| 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 | 68.9 | Low | 90.6 | Very high | 203 Ų | 203 | 108.4 Ų | 108.4 | 100% | 1 | 61% | 0.613 | S | S | * | * | 0 | -38.4 | 0 | -60.9 | -170.1 | -155.5 | 0 | 0 | 111.4 | D3 | M1-D3 PolarHBondContact O-N 3.21Š| |||
| 2 | S | 86.4 | Confident | 91.1 | Very high | 80 Ų | 80 | 102.6 Ų | 102.6 | 56% | 0.559 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -58.5 | -38.4 | 175.3 | 41.1 | 0 | 0 | 0 | 0 | 114.9 | L4 L5 L6 | S2-L4 PolarHBondContact O-N 3.23Å; S2-L5 WeakPolarHBondContact O-CB 3.38Å; S2-L5 PolarHBondContact O-N 2.83Å; S2-L6 PolarHBondContact O-N 3.47Å |
| 3 | D | 90.3 | Very high | 91.5 | Very high | 119 Ų | 119 | 103.1 Ų | 103.1 | 64% | 0.636 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -71.9 | -33.7 | -172.2 | -49.6 | -34 | 0 | 0 | 0 | 113 | M1 L6 L7 | M1-D3 PolarHBondContact O-N 3.21Å; D3-L6 PolarHBondContact O-N 2.99Å; D3-L7 WeakPolarHBondContact O-CB 3.47Å; D3-L7 PolarHBondContact O-N 2.9Å |
| 4 | L | 90 | Very high | 91.8 | Very high | 140 Ų | 140 | 101.5 Ų | 101.5 | 73% | 0.733 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -69.8 | -35 | 173.2 | -66.8 | 175.6 | 0 | 0 | 0 | 111.7 | S2 G8 | S2-L4 PolarHBondContact O-N 3.23Å; L4-G8 PolarHBondContact O-N 2.91Å |
| 5 | L | 91.3 | Very high | 92.1 | Very high | 129 Ų | 129 | 101.6 Ų | 101.6 | 68% | 0.675 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -67.4 | -43.3 | 173.8 | -68 | 174.7 | 0 | 0 | 0 | 111.1 | S2 G8 L9 | S2-L5 WeakPolarHBondContact O-CB 3.38Å; S2-L5 PolarHBondContact O-N 2.83Å; L5-G8 PolarHBondContact O-N 3.46Å; L5-L9 WeakPolarHBondContact O-CB 3.44Å; L5-L9 PolarHBondContact O-N 3.34Å |
| 6 | L | 93.5 | Very high | 92.4 | Very high | 107 Ų | 107 | 102.2 Ų | 102.2 | 56% | 0.56 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -62 | -46.5 | 176.6 | -173.9 | 71.5 | 0 | 0 | 0 | 111.3 | S2 D3 G8 L9 I10 | S2-L6 PolarHBondContact O-N 3.47Å; D3-L6 PolarHBondContact O-N 2.99Å; L6-G8 VanDerWaalsContact C-N 3.33Å; L6-G8 PolarHBondContact O-N 3.22Å; L6-L9 PolarHBondContact O-N 3.39Å; L6-I10 HydrophobicContact CD1-CD1 4.49Å; L6-I10 HydrophobicContact CG-CD1 3.97Å; L6-I10 VanDerWaalsContact O-CG1 3.29Å; L6-I10 WeakPolarHBondContact O-CG1 3.32Å; L6-I10 PolarHBondContact O-N 3.46Å |
| 7 | L | 93.4 | Very high | 92.6 | Very high | 120 Ų | 120 | 102 Ų | 102 | 63% | 0.628 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -64.1 | -38.8 | 178.4 | -165.3 | 70.7 | 0 | 0 | 0 | 111.8 | D3 G11 | D3-L7 WeakPolarHBondContact O-CB 3.47Å; D3-L7 PolarHBondContact O-N 2.9Å; L7-G11 PolarHBondContact O-N 3.1Å |
| 8 | G | 94.4 | Very high | 92.8 | Very high | 48 Ų | 48 | 102.6 Ų | 102.6 | 50% | 0.495 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -64.7 | -39.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | L4 L5 L6 G11 G12 | L4-G8 PolarHBondContact O-N 2.91Å; L5-G8 PolarHBondContact O-N 3.46Å; L6-G8 VanDerWaalsContact C-N 3.33Å; L6-G8 PolarHBondContact O-N 3.22Å; G8-G11 PolarHBondContact O-N 3.47Å; G8-G12 PolarHBondContact O-N 3.47Å |
| 9 | L | 95.3 | Very high | 93 | Very high | 121 Ų | 121 | 102.4 Ų | 102.4 | 63% | 0.634 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -69.1 | -42.7 | 178.4 | -148.8 | 155.9 | 0 | 0 | 0 | 111 | L5 L6 G12 L13 | L5-L9 WeakPolarHBondContact O-CB 3.44Å; L5-L9 PolarHBondContact O-N 3.34Å; L6-L9 PolarHBondContact O-N 3.39Å; L9-G12 PolarHBondContact O-N 2.86Å; L9-L13 VanDerWaalsContact O-CB 3.3Å; L9-L13 WeakPolarHBondContact O-CB 3.37Å; L9-L13 PolarHBondContact O-N 3.01Å |
| 10 | I | 96.2 | Very high | 93.1 | Very high | 90 Ų | 90 | 101.1 Ų | 101.1 | 46% | 0.462 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -61 | -49 | 173.2 | -66.9 | 163.2 | 0 | 0 | 0 | 110.2 | L6 G12 L13 T14 | L6-I10 HydrophobicContact CD1-CD1 4.49Å; L6-I10 HydrophobicContact CG-CD1 3.97Å; L6-I10 VanDerWaalsContact O-CG1 3.29Å; L6-I10 WeakPolarHBondContact O-CG1 3.32Å; L6-I10 PolarHBondContact O-N 3.46Å; I10-G12 VanDerWaalsContact C-N 3.34Å; I10-G12 PolarHBondContact O-N 3.28Å; I10-L13 PolarHBondContact O-N 3.39Å; I10-T14 HydrophobicContact CG2-CG2 4.31Å; I10-T14 VanDerWaalsContact O-CG2 3.25Å; I10-T14 WeakPolarHBondContact O-CG2 3.39Å; I10-T14 PolarHBondContact O-N 3.16Å; I10-T14 PolarHBondContact O-OG1 3.11Å |
| 11 | G | 96.4 | Very high | 93.2 | Very high | 35 Ų | 35 | 101.1 Ų | 101.1 | 36% | 0.361 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -62.4 | -38.1 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | L7 G8 T14 L15 | L7-G11 PolarHBondContact O-N 3.1Å; G8-G11 PolarHBondContact O-N 3.47Å; G11-T14 WeakPolarHBondContact CA-OG1 3.3Å; G11-T14 PolarHBondContact O-OG1 2.83Å; G11-L15 VanDerWaalsContact O-CB 3.25Å; G11-L15 WeakPolarHBondContact O-CB 3.25Å; G11-L15 PolarHBondContact O-N 3.37Å |
| 12 | G | 96.6 | Very high | 94.2 | Very high | 39 Ų | 39 | 97.4 Ų | 97.4 | 40% | 0.402 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -66.5 | -42.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | G8 L9 I10 L15 L16 | G8-G12 PolarHBondContact O-N 3.47Å; L9-G12 PolarHBondContact O-N 2.86Å; I10-G12 VanDerWaalsContact C-N 3.34Å; I10-G12 PolarHBondContact O-N 3.28Å; G12-L15 PolarHBondContact O-N 3.4Å; G12-L16 WeakPolarHBondContact O-CB 3.45Å; G12-L16 PolarHBondContact O-N 2.92Å |
| 13 | L | 96.5 | Very high | 94.4 | Very high | 109 Ų | 109 | 96.8 Ų | 96.8 | 57% | 0.571 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -69.4 | -40.3 | 179.8 | -155.7 | 154.3 | 0 | 0 | 0 | 111.3 | L9 I10 L16 L17 | L9-L13 VanDerWaalsContact O-CB 3.3Å; L9-L13 WeakPolarHBondContact O-CB 3.37Å; L9-L13 PolarHBondContact O-N 3.01Å; I10-L13 PolarHBondContact O-N 3.39Å; L13-L16 PolarHBondContact O-N 3.49Å; L13-L17 WeakPolarHBondContact O-CB 3.38Å; L13-L17 PolarHBondContact O-N 3.43Å |
| 14 | T | 96.1 | Very high | 94.4 | Very high | 81 Ų | 81 | 97.4 Ų | 97.4 | 50% | 0.497 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -66.5 | -39.6 | 174.7 | 58.3 | 0 | 0 | 0 | 0 | 111.8 | I10 G11 L17 L18 | I10-T14 HydrophobicContact CG2-CG2 4.31Å; I10-T14 VanDerWaalsContact O-CG2 3.25Å; I10-T14 WeakPolarHBondContact O-CG2 3.39Å; I10-T14 PolarHBondContact O-N 3.16Å; I10-T14 PolarHBondContact O-OG1 3.11Å; G11-T14 WeakPolarHBondContact CA-OG1 3.3Å; G11-T14 PolarHBondContact O-OG1 2.83Å; T14-L17 PolarHBondContact O-N 3.03Å; T14-L18 WeakPolarHBondContact O-CB 3.44Å; T14-L18 PolarHBondContact O-N 3.45Å |
| 15 | L | 96.8 | Very high | 94.2 | Very high | 103 Ų | 103 | 92.2 Ų | 92.2 | 54% | 0.539 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.8 | -43.4 | 174.8 | -179.9 | 64.2 | 0 | 0 | 0 | 111.7 | G11 G12 L17 L18 L19 | G11-L15 VanDerWaalsContact O-CB 3.25Å; G11-L15 WeakPolarHBondContact O-CB 3.25Å; G11-L15 PolarHBondContact O-N 3.37Å; G12-L15 PolarHBondContact O-N 3.4Å; L15-L17 VanDerWaalsContact C-N 3.34Å; L15-L18 PolarHBondContact O-N 2.99Å; L15-L19 HydrophobicContact CD1-CD1 4.44Å; L15-L19 HydrophobicContact CG-CD1 4.17Å; L15-L19 PolarHBondContact O-N 3.35Å |
| 16 | L | 96.4 | Very high | 93.9 | Very high | 111 Ų | 111 | 88.5 Ų | 88.5 | 58% | 0.581 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -62.4 | -43 | 176.9 | -174.9 | 64.3 | 0 | 0 | 0 | 111.1 | G12 L13 L19 T20 | G12-L16 WeakPolarHBondContact O-CB 3.45Å; G12-L16 PolarHBondContact O-N 2.92Å; L13-L16 PolarHBondContact O-N 3.49Å; L16-L19 PolarHBondContact O-N 2.96Å; L16-T20 WeakPolarHBondContact O-CG2 3.36Å; L16-T20 PolarHBondContact O-N 3.27Å; L16-T20 PolarHBondContact O-OG1 3Å |
| 17 | L | 96.3 | Very high | 93.5 | Very high | 99 Ų | 99 | 93.2 Ų | 93.2 | 52% | 0.518 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62 | -41.2 | 174.8 | -177.5 | 69.4 | 0 | 0 | 0 | 112.1 | L13 T14 L15 T20 L21 | L13-L17 WeakPolarHBondContact O-CB 3.38Å; L13-L17 PolarHBondContact O-N 3.43Å; T14-L17 PolarHBondContact O-N 3.03Å; L15-L17 VanDerWaalsContact C-N 3.34Å; L17-T20 WeakPolarHBondContact CA-OG1 3.41Å; L17-T20 PolarHBondContact O-N 2.93Å; L17-T20 PolarHBondContact O-OG1 3.27Å; L17-L21 HydrophobicContact CG-CD1 4.33Å; L17-L21 WeakPolarHBondContact O-CG 3.25Å; L17-L21 PolarHBondContact O-N 2.88Å |
| 18 | L | 96.1 | Very high | 93 | Very high | 113 Ų | 113 | 90.7 Ų | 90.7 | 59% | 0.592 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -65.5 | -41.7 | 177.8 | -174.3 | 66.6 | 0 | 0 | 0 | 111.4 | T14 L15 L21 L22 | T14-L18 WeakPolarHBondContact O-CB 3.44Å; T14-L18 PolarHBondContact O-N 3.45Å; L15-L18 PolarHBondContact O-N 2.99Å; L18-L21 PolarHBondContact O-N 3.43Å; L18-L22 WeakPolarHBondContact O-CB 3.38Å; L18-L22 PolarHBondContact O-N 3.37Å |
| 19 | L | 95.9 | Very high | 92.1 | Very high | 99 Ų | 99 | 90 Ų | 90 | 52% | 0.518 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63.4 | -41.9 | 176.4 | -84.5 | 160.1 | 0 | 0 | 0 | 112.2 | L15 L16 L22 A23 | L15-L19 HydrophobicContact CD1-CD1 4.44Å; L15-L19 HydrophobicContact CG-CD1 4.17Å; L15-L19 PolarHBondContact O-N 3.35Å; L16-L19 PolarHBondContact O-N 2.96Å; L19-L22 PolarHBondContact O-N 2.97Å; L19-A23 WeakPolarHBondContact O-CB 3.3Å; L19-A23 PolarHBondContact O-N 2.9Å |
| 20 | T | 95.6 | Very high | 90.9 | Very high | 76 Ų | 76 | 91 Ų | 91 | 47% | 0.466 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -67.2 | -40.2 | 177.2 | 52.9 | 0 | 0 | 0 | 0 | 111.9 | L16 L17 L22 A23 F24 | L16-T20 WeakPolarHBondContact O-CG2 3.36Å; L16-T20 PolarHBondContact O-N 3.27Å; L16-T20 PolarHBondContact O-OG1 3Å; L17-T20 WeakPolarHBondContact CA-OG1 3.41Å; L17-T20 PolarHBondContact O-N 2.93Å; L17-T20 PolarHBondContact O-OG1 3.27Å; T20-L22 VanDerWaalsContact C-N 3.34Å; T20-L22 PolarHBondContact O-N 3.44Å; T20-A23 PolarHBondContact O-N 2.96Å; T20-F24 VanDerWaalsContact O-CB 3.3Å; T20-F24 WeakPolarHBondContact O-CB 3.34Å; T20-F24 PolarHBondContact O-N 3.15Å |
| 21 | L | 93.9 | Very high | 89.5 | Confident | 101 Ų | 101 | 94.5 Ų | 94.5 | 53% | 0.529 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -62.4 | -40.5 | 173.8 | -74.1 | 171.3 | 0 | 0 | 0 | 112 | L17 L18 F24 A25 | L17-L21 HydrophobicContact CG-CD1 4.33Å; L17-L21 WeakPolarHBondContact O-CG 3.25Å; L17-L21 PolarHBondContact O-N 2.88Å; L18-L21 PolarHBondContact O-N 3.43Å; L21-F24 PolarHBondContact O-N 2.89Å; L21-A25 WeakPolarHBondContact O-CB 3.29Å; L21-A25 PolarHBondContact O-N 3.27Å |
| 22 | L | 90.8 | Very high | 88.1 | Confident | 126 Ų | 126 | 96.2 Ų | 96.2 | 66% | 0.66 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -68.4 | -41.5 | 178 | -169.7 | 63.6 | 0 | 0 | 0 | 111.7 | L18 L19 T20 F24 A25 G26 | L18-L22 WeakPolarHBondContact O-CB 3.38Å; L18-L22 PolarHBondContact O-N 3.37Å; L19-L22 PolarHBondContact O-N 2.97Å; T20-L22 VanDerWaalsContact C-N 3.34Å; T20-L22 PolarHBondContact O-N 3.44Å; L22-F24 VanDerWaalsContact C-N 3.33Å; L22-A25 PolarHBondContact O-N 2.93Å; L22-G26 PolarHBondContact O-N 3.41Å |
| 23 | A | 90.3 | Very high | 86.9 | Confident | 66 Ų | 66 | 98 Ų | 98 | 55% | 0.545 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -62.3 | -41.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | L19 T20 G26 Y27 | L19-A23 WeakPolarHBondContact O-CB 3.3Å; L19-A23 PolarHBondContact O-N 2.9Å; T20-A23 PolarHBondContact O-N 2.96Å; A23-G26 PolarHBondContact O-N 2.91Å; A23-Y27 WeakPolarHBondContact O-CB 3.49Å; A23-Y27 PolarHBondContact O-N 2.91Å |
