHBondContact O-CB 3.3Å; A40-F44 WeakPolarHBondContact O-CD2 3.3Å; A40-F44 WeakPolarHBondContact O-CG 2.81Å; A40-F44 PolarHBondContact O-N 3.37Å |
| 41 | E | 56.6 | Low | 54.8 | Low | 122 Ų | 122 | 96.9 Ų | 96.9 | 57% | 0.57 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -56 | -43.9 | 175.5 | -77.8 | -172.5 | 153 | 0 | 0 | 112.7 | V37 P38 F44 D45 | V37-E41 HydrophobicContact CG1-CG 4.49Å; V37-E41 WeakPolarHBondContact O-CB 3.49Å; V37-E41 WeakPolarHBondContact O-CG 3.49Å; V37-E41 PolarHBondContact O-N 2.83Å; P38-E41 PolarHBondContact O-N 3.35Å; E41-F44 CarbonylContact O-C 3.51Å; E41-F44 WeakPolarHBondContact O-CB 3.08Å; E41-F44 PolarHBondContact O-N 2.93Å; E41-D45 PolarHBondContact O-N 2.8Å |
| 42 | V | 63.4 | Low | 54.8 | Low | 84 Ų | 84 | 93.6 Ų | 93.6 | 51% | 0.509 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -66.8 | -42 | 176.7 | 173.4 | 0 | 0 | 0 | 0 | 111.7 | P38 K39 A40 F44 D45 R46 | P38-V42 WeakPolarHBondContact O-CG2 3.19Å; P38-V42 PolarHBondContact O-N 2.85Å; K39-V42 PolarHBondContact O-N 3.3Å; A40-V42 VanDerWaalsContact C-N 3.35Å; A40-V42 PolarHBondContact O-N 2.89Å; V42-F44 PolarHBondContact O-N 3.18Å; V42-D45 PolarHBondContact O-N 3.16Å; V42-R46 WeakPolarHBondContact O-CG 3.42Å; V42-R46 PolarHBondContact O-N 3.01Å |
| 43 | V | 60.3 | Low | 55.1 | Low | 87 Ų | 87 | 96.5 Ų | 96.5 | 53% | 0.527 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.4 | -38 | 172.6 | 172.2 | 0 | 0 | 0 | 0 | 109.9 | K39 A40 R46 L47 | K39-V43 VanDerWaalsContact O-CG2 3.25Å; K39-V43 WeakPolarHBondContact O-CG2 3.47Å; K39-V43 PolarHBondContact O-N 3.29Å; A40-V43 CarbonylContact O-C 3.58Å; A40-V43 PolarHBondContact O-N 2.88Å; A40-V43 VanDerWaalsContact O-N 3.16Å; V43-R46 PolarHBondContact O-N 3.38Å; V43-L47 VanDerWaalsContact O-CB 3.25Å; V43-L47 WeakPolarHBondContact O-CB 3.08Å; V43-L47 PolarHBondContact O-N 3.21Å |
| 44 | F | 55.6 | Low | 55.3 | Low | 78 Ų | 78 | 102.1 Ų | 102.1 | 34% | 0.342 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -70.7 | -37.6 | 178.8 | -72.8 | -54.1 | 0 | 0 | 0 | 112.6 | A40 E41 V42 R46 L47 K48 Y63 | A40-F44 HydrophobicContact CB-CD2 3.93Å; A40-F44 HydrophobicContact CB-CE2 3.52Å; A40-F44 HydrophobicContact CB-CZ 4.45Å; A40-F44 VanDerWaalsContact O-CB 3.3Å; A40-F44 WeakPolarHBondContact O-CB 3.3Å; A40-F44 WeakPolarHBondContact O-CD2 3.3Å; A40-F44 WeakPolarHBondContact O-CG 2.81Å; A40-F44 PolarHBondContact O-N 3.37Å; E41-F44 CarbonylContact O-C 3.51Å; E41-F44 WeakPolarHBondContact O-CB 3.08Å; E41-F44 PolarHBondContact O-N 2.93Å; V42-F44 PolarHBondContact O-N 3.18Å; F44-R46 VanDerWaalsContact C-N 3.28Å; F44-R46 PolarHBondContact O-N 3.4Å; F44-L47 PolarHBondContact O-N 2.88Å; F44-K48 WeakPolarHBondContact O-CA 3.4Å; F44-K48 WeakPolarHBondContact O-CB 3.44Å; F44-K48 PolarHBondContact O-N 3.19Å; F44-Y63 AromaticContact CD1-CE2 3.9Å; F44-Y63 HydrophobicContact CD1-CE2 3.9Å; F44-Y63 AromaticContact CD1-CZ 3.87Å; F44-Y63 WeakPolarHBondContact CD1-OH 3.21Å; F44-Y63 WeakPolarHBondContact CD2-OH 3.35Å; F44-Y63 AromaticContact CE1-CE2 3.4Å; F44-Y63 HydrophobicContact CE1-CE2 3.4Å; F44-Y63 VanDerWaalsContact CE1-CE2 3.4Å; F44-Y63 AromaticContact CE1-CZ 3.71Å; F44-Y63 WeakPolarHBondContact CE1-OH 3.29Å; F44-Y63 WeakPolarHBondContact CE2-OH 3.35Å; F44-Y63 WeakPolarHBondContact CG-OH 3.35Å; F44-Y63 AromaticContact CZ-CE2 3.81Å; F44-Y63 HydrophobicContact CZ-CE2 3.81Å; F44-Y63 AromaticContact CZ-CZ 3.92Å; F44-Y63 WeakPolarHBondContact CZ-OH 3.41Å |
| 45 | D | 60 | Low | 55.2 | Low | 115 Ų | 115 | 103 Ų | 103 | 62% | 0.615 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -63.4 | -39.8 | 174.2 | -111.9 | -34 | 0 | 0 | 0 | 110.6 | E41 V42 K49 | E41-D45 PolarHBondContact O-N 2.8Å; V42-D45 PolarHBondContact O-N 3.16Å; D45-K49 VanDerWaalsContact O-CB 3.27Å; D45-K49 WeakPolarHBondContact O-CB 3.32Å; D45-K49 PolarHBondContact O-N 2.95Å |
