| 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 | 54.1 | Low | 66.9 | Low | 207 Ų | 207 | 140.4 Ų | 140.4 | 100% | 1.02 | 66% | 0.659 | S | S | * | * | 0 | -34.7 | 0 | -107.2 | 175.3 | 168.2 | 0 | 0 | 114.2 | Y3 F4 | M1-Y3 PolarHBondContact O-N 3.27Å; M1-F4 PolarHBondContact O-N 3.26Å | |||
| 2 | Y | 58.4 | Low | 67.5 | Low | 218 Ų | 218 | 140.7 Ų | 140.7 | 86% | 0.855 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -63.9 | -31.9 | -176.6 | -68.5 | -77.6 | 0 | 0 | 0 | 116.3 | F4 | Y2-F4 PolarHBondContact O-N 3.4Å |
| 3 | Y | 62.5 | Low | 68.6 | Low | 225 Ų | 225 | 132.2 Ų | 132.2 | 88% | 0.882 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -69.7 | -18.4 | 176.1 | -65.9 | -76.4 | 0 | 0 | 0 | 114.1 | M1 G7 | M1-Y3 PolarHBondContact O-N 3.27Å; Y3-G7 PolarHBondContact O-N 3.04Å |
| 4 | F | 64.4 | Low | 69.7 | Low | 162 Ų | 162 | 135.1 Ų | 135.1 | 71% | 0.711 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -80.4 | -35.9 | -173.4 | -139.3 | -97 | 0 | 0 | 0 | 112.5 | M1 Y2 L8 | M1-F4 PolarHBondContact O-N 3.26Å; Y2-F4 PolarHBondContact O-N 3.4Å; F4-L8 HydrophobicContact CD1-CD1 4.26Å; F4-L8 PolarHBondContact O-N 3.08Å |
| 5 | I | 68.8 | Low | 70.8 | Confident | 104 Ų | 104 | 130.6 Ų | 130.6 | 53% | 0.533 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -68.6 | -46.4 | 176 | -76 | 108.2 | 0 | 0 | 0 | 110.9 | G7 L8 F9 | I5-G7 VanDerWaalsContact C-N 3.3Å; I5-G7 PolarHBondContact O-N 3.42Å; I5-L8 PolarHBondContact O-N 3.27Å; I5-F9 HydrophobicContact CG2-CD2 3.82Å; I5-F9 HydrophobicContact CG2-CE2 3.85Å; I5-F9 WeakPolarHBondContact O-CD2 3.27Å; I5-F9 PolarHBondContact O-N 3.47Å; I5-F9 VanDerWaalsContact O-N 3.16Å |
| 6 | G | 71.4 | Confident | 71.9 | Confident | 45 Ų | 45 | 127.5 Ų | 127.5 | 46% | 0.464 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -59.3 | -39.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | F9 Y10 | G6-F9 PolarHBondContact O-N 3.39Å; G6-Y10 WeakPolarHBondContact O-CB 3.39Å; G6-Y10 PolarHBondContact O-N 3.03Å |
| 7 | G | 72.5 | Confident | 73 | Confident | 31 Ų | 31 | 126.4 Ų | 126.4 | 32% | 0.32 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -65 | -40.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114 | Y3 I5 Y10 Q11 | Y3-G7 PolarHBondContact O-N 3.04Å; I5-G7 VanDerWaalsContact C-N 3.3Å; I5-G7 PolarHBondContact O-N 3.42Å; G7-Y10 PolarHBondContact O-N 3.38Å; G7-Q11 WeakPolarHBondContact O-CB 3.39Å; G7-Q11 WeakPolarHBondContact O-CG 3.43Å; G7-Q11 PolarHBondContact O-N 3.29Å |
| 8 | L | 65.5 | Low | 73.9 | Confident | 89 Ų | 89 | 129.9 Ų | 129.9 | 47% | 0.466 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -66.2 | -41.5 | 176.5 | -86 | 160 | 0 | 0 | 0 | 112.2 | F4 I5 K12 | F4-L8 HydrophobicContact CD1-CD1 4.26Å; F4-L8 PolarHBondContact O-N 3.08Å; I5-L8 PolarHBondContact O-N 3.27Å; L8-K12 WeakPolarHBondContact O-CB 3.31Å; L8-K12 WeakPolarHBondContact O-CG 3.49Å; L8-K12 PolarHBondContact O-N 2.95Å |
| 9 | F | 68.9 | Low | 74.8 | Confident | 157 Ų | 157 | 130.5 Ų | 130.5 | 69% | 0.689 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -67.7 | -38.6 | 174.4 | -82.5 | -81.6 | 0 | 0 | 0 | 112 | I5 G6 K12 G13 | I5-F9 HydrophobicContact CG2-CD2 3.82Å; I5-F9 HydrophobicContact CG2-CE2 3.85Å; I5-F9 WeakPolarHBondContact O-CD2 3.27Å; I5-F9 PolarHBondContact O-N 3.47Å; I5-F9 VanDerWaalsContact O-N 3.16Å; G6-F9 PolarHBondContact O-N 3.39Å; F9-K12 PolarHBondContact O-N 3.49Å; F9-G13 PolarHBondContact O-N 2.88Å |
| 10 | Y | 75 | Confident | 75.6 | Confident | 166 Ų | 166 | 127.8 Ų | 127.8 | 65% | 0.651 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -64.7 | -41.7 | 175.6 | -169.9 | -100.8 | 0 | 0 | 0 | 112.2 | G6 G7 G13 R14 | G6-Y10 WeakPolarHBondContact O-CB 3.39Å; G6-Y10 PolarHBondContact O-N 3.03Å; G7-Y10 PolarHBondContact O-N 3.38Å; Y10-G13 PolarHBondContact O-N 3.35Å; Y10-R14 VanDerWaalsContact O-CB 3.27Å; Y10-R14 WeakPolarHBondContact O-CB 3.23Å; Y10-R14 PolarHBondContact O-N 2.92Å |
| 11 | Q | 74.7 | Confident | 76.4 | Confident | 140 Ų | 140 | 124.2 Ų | 124.2 | 65% | 0.654 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -65.6 | -44.8 | 176 | -75 | -176.6 | 36.6 | 0 | 0 | 112.2 | G7 R14 S15 | G7-Q11 WeakPolarHBondContact O-CB 3.39Å; G7-Q11 WeakPolarHBondContact O-CG 3.43Å; G7-Q11 PolarHBondContact O-N 3.29Å; Q11-R14 PolarHBondContact O-N 2.84Å; Q11-S15 PolarHBondContact O-N 3.19Å; Q11-S15 VanDerWaalsContact O-N 3.08Å; Q11-S15 PolarHBondContact O-OG 3.43Å |