| 24 | F | 90 | Very high | 85.7 | Confident | 133 Ų | 133 | 99 Ų | 99 | 58% | 0.583 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -63.6 | -46.3 | 175 | -177.4 | -99.5 | 0 | 0 | 0 | 111.5 | T20 L21 L22 G26 Y27 S28 | T20-F24 VanDerWaalsContact O-CB 3.3Å; T20-F24 WeakPolarHBondContact O-CB 3.34Å; T20-F24 PolarHBondContact O-N 3.15Å; L21-F24 PolarHBondContact O-N 2.89Å; L22-F24 VanDerWaalsContact C-N 3.33Å; F24-G26 VanDerWaalsContact C-N 3.27Å; F24-G26 PolarHBondContact O-N 3.43Å; F24-Y27 CarbonylContact O-C 3.43Å; F24-Y27 PolarHBondContact O-N 3.46Å; F24-Y27 VanDerWaalsContact O-N 3.1Å; F24-S28 VanDerWaalsContact CE1-OG 3.28Å; F24-S28 WeakPolarHBondContact CE1-OG 3.28Å; F24-S28 WeakPolarHBondContact CZ-OG 3.38Å; F24-S28 WeakPolarHBondContact O-CB 3.4Å; F24-S28 PolarHBondContact O-N 3.37Å; F24-S28 PolarHBondContact O-OG 2.95Å |
| 25 | A | 87.3 | Confident | 84.6 | Confident | 30 Ų | 30 | 103.5 Ų | 103.5 | 25% | 0.248 | 60% | 0.596 | C | S | . | * | H | α-helix | trans | -60.4 | -37.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | L21 L22 L30 | L21-A25 WeakPolarHBondContact O-CB 3.29Å; L21-A25 PolarHBondContact O-N 3.27Å; L22-A25 PolarHBondContact O-N 2.93Å; A25-L30 WeakPolarHBondContact O-CB 3.15Å; A25-L30 PolarHBondContact O-N 2.83Å |
| 26 | G | 84.6 | Confident | 83.4 | Confident | 52 Ų | 52 | 105 Ų | 105 | 54% | 0.536 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -66.1 | -45 | 171.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | L22 A23 F24 G29 | L22-G26 PolarHBondContact O-N 3.41Å; A23-G26 PolarHBondContact O-N 2.91Å; F24-G26 VanDerWaalsContact C-N 3.27Å; F24-G26 PolarHBondContact O-N 3.43Å; G26-G29 PolarHBondContact O-N 3.39Å |
| 27 | Y | 85 | Confident | 82.1 | Confident | 205 Ų | 205 | 104.1 Ų | 104.1 | 80% | 0.804 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -66.3 | -39.9 | 177.9 | 179.9 | -97.7 | 0 | 0 | 0 | 112.9 | A23 F24 G29 | A23-Y27 WeakPolarHBondContact O-CB 3.49Å; A23-Y27 PolarHBondContact O-N 2.91Å; F24-Y27 CarbonylContact O-C 3.43Å; F24-Y27 PolarHBondContact O-N 3.46Å; F24-Y27 VanDerWaalsContact O-N 3.1Å; Y27-G29 PolarHBondContact O-N 3.19Å; Y27-G29 VanDerWaalsContact O-N 3.08Å |
| 28 | S | 82.1 | Confident | 80.7 | Confident | 67 Ų | 67 | 104.5 Ų | 104.5 | 47% | 0.469 | 63% | 0.63 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -68.1 | -3.2 | 176.9 | -60.7 | 0 | 0 | 0 | 0 | 113.3 | F24 L30 | F24-S28 VanDerWaalsContact CE1-OG 3.28Å; F24-S28 WeakPolarHBondContact CE1-OG 3.28Å; F24-S28 WeakPolarHBondContact CZ-OG 3.38Å; F24-S28 WeakPolarHBondContact O-CB 3.4Å; F24-S28 PolarHBondContact O-N 3.37Å; F24-S28 PolarHBondContact O-OG 2.95Å; S28-L30 VanDerWaalsContact C-N 3.28Å; S28-L30 PolarHBondContact O-N 2.92Å |
| 29 | G | 75.3 | Confident | 79.5 | Confident | 33 Ų | 33 | 102.4 Ų | 102.4 | 34% | 0.34 | 64% | 0.636 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 66.4 | 30.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | G26 Y27 L31 A32 | G26-G29 PolarHBondContact O-N 3.39Å; Y27-G29 PolarHBondContact O-N 3.19Å; Y27-G29 VanDerWaalsContact O-N 3.08Å; G29-L31 PolarHBondContact O-N 3.02Å; G29-A32 WeakPolarHBondContact O-CB 3.36Å; G29-A32 PolarHBondContact O-N 2.86Å |
| 30 | L | 71.8 | Confident | 78.1 | Confident | 142 Ų | 142 | 101.9 Ų | 101.9 | 74% | 0.743 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.4 | -20.5 | 175.6 | -171.3 | 66.2 | 0 | 0 | 0 | 112.1 | A25 S28 | A25-L30 WeakPolarHBondContact O-CB 3.15Å; A25-L30 PolarHBondContact O-N 2.83Å; S28-L30 VanDerWaalsContact C-N 3.28Å; S28-L30 PolarHBondContact O-N 2.92Å |
| 31 | L | 65.3 | Low | 76.6 | Confident | 164 Ų | 164 | 101.7 Ų | 101.7 | 86% | 0.859 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.8 | 8.8 | 175.6 | -58.7 | 175.6 | 0 | 0 | 0 | 113.2 | G29 G33 | G29-L31 PolarHBondContact O-N 3.02Å; L31-G33 PolarHBondContact O-N 3Å |
| 32 | A | 66.9 | Low | 75.3 | Confident | 71 Ų | 71 | 100.3 Ų | 100.3 | 59% | 0.587 | 64% | 0.638 | S | S | * | * | trans | -65.6 | 118 | 176.3 | 0 | 0 | 0 | 0 | 0 | 108.8 | G29 V34 | G29-A32 WeakPolarHBondContact O-CB 3.36Å; G29-A32 PolarHBondContact O-N 2.86Å; A32-V34 PolarHBondContact O-N 2.85Å | ||
| 33 | G | 71.6 | Confident | 74.2 | Confident | 78 Ų | 78 | 96.2 Ų | 96.2 | 80% | 0.804 | 62% | 0.616 | S | S | * | * | trans | -67.2 | 122.3 | 179.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | L31 E35 | L31-G33 PolarHBondContact O-N 3Å; G33-E35 PolarHBondContact O-N 3.33Å | ||
| 34 | V | 72.6 | Confident | 73 | Confident | 130 Ų | 130 | 102.8 Ų | 102.8 | 79% | 0.788 | 63% | 0.627 | S | S | * | * | trans | -76.7 | 110.2 | 168.9 | -178.5 | 0 | 0 | 0 | 0 | 107.8 | A32 V36 | A32-V34 PolarHBondContact O-N 2.85Å; V34-V36 HydrophobicContact CG1-CG2 4.05Å; V34-V36 PolarHBondContact O-N 3.34Å; V34-V36 VanDerWaalsContact O-N 3.17Å | ||
| 35 | E | 71.6 | Confident | 71.9 | Confident | 174 Ų | 174 | 104.8 Ų | 104.8 | 81% | 0.813 | 64% | 0.643 | S | S | * | * | trans | -75.2 | 103.7 | 173.8 | -170.6 | 179.7 | 165.2 | 0 | 0 | 109.5 | G33 | G33-E35 PolarHBondContact O-N 3.33Š| ||
| 36 | V | 72.6 | Confident | 71.3 | Confident | 134 Ų | 134 | 107.5 Ų | 107.5 | 81% | 0.812 | 66% | 0.657 | S | S | * | * | trans | -95.6 | 108.4 | 171.7 | -175.8 | 0 | 0 | 0 | 0 | 108.1 | V34 | V34-V36 HydrophobicContact CG1-CG2 4.05Å; V34-V36 PolarHBondContact O-N 3.34Å; V34-V36 VanDerWaalsContact O-N 3.17Å | ||
| 37 | S | 69.2 | Low | 70.9 | Confident | 94 Ų | 94 | 112.2 Ų | 112.2 | 66% | 0.657 | 68% | 0.675 | S | S | * | * | trans | -122.1 | 143 | 173.7 | 64.3 | 0 | 0 | 0 | 0 | 111 | ||||
| 38 | A | 67.6 | Low | 70.6 | Confident | 107 Ų | 107 | 106.3 Ų | 106.3 | 88% | 0.884 | 66% | 0.661 | S | S | * | * | trans | -106.2 | 114.1 | 169.2 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 39 | G | 70.3 | Confident | 70.7 | Confident | 68 Ų | 68 | 108.1 Ų | 108.1 | 70% | 0.701 | 68% | 0.68 | S | S | * | * | trans | -160.6 | -177.1 | -173.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 40 | S | 65.8 | Low | 71.1 | Confident | 89 Ų | 89 | 112.8 Ų | 112.8 | 62% | 0.622 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -61 | 138 | 173 | 59.9 | 0 | 0 | 0 | 0 | 110 | ||
| 41 | P | 65.2 | Low | 71.6 | Confident | 71 Ų | 71 | 112 Ų | 112 | 46% | 0.461 | 68% | 0.678 | S | S | . | * | trans | -58.1 | 141 | -177.5 | 22.1 | -31.8 | 0 | 0 | 0 | 111.2 | I43 M107 | P41-I43 PolarHBondContact O-N 3.31Å; P41-I43 VanDerWaalsContact O-N 3.08Å; P41-M107 HydrophobicContact CB-CE 4.05Å; P41-M107 HydrophobicContact CB-SD 3.95Å | ||
| 42 | P | 65.2 | Low | 72.5 | Confident | 73 Ų | 73 | 108 Ų | 108 | 47% | 0.474 | 65% | 0.654 | S | S | . | * | S | Bend | trans | -70.7 | -3 | -179.1 | 30 | -33.3 | 0 | 0 | 0 | 112.6 | M107 | P42-M107 HydrophobicContact CG-CE 4.21Š|
| 43 | I | 68.3 | Low | 73.2 | Confident | 40 Ų | 40 | 108.8 Ų | 108.8 | 21% | 0.205 | 65% | 0.646 | C | S | . | * | trans | -105.4 | 114.4 | -179.8 | -56.1 | 176.1 | 0 | 0 | 0 | 108 | P41 V46 I77 I98 | P41-I43 PolarHBondContact O-N 3.31Å; P41-I43 VanDerWaalsContact O-N 3.08Å; I43-V46 HydrophobicContact CG2-CB 4Å; I43-V46 HydrophobicContact CG2-CG1 3.41Å; I43-V46 VanDerWaalsContact CG2-CG1 3.41Å; I43-V46 HydrophobicContact CG2-CG2 3.35Å; I43-I77 HydrophobicContact CD1-CD1 3.82Å; I43-I98 HydrophobicContact CD1-CD1 3.42Å; I43-I98 VanDerWaalsContact CD1-CD1 3.42Å; I43-I98 HydrophobicContact CD1-CG1 3.91Å; I43-I98 HydrophobicContact CG1-CD1 4.14Å | ||
| 44 | R | 64.6 | Low | 73.6 | Confident | 204 Ų | 204 | 110.1 Ų | 110.1 | 77% | 0.77 | 63% | 0.632 | S | S | * | * | trans | -114.8 | 121 | 172.2 | -65.7 | -177.8 | 178 | 174.2 | -0.1 | 108.2 | ||||
| 45 | N | 67.6 | Low | 73.7 | Confident | 174 Ų | 174 | 106.3 Ų | 106.3 | 93% | 0.93 | 62% | 0.619 | S | S | * | * | S | Bend | trans | 41.3 | 88.9 | 177.3 | -63.6 | -16.9 | 0 | 0 | 0 | 114.4 | ||
| 46 | V | 73.6 | Confident | 74 | Confident | 87 Ų | 87 | 104 Ų | 104 | 53% | 0.527 | 61% | 0.612 | S | S | . | * | trans | -114.9 | 140 | 178.6 | -75.2 | 0 | 0 | 0 | 0 | 111.7 | I43 V48 | I43-V46 HydrophobicContact CG2-CB 4Å; I43-V46 HydrophobicContact CG2-CG1 3.41Å; I43-V46 VanDerWaalsContact CG2-CG1 3.41Å; I43-V46 HydrophobicContact CG2-CG2 3.35Å; V46-V48 HydrophobicContact CB-CG2 4.16Å; V46-V48 HydrophobicContact CG2-CG2 3.73Å | ||
| 47 | T | 77 | Confident | 74.2 | Confident | 151 Ų | 151 | 103.4 Ų | 103.4 | 93% | 0.926 | 60% | 0.596 | S | S | * | * | trans | -90.5 | 120.3 | 163.7 | -55.8 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 48 | V | 79.4 | Confident | 74.6 | Confident | 82 Ų | 82 | 102.6 Ų | 102.6 | 50% | 0.497 | 60% | 0.602 | S | S | . | * | trans | -115.4 | 125.8 | -174.8 | -177 | 0 | 0 | 0 | 0 | 108.8 | V46 | V46-V48 HydrophobicContact CB-CG2 4.16Å; V46-V48 HydrophobicContact CG2-CG2 3.73Å | ||
| 49 | A | 83.3 | Confident | 75.2 | Confident | 105 Ų | 105 | 103.9 Ų | 103.9 | 87% | 0.868 | 59% | 0.59 | S | S | * | * | trans | -86.4 | 130.9 | 160.6 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 50 | Y | 83.1 | Confident | 75.8 | Confident | 130 Ų | 130 | 102.6 Ų | 102.6 | 51% | 0.51 | 57% | 0.569 | S | S | . | * | trans | -125.8 | 150.9 | -177 | 71.5 | -86.6 | 0 | 0 | 0 | 111.3 | F52 V118 E120 | Y50-F52 HydrophobicContact CD2-CB 4.47Å; Y50-F52 HydrophobicContact CE2-CB 4.42Å; Y50-V118 HydrophobicContact CD2-CG1 4.34Å; Y50-V118 HydrophobicContact CD2-CG2 4.42Å; Y50-V118 HydrophobicContact CE2-CG1 3.64Å; Y50-V118 HydrophobicContact CE2-CG2 4.42Å; Y50-E120 VanDerWaalsContact CE2-OE1 3.32Å; Y50-E120 WeakPolarHBondContact CE2-OE1 3.24Å; Y50-E120 PolarHBondContact OH-OE1 2.91Å; Y50-E120 PolarHBondContact OH-OE2 3.08Å | ||
| 51 | K | 83.4 | Confident | 76.5 | Confident | 125 Ų | 125 | 100.4 Ų | 100.4 | 54% | 0.543 | 56% | 0.56 | S | S | . | * | trans | -120.2 | 118.3 | 169.8 | -174.9 | 177.3 | -177.8 | 179.3 | 0 | 107 | L63 E66 | K51-L63 HydrophobicContact CD-CD2 4.45Å; K51-E66 IonicContact NZ-OE2 2.78Å; K51-E66 PolarHBondContact NZ-OE2 3.38Å | ||
| 52 | F | 82.9 | Confident | 77.4 | Confident | 81 Ų | 81 | 105.9 Ų | 105.9 | 36% | 0.355 | 57% | 0.571 | S | S | . | * | trans | -87.7 | 136.6 | -179.5 | 178.9 | -102.5 | 0 | 0 | 0 | 110.9 | Y50 M54 V118 E120 | Y50-F52 HydrophobicContact CD2-CB 4.47Å; Y50-F52 HydrophobicContact CE2-CB 4.42Å; F52-M54 HydrophobicContact CE1-CB 4.4Å; F52-M54 HydrophobicContact CZ-CB 4.39Å; F52-V118 HydrophobicContact CD2-CG1 4.21Å; F52-E120 HydrophobicContact CD1-CB 4.27Å; F52-E120 HydrophobicContact CE1-CB 4.35Å; F52-E120 HydrophobicContact CG-CB 4.46Å | ||
| 53 | H | 81.9 | Confident | 78.3 | Confident | 88 Ų | 88 | 103.9 Ų | 103.9 | 41% | 0.407 | 56% | 0.556 | S | S | . | * | trans | -145 | 142.3 | 175.1 | 176.4 | -100.9 | 0 | 0 | 0 | 110 | L63 | H53-L63 HydrophobicContact CB-CD1 3.37Å; H53-L63 VanDerWaalsContact CD2-CD1 3.44Å; H53-L63 WeakPolarHBondContact CD2-CD1 3.34Å | ||
| 54 | M | 79.6 | Confident | 78.9 | Confident | 105 Ų | 105 | 104.7 Ų | 104.7 | 52% | 0.517 | 56% | 0.558 | S | S | . | * | trans | -122.4 | 117.3 | 177.3 | -173.4 | 176.5 | 177.1 | 0 | 0 | 108.5 | F52 T124 | F52-M54 HydrophobicContact CE1-CB 4.4Å; F52-M54 HydrophobicContact CZ-CB 4.39Å; M54-T124 HydrophobicContact CE-CG2 4.48Å; M54-T124 HydrophobicContact SD-CG2 4.18Å | ||
| 55 | G | 75.6 | Confident | 79.8 | Confident | 51 Ų | 51 | 99.5 Ų | 99.5 | 53% | 0.526 | 55% | 0.549 | S | S | . | . | S | Bend | trans | 171 | -174.6 | -176.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||
| 56 | L | 78.6 | Confident | 80.6 | Confident | 125 Ų | 125 | 94 Ų | 94 | 65% | 0.654 | 52% | 0.518 | S | S | * | . | trans | -66.4 | 139.6 | 177.7 | -67 | 171 | 0 | 0 | 0 | 110.6 | G58 E59 T60 | L56-G58 PolarHBondContact O-N 3.32Å; L56-E59 HydrophobicContact CB-CG 4.42Å; L56-E59 PolarHBondContact O-N 3.41Å; L56-E59 VanDerWaalsContact O-N 3.09Å; L56-T60 PolarHBondContact O-OG1 3.5Å | ||
