| 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 | 62.8 | Low | 85 | Confident | 172 Ų | 172 | 117.1 Ų | 117.1 | 85% | 0.847 | 59% | 0.593 | S | S | * | * | 0 | 107.5 | 0 | -148.8 | -179.2 | -172.7 | 0 | 0 | 106.8 | M6 L9 | M1-M6 HydrophobicContact CB-CE 4.09Å; M1-M6 HydrophobicContact CG-CE 4.27Å; M1-M6 HydrophobicContact SD-CE 3.76Å; M1-M6 HydrophobicContact SD-CG 4.39Å; M1-L9 HydrophobicContact CE-CD1 4.04Å | |||
| 2 | T | 81.2 | Confident | 85.4 | Confident | 83 Ų | 83 | 116.3 Ų | 116.3 | 51% | 0.509 | 59% | 0.59 | S | S | . | * | trans | -68.8 | 139.5 | -175.3 | 22.3 | 0 | 0 | 0 | 0 | 110.6 | Q4 K5 M6 | T2-Q4 PolarHBondContact O-N 3.48Å; T2-K5 WeakPolarHBondContact O-CB 3.07Å; T2-K5 PolarHBondContact O-N 3.26Å; T2-M6 PolarHBondContact O-N 3.05Å | ||
| 3 | L | 84.6 | Confident | 85.8 | Confident | 133 Ų | 133 | 117.3 Ų | 117.3 | 70% | 0.696 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -45.5 | -39.4 | 179.2 | -167.3 | 92 | 0 | 0 | 0 | 112.4 | K5 M6 I7 | L3-K5 VanDerWaalsContact C-N 3.34Å; L3-K5 PolarHBondContact O-N 3.33Å; L3-M6 PolarHBondContact O-N 3.29Å; L3-M6 VanDerWaalsContact O-N 3.16Å; L3-I7 HydrophobicContact CD2-CD1 4.04Å; L3-I7 HydrophobicContact CG-CD1 4.16Å; L3-I7 WeakPolarHBondContact O-CG1 3.45Å; L3-I7 PolarHBondContact O-N 3.25Å |
| 4 | Q | 86.1 | Confident | 86.3 | Confident | 154 Ų | 154 | 114.7 Ų | 114.7 | 72% | 0.72 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -57.2 | -40.4 | 176 | -69.7 | 178.8 | -34 | 0 | 0 | 113.8 | T2 M6 I7 L8 | T2-Q4 PolarHBondContact O-N 3.48Å; Q4-M6 VanDerWaalsContact C-N 3.34Å; Q4-I7 PolarHBondContact O-N 3.42Å; Q4-L8 WeakPolarHBondContact O-CB 3.5Å; Q4-L8 PolarHBondContact O-N 3.36Å |
| 5 | K | 83.7 | Confident | 86.4 | Confident | 136 Ų | 136 | 113.7 Ų | 113.7 | 59% | 0.591 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -67.5 | -36.7 | 177.9 | -68.9 | -176.2 | 175.3 | -176.4 | 0 | 111.4 | T2 L3 L8 L9 | T2-K5 WeakPolarHBondContact O-CB 3.07Å; T2-K5 PolarHBondContact O-N 3.26Å; L3-K5 VanDerWaalsContact C-N 3.34Å; L3-K5 PolarHBondContact O-N 3.33Å; K5-L8 PolarHBondContact O-N 3.01Å; K5-L9 WeakPolarHBondContact O-CG 3.47Å; K5-L9 PolarHBondContact O-N 3.07Å |
| 6 | M | 86.5 | Confident | 86.7 | Confident | 92 Ų | 92 | 112.9 Ų | 112.9 | 45% | 0.453 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -66.4 | -44.7 | 175.2 | -66.6 | -177.5 | 178.8 | 0 | 0 | 111.2 | M1 T2 L3 Q4 L8 L9 V10 | M1-M6 HydrophobicContact CB-CE 4.09Å; M1-M6 HydrophobicContact CG-CE 4.27Å; M1-M6 HydrophobicContact SD-CE 3.76Å; M1-M6 HydrophobicContact SD-CG 4.39Å; T2-M6 PolarHBondContact O-N 3.05Å; L3-M6 PolarHBondContact O-N 3.29Å; L3-M6 VanDerWaalsContact O-N 3.16Å; Q4-M6 VanDerWaalsContact C-N 3.34Å; M6-L8 VanDerWaalsContact C-N 3.32Å; M6-L8 PolarHBondContact O-N 3.4Å; M6-L9 PolarHBondContact O-N 2.84Å; M6-V10 WeakPolarHBondContact O-CG2 3.39Å; M6-V10 PolarHBondContact O-N 3.21Å |
| 7 | I | 90.4 | Very high | 86.8 | Confident | 97 Ų | 97 | 111.4 Ų | 111.4 | 50% | 0.497 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -59.9 | -44.2 | 176.7 | -66 | 166.6 | 0 | 0 | 0 | 110.6 | L3 Q4 L9 V10 Q11 | L3-I7 HydrophobicContact CD2-CD1 4.04Å; L3-I7 HydrophobicContact CG-CD1 4.16Å; L3-I7 WeakPolarHBondContact O-CG1 3.45Å; L3-I7 PolarHBondContact O-N 3.25Å; Q4-I7 PolarHBondContact O-N 3.42Å; I7-L9 PolarHBondContact O-N 3.46Å; I7-V10 PolarHBondContact O-N 2.93Å; I7-Q11 WeakPolarHBondContact O-CB 3.25Å; I7-Q11 PolarHBondContact O-N 3.48Å |
| 8 | L | 89.5 | Confident | 86.9 | Confident | 106 Ų | 106 | 110.3 Ų | 110.3 | 56% | 0.555 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -64.9 | -39.3 | 179.7 | -167.5 | 145.9 | 0 | 0 | 0 | 112.1 | Q4 K5 M6 Q11 L12 | Q4-L8 WeakPolarHBondContact O-CB 3.5Å; Q4-L8 PolarHBondContact O-N 3.36Å; K5-L8 PolarHBondContact O-N 3.01Å; M6-L8 VanDerWaalsContact C-N 3.32Å; M6-L8 PolarHBondContact O-N 3.4Å; L8-Q11 PolarHBondContact O-N 3.21Å; L8-L12 HydrophobicContact CD2-CD1 3.87Å; L8-L12 WeakPolarHBondContact O-CB 3.38Å; L8-L12 PolarHBondContact O-N 3.1Å |
| 9 | L | 89.6 | Confident | 86.8 | Confident | 98 Ų | 98 | 109.7 Ų | 109.7 | 51% | 0.513 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -63.9 | -43.6 | 173.9 | -75.8 | 169.7 | 0 | 0 | 0 | 112.1 | M1 K5 M6 I7 Q11 L12 F13 | M1-L9 HydrophobicContact CE-CD1 4.04Å; K5-L9 WeakPolarHBondContact O-CG 3.47Å; K5-L9 PolarHBondContact O-N 3.07Å; M6-L9 PolarHBondContact O-N 2.84Å; I7-L9 PolarHBondContact O-N 3.46Å; L9-Q11 VanDerWaalsContact C-N 3.34Å; L9-L12 PolarHBondContact O-N 3.06Å; L9-F13 WeakPolarHBondContact O-CB 3.3Å; L9-F13 PolarHBondContact O-N 2.79Å |
| 10 | V | 90.8 | Very high | 86.8 | Confident | 92 Ų | 92 | 109.1 Ų | 109.1 | 56% | 0.558 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -63.6 | -42.2 | 175.9 | 173 | 0 | 0 | 0 | 0 | 110.6 | M6 I7 F13 V14 | M6-V10 WeakPolarHBondContact O-CG2 3.39Å; M6-V10 PolarHBondContact O-N 3.21Å; I7-V10 PolarHBondContact O-N 2.93Å; V10-F13 WeakPolarHBondContact O-CB 3.43Å; V10-F13 PolarHBondContact O-N 2.72Å; V10-V14 HydrophobicContact CG1-CG2 4.38Å; V10-V14 VanDerWaalsContact O-CG2 3.3Å; V10-V14 WeakPolarHBondContact O-CG2 3.32Å; V10-V14 PolarHBondContact O-N 2.84Å |
| 11 | Q | 89.6 | Confident | 86.6 | Confident | 125 Ų | 125 | 109.7 Ų | 109.7 | 58% | 0.584 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -64 | -43 | 178 | -172.3 | 172.4 | -11.8 | 0 | 0 | 111.8 | I7 L8 L9 F13 V14 M15 | I7-Q11 WeakPolarHBondContact O-CB 3.25Å; I7-Q11 PolarHBondContact O-N 3.48Å; L8-Q11 PolarHBondContact O-N 3.21Å; L9-Q11 VanDerWaalsContact C-N 3.34Å; Q11-F13 VanDerWaalsContact C-N 3.34Å; Q11-F13 PolarHBondContact O-N 2.85Å; Q11-V14 PolarHBondContact O-N 3.34Å; Q11-M15 WeakPolarHBondContact O-CB 3.45Å; Q11-M15 VanDerWaalsContact O-CG 3.28Å; Q11-M15 WeakPolarHBondContact O-CG 3.2Å; Q11-M15 PolarHBondContact O-N 3.42Å |