| 12 | K | 73.9 | Confident | 78.2 | Confident | 144 Ų | 144 | 116.5 Ų | 116.5 | 63% | 0.626 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -65.2 | -39.3 | 176 | -75.2 | -176.1 | 177.7 | -177.5 | 0 | 112.5 | L8 F9 S15 V16 | L8-K12 WeakPolarHBondContact O-CB 3.31Å; L8-K12 WeakPolarHBondContact O-CG 3.49Å; L8-K12 PolarHBondContact O-N 2.95Å; F9-K12 PolarHBondContact O-N 3.49Å; K12-S15 PolarHBondContact O-OG 3.36Å; K12-V16 WeakPolarHBondContact O-CG2 3.38Å; K12-V16 PolarHBondContact O-N 3.5Å |
| 13 | G | 82.3 | Confident | 79.8 | Confident | 31 Ų | 31 | 111.4 Ų | 111.4 | 32% | 0.32 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -65.3 | -43 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | F9 Y10 S15 V16 I17 | F9-G13 PolarHBondContact O-N 2.88Å; Y10-G13 PolarHBondContact O-N 3.35Å; G13-S15 PolarHBondContact O-N 3.02Å; G13-V16 PolarHBondContact O-N 3.41Å; G13-I17 WeakPolarHBondContact O-CD1 3.38Å; G13-I17 VanDerWaalsContact O-CG1 3.26Å; G13-I17 WeakPolarHBondContact O-CG1 3.3Å; G13-I17 PolarHBondContact O-N 3.4Å |
| 14 | R | 83.1 | Confident | 81.3 | Confident | 172 Ų | 172 | 106.5 Ų | 106.5 | 65% | 0.649 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -64.4 | -38.9 | 178.9 | -171.1 | 175.6 | -177.4 | -178.9 | 1.5 | 112.5 | Y10 Q11 I17 W18 | Y10-R14 VanDerWaalsContact O-CB 3.27Å; Y10-R14 WeakPolarHBondContact O-CB 3.23Å; Y10-R14 PolarHBondContact O-N 2.92Å; Q11-R14 PolarHBondContact O-N 2.84Å; R14-I17 PolarHBondContact O-N 2.94Å; R14-W18 WeakPolarHBondContact O-CB 3.49Å; R14-W18 PolarHBondContact O-N 3.46Å |
| 15 | S | 87.1 | Confident | 82.7 | Confident | 68 Ų | 68 | 106 Ų | 106 | 48% | 0.476 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -67.1 | -40.2 | 177.1 | 62.9 | 0 | 0 | 0 | 0 | 112 | Q11 K12 G13 W18 F19 | Q11-S15 PolarHBondContact O-N 3.19Å; Q11-S15 VanDerWaalsContact O-N 3.08Å; Q11-S15 PolarHBondContact O-OG 3.43Å; K12-S15 PolarHBondContact O-OG 3.36Å; G13-S15 PolarHBondContact O-N 3.02Å; S15-W18 PolarHBondContact O-N 2.96Å; S15-F19 WeakPolarHBondContact O-CB 3.28Å; S15-F19 PolarHBondContact O-N 3.28Å |
| 16 | V | 88.2 | Confident | 84 | Confident | 81 Ų | 81 | 105.4 Ų | 105.4 | 49% | 0.491 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.3 | -45 | 175.2 | 173.5 | 0 | 0 | 0 | 0 | 111.2 | K12 G13 W18 F19 I20 | K12-V16 WeakPolarHBondContact O-CG2 3.38Å; K12-V16 PolarHBondContact O-N 3.5Å; G13-V16 PolarHBondContact O-N 3.41Å; V16-W18 VanDerWaalsContact C-N 3.31Å; V16-W18 PolarHBondContact O-N 2.84Å; V16-F19 PolarHBondContact O-N 3.32Å; V16-I20 HydrophobicContact CG1-CD1 3.59Å; V16-I20 HydrophobicContact CG1-CG1 4.29Å; V16-I20 WeakPolarHBondContact O-CB 3.49Å; V16-I20 VanDerWaalsContact O-CG1 3.24Å; V16-I20 WeakPolarHBondContact O-CG1 3Å; V16-I20 PolarHBondContact O-N 2.72Å |
| 17 | I | 89.7 | Confident | 85.1 | Confident | 109 Ų | 109 | 106 Ų | 106 | 56% | 0.559 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -61.3 | -41.8 | 176.6 | -66.9 | 162.1 | 0 | 0 | 0 | 110.9 | G13 R14 S21 | G13-I17 WeakPolarHBondContact O-CD1 3.38Å; G13-I17 VanDerWaalsContact O-CG1 3.26Å; G13-I17 WeakPolarHBondContact O-CG1 3.3Å; G13-I17 PolarHBondContact O-N 3.4Å; R14-I17 PolarHBondContact O-N 2.94Å; I17-S21 VanDerWaalsContact O-CB 3.27Å; I17-S21 WeakPolarHBondContact O-CB 3.48Å; I17-S21 PolarHBondContact O-N 3.2Å; I17-S21 PolarHBondContact O-OG 3.38Å |
| 18 | W | 89.2 | Confident | 86.2 | Confident | 189 Ų | 189 | 108 Ų | 108 | 72% | 0.716 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -65.8 | -42.1 | 177.9 | -171.2 | 76.8 | 0 | 0 | 0 | 111.7 | R14 S15 V16 S21 S22 | R14-W18 WeakPolarHBondContact O-CB 3.49Å; R14-W18 PolarHBondContact O-N 3.46Å; S15-W18 PolarHBondContact O-N 2.96Å; V16-W18 VanDerWaalsContact C-N 3.31Å; V16-W18 PolarHBondContact O-N 2.84Å; W18-S21 PolarHBondContact O-N 2.84Å; W18-S22 PolarHBondContact O-N 2.94Å |
| 19 | F | 91.4 | Very high | 87.7 | Confident | 141 Ų | 141 | 110.7 Ų | 110.7 | 62% | 0.618 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -61.3 | -49.7 | 175.6 | -177.8 | -97.8 | 0 | 0 | 0 | 111.9 | S15 V16 S21 S22 F23 | S15-F19 WeakPolarHBondContact O-CB 3.28Å; S15-F19 PolarHBondContact O-N 3.28Å; V16-F19 PolarHBondContact O-N 3.32Å; F19-S21 VanDerWaalsContact C-N 3.29Å; F19-S21 PolarHBondContact O-N 3.38Å; F19-S22 PolarHBondContact O-N 3.38Å; F19-F23 WeakPolarHBondContact O-CB 3.36Å; F19-F23 PolarHBondContact O-N 3.34Å |