| 57 | Y | 76.8 | Confident | 81 | Confident | 122 Ų | 122 | 92.1 Ų | 92.1 | 48% | 0.478 | 51% | 0.509 | S | S | . | . | G | 310 helix | trans | -55.6 | -40.9 | 178.5 | -179.2 | -103.5 | 0 | 0 | 0 | 112.2 | E59 T60 Y80 E97 | Y57-E59 PolarHBondContact O-N 2.99Å; Y57-E59 VanDerWaalsContact O-N 3.09Å; Y57-T60 WeakPolarHBondContact O-CB 3.45Å; Y57-T60 PolarHBondContact O-N 2.74Å; Y57-Y80 HydrophobicContact CD2-CD2 4.05Å; Y57-Y80 HydrophobicContact CD2-CE2 4.48Å; Y57-E97 PolarHBondContact OH-OE2 2.77Å |
| 58 | G | 76.3 | Confident | 81 | Confident | 76 Ų | 76 | 86.7 Ų | 86.7 | 78% | 0.784 | 48% | 0.477 | S | S | * | . | G | 310 helix | trans | -59.3 | -22.5 | 180 | 0 | 0 | 0 | 0 | 0 | 115 | L56 | L56-G58 PolarHBondContact O-N 3.32Š|
| 59 | E | 80.8 | Confident | 81.1 | Confident | 134 Ų | 134 | 86.8 Ų | 86.8 | 63% | 0.626 | 48% | 0.481 | S | S | * | . | G | 310 helix | trans | -93.6 | -10.1 | 178.9 | -60.8 | -178 | 160.3 | 0 | 0 | 112.6 | L56 Y57 G61 | L56-E59 HydrophobicContact CB-CG 4.42Å; L56-E59 PolarHBondContact O-N 3.41Å; L56-E59 VanDerWaalsContact O-N 3.09Å; Y57-E59 PolarHBondContact O-N 2.99Å; Y57-E59 VanDerWaalsContact O-N 3.09Å; E59-G61 VanDerWaalsContact C-N 3.28Å; E59-G61 PolarHBondContact O-N 3Å |
| 60 | T | 81.9 | Confident | 81.1 | Confident | 42 Ų | 42 | 88.5 Ų | 88.5 | 26% | 0.258 | 47% | 0.474 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.7 | -12.3 | -174.8 | -54.4 | 0 | 0 | 0 | 0 | 112.6 | L56 Y57 R62 L63 F64 | L56-T60 PolarHBondContact O-OG1 3.5Å; Y57-T60 WeakPolarHBondContact O-CB 3.45Å; Y57-T60 PolarHBondContact O-N 2.74Å; T60-R62 PolarHBondContact O-N 2.83Å; T60-R62 VanDerWaalsContact O-N 3.15Å; T60-L63 HydrophobicContact CG2-CB 4.4Å; T60-L63 HydrophobicContact CG2-CD1 4.39Å; T60-L63 WeakPolarHBondContact O-CB 3.3Å; T60-L63 PolarHBondContact O-N 3.45Å; T60-F64 PolarHBondContact O-N 3.42Å; T60-F64 VanDerWaalsContact O-N 3.11Å |
| 61 | G | 81.4 | Confident | 80.6 | Confident | 42 Ų | 42 | 84.3 Ų | 84.3 | 43% | 0.433 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -54 | -37.8 | -178.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | E59 L63 F64 T65 | E59-G61 VanDerWaalsContact C-N 3.28Å; E59-G61 PolarHBondContact O-N 3Å; G61-L63 PolarHBondContact O-N 2.95Å; G61-F64 WeakPolarHBondContact O-CB 3.43Å; G61-F64 PolarHBondContact O-N 3.08Å; G61-T65 PolarHBondContact O-N 3.32Å; G61-T65 PolarHBondContact O-OG1 3.48Å; G61-T65 VanDerWaalsContact O-OG1 3.07Å |
| 62 | R | 84.4 | Confident | 80.2 | Confident | 186 Ų | 186 | 83.7 Ų | 83.7 | 70% | 0.702 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -62.8 | -43 | 176.1 | 179.7 | -179.1 | 163.8 | 172.3 | 1.4 | 112.4 | T60 F64 T65 E66 | T60-R62 PolarHBondContact O-N 2.83Å; T60-R62 VanDerWaalsContact O-N 3.15Å; R62-F64 VanDerWaalsContact C-N 3.28Å; R62-F64 PolarHBondContact O-N 3.17Å; R62-T65 PolarHBondContact O-N 2.82Å; R62-E66 IonicContact CZ-OE1 3.11Å; R62-E66 IonicContact NE-OE1 2.77Å; R62-E66 PolarHBondContact NE-OE1 3.46Å; R62-E66 IonicContact NH2-OE1 2.68Å; R62-E66 PolarHBondContact NH2-OE1 2.72Å; R62-E66 WeakPolarHBondContact O-CG 3.45Å; R62-E66 PolarHBondContact O-N 2.88Å |
| 63 | L | 84.1 | Confident | 79.8 | Confident | 32 Ų | 32 | 89.4 Ų | 89.4 | 17% | 0.168 | 50% | 0.497 | C | S | . | . | H | α-helix | trans | -67.7 | -33.9 | -179.6 | -62.2 | 176.6 | 0 | 0 | 0 | 111.6 | K51 H53 T60 G61 S67 | K51-L63 HydrophobicContact CD-CD2 4.45Å; H53-L63 HydrophobicContact CB-CD1 3.37Å; H53-L63 VanDerWaalsContact CD2-CD1 3.44Å; H53-L63 WeakPolarHBondContact CD2-CD1 3.34Å; T60-L63 HydrophobicContact CG2-CB 4.4Å; T60-L63 HydrophobicContact CG2-CD1 4.39Å; T60-L63 WeakPolarHBondContact O-CB 3.3Å; T60-L63 PolarHBondContact O-N 3.45Å; G61-L63 PolarHBondContact O-N 2.95Å; L63-S67 WeakPolarHBondContact O-CB 3.34Å; L63-S67 PolarHBondContact O-N 3.03Å; L63-S67 PolarHBondContact O-OG 3.38Å |
| 64 | F | 80.5 | Confident | 79.6 | Confident | 56 Ų | 56 | 91.3 Ų | 91.3 | 25% | 0.246 | 51% | 0.51 | C | S | . | . | H | α-helix | trans | -65.2 | -48 | 172.6 | -176.4 | -99.8 | 0 | 0 | 0 | 111.1 | T60 G61 R62 E66 S67 C68 S76 Y99 | T60-F64 PolarHBondContact O-N 3.42Å; T60-F64 VanDerWaalsContact O-N 3.11Å; G61-F64 WeakPolarHBondContact O-CB 3.43Å; G61-F64 PolarHBondContact O-N 3.08Å; R62-F64 VanDerWaalsContact C-N 3.28Å; R62-F64 PolarHBondContact O-N 3.17Å; F64-E66 VanDerWaalsContact C-N 3.32Å; F64-E66 PolarHBondContact O-N 3.31Å; F64-S67 PolarHBondContact O-N 2.95Å; F64-C68 WeakPolarHBondContact CE1-SG 3.32Å; F64-C68 WeakPolarHBondContact CZ-SG 3.38Å; F64-C68 PolarHBondContact O-N 3.4Å; F64-C68 PolarHBondContact O-SG 2.86Å; F64-C68 VanDerWaalsContact O-SG 3.4Å; F64-S76 WeakPolarHBondContact CE2-OG 3.48Å; F64-Y99 HydrophobicContact CD2-CE2 4.39Å; F64-Y99 HydrophobicContact CE1-CD1 4.22Å; F64-Y99 HydrophobicContact CE1-CE1 4.13Å; F64-Y99 HydrophobicContact CE1-CG 4.48Å; F64-Y99 HydrophobicContact CE2-CD1 4.4Å; F64-Y99 AromaticContact CE2-CD2 3.45Å; F64-Y99 HydrophobicContact CE2-CD2 3.45Å; F64-Y99 VanDerWaalsContact CE2-CD2 3.45Å; F64-Y99 HydrophobicContact CE2-CE1 4.4Å; F64-Y99 AromaticContact CE2-CE2 3.47Å; F64-Y99 HydrophobicContact CE2-CE2 3.47Å; F64-Y99 VanDerWaalsContact CE2-CE2 3.47Å; F64-Y99 AromaticContact CE2-CG 3.95Å; F64-Y99 HydrophobicContact CE2-CG 3.95Å; F64-Y99 AromaticContact CE2-CZ 3.98Å; F64-Y99 AromaticContact CZ-CD1 3.57Å; F64-Y99 HydrophobicContact CZ-CD1 3.57Å; F64-Y99 AromaticContact CZ-CD2 3.44Å; F64-Y99 HydrophobicContact CZ-CD2 3.44Å; F64-Y99 VanDerWaalsContact CZ-CD2 3.44Å; F64-Y99 AromaticContact CZ-CE1 3.7Å; F64-Y99 HydrophobicContact CZ-CE1 3.7Å; F64-Y99 AromaticContact CZ-CE2 3.61Å; F64-Y99 HydrophobicContact CZ-CE2 3.61Å; F64-Y99 AromaticContact CZ-CG 3.43Å; F64-Y99 HydrophobicContact CZ-CG 3.43Å; F64-Y99 VanDerWaalsContact CZ-CG 3.43Å; F64-Y99 AromaticContact CZ-CZ 3.74Å |
| 65 | T | 83.3 | Confident | 79.6 | Confident | 95 Ų | 95 | 92.5 Ų | 92.5 | 58% | 0.583 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -57.8 | -43.6 | 175.4 | -57.2 | 0 | 0 | 0 | 0 | 112.1 | G61 R62 S67 C68 S69 | G61-T65 PolarHBondContact O-N 3.32Å; G61-T65 PolarHBondContact O-OG1 3.48Å; G61-T65 VanDerWaalsContact O-OG1 3.07Å; R62-T65 PolarHBondContact O-N 2.82Å; T65-S67 VanDerWaalsContact C-N 3.32Å; T65-S67 PolarHBondContact O-N 3.46Å; T65-C68 PolarHBondContact O-N 2.98Å; T65-S69 WeakPolarHBondContact O-CB 3.39Å; T65-S69 PolarHBondContact O-N 3.29Å; T65-S69 PolarHBondContact O-OG 2.93Å |
| 66 | E | 84.9 | Confident | 80 | Confident | 59 Ų | 59 | 91.1 Ų | 91.1 | 28% | 0.276 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.2 | -37.2 | 174 | -73.5 | 174.8 | -169.9 | 0 | 0 | 112.3 | K51 R62 F64 S69 I70 | K51-E66 IonicContact NZ-OE2 2.78Å; K51-E66 PolarHBondContact NZ-OE2 3.38Å; R62-E66 IonicContact CZ-OE1 3.11Å; R62-E66 IonicContact NE-OE1 2.77Å; R62-E66 PolarHBondContact NE-OE1 3.46Å; R62-E66 IonicContact NH2-OE1 2.68Å; R62-E66 PolarHBondContact NH2-OE1 2.72Å; R62-E66 WeakPolarHBondContact O-CG 3.45Å; R62-E66 PolarHBondContact O-N 2.88Å; F64-E66 VanDerWaalsContact C-N 3.32Å; F64-E66 PolarHBondContact O-N 3.31Å; E66-S69 PolarHBondContact O-OG 3.07Å; E66-I70 WeakPolarHBondContact O-CD1 3.44Å; E66-I70 VanDerWaalsContact O-CG1 3.3Å; E66-I70 WeakPolarHBondContact O-CG1 3.4Å |
| 67 | S | 82.9 | Confident | 80.3 | Confident | 47 Ų | 47 | 87.6 Ų | 87.6 | 33% | 0.329 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -72.4 | -40.5 | 179.7 | -57.2 | 0 | 0 | 0 | 0 | 111.8 | L63 F64 T65 I70 | L63-S67 WeakPolarHBondContact O-CB 3.34Å; L63-S67 PolarHBondContact O-N 3.03Å; L63-S67 PolarHBondContact O-OG 3.38Å; F64-S67 PolarHBondContact O-N 2.95Å; T65-S67 VanDerWaalsContact C-N 3.32Å; T65-S67 PolarHBondContact O-N 3.46Å; S67-I70 PolarHBondContact O-N 3.48Å |
| 68 | C | 76.5 | Confident | 80.6 | Confident | 37 Ų | 37 | 83.1 Ų | 83.1 | 25% | 0.25 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -70.1 | -30.3 | 177.6 | -68.8 | 0 | 0 | 0 | 0 | 112.8 | F64 T65 I70 S71 S76 | F64-C68 WeakPolarHBondContact CE1-SG 3.32Å; F64-C68 WeakPolarHBondContact CZ-SG 3.38Å; F64-C68 PolarHBondContact O-N 3.4Å; F64-C68 PolarHBondContact O-SG 2.86Å; F64-C68 VanDerWaalsContact O-SG 3.4Å; T65-C68 PolarHBondContact O-N 2.98Å; C68-I70 VanDerWaalsContact C-N 3.35Å; C68-S71 CarbonylContact O-C 3.59Å; C68-S76 PolarHBondContact SG-OG 2.63Å |
| 69 | S | 80.6 | Confident | 81 | Confident | 84 Ų | 84 | 82.1 Ų | 82.1 | 59% | 0.587 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -71.6 | -28.1 | 178.3 | 69.6 | 0 | 0 | 0 | 0 | 113.2 | T65 E66 S71 | T65-S69 WeakPolarHBondContact O-CB 3.39Å; T65-S69 PolarHBondContact O-N 3.29Å; T65-S69 PolarHBondContact O-OG 2.93Å; E66-S69 PolarHBondContact O-OG 3.07Å; S69-S71 VanDerWaalsContact C-N 3.31Å; S69-S71 PolarHBondContact O-N 3.36Å |
| 70 | I | 83.1 | Confident | 81 | Confident | 142 Ų | 142 | 80.2 Ų | 80.2 | 73% | 0.728 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -65.4 | -36.2 | 178.4 | -66.9 | 162.6 | 0 | 0 | 0 | 111.3 | E66 S67 C68 | E66-I70 WeakPolarHBondContact O-CD1 3.44Å; E66-I70 VanDerWaalsContact O-CG1 3.3Å; E66-I70 WeakPolarHBondContact O-CG1 3.4Å; S67-I70 PolarHBondContact O-N 3.48Å; C68-I70 VanDerWaalsContact C-N 3.35Å |
| 71 | S | 73.1 | Confident | 80.7 | Confident | 41 Ų | 41 | 80 Ų | 80 | 29% | 0.287 | 42% | 0.422 | S | S | . | . | trans | -152.9 | 88.9 | 176.3 | -157.6 | 0 | 0 | 0 | 0 | 112.2 | C68 S69 K73 L74 | C68-S71 CarbonylContact O-C 3.59Å; S69-S71 VanDerWaalsContact C-N 3.31Å; S69-S71 PolarHBondContact O-N 3.36Å; S71-K73 PolarHBondContact O-N 2.83Å; S71-K73 VanDerWaalsContact O-N 3.11Å; S71-L74 PolarHBondContact O-N 2.88Å; S71-L74 VanDerWaalsContact O-N 3.16Å; S71-L74 WeakPolarHBondContact OG-CD1 3.48Å; S71-L74 VanDerWaalsContact OG-CG 3.32Å; S71-L74 WeakPolarHBondContact OG-CG 3.39Å | ||
| 72 | P | 75.3 | Confident | 80.1 | Confident | 113 Ų | 113 | 82.7 Ų | 82.7 | 73% | 0.734 | 43% | 0.426 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.5 | -13.4 | -180 | 26.6 | -35 | 0 | 0 | 0 | 113.3 | ||
| 73 | K | 74.9 | Confident | 79.1 | Confident | 201 Ų | 201 | 76.9 Ų | 76.9 | 87% | 0.874 | 41% | 0.409 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89 | -11.8 | 178.7 | -65.2 | -179.1 | -179.6 | 174 | 0 | 113.4 | S71 | S71-K73 PolarHBondContact O-N 2.83Å; S71-K73 VanDerWaalsContact O-N 3.11Å |
| 74 | L | 77.9 | Confident | 77.5 | Confident | 128 Ų | 128 | 76.4 Ų | 76.4 | 67% | 0.67 | 41% | 0.407 | S | S | * | . | S | Bend | trans | -98.6 | 151.8 | 179 | -65.9 | 178 | 0 | 0 | 0 | 110.2 | S71 S76 | S71-L74 PolarHBondContact O-N 2.88Å; S71-L74 VanDerWaalsContact O-N 3.16Å; S71-L74 WeakPolarHBondContact OG-CD1 3.48Å; S71-L74 VanDerWaalsContact OG-CG 3.32Å; S71-L74 WeakPolarHBondContact OG-CG 3.39Å; L74-S76 PolarHBondContact O-N 2.85Å |
| 75 | R | 79.1 | Confident | 76.2 | Confident | 130 Ų | 130 | 78.6 Ų | 78.6 | 49% | 0.491 | 42% | 0.418 | S | S | . | . | P | Polyproline II helix | trans | -69.2 | 127 | 174.1 | -62.2 | -177.6 | -173.9 | -179 | -0 | 108.9 | Q100 | R75-Q100 HydrophobicContact CG-CG 4.34Š|
| 76 | S | 82.9 | Confident | 74.7 | Confident | 22 Ų | 22 | 81.4 Ų | 81.4 | 15% | 0.154 | 43% | 0.427 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.6 | 134.9 | 173.6 | -168.8 | 0 | 0 | 0 | 0 | 109.1 | F64 C68 L74 Y99 | F64-S76 WeakPolarHBondContact CE2-OG 3.48Å; C68-S76 PolarHBondContact SG-OG 2.63Å; L74-S76 PolarHBondContact O-N 2.85Å; S76-Y99 PolarHBondContact N-O 3.15Å; S76-Y99 PolarHBondContact O-N 2.88Å |