| 46 | R | 61.9 | Low | 55.1 | Low | 181 Ų | 181 | 104.4 Ų | 104.4 | 68% | 0.683 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -66 | -49.5 | 173 | -68.8 | -176 | -177.5 | -150.7 | 1 | 111.6 | V42 V43 F44 K48 K49 D50 | V42-R46 WeakPolarHBondContact O-CG 3.42Å; V42-R46 PolarHBondContact O-N 3.01Å; V43-R46 PolarHBondContact O-N 3.38Å; F44-R46 VanDerWaalsContact C-N 3.28Å; F44-R46 PolarHBondContact O-N 3.4Å; R46-K48 VanDerWaalsContact C-N 3.32Å; R46-K48 PolarHBondContact O-N 2.85Å; R46-K49 PolarHBondContact O-N 3.39Å; R46-K49 VanDerWaalsContact O-N 3.16Å; R46-D50 PolarHBondContact O-N 2.79Å |
| 47 | L | 54.9 | Low | 55.4 | Low | 85 Ų | 85 | 103.7 Ų | 103.7 | 45% | 0.445 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63.9 | -38.8 | -178.8 | -153.3 | 98.6 | 0 | 0 | 0 | 111.8 | V43 F44 D50 I51 | V43-L47 VanDerWaalsContact O-CB 3.25Å; V43-L47 WeakPolarHBondContact O-CB 3.08Å; V43-L47 PolarHBondContact O-N 3.21Å; F44-L47 PolarHBondContact O-N 2.88Å; L47-D50 PolarHBondContact O-N 3.39Å; L47-I51 HydrophobicContact CD1-CD1 4.11Å; L47-I51 HydrophobicContact CD2-CD1 3.73Å; L47-I51 HydrophobicContact CG-CD1 3.5Å; L47-I51 HydrophobicContact CG-CG1 4.31Å; L47-I51 VanDerWaalsContact O-CB 3.28Å; L47-I51 WeakPolarHBondContact O-CB 3.49Å; L47-I51 WeakPolarHBondContact O-CG1 3.44Å; L47-I51 PolarHBondContact O-N 3.14Å |
| 48 | K | 54.9 | Low | 55.3 | Low | 135 Ų | 135 | 103.4 Ų | 103.4 | 59% | 0.587 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -63.9 | -48.3 | 173.6 | -176.2 | 177.8 | 179.8 | -174.4 | 0 | 109.2 | F44 R46 D50 I51 V52 | F44-K48 WeakPolarHBondContact O-CA 3.4Å; F44-K48 WeakPolarHBondContact O-CB 3.44Å; F44-K48 PolarHBondContact O-N 3.19Å; R46-K48 VanDerWaalsContact C-N 3.32Å; R46-K48 PolarHBondContact O-N 2.85Å; K48-D50 VanDerWaalsContact C-N 3.27Å; K48-D50 PolarHBondContact O-N 3.17Å; K48-I51 PolarHBondContact O-N 2.66Å; K48-V52 HydrophobicContact CB-CG2 4.27Å; K48-V52 HydrophobicContact CD-CG2 4.36Å; K48-V52 HydrophobicContact CG-CG2 3.27Å; K48-V52 WeakPolarHBondContact O-CA 3.49Å; K48-V52 WeakPolarHBondContact O-CB 3.3Å; K48-V52 WeakPolarHBondContact O-CG2 3.43Å; K48-V52 PolarHBondContact O-N 3.09Å |
| 49 | K | 61.2 | Low | 55.6 | Low | 177 Ų | 177 | 107.3 Ų | 107.3 | 77% | 0.77 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -61.1 | -36.5 | 178.4 | -165.1 | 172.2 | -179 | 175.1 | 0 | 112.8 | D45 R46 | D45-K49 VanDerWaalsContact O-CB 3.27Å; D45-K49 WeakPolarHBondContact O-CB 3.32Å; D45-K49 PolarHBondContact O-N 2.95Å; R46-K49 PolarHBondContact O-N 3.39Å; R46-K49 VanDerWaalsContact O-N 3.16Å |
| 50 | D | 56.6 | Low | 55.6 | Low | 128 Ų | 128 | 105.3 Ų | 105.3 | 68% | 0.684 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -80.7 | -29.1 | -179.8 | -71 | -24.2 | 0 | 0 | 0 | 113.6 | R46 L47 K48 | R46-D50 PolarHBondContact O-N 2.79Å; L47-D50 PolarHBondContact O-N 3.39Å; K48-D50 VanDerWaalsContact C-N 3.27Å; K48-D50 PolarHBondContact O-N 3.17Å |
| 51 | I | 51.1 | Low | 55.6 | Low | 58 Ų | 58 | 110.2 Ų | 110.2 | 30% | 0.297 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -111.9 | -15.6 | -172.5 | -47.2 | 175.6 | 0 | 0 | 0 | 113.6 | L47 K48 P53 H54 F55 | L47-I51 HydrophobicContact CD1-CD1 4.11Å; L47-I51 HydrophobicContact CD2-CD1 3.73Å; L47-I51 HydrophobicContact CG-CD1 3.5Å; L47-I51 HydrophobicContact CG-CG1 4.31Å; L47-I51 VanDerWaalsContact O-CB 3.28Å; L47-I51 WeakPolarHBondContact O-CB 3.49Å; L47-I51 WeakPolarHBondContact O-CG1 3.44Å; L47-I51 PolarHBondContact O-N 3.14Å; K48-I51 PolarHBondContact O-N 2.66Å; I51-P53 VanDerWaalsContact C-N 3.31Å; I51-P53 VanDerWaalsContact O-N 3.12Å; I51-H54 PolarHBondContact O-N 3.36Å; I51-F55 HydrophobicContact CB-CD2 4.12Å; I51-F55 HydrophobicContact CB-CE2 3.43Å; I51-F55 VanDerWaalsContact CB-CE2 3.43Å; I51-F55 HydrophobicContact CB-CZ 3.98Å; I51-F55 HydrophobicContact CG2-CD2 3.73Å; I51-F55 HydrophobicContact CG2-CE1 3.99Å; I51-F55 HydrophobicContact CG2-CE2 3.1Å; I51-F55 HydrophobicContact CG2-CG 4.44Å; I51-F55 HydrophobicContact CG2-CZ 3.25Å; I51-F55 WeakPolarHBondContact O-CD2 3.31Å |