| 20 | I | 91.9 | Very high | 89 | Confident | 76 Ų | 76 | 107.5 Ų | 107.5 | 39% | 0.39 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -59.8 | -42.8 | 177.1 | -68.8 | 166.8 | 0 | 0 | 0 | 110.4 | V16 S22 F23 F24 | V16-I20 HydrophobicContact CG1-CD1 3.59Å; V16-I20 HydrophobicContact CG1-CG1 4.29Å; V16-I20 WeakPolarHBondContact O-CB 3.49Å; V16-I20 VanDerWaalsContact O-CG1 3.24Å; V16-I20 WeakPolarHBondContact O-CG1 3Å; V16-I20 PolarHBondContact O-N 2.72Å; I20-S22 PolarHBondContact O-N 2.94Å; I20-F23 PolarHBondContact O-N 2.89Å; I20-F24 HydrophobicContact CG2-CD2 3.51Å; I20-F24 HydrophobicContact CG2-CE2 3.33Å; I20-F24 WeakPolarHBondContact O-CD2 3.38Å; I20-F24 PolarHBondContact O-N 3.21Å |
| 21 | S | 91.8 | Very high | 90.1 | Very high | 53 Ų | 53 | 104 Ų | 104 | 37% | 0.371 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -65.3 | -37.9 | 178.9 | -60.3 | 0 | 0 | 0 | 0 | 112.5 | I17 W18 F19 K25 | I17-S21 VanDerWaalsContact O-CB 3.27Å; I17-S21 WeakPolarHBondContact O-CB 3.48Å; I17-S21 PolarHBondContact O-N 3.2Å; I17-S21 PolarHBondContact O-OG 3.38Å; W18-S21 PolarHBondContact O-N 2.84Å; F19-S21 VanDerWaalsContact C-N 3.29Å; F19-S21 PolarHBondContact O-N 3.38Å; S21-K25 WeakPolarHBondContact O-CG 3.31Å; S21-K25 PolarHBondContact O-N 2.98Å |
| 22 | S | 91.7 | Very high | 91.2 | Very high | 46 Ų | 46 | 102.5 Ų | 102.5 | 32% | 0.322 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.6 | -47.2 | 173.6 | -164.5 | 0 | 0 | 0 | 0 | 110.7 | W18 F19 I20 F24 K25 D26 | W18-S22 PolarHBondContact O-N 2.94Å; F19-S22 PolarHBondContact O-N 3.38Å; I20-S22 PolarHBondContact O-N 2.94Å; S22-F24 VanDerWaalsContact C-N 3.32Å; S22-F24 PolarHBondContact O-N 3.46Å; S22-K25 WeakPolarHBondContact O-CB 3.36Å; S22-K25 PolarHBondContact O-N 2.89Å; S22-D26 PolarHBondContact O-N 3.2Å |
| 23 | F | 93.1 | Very high | 92.3 | Very high | 111 Ų | 111 | 98.2 Ų | 98.2 | 49% | 0.487 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -58.1 | -43 | 179.1 | -177.8 | -106.6 | 0 | 0 | 0 | 112.4 | F19 I20 K25 D26 I27 | F19-F23 WeakPolarHBondContact O-CB 3.36Å; F19-F23 PolarHBondContact O-N 3.34Å; I20-F23 PolarHBondContact O-N 2.89Å; F23-K25 VanDerWaalsContact C-N 3.35Å; F23-K25 PolarHBondContact O-N 2.86Å; F23-D26 PolarHBondContact O-N 3.22Å; F23-I27 HydrophobicContact CD1-CD1 3.7Å; F23-I27 HydrophobicContact CE1-CD1 3.2Å; F23-I27 HydrophobicContact CE1-CG1 4.32Å; F23-I27 HydrophobicContact CE2-CD1 4.19Å; F23-I27 HydrophobicContact CG-CD1 4.39Å; F23-I27 HydrophobicContact CZ-CD1 3.49Å; F23-I27 VanDerWaalsContact CZ-CD1 3.49Å; F23-I27 HydrophobicContact CZ-CG1 4.33Å; F23-I27 WeakPolarHBondContact O-CG1 3.46Å; F23-I27 PolarHBondContact O-N 2.93Å |
| 24 | F | 93.1 | Very high | 93 | Very high | 122 Ų | 122 | 100.6 Ų | 100.6 | 54% | 0.535 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -66.6 | -33.1 | 175.7 | -81.8 | -64 | 0 | 0 | 0 | 113.5 | I20 S22 S28 | I20-F24 HydrophobicContact CG2-CD2 3.51Å; I20-F24 HydrophobicContact CG2-CE2 3.33Å; I20-F24 WeakPolarHBondContact O-CD2 3.38Å; I20-F24 PolarHBondContact O-N 3.21Å; S22-F24 VanDerWaalsContact C-N 3.32Å; S22-F24 PolarHBondContact O-N 3.46Å; F24-S28 VanDerWaalsContact O-CB 3.27Å; F24-S28 WeakPolarHBondContact O-CB 3.31Å; F24-S28 PolarHBondContact O-N 3.43Å; F24-S28 PolarHBondContact O-OG 3.37Å |
| 25 | K | 94.1 | Very high | 93.7 | Very high | 151 Ų | 151 | 99.2 Ų | 99.2 | 66% | 0.657 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -64.7 | -44 | 173.9 | -74.5 | 173.4 | 179.6 | -175.8 | 0 | 111 | S21 S22 F23 S28 F29 | S21-K25 WeakPolarHBondContact O-CG 3.31Å; S21-K25 PolarHBondContact O-N 2.98Å; S22-K25 WeakPolarHBondContact O-CB 3.36Å; S22-K25 PolarHBondContact O-N 2.89Å; F23-K25 VanDerWaalsContact C-N 3.35Å; F23-K25 PolarHBondContact O-N 2.86Å; K25-S28 PolarHBondContact O-N 3.31Å; K25-F29 WeakPolarHBondContact O-CB 3.49Å; K25-F29 PolarHBondContact O-N 2.91Å |
| 26 | D | 95 | Very high | 94.2 | Very high | 91 Ų | 91 | 100.8 Ų | 100.8 | 49% | 0.487 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.6 | -44.9 | 179.6 | -61.2 | -30.9 | 0 | 0 | 0 | 111.2 | S22 F23 S28 F29 I30 | S22-D26 PolarHBondContact O-N 3.2Å; F23-D26 PolarHBondContact O-N 3.22Å; D26-S28 PolarHBondContact O-N 3.45Å; D26-F29 PolarHBondContact O-N 3.3Å; D26-I30 WeakPolarHBondContact O-CG1 3.36Å; D26-I30 PolarHBondContact O-N 3.28Å |