| 77 | I | 84.7 | Confident | 73 | Confident | 50 Ų | 50 | 86.5 Ų | 86.5 | 26% | 0.256 | 45% | 0.45 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.7 | 118.2 | -179.2 | -55.1 | 174.4 | 0 | 0 | 0 | 107.6 | I43 V79 L96 E97 I98 | I43-I77 HydrophobicContact CD1-CD1 3.82Å; I77-V79 HydrophobicContact CG2-CG2 4.29Å; I77-L96 HydrophobicContact CG2-CD2 4.19Å; I77-E97 CarbonylContact C-O 3.57Å; I77-E97 WeakPolarHBondContact CA-O 3.33Å; I77-I98 HydrophobicContact CG1-CG1 4.28Å; I77-I98 HydrophobicContact CG1-CG2 4.29Å; I77-I98 HydrophobicContact CG2-CG1 4.26Å |
| 78 | A | 83.9 | Confident | 71.3 | Confident | 28 Ų | 28 | 93.1 Ų | 93.1 | 23% | 0.231 | 47% | 0.468 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96 | 134.2 | 168.6 | 0 | 0 | 0 | 0 | 0 | 109.3 | L96 E97 Y99 | A78-L96 CarbonylContact O-C 3.44Å; A78-L96 WeakPolarHBondContact O-CA 3.37Å; A78-E97 HydrophobicContact CB-CB 4.26Å; A78-E97 PolarHBondContact N-O 2.68Å; A78-E97 PolarHBondContact O-N 3.33Å; A78-Y99 HydrophobicContact CB-CE2 4.22Å |
| 79 | V | 84.6 | Confident | 70.1 | Confident | 56 Ų | 56 | 101.7 Ų | 101.7 | 34% | 0.339 | 50% | 0.501 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.7 | 116.6 | 174.2 | -170.8 | 0 | 0 | 0 | 0 | 107.6 | I77 Y81 P94 L96 | I77-V79 HydrophobicContact CG2-CG2 4.29Å; V79-Y81 HydrophobicContact CG1-CE1 4.08Å; V79-Y81 HydrophobicContact CG1-CE2 4.24Å; V79-P94 HydrophobicContact CG1-CB 4.19Å; V79-L96 HydrophobicContact CG1-CD1 4.44Å; V79-L96 HydrophobicContact CG1-CG 4.42Å; V79-L96 HydrophobicContact CG2-CD2 4.43Å; V79-L96 HydrophobicContact CG2-CG 4.15Å |
| 80 | Y | 80.7 | Confident | 68.7 | Low | 93 Ų | 93 | 103.3 Ų | 103.3 | 37% | 0.365 | 50% | 0.503 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.4 | 135.4 | 176.4 | 178.4 | -97.2 | 0 | 0 | 0 | 110.1 | Y57 D82 P94 R95 | Y57-Y80 HydrophobicContact CD2-CD2 4.05Å; Y57-Y80 HydrophobicContact CD2-CE2 4.48Å; Y80-D82 HydrophobicContact CE1-CB 4.25Å; Y80-D82 PolarHBondContact OH-OD1 3.27Å; Y80-P94 WeakPolarHBondContact O-CA 2.9Å; Y80-R95 PolarHBondContact N-O 2.95Å; Y80-R95 PolarHBondContact O-N 3.46Å |
| 81 | Y | 75.6 | Confident | 67.2 | Low | 39 Ų | 39 | 101.2 Ų | 101.2 | 15% | 0.153 | 50% | 0.5 | C | S | . | . | trans | -112.5 | 123.3 | 170.3 | -48.7 | -86.5 | 0 | 0 | 0 | 107.1 | V79 P94 F116 Y117 V118 M121 | V79-Y81 HydrophobicContact CG1-CE1 4.08Å; V79-Y81 HydrophobicContact CG1-CE2 4.24Å; Y81-P94 HydrophobicContact CD1-CB 4.37Å; Y81-P94 HydrophobicContact CE1-CB 4.3Å; Y81-F116 PolarHBondContact OH-O 3.15Å; Y81-Y117 HydrophobicContact CD1-CD1 4.12Å; Y81-Y117 AromaticContact CD1-CE1 3.96Å; Y81-Y117 HydrophobicContact CD1-CE1 3.96Å; Y81-Y117 HydrophobicContact CE1-CD1 4.04Å; Y81-Y117 HydrophobicContact CE1-CE1 4.32Å; Y81-Y117 HydrophobicContact CE1-CG 4.36Å; Y81-V118 WeakPolarHBondContact OH-CG2 3.49Å; Y81-M121 HydrophobicContact CD1-SD 3.82Å; Y81-M121 HydrophobicContact CD2-SD 4.2Å; Y81-M121 HydrophobicContact CE1-SD 4.26Å; Y81-M121 HydrophobicContact CG-CE 4.43Å; Y81-M121 HydrophobicContact CG-SD 3.78Å | ||
| 82 | D | 69.6 | Low | 66.5 | Low | 97 Ų | 97 | 99.6 Ų | 99.6 | 52% | 0.519 | 49% | 0.489 | S | S | . | . | trans | -62.2 | 141.9 | 159.6 | -115.5 | -13 | 0 | 0 | 0 | 107.5 | Y80 P84 A92 | Y80-D82 HydrophobicContact CE1-CB 4.25Å; Y80-D82 PolarHBondContact OH-OD1 3.27Å; D82-P84 VanDerWaalsContact O-CD 3.24Å; D82-P84 WeakPolarHBondContact O-CD 3.46Å; D82-A92 VanDerWaalsContact C-CB 3.42Å; D82-A92 HydrophobicContact CB-CB 3.47Å; D82-A92 VanDerWaalsContact CB-CB 3.47Å; D82-A92 WeakPolarHBondContact O-CB 3.32Å | ||
| 83 | N | 61.9 | Low | 66.2 | Low | 64 Ų | 64 | 100.8 Ų | 100.8 | 34% | 0.342 | 48% | 0.48 | S | S | . | . | trans | -103.9 | 98.3 | 177.4 | -160 | -6.5 | 0 | 0 | 0 | 108.9 | H85 | N83-H85 PolarHBondContact O-N 3.11Š| ||
| 84 | P | 52.3 | Low | 66.2 | Low | 22 Ų | 22 | 91.3 Ų | 91.3 | 14% | 0.143 | 44% | 0.438 | C | S | . | . | G | 310 helix | trans | -78.5 | -12.9 | -173.9 | 33.2 | -34.7 | 0 | 0 | 0 | 112.9 | D82 M86 R88 L90 A92 | D82-P84 VanDerWaalsContact O-CD 3.24Å; D82-P84 WeakPolarHBondContact O-CD 3.46Å; P84-M86 PolarHBondContact O-N 3.33Å; P84-R88 CarbonylContact O-C 3.55Å; P84-R88 PolarHBondContact O-N 3.46Å; P84-L90 HydrophobicContact CB-CB 4.36Å; P84-L90 WeakPolarHBondContact CB-O 3.44Å; P84-L90 WeakPolarHBondContact CG-O 3.5Å; P84-A92 HydrophobicContact CG-CB 4.12Å |
| 85 | H | 52.7 | Low | 66.4 | Low | 102 Ų | 102 | 92 Ų | 92 | 47% | 0.472 | 43% | 0.432 | S | S | . | . | G | 310 helix | trans | -73.1 | -11.9 | -175.7 | -67.7 | -69.6 | 0 | 0 | 0 | 113.7 | N83 E125 | N83-H85 PolarHBondContact O-N 3.11Å; H85-E125 IonicContact CD2-OE1 3.32Å; H85-E125 IonicContact CE1-OE1 2.82Å; H85-E125 VanDerWaalsContact NE2-CD 3.3Å; H85-E125 IonicContact NE2-OE1 3.51Å; H85-E125 PolarHBondContact NE2-OE1 3.24Å; H85-E125 IonicContact NE2-OE2 3.89Å |
| 86 | M | 51.6 | Low | 66.7 | Low | 155 Ų | 155 | 86.2 Ų | 86.2 | 76% | 0.764 | 41% | 0.411 | S | S | * | . | G | 310 helix | trans | -78.5 | -27.1 | 177.8 | -77.3 | -175.3 | 67.7 | 0 | 0 | 113.2 | P84 | P84-M86 PolarHBondContact O-N 3.33Š|
| 87 | E | 49.3 | Very low | 66.9 | Low | 165 Ų | 165 | 86.2 Ų | 86.2 | 77% | 0.771 | 41% | 0.409 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -144.6 | -33.6 | -175.2 | -63.2 | -169.6 | -167.4 | 0 | 0 | 116.8 | ||
| 88 | R | 47.1 | Very low | 67 | Low | 186 Ų | 186 | 84 Ų | 84 | 70% | 0.702 | 40% | 0.397 | S | S | * | . | S | Bend | trans | -156.4 | 120.2 | -172.7 | -55.8 | -178.8 | -167.4 | -168.7 | 2.5 | 108.5 | P84 L90 | P84-R88 CarbonylContact O-C 3.55Å; P84-R88 PolarHBondContact O-N 3.46Å; R88-L90 HydrophobicContact CB-CD1 3.52Å; R88-L90 WeakPolarHBondContact O-CD1 3.02Å; R88-L90 PolarHBondContact O-N 3.38Å |
| 89 | K | 51.3 | Low | 66.9 | Low | 217 Ų | 217 | 85.1 Ų | 85.1 | 94% | 0.943 | 40% | 0.396 | S | S | * | . | trans | -49.9 | 55.7 | 179.5 | -62.4 | 174 | 176.4 | 177 | 0 | 115.7 | ||||
| 90 | L | 50.3 | Low | 66.7 | Low | 118 Ų | 118 | 85.1 Ų | 85.1 | 62% | 0.618 | 39% | 0.392 | S | S | * | . | P | Polyproline II helix | trans | -92.1 | 147 | 174.3 | -82.4 | 83.1 | 0 | 0 | 0 | 108.2 | P84 R88 A92 | P84-L90 HydrophobicContact CB-CB 4.36Å; P84-L90 WeakPolarHBondContact CB-O 3.44Å; P84-L90 WeakPolarHBondContact CG-O 3.5Å; R88-L90 HydrophobicContact CB-CD1 3.52Å; R88-L90 WeakPolarHBondContact O-CD1 3.02Å; R88-L90 PolarHBondContact O-N 3.38Å; L90-A92 PolarHBondContact O-N 2.98Å |
| 91 | C | 53.1 | Low | 66.6 | Low | 98 Ų | 98 | 90.3 Ų | 90.3 | 66% | 0.662 | 42% | 0.42 | S | S | * | . | P | Polyproline II helix | trans | -77.9 | 116.6 | 170 | -62.6 | 0 | 0 | 0 | 0 | 107.5 | Y93 | C91-Y93 HydrophobicContact CB-CE1 4.39Å; C91-Y93 PolarHBondContact O-N 2.78Å |
| 92 | A | 58.7 | Low | 66.7 | Low | 7 Ų | 7 | 96.2 Ų | 96.2 | 6% | 0.058 | 45% | 0.454 | C | S | . | . | P | Polyproline II helix | trans | -78.1 | 122.2 | 172.8 | 0 | 0 | 0 | 0 | 0 | 110 | D82 P84 L90 Y117 | D82-A92 VanDerWaalsContact C-CB 3.42Å; D82-A92 HydrophobicContact CB-CB 3.47Å; D82-A92 VanDerWaalsContact CB-CB 3.47Å; D82-A92 WeakPolarHBondContact O-CB 3.32Å; P84-A92 HydrophobicContact CG-CB 4.12Å; L90-A92 PolarHBondContact O-N 2.98Å; A92-Y117 PolarHBondContact O-OH 3.15Å |
| 93 | Y | 67.9 | Low | 67.2 | Low | 139 Ų | 139 | 97.7 Ų | 97.7 | 55% | 0.545 | 46% | 0.458 | S | S | . | . | P | Polyproline II helix | trans | -86.9 | 135 | 177.5 | -63.7 | -60.3 | 0 | 0 | 0 | 110.2 | C91 R95 Q113 | C91-Y93 HydrophobicContact CB-CE1 4.39Å; C91-Y93 PolarHBondContact O-N 2.78Å; Y93-R95 PolarHBondContact O-N 3.48Å; Y93-Q113 HydrophobicContact CD1-CG 4.16Å; Y93-Q113 VanDerWaalsContact CE1-CD 3.44Å |
| 94 | P | 76 | Confident | 68.2 | Low | 1 Ų | 1 | 98.6 Ų | 98.6 | 1% | 0.006 | 46% | 0.461 | C | S | . | . | P | Polyproline II helix | trans | -60.6 | 130.1 | 176.9 | 25.6 | -33.4 | 0 | 0 | 0 | 109 | V79 Y80 Y81 L96 P109 Q113 F116 | V79-P94 HydrophobicContact CG1-CB 4.19Å; Y80-P94 WeakPolarHBondContact O-CA 2.9Å; Y81-P94 HydrophobicContact CD1-CB 4.37Å; Y81-P94 HydrophobicContact CE1-CB 4.3Å; P94-L96 HydrophobicContact CB-CD1 4.35Å; P94-P109 HydrophobicContact CG-CG 4.21Å; P94-P109 WeakPolarHBondContact O-CD 3.43Å; P94-Q113 HydrophobicContact CG-CB 4.27Å; P94-F116 HydrophobicContact CB-CB 3.99Å; P94-F116 HydrophobicContact CG-CB 3.84Å; P94-F116 HydrophobicContact CG-CD2 4.47Å; P94-F116 HydrophobicContact CG-CG 4.28Å |
| 95 | R | 81.3 | Confident | 69.7 | Low | 142 Ų | 142 | 100.6 Ų | 100.6 | 54% | 0.536 | 47% | 0.469 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.2 | 130.1 | 171.4 | -174.3 | 172.7 | -76.6 | -178.8 | -1.4 | 108.3 | Y80 Y93 | Y80-R95 PolarHBondContact N-O 2.95Å; Y80-R95 PolarHBondContact O-N 3.46Å; Y93-R95 PolarHBondContact O-N 3.48Å |
| 96 | L | 85.9 | Confident | 71.2 | Confident | 10 Ų | 10 | 102.3 Ų | 102.3 | 5% | 0.052 | 48% | 0.475 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.3 | 139 | -177.3 | -73.7 | 81.4 | 0 | 0 | 0 | 110 | I77 A78 V79 P94 F106 M107 P109 F116 | I77-L96 HydrophobicContact CG2-CD2 4.19Å; A78-L96 CarbonylContact O-C 3.44Å; A78-L96 WeakPolarHBondContact O-CA 3.37Å; V79-L96 HydrophobicContact CG1-CD1 4.44Å; V79-L96 HydrophobicContact CG1-CG 4.42Å; V79-L96 HydrophobicContact CG2-CD2 4.43Å; V79-L96 HydrophobicContact CG2-CG 4.15Å; P94-L96 HydrophobicContact CB-CD1 4.35Å; L96-F106 WeakPolarHBondContact O-CA 3.34Å; L96-M107 HydrophobicContact CB-CB 4.24Å; L96-M107 PolarHBondContact N-O 2.69Å; L96-M107 PolarHBondContact O-N 2.91Å; L96-P109 HydrophobicContact CD1-CG 3.52Å; L96-F116 HydrophobicContact CD1-CD1 4Å; L96-F116 HydrophobicContact CD1-CE1 4.17Å; L96-F116 HydrophobicContact CD2-CD1 4.03Å; L96-F116 HydrophobicContact CD2-CE1 3.77Å |
| 97 | E | 87.3 | Confident | 72.7 | Confident | 22 Ų | 22 | 97.2 Ų | 97.2 | 10% | 0.103 | 45% | 0.45 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.7 | 113.6 | 170.9 | -54.3 | -178 | 171.7 | 0 | 0 | 107.5 | Y57 I77 A78 Y99 H105 F106 | Y57-E97 PolarHBondContact OH-OE2 2.77Å; I77-E97 CarbonylContact C-O 3.57Å; I77-E97 WeakPolarHBondContact CA-O 3.33Å; A78-E97 HydrophobicContact CB-CB 4.26Å; A78-E97 PolarHBondContact N-O 2.68Å; A78-E97 PolarHBondContact O-N 3.33Å; E97-Y99 HydrophobicContact CB-CD2 4.34Å; E97-Y99 HydrophobicContact CB-CE2 3.58Å; E97-Y99 PolarHBondContact OE2-OH 3.34Å; E97-H105 WeakPolarHBondContact CA-O 3.38Å; E97-F106 HydrophobicContact CB-CE1 4.5Å; E97-F106 HydrophobicContact CG-CD1 3.77Å; E97-F106 HydrophobicContact CG-CE1 3.72Å; E97-F106 WeakPolarHBondContact OE1-CE1 3.3Å |
| 98 | I | 85.4 | Confident | 74.3 | Confident | 2 Ų | 2 | 92.4 Ų | 92.4 | 1% | 0.01 | 43% | 0.434 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.3 | 113.1 | -179 | -55.3 | 153.3 | 0 | 0 | 0 | 106.9 | I43 I77 I104 H105 | I43-I98 HydrophobicContact CD1-CD1 3.42Å; I43-I98 VanDerWaalsContact CD1-CD1 3.42Å; I43-I98 HydrophobicContact CD1-CG1 3.91Å; I43-I98 HydrophobicContact CG1-CD1 4.14Å; I77-I98 HydrophobicContact CG1-CG1 4.28Å; I77-I98 HydrophobicContact CG1-CG2 4.29Å; I77-I98 HydrophobicContact CG2-CG1 4.26Å; I98-I104 WeakPolarHBondContact O-CA 3.44Å; I98-H105 HydrophobicContact CB-CB 4.19Å; I98-H105 HydrophobicContact CD1-CB 4.38Å; I98-H105 PolarHBondContact N-O 2.82Å; I98-H105 PolarHBondContact O-N 3.4Å |