| 52 | V | 49.2 | Very low | 55.8 | Low | 78 Ų | 78 | 109.1 Ų | 109.1 | 47% | 0.473 | 56% | 0.562 | S | S | . | * | G | 310 helix | trans | -49.1 | -35.7 | 177.4 | 157.4 | 0 | 0 | 0 | 0 | 115.6 | K48 H54 | K48-V52 HydrophobicContact CB-CG2 4.27Å; K48-V52 HydrophobicContact CD-CG2 4.36Å; K48-V52 HydrophobicContact CG-CG2 3.27Å; K48-V52 WeakPolarHBondContact O-CA 3.49Å; K48-V52 WeakPolarHBondContact O-CB 3.3Å; K48-V52 WeakPolarHBondContact O-CG2 3.43Å; K48-V52 PolarHBondContact O-N 3.09Å; V52-H54 PolarHBondContact O-N 3.19Å; V52-H54 VanDerWaalsContact O-N 3.11Å |
| 53 | P | 54.5 | Low | 55.6 | Low | 105 Ų | 105 | 109.5 Ų | 109.5 | 68% | 0.682 | 56% | 0.555 | S | S | * | * | G | 310 helix | trans | -66.3 | -11.5 | 177.7 | 22.9 | -31.7 | 0 | 0 | 0 | 114.6 | I51 | I51-P53 VanDerWaalsContact C-N 3.31Å; I51-P53 VanDerWaalsContact O-N 3.12Å |
| 54 | H | 54.4 | Low | 55.6 | Low | 169 Ų | 169 | 111.8 Ų | 111.8 | 78% | 0.782 | 56% | 0.558 | S | S | * | * | G | 310 helix | trans | -110.8 | -2.1 | -177 | -88.7 | -67.2 | 0 | 0 | 0 | 115.9 | I51 V52 S56 | I51-H54 PolarHBondContact O-N 3.36Å; V52-H54 PolarHBondContact O-N 3.19Å; V52-H54 VanDerWaalsContact O-N 3.11Å; H54-S56 PolarHBondContact O-N 3.27Å |
| 55 | F | 45.9 | Very low | 55.9 | Low | 84 Ų | 84 | 111.4 Ų | 111.4 | 37% | 0.368 | 56% | 0.558 | S | S | . | * | trans | -87.2 | 104.8 | -170.3 | -80.2 | -56.3 | 0 | 0 | 0 | 114 | I51 Y59 | I51-F55 HydrophobicContact CB-CD2 4.12Å; I51-F55 HydrophobicContact CB-CE2 3.43Å; I51-F55 VanDerWaalsContact CB-CE2 3.43Å; I51-F55 HydrophobicContact CB-CZ 3.98Å; I51-F55 HydrophobicContact CG2-CD2 3.73Å; I51-F55 HydrophobicContact CG2-CE1 3.99Å; I51-F55 HydrophobicContact CG2-CE2 3.1Å; I51-F55 HydrophobicContact CG2-CG 4.44Å; I51-F55 HydrophobicContact CG2-CZ 3.25Å; I51-F55 WeakPolarHBondContact O-CD2 3.31Å; F55-Y59 HydrophobicContact CD1-CD1 4.14Å; F55-Y59 AromaticContact CD1-CD2 3.63Å; F55-Y59 HydrophobicContact CD1-CD2 3.63Å; F55-Y59 HydrophobicContact CD1-CE2 4.48Å; F55-Y59 AromaticContact CD1-CG 3.41Å; F55-Y59 HydrophobicContact CD1-CG 3.41Å; F55-Y59 VanDerWaalsContact CD1-CG 3.41Å; F55-Y59 VanDerWaalsContact CE1-CB 3.45Å; F55-Y59 AromaticContact CE1-CD1 3.58Å; F55-Y59 HydrophobicContact CE1-CD1 3.58Å; F55-Y59 AromaticContact CE1-CD2 3.87Å; F55-Y59 HydrophobicContact CE1-CD2 3.87Å; F55-Y59 HydrophobicContact CE1-CE1 4.25Å; F55-Y59 HydrophobicContact CE1-CE2 4.49Å; F55-Y59 AromaticContact CE1-CG 3.35Å; F55-Y59 HydrophobicContact CE1-CG 3.35Å | ||
| 56 | S | 51.1 | Low | 56.2 | Low | 83 Ų | 83 | 110 Ų | 110 | 58% | 0.58 | 55% | 0.554 | S | S | * | * | trans | -60.4 | 143.3 | 155.7 | -173.7 | 0 | 0 | 0 | 0 | 110 | H54 S58 Y59 | H54-S56 PolarHBondContact O-N 3.27Å; S56-S58 PolarHBondContact O-N 2.89Å; S56-Y59 PolarHBondContact O-N 3.19Å; S56-Y59 VanDerWaalsContact O-N 3.14Å | ||
| 57 | S | 56.3 | Low | 56.3 | Low | 103 Ų | 103 | 104.6 Ų | 104.6 | 72% | 0.72 | 54% | 0.538 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -47.8 | -18.8 | -174.3 | -173.9 | 0 | 0 | 0 | 0 | 115.8 | ||
| 58 | S | 52.8 | Low | 56.1 | Low | 64 Ų | 64 | 102.4 Ų | 102.4 | 45% | 0.448 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -67.6 | -32.5 | 179.7 | 53.5 | 0 | 0 | 0 | 0 | 114.2 | S56 F61 L62 | S56-S58 PolarHBondContact O-N 2.89Å; S58-F61 WeakPolarHBondContact O-CB 3.2Å; S58-F61 PolarHBondContact O-N 3.47Å; S58-L62 PolarHBondContact O-N 3.4Å; S58-L62 VanDerWaalsContact O-N 3.09Å |