| 12 | L | 89.8 | Confident | 87.6 | Confident | 107 Ų | 107 | 106.1 Ų | 106.1 | 56% | 0.56 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -60 | -44 | 173.3 | -108.8 | 158.2 | 0 | 0 | 0 | 111.8 | L8 L9 M15 L16 | L8-L12 HydrophobicContact CD2-CD1 3.87Å; L8-L12 WeakPolarHBondContact O-CB 3.38Å; L8-L12 PolarHBondContact O-N 3.1Å; L9-L12 PolarHBondContact O-N 3.06Å; L12-M15 PolarHBondContact O-N 3.35Å; L12-L16 WeakPolarHBondContact O-CB 3.26Å; L12-L16 PolarHBondContact O-N 3.28Å |
| 13 | F | 91.3 | Very high | 87.7 | Confident | 130 Ų | 130 | 105.3 Ų | 105.3 | 57% | 0.57 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -60.7 | -47.8 | 176.7 | -176.4 | -93.4 | 0 | 0 | 0 | 111.4 | L9 V10 Q11 M15 L16 H17 | L9-F13 WeakPolarHBondContact O-CB 3.3Å; L9-F13 PolarHBondContact O-N 2.79Å; V10-F13 WeakPolarHBondContact O-CB 3.43Å; V10-F13 PolarHBondContact O-N 2.72Å; Q11-F13 VanDerWaalsContact C-N 3.34Å; Q11-F13 PolarHBondContact O-N 2.85Å; F13-M15 PolarHBondContact O-N 2.9Å; F13-L16 PolarHBondContact O-N 3.49Å; F13-H17 AromaticContact CD1-CE1 3.82Å; F13-H17 AromaticContact CD1-ND1 3.74Å; F13-H17 AromaticContact CD2-CE1 3.59Å; F13-H17 AromaticContact CE1-CE1 3.39Å; F13-H17 WeakPolarHBondContact CE1-CE1 3.4Å; F13-H17 AromaticContact CE1-ND1 3.66Å; F13-H17 AromaticContact CE1-NE2 3.82Å; F13-H17 AromaticContact CE2-CE1 3.16Å; F13-H17 WeakPolarHBondContact CE2-CE1 3.21Å; F13-H17 AromaticContact CE2-ND1 3.99Å; F13-H17 AromaticContact CE2-NE2 3.89Å; F13-H17 AromaticContact CG-CE1 3.91Å; F13-H17 AromaticContact CG-ND1 3.93Å; F13-H17 AromaticContact CZ-CE1 3.04Å; F13-H17 WeakPolarHBondContact CZ-CE1 3.34Å; F13-H17 AromaticContact CZ-ND1 3.8Å; F13-H17 AromaticContact CZ-NE2 3.41Å; F13-H17 WeakPolarHBondContact CZ-NE2 3.33Å; F13-H17 PolarHBondContact O-N 2.81Å; F13-H17 PolarHBondContact O-ND1 3.44Å |
| 14 | V | 91.8 | Very high | 87.5 | Confident | 81 Ų | 81 | 102.8 Ų | 102.8 | 49% | 0.491 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -61.3 | -44.3 | 177.7 | 172.3 | 0 | 0 | 0 | 0 | 111.4 | V10 Q11 L16 H17 L18 | V10-V14 HydrophobicContact CG1-CG2 4.38Å; V10-V14 VanDerWaalsContact O-CG2 3.3Å; V10-V14 WeakPolarHBondContact O-CG2 3.32Å; V10-V14 PolarHBondContact O-N 2.84Å; Q11-V14 PolarHBondContact O-N 3.34Å; V14-L16 PolarHBondContact O-N 3.26Å; V14-H17 PolarHBondContact O-N 3.33Å; V14-L18 WeakPolarHBondContact O-CB 3.49Å; V14-L18 PolarHBondContact O-N 2.85Å |
| 15 | M | 88.5 | Confident | 86.9 | Confident | 100 Ų | 100 | 99.4 Ų | 99.4 | 49% | 0.493 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.2 | -41.2 | 178 | -71.4 | -64.4 | -68.7 | 0 | 0 | 112.3 | Q11 L12 F13 H17 L18 I19 | Q11-M15 WeakPolarHBondContact O-CB 3.45Å; Q11-M15 VanDerWaalsContact O-CG 3.28Å; Q11-M15 WeakPolarHBondContact O-CG 3.2Å; Q11-M15 PolarHBondContact O-N 3.42Å; L12-M15 PolarHBondContact O-N 3.35Å; F13-M15 PolarHBondContact O-N 2.9Å; M15-H17 PolarHBondContact O-N 3.49Å; M15-L18 PolarHBondContact O-N 3.17Å; M15-I19 WeakPolarHBondContact O-CG1 3.19Å; M15-I19 PolarHBondContact O-N 3.36Å |
| 16 | L | 90.5 | Very high | 86.4 | Confident | 101 Ų | 101 | 95.1 Ų | 95.1 | 53% | 0.529 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.5 | -45.7 | 176 | -169.4 | 92.7 | 0 | 0 | 0 | 111.2 | L12 F13 V14 L18 I19 L20 | L12-L16 WeakPolarHBondContact O-CB 3.26Å; L12-L16 PolarHBondContact O-N 3.28Å; F13-L16 PolarHBondContact O-N 3.49Å; V14-L16 PolarHBondContact O-N 3.26Å; L16-L18 VanDerWaalsContact C-N 3.32Å; L16-L18 PolarHBondContact O-N 3.48Å; L16-I19 PolarHBondContact O-N 2.91Å; L16-L20 HydrophobicContact CD2-CD1 4.34Å; L16-L20 HydrophobicContact CG-CD1 4.37Å; L16-L20 WeakPolarHBondContact O-CG 3.46Å; L16-L20 PolarHBondContact O-N 3.38Å |
| 17 | H | 88.8 | Confident | 85.8 | Confident | 86 Ų | 86 | 96.8 Ų | 96.8 | 40% | 0.398 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -66.2 | -37.3 | 178.3 | -73.3 | 68 | 0 | 0 | 0 | 111.6 | F13 V14 M15 L20 L21 | F13-H17 AromaticContact CD1-CE1 3.82Å; F13-H17 AromaticContact CD1-ND1 3.74Å; F13-H17 AromaticContact CD2-CE1 3.59Å; F13-H17 AromaticContact CE1-CE1 3.39Å; F13-H17 WeakPolarHBondContact CE1-CE1 3.4Å; F13-H17 AromaticContact CE1-ND1 3.66Å; F13-H17 AromaticContact CE1-NE2 3.82Å; F13-H17 AromaticContact CE2-CE1 3.16Å; F13-H17 WeakPolarHBondContact CE2-CE1 3.21Å; F13-H17 AromaticContact CE2-ND1 3.99Å; F13-H17 AromaticContact CE2-NE2 3.89Å; F13-H17 AromaticContact CG-CE1 3.91Å; F13-H17 AromaticContact CG-ND1 3.93Å; F13-H17 AromaticContact CZ-CE1 3.04Å; F13-H17 WeakPolarHBondContact CZ-CE1 3.34Å; F13-H17 AromaticContact CZ-ND1 3.8Å; F13-H17 AromaticContact CZ-NE2 3.41Å; F13-H17 WeakPolarHBondContact CZ-NE2 3.33Å; F13-H17 PolarHBondContact O-N 2.81Å; F13-H17 PolarHBondContact O-ND1 3.44Å; V14-H17 PolarHBondContact O-N 3.33Å; M15-H17 PolarHBondContact O-N 3.49Å; H17-L20 PolarHBondContact O-N 3.44Å; H17-L21 WeakPolarHBondContact O-CB 3.31Å; H17-L21 PolarHBondContact O-N 3.44Å |
| 18 | L | 88.2 | Confident | 84.8 | Confident | 93 Ų | 93 | 95.2 Ų | 95.2 | 49% | 0.487 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.4 | -43.7 | 176.6 | -161.4 | 115.7 | 0 | 0 | 0 | 111.2 | V14 M15 L16 L21 I22 | V14-L18 WeakPolarHBondContact O-CB 3.49Å; V14-L18 PolarHBondContact O-N 2.85Å; M15-L18 PolarHBondContact O-N 3.17Å; L16-L18 VanDerWaalsContact C-N 3.32Å; L16-L18 PolarHBondContact O-N 3.48Å; L18-L21 PolarHBondContact O-N 2.77Å; L18-I22 HydrophobicContact CD2-CD1 3.75Å; L18-I22 HydrophobicContact CG-CD1 4.2Å; L18-I22 WeakPolarHBondContact O-CB 3.35Å; L18-I22 WeakPolarHBondContact O-CD1 3.42Å; L18-I22 WeakPolarHBondContact O-CG1 3.08Å; L18-I22 PolarHBondContact O-N 2.86Å |