| 99 | Y | 82.7 | Confident | 75.8 | Confident | 53 Ų | 53 | 84.1 Ų | 84.1 | 21% | 0.208 | 40% | 0.404 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.9 | 117.7 | 179.4 | -64 | -101.1 | 0 | 0 | 0 | 108.6 | F64 S76 A78 E97 I104 | F64-Y99 HydrophobicContact CD2-CE2 4.39Å; F64-Y99 HydrophobicContact CE1-CD1 4.22Å; F64-Y99 HydrophobicContact CE1-CE1 4.13Å; F64-Y99 HydrophobicContact CE1-CG 4.48Å; F64-Y99 HydrophobicContact CE2-CD1 4.4Å; F64-Y99 AromaticContact CE2-CD2 3.45Å; F64-Y99 HydrophobicContact CE2-CD2 3.45Å; F64-Y99 VanDerWaalsContact CE2-CD2 3.45Å; F64-Y99 HydrophobicContact CE2-CE1 4.4Å; F64-Y99 AromaticContact CE2-CE2 3.47Å; F64-Y99 HydrophobicContact CE2-CE2 3.47Å; F64-Y99 VanDerWaalsContact CE2-CE2 3.47Å; F64-Y99 AromaticContact CE2-CG 3.95Å; F64-Y99 HydrophobicContact CE2-CG 3.95Å; F64-Y99 AromaticContact CE2-CZ 3.98Å; F64-Y99 AromaticContact CZ-CD1 3.57Å; F64-Y99 HydrophobicContact CZ-CD1 3.57Å; F64-Y99 AromaticContact CZ-CD2 3.44Å; F64-Y99 HydrophobicContact CZ-CD2 3.44Å; F64-Y99 VanDerWaalsContact CZ-CD2 3.44Å; F64-Y99 AromaticContact CZ-CE1 3.7Å; F64-Y99 HydrophobicContact CZ-CE1 3.7Å; F64-Y99 AromaticContact CZ-CE2 3.61Å; F64-Y99 HydrophobicContact CZ-CE2 3.61Å; F64-Y99 AromaticContact CZ-CG 3.43Å; F64-Y99 HydrophobicContact CZ-CG 3.43Å; F64-Y99 VanDerWaalsContact CZ-CG 3.43Å; F64-Y99 AromaticContact CZ-CZ 3.74Å; S76-Y99 PolarHBondContact N-O 3.15Å; S76-Y99 PolarHBondContact O-N 2.88Å; A78-Y99 HydrophobicContact CB-CE2 4.22Å; E97-Y99 HydrophobicContact CB-CD2 4.34Å; E97-Y99 HydrophobicContact CB-CE2 3.58Å; E97-Y99 PolarHBondContact OE2-OH 3.34Å; Y99-I104 HydrophobicContact CD1-CD1 3.91Å; Y99-I104 HydrophobicContact CD1-CG1 3.76Å; Y99-I104 HydrophobicContact CD1-CG2 4.34Å; Y99-I104 HydrophobicContact CE1-CD1 3.63Å; Y99-I104 HydrophobicContact CE1-CG1 3.96Å; Y99-I104 HydrophobicContact CE1-CG2 4.19Å |
| 100 | Q | 79.4 | Confident | 77 | Confident | 56 Ų | 56 | 81.4 Ų | 81.4 | 26% | 0.262 | 40% | 0.399 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.7 | 100.5 | 179.5 | -173.3 | 173.1 | -7.2 | 0 | 0 | 109.6 | R75 D102 Q103 | R75-Q100 HydrophobicContact CG-CG 4.34Å; Q100-D102 PolarHBondContact O-N 2.81Å; Q100-Q103 CarbonylContact C-O 3.58Å; Q100-Q103 PolarHBondContact N-O 3.13Å; Q100-Q103 PolarHBondContact O-N 2.78Å; Q100-Q103 VanDerWaalsContact O-O 3.13Å |
| 101 | E | 78.7 | Confident | 77.9 | Confident | 202 Ų | 202 | 79.2 Ų | 79.2 | 94% | 0.944 | 40% | 0.398 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.7 | -108.2 | -179.8 | -60.3 | 173.5 | -168.6 | 0 | 0 | 111.3 | ||
| 102 | D | 79 | Confident | 78.8 | Confident | 163 Ų | 163 | 83.5 Ų | 83.5 | 87% | 0.872 | 40% | 0.4 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.3 | 7.3 | -178.8 | -162.4 | 46.3 | 0 | 0 | 0 | 113.5 | Q100 | Q100-D102 PolarHBondContact O-N 2.81Š|
| 103 | Q | 78.9 | Confident | 79.5 | Confident | 128 Ų | 128 | 85.4 Ų | 85.4 | 60% | 0.598 | 41% | 0.408 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -123.2 | 137.8 | -178.1 | -69.1 | -178.9 | 66.2 | 0 | 0 | 111.6 | Q100 | Q100-Q103 CarbonylContact C-O 3.58Å; Q100-Q103 PolarHBondContact N-O 3.13Å; Q100-Q103 PolarHBondContact O-N 2.78Å; Q100-Q103 VanDerWaalsContact O-O 3.13Å |
| 104 | I | 83.8 | Confident | 79.6 | Confident | 82 Ų | 82 | 80.6 Ų | 80.6 | 42% | 0.421 | 40% | 0.401 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.6 | 116.7 | 173 | -54.5 | 173.4 | 0 | 0 | 0 | 107.7 | I98 Y99 F106 | I98-I104 WeakPolarHBondContact O-CA 3.44Å; Y99-I104 HydrophobicContact CD1-CD1 3.91Å; Y99-I104 HydrophobicContact CD1-CG1 3.76Å; Y99-I104 HydrophobicContact CD1-CG2 4.34Å; Y99-I104 HydrophobicContact CE1-CD1 3.63Å; Y99-I104 HydrophobicContact CE1-CG1 3.96Å; Y99-I104 HydrophobicContact CE1-CG2 4.19Å; I104-F106 HydrophobicContact CB-CE2 4.16Å; I104-F106 HydrophobicContact CG2-CD2 4.25Å; I104-F106 HydrophobicContact CG2-CE1 4.31Å; I104-F106 HydrophobicContact CG2-CE2 3.68Å; I104-F106 HydrophobicContact CG2-CZ 3.71Å |
| 105 | H | 82.8 | Confident | 79.6 | Confident | 65 Ų | 65 | 85.4 Ų | 85.4 | 30% | 0.301 | 43% | 0.427 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.6 | 116.3 | 174.1 | -56.5 | -76.4 | 0 | 0 | 0 | 110.2 | E97 I98 | E97-H105 WeakPolarHBondContact CA-O 3.38Å; I98-H105 HydrophobicContact CB-CB 4.19Å; I98-H105 HydrophobicContact CD1-CB 4.38Å; I98-H105 PolarHBondContact N-O 2.82Å; I98-H105 PolarHBondContact O-N 3.4Å |
| 106 | F | 84.4 | Confident | 79.4 | Confident | 137 Ų | 137 | 82.3 Ų | 82.3 | 60% | 0.601 | 42% | 0.417 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -88.3 | 122.3 | 170.4 | -64.5 | -85.9 | 0 | 0 | 0 | 109.6 | L96 E97 I104 | L96-F106 WeakPolarHBondContact O-CA 3.34Å; E97-F106 HydrophobicContact CB-CE1 4.5Å; E97-F106 HydrophobicContact CG-CD1 3.77Å; E97-F106 HydrophobicContact CG-CE1 3.72Å; E97-F106 WeakPolarHBondContact OE1-CE1 3.3Å; I104-F106 HydrophobicContact CB-CE2 4.16Å; I104-F106 HydrophobicContact CG2-CD2 4.25Å; I104-F106 HydrophobicContact CG2-CE1 4.31Å; I104-F106 HydrophobicContact CG2-CE2 3.68Å; I104-F106 HydrophobicContact CG2-CZ 3.71Å |
| 107 | M | 83.7 | Confident | 78.8 | Confident | 48 Ų | 48 | 84.2 Ų | 84.2 | 24% | 0.236 | 42% | 0.424 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.5 | 134.1 | -177.6 | 176.6 | 166 | -67.2 | 0 | 0 | 111.4 | P41 P42 L96 | P41-M107 HydrophobicContact CB-CE 4.05Å; P41-M107 HydrophobicContact CB-SD 3.95Å; P42-M107 HydrophobicContact CG-CE 4.21Å; L96-M107 HydrophobicContact CB-CB 4.24Å; L96-M107 PolarHBondContact N-O 2.69Å; L96-M107 PolarHBondContact O-N 2.91Å |
| 108 | C | 82.1 | Confident | 78.3 | Confident | 64 Ų | 64 | 84.3 Ų | 84.3 | 43% | 0.432 | 43% | 0.426 | S | S | . | . | trans | -115.8 | 111.7 | 169.8 | -64.7 | 0 | 0 | 0 | 0 | 108.2 | L110 | C108-L110 PolarHBondContact O-N 3.35Š| ||
| 109 | P | 79.8 | Confident | 77.5 | Confident | 13 Ų | 13 | 87.9 Ų | 87.9 | 8% | 0.084 | 45% | 0.449 | C | S | . | . | trans | -61.9 | 128.2 | 176.8 | -21.3 | 34.8 | 0 | 0 | 0 | 110.6 | P94 L96 Q113 F116 | P94-P109 HydrophobicContact CG-CG 4.21Å; P94-P109 WeakPolarHBondContact O-CD 3.43Å; L96-P109 HydrophobicContact CD1-CG 3.52Å; P109-Q113 HydrophobicContact CB-CG 4.22Å; P109-Q113 WeakPolarHBondContact O-CG 3.44Å; P109-Q113 PolarHBondContact O-NE2 3.09Å; P109-F116 HydrophobicContact CB-CD2 4.09Å; P109-F116 HydrophobicContact CB-CE2 3.63Å; P109-F116 HydrophobicContact CB-CZ 4.06Å; P109-F116 HydrophobicContact CG-CD1 4.37Å; P109-F116 HydrophobicContact CG-CD2 3.97Å; P109-F116 HydrophobicContact CG-CE1 4.12Å; P109-F116 HydrophobicContact CG-CE2 3.7Å; P109-F116 HydrophobicContact CG-CG 4.3Å; P109-F116 HydrophobicContact CG-CZ 3.77Å | ||
| 110 | L | 75.2 | Confident | 77.1 | Confident | 159 Ų | 159 | 88.2 Ų | 88.2 | 83% | 0.832 | 45% | 0.453 | S | S | * | . | S | Bend | trans | -92 | -15.7 | -179.8 | -61.7 | 177.6 | 0 | 0 | 0 | 113.2 | C108 | C108-L110 PolarHBondContact O-N 3.35Š|
| 111 | A | 69.5 | Low | 76.5 | Confident | 72 Ų | 72 | 86.4 Ų | 86.4 | 60% | 0.595 | 45% | 0.445 | S | S | * | . | S | Bend | trans | -145.3 | 159.5 | -178.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | Q113 | A111-Q113 PolarHBondContact O-N 3.24Å; A111-Q113 VanDerWaalsContact O-N 3.15Å |
| 112 | R | 71.9 | Confident | 75.7 | Confident | 189 Ų | 189 | 82.6 Ų | 82.6 | 71% | 0.713 | 43% | 0.425 | S | S | * | . | trans | 52.8 | 33 | -178.9 | -62.4 | 177.4 | 59.4 | -164 | -1.6 | 113.5 | G114 D115 | R112-G114 PolarHBondContact O-N 3.09Å; R112-G114 VanDerWaalsContact O-N 3.15Å; R112-D115 IonicContact CZ-OD2 2.82Å; R112-D115 IonicContact NE-OD2 3.55Å; R112-D115 PolarHBondContact NE-OD2 3.45Å; R112-D115 IonicContact NH2-OD2 3.92Å; R112-D115 PolarHBondContact NH2-OD2 3.31Å; R112-D115 WeakPolarHBondContact O-CB 3.32Å; R112-D115 PolarHBondContact O-N 3.24Å | ||
| 113 | Q | 73.7 | Confident | 74.9 | Confident | 46 Ų | 46 | 80.2 Ų | 80.2 | 22% | 0.215 | 41% | 0.409 | C | S | . | . | G | 310 helix | trans | -58.7 | -31 | -177.9 | -67.4 | 154 | -21.9 | 0 | 0 | 112.2 | Y93 P94 P109 A111 D115 F116 Y117 | Y93-Q113 HydrophobicContact CD1-CG 4.16Å; Y93-Q113 VanDerWaalsContact CE1-CD 3.44Å; P94-Q113 HydrophobicContact CG-CB 4.27Å; P109-Q113 HydrophobicContact CB-CG 4.22Å; P109-Q113 WeakPolarHBondContact O-CG 3.44Å; P109-Q113 PolarHBondContact O-NE2 3.09Å; A111-Q113 PolarHBondContact O-N 3.24Å; A111-Q113 VanDerWaalsContact O-N 3.15Å; Q113-D115 PolarHBondContact O-N 2.98Å; Q113-F116 PolarHBondContact O-N 2.99Å; Q113-F116 VanDerWaalsContact O-N 3.13Å; Q113-Y117 VanDerWaalsContact O-CD2 3.3Å; Q113-Y117 WeakPolarHBondContact O-CD2 3.39Å |
| 114 | G | 69.5 | Low | 74.1 | Confident | 39 Ų | 39 | 76 Ų | 76 | 40% | 0.402 | 39% | 0.391 | S | S | . | . | G | 310 helix | trans | -58.1 | -22.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | R112 | R112-G114 PolarHBondContact O-N 3.09Å; R112-G114 VanDerWaalsContact O-N 3.15Å |
| 115 | D | 76.9 | Confident | 73 | Confident | 102 Ų | 102 | 74.2 Ų | 74.2 | 55% | 0.545 | 38% | 0.381 | S | S | . | . | G | 310 helix | trans | -82.5 | -17.1 | -179.4 | -63.7 | -11 | 0 | 0 | 0 | 112.5 | R112 Q113 Y117 | R112-D115 IonicContact CZ-OD2 2.82Å; R112-D115 IonicContact NE-OD2 3.55Å; R112-D115 PolarHBondContact NE-OD2 3.45Å; R112-D115 IonicContact NH2-OD2 3.92Å; R112-D115 PolarHBondContact NH2-OD2 3.31Å; R112-D115 WeakPolarHBondContact O-CB 3.32Å; R112-D115 PolarHBondContact O-N 3.24Å; Q113-D115 PolarHBondContact O-N 2.98Å; D115-Y117 VanDerWaalsContact C-N 3.29Å |
| 116 | F | 76.3 | Confident | 71.7 | Confident | 76 Ų | 76 | 79 Ų | 79 | 33% | 0.333 | 40% | 0.397 | S | S | . | . | G | 310 helix | trans | -83.4 | -9.6 | 175.8 | -68.4 | -91.8 | 0 | 0 | 0 | 112.2 | Y81 P94 L96 P109 Q113 V118 | Y81-F116 PolarHBondContact OH-O 3.15Å; P94-F116 HydrophobicContact CB-CB 3.99Å; P94-F116 HydrophobicContact CG-CB 3.84Å; P94-F116 HydrophobicContact CG-CD2 4.47Å; P94-F116 HydrophobicContact CG-CG 4.28Å; L96-F116 HydrophobicContact CD1-CD1 4Å; L96-F116 HydrophobicContact CD1-CE1 4.17Å; L96-F116 HydrophobicContact CD2-CD1 4.03Å; L96-F116 HydrophobicContact CD2-CE1 3.77Å; P109-F116 HydrophobicContact CB-CD2 4.09Å; P109-F116 HydrophobicContact CB-CE2 3.63Å; P109-F116 HydrophobicContact CB-CZ 4.06Å; P109-F116 HydrophobicContact CG-CD1 4.37Å; P109-F116 HydrophobicContact CG-CD2 3.97Å; P109-F116 HydrophobicContact CG-CE1 4.12Å; P109-F116 HydrophobicContact CG-CE2 3.7Å; P109-F116 HydrophobicContact CG-CG 4.3Å; P109-F116 HydrophobicContact CG-CZ 3.77Å; Q113-F116 PolarHBondContact O-N 2.99Å; Q113-F116 VanDerWaalsContact O-N 3.13Å; F116-V118 PolarHBondContact O-N 2.82Å |
| 117 | Y | 74.4 | Confident | 70.6 | Confident | 50 Ų | 50 | 79.6 Ų | 79.6 | 20% | 0.196 | 40% | 0.399 | C | S | . | . | S | Bend | trans | -75.9 | 120.3 | 177.2 | -75.7 | -93.8 | 0 | 0 | 0 | 111.1 | Y81 A92 Q113 D115 M121 | Y81-Y117 HydrophobicContact CD1-CD1 4.12Å; Y81-Y117 AromaticContact CD1-CE1 3.96Å; Y81-Y117 HydrophobicContact CD1-CE1 3.96Å; Y81-Y117 HydrophobicContact CE1-CD1 4.04Å; Y81-Y117 HydrophobicContact CE1-CE1 4.32Å; Y81-Y117 HydrophobicContact CE1-CG 4.36Å; A92-Y117 PolarHBondContact O-OH 3.15Å; Q113-Y117 VanDerWaalsContact O-CD2 3.3Å; Q113-Y117 WeakPolarHBondContact O-CD2 3.39Å; D115-Y117 VanDerWaalsContact C-N 3.29Å; Y117-M121 HydrophobicContact CD1-CE 4.13Å; Y117-M121 HydrophobicContact CD1-CG 4.25Å; Y117-M121 HydrophobicContact CD1-SD 3.32Å; Y117-M121 WeakPolarHBondContact CD1-SD 2.74Å; Y117-M121 HydrophobicContact CE1-CE 3.65Å; Y117-M121 HydrophobicContact CE1-SD 3.44Å; Y117-M121 WeakPolarHBondContact CE1-SD 3.44Å |
| 118 | V | 75.8 | Confident | 69.3 | Low | 24 Ų | 24 | 84.1 Ų | 84.1 | 15% | 0.145 | 41% | 0.414 | C | S | . | . | trans | -64.2 | 133.9 | 170.4 | 172.7 | 0 | 0 | 0 | 0 | 109.2 | Y50 F52 Y81 F116 E120 M121 | Y50-V118 HydrophobicContact CD2-CG1 4.34Å; Y50-V118 HydrophobicContact CD2-CG2 4.42Å; Y50-V118 HydrophobicContact CE2-CG1 3.64Å; Y50-V118 HydrophobicContact CE2-CG2 4.42Å; F52-V118 HydrophobicContact CD2-CG1 4.21Å; Y81-V118 WeakPolarHBondContact OH-CG2 3.49Å; F116-V118 PolarHBondContact O-N 2.82Å; V118-E120 HydrophobicContact CG1-CB 4.04Å; V118-E120 VanDerWaalsContact CG1-CD 3.42Å; V118-E120 HydrophobicContact CG1-CG 4.28Å; V118-E120 WeakPolarHBondContact CG1-OE2 3.47Å; V118-E120 PolarHBondContact O-N 3.17Å; V118-E120 VanDerWaalsContact O-N 3.12Å; V118-M121 WeakPolarHBondContact O-CB 3.37Å; V118-M121 PolarHBondContact O-N 3.31Å | ||