| 27 | I | 95.8 | Very high | 94.7 | Very high | 58 Ų | 58 | 103.8 Ų | 103.8 | 30% | 0.297 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.5 | -46.1 | 173.6 | -69.9 | 174.2 | 0 | 0 | 0 | 111 | F23 F29 I30 M31 | F23-I27 HydrophobicContact CD1-CD1 3.7Å; F23-I27 HydrophobicContact CE1-CD1 3.2Å; F23-I27 HydrophobicContact CE1-CG1 4.32Å; F23-I27 HydrophobicContact CE2-CD1 4.19Å; F23-I27 HydrophobicContact CG-CD1 4.39Å; F23-I27 HydrophobicContact CZ-CD1 3.49Å; F23-I27 VanDerWaalsContact CZ-CD1 3.49Å; F23-I27 HydrophobicContact CZ-CG1 4.33Å; F23-I27 WeakPolarHBondContact O-CG1 3.46Å; F23-I27 PolarHBondContact O-N 2.93Å; I27-F29 VanDerWaalsContact C-N 3.26Å; I27-F29 PolarHBondContact O-N 3.07Å; I27-I30 PolarHBondContact O-N 3.35Å; I27-M31 HydrophobicContact CG2-CE 4.47Å; I27-M31 HydrophobicContact CG2-CG 4.07Å; I27-M31 WeakPolarHBondContact O-CB 3.35Å; I27-M31 VanDerWaalsContact O-CG 3.3Å; I27-M31 WeakPolarHBondContact O-CG 3.37Å; I27-M31 PolarHBondContact O-N 2.91Å |
| 28 | S | 95.7 | Very high | 95 | Very high | 72 Ų | 72 | 102.8 Ų | 102.8 | 50% | 0.503 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.3 | -39.8 | -179.4 | -61.2 | 0 | 0 | 0 | 0 | 111.3 | F24 K25 D26 N32 | F24-S28 VanDerWaalsContact O-CB 3.27Å; F24-S28 WeakPolarHBondContact O-CB 3.31Å; F24-S28 PolarHBondContact O-N 3.43Å; F24-S28 PolarHBondContact O-OG 3.37Å; K25-S28 PolarHBondContact O-N 3.31Å; D26-S28 PolarHBondContact O-N 3.45Å; S28-N32 VanDerWaalsContact O-CB 3.31Å; S28-N32 WeakPolarHBondContact O-CB 3.5Å; S28-N32 PolarHBondContact O-N 3.38Å |
| 29 | F | 96.4 | Very high | 95.4 | Very high | 146 Ų | 146 | 100.6 Ų | 100.6 | 64% | 0.64 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -63.5 | -44.8 | 175.6 | 179.5 | -97.4 | 0 | 0 | 0 | 112.3 | K25 D26 I27 N32 S33 | K25-F29 WeakPolarHBondContact O-CB 3.49Å; K25-F29 PolarHBondContact O-N 2.91Å; D26-F29 PolarHBondContact O-N 3.3Å; I27-F29 VanDerWaalsContact C-N 3.26Å; I27-F29 PolarHBondContact O-N 3.07Å; F29-N32 PolarHBondContact O-N 3.43Å; F29-S33 WeakPolarHBondContact O-CB 3.45Å; F29-S33 PolarHBondContact O-N 3.46Å; F29-S33 PolarHBondContact O-OG 3.03Å |
| 30 | I | 97 | Very high | 95.7 | Very high | 90 Ų | 90 | 97.8 Ų | 97.8 | 46% | 0.462 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62.7 | -48 | 177 | -67.9 | 164.8 | 0 | 0 | 0 | 110.5 | D26 I27 N32 S33 I34 | D26-I30 WeakPolarHBondContact O-CG1 3.36Å; D26-I30 PolarHBondContact O-N 3.28Å; I27-I30 PolarHBondContact O-N 3.35Å; I30-N32 PolarHBondContact O-N 3.36Å; I30-S33 WeakPolarHBondContact O-CB 3.34Å; I30-S33 PolarHBondContact O-N 2.89Å; I30-S33 VanDerWaalsContact O-N 3.16Å; I30-I34 HydrophobicContact CG2-CD1 3.84Å; I30-I34 HydrophobicContact CG2-CG1 4.5Å; I30-I34 WeakPolarHBondContact O-CG1 3.38Å; I30-I34 PolarHBondContact O-N 2.95Å |
| 31 | M | 97.5 | Very high | 95.9 | Very high | 93 Ų | 93 | 99.2 Ų | 99.2 | 46% | 0.458 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.1 | -44.8 | 179.4 | -68.3 | -62.4 | 150.8 | 0 | 0 | 111.2 | I27 S33 I34 F35 | I27-M31 HydrophobicContact CG2-CE 4.47Å; I27-M31 HydrophobicContact CG2-CG 4.07Å; I27-M31 WeakPolarHBondContact O-CB 3.35Å; I27-M31 VanDerWaalsContact O-CG 3.3Å; I27-M31 WeakPolarHBondContact O-CG 3.37Å; I27-M31 PolarHBondContact O-N 2.91Å; M31-S33 VanDerWaalsContact C-N 3.28Å; M31-S33 PolarHBondContact O-N 3.44Å; M31-I34 PolarHBondContact O-N 3.24Å; M31-I34 HydrophobicContact SD-CD1 4.44Å; M31-F35 HydrophobicContact CB-CD2 4.49Å; M31-F35 HydrophobicContact CB-CE2 4.44Å; M31-F35 WeakPolarHBondContact O-CD2 3.3Å; M31-F35 PolarHBondContact O-N 2.95Å |
| 32 | N | 96.7 | Very high | 96 | Very high | 109 Ų | 109 | 102.3 Ų | 102.3 | 58% | 0.583 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -60.8 | -38.2 | 176.4 | -170.2 | 52.8 | 0 | 0 | 0 | 112.4 | S28 F29 I30 F35 M36 | S28-N32 VanDerWaalsContact O-CB 3.31Å; S28-N32 WeakPolarHBondContact O-CB 3.5Å; S28-N32 PolarHBondContact O-N 3.38Å; F29-N32 PolarHBondContact O-N 3.43Å; I30-N32 PolarHBondContact O-N 3.36Å; N32-F35 PolarHBondContact O-N 2.96Å; N32-M36 WeakPolarHBondContact O-CB 3.5Å; N32-M36 PolarHBondContact O-N 2.91Å |
| 33 | S | 97.3 | Very high | 96.2 | Very high | 53 Ų | 53 | 103 Ų | 103 | 37% | 0.371 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -66.3 | -41.2 | 176.4 | -58.5 | 0 | 0 | 0 | 0 | 112.1 | F29 I30 M31 M36 F37 | F29-S33 WeakPolarHBondContact O-CB 3.45Å; F29-S33 PolarHBondContact O-N 3.46Å; F29-S33 PolarHBondContact O-OG 3.03Å; I30-S33 WeakPolarHBondContact O-CB 3.34Å; I30-S33 PolarHBondContact O-N 2.89Å; I30-S33 VanDerWaalsContact O-N 3.16Å; M31-S33 VanDerWaalsContact C-N 3.28Å; M31-S33 PolarHBondContact O-N 3.44Å; S33-M36 PolarHBondContact O-N 3.21Å; S33-F37 WeakPolarHBondContact O-CB 3.4Å; S33-F37 PolarHBondContact O-N 3.16Å |