| 19 | I | 86.1 | Confident | 83.6 | Confident | 99 Ų | 99 | 92 Ų | 92 | 51% | 0.508 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63.8 | -49.5 | 175.9 | -66.5 | 166.5 | 0 | 0 | 0 | 110.3 | M15 L16 L21 I22 T23 | M15-I19 WeakPolarHBondContact O-CG1 3.19Å; M15-I19 PolarHBondContact O-N 3.36Å; L16-I19 PolarHBondContact O-N 2.91Å; I19-L21 VanDerWaalsContact C-N 3.29Å; I19-L21 PolarHBondContact O-N 2.97Å; I19-I22 PolarHBondContact O-N 2.95Å; I19-I22 VanDerWaalsContact O-N 3.17Å; I19-T23 PolarHBondContact O-N 2.84Å; I19-T23 PolarHBondContact O-OG1 2.95Å; I19-T23 VanDerWaalsContact O-OG1 3.06Å |
| 20 | L | 85.6 | Confident | 82.4 | Confident | 96 Ų | 96 | 95 Ų | 95 | 50% | 0.503 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -57.5 | -44 | 177.6 | -75.2 | 171.1 | 0 | 0 | 0 | 111.7 | L16 H17 I22 T23 V24 | L16-L20 HydrophobicContact CD2-CD1 4.34Å; L16-L20 HydrophobicContact CG-CD1 4.37Å; L16-L20 WeakPolarHBondContact O-CG 3.46Å; L16-L20 PolarHBondContact O-N 3.38Å; H17-L20 PolarHBondContact O-N 3.44Å; L20-I22 VanDerWaalsContact C-N 3.35Å; L20-I22 PolarHBondContact O-N 2.84Å; L20-T23 PolarHBondContact O-N 3.36Å; L20-V24 WeakPolarHBondContact O-CB 3.5Å; L20-V24 WeakPolarHBondContact O-CG2 3.39Å; L20-V24 PolarHBondContact O-N 3.35Å |
| 21 | L | 83.8 | Confident | 81.2 | Confident | 122 Ų | 122 | 96 Ų | 96 | 64% | 0.639 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -65.7 | -39 | 179.5 | -164.4 | 147.4 | 0 | 0 | 0 | 111.3 | H17 L18 I19 Y25 | H17-L21 WeakPolarHBondContact O-CB 3.31Å; H17-L21 PolarHBondContact O-N 3.44Å; L18-L21 PolarHBondContact O-N 2.77Å; I19-L21 VanDerWaalsContact C-N 3.29Å; I19-L21 PolarHBondContact O-N 2.97Å; L21-Y25 WeakPolarHBondContact O-CB 3.45Å; L21-Y25 PolarHBondContact O-N 3.5Å |
| 22 | I | 84.4 | Confident | 80 | Confident | 97 Ų | 97 | 94.3 Ų | 94.3 | 50% | 0.497 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -66.9 | -43.5 | 174.3 | -67.8 | 163.7 | 0 | 0 | 0 | 111.2 | L18 I19 L20 Y25 A26 | L18-I22 HydrophobicContact CD2-CD1 3.75Å; L18-I22 HydrophobicContact CG-CD1 4.2Å; L18-I22 WeakPolarHBondContact O-CB 3.35Å; L18-I22 WeakPolarHBondContact O-CD1 3.42Å; L18-I22 WeakPolarHBondContact O-CG1 3.08Å; L18-I22 PolarHBondContact O-N 2.86Å; I19-I22 PolarHBondContact O-N 2.95Å; I19-I22 VanDerWaalsContact O-N 3.17Å; L20-I22 VanDerWaalsContact C-N 3.35Å; L20-I22 PolarHBondContact O-N 2.84Å; I22-Y25 PolarHBondContact O-N 3.32Å; I22-A26 VanDerWaalsContact O-CB 3.32Å; I22-A26 WeakPolarHBondContact O-CB 3.17Å; I22-A26 PolarHBondContact O-N 3.03Å |
| 23 | T | 82.4 | Confident | 78.8 | Confident | 67 Ų | 67 | 93.7 Ų | 93.7 | 41% | 0.411 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64.5 | -46.7 | 178.4 | -56.1 | 0 | 0 | 0 | 0 | 111.1 | I19 L20 Y25 A26 E27 | I19-T23 PolarHBondContact O-N 2.84Å; I19-T23 PolarHBondContact O-OG1 2.95Å; I19-T23 VanDerWaalsContact O-OG1 3.06Å; L20-T23 PolarHBondContact O-N 3.36Å; T23-Y25 VanDerWaalsContact C-N 3.32Å; T23-Y25 PolarHBondContact O-N 3.11Å; T23-A26 WeakPolarHBondContact O-CB 3.47Å; T23-A26 PolarHBondContact O-N 2.98Å; T23-E27 PolarHBondContact O-N 3.48Å |
| 24 | V | 79.9 | Confident | 77.8 | Confident | 79 Ų | 79 | 92.1 Ų | 92.1 | 48% | 0.479 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.3 | -41.6 | 175.1 | 172.1 | 0 | 0 | 0 | 0 | 110.6 | L20 E27 L28 | L20-V24 WeakPolarHBondContact O-CB 3.5Å; L20-V24 WeakPolarHBondContact O-CG2 3.39Å; L20-V24 PolarHBondContact O-N 3.35Å; V24-E27 PolarHBondContact O-N 2.9Å; V24-L28 HydrophobicContact CG1-CD1 3.89Å; V24-L28 WeakPolarHBondContact O-CB 3.31Å; V24-L28 PolarHBondContact O-N 3.32Å |
| 25 | Y | 73.6 | Confident | 76.7 | Confident | 84 Ų | 84 | 93 Ų | 93 | 33% | 0.329 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.5 | -40.1 | 175.4 | -176.4 | -95.1 | 0 | 0 | 0 | 111.9 | L21 I22 T23 L28 T29 W36 | L21-Y25 WeakPolarHBondContact O-CB 3.45Å; L21-Y25 PolarHBondContact O-N 3.5Å; I22-Y25 PolarHBondContact O-N 3.32Å; T23-Y25 VanDerWaalsContact C-N 3.32Å; T23-Y25 PolarHBondContact O-N 3.11Å; Y25-L28 PolarHBondContact O-N 2.96Å; Y25-T29 HydrophobicContact CD1-CG2 3.92Å; Y25-T29 HydrophobicContact CD2-CG2 4.4Å; Y25-T29 HydrophobicContact CE1-CG2 3.58Å; Y25-T29 HydrophobicContact CE2-CG2 4.1Å; Y25-T29 HydrophobicContact CG-CG2 4.32Å; Y25-T29 VanDerWaalsContact O-CB 3.3Å; Y25-T29 WeakPolarHBondContact O-CB 3.39Å; Y25-T29 WeakPolarHBondContact O-CG2 3.2Å; Y25-T29 PolarHBondContact O-N 3.32Å; Y25-T29 PolarHBondContact O-OG1 3.46Å; Y25-W36 HydrophobicContact CD2-CE3 4.12Å; Y25-W36 HydrophobicContact CD2-CH2 4.3Å; Y25-W36 AromaticContact CD2-CZ3 3.87Å; Y25-W36 HydrophobicContact CD2-CZ3 3.87Å; Y25-W36 HydrophobicContact CE2-CD2 4.4Å; Y25-W36 AromaticContact CE2-CE3 3.59Å; Y25-W36 HydrophobicContact CE2-CE3 3.59Å; Y25-W36 HydrophobicContact CE2-CH2 4.5Å; Y25-W36 AromaticContact CE2-CZ3 3.64Å; Y25-W36 HydrophobicContact CE2-CZ3 3.64Å |
| 26 | A | 74.1 | Confident | 75.8 | Confident | 46 Ų | 46 | 91.2 Ų | 91.2 | 38% | 0.38 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -65 | -40.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | I22 T23 T29 Q30 | I22-A26 VanDerWaalsContact O-CB 3.32Å; I22-A26 WeakPolarHBondContact O-CB 3.17Å; I22-A26 PolarHBondContact O-N 3.03Å; T23-A26 WeakPolarHBondContact O-CB 3.47Å; T23-A26 PolarHBondContact O-N 2.98Å; A26-T29 WeakPolarHBondContact CA-OG1 3.3Å; A26-T29 PolarHBondContact O-OG1 3.29Å; A26-Q30 WeakPolarHBondContact O-CG 3.39Å; A26-Q30 PolarHBondContact O-N 3.47Å |
| 27 | E | 73.5 | Confident | 74.9 | Confident | 126 Ų | 126 | 93.4 Ų | 93.4 | 59% | 0.589 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -68.9 | -44.5 | 175.4 | -73.5 | -176.3 | -179 | 0 | 0 | 111.9 | T23 V24 T29 Q30 T31 | T23-E27 PolarHBondContact O-N 3.48Å; V24-E27 PolarHBondContact O-N 2.9Å; E27-T29 PolarHBondContact O-N 3.5Å; E27-Q30 PolarHBondContact O-N 3.32Å; E27-T31 PolarHBondContact O-N 3.07Å; E27-T31 PolarHBondContact O-OG1 3.49Å |