| 119 | P | 69.3 | Low | 68.3 | Low | 77 Ų | 77 | 86.6 Ų | 86.6 | 50% | 0.5 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -49.7 | -37.3 | -179.1 | -28.6 | 34.2 | 0 | 0 | 0 | 114.2 | M121 K122 E123 | P119-M121 PolarHBondContact O-N 3.49Å; P119-K122 WeakPolarHBondContact O-CA 3.49Å; P119-K122 WeakPolarHBondContact O-CB 2.95Å; P119-K122 PolarHBondContact O-N 2.96Å; P119-E123 PolarHBondContact O-N 3.12Å |
| 120 | E | 74.3 | Confident | 67.5 | Low | 60 Ų | 60 | 87.8 Ų | 87.8 | 28% | 0.28 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -59.8 | -29 | 179.3 | -63.5 | 88 | 132 | 0 | 0 | 112.3 | Y50 F52 V118 E123 T124 | Y50-E120 VanDerWaalsContact CE2-OE1 3.32Å; Y50-E120 WeakPolarHBondContact CE2-OE1 3.24Å; Y50-E120 PolarHBondContact OH-OE1 2.91Å; Y50-E120 PolarHBondContact OH-OE2 3.08Å; F52-E120 HydrophobicContact CD1-CB 4.27Å; F52-E120 HydrophobicContact CE1-CB 4.35Å; F52-E120 HydrophobicContact CG-CB 4.46Å; V118-E120 HydrophobicContact CG1-CB 4.04Å; V118-E120 VanDerWaalsContact CG1-CD 3.42Å; V118-E120 HydrophobicContact CG1-CG 4.28Å; V118-E120 WeakPolarHBondContact CG1-OE2 3.47Å; V118-E120 PolarHBondContact O-N 3.17Å; V118-E120 VanDerWaalsContact O-N 3.12Å; E120-E123 PolarHBondContact O-N 3.08Å; E120-T124 PolarHBondContact O-N 3.41Å; E120-T124 VanDerWaalsContact O-N 3.08Å; E120-T124 PolarHBondContact O-OG1 2.8Å |
| 121 | M | 65.8 | Low | 66.8 | Low | 19 Ų | 19 | 84.4 Ų | 84.4 | 9% | 0.094 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -72.8 | -44.5 | 172.9 | -175.8 | 175 | 179.8 | 0 | 0 | 111.4 | Y81 Y117 V118 P119 E123 T124 E125 | Y81-M121 HydrophobicContact CD1-SD 3.82Å; Y81-M121 HydrophobicContact CD2-SD 4.2Å; Y81-M121 HydrophobicContact CE1-SD 4.26Å; Y81-M121 HydrophobicContact CG-CE 4.43Å; Y81-M121 HydrophobicContact CG-SD 3.78Å; Y117-M121 HydrophobicContact CD1-CE 4.13Å; Y117-M121 HydrophobicContact CD1-CG 4.25Å; Y117-M121 HydrophobicContact CD1-SD 3.32Å; Y117-M121 WeakPolarHBondContact CD1-SD 2.74Å; Y117-M121 HydrophobicContact CE1-CE 3.65Å; Y117-M121 HydrophobicContact CE1-SD 3.44Å; Y117-M121 WeakPolarHBondContact CE1-SD 3.44Å; V118-M121 WeakPolarHBondContact O-CB 3.37Å; V118-M121 PolarHBondContact O-N 3.31Å; P119-M121 PolarHBondContact O-N 3.49Å; M121-E123 PolarHBondContact O-N 3.04Å; M121-T124 PolarHBondContact O-N 2.97Å; M121-E125 WeakPolarHBondContact O-CG 3.44Å; M121-E125 PolarHBondContact O-N 3.15Å |
| 122 | K | 62.1 | Low | 66.3 | Low | 121 Ų | 121 | 84.6 Ų | 84.6 | 53% | 0.526 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -58.2 | -35.4 | 173.1 | -63.2 | -179.9 | -178.8 | 171.9 | 0 | 109.5 | P119 E125 W126 | P119-K122 WeakPolarHBondContact O-CA 3.49Å; P119-K122 WeakPolarHBondContact O-CB 2.95Å; P119-K122 PolarHBondContact O-N 2.96Å; K122-E125 PolarHBondContact O-N 3.01Å; K122-W126 PolarHBondContact O-N 3.21Å |
| 123 | E | 63.7 | Low | 65.8 | Low | 114 Ų | 114 | 81.6 Ų | 81.6 | 53% | 0.533 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -66.1 | -45.8 | -179 | -75.2 | -172.5 | -175.4 | 0 | 0 | 113.6 | P119 E120 M121 E125 W126 K127 | P119-E123 PolarHBondContact O-N 3.12Å; E120-E123 PolarHBondContact O-N 3.08Å; M121-E123 PolarHBondContact O-N 3.04Å; E123-E125 VanDerWaalsContact C-N 3.32Å; E123-E125 PolarHBondContact O-N 2.69Å; E123-W126 PolarHBondContact O-N 3.35Å; E123-W126 PolarHBondContact O-NE1 3.37Å; E123-K127 WeakPolarHBondContact O-CB 2.73Å; E123-K127 PolarHBondContact O-N 2.82Å; E123-K127 VanDerWaalsContact O-N 3.15Å |
| 124 | T | 60.4 | Low | 65.2 | Low | 38 Ų | 38 | 82.2 Ų | 82.2 | 23% | 0.233 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -61 | -44.7 | 176.8 | -57.4 | 0 | 0 | 0 | 0 | 109.9 | M54 E120 M121 W126 K127 W128 | M54-T124 HydrophobicContact CE-CG2 4.48Å; M54-T124 HydrophobicContact SD-CG2 4.18Å; E120-T124 PolarHBondContact O-N 3.41Å; E120-T124 VanDerWaalsContact O-N 3.08Å; E120-T124 PolarHBondContact O-OG1 2.8Å; M121-T124 PolarHBondContact O-N 2.97Å; T124-W126 PolarHBondContact O-N 3.19Å; T124-K127 PolarHBondContact O-N 2.82Å; T124-W128 VanDerWaalsContact CG2-CD1 3.4Å; T124-W128 PolarHBondContact O-N 3.26Å |
| 125 | E | 61.3 | Low | 64.7 | Low | 45 Ų | 45 | 85 Ų | 85 | 21% | 0.21 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -62.2 | -42.5 | 178.5 | -69.7 | -166 | 168.7 | 0 | 0 | 114.8 | H85 M121 K122 E123 K127 W128 R129 | H85-E125 IonicContact CD2-OE1 3.32Å; H85-E125 IonicContact CE1-OE1 2.82Å; H85-E125 VanDerWaalsContact NE2-CD 3.3Å; H85-E125 IonicContact NE2-OE1 3.51Å; H85-E125 PolarHBondContact NE2-OE1 3.24Å; H85-E125 IonicContact NE2-OE2 3.89Å; M121-E125 WeakPolarHBondContact O-CG 3.44Å; M121-E125 PolarHBondContact O-N 3.15Å; K122-E125 PolarHBondContact O-N 3.01Å; E123-E125 VanDerWaalsContact C-N 3.32Å; E123-E125 PolarHBondContact O-N 2.69Å; E125-K127 VanDerWaalsContact C-N 3.33Å; E125-W128 PolarHBondContact O-N 3.45Å; E125-R129 WeakPolarHBondContact O-CB 3.37Å; E125-R129 PolarHBondContact O-N 3.46Å; E125-R129 IonicContact OE2-CZ 3.65Å; E125-R129 IonicContact OE2-NH1 2.95Å; E125-R129 IonicContact OE2-NH2 3.46Å; E125-R129 PolarHBondContact OE2-NH2 3.3Å |
| 126 | W | 56.7 | Low | 63.8 | Low | 167 Ų | 167 | 85.3 Ų | 85.3 | 63% | 0.633 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -68.5 | -35.8 | 177.2 | 69.9 | -96.8 | 0 | 0 | 0 | 111.6 | K122 E123 T124 R129 G130 | K122-W126 PolarHBondContact O-N 3.21Å; E123-W126 PolarHBondContact O-N 3.35Å; E123-W126 PolarHBondContact O-NE1 3.37Å; T124-W126 PolarHBondContact O-N 3.19Å; W126-R129 PolarHBondContact O-N 3.42Å; W126-G130 PolarHBondContact O-N 3.03Å |
| 127 | K | 59.8 | Low | 63 | Low | 149 Ų | 149 | 87 Ų | 87 | 65% | 0.648 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -62.6 | -43.4 | 174.9 | -175.3 | 178.5 | 176.5 | -177.8 | 0 | 111.4 | E123 T124 E125 L131 | E123-K127 WeakPolarHBondContact O-CB 2.73Å; E123-K127 PolarHBondContact O-N 2.82Å; E123-K127 VanDerWaalsContact O-N 3.15Å; T124-K127 PolarHBondContact O-N 2.82Å; E125-K127 VanDerWaalsContact C-N 3.33Å; K127-L131 WeakPolarHBondContact O-CB 3.49Å; K127-L131 PolarHBondContact O-N 3.32Å; K127-L131 VanDerWaalsContact O-N 3.09Å |
| 128 | W | 57 | Low | 62 | Low | 142 Ų | 142 | 92.4 Ų | 92.4 | 54% | 0.538 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -69.3 | -39.6 | 175.4 | -68.4 | 116.8 | 0 | 0 | 0 | 112.5 | T124 E125 L131 V132 | T124-W128 VanDerWaalsContact CG2-CD1 3.4Å; T124-W128 PolarHBondContact O-N 3.26Å; E125-W128 PolarHBondContact O-N 3.45Å; W128-L131 HydrophobicContact CE3-CD2 3.91Å; W128-L131 HydrophobicContact CZ3-CD2 3.91Å; W128-L131 PolarHBondContact O-N 2.88Å; W128-V132 WeakPolarHBondContact O-CG2 3.34Å; W128-V132 PolarHBondContact O-N 3.38Å |
| 129 | R | 61.2 | Low | 61 | Low | 117 Ų | 117 | 97.2 Ų | 97.2 | 44% | 0.442 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -60.1 | -46.5 | 173.6 | -96.6 | -173.8 | -81.1 | -81.5 | 3.4 | 112 | E125 W126 L131 V132 E133 | E125-R129 WeakPolarHBondContact O-CB 3.37Å; E125-R129 PolarHBondContact O-N 3.46Å; E125-R129 IonicContact OE2-CZ 3.65Å; E125-R129 IonicContact OE2-NH1 2.95Å; E125-R129 IonicContact OE2-NH2 3.46Å; E125-R129 PolarHBondContact OE2-NH2 3.3Å; W126-R129 PolarHBondContact O-N 3.42Å; R129-L131 VanDerWaalsContact C-N 3.27Å; R129-L131 PolarHBondContact O-N 2.79Å; R129-V132 PolarHBondContact O-N 2.6Å; R129-E133 WeakPolarHBondContact O-CB 3.43Å; R129-E133 WeakPolarHBondContact O-CG 3.46Å; R129-E133 PolarHBondContact O-N 3.28Å |
| 130 | G | 62.1 | Low | 60.1 | Low | 37 Ų | 37 | 101.1 Ų | 101.1 | 38% | 0.381 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.2 | -32.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | W126 A134 | W126-G130 PolarHBondContact O-N 3.03Å; G130-A134 VanDerWaalsContact O-CB 3.24Å; G130-A134 WeakPolarHBondContact O-CB 3.24Å; G130-A134 PolarHBondContact O-N 3.3Å |
| 131 | L | 61.3 | Low | 59.1 | Low | 89 Ų | 89 | 101 Ų | 101 | 47% | 0.466 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -70.9 | -42.6 | 174.6 | -172 | 69.5 | 0 | 0 | 0 | 112.1 | K127 W128 R129 A134 I135 | K127-L131 WeakPolarHBondContact O-CB 3.49Å; K127-L131 PolarHBondContact O-N 3.32Å; K127-L131 VanDerWaalsContact O-N 3.09Å; W128-L131 HydrophobicContact CE3-CD2 3.91Å; W128-L131 HydrophobicContact CZ3-CD2 3.91Å; W128-L131 PolarHBondContact O-N 2.88Å; R129-L131 VanDerWaalsContact C-N 3.27Å; R129-L131 PolarHBondContact O-N 2.79Å; L131-A134 PolarHBondContact O-N 2.94Å; L131-I135 HydrophobicContact CG-CD1 4.13Å; L131-I135 WeakPolarHBondContact O-CD1 3.49Å; L131-I135 WeakPolarHBondContact O-CG1 3.21Å; L131-I135 PolarHBondContact O-N 3.36Å |
| 132 | V | 59.9 | Low | 58.2 | Low | 76 Ų | 76 | 105.8 Ų | 105.8 | 46% | 0.461 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -66.5 | -43.3 | 177.1 | 171.8 | 0 | 0 | 0 | 0 | 111.1 | W128 R129 A134 I135 D136 | W128-V132 WeakPolarHBondContact O-CG2 3.34Å; W128-V132 PolarHBondContact O-N 3.38Å; R129-V132 PolarHBondContact O-N 2.6Å; V132-A134 VanDerWaalsContact C-N 3.31Å; V132-A134 PolarHBondContact O-N 3.09Å; V132-I135 PolarHBondContact O-N 2.88Å; V132-D136 PolarHBondContact O-N 3.49Å |
| 133 | E | 60.8 | Low | 57.9 | Low | 126 Ų | 126 | 104.2 Ų | 104.2 | 59% | 0.589 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -64.3 | -35.3 | 175.1 | -74 | 178.7 | 169.3 | 0 | 0 | 112.2 | R129 D136 T137 | R129-E133 WeakPolarHBondContact O-CB 3.43Å; R129-E133 WeakPolarHBondContact O-CG 3.46Å; R129-E133 PolarHBondContact O-N 3.28Å; E133-D136 PolarHBondContact O-N 2.87Å; E133-T137 WeakPolarHBondContact O-CB 3.35Å; E133-T137 PolarHBondContact O-N 3.43Å; E133-T137 PolarHBondContact O-OG1 3.26Å |
| 134 | A | 60.5 | Low | 57.4 | Low | 58 Ų | 58 | 101.5 Ų | 101.5 | 48% | 0.479 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -67.9 | -34.7 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | G130 L131 V132 Q138 | G130-A134 VanDerWaalsContact O-CB 3.24Å; G130-A134 WeakPolarHBondContact O-CB 3.24Å; G130-A134 PolarHBondContact O-N 3.3Å; L131-A134 PolarHBondContact O-N 2.94Å; V132-A134 VanDerWaalsContact C-N 3.31Å; V132-A134 PolarHBondContact O-N 3.09Å; A134-Q138 PolarHBondContact O-N 3.46Å |
| 135 | I | 59.6 | Low | 57.3 | Low | 98 Ų | 98 | 107 Ų | 107 | 50% | 0.503 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -70.2 | -43.4 | 175 | -68.7 | 161.2 | 0 | 0 | 0 | 110.6 | L131 V132 Q138 | L131-I135 HydrophobicContact CG-CD1 4.13Å; L131-I135 WeakPolarHBondContact O-CD1 3.49Å; L131-I135 WeakPolarHBondContact O-CG1 3.21Å; L131-I135 PolarHBondContact O-N 3.36Å; V132-I135 PolarHBondContact O-N 2.88Å; I135-Q138 WeakPolarHBondContact O-CB 3.38Å; I135-Q138 PolarHBondContact O-N 3.25Å |
| 136 | D | 58.6 | Low | 56.9 | Low | 109 Ų | 109 | 110.9 Ų | 110.9 | 58% | 0.583 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -68.4 | -36.2 | 179.5 | -75.9 | -17.7 | 0 | 0 | 0 | 112.2 | V132 E133 Q138 V139 | V132-D136 PolarHBondContact O-N 3.49Å; E133-D136 PolarHBondContact O-N 2.87Å; D136-Q138 PolarHBondContact O-N 3.04Å; D136-V139 PolarHBondContact O-N 2.93Å |
| 137 | T | 59.5 | Low | 56.8 | Low | 110 Ų | 110 | 112 Ų | 112 | 68% | 0.675 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -69.6 | -19.3 | 176.5 | -50.6 | 0 | 0 | 0 | 0 | 112.4 | E133 V139 | E133-T137 WeakPolarHBondContact O-CB 3.35Å; E133-T137 PolarHBondContact O-N 3.43Å; E133-T137 PolarHBondContact O-OG1 3.26Å; T137-V139 VanDerWaalsContact C-N 3.34Å |