| 34 | I | 97.6 | Very high | 96.2 | Very high | 81 Ų | 81 | 101.9 Ų | 101.9 | 42% | 0.415 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64 | -46.1 | 174.9 | -66.3 | 166 | 0 | 0 | 0 | 110.4 | I30 M31 M36 F37 I38 | I30-I34 HydrophobicContact CG2-CD1 3.84Å; I30-I34 HydrophobicContact CG2-CG1 4.5Å; I30-I34 WeakPolarHBondContact O-CG1 3.38Å; I30-I34 PolarHBondContact O-N 2.95Å; M31-I34 PolarHBondContact O-N 3.24Å; M31-I34 HydrophobicContact SD-CD1 4.44Å; I34-M36 VanDerWaalsContact C-N 3.33Å; I34-M36 PolarHBondContact O-N 2.96Å; I34-F37 PolarHBondContact O-N 3.01Å; I34-I38 HydrophobicContact CG2-CD1 3.81Å; I34-I38 HydrophobicContact CG2-CG1 4.45Å; I34-I38 WeakPolarHBondContact O-CG1 3.49Å; I34-I38 PolarHBondContact O-N 3.46Å |
| 35 | F | 98 | Very high | 96.2 | Very high | 144 Ų | 144 | 99.1 Ų | 99.1 | 63% | 0.632 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -58.7 | -44.9 | 175.9 | -81.2 | -64.9 | 0 | 0 | 0 | 111.8 | M31 N32 F37 I38 Y39 | M31-F35 HydrophobicContact CB-CD2 4.49Å; M31-F35 HydrophobicContact CB-CE2 4.44Å; M31-F35 WeakPolarHBondContact O-CD2 3.3Å; M31-F35 PolarHBondContact O-N 2.95Å; N32-F35 PolarHBondContact O-N 2.96Å; F35-F37 VanDerWaalsContact C-N 3.34Å; F35-F37 PolarHBondContact O-N 3.43Å; F35-I38 PolarHBondContact O-N 3.4Å; F35-Y39 WeakPolarHBondContact O-CB 3.07Å; F35-Y39 PolarHBondContact O-N 2.69Å |
| 36 | M | 97.6 | Very high | 96.2 | Very high | 100 Ų | 100 | 99.1 Ų | 99.1 | 49% | 0.493 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.8 | -40.9 | 177.5 | -172.4 | 62.7 | -179.3 | 0 | 0 | 112 | N32 S33 I34 Y39 L40 | N32-M36 WeakPolarHBondContact O-CB 3.5Å; N32-M36 PolarHBondContact O-N 2.91Å; S33-M36 PolarHBondContact O-N 3.21Å; I34-M36 VanDerWaalsContact C-N 3.33Å; I34-M36 PolarHBondContact O-N 2.96Å; M36-Y39 PolarHBondContact O-N 2.91Å; M36-Y39 HydrophobicContact SD-CD1 4.39Å; M36-L40 HydrophobicContact CE-CD1 4.11Å; M36-L40 HydrophobicContact CE-CD2 4.25Å; M36-L40 HydrophobicContact CE-CG 4.13Å; M36-L40 HydrophobicContact CG-CD1 4.29Å; M36-L40 WeakPolarHBondContact O-CG 3.45Å; M36-L40 PolarHBondContact O-N 3.36Å |
| 37 | F | 97.9 | Very high | 96 | Very high | 145 Ų | 145 | 99.1 Ų | 99.1 | 64% | 0.636 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -62.4 | -47.7 | 176.3 | 178.6 | -98 | 0 | 0 | 0 | 112 | S33 I34 F35 Y39 L40 H41 | S33-F37 WeakPolarHBondContact O-CB 3.4Å; S33-F37 PolarHBondContact O-N 3.16Å; I34-F37 PolarHBondContact O-N 3.01Å; F35-F37 VanDerWaalsContact C-N 3.34Å; F35-F37 PolarHBondContact O-N 3.43Å; F37-Y39 VanDerWaalsContact C-N 3.3Å; F37-Y39 PolarHBondContact O-N 3.47Å; F37-L40 PolarHBondContact O-N 3.44Å; F37-H41 WeakPolarHBondContact O-CB 3.31Å; F37-H41 PolarHBondContact O-N 2.94Å |
| 38 | I | 97.5 | Very high | 95.7 | Very high | 87 Ų | 87 | 100.6 Ų | 100.6 | 45% | 0.446 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.4 | -43.6 | 176.9 | -66.9 | 167.4 | 0 | 0 | 0 | 110.3 | I34 F35 H41 M42 | I34-I38 HydrophobicContact CG2-CD1 3.81Å; I34-I38 HydrophobicContact CG2-CG1 4.45Å; I34-I38 WeakPolarHBondContact O-CG1 3.49Å; I34-I38 PolarHBondContact O-N 3.46Å; F35-I38 PolarHBondContact O-N 3.4Å; I38-H41 WeakPolarHBondContact O-CB 3.34Å; I38-H41 PolarHBondContact O-N 2.86Å; I38-M42 HydrophobicContact CG2-CG 4.41Å; I38-M42 VanDerWaalsContact O-CG 3.31Å; I38-M42 WeakPolarHBondContact O-CG 3.49Å; I38-M42 PolarHBondContact O-N 2.86Å |
| 39 | Y | 97.2 | Very high | 95.6 | Very high | 144 Ų | 144 | 100.3 Ų | 100.3 | 57% | 0.565 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -60.3 | -48.7 | 178.6 | 178.6 | -105.1 | 0 | 0 | 0 | 112.3 | F35 M36 F37 H41 M42 I43 | F35-Y39 WeakPolarHBondContact O-CB 3.07Å; F35-Y39 PolarHBondContact O-N 2.69Å; M36-Y39 PolarHBondContact O-N 2.91Å; M36-Y39 HydrophobicContact SD-CD1 4.39Å; F37-Y39 VanDerWaalsContact C-N 3.3Å; F37-Y39 PolarHBondContact O-N 3.47Å; Y39-H41 VanDerWaalsContact C-N 3.32Å; Y39-H41 PolarHBondContact O-N 3.28Å; Y39-M42 PolarHBondContact O-N 3.35Å; Y39-I43 HydrophobicContact CD1-CD1 3.87Å; Y39-I43 HydrophobicContact CE1-CD1 3.31Å; Y39-I43 HydrophobicContact CE1-CG1 4.48Å; Y39-I43 HydrophobicContact CE2-CD1 4.11Å; Y39-I43 HydrophobicContact CG-CD1 4.48Å; Y39-I43 VanDerWaalsContact CZ-CD1 3.46Å; Y39-I43 WeakPolarHBondContact O-CG1 3.45Å; Y39-I43 PolarHBondContact O-N 2.93Å; Y39-I43 VanDerWaalsContact O-N 3.07Å |
| 40 | L | 96.3 | Very high | 95.1 | Very high | 81 Ų | 81 | 96.4 Ų | 96.4 | 42% | 0.424 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -62.4 | -40.3 | 176.2 | -73 | 171.8 | 0 | 0 | 0 | 111.9 | M36 F37 I43 N44 | M36-L40 HydrophobicContact CE-CD1 4.11Å; M36-L40 HydrophobicContact CE-CD2 4.25Å; M36-L40 HydrophobicContact CE-CG 4.13Å; M36-L40 HydrophobicContact CG-CD1 4.29Å; M36-L40 WeakPolarHBondContact O-CG 3.45Å; M36-L40 PolarHBondContact O-N 3.36Å; F37-L40 PolarHBondContact O-N 3.44Å; L40-I43 PolarHBondContact O-N 3.31Å; L40-N44 PolarHBondContact O-N 3.04Å; L40-N44 PolarHBondContact O-ND2 2.94Å |