| 28 | L | 68.5 | Low | 74.3 | Confident | 65 Ų | 65 | 95.7 Ų | 95.7 | 34% | 0.34 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -67.5 | -34.8 | 178.7 | -104.7 | 82.8 | 0 | 0 | 0 | 112.9 | V24 Y25 Q30 T31 E32 W36 | V24-L28 HydrophobicContact CG1-CD1 3.89Å; V24-L28 WeakPolarHBondContact O-CB 3.31Å; V24-L28 PolarHBondContact O-N 3.32Å; Y25-L28 PolarHBondContact O-N 2.96Å; L28-Q30 VanDerWaalsContact C-N 3.26Å; L28-Q30 PolarHBondContact O-N 3Å; L28-T31 PolarHBondContact O-N 2.87Å; L28-T31 PolarHBondContact O-OG1 2.85Å; L28-E32 PolarHBondContact O-N 3.3Å; L28-W36 HydrophobicContact CB-CZ2 4.24Å; L28-W36 HydrophobicContact CD2-CZ2 3.36Å; L28-W36 HydrophobicContact CG-CZ2 4.4Å |
| 29 | T | 65.9 | Low | 73.8 | Confident | 37 Ų | 37 | 94.9 Ų | 94.9 | 23% | 0.227 | 49% | 0.493 | C | S | . | . | H | α-helix | trans | -68.4 | -26.9 | 176.5 | 47.2 | 0 | 0 | 0 | 0 | 112 | Y25 A26 E27 T33 W36 | Y25-T29 HydrophobicContact CD1-CG2 3.92Å; Y25-T29 HydrophobicContact CD2-CG2 4.4Å; Y25-T29 HydrophobicContact CE1-CG2 3.58Å; Y25-T29 HydrophobicContact CE2-CG2 4.1Å; Y25-T29 HydrophobicContact CG-CG2 4.32Å; Y25-T29 VanDerWaalsContact O-CB 3.3Å; Y25-T29 WeakPolarHBondContact O-CB 3.39Å; Y25-T29 WeakPolarHBondContact O-CG2 3.2Å; Y25-T29 PolarHBondContact O-N 3.32Å; Y25-T29 PolarHBondContact O-OG1 3.46Å; A26-T29 WeakPolarHBondContact CA-OG1 3.3Å; A26-T29 PolarHBondContact O-OG1 3.29Å; E27-T29 PolarHBondContact O-N 3.5Å; T29-T33 WeakPolarHBondContact O-CG2 3.41Å; T29-T33 PolarHBondContact O-N 2.74Å; T29-W36 HydrophobicContact CG2-CB 4.38Å; T29-W36 HydrophobicContact CG2-CG 4.39Å |
| 30 | Q | 63.9 | Low | 73.4 | Confident | 163 Ų | 163 | 97.8 Ų | 97.8 | 76% | 0.762 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -75.2 | -36.2 | 175.1 | -74.5 | -173.6 | 7.4 | 0 | 0 | 113 | A26 E27 L28 | A26-Q30 WeakPolarHBondContact O-CG 3.39Å; A26-Q30 PolarHBondContact O-N 3.47Å; E27-Q30 PolarHBondContact O-N 3.32Å; L28-Q30 VanDerWaalsContact C-N 3.26Å; L28-Q30 PolarHBondContact O-N 3Å |
| 31 | T | 64.9 | Low | 73.2 | Confident | 111 Ų | 111 | 97.6 Ų | 97.6 | 68% | 0.681 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -83.4 | -31.8 | -177.8 | 44.2 | 0 | 0 | 0 | 0 | 113.4 | E27 L28 | E27-T31 PolarHBondContact O-N 3.07Å; E27-T31 PolarHBondContact O-OG1 3.49Å; L28-T31 PolarHBondContact O-N 2.87Å; L28-T31 PolarHBondContact O-OG1 2.85Å |
| 32 | E | 64.8 | Low | 73.1 | Confident | 91 Ų | 91 | 96.8 Ų | 96.8 | 43% | 0.425 | 49% | 0.49 | S | S | . | . | trans | -135.2 | 47.2 | -173.5 | -61.4 | -165.5 | 156.4 | 0 | 0 | 113.4 | L28 P34 L35 W36 | L28-E32 PolarHBondContact O-N 3.3Å; E32-P34 VanDerWaalsContact C-N 3.28Å; E32-P34 VanDerWaalsContact O-N 3.1Å; E32-L35 HydrophobicContact CB-CB 4.34Å; E32-L35 HydrophobicContact CB-CD1 4.46Å; E32-L35 PolarHBondContact O-N 2.89Å; E32-L35 VanDerWaalsContact O-N 3.07Å; E32-L35 WeakPolarHBondContact OE2-CD1 3.16Å; E32-W36 PolarHBondContact O-N 3.5Å; E32-W36 VanDerWaalsContact O-N 3.1Å | ||
| 33 | T | 65.1 | Low | 73 | Confident | 94 Ų | 94 | 97.7 Ų | 97.7 | 58% | 0.577 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -40.3 | -44.1 | 173.7 | 32.5 | 0 | 0 | 0 | 0 | 115.2 | T29 K37 | T29-T33 WeakPolarHBondContact O-CG2 3.41Å; T29-T33 PolarHBondContact O-N 2.74Å; T33-K37 VanDerWaalsContact O-CB 3.25Å; T33-K37 WeakPolarHBondContact O-CB 3.45Å; T33-K37 PolarHBondContact O-N 3.39Å |
| 34 | P | 68.8 | Low | 72.9 | Confident | 96 Ų | 96 | 96.1 Ų | 96.1 | 62% | 0.623 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -73.4 | -34.5 | -178.1 | 26.9 | -34.4 | 0 | 0 | 0 | 113.9 | E32 K38 | E32-P34 VanDerWaalsContact C-N 3.28Å; E32-P34 VanDerWaalsContact O-N 3.1Å; P34-K38 PolarHBondContact O-N 2.93Å |
| 35 | L | 69.8 | Low | 73 | Confident | 101 Ų | 101 | 97.8 Ų | 97.8 | 53% | 0.529 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -76.2 | -43.2 | -178.1 | -71.7 | 172.1 | 0 | 0 | 0 | 111.2 | E32 K37 K38 L39 | E32-L35 HydrophobicContact CB-CB 4.34Å; E32-L35 HydrophobicContact CB-CD1 4.46Å; E32-L35 PolarHBondContact O-N 2.89Å; E32-L35 VanDerWaalsContact O-N 3.07Å; E32-L35 WeakPolarHBondContact OE2-CD1 3.16Å; L35-K37 PolarHBondContact O-N 3.49Å; L35-K38 PolarHBondContact O-N 3.26Å; L35-L39 WeakPolarHBondContact O-CB 3.04Å; L35-L39 PolarHBondContact O-N 2.93Å |
| 36 | W | 68.9 | Low | 73.4 | Confident | 62 Ų | 62 | 98.5 Ų | 98.5 | 24% | 0.235 | 50% | 0.502 | C | S | . | . | H | α-helix | trans | -64.7 | -39.7 | 176.7 | -86.1 | 95.1 | 0 | 0 | 0 | 112.8 | Y25 L28 T29 E32 K38 L39 W40 | Y25-W36 HydrophobicContact CD2-CE3 4.12Å; Y25-W36 HydrophobicContact CD2-CH2 4.3Å; Y25-W36 AromaticContact CD2-CZ3 3.87Å; Y25-W36 HydrophobicContact CD2-CZ3 3.87Å; Y25-W36 HydrophobicContact CE2-CD2 4.4Å; Y25-W36 AromaticContact CE2-CE3 3.59Å; Y25-W36 HydrophobicContact CE2-CE3 3.59Å; Y25-W36 HydrophobicContact CE2-CH2 4.5Å; Y25-W36 AromaticContact CE2-CZ3 3.64Å; Y25-W36 HydrophobicContact CE2-CZ3 3.64Å; L28-W36 HydrophobicContact CB-CZ2 4.24Å; L28-W36 HydrophobicContact CD2-CZ2 3.36Å; L28-W36 HydrophobicContact CG-CZ2 4.4Å; T29-W36 HydrophobicContact CG2-CB 4.38Å; T29-W36 HydrophobicContact CG2-CG 4.39Å; E32-W36 PolarHBondContact O-N 3.5Å; E32-W36 VanDerWaalsContact O-N 3.1Å; W36-K38 VanDerWaalsContact C-N 3.33Å; W36-K38 PolarHBondContact O-N 3.36Å; W36-L39 HydrophobicContact CE3-CD2 4.25Å; W36-L39 HydrophobicContact CH2-CD2 4.42Å; W36-L39 HydrophobicContact CZ3-CD2 4.05Å; W36-L39 PolarHBondContact O-N 2.88Å; W36-W40 VanDerWaalsContact O-CB 3.26Å; W36-W40 WeakPolarHBondContact O-CB 3.39Å; W36-W40 PolarHBondContact O-N 3.39Å |