| 138 | Q | 52.8 | Low | 56.1 | Low | 165 Ų | 165 | 110 Ų | 110 | 77% | 0.771 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.8 | -15.5 | 175 | -162.7 | 176.5 | -71.6 | 0 | 0 | 113 | A134 I135 D136 | A134-Q138 PolarHBondContact O-N 3.46Å; I135-Q138 WeakPolarHBondContact O-CB 3.38Å; I135-Q138 PolarHBondContact O-N 3.25Å; D136-Q138 PolarHBondContact O-N 3.04Å |
| 139 | V | 53.8 | Low | 55.7 | Low | 125 Ų | 125 | 110.3 Ų | 110.3 | 76% | 0.758 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.9 | -20.5 | -177.1 | 164.6 | 0 | 0 | 0 | 0 | 113.7 | D136 T137 | D136-V139 PolarHBondContact O-N 2.93Å; T137-V139 VanDerWaalsContact C-N 3.34Å |
| 140 | D | 50.3 | Low | 54.9 | Low | 158 Ų | 158 | 111.1 Ų | 111.1 | 85% | 0.845 | 67% | 0.672 | S | S | * | * | S | Bend | trans | -96.5 | 17.4 | -177.7 | -159.5 | 31.7 | 0 | 0 | 0 | 114.1 | ||
| 141 | G | 54 | Low | 53.8 | Low | 57 Ų | 57 | 114.6 Ų | 114.6 | 59% | 0.588 | 69% | 0.691 | S | S | * | * | S | Bend | trans | -124.5 | 18.2 | -164.1 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||
| 142 | T | 47.5 | Very low | 52.7 | Low | 121 Ų | 121 | 115.8 Ų | 115.8 | 74% | 0.742 | 71% | 0.706 | S | S | * | * | trans | -146.2 | 71.2 | 175.4 | -40.8 | 0 | 0 | 0 | 0 | 113.1 | A144 | T142-A144 VanDerWaalsContact C-N 3.33Å; T142-A144 PolarHBondContact O-N 3.35Å | ||
| 143 | G | 55.2 | Low | 51.4 | Low | 87 Ų | 87 | 118.5 Ų | 118.5 | 90% | 0.897 | 72% | 0.723 | S | S | * | * | trans | -83.2 | 79.8 | 149.4 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 144 | A | 53.8 | Low | 50.3 | Low | 57 Ų | 57 | 116.5 Ų | 116.5 | 47% | 0.471 | 72% | 0.723 | S | S | . | * | S | Bend | trans | 170.7 | 104.3 | 154.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | T142 | T142-A144 VanDerWaalsContact C-N 3.33Å; T142-A144 PolarHBondContact O-N 3.35Å |
| 145 | D | 57.2 | Low | 49.2 | Very low | 154 Ų | 154 | 121.3 Ų | 121.3 | 82% | 0.824 | 74% | 0.739 | S | S | * | * | trans | 15.4 | 107.9 | 142.2 | 7.1 | -57.2 | 0 | 0 | 0 | 117.3 | ||||
| 146 | T | 52.5 | Low | 47.9 | Very low | 127 Ų | 127 | 124.8 Ų | 124.8 | 78% | 0.779 | 75% | 0.753 | S | S | * | * | trans | -151.4 | 112.1 | 147.3 | -65.3 | 0 | 0 | 0 | 0 | 108.7 | S148 | T146-S148 PolarHBondContact O-N 3.12Š| ||
| 147 | M | 55.3 | Low | 46.9 | Very low | 189 Ų | 189 | 126 Ų | 126 | 93% | 0.931 | 77% | 0.765 | S | S | * | * | trans | -70.7 | 123.1 | 167.7 | -52.6 | -162.2 | -169.2 | 0 | 0 | 107.9 | ||||
| 148 | S | 45.7 | Very low | 45.7 | Very low | 108 Ų | 108 | 125.7 Ų | 125.7 | 76% | 0.755 | 77% | 0.767 | S | S | * | * | trans | -150.7 | 109.2 | 162.2 | -75.1 | 0 | 0 | 0 | 0 | 108.8 | T146 | T146-S148 PolarHBondContact O-N 3.12Š| ||
| 149 | D | 48.3 | Very low | 45.4 | Very low | 148 Ų | 148 | 123.9 Ų | 123.9 | 79% | 0.791 | 77% | 0.769 | S | S | * | * | trans | -57.7 | 158.4 | 164.6 | -62.9 | -59.8 | 0 | 0 | 0 | 110.8 | ||||
| 150 | T | 43.5 | Very low | 44.3 | Very low | 134 Ų | 134 | 121 Ų | 121 | 82% | 0.822 | 77% | 0.765 | S | S | * | * | trans | 110.8 | 119.9 | 153.3 | 80 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 151 | S | 39.8 | Very low | 43.6 | Very low | 111 Ų | 111 | 119.1 Ų | 119.1 | 78% | 0.776 | 76% | 0.764 | S | S | * | * | trans | 87.8 | 85.5 | 154.4 | 80.4 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 152 | S | 38.1 | Very low | 43.3 | Very low | 113 Ų | 113 | 126.3 Ų | 126.3 | 79% | 0.79 | 77% | 0.774 | S | S | * | * | trans | -83.9 | 110.1 | 148.8 | 53 | 0 | 0 | 0 | 0 | 109 | S154 | S152-S154 PolarHBondContact O-N 3.41Š| ||
| 153 | V | 32.8 | Very low | 42.5 | Very low | 133 Ų | 133 | 126.8 Ų | 126.8 | 81% | 0.806 | 77% | 0.767 | S | S | * | * | trans | -87.8 | 97.9 | 162.9 | 171.8 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 154 | S | 38.1 | Very low | 41.3 | Very low | 84 Ų | 84 | 128.4 Ų | 128.4 | 59% | 0.587 | 76% | 0.76 | S | S | * | * | trans | -80.1 | 120.9 | 161.6 | -61.2 | 0 | 0 | 0 | 0 | 107.9 | S152 E156 | S152-S154 PolarHBondContact O-N 3.41Å; S154-E156 VanDerWaalsContact C-N 3.32Å; S154-E156 PolarHBondContact O-N 3.43Å; S154-E156 VanDerWaalsContact O-N 3.12Å | ||
| 155 | L | 35.8 | Very low | 40.3 | Very low | 159 Ų | 159 | 131 Ų | 131 | 83% | 0.832 | 78% | 0.775 | S | S | * | * | trans | -83.9 | 83.4 | 173.7 | -151.4 | 162.4 | 0 | 0 | 0 | 108 | ||||
| 156 | E | 34.3 | Very low | 39 | Very low | 171 Ų | 171 | 128.6 Ų | 128.6 | 80% | 0.799 | 78% | 0.776 | S | S | * | * | trans | -81.1 | 115.2 | 170 | -60.6 | -89.1 | 126.9 | 0 | 0 | 108.2 | S154 | S154-E156 VanDerWaalsContact C-N 3.32Å; S154-E156 PolarHBondContact O-N 3.43Å; S154-E156 VanDerWaalsContact O-N 3.12Å | ||
| 157 | V | 35.8 | Very low | 37.8 | Very low | 135 Ų | 135 | 127.4 Ų | 127.4 | 82% | 0.818 | 78% | 0.779 | S | S | * | * | trans | -95 | 112.9 | 164.2 | 90 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 158 | S | 35.8 | Very low | 36.7 | Very low | 103 Ų | 103 | 125 Ų | 125 | 72% | 0.72 | 78% | 0.775 | S | S | * | * | trans | -113.2 | 139 | 169.4 | -169.1 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 159 | P | 45.3 | Very low | 36 | Very low | 127 Ų | 127 | 127.7 Ų | 127.7 | 83% | 0.825 | 78% | 0.781 | S | S | * | * | -138.8 | 149.5 | 116.8 | 36.7 | -24 | 0 | 0 | 0 | 109.9 | |||||
| 160 | G | 30.4 | Very low | 35.1 | Very low | 65 Ų | 65 | 126 Ų | 126 | 67% | 0.67 | 78% | 0.781 | S | S | * | * | cis | 145 | 111.3 | 11.7 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 161 | S | 35.7 | Very low | 35.3 | Very low | 118 Ų | 118 | 125.9 Ų | 125.9 | 83% | 0.825 | 78% | 0.782 | S | S | * | * | trans | -177.9 | 99.5 | 160 | 54.1 | 0 | 0 | 0 | 0 | 108 | ||||
| 162 | R | 48.7 | Very low | 34.7 | Very low | 208 Ų | 208 | 124.4 Ų | 124.4 | 79% | 0.785 | 78% | 0.784 | S | S | * | * | 77.3 | 103 | 92 | -161.6 | 172.5 | 179.3 | -135.7 | -19.3 | 113.2 | |||||
| 163 | E | 31.5 | Very low | 34.4 | Very low | 131 Ų | 131 | 123.8 Ų | 123.8 | 61% | 0.612 | 79% | 0.786 | S | S | * | * | trans | 87.4 | 105 | 134.6 | -73.7 | 170.2 | -160.5 | 0 | 0 | 122.3 | ||||
| 164 | T | 29 | Very low | 34.3 | Very low | 121 Ų | 121 | 122.5 Ų | 122.5 | 74% | 0.742 | 78% | 0.783 | S | S | * | * | 62.1 | 105.4 | 125 | 41.5 | 0 | 0 | 0 | 0 | 121.1 | |||||
| 165 | S | 32.5 | Very low | 34 | Very low | 112 Ų | 112 | 122.9 Ų | 122.9 | 78% | 0.783 | 79% | 0.786 | S | S | * | * | 136.4 | 142 | 94.6 | -83.6 | 0 | 0 | 0 | 0 | 115.8 | |||||
| 166 | A | 29.6 | Very low | 34.2 | Very low | 103 Ų | 103 | 127.2 Ų | 127.2 | 85% | 0.851 | 79% | 0.791 | S | S | * | * | trans | 75.4 | 105.3 | 154.7 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 167 | A | 27.9 | Very low | 33.9 | Very low | 102 Ų | 102 | 122.4 Ų | 122.4 | 84% | 0.843 | 79% | 0.787 | S | S | * | * | trans | -149.8 | 110.2 | 138.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 168 | T | 32.6 | Very low | 34.4 | Very low | 138 Ų | 138 | 128.3 Ų | 128.3 | 85% | 0.847 | 80% | 0.795 | S | S | * | * | trans | -74.8 | 119.4 | 163.8 | -60.4 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 169 | L | 30.3 | Very low | 34.5 | Very low | 166 Ų | 166 | 131.2 Ų | 131.2 | 87% | 0.869 | 80% | 0.803 | S | S | * | * | trans | -152.2 | 135.8 | 157.6 | -75.6 | -176.3 | 0 | 0 | 0 | 113.1 | ||||
| 170 | S | 29.2 | Very low | 34.5 | Very low | 113 Ų | 113 | 132.4 Ų | 132.4 | 79% | 0.79 | 80% | 0.802 | S | S | * | * | trans | -159.6 | 164.3 | 153.3 | -79.8 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 171 | P | 47.4 | Very low | 34.9 | Very low | 131 Ų | 131 | 132.3 Ų | 132.3 | 85% | 0.851 | 80% | 0.801 | S | S | * | * | cis | -132.2 | 170.9 | -37.1 | 34.5 | -17.9 | 0 | 0 | 0 | 110.8 | ||||
| 172 | G | 28.5 | Very low | 35.5 | Very low | 79 Ų | 79 | 134.8 Ų | 134.8 | 81% | 0.814 | 81% | 0.805 | S | S | * | * | trans | -176.8 | 110.7 | 172.1 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 173 | A | 31.1 | Very low | 35 | Very low | 101 Ų | 101 | 131 Ų | 131 | 84% | 0.835 | 81% | 0.805 | S | S | * | * | trans | -55.9 | 153.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 174 | S | 30 | Very low | 35.7 | Very low | 105 Ų | 105 | 134.9 Ų | 134.9 | 73% | 0.734 | 81% | 0.814 | S | S | * | * | 146.9 | 114.7 | 110 | -172.6 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 175 | S | 33.6 | Very low | 36.4 | Very low | 93 Ų | 93 | 134.7 Ų | 134.7 | 65% | 0.65 | 82% | 0.818 | S | S | * | * | trans | 38.9 | 131.5 | 138.4 | 75 | 0 | 0 | 0 | 0 | 123.8 | ||||
| 176 | R | 38.3 | Very low | 36.8 | Very low | 249 Ų | 249 | 134.9 Ų | 134.9 | 94% | 0.94 | 81% | 0.806 | S | S | * | * | trans | 62.9 | 122.3 | 135.2 | -76.9 | 178.3 | 173.6 | 175.1 | -2.1 | 119.7 | ||||
| 177 | G | 28.4 | Very low | 37.1 | Very low | 71 Ų | 71 | 138.2 Ų | 138.2 | 73% | 0.732 | 80% | 0.804 | S | S | * | * | trans | 167.7 | 106.1 | 149.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 178 | W | 46 | Very low | 37.7 | Very low | 259 Ų | 259 | 137.8 Ų | 137.8 | 98% | 0.981 | 80% | 0.795 | S | S | * | * | trans | -77.2 | 125.3 | 160 | -69.1 | 59.7 | 0 | 0 | 0 | 106.2 | ||||
| 179 | D | 37.8 | Very low | 38.1 | Very low | 164 Ų | 164 | 141.8 Ų | 141.8 | 88% | 0.877 | 80% | 0.796 | S | S | * | * | trans | -155.3 | 145.9 | 152.8 | -153.1 | 16.8 | 0 | 0 | 0 | 112.2 | ||||
| 180 | D | 46.9 | Very low | 38.7 | Very low | 152 Ų | 152 | 139.3 Ų | 139.3 | 81% | 0.813 | 79% | 0.793 | S | S | * | * | trans | -74.4 | 154.4 | -176.6 | -158.8 | 4.4 | 0 | 0 | 0 | 111 | ||||
| 181 | G | 37.1 | Very low | 39.5 | Very low | 62 Ų | 62 | 142.5 Ų | 142.5 | 64% | 0.639 | 80% | 0.795 | S | S | * | * | trans | 172.3 | 86.1 | 179.1 | 0 | 0 | 0 | 0 | 0 | 115.8 | T183 | G181-T183 PolarHBondContact O-N 3.38Š| ||
| 182 | D | 48.5 | Very low | 39.1 | Very low | 170 Ų | 170 | 142.4 Ų | 142.4 | 91% | 0.909 | 80% | 0.797 | S | S | * | * | trans | -35.7 | 123.4 | 159.4 | -96.1 | -36.4 | 0 | 0 | 0 | 112.9 | ||||
| 183 | T | 39.3 | Very low | 39.6 | Very low | 130 Ų | 130 | 142.1 Ų | 142.1 | 80% | 0.798 | 80% | 0.795 | S | S | * | * | trans | -147.8 | 103 | 154.4 | 23.8 | 0 | 0 | 0 | 0 | 111.3 | G181 S185 | G181-T183 PolarHBondContact O-N 3.38Å; T183-S185 PolarHBondContact O-N 2.96Å | ||
| 184 | R | 46.2 | Very low | 40.2 | Very low | 211 Ų | 211 | 142.5 Ų | 142.5 | 80% | 0.796 | 80% | 0.797 | S | S | * | * | trans | -18.1 | 121.9 | 143.7 | 179.7 | -178.3 | -177.9 | 164.8 | 1.4 | 113.7 | E186 | R184-E186 IonicContact CZ-OE2 3.76Å; R184-E186 IonicContact NE-OE2 3.88Å; R184-E186 PolarHBondContact NE-OE2 3.5Å; R184-E186 IonicContact NH2-OE2 2.79Å; R184-E186 PolarHBondContact NH2-OE2 3.17Å | ||
| 185 | S | 43.4 | Very low | 40.6 | Very low | 118 Ų | 118 | 143.3 Ų | 143.3 | 83% | 0.825 | 80% | 0.803 | S | S | * | * | trans | -134.8 | 108.3 | 155.7 | 46.7 | 0 | 0 | 0 | 0 | 110.1 | T183 | T183-S185 PolarHBondContact O-N 2.96Š| ||
| 186 | E | 39.8 | Very low | 40.9 | Very low | 115 Ų | 115 | 142.9 Ų | 142.9 | 54% | 0.537 | 81% | 0.814 | S | S | . | * | trans | -73 | 166.4 | 160.5 | -59 | -172.2 | 87.7 | 0 | 0 | 109.3 | R184 | R184-E186 IonicContact CZ-OE2 3.76Å; R184-E186 IonicContact NE-OE2 3.88Å; R184-E186 PolarHBondContact NE-OE2 3.5Å; R184-E186 IonicContact NH2-OE2 2.79Å; R184-E186 PolarHBondContact NH2-OE2 3.17Å | ||
| 187 | H | 35.9 | Very low | 40.9 | Very low | 173 Ų | 173 | 136.6 Ų | 136.6 | 80% | 0.801 | 81% | 0.808 | S | S | * | * | trans | 87.8 | 131.8 | 168.1 | -50.6 | -69.6 | 0 | 0 | 0 | 114.9 | ||||
| 188 | S | 40.5 | Very low | 41.5 | Very low | 93 Ų | 93 | 138.4 Ų | 138.4 | 65% | 0.65 | 81% | 0.809 | S | S | * | * | cis | -158.7 | 142.1 | 16.3 | -75 | 0 | 0 | 0 | 0 | 109.8 | S190 | S188-S190 PolarHBondContact O-N 3.01Š| ||