| 59 | Y | 56.7 | Low | 56 | Low | 140 Ų | 140 | 104.2 Ų | 104.2 | 55% | 0.549 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -75.6 | -35.3 | -176.9 | -85.7 | -84.8 | 0 | 0 | 0 | 113.1 | F55 S56 F61 L62 Y63 | F55-Y59 HydrophobicContact CD1-CD1 4.14Å; F55-Y59 AromaticContact CD1-CD2 3.63Å; F55-Y59 HydrophobicContact CD1-CD2 3.63Å; F55-Y59 HydrophobicContact CD1-CE2 4.48Å; F55-Y59 AromaticContact CD1-CG 3.41Å; F55-Y59 HydrophobicContact CD1-CG 3.41Å; F55-Y59 VanDerWaalsContact CD1-CG 3.41Å; F55-Y59 VanDerWaalsContact CE1-CB 3.45Å; F55-Y59 AromaticContact CE1-CD1 3.58Å; F55-Y59 HydrophobicContact CE1-CD1 3.58Å; F55-Y59 AromaticContact CE1-CD2 3.87Å; F55-Y59 HydrophobicContact CE1-CD2 3.87Å; F55-Y59 HydrophobicContact CE1-CE1 4.25Å; F55-Y59 HydrophobicContact CE1-CE2 4.49Å; F55-Y59 AromaticContact CE1-CG 3.35Å; F55-Y59 HydrophobicContact CE1-CG 3.35Å; S56-Y59 PolarHBondContact O-N 3.19Å; S56-Y59 VanDerWaalsContact O-N 3.14Å; Y59-F61 PolarHBondContact O-N 3.44Å; Y59-L62 PolarHBondContact O-N 3.26Å; Y59-Y63 VanDerWaalsContact O-CB 3.24Å; Y59-Y63 WeakPolarHBondContact O-CB 3.07Å; Y59-Y63 PolarHBondContact O-N 3.46Å |
| 60 | V | 54.7 | Low | 55.7 | Low | 102 Ų | 102 | 101 Ų | 101 | 62% | 0.618 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -61.2 | -36.2 | 173.1 | -178.6 | 0 | 0 | 0 | 0 | 110.3 | Y63 F64 | V60-Y63 PolarHBondContact O-N 2.84Å; V60-F64 PolarHBondContact O-N 3.27Å |
| 61 | F | 56.3 | Low | 55.5 | Low | 137 Ų | 137 | 102.8 Ų | 102.8 | 60% | 0.601 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -69.8 | -47.1 | 177 | -169.4 | -104.1 | 0 | 0 | 0 | 112.8 | S58 Y59 Y63 F64 I65 | S58-F61 WeakPolarHBondContact O-CB 3.2Å; S58-F61 PolarHBondContact O-N 3.47Å; Y59-F61 PolarHBondContact O-N 3.44Å; F61-Y63 PolarHBondContact O-N 3.49Å; F61-F64 PolarHBondContact O-N 3.29Å; F61-I65 HydrophobicContact CD1-CD1 3.7Å; F61-I65 HydrophobicContact CE1-CD1 3.51Å; F61-I65 HydrophobicContact CE1-CG1 4.38Å; F61-I65 HydrophobicContact CZ-CD1 4.26Å; F61-I65 WeakPolarHBondContact O-CG1 3.5Å; F61-I65 PolarHBondContact O-N 3.05Å |
| 62 | L | 60.7 | Low | 55.5 | Low | 98 Ų | 98 | 107.2 Ų | 107.2 | 51% | 0.513 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -57.9 | -39.9 | 172.9 | -84 | 164.1 | 0 | 0 | 0 | 111.6 | S58 Y59 I65 V66 | S58-L62 PolarHBondContact O-N 3.4Å; S58-L62 VanDerWaalsContact O-N 3.09Å; Y59-L62 PolarHBondContact O-N 3.26Å; L62-I65 WeakPolarHBondContact O-CB 3.35Å; L62-I65 PolarHBondContact O-N 3.24Å; L62-V66 WeakPolarHBondContact O-CG2 3.32Å; L62-V66 PolarHBondContact O-N 2.86Å |
| 63 | Y | 57.8 | Low | 55.5 | Low | 93 Ų | 93 | 109.1 Ų | 109.1 | 37% | 0.365 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -64.9 | -43 | 178.2 | -173 | -101.4 | 0 | 0 | 0 | 112.5 | F44 Y59 V60 F61 I65 V66 I67 | F44-Y63 AromaticContact CD1-CE2 3.9Å; F44-Y63 HydrophobicContact CD1-CE2 3.9Å; F44-Y63 AromaticContact CD1-CZ 3.87Å; F44-Y63 WeakPolarHBondContact CD1-OH 3.21Å; F44-Y63 WeakPolarHBondContact CD2-OH 3.35Å; F44-Y63 AromaticContact CE1-CE2 3.4Å; F44-Y63 HydrophobicContact CE1-CE2 3.4Å; F44-Y63 VanDerWaalsContact CE1-CE2 3.4Å; F44-Y63 AromaticContact CE1-CZ 3.71Å; F44-Y63 WeakPolarHBondContact CE1-OH 3.29Å; F44-Y63 WeakPolarHBondContact CE2-OH 3.35Å; F44-Y63 WeakPolarHBondContact CG-OH 3.35Å; F44-Y63 AromaticContact CZ-CE2 3.81Å; F44-Y63 HydrophobicContact CZ-CE2 3.81Å; F44-Y63 AromaticContact CZ-CZ 3.92Å; F44-Y63 WeakPolarHBondContact CZ-OH 3.41Å; Y59-Y63 VanDerWaalsContact O-CB 3.24Å; Y59-Y63 WeakPolarHBondContact O-CB 3.07Å; Y59-Y63 PolarHBondContact O-N 3.46Å; V60-Y63 PolarHBondContact O-N 2.84Å; F61-Y63 PolarHBondContact O-N 3.49Å; Y63-I65 VanDerWaalsContact C-N 3.3Å; Y63-I65 PolarHBondContact O-N 2.82Å; Y63-V66 PolarHBondContact O-N 2.91Å; Y63-I67 HydrophobicContact CD1-CD1 3.89Å; Y63-I67 HydrophobicContact CE1-CD1 3.26Å; Y63-I67 HydrophobicContact CE1-CG1 4.25Å; Y63-I67 HydrophobicContact CE2-CD1 4.45Å; Y63-I67 PolarHBondContact O-N 3.03Å |