| 37 | K | 72.5 | Confident | 73.7 | Confident | 146 Ų | 146 | 101.5 Ų | 101.5 | 64% | 0.635 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61.5 | -43.9 | 175.6 | -171.7 | 176 | -177.8 | 178.8 | 0 | 111.2 | T33 L35 W40 D41 | T33-K37 VanDerWaalsContact O-CB 3.25Å; T33-K37 WeakPolarHBondContact O-CB 3.45Å; T33-K37 PolarHBondContact O-N 3.39Å; L35-K37 PolarHBondContact O-N 3.49Å; K37-W40 PolarHBondContact O-N 3.4Å; K37-D41 WeakPolarHBondContact O-CB 3.46Å; K37-D41 PolarHBondContact O-N 2.94Å |
| 38 | K | 76.7 | Confident | 73.9 | Confident | 135 Ų | 135 | 103.3 Ų | 103.3 | 59% | 0.587 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -64.3 | -44.5 | 176.9 | -170.8 | 177.6 | 179.3 | -176.4 | 0 | 112 | P34 L35 W36 W40 D41 E42 | P34-K38 PolarHBondContact O-N 2.93Å; L35-K38 PolarHBondContact O-N 3.26Å; W36-K38 VanDerWaalsContact C-N 3.33Å; W36-K38 PolarHBondContact O-N 3.36Å; K38-W40 VanDerWaalsContact C-N 3.34Å; K38-W40 PolarHBondContact O-N 3.45Å; K38-D41 PolarHBondContact O-N 2.82Å; K38-E42 PolarHBondContact O-N 2.86Å |
| 39 | L | 77.6 | Confident | 74.4 | Confident | 76 Ų | 76 | 103.1 Ų | 103.1 | 40% | 0.398 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.1 | -45.3 | 176.5 | -163.2 | 75 | 0 | 0 | 0 | 110.6 | L35 W36 E42 F43 | L35-L39 WeakPolarHBondContact O-CB 3.04Å; L35-L39 PolarHBondContact O-N 2.93Å; W36-L39 HydrophobicContact CE3-CD2 4.25Å; W36-L39 HydrophobicContact CH2-CD2 4.42Å; W36-L39 HydrophobicContact CZ3-CD2 4.05Å; W36-L39 PolarHBondContact O-N 2.88Å; L39-E42 PolarHBondContact O-N 3.47Å; L39-F43 HydrophobicContact CD1-CD2 4.22Å; L39-F43 HydrophobicContact CD1-CE2 3.93Å; L39-F43 HydrophobicContact CD2-CE2 4.34Å; L39-F43 HydrophobicContact CG-CD2 3.85Å; L39-F43 HydrophobicContact CG-CE2 3.87Å; L39-F43 WeakPolarHBondContact O-CB 3.28Å; L39-F43 VanDerWaalsContact O-CD2 3.31Å; L39-F43 WeakPolarHBondContact O-CD2 3.3Å; L39-F43 PolarHBondContact O-N 2.93Å |
| 40 | W | 77.6 | Confident | 75.1 | Confident | 159 Ų | 159 | 106.1 Ų | 106.1 | 60% | 0.602 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -66.7 | -39 | -180 | -163 | -100.5 | 0 | 0 | 0 | 112.9 | W36 K37 K38 G44 | W36-W40 VanDerWaalsContact O-CB 3.26Å; W36-W40 WeakPolarHBondContact O-CB 3.39Å; W36-W40 PolarHBondContact O-N 3.39Å; K37-W40 PolarHBondContact O-N 3.4Å; K38-W40 VanDerWaalsContact C-N 3.34Å; K38-W40 PolarHBondContact O-N 3.45Å; W40-G44 WeakPolarHBondContact O-CA 3.32Å; W40-G44 PolarHBondContact O-N 3.25Å |
| 41 | D | 81 | Confident | 75.8 | Confident | 92 Ų | 92 | 101.6 Ų | 101.6 | 49% | 0.492 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64.5 | -40.4 | 174.3 | -81.8 | -10.2 | 0 | 0 | 0 | 111.4 | K37 K38 N45 | K37-D41 WeakPolarHBondContact O-CB 3.46Å; K37-D41 PolarHBondContact O-N 2.94Å; K38-D41 PolarHBondContact O-N 2.82Å; D41-N45 WeakPolarHBondContact O-CB 3.24Å; D41-N45 PolarHBondContact O-N 3.37Å; D41-N45 PolarHBondContact O-ND2 3.48Å; D41-N45 VanDerWaalsContact O-ND2 3.11Å |
| 42 | E | 81.7 | Confident | 76.2 | Confident | 106 Ų | 106 | 100.1 Ų | 100.1 | 50% | 0.495 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -66.9 | -48.2 | 175.1 | -76.4 | -175.1 | -163.4 | 0 | 0 | 111.9 | K38 L39 G44 N45 I46 | K38-E42 PolarHBondContact O-N 2.86Å; L39-E42 PolarHBondContact O-N 3.47Å; E42-G44 VanDerWaalsContact C-N 3.34Å; E42-G44 PolarHBondContact O-N 3.29Å; E42-N45 PolarHBondContact O-N 3.48Å; E42-I46 VanDerWaalsContact O-CG1 3.31Å; E42-I46 WeakPolarHBondContact O-CG1 3.29Å; E42-I46 PolarHBondContact O-N 2.86Å |
| 43 | F | 81.4 | Confident | 76.6 | Confident | 116 Ų | 116 | 97.2 Ų | 97.2 | 51% | 0.509 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.8 | -42.5 | 176.3 | -92.8 | -87.2 | 0 | 0 | 0 | 111.8 | L39 I46 L47 | L39-F43 HydrophobicContact CD1-CD2 4.22Å; L39-F43 HydrophobicContact CD1-CE2 3.93Å; L39-F43 HydrophobicContact CD2-CE2 4.34Å; L39-F43 HydrophobicContact CG-CD2 3.85Å; L39-F43 HydrophobicContact CG-CE2 3.87Å; L39-F43 WeakPolarHBondContact O-CB 3.28Å; L39-F43 VanDerWaalsContact O-CD2 3.31Å; L39-F43 WeakPolarHBondContact O-CD2 3.3Å; L39-F43 PolarHBondContact O-N 2.93Å; F43-I46 PolarHBondContact O-N 3.28Å; F43-L47 WeakPolarHBondContact O-CB 3.39Å; F43-L47 PolarHBondContact O-N 3.43Å |
| 44 | G | 81.9 | Confident | 76.9 | Confident | 33 Ų | 33 | 98.3 Ų | 98.3 | 34% | 0.34 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.8 | -43.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | W40 E42 L47 W48 | W40-G44 WeakPolarHBondContact O-CA 3.32Å; W40-G44 PolarHBondContact O-N 3.25Å; E42-G44 VanDerWaalsContact C-N 3.34Å; E42-G44 PolarHBondContact O-N 3.29Å; G44-L47 PolarHBondContact O-N 2.85Å; G44-W48 WeakPolarHBondContact O-CB 3.42Å; G44-W48 PolarHBondContact O-N 3.47Å |
| 45 | N | 81.4 | Confident | 76.7 | Confident | 114 Ų | 114 | 99.2 Ų | 99.2 | 61% | 0.61 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -63.9 | -41.4 | 175.4 | -81.8 | -36.3 | 0 | 0 | 0 | 112.5 | D41 E42 W48 A49 | D41-N45 WeakPolarHBondContact O-CB 3.24Å; D41-N45 PolarHBondContact O-N 3.37Å; D41-N45 PolarHBondContact O-ND2 3.48Å; D41-N45 VanDerWaalsContact O-ND2 3.11Å; E42-N45 PolarHBondContact O-N 3.48Å; N45-W48 PolarHBondContact O-N 2.84Å; N45-A49 VanDerWaalsContact O-CB 3.3Å; N45-A49 WeakPolarHBondContact O-CB 3.33Å; N45-A49 PolarHBondContact O-N 3.05Å |
| 46 | I | 80.8 | Confident | 76.2 | Confident | 100 Ų | 100 | 103 Ų | 103 | 51% | 0.513 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.9 | -47.5 | 177.1 | -66.7 | 165.9 | 0 | 0 | 0 | 110.6 | E42 F43 W48 A49 I50 | E42-I46 VanDerWaalsContact O-CG1 3.31Å; E42-I46 WeakPolarHBondContact O-CG1 3.29Å; E42-I46 PolarHBondContact O-N 2.86Å; F43-I46 PolarHBondContact O-N 3.28Å; I46-W48 VanDerWaalsContact C-N 3.33Å; I46-W48 PolarHBondContact O-N 3.28Å; I46-A49 PolarHBondContact O-N 3.5Å; I46-I50 HydrophobicContact CG2-CD1 3.86Å; I46-I50 VanDerWaalsContact O-CG1 3.32Å; I46-I50 WeakPolarHBondContact O-CG1 3.34Å; I46-I50 PolarHBondContact O-N 2.97Å |