| 41 | H | 96.3 | Very high | 94.7 | Very high | 106 Ų | 106 | 99.2 Ų | 99.2 | 49% | 0.491 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.6 | -46.3 | 176.6 | -175.5 | 70.1 | 0 | 0 | 0 | 111.6 | F37 I38 Y39 I43 N44 V45 | F37-H41 WeakPolarHBondContact O-CB 3.31Å; F37-H41 PolarHBondContact O-N 2.94Å; I38-H41 WeakPolarHBondContact O-CB 3.34Å; I38-H41 PolarHBondContact O-N 2.86Å; Y39-H41 VanDerWaalsContact C-N 3.32Å; Y39-H41 PolarHBondContact O-N 3.28Å; H41-I43 VanDerWaalsContact C-N 3.35Å; H41-I43 PolarHBondContact O-N 3Å; H41-N44 PolarHBondContact O-N 3.19Å; H41-V45 WeakPolarHBondContact O-CG2 3.15Å; H41-V45 PolarHBondContact O-N 3.33Å |
| 42 | M | 95.2 | Very high | 94.2 | Very high | 119 Ų | 119 | 99.2 Ų | 99.2 | 59% | 0.586 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -62.7 | -39.5 | 178.1 | -70.7 | -63.8 | -69.8 | 0 | 0 | 112.5 | I38 Y39 V45 Y46 | I38-M42 HydrophobicContact CG2-CG 4.41Å; I38-M42 VanDerWaalsContact O-CG 3.31Å; I38-M42 WeakPolarHBondContact O-CG 3.49Å; I38-M42 PolarHBondContact O-N 2.86Å; Y39-M42 PolarHBondContact O-N 3.35Å; M42-V45 PolarHBondContact O-N 3.49Å; M42-Y46 WeakPolarHBondContact O-CB 3.27Å; M42-Y46 PolarHBondContact O-N 3.32Å |
| 43 | I | 95.7 | Very high | 93.5 | Very high | 59 Ų | 59 | 98.1 Ų | 98.1 | 30% | 0.303 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -62.2 | -45 | 174.9 | -72 | 172.2 | 0 | 0 | 0 | 110.9 | Y39 L40 H41 Y46 I47 | Y39-I43 HydrophobicContact CD1-CD1 3.87Å; Y39-I43 HydrophobicContact CE1-CD1 3.31Å; Y39-I43 HydrophobicContact CE1-CG1 4.48Å; Y39-I43 HydrophobicContact CE2-CD1 4.11Å; Y39-I43 HydrophobicContact CG-CD1 4.48Å; Y39-I43 VanDerWaalsContact CZ-CD1 3.46Å; Y39-I43 WeakPolarHBondContact O-CG1 3.45Å; Y39-I43 PolarHBondContact O-N 2.93Å; Y39-I43 VanDerWaalsContact O-N 3.07Å; L40-I43 PolarHBondContact O-N 3.31Å; H41-I43 VanDerWaalsContact C-N 3.35Å; H41-I43 PolarHBondContact O-N 3Å; I43-Y46 WeakPolarHBondContact O-CB 3.34Å; I43-Y46 PolarHBondContact O-N 3.22Å; I43-I47 HydrophobicContact CG2-CD1 3.64Å; I43-I47 HydrophobicContact CG2-CG1 4.28Å; I43-I47 VanDerWaalsContact O-CG1 3.31Å; I43-I47 WeakPolarHBondContact O-CG1 3.24Å; I43-I47 PolarHBondContact O-N 2.91Å |
| 44 | N | 92.3 | Very high | 92.9 | Very high | 89 Ų | 89 | 102.5 Ų | 102.5 | 48% | 0.476 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63 | -45.2 | 179.4 | -70.8 | -27.1 | 0 | 0 | 0 | 111.4 | L40 H41 Y46 I47 D48 | L40-N44 PolarHBondContact O-N 3.04Å; L40-N44 PolarHBondContact O-ND2 2.94Å; H41-N44 PolarHBondContact O-N 3.19Å; N44-Y46 VanDerWaalsContact C-N 3.27Å; N44-Y46 PolarHBondContact O-N 3.47Å; N44-I47 PolarHBondContact O-N 3.22Å; N44-D48 WeakPolarHBondContact O-CB 3.44Å; N44-D48 PolarHBondContact O-N 3.32Å |
| 45 | V | 94 | Very high | 92.1 | Very high | 63 Ų | 63 | 101.2 Ų | 101.2 | 38% | 0.382 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -58.2 | -41.4 | 174.2 | 172.1 | 0 | 0 | 0 | 0 | 111.2 | H41 M42 T49 | H41-V45 WeakPolarHBondContact O-CG2 3.15Å; H41-V45 PolarHBondContact O-N 3.33Å; M42-V45 PolarHBondContact O-N 3.49Å; V45-T49 VanDerWaalsContact O-CB 3.3Å; V45-T49 WeakPolarHBondContact O-CB 3.27Å; V45-T49 PolarHBondContact O-N 2.9Å; V45-T49 PolarHBondContact O-OG1 3.39Å |
| 46 | Y | 93.4 | Very high | 91.4 | Very high | 151 Ų | 151 | 97.8 Ų | 97.8 | 59% | 0.592 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -65.6 | -43.4 | 177.2 | -179.4 | -104.2 | 0 | 0 | 0 | 112.5 | M42 I43 N44 N50 | M42-Y46 WeakPolarHBondContact O-CB 3.27Å; M42-Y46 PolarHBondContact O-N 3.32Å; I43-Y46 WeakPolarHBondContact O-CB 3.34Å; I43-Y46 PolarHBondContact O-N 3.22Å; N44-Y46 VanDerWaalsContact C-N 3.27Å; N44-Y46 PolarHBondContact O-N 3.47Å; Y46-N50 WeakPolarHBondContact CD1-ND2 3.41Å; Y46-N50 WeakPolarHBondContact CE1-ND2 3.38Å; Y46-N50 WeakPolarHBondContact O-CB 3.38Å; Y46-N50 PolarHBondContact O-N 3.41Å; Y46-N50 PolarHBondContact O-ND2 2.9Å; Y46-N50 PolarHBondContact OH-ND2 3.05Å |
| 47 | I | 91.7 | Very high | 90.5 | Very high | 91 Ų | 91 | 99.7 Ų | 99.7 | 47% | 0.467 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64 | -45.9 | 177.4 | -69.3 | 168.4 | 0 | 0 | 0 | 110.5 | I43 N44 N50 K51 | I43-I47 HydrophobicContact CG2-CD1 3.64Å; I43-I47 HydrophobicContact CG2-CG1 4.28Å; I43-I47 VanDerWaalsContact O-CG1 3.31Å; I43-I47 WeakPolarHBondContact O-CG1 3.24Å; I43-I47 PolarHBondContact O-N 2.91Å; N44-I47 PolarHBondContact O-N 3.22Å; I47-N50 PolarHBondContact O-N 2.88Å; I47-K51 WeakPolarHBondContact O-CB 3.46Å; I47-K51 PolarHBondContact O-N 2.87Å |