| 64 | F | 61.8 | Low | 55.2 | Low | 134 Ų | 134 | 107.5 Ų | 107.5 | 59% | 0.588 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -58.8 | -42.1 | 172 | -174.7 | -100.2 | 0 | 0 | 0 | 111.5 | V60 F61 V66 I67 C68 | V60-F64 PolarHBondContact O-N 3.27Å; F61-F64 PolarHBondContact O-N 3.29Å; F64-V66 PolarHBondContact O-N 3.44Å; F64-I67 PolarHBondContact O-N 3.4Å; F64-C68 VanDerWaalsContact CE1-SG 3.56Å; F64-C68 VanDerWaalsContact O-CB 3.28Å; F64-C68 WeakPolarHBondContact O-CB 3.35Å; F64-C68 PolarHBondContact O-N 2.91Å; F64-C68 PolarHBondContact O-SG 3.02Å; F64-C68 VanDerWaalsContact O-SG 3.38Å |
| 65 | I | 61.9 | Low | 54.9 | Low | 70 Ų | 70 | 106.4 Ų | 106.4 | 36% | 0.359 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.8 | -43.4 | 176 | -67.6 | 166.4 | 0 | 0 | 0 | 111.5 | F61 L62 Y63 C68 R69 | F61-I65 HydrophobicContact CD1-CD1 3.7Å; F61-I65 HydrophobicContact CE1-CD1 3.51Å; F61-I65 HydrophobicContact CE1-CG1 4.38Å; F61-I65 HydrophobicContact CZ-CD1 4.26Å; F61-I65 WeakPolarHBondContact O-CG1 3.5Å; F61-I65 PolarHBondContact O-N 3.05Å; L62-I65 WeakPolarHBondContact O-CB 3.35Å; L62-I65 PolarHBondContact O-N 3.24Å; Y63-I65 VanDerWaalsContact C-N 3.3Å; Y63-I65 PolarHBondContact O-N 2.82Å; I65-C68 PolarHBondContact O-N 3.31Å; I65-R69 HydrophobicContact CG2-CG 4.34Å; I65-R69 VanDerWaalsContact O-CB 3.29Å; I65-R69 WeakPolarHBondContact O-CB 3.48Å; I65-R69 WeakPolarHBondContact O-CG 3.22Å; I65-R69 PolarHBondContact O-N 3.45Å |
| 66 | V | 64.7 | Low | 54.7 | Low | 85 Ų | 85 | 107.6 Ų | 107.6 | 52% | 0.515 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -64.1 | -45.3 | -179.8 | 172.2 | 0 | 0 | 0 | 0 | 110.9 | L62 Y63 F64 R69 L70 | L62-V66 WeakPolarHBondContact O-CG2 3.32Å; L62-V66 PolarHBondContact O-N 2.86Å; Y63-V66 PolarHBondContact O-N 2.91Å; F64-V66 PolarHBondContact O-N 3.44Å; V66-R69 PolarHBondContact O-N 2.72Å; V66-L70 WeakPolarHBondContact O-CB 3.31Å; V66-L70 PolarHBondContact O-N 3.33Å |
| 67 | I | 64.3 | Low | 54.3 | Low | 68 Ų | 68 | 111.5 Ų | 111.5 | 35% | 0.349 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -64.7 | -44.3 | 176.9 | -68 | 178.4 | 0 | 0 | 0 | 111 | Y63 F64 L70 R71 | Y63-I67 HydrophobicContact CD1-CD1 3.89Å; Y63-I67 HydrophobicContact CE1-CD1 3.26Å; Y63-I67 HydrophobicContact CE1-CG1 4.25Å; Y63-I67 HydrophobicContact CE2-CD1 4.45Å; Y63-I67 PolarHBondContact O-N 3.03Å; F64-I67 PolarHBondContact O-N 3.4Å; I67-L70 PolarHBondContact O-N 2.93Å; I67-R71 PolarHBondContact O-N 2.75Å |
| 68 | C | 51.6 | Low | 53.4 | Low | 40 Ų | 40 | 108.8 Ų | 108.8 | 27% | 0.27 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -61.7 | -43.1 | 176.3 | -78.8 | 0 | 0 | 0 | 0 | 111.6 | F64 I65 R71 F72 | F64-C68 VanDerWaalsContact CE1-SG 3.56Å; F64-C68 VanDerWaalsContact O-CB 3.28Å; F64-C68 WeakPolarHBondContact O-CB 3.35Å; F64-C68 PolarHBondContact O-N 2.91Å; F64-C68 PolarHBondContact O-SG 3.02Å; F64-C68 VanDerWaalsContact O-SG 3.38Å; I65-C68 PolarHBondContact O-N 3.31Å; C68-R71 PolarHBondContact O-N 3.47Å; C68-F72 WeakPolarHBondContact O-CB 3.22Å; C68-F72 WeakPolarHBondContact O-CD2 3.47Å; C68-F72 PolarHBondContact O-N 3.48Å |
| 69 | R | 51.4 | Low | 52.5 | Low | 172 Ų | 172 | 107.2 Ų | 107.2 | 65% | 0.649 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -62.2 | -42.6 | 174.7 | -87.8 | -112 | -175.7 | -173.7 | 1 | 111.7 | I65 V66 R71 F72 M73 | I65-R69 HydrophobicContact CG2-CG 4.34Å; I65-R69 VanDerWaalsContact O-CB 3.29Å; I65-R69 WeakPolarHBondContact O-CB 3.48Å; I65-R69 WeakPolarHBondContact O-CG 3.22Å; I65-R69 PolarHBondContact O-N 3.45Å; V66-R69 PolarHBondContact O-N 2.72Å; R69-R71 VanDerWaalsContact C-N 3.35Å; R69-F72 PolarHBondContact O-N 2.76Å; R69-M73 WeakPolarHBondContact O-CG 3.47Å; R69-M73 PolarHBondContact O-N 3.33Å |
| 70 | L | 56.2 | Low | 51.4 | Low | 111 Ų | 111 | 104.2 Ų | 104.2 | 58% | 0.581 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -60 | -48.8 | 175.5 | -128.4 | 87 | 0 | 0 | 0 | 110 | V66 I67 F72 M73 I74 | V66-L70 WeakPolarHBondContact O-CB 3.31Å; V66-L70 PolarHBondContact O-N 3.33Å; I67-L70 PolarHBondContact O-N 2.93Å; L70-F72 PolarHBondContact O-N 2.9Å; L70-M73 PolarHBondContact O-N 3.21Å; L70-I74 WeakPolarHBondContact O-CB 3.37Å; L70-I74 WeakPolarHBondContact O-CD1 3.23Å; L70-I74 WeakPolarHBondContact O-CG1 3.47Å; L70-I74 PolarHBondContact O-N 2.91Å |