| 47 | L | 80.2 | Confident | 75.7 | Confident | 109 Ų | 109 | 105 Ų | 105 | 57% | 0.571 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -59.5 | -45.6 | 176.9 | -107.5 | 135.6 | 0 | 0 | 0 | 111 | F43 G44 A49 I50 V51 | F43-L47 WeakPolarHBondContact O-CB 3.39Å; F43-L47 PolarHBondContact O-N 3.43Å; G44-L47 PolarHBondContact O-N 2.85Å; L47-A49 VanDerWaalsContact C-N 3.35Å; L47-A49 PolarHBondContact O-N 3.29Å; L47-I50 PolarHBondContact O-N 2.97Å; L47-V51 WeakPolarHBondContact O-CB 3.38Å; L47-V51 VanDerWaalsContact O-CG2 3.24Å; L47-V51 WeakPolarHBondContact O-CG2 3.38Å; L47-V51 PolarHBondContact O-N 2.82Å |
| 48 | W | 79 | Confident | 75 | Confident | 163 Ų | 163 | 107.1 Ų | 107.1 | 62% | 0.617 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -63 | -41.1 | 177.6 | -168.2 | -114.9 | 0 | 0 | 0 | 111.9 | G44 N45 I46 V51 L52 | G44-W48 WeakPolarHBondContact O-CB 3.42Å; G44-W48 PolarHBondContact O-N 3.47Å; N45-W48 PolarHBondContact O-N 2.84Å; I46-W48 VanDerWaalsContact C-N 3.33Å; I46-W48 PolarHBondContact O-N 3.28Å; W48-V51 PolarHBondContact O-N 3.32Å; W48-L52 HydrophobicContact CD2-CD1 4.5Å; W48-L52 HydrophobicContact CD2-CG 4.38Å; W48-L52 HydrophobicContact CG-CD1 4.27Å; W48-L52 HydrophobicContact CG-CG 4.46Å; W48-L52 HydrophobicContact CZ2-CD2 4.26Å; W48-L52 HydrophobicContact CZ2-CG 4.45Å; W48-L52 VanDerWaalsContact NE1-CD1 3.26Å; W48-L52 VanDerWaalsContact O-CB 3.29Å; W48-L52 WeakPolarHBondContact O-CB 3.33Å; W48-L52 WeakPolarHBondContact O-CG 3.4Å; W48-L52 PolarHBondContact O-N 2.85Å |
| 49 | A | 79.6 | Confident | 74.1 | Confident | 61 Ų | 61 | 107.1 Ų | 107.1 | 50% | 0.504 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63.4 | -41.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | N45 I46 L47 G53 | N45-A49 VanDerWaalsContact O-CB 3.3Å; N45-A49 WeakPolarHBondContact O-CB 3.33Å; N45-A49 PolarHBondContact O-N 3.05Å; I46-A49 PolarHBondContact O-N 3.5Å; L47-A49 VanDerWaalsContact C-N 3.35Å; L47-A49 PolarHBondContact O-N 3.29Å; A49-G53 PolarHBondContact O-N 3.28Å |
| 50 | I | 80.5 | Confident | 73 | Confident | 101 Ų | 101 | 109.8 Ų | 109.8 | 52% | 0.518 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -66.4 | -45.8 | 176 | -66.9 | 167.1 | 0 | 0 | 0 | 110.4 | I46 L47 G53 Q54 | I46-I50 HydrophobicContact CG2-CD1 3.86Å; I46-I50 VanDerWaalsContact O-CG1 3.32Å; I46-I50 WeakPolarHBondContact O-CG1 3.34Å; I46-I50 PolarHBondContact O-N 2.97Å; L47-I50 PolarHBondContact O-N 2.97Å; I50-G53 PolarHBondContact O-N 2.94Å; I50-Q54 HydrophobicContact CG2-CG 4.3Å; I50-Q54 WeakPolarHBondContact O-CB 3.27Å; I50-Q54 WeakPolarHBondContact O-CG 3.44Å; I50-Q54 PolarHBondContact O-N 3.36Å |
| 51 | V | 77.4 | Confident | 72 | Confident | 67 Ų | 67 | 109.6 Ų | 109.6 | 41% | 0.406 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -63.4 | -46.9 | 179.4 | 170.9 | 0 | 0 | 0 | 0 | 110.7 | L47 W48 G53 Q54 L55 | L47-V51 WeakPolarHBondContact O-CB 3.38Å; L47-V51 VanDerWaalsContact O-CG2 3.24Å; L47-V51 WeakPolarHBondContact O-CG2 3.38Å; L47-V51 PolarHBondContact O-N 2.82Å; W48-V51 PolarHBondContact O-N 3.32Å; V51-G53 VanDerWaalsContact C-N 3.34Å; V51-G53 PolarHBondContact O-N 3.46Å; V51-Q54 PolarHBondContact O-N 2.9Å; V51-L55 WeakPolarHBondContact O-CB 3.19Å; V51-L55 PolarHBondContact O-N 3.46Å |
| 52 | L | 74.2 | Confident | 70.8 | Confident | 81 Ų | 81 | 112.4 Ų | 112.4 | 42% | 0.424 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -62.8 | -39.3 | 174.8 | -75.2 | 179.2 | 0 | 0 | 0 | 112.1 | W48 L55 R56 | W48-L52 HydrophobicContact CD2-CD1 4.5Å; W48-L52 HydrophobicContact CD2-CG 4.38Å; W48-L52 HydrophobicContact CG-CD1 4.27Å; W48-L52 HydrophobicContact CG-CG 4.46Å; W48-L52 HydrophobicContact CZ2-CD2 4.26Å; W48-L52 HydrophobicContact CZ2-CG 4.45Å; W48-L52 VanDerWaalsContact NE1-CD1 3.26Å; W48-L52 VanDerWaalsContact O-CB 3.29Å; W48-L52 WeakPolarHBondContact O-CB 3.33Å; W48-L52 WeakPolarHBondContact O-CG 3.4Å; W48-L52 PolarHBondContact O-N 2.85Å; L52-L55 PolarHBondContact O-N 2.97Å; L52-R56 VanDerWaalsContact O-CB 3.27Å; L52-R56 WeakPolarHBondContact O-CB 3.42Å; L52-R56 PolarHBondContact O-N 3.37Å |
| 53 | G | 73 | Confident | 69.4 | Low | 30 Ų | 30 | 111.3 Ų | 111.3 | 31% | 0.309 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -62.3 | -44.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | A49 I50 V51 R56 N57 | A49-G53 PolarHBondContact O-N 3.28Å; I50-G53 PolarHBondContact O-N 2.94Å; V51-G53 VanDerWaalsContact C-N 3.34Å; V51-G53 PolarHBondContact O-N 3.46Å; G53-R56 PolarHBondContact O-N 2.82Å; G53-N57 WeakPolarHBondContact O-CB 3.4Å; G53-N57 VanDerWaalsContact O-CG 3.27Å; G53-N57 PolarHBondContact O-N 3.41Å; G53-N57 PolarHBondContact O-ND2 3.12Å |
| 54 | Q | 70.6 | Confident | 68.1 | Low | 116 Ų | 116 | 112.3 Ų | 112.3 | 54% | 0.542 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -62.7 | -44.2 | 174 | -72.3 | -89.8 | -20.9 | 0 | 0 | 111.3 | I50 V51 N57 R58 | I50-Q54 HydrophobicContact CG2-CG 4.3Å; I50-Q54 WeakPolarHBondContact O-CB 3.27Å; I50-Q54 WeakPolarHBondContact O-CG 3.44Å; I50-Q54 PolarHBondContact O-N 3.36Å; V51-Q54 PolarHBondContact O-N 2.9Å; Q54-N57 PolarHBondContact O-N 3.3Å; Q54-R58 WeakPolarHBondContact O-CG 3.35Å; Q54-R58 PolarHBondContact O-N 2.93Å |
| 55 | L | 65.9 | Low | 66.9 | Low | 115 Ų | 115 | 115.4 Ų | 115.4 | 60% | 0.602 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -62.7 | -45.3 | 178.3 | -141.6 | 84.7 | 0 | 0 | 0 | 111 | V51 L52 N57 R58 H59 | V51-L55 WeakPolarHBondContact O-CB 3.19Å; V51-L55 PolarHBondContact O-N 3.46Å; L52-L55 PolarHBondContact O-N 2.97Å; L55-N57 VanDerWaalsContact C-N 3.34Å; L55-N57 PolarHBondContact O-N 3.3Å; L55-R58 PolarHBondContact O-N 3.16Å; L55-H59 PolarHBondContact O-N 3.49Å |