| 189 | Y | 41.5 | Very low | 41.3 | Very low | 223 Ų | 223 | 133.6 Ų | 133.6 | 88% | 0.875 | 80% | 0.796 | S | S | * | * | trans | -71.8 | 107.3 | 156.2 | 35.3 | -86 | 0 | 0 | 0 | 107.8 | E191 | Y189-E191 PolarHBondContact O-N 2.91Š| ||
| 190 | S | 42.5 | Very low | 41.6 | Very low | 114 Ų | 114 | 134.4 Ų | 134.4 | 80% | 0.797 | 79% | 0.794 | S | S | * | * | trans | -86.7 | 104.5 | 168.6 | -62.3 | 0 | 0 | 0 | 0 | 108.7 | S188 | S188-S190 PolarHBondContact O-N 3.01Š| ||
| 191 | E | 46.5 | Very low | 41.2 | Very low | 180 Ų | 180 | 135 Ų | 135 | 84% | 0.841 | 79% | 0.792 | S | S | * | * | trans | -63.6 | 125.8 | 163.4 | -166.3 | -176.6 | 141.8 | 0 | 0 | 109.5 | Y189 | Y189-E191 PolarHBondContact O-N 2.91Š| ||
| 192 | S | 39.3 | Very low | 41.3 | Very low | 128 Ų | 128 | 140.1 Ų | 140.1 | 90% | 0.895 | 80% | 0.804 | S | S | * | * | trans | 172.1 | 133.6 | 146.5 | -81.6 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 193 | G | 38.4 | Very low | 40.8 | Very low | 74 Ų | 74 | 139.2 Ų | 139.2 | 76% | 0.763 | 80% | 0.799 | S | S | * | * | trans | 143.5 | 75.9 | 153 | 0 | 0 | 0 | 0 | 0 | 115 | S195 | G193-S195 PolarHBondContact O-N 3.48Š| ||
| 194 | A | 45.2 | Very low | 40.8 | Very low | 108 Ų | 108 | 141 Ų | 141 | 89% | 0.893 | 80% | 0.803 | S | S | * | * | trans | -51 | 127.7 | 164 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 195 | S | 37.9 | Very low | 40.4 | Very low | 122 Ų | 122 | 139.6 Ų | 139.6 | 85% | 0.853 | 81% | 0.805 | S | S | * | * | trans | -131.3 | 104.2 | 158.4 | -93.3 | 0 | 0 | 0 | 0 | 107.9 | G193 S197 | G193-S195 PolarHBondContact O-N 3.48Å; S195-S197 PolarHBondContact O-N 2.69Å | ||
| 196 | G | 40 | Very low | 40 | Very low | 85 Ų | 85 | 137.4 Ų | 137.4 | 88% | 0.876 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -66.7 | 124.5 | 171.2 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||
| 197 | S | 37.6 | Very low | 39.8 | Very low | 117 Ų | 117 | 141.6 Ų | 141.6 | 82% | 0.818 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -95.6 | 119 | 168.8 | -171.1 | 0 | 0 | 0 | 0 | 108.7 | S195 | S195-S197 PolarHBondContact O-N 2.69Š|
| 198 | S | 41.6 | Very low | 39.6 | Very low | 108 Ų | 108 | 136.9 Ų | 136.9 | 76% | 0.755 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 116.4 | 174 | 173.4 | 0 | 0 | 0 | 0 | 110 | ||
| 199 | F | 41.1 | Very low | 39.7 | Very low | 159 Ų | 159 | 138.2 Ų | 138.2 | 70% | 0.697 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -104 | 127.3 | 159.2 | 72.1 | -85.5 | 0 | 0 | 0 | 107.9 | E201 | F199-E201 HydrophobicContact CD2-CG 4.05Å; F199-E201 HydrophobicContact CE2-CG 3.49Å; F199-E201 VanDerWaalsContact CE2-CG 3.49Å; F199-E201 HydrophobicContact CZ-CG 4.35Å |
| 200 | E | 43.7 | Very low | 39.1 | Very low | 181 Ų | 181 | 136.7 Ų | 136.7 | 85% | 0.846 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -76.4 | 121.2 | 166.9 | -70.1 | 175.4 | 117 | 0 | 0 | 107.3 | L202 | E200-L202 PolarHBondContact O-N 3.31Š|
| 201 | E | 39.8 | Very low | 38.6 | Very low | 165 Ų | 165 | 134.8 Ų | 134.8 | 77% | 0.771 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 123.5 | 174.5 | -73.7 | -174.9 | 126.6 | 0 | 0 | 109.8 | F199 D203 | F199-E201 HydrophobicContact CD2-CG 4.05Å; F199-E201 HydrophobicContact CE2-CG 3.49Å; F199-E201 VanDerWaalsContact CE2-CG 3.49Å; F199-E201 HydrophobicContact CZ-CG 4.35Å; E201-D203 PolarHBondContact O-N 3.25Å |
| 202 | L | 38.5 | Very low | 37.8 | Very low | 169 Ų | 169 | 135 Ų | 135 | 89% | 0.885 | 83% | 0.831 | S | S | * | * | trans | -75.2 | 108.9 | 169.7 | -71.2 | 169.9 | 0 | 0 | 0 | 108.4 | E200 L204 | E200-L202 PolarHBondContact O-N 3.31Å; L202-L204 PolarHBondContact O-N 3.19Å | ||
| 203 | D | 37.3 | Very low | 37.3 | Very low | 151 Ų | 151 | 134.6 Ų | 134.6 | 81% | 0.807 | 83% | 0.828 | S | S | * | * | trans | -69.7 | 108.3 | 171.4 | -112.7 | -20.5 | 0 | 0 | 0 | 109.7 | E201 | E201-D203 PolarHBondContact O-N 3.25Š| ||
| 204 | L | 40.9 | Very low | 36.9 | Very low | 168 Ų | 168 | 141 Ų | 141 | 88% | 0.88 | 83% | 0.829 | S | S | * | * | trans | -101.7 | 87.9 | 168.8 | -85.2 | 167.2 | 0 | 0 | 0 | 108.4 | L202 | L202-L204 PolarHBondContact O-N 3.19Š| ||
| 205 | E | 36.8 | Very low | 36.1 | Very low | 180 Ų | 180 | 144.5 Ų | 144.5 | 84% | 0.841 | 83% | 0.832 | S | S | * | * | trans | -86.6 | 120.2 | 164.4 | -63.3 | -164.7 | 119.2 | 0 | 0 | 109.3 | ||||
| 206 | G | 35.8 | Very low | 35.7 | Very low | 73 Ų | 73 | 145.8 Ų | 145.8 | 75% | 0.753 | 83% | 0.829 | S | S | * | * | trans | -89 | 144.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 207 | E | 34.4 | Very low | 35.9 | Very low | 203 Ų | 203 | 147.4 Ų | 147.4 | 95% | 0.949 | 82% | 0.824 | S | S | * | * | trans | -143 | 125.7 | 156.2 | -110.4 | 164.5 | 70.4 | 0 | 0 | 108.3 | ||||
| 208 | G | 32.4 | Very low | 35.4 | Very low | 73 Ų | 73 | 145.1 Ų | 145.1 | 75% | 0.753 | 82% | 0.819 | S | S | * | * | trans | -83.9 | -148.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 209 | P | 41.9 | Very low | 34.8 | Very low | 122 Ų | 122 | 147 Ų | 147 | 79% | 0.792 | 83% | 0.826 | S | S | * | * | -121.6 | 145.2 | -69.1 | 35.5 | -25.4 | 0 | 0 | 0 | 110.7 | |||||
| 210 | L | 29.9 | Very low | 34.4 | Very low | 191 Ų | 191 | 147.8 Ų | 147.8 | 100% | 1 | 83% | 0.832 | S | S | * | * | trans | -167.8 | 134.9 | 158.1 | -136.8 | 92.7 | 0 | 0 | 0 | 110.6 | ||||
| 211 | G | 30.5 | Very low | 34.5 | Very low | 73 Ų | 73 | 144.5 Ų | 144.5 | 75% | 0.753 | 83% | 0.826 | S | S | * | * | trans | 138.6 | 61.8 | 160.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 212 | E | 30.4 | Very low | 33.9 | Very low | 186 Ų | 186 | 144.5 Ų | 144.5 | 87% | 0.869 | 83% | 0.831 | S | S | * | * | trans | -58.5 | 130.4 | 162.4 | -166.9 | 151.5 | 86.8 | 0 | 0 | 110.9 | ||||
| 213 | S | 29.7 | Very low | 33.5 | Very low | 119 Ų | 119 | 139.8 Ų | 139.8 | 83% | 0.832 | 82% | 0.823 | S | S | * | * | trans | -151.1 | 106.1 | 147 | 55.3 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 214 | R | 29 | Very low | 33.3 | Very low | 209 Ų | 209 | 138.5 Ų | 138.5 | 79% | 0.789 | 82% | 0.821 | S | S | * | * | trans | -76 | 134.1 | 162 | -59.4 | 168.6 | 84.6 | 163.7 | 6.2 | 107.5 | ||||
| 215 | L | 28.6 | Very low | 32.9 | Very low | 181 Ų | 181 | 136.2 Ų | 136.2 | 95% | 0.948 | 81% | 0.814 | S | S | * | * | trans | -150 | 136.2 | 140.4 | -79.4 | -173.2 | 0 | 0 | 0 | 110.1 | ||||
| 216 | D | 30.5 | Very low | 32.5 | Very low | 149 Ų | 149 | 136.7 Ų | 136.7 | 80% | 0.797 | 81% | 0.813 | S | S | * | * | trans | -72.6 | 174.3 | -166.2 | -102.8 | -71.7 | 0 | 0 | 0 | 116 | ||||
| 217 | P | 43.7 | Very low | 32.2 | Very low | 118 Ų | 118 | 144.6 Ų | 144.6 | 77% | 0.766 | 82% | 0.82 | S | S | * | * | trans | -93.2 | 163.4 | -164.9 | 38.7 | -36.6 | 0 | 0 | 0 | 113.9 | ||||
| 218 | G | 26.4 | Very low | 31.7 | Very low | 70 Ų | 70 | 141.5 Ų | 141.5 | 72% | 0.722 | 81% | 0.81 | S | S | * | * | trans | 145.7 | 114.1 | 158.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 219 | T | 29 | Very low | 31.6 | Very low | 146 Ų | 146 | 149 Ų | 149 | 90% | 0.896 | 82% | 0.816 | S | S | * | * | 147.2 | 105.5 | 128.1 | -67.4 | 0 | 0 | 0 | 0 | 111.5 | |||||
| 220 | E | 33.7 | Very low | 31.1 | Very low | 177 Ų | 177 | 150.9 Ų | 150.9 | 83% | 0.827 | 81% | 0.814 | S | S | * | * | trans | -110.8 | 171.4 | 148.2 | -80.4 | -139.1 | 130.6 | 0 | 0 | 107.6 | ||||
| 221 | P | 45.1 | Very low | 31.2 | Very low | 112 Ų | 112 | 147.1 Ų | 147.1 | 73% | 0.727 | 80% | 0.801 | S | S | * | * | cis | -130.8 | 177.6 | -19.4 | 23.3 | -0.4 | 0 | 0 | 0 | 111.5 | ||||
| 222 | L | 28.3 | Very low | 31.2 | Very low | 164 Ų | 164 | 150.7 Ų | 150.7 | 86% | 0.859 | 81% | 0.808 | S | S | * | * | trans | 151.8 | 116.5 | 136.2 | -171.5 | 67 | 0 | 0 | 0 | 111.1 | ||||
| 223 | G | 28.3 | Very low | 31.4 | Very low | 70 Ų | 70 | 145.8 Ų | 145.8 | 72% | 0.722 | 80% | 0.799 | S | S | * | * | trans | -178.3 | 68 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | T225 | G223-T225 PolarHBondContact O-N 3.39Š| ||
| 224 | T | 34.9 | Very low | 31.9 | Very low | 124 Ų | 124 | 146.2 Ų | 146.2 | 76% | 0.761 | 80% | 0.799 | S | S | * | * | trans | -58.9 | 120.6 | 175.6 | 41 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 225 | T | 32.4 | Very low | 32.4 | Very low | 121 Ų | 121 | 145.8 Ų | 145.8 | 74% | 0.742 | 81% | 0.806 | S | S | * | * | trans | -127 | 97.1 | 151.3 | 46.9 | 0 | 0 | 0 | 0 | 109.6 | G223 | G223-T225 PolarHBondContact O-N 3.39Š| ||
| 226 | K | 27.7 | Very low | 32.8 | Very low | 190 Ų | 190 | 146.4 Ų | 146.4 | 83% | 0.826 | 80% | 0.801 | S | S | * | * | trans | -74.3 | 113.4 | 172.9 | -179.9 | -176.5 | -179.3 | -176.9 | 0 | 108.2 | ||||
| 227 | W | 29.4 | Very low | 33.1 | Very low | 238 Ų | 238 | 142.5 Ų | 142.5 | 90% | 0.902 | 80% | 0.796 | S | S | * | * | trans | -95.7 | 115.3 | 165.9 | -72.5 | 105.4 | 0 | 0 | 0 | 109.5 | ||||
| 228 | L | 24.6 | Very low | 32.8 | Very low | 138 Ų | 138 | 146.6 Ų | 146.6 | 72% | 0.723 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -79.5 | 120.4 | 175.2 | -179.8 | 71.8 | 0 | 0 | 0 | 107.9 | ||
| 229 | W | 30.1 | Very low | 33.2 | Very low | 231 Ų | 231 | 155.9 Ų | 155.9 | 88% | 0.875 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -91.8 | 117 | 170.3 | -173.8 | -90.3 | 0 | 0 | 0 | 108.8 | ||
| 230 | E | 30 | Very low | 33.4 | Very low | 162 Ų | 162 | 156.4 Ų | 156.4 | 76% | 0.757 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -88 | 132.9 | 166.8 | -76.2 | -175 | 111.2 | 0 | 0 | 109.8 | ||
| 231 | P | 33.3 | Very low | 33.4 | Very low | 112 Ų | 112 | 155.3 Ų | 155.3 | 73% | 0.727 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -89.2 | 117.9 | 169.1 | 11.6 | 4.5 | 0 | 0 | 0 | 110.7 | A233 | P231-A233 PolarHBondContact O-N 3.46Š|
| 232 | T | 30.8 | Very low | 32.8 | Very low | 147 Ų | 147 | 157.7 Ų | 157.7 | 90% | 0.902 | 83% | 0.828 | S | S | * | * | trans | -74.6 | 112.5 | 167.8 | -18.5 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 233 | A | 34.4 | Very low | 33 | Very low | 83 Ų | 83 | 157.3 Ų | 157.3 | 69% | 0.686 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -84.3 | 154 | 168.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | P231 | P231-A233 PolarHBondContact O-N 3.46Š|
| 234 | P | 40.7 | Very low | 33.3 | Very low | 129 Ų | 129 | 162.8 Ų | 162.8 | 84% | 0.838 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -79.9 | 131.3 | -172.2 | 31.5 | -32.7 | 0 | 0 | 0 | 111.7 | ||
| 235 | E | 38.9 | Very low | 33.2 | Very low | 199 Ų | 199 | 165.3 Ų | 165.3 | 93% | 0.93 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 130.5 | 173.8 | -159.3 | -176 | 144.1 | 0 | 0 | 110.6 | ||
| 236 | K | 35.8 | Very low | 33.3 | Very low | 195 Ų | 195 | 168.5 Ų | 168.5 | 85% | 0.848 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -88.8 | 130.1 | -175.1 | -171.6 | -177.8 | -174.5 | 178.4 | 0 | 108.4 | ||
| 237 | G | 36.9 | Very low | 33.7 | Very low | 67 Ų | 67 | 166.8 Ų | 166.8 | 69% | 0.691 | 85% | 0.846 | S | S | * | * | P | Polyproline II helix | trans | -63.1 | 154.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||
| 238 | K | 37.7 | Very low | 34.1 | Very low | 203 Ų | 203 | 160.9 Ų | 160.9 | 88% | 0.883 | 84% | 0.841 | S | S | * | * | trans | 155.4 | 130.3 | 160.2 | -94.5 | 176.2 | -177.4 | -171.3 | 0 | 105.7 | ||||
| 239 | E | 35.8 | Very low | 34.9 | Very low | 265 Ų | 265 | 163 Ų | 163 | 100% | 1.238 | 85% | 0.852 | S | S | * | * | cis | -146.8 | 0 | 26.9 | -90.4 | 166.9 | 143.3 | 0 | 0 | 110.3 |
Retrieved 239 of 239 residues in 78.9 ms
(Link to these results)