| 71 | R | 51.9 | Low | 50.6 | Low | 164 Ų | 164 | 102.6 Ų | 102.6 | 62% | 0.619 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -62 | -40.7 | 176.5 | -75.8 | -163.7 | 177.5 | -159.4 | 1.2 | 112.4 | I67 C68 R69 I74 F75 | I67-R71 PolarHBondContact O-N 2.75Å; C68-R71 PolarHBondContact O-N 3.47Å; R69-R71 VanDerWaalsContact C-N 3.35Å; R71-I74 WeakPolarHBondContact O-CB 3.3Å; R71-I74 PolarHBondContact O-N 2.81Å; R71-F75 WeakPolarHBondContact O-CB 3.43Å; R71-F75 VanDerWaalsContact O-CD2 3.3Å; R71-F75 WeakPolarHBondContact O-CD2 3.39Å; R71-F75 PolarHBondContact O-N 2.96Å |
| 72 | F | 51.8 | Low | 49.4 | Very low | 152 Ų | 152 | 97.9 Ų | 97.9 | 67% | 0.667 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -67.6 | -41.2 | 177.2 | -98.2 | -79.4 | 0 | 0 | 0 | 111.9 | C68 R69 L70 I74 F75 D76 | C68-F72 WeakPolarHBondContact O-CB 3.22Å; C68-F72 WeakPolarHBondContact O-CD2 3.47Å; C68-F72 PolarHBondContact O-N 3.48Å; R69-F72 PolarHBondContact O-N 2.76Å; L70-F72 PolarHBondContact O-N 2.9Å; F72-I74 VanDerWaalsContact C-N 3.25Å; F72-I74 PolarHBondContact O-N 3.46Å; F72-F75 CarbonylContact O-C 3.51Å; F72-F75 PolarHBondContact O-N 2.68Å; F72-D76 WeakPolarHBondContact O-CA 3.41Å; F72-D76 WeakPolarHBondContact O-CB 3.44Å; F72-D76 PolarHBondContact O-N 2.92Å |
| 73 | M | 49.6 | Very low | 47.9 | Very low | 117 Ų | 117 | 100.3 Ų | 100.3 | 58% | 0.576 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61 | -37.8 | 172.3 | -70.3 | -163.8 | -155.4 | 0 | 0 | 111.7 | R69 L70 Q77 | R69-M73 WeakPolarHBondContact O-CG 3.47Å; R69-M73 PolarHBondContact O-N 3.33Å; L70-M73 PolarHBondContact O-N 3.21Å; M73-Q77 PolarHBondContact O-N 3.48Å |
| 74 | I | 48 | Very low | 46.9 | Very low | 71 Ų | 71 | 102.3 Ų | 102.3 | 36% | 0.364 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.1 | -44.1 | 176.4 | -66.8 | 160.1 | 0 | 0 | 0 | 111.4 | I33 L70 R71 F72 G78 | I33-I74 HydrophobicContact CD1-CD1 4.06Å; I33-I74 HydrophobicContact CD1-CG1 4.29Å; I33-I74 HydrophobicContact CD1-CG2 4.35Å; L70-I74 WeakPolarHBondContact O-CB 3.37Å; L70-I74 WeakPolarHBondContact O-CD1 3.23Å; L70-I74 WeakPolarHBondContact O-CG1 3.47Å; L70-I74 PolarHBondContact O-N 2.91Å; R71-I74 WeakPolarHBondContact O-CB 3.3Å; R71-I74 PolarHBondContact O-N 2.81Å; F72-I74 VanDerWaalsContact C-N 3.25Å; F72-I74 PolarHBondContact O-N 3.46Å; I74-G78 PolarHBondContact O-N 3.04Å; I74-G78 VanDerWaalsContact O-N 3.09Å |
| 75 | F | 46.4 | Very low | 45.4 | Very low | 147 Ų | 147 | 98.1 Ų | 98.1 | 65% | 0.645 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -83.2 | -19.8 | 179.4 | -83.7 | -77.7 | 0 | 0 | 0 | 113.9 | R71 F72 G79 | R71-F75 WeakPolarHBondContact O-CB 3.43Å; R71-F75 VanDerWaalsContact O-CD2 3.3Å; R71-F75 WeakPolarHBondContact O-CD2 3.39Å; R71-F75 PolarHBondContact O-N 2.96Å; F72-F75 CarbonylContact O-C 3.51Å; F72-F75 PolarHBondContact O-N 2.68Å; F75-G79 WeakPolarHBondContact O-CA 3.3Å; F75-G79 PolarHBondContact O-N 2.94Å |
| 76 | D | 43 | Very low | 43.9 | Very low | 108 Ų | 108 | 102.9 Ų | 102.9 | 58% | 0.578 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -78.6 | -41.5 | 176.7 | -169 | 55.6 | 0 | 0 | 0 | 110.1 | F72 C80 | F72-D76 WeakPolarHBondContact O-CA 3.41Å; F72-D76 WeakPolarHBondContact O-CB 3.44Å; F72-D76 PolarHBondContact O-N 2.92Å; D76-C80 PolarHBondContact O-N 3.47Å; D76-C80 VanDerWaalsContact O-N 3.14Å |
| 77 | Q | 42.9 | Very low | 42.4 | Very low | 165 Ų | 165 | 104.5 Ų | 104.5 | 77% | 0.771 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -70.3 | -34.3 | 169.5 | -86.3 | 179.8 | -20.1 | 0 | 0 | 112.9 | M73 | M73-Q77 PolarHBondContact O-N 3.48Å |