| 56 | R | 58 | Low | 65.8 | Low | 181 Ų | 181 | 114.4 Ų | 114.4 | 68% | 0.683 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -62.6 | -40 | 176.4 | -170.2 | 178.6 | -175.8 | -165.8 | 1.9 | 111.7 | L52 G53 H59 K60 | L52-R56 VanDerWaalsContact O-CB 3.27Å; L52-R56 WeakPolarHBondContact O-CB 3.42Å; L52-R56 PolarHBondContact O-N 3.37Å; G53-R56 PolarHBondContact O-N 2.82Å; R56-H59 PolarHBondContact O-N 3.02Å; R56-K60 PolarHBondContact O-N 3.02Å |
| 57 | N | 59.2 | Low | 64.6 | Low | 104 Ų | 104 | 115.9 Ų | 115.9 | 56% | 0.556 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -68.1 | -37.3 | 176.4 | -77.6 | -17.3 | 0 | 0 | 0 | 112.6 | G53 Q54 L55 H59 K61 | G53-N57 WeakPolarHBondContact O-CB 3.4Å; G53-N57 VanDerWaalsContact O-CG 3.27Å; G53-N57 PolarHBondContact O-N 3.41Å; G53-N57 PolarHBondContact O-ND2 3.12Å; Q54-N57 PolarHBondContact O-N 3.3Å; L55-N57 VanDerWaalsContact C-N 3.34Å; L55-N57 PolarHBondContact O-N 3.3Å; N57-H59 VanDerWaalsContact C-N 3.33Å; N57-K61 PolarHBondContact O-N 3.43Å; N57-K61 VanDerWaalsContact O-N 3.12Å |
| 58 | R | 58.4 | Low | 63.4 | Low | 190 Ų | 190 | 115.7 Ų | 115.7 | 72% | 0.717 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -66.9 | -35.8 | 172.1 | -68.9 | -141.7 | -168.6 | -148.3 | 6.4 | 112 | Q54 L55 K62 | Q54-R58 WeakPolarHBondContact O-CG 3.35Å; Q54-R58 PolarHBondContact O-N 2.93Å; L55-R58 PolarHBondContact O-N 3.16Å; R58-K62 PolarHBondContact O-N 2.86Å; R58-K62 VanDerWaalsContact O-N 3.14Å |
| 59 | H | 56.6 | Low | 62.4 | Low | 135 Ų | 135 | 114.8 Ų | 114.8 | 63% | 0.625 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -66.9 | -45.5 | 176.6 | -131.5 | -87.8 | 0 | 0 | 0 | 111.7 | L55 R56 N57 K61 K62 T63 | L55-H59 PolarHBondContact O-N 3.49Å; R56-H59 PolarHBondContact O-N 3.02Å; N57-H59 VanDerWaalsContact C-N 3.33Å; H59-K61 PolarHBondContact O-N 3.19Å; H59-K62 PolarHBondContact O-N 2.97Å; H59-T63 PolarHBondContact O-N 3.14Å; H59-T63 PolarHBondContact O-OG1 3.49Å |
| 60 | K | 54.7 | Low | 61.3 | Low | 133 Ų | 133 | 117.1 Ų | 117.1 | 58% | 0.578 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -59.3 | -42.5 | 175.4 | -91.9 | -168.9 | 173.5 | -172.7 | 0 | 113.1 | R56 K62 T63 Q64 | R56-K60 PolarHBondContact O-N 3.02Å; K60-K62 VanDerWaalsContact C-N 3.34Å; K60-K62 PolarHBondContact O-N 3.48Å; K60-T63 PolarHBondContact O-N 3.04Å; K60-T63 PolarHBondContact O-OG1 2.87Å; K60-Q64 PolarHBondContact O-N 3.43Å |
| 61 | K | 56.2 | Low | 60.2 | Low | 155 Ų | 155 | 116.9 Ų | 116.9 | 67% | 0.674 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -60.7 | -44.1 | 175.6 | -89.4 | -172.7 | 173.8 | -176.7 | 0 | 111.3 | N57 H59 T63 Q64 T65 | N57-K61 PolarHBondContact O-N 3.43Å; N57-K61 VanDerWaalsContact O-N 3.12Å; H59-K61 PolarHBondContact O-N 3.19Å; K61-T63 PolarHBondContact O-N 3.03Å; K61-Q64 PolarHBondContact O-N 3.38Å; K61-T65 PolarHBondContact O-N 3.35Å; K61-T65 PolarHBondContact O-OG1 3.47Å |
| 62 | K | 55.8 | Low | 59.3 | Low | 150 Ų | 150 | 117.4 Ų | 117.4 | 65% | 0.652 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -61.3 | -43.3 | 176.6 | -82 | -173.7 | 173.3 | -174.8 | 0 | 112.6 | R58 H59 K60 Q64 T65 V66 | R58-K62 PolarHBondContact O-N 2.86Å; R58-K62 VanDerWaalsContact O-N 3.14Å; H59-K62 PolarHBondContact O-N 2.97Å; K60-K62 VanDerWaalsContact C-N 3.34Å; K60-K62 PolarHBondContact O-N 3.48Å; K62-Q64 PolarHBondContact O-N 3.33Å; K62-T65 PolarHBondContact O-N 3.5Å; K62-V66 VanDerWaalsContact O-CG2 3.31Å; K62-V66 WeakPolarHBondContact O-CG2 3.31Å; K62-V66 PolarHBondContact O-N 2.97Å |
| 63 | T | 53.2 | Low | 58.5 | Low | 83 Ų | 83 | 117 Ų | 117 | 51% | 0.509 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -65.9 | -37.9 | 177.8 | 6.1 | 0 | 0 | 0 | 0 | 112.6 | H59 K60 K61 V66 Q67 | H59-T63 PolarHBondContact O-N 3.14Å; H59-T63 PolarHBondContact O-OG1 3.49Å; K60-T63 PolarHBondContact O-N 3.04Å; K60-T63 PolarHBondContact O-OG1 2.87Å; K61-T63 PolarHBondContact O-N 3.03Å; T63-V66 PolarHBondContact O-N 3.06Å; T63-Q67 PolarHBondContact O-N 3.03Å |
| 64 | Q | 54.5 | Low | 57.7 | Low | 137 Ų | 137 | 123.5 Ų | 123.5 | 64% | 0.64 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -65.5 | -40 | 174.1 | -101 | 178.9 | -20.4 | 0 | 0 | 112.4 | K60 K61 K62 V66 Q67 N68 | K60-Q64 PolarHBondContact O-N 3.43Å; K61-Q64 PolarHBondContact O-N 3.38Å; K62-Q64 PolarHBondContact O-N 3.33Å; Q64-V66 VanDerWaalsContact C-N 3.35Å; Q64-Q67 PolarHBondContact O-N 3.44Å; Q64-N68 WeakPolarHBondContact O-CB 3.32Å; Q64-N68 PolarHBondContact O-N 3.33Å |
| 65 | T | 56.4 | Low | 57 | Low | 98 Ų | 98 | 125 Ų | 125 | 60% | 0.601 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -66.4 | -37.7 | 177 | -45 | 0 | 0 | 0 | 0 | 111.8 | K61 K62 K69 | K61-T65 PolarHBondContact O-N 3.35Å; K61-T65 PolarHBondContact O-OG1 3.47Å; K62-T65 PolarHBondContact O-N 3.5Å; T65-K69 WeakPolarHBondContact O-CB 3.39Å; T65-K69 PolarHBondContact O-N 2.92Å |
| 66 | V | 58.5 | Low | 56.7 | Low | 93 Ų | 93 | 124.2 Ų | 124.2 | 56% | 0.564 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -69.7 | -41.7 | 176.8 | 175 | 0 | 0 | 0 | 0 | 111.5 | K62 T63 Q64 K69 N70 | K62-V66 VanDerWaalsContact O-CG2 3.31Å; K62-V66 WeakPolarHBondContact O-CG2 3.31Å; K62-V66 PolarHBondContact O-N 2.97Å; T63-V66 PolarHBondContact O-N 3.06Å; Q64-V66 VanDerWaalsContact C-N 3.35Å; V66-K69 PolarHBondContact O-N 3.49Å; V66-N70 PolarHBondContact O-N 3.05Å |
| 67 | Q | 55.7 | Low | 56.6 | Low | 132 Ų | 132 | 121.8 Ų | 121.8 | 62% | 0.617 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -65.2 | -42.8 | 174.8 | -82.8 | -164.4 | -23.7 | 0 | 0 | 112.3 | T63 Q64 K69 N70 I71 | T63-Q67 PolarHBondContact O-N 3.03Å; Q64-Q67 PolarHBondContact O-N 3.44Å; Q67-K69 VanDerWaalsContact C-N 3.32Å; Q67-K69 PolarHBondContact O-N 2.96Å; Q67-N70 PolarHBondContact O-N 3.33Å; Q67-I71 VanDerWaalsContact O-CG1 3.26Å; Q67-I71 WeakPolarHBondContact O-CG1 3.42Å; Q67-I71 PolarHBondContact O-N 3.06Å |