| 48 | D | 89.5 | Confident | 89.6 | Confident | 90 Ų | 90 | 96.7 Ų | 96.7 | 48% | 0.481 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -63.4 | -45 | 179.2 | -76.4 | -31 | 0 | 0 | 0 | 111.3 | N44 N50 K51 I52 | N44-D48 WeakPolarHBondContact O-CB 3.44Å; N44-D48 PolarHBondContact O-N 3.32Å; D48-N50 VanDerWaalsContact C-N 3.32Å; D48-N50 PolarHBondContact O-N 3.27Å; D48-K51 PolarHBondContact O-N 3.03Å; D48-I52 WeakPolarHBondContact O-CB 3.26Å; D48-I52 WeakPolarHBondContact O-CD1 3.5Å; D48-I52 VanDerWaalsContact O-CG1 3.23Å; D48-I52 WeakPolarHBondContact O-CG1 3.46Å; D48-I52 PolarHBondContact O-N 2.73Å |
| 49 | T | 91.6 | Very high | 88.8 | Confident | 66 Ų | 66 | 99 Ų | 99 | 41% | 0.405 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -60.5 | -42.4 | 176 | -56 | 0 | 0 | 0 | 0 | 111.2 | V45 I52 N53 | V45-T49 VanDerWaalsContact O-CB 3.3Å; V45-T49 WeakPolarHBondContact O-CB 3.27Å; V45-T49 PolarHBondContact O-N 2.9Å; V45-T49 PolarHBondContact O-OG1 3.39Å; T49-I52 PolarHBondContact O-N 3.34Å; T49-N53 WeakPolarHBondContact O-CB 3.35Å; T49-N53 PolarHBondContact O-N 2.96Å; T49-N53 PolarHBondContact O-ND2 3.34Å |
| 50 | N | 87.6 | Confident | 88.1 | Confident | 64 Ų | 64 | 98.9 Ų | 98.9 | 34% | 0.342 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -67.2 | -37.6 | 176.3 | -79.7 | -24 | 0 | 0 | 0 | 113.1 | Y46 I47 D48 I52 N53 K54 | Y46-N50 WeakPolarHBondContact CD1-ND2 3.41Å; Y46-N50 WeakPolarHBondContact CE1-ND2 3.38Å; Y46-N50 WeakPolarHBondContact O-CB 3.38Å; Y46-N50 PolarHBondContact O-N 3.41Å; Y46-N50 PolarHBondContact O-ND2 2.9Å; Y46-N50 PolarHBondContact OH-ND2 3.05Å; I47-N50 PolarHBondContact O-N 2.88Å; D48-N50 VanDerWaalsContact C-N 3.32Å; D48-N50 PolarHBondContact O-N 3.27Å; N50-I52 VanDerWaalsContact C-N 3.35Å; N50-N53 PolarHBondContact O-N 3.49Å; N50-K54 VanDerWaalsContact O-CB 3.28Å; N50-K54 WeakPolarHBondContact O-CB 3.34Å; N50-K54 PolarHBondContact O-N 3.47Å |
| 51 | K | 87.8 | Confident | 87.3 | Confident | 148 Ų | 148 | 102.2 Ų | 102.2 | 64% | 0.643 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -64.3 | -41.9 | 175.4 | -172.7 | 179.4 | 178.7 | -176.2 | 0 | 110.9 | I47 D48 K54 S55 | I47-K51 WeakPolarHBondContact O-CB 3.46Å; I47-K51 PolarHBondContact O-N 2.87Å; D48-K51 PolarHBondContact O-N 3.03Å; K51-K54 PolarHBondContact O-N 2.84Å; K51-S55 PolarHBondContact O-N 3.25Å; K51-S55 PolarHBondContact O-OG 3.49Å |
| 52 | I | 86.4 | Confident | 86.2 | Confident | 93 Ų | 93 | 104.9 Ų | 104.9 | 48% | 0.477 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.4 | -46.7 | 174.7 | -66.3 | 163.6 | 0 | 0 | 0 | 110.6 | D48 T49 N50 K54 S55 I56 | D48-I52 WeakPolarHBondContact O-CB 3.26Å; D48-I52 WeakPolarHBondContact O-CD1 3.5Å; D48-I52 VanDerWaalsContact O-CG1 3.23Å; D48-I52 WeakPolarHBondContact O-CG1 3.46Å; D48-I52 PolarHBondContact O-N 2.73Å; T49-I52 PolarHBondContact O-N 3.34Å; N50-I52 VanDerWaalsContact C-N 3.35Å; I52-K54 VanDerWaalsContact C-N 3.3Å; I52-K54 PolarHBondContact O-N 3.5Å; I52-S55 PolarHBondContact O-N 2.94Å; I52-S55 PolarHBondContact O-OG 3.36Å; I52-I56 HydrophobicContact CG2-CD1 3.68Å; I52-I56 HydrophobicContact CG2-CG1 4.36Å; I52-I56 VanDerWaalsContact O-CG1 3.27Å; I52-I56 WeakPolarHBondContact O-CG1 3.5Å; I52-I56 PolarHBondContact O-N 3.08Å |
| 53 | N | 83.8 | Confident | 85.2 | Confident | 86 Ų | 86 | 108.3 Ų | 108.3 | 46% | 0.46 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.3 | -40.1 | 178 | -72.5 | -20.8 | 0 | 0 | 0 | 111.8 | T49 N50 F57 | T49-N53 WeakPolarHBondContact O-CB 3.35Å; T49-N53 PolarHBondContact O-N 2.96Å; T49-N53 PolarHBondContact O-ND2 3.34Å; N50-N53 PolarHBondContact O-N 3.49Å; N53-F57 WeakPolarHBondContact O-CB 3.35Å; N53-F57 PolarHBondContact O-N 2.95Å |
| 54 | K | 83.2 | Confident | 83.7 | Confident | 146 Ų | 146 | 116.5 Ų | 116.5 | 64% | 0.635 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -65.6 | -41.9 | 175.3 | -173.1 | 176.3 | -179.7 | 179.3 | 0 | 111.8 | N50 K51 I52 F57 I58 | N50-K54 VanDerWaalsContact O-CB 3.28Å; N50-K54 WeakPolarHBondContact O-CB 3.34Å; N50-K54 PolarHBondContact O-N 3.47Å; K51-K54 PolarHBondContact O-N 2.84Å; I52-K54 VanDerWaalsContact C-N 3.3Å; I52-K54 PolarHBondContact O-N 3.5Å; K54-F57 PolarHBondContact O-N 3.41Å; K54-I58 HydrophobicContact CG-CD1 4.07Å; K54-I58 VanDerWaalsContact O-CG1 3.31Å; K54-I58 WeakPolarHBondContact O-CG1 3.27Å; K54-I58 PolarHBondContact O-N 3.47Å |