| 78 | G | 37.7 | Very low | 40.8 | Very low | 46 Ų | 46 | 105.7 Ų | 105.7 | 47% | 0.474 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -79.8 | -26 | 174.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | I74 G82 | I74-G78 PolarHBondContact O-N 3.04Å; I74-G78 VanDerWaalsContact O-N 3.09Å; G78-G82 PolarHBondContact O-N 2.94Å |
| 79 | G | 32.3 | Very low | 39.8 | Very low | 31 Ų | 31 | 109.3 Ų | 109.3 | 32% | 0.32 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -91.3 | -31.2 | -171.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | F75 A81 G82 M83 | F75-G79 WeakPolarHBondContact O-CA 3.3Å; F75-G79 PolarHBondContact O-N 2.94Å; G79-A81 VanDerWaalsContact C-N 3.33Å; G79-G82 PolarHBondContact O-N 3.36Å; G79-M83 PolarHBondContact O-N 2.98Å |
| 80 | C | 34.7 | Very low | 39.1 | Very low | 77 Ų | 77 | 106.2 Ų | 106.2 | 52% | 0.52 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -69.6 | -32 | 169.3 | -79.1 | 0 | 0 | 0 | 0 | 112.1 | D76 I84 | D76-C80 PolarHBondContact O-N 3.47Å; D76-C80 VanDerWaalsContact O-N 3.14Å; C80-I84 WeakPolarHBondContact O-CD1 3.48Å; C80-I84 WeakPolarHBondContact O-CG1 3.37Å; C80-I84 PolarHBondContact O-N 3.27Å |
| 81 | A | 38 | Very low | 38.2 | Very low | 69 Ų | 69 | 107.3 Ų | 107.3 | 57% | 0.57 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -74 | -34 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | G79 G85 | G79-A81 VanDerWaalsContact C-N 3.33Å; A81-G85 PolarHBondContact O-N 3.39Å |
| 82 | G | 31.4 | Very low | 37.3 | Very low | 38 Ų | 38 | 102.4 Ų | 102.4 | 39% | 0.392 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -71.3 | -36.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | G78 G79 G85 M86 | G78-G82 PolarHBondContact O-N 2.94Å; G79-G82 PolarHBondContact O-N 3.36Å; G82-G85 PolarHBondContact O-N 3.44Å; G82-M86 PolarHBondContact O-N 3.45Å |
| 83 | M | 28.8 | Very low | 36.4 | Very low | 149 Ų | 149 | 104.1 Ų | 104.1 | 73% | 0.734 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -74.5 | -28.7 | 178.5 | -86.8 | -161.5 | 69.4 | 0 | 0 | 113.7 | G79 | G79-M83 PolarHBondContact O-N 2.98Å |
| 84 | I | 35.8 | Very low | 35.6 | Very low | 135 Ų | 135 | 106.6 Ų | 106.6 | 69% | 0.692 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -75.9 | -29.2 | 173.5 | -62.7 | 167.8 | 0 | 0 | 0 | 110.6 | C80 | C80-I84 WeakPolarHBondContact O-CD1 3.48Å; C80-I84 WeakPolarHBondContact O-CG1 3.37Å; C80-I84 PolarHBondContact O-N 3.27Å |
| 85 | G | 31.2 | Very low | 35.2 | Very low | 45 Ų | 45 | 106.4 Ų | 106.4 | 46% | 0.464 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -76.6 | -23.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | A81 G82 | A81-G85 PolarHBondContact O-N 3.39Å; G82-G85 PolarHBondContact O-N 3.44Å |
| 86 | M | 31 | Very low | 34.6 | Very low | 171 Ų | 171 | 104.5 Ų | 104.5 | 84% | 0.842 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -87.9 | -16.7 | -179.2 | -72.4 | -150 | 96.3 | 0 | 0 | 114.9 | G82 | G82-M86 PolarHBondContact O-N 3.45Å |
| 87 | V | 32.1 | Very low | 34.2 | Very low | 119 Ų | 119 | 103.9 Ų | 103.9 | 72% | 0.721 | 61% | 0.612 | S | S | * | * | S | Bend | trans | -84.7 | -16 | 179.9 | 177.7 | 0 | 0 | 0 | 0 | 112.8 | ||
| 88 | S | 30 | Very low | 34 | Very low | 93 Ų | 93 | 100.7 Ų | 100.7 | 65% | 0.65 | 60% | 0.603 | S | S | * | * | S | Bend | trans | -117.1 | 30.5 | -171.8 | -57.4 | 0 | 0 | 0 | 0 | 115 | P90 | S88-P90 VanDerWaalsContact C-CD 3.45Š|
| 89 | L | 30.9 | Very low | 33.8 | Very low | 116 Ų | 116 | 106.9 Ų | 106.9 | 61% | 0.607 | 62% | 0.62 | S | S | * | * | trans | -124.2 | 51.5 | 169.3 | -114.3 | 92.2 | 0 | 0 | 0 | 115.6 | N91 | L89-N91 PolarHBondContact O-N 3.09Š| ||
| 90 | P | 36.7 | Very low | 33.7 | Very low | 107 Ų | 107 | 109.7 Ų | 109.7 | 70% | 0.695 | 63% | 0.631 | S | S | * | * | S | Bend | trans | -74.2 | 105.4 | 150.4 | 29.7 | -25 | 0 | 0 | 0 | 108.2 | S88 | S88-P90 VanDerWaalsContact C-CD 3.45Š|