| 68 | N | 55.2 | Low | 56.3 | Low | 104 Ų | 104 | 120.6 Ų | 120.6 | 56% | 0.556 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -65.7 | -37.4 | -179.7 | -156 | 18.3 | 0 | 0 | 0 | 111.5 | Q64 I71 V72 | Q64-N68 WeakPolarHBondContact O-CB 3.32Å; Q64-N68 PolarHBondContact O-N 3.33Å; N68-I71 PolarHBondContact O-N 3.33Å; N68-V72 WeakPolarHBondContact O-CG2 3.47Å; N68-V72 PolarHBondContact O-N 3.28Å |
| 69 | K | 57.4 | Low | 56.1 | Low | 144 Ų | 144 | 116.8 Ų | 116.8 | 63% | 0.626 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -65 | -43.2 | 174.6 | -161.1 | 176.4 | -177.4 | -176.2 | 0 | 112.1 | T65 V66 Q67 I71 V72 D73 | T65-K69 WeakPolarHBondContact O-CB 3.39Å; T65-K69 PolarHBondContact O-N 2.92Å; V66-K69 PolarHBondContact O-N 3.49Å; Q67-K69 VanDerWaalsContact C-N 3.32Å; Q67-K69 PolarHBondContact O-N 2.96Å; K69-I71 VanDerWaalsContact C-N 3.3Å; K69-I71 PolarHBondContact O-N 3.35Å; K69-V72 PolarHBondContact O-N 3.37Å; K69-D73 WeakPolarHBondContact O-CB 3.26Å; K69-D73 PolarHBondContact O-N 3.44Å |
| 70 | N | 57.1 | Low | 56.2 | Low | 111 Ų | 111 | 116.3 Ų | 116.3 | 59% | 0.594 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -65.2 | -28.7 | 175.5 | -95.4 | 8.2 | 0 | 0 | 0 | 113.7 | V66 Q67 K74 | V66-N70 PolarHBondContact O-N 3.05Å; Q67-N70 PolarHBondContact O-N 3.33Å; N70-K74 WeakPolarHBondContact O-CB 3.34Å; N70-K74 PolarHBondContact O-N 3Å |
| 71 | I | 56.9 | Low | 55.9 | Low | 95 Ų | 95 | 119 Ų | 119 | 49% | 0.487 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -75.8 | -42.7 | 176.4 | -66 | 162.6 | 0 | 0 | 0 | 110.4 | Q67 N68 K69 K74 H75 | Q67-I71 VanDerWaalsContact O-CG1 3.26Å; Q67-I71 WeakPolarHBondContact O-CG1 3.42Å; Q67-I71 PolarHBondContact O-N 3.06Å; N68-I71 PolarHBondContact O-N 3.33Å; K69-I71 VanDerWaalsContact C-N 3.3Å; K69-I71 PolarHBondContact O-N 3.35Å; I71-K74 PolarHBondContact O-N 3.08Å; I71-H75 PolarHBondContact O-N 3.31Å; I71-H75 VanDerWaalsContact O-N 3.08Å |
| 72 | V | 57.6 | Low | 55.3 | Low | 78 Ų | 78 | 120.3 Ų | 120.3 | 47% | 0.473 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -62.7 | -47.8 | 176.7 | 173.9 | 0 | 0 | 0 | 0 | 110.5 | N68 K69 K74 H75 T76 | N68-V72 WeakPolarHBondContact O-CG2 3.47Å; N68-V72 PolarHBondContact O-N 3.28Å; K69-V72 PolarHBondContact O-N 3.37Å; V72-K74 PolarHBondContact O-N 3.06Å; V72-H75 PolarHBondContact O-N 3.22Å; V72-T76 PolarHBondContact O-N 2.91Å; V72-T76 PolarHBondContact O-OG1 2.93Å |
| 73 | D | 57.2 | Low | 55.3 | Low | 73 Ų | 73 | 118.9 Ų | 118.9 | 39% | 0.39 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -63 | -27.7 | 179.2 | -72.7 | -25.7 | 0 | 0 | 0 | 112.7 | K69 N77 | K69-D73 WeakPolarHBondContact O-CB 3.26Å; K69-D73 PolarHBondContact O-N 3.44Å; D73-N77 PolarHBondContact O-ND2 2.85Å |
| 74 | K | 56.2 | Low | 55.4 | Low | 167 Ų | 167 | 120.7 Ų | 120.7 | 73% | 0.726 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -78.5 | -30.4 | 175.4 | -137 | 177.4 | -174.9 | -174.2 | 0 | 112.7 | N70 I71 V72 | N70-K74 WeakPolarHBondContact O-CB 3.34Å; N70-K74 PolarHBondContact O-N 3Å; I71-K74 PolarHBondContact O-N 3.08Å; V72-K74 PolarHBondContact O-N 3.06Å |
| 75 | H | 57.4 | Low | 55.5 | Low | 146 Ų | 146 | 119.8 Ų | 119.8 | 68% | 0.676 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -83.5 | -30.7 | 178.4 | -97.9 | -78.9 | 0 | 0 | 0 | 113.4 | I71 V72 N77 | I71-H75 PolarHBondContact O-N 3.31Å; I71-H75 VanDerWaalsContact O-N 3.08Å; V72-H75 PolarHBondContact O-N 3.22Å; H75-N77 VanDerWaalsContact C-N 3.33Å |
| 76 | T | 58.1 | Low | 55.4 | Low | 100 Ų | 100 | 121.1 Ų | 121.1 | 61% | 0.613 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -77.2 | -17.9 | 176.4 | 39.8 | 0 | 0 | 0 | 0 | 113.8 | V72 | V72-T76 PolarHBondContact O-N 2.91Å; V72-T76 PolarHBondContact O-OG1 2.93Å |
| 77 | N | 56.3 | Low | 55.2 | Low | 129 Ų | 129 | 122.9 Ų | 122.9 | 69% | 0.69 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.4 | 5.5 | 178.3 | -70.4 | -40.9 | 0 | 0 | 0 | 113.7 | D73 H75 P79 | D73-N77 PolarHBondContact O-ND2 2.85Å; H75-N77 VanDerWaalsContact C-N 3.33Å; N77-P79 VanDerWaalsContact O-CD 3.31Å; N77-P79 WeakPolarHBondContact O-CD 3.31Å |
| 78 | S | 53.4 | Low | 55.2 | Low | 80 Ų | 80 | 122.3 Ų | 122.3 | 56% | 0.559 | 67% | 0.674 | S | S | * | * | S | Bend | trans | -74.8 | 116.5 | 168.8 | -70.7 | 0 | 0 | 0 | 0 | 108.5 | C80 | S78-C80 PolarHBondContact O-N 3.35Š|
| 79 | P | 53.2 | Low | 55.2 | Low | 110 Ų | 110 | 123.6 Ų | 123.6 | 71% | 0.714 | 68% | 0.683 | S | S | * | * | trans | -62.2 | 132 | 173.3 | 26 | -30.6 | 0 | 0 | 0 | 108.3 | N77 E81 | N77-P79 VanDerWaalsContact O-CD 3.31Å; N77-P79 WeakPolarHBondContact O-CD 3.31Å; P79-E81 VanDerWaalsContact C-N 3.27Å; P79-E81 PolarHBondContact O-N 3.12Å | ||
| 80 | C | 59.7 | Low | 55 | Low | 125 Ų | 125 | 122 Ų | 122 | 85% | 0.845 | 69% | 0.687 | S | S | * | * | trans | -63.9 | 95 | 162.7 | -117.6 | 0 | 0 | 0 | 0 | 106.6 | S78 S82 | S78-C80 PolarHBondContact O-N 3.35Å; C80-S82 PolarHBondContact O-N 2.92Å; C80-S82 VanDerWaalsContact O-N 3.12Å | ||
| 81 | E | 47.6 | Very low | 54.8 | Low | 188 Ų | 188 | 122.9 Ų | 122.9 | 88% | 0.879 | 70% | 0.695 | S | S | * | * | trans | -65.4 | 105.8 | 158.8 | -82.2 | -176.9 | 143.9 | 0 | 0 | 106.6 | P79 | P79-E81 VanDerWaalsContact C-N 3.27Å; P79-E81 PolarHBondContact O-N 3.12Å | ||
| 82 | S | 44.3 | Very low | 54.6 | Low | 184 Ų | 184 | 125.5 Ų | 125.5 | 100% | 1.287 | 71% | 0.714 | S | S | * | * | trans | -92.4 | 0 | 161.6 | -64.6 | 0 | 0 | 0 | 0 | 109.6 | C80 | C80-S82 PolarHBondContact O-N 2.92Å; C80-S82 VanDerWaalsContact O-N 3.12Å |
Retrieved 82 of 82 residues in 18.7 ms
(Link to these results)