| 55 | S | 81.8 | Confident | 83.3 | Confident | 53 Ų | 53 | 117.9 Ų | 117.9 | 37% | 0.371 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -66.3 | -40.8 | 177.8 | 68.8 | 0 | 0 | 0 | 0 | 111.8 | K51 I52 F57 I58 Q59 | K51-S55 PolarHBondContact O-N 3.25Å; K51-S55 PolarHBondContact O-OG 3.49Å; I52-S55 PolarHBondContact O-N 2.94Å; I52-S55 PolarHBondContact O-OG 3.36Å; S55-F57 PolarHBondContact O-N 2.92Å; S55-I58 PolarHBondContact O-N 3.04Å; S55-Q59 WeakPolarHBondContact O-CG 3.35Å; S55-Q59 PolarHBondContact O-N 3.47Å |
| 56 | I | 81.8 | Confident | 82.7 | Confident | 72 Ų | 72 | 120.7 Ų | 120.7 | 37% | 0.369 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -62.2 | -42.4 | 174.1 | -65.9 | 166.9 | 0 | 0 | 0 | 110.9 | I52 Q59 K60 | I52-I56 HydrophobicContact CG2-CD1 3.68Å; I52-I56 HydrophobicContact CG2-CG1 4.36Å; I52-I56 VanDerWaalsContact O-CG1 3.27Å; I52-I56 WeakPolarHBondContact O-CG1 3.5Å; I52-I56 PolarHBondContact O-N 3.08Å; I56-Q59 PolarHBondContact O-N 3.16Å; I56-K60 HydrophobicContact CG2-CD 4.37Å; I56-K60 WeakPolarHBondContact O-CG 3.38Å; I56-K60 PolarHBondContact O-N 3.24Å |
| 57 | F | 80.7 | Confident | 82.1 | Confident | 141 Ų | 141 | 119.1 Ų | 119.1 | 62% | 0.618 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -63.6 | -44.8 | 178.2 | -177.6 | -98.7 | 0 | 0 | 0 | 112.4 | N53 K54 S55 Q59 K60 K61 | N53-F57 WeakPolarHBondContact O-CB 3.35Å; N53-F57 PolarHBondContact O-N 2.95Å; K54-F57 PolarHBondContact O-N 3.41Å; S55-F57 PolarHBondContact O-N 2.92Å; F57-Q59 VanDerWaalsContact C-N 3.34Å; F57-Q59 PolarHBondContact O-N 2.93Å; F57-K60 PolarHBondContact O-N 3.33Å; F57-K61 PolarHBondContact O-N 3.19Å; F57-K61 VanDerWaalsContact O-N 3.08Å |
| 58 | I | 78.5 | Confident | 81.5 | Confident | 82 Ų | 82 | 120.7 Ų | 120.7 | 42% | 0.421 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -62 | -42.9 | 176.8 | -66.5 | 166 | 0 | 0 | 0 | 110.6 | K54 S55 K60 K61 H62 | K54-I58 HydrophobicContact CG-CD1 4.07Å; K54-I58 VanDerWaalsContact O-CG1 3.31Å; K54-I58 WeakPolarHBondContact O-CG1 3.27Å; K54-I58 PolarHBondContact O-N 3.47Å; S55-I58 PolarHBondContact O-N 3.04Å; I58-K60 VanDerWaalsContact C-N 3.34Å; I58-K60 PolarHBondContact O-N 3.3Å; I58-K61 PolarHBondContact O-N 3.38Å; I58-H62 PolarHBondContact O-CD2 2.92Å; I58-H62 PolarHBondContact O-N 3.4Å |
| 59 | Q | 81.2 | Confident | 81 | Confident | 134 Ų | 134 | 122.6 Ų | 122.6 | 63% | 0.626 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -62.9 | -37 | 177 | -74.2 | -177.9 | 13.6 | 0 | 0 | 113.2 | S55 I56 F57 | S55-Q59 WeakPolarHBondContact O-CG 3.35Å; S55-Q59 PolarHBondContact O-N 3.47Å; I56-Q59 PolarHBondContact O-N 3.16Å; F57-Q59 VanDerWaalsContact C-N 3.34Å; F57-Q59 PolarHBondContact O-N 2.93Å |
| 60 | K | 81.5 | Confident | 80.3 | Confident | 143 Ų | 143 | 126.4 Ų | 126.4 | 62% | 0.622 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -67.5 | -38.7 | 176 | -74.4 | -179.5 | 179.2 | -177.1 | 0 | 111.9 | I56 F57 I58 H62 K63 | I56-K60 HydrophobicContact CG2-CD 4.37Å; I56-K60 WeakPolarHBondContact O-CG 3.38Å; I56-K60 PolarHBondContact O-N 3.24Å; F57-K60 PolarHBondContact O-N 3.33Å; I58-K60 VanDerWaalsContact C-N 3.34Å; I58-K60 PolarHBondContact O-N 3.3Å; K60-H62 VanDerWaalsContact C-N 3.31Å; K60-H62 PolarHBondContact O-N 3.37Å; K60-K63 PolarHBondContact O-N 3.32Å |
| 61 | K | 78.4 | Confident | 79.8 | Confident | 151 Ų | 151 | 130.9 Ų | 130.9 | 66% | 0.657 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -65.4 | -30.9 | 179.5 | -168.2 | 177.9 | 178.3 | -177.6 | 0 | 113.1 | F57 I58 K63 | F57-K61 PolarHBondContact O-N 3.19Å; F57-K61 VanDerWaalsContact O-N 3.08Å; I58-K61 PolarHBondContact O-N 3.38Å; K61-K63 VanDerWaalsContact C-N 3.33Å |
| 62 | H | 74.4 | Confident | 79.2 | Confident | 161 Ų | 161 | 129.5 Ų | 129.5 | 75% | 0.745 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.2 | -11.8 | 177.9 | -84.6 | -79.1 | 0 | 0 | 0 | 114.7 | I58 K60 | I58-H62 PolarHBondContact O-CD2 2.92Å; I58-H62 PolarHBondContact O-N 3.4Å; K60-H62 VanDerWaalsContact C-N 3.31Å; K60-H62 PolarHBondContact O-N 3.37Å |
| 63 | K | 73.7 | Confident | 78.6 | Confident | 192 Ų | 192 | 132.6 Ų | 132.6 | 84% | 0.835 | 62% | 0.619 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.3 | -3.4 | 179.5 | -75.2 | -172.2 | 176 | -176.1 | 0 | 114 | K60 K61 | K60-K63 PolarHBondContact O-N 3.32Å; K61-K63 VanDerWaalsContact C-N 3.33Å |
| 64 | Q | 64.1 | Low | 78.1 | Confident | 230 Ų | 230 | 136.8 Ų | 136.8 | 100% | 1.075 | 63% | 0.634 | S | S | * | * | trans | -103 | 0 | 172.6 | -70.3 | -175.6 | -35.3 | 0 | 0 | 109.4 |
Retrieved 64 of 64 residues in 305.5 ms
(Link to these results)