| 91 | N | 37.9 | Very low | 33.5 | Very low | 133 Ų | 133 | 113.8 Ų | 113.8 | 71% | 0.711 | 64% | 0.64 | S | S | * | * | S | Bend | trans | 113.2 | 12 | 164.4 | -64.5 | -33.4 | 0 | 0 | 0 | 121.6 | L89 | L89-N91 PolarHBondContact O-N 3.09Š|
| 92 | S | 33.3 | Very low | 33.2 | Very low | 62 Ų | 62 | 121.2 Ų | 121.2 | 43% | 0.434 | 65% | 0.653 | S | S | . | * | trans | -112.7 | 50.4 | 167.7 | -99.6 | 0 | 0 | 0 | 0 | 114 | K94 | S92-K94 PolarHBondContact O-N 3.06Š| ||
| 93 | Y | 32.1 | Very low | 33.3 | Very low | 188 Ų | 188 | 126.5 Ų | 126.5 | 74% | 0.737 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.1 | 7.4 | 161.7 | 59.5 | -91.4 | 0 | 0 | 0 | 113 | ||
| 94 | K | 33.2 | Very low | 33.7 | Very low | 168 Ų | 168 | 128.9 Ų | 128.9 | 73% | 0.73 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.2 | -8.9 | -173.9 | -110.9 | -177.7 | 179.7 | 179.1 | 0 | 116.2 | S92 | S92-K94 PolarHBondContact O-N 3.06Š|
| 95 | S | 39.7 | Very low | 33.6 | Very low | 67 Ų | 67 | 126.7 Ų | 126.7 | 47% | 0.469 | 67% | 0.67 | S | S | . | * | S | Bend | trans | -118.3 | -11.6 | -176.2 | 57.7 | 0 | 0 | 0 | 0 | 115.9 | S97 V98 | S95-S97 VanDerWaalsContact C-N 3.26Å; S95-S97 PolarHBondContact O-N 3.27Å; S95-V98 PolarHBondContact O-N 3.45Å |
| 96 | V | 35 | Very low | 34.1 | Very low | 107 Ų | 107 | 132.8 Ų | 132.8 | 65% | 0.648 | 72% | 0.716 | S | S | * | * | H | α-helix | trans | -72.7 | -20.3 | 177.9 | -176.4 | 0 | 0 | 0 | 0 | 112.4 | V98 | V96-V98 PolarHBondContact O-N 3.09Å |
| 97 | S | 34.1 | Very low | 34.3 | Very low | 95 Ų | 95 | 130.9 Ų | 130.9 | 66% | 0.664 | 71% | 0.71 | S | S | * | * | H | α-helix | trans | -72.1 | -8.4 | 173.2 | 56.2 | 0 | 0 | 0 | 0 | 114.3 | S95 | S95-S97 VanDerWaalsContact C-N 3.26Å; S95-S97 PolarHBondContact O-N 3.27Å |
| 98 | V | 38.2 | Very low | 34.4 | Very low | 98 Ų | 98 | 131.5 Ų | 131.5 | 59% | 0.594 | 71% | 0.709 | S | S | * | * | H | α-helix | trans | -87.9 | -27.1 | -179.2 | -164.7 | 0 | 0 | 0 | 0 | 112.4 | S95 V96 | S95-V98 PolarHBondContact O-N 3.45Å; V96-V98 PolarHBondContact O-N 3.09Å |
| 99 | Q | 32.8 | Very low | 34.7 | Very low | 176 Ų | 176 | 133.6 Ų | 133.6 | 82% | 0.822 | 71% | 0.713 | S | S | * | * | H | α-helix | trans | -89.5 | -11.4 | -175.4 | -71.6 | -161.9 | -7.8 | 0 | 0 | 115.6 | K101 | Q99-K101 VanDerWaalsContact C-N 3.33Å |
| 100 | V | 31.1 | Very low | 34.9 | Very low | 91 Ų | 91 | 134.6 Ų | 134.6 | 55% | 0.552 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.5 | -7.8 | 174.6 | -159.1 | 0 | 0 | 0 | 0 | 112.3 | Y104 | V100-Y104 HydrophobicContact CG1-CD2 4.45Š|
| 101 | K | 29.8 | Very low | 34.8 | Very low | 162 Ų | 162 | 136.4 Ų | 136.4 | 70% | 0.704 | 72% | 0.72 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.6 | -19.9 | -178.9 | -145.1 | 174.1 | -173.3 | -179.3 | 0 | 114.3 | Q99 | Q99-K101 VanDerWaalsContact C-N 3.33Š|
| 102 | W | 32.5 | Very low | 34.6 | Very low | 226 Ų | 226 | 136.6 Ų | 136.6 | 86% | 0.856 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.7 | -16.2 | 176.5 | -83.9 | 99.3 | 0 | 0 | 0 | 114.1 | ||
| 103 | L | 33.6 | Very low | 34.6 | Very low | 148 Ų | 148 | 141.9 Ų | 141.9 | 78% | 0.775 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -89.5 | -9.8 | 178.9 | -133.9 | 88.3 | 0 | 0 | 0 | 114 | ||
| 104 | Y | 36.8 | Very low | 34.8 | Very low | 200 Ų | 200 | 138.4 Ų | 138.4 | 78% | 0.784 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -124.9 | 13.1 | -177 | -76.1 | -76 | 0 | 0 | 0 | 114.4 | V100 | V100-Y104 HydrophobicContact CG1-CD2 4.45Š|
| 105 | S | 34.2 | Very low | 35 | Very low | 88 Ų | 88 | 135.9 Ų | 135.9 | 62% | 0.615 | 74% | 0.743 | S | S | * | * | trans | -145.6 | 63.9 | -179.6 | -163.7 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 106 | A | 41.9 | Very low | 34.5 | Very low | 173 Ų | 173 | 142.2 Ų | 142.2 | 100% | 1.43 | 77% | 0.768 | S | S | * | * | trans | 169.8 | 0 | 143.2 | 0 | 0 | 0 | 0 | 0 | 109.6 |
Retrieved 106 of 106 residues in 44.2 ms
(Link to these results)