| 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 | 45.5 | Very low | 53.9 | Low | 239 Ų | 239 | 150.6 Ų | 150.6 | 100% | 1.177 | 81% | 0.806 | S | S | * | * | 0 | 68.9 | 0 | -166.8 | 171.5 | -172.3 | 0 | 0 | 106 | |||||
| 2 | F | 46.1 | Very low | 54.3 | Low | 185 Ų | 185 | 144.4 Ų | 144.4 | 81% | 0.811 | 78% | 0.783 | S | S | * | * | 66.5 | 91.5 | 59.4 | -98.2 | -80.1 | 0 | 0 | 0 | 114.6 | |||||
| 3 | N | 54.7 | Low | 54.9 | Low | 118 Ų | 118 | 141.8 Ų | 141.8 | 63% | 0.631 | 78% | 0.782 | S | S | * | * | trans | 81.2 | 149.4 | 140.8 | -65 | 9.1 | 0 | 0 | 0 | 122.8 | ||||
| 4 | N | 61.1 | Low | 55.9 | Low | 147 Ų | 147 | 146.1 Ų | 146.1 | 79% | 0.786 | 78% | 0.783 | S | S | * | * | trans | 95.7 | 74.1 | 172.7 | -53.8 | -6.2 | 0 | 0 | 0 | 112.4 | ||||
| 5 | E | 54.7 | Low | 56.9 | Low | 168 Ų | 168 | 142.5 Ų | 142.5 | 79% | 0.785 | 76% | 0.763 | S | S | * | * | 43 | 114.2 | 64.5 | -70.1 | -176.1 | 146.8 | 0 | 0 | 111.8 | |||||
| 6 | E | 53.7 | Low | 58.5 | Low | 175 Ų | 175 | 137.8 Ų | 137.8 | 82% | 0.818 | 74% | 0.742 | S | S | * | * | trans | 69.1 | 68 | 156.4 | -54 | -176.3 | 166.5 | 0 | 0 | 118.2 | V8 | E6-V8 VanDerWaalsContact C-N 3.32Š| ||
| 7 | M | 53.4 | Low | 60 | Low | 190 Ų | 190 | 138.8 Ų | 138.8 | 94% | 0.936 | 75% | 0.746 | S | S | * | * | trans | -95.9 | 68.7 | 145.7 | -72.2 | -171 | 176.5 | 0 | 0 | 109.4 | S9 | M7-S9 PolarHBondContact O-N 3.18Š| ||
| 8 | V | 57.6 | Low | 61.6 | Low | 131 Ų | 131 | 141.3 Ų | 141.3 | 79% | 0.794 | 74% | 0.743 | S | S | * | * | trans | -68.1 | 81.7 | 151.9 | 177.4 | 0 | 0 | 0 | 0 | 105.3 | E6 S10 | E6-V8 VanDerWaalsContact C-N 3.32Å; V8-S10 VanDerWaalsContact C-N 3.28Å; V8-S10 PolarHBondContact O-N 3.32Å | ||
| 9 | S | 53.5 | Low | 63 | Low | 98 Ų | 98 | 134.9 Ų | 134.9 | 69% | 0.685 | 71% | 0.713 | S | S | * | * | trans | -65.4 | 96.2 | 169.8 | 56.4 | 0 | 0 | 0 | 0 | 106.7 | M7 S11 | M7-S9 PolarHBondContact O-N 3.18Å; S9-S11 PolarHBondContact O-N 3.31Å | ||
| 10 | S | 56.7 | Low | 64.2 | Low | 106 Ų | 106 | 135.9 Ų | 135.9 | 74% | 0.741 | 71% | 0.707 | S | S | * | * | trans | -53.9 | 90.4 | 158.5 | 50.6 | 0 | 0 | 0 | 0 | 107.2 | V8 S12 | V8-S10 VanDerWaalsContact C-N 3.28Å; V8-S10 PolarHBondContact O-N 3.32Å; S10-S12 PolarHBondContact O-N 3.46Å | ||
| 11 | S | 56.5 | Low | 65.4 | Low | 100 Ų | 100 | 136.6 Ų | 136.6 | 70% | 0.699 | 70% | 0.701 | S | S | * | * | trans | -64 | 87.9 | 168.2 | 31.1 | 0 | 0 | 0 | 0 | 106.4 | S9 S13 | S9-S11 PolarHBondContact O-N 3.31Å; S11-S13 PolarHBondContact O-N 2.98Å | ||
| 12 | S | 58.2 | Low | 67.6 | Low | 76 Ų | 76 | 132.9 Ų | 132.9 | 53% | 0.531 | 68% | 0.675 | S | S | . | * | trans | -55 | 99.2 | 159.9 | 40.1 | 0 | 0 | 0 | 0 | 106.1 | S10 Y14 | S10-S12 PolarHBondContact O-N 3.46Å; S12-Y14 WeakPolarHBondContact O-CD2 3.43Å; S12-Y14 PolarHBondContact O-N 2.76Å; S12-Y14 WeakPolarHBondContact OG-CE2 3.34Å | ||
| 13 | S | 62.6 | Low | 69.7 | Low | 110 Ų | 110 | 128.9 Ų | 128.9 | 77% | 0.769 | 66% | 0.662 | S | S | * | * | trans | -62.1 | 88.7 | 173.4 | -60.9 | 0 | 0 | 0 | 0 | 107.4 | S11 L15 | S11-S13 PolarHBondContact O-N 2.98Å; S13-L15 PolarHBondContact O-N 3.38Å | ||
| 14 | Y | 68.9 | Low | 71.5 | Confident | 203 Ų | 203 | 130.9 Ų | 130.9 | 80% | 0.796 | 66% | 0.662 | S | S | * | * | trans | -59.8 | 102.9 | 171.9 | -75.1 | -85.6 | 0 | 0 | 0 | 107 | S12 P16 | S12-Y14 WeakPolarHBondContact O-CD2 3.43Å; S12-Y14 PolarHBondContact O-N 2.76Å; S12-Y14 WeakPolarHBondContact OG-CE2 3.34Å; Y14-P16 VanDerWaalsContact O-CD 3.26Å; Y14-P16 WeakPolarHBondContact O-CD 3.45Å; Y14-P16 VanDerWaalsContact O-N 3.14Å | ||
| 15 | L | 70.4 | Confident | 73.1 | Confident | 91 Ų | 91 | 126.7 Ų | 126.7 | 48% | 0.476 | 64% | 0.639 | S | S | . | * | trans | -59.2 | 119.1 | 172.4 | -84.4 | 160.5 | 0 | 0 | 0 | 107.1 | S13 L17 A19 W20 | S13-L15 PolarHBondContact O-N 3.38Å; L15-L17 PolarHBondContact O-N 3.42Å; L15-A19 HydrophobicContact CD2-CB 4.17Å; L15-W20 HydrophobicContact CD1-CZ2 4.22Å; L15-W20 PolarHBondContact O-NE1 3.3Å | ||
| 16 | P | 83.2 | Confident | 75 | Confident | 67 Ų | 67 | 122.2 Ų | 122.2 | 44% | 0.435 | 62% | 0.623 | S | S | . | * | trans | -55.1 | 142.8 | 178.2 | 21.2 | -34.6 | 0 | 0 | 0 | 110.4 | Y14 W18 A19 | Y14-P16 VanDerWaalsContact O-CD 3.26Å; Y14-P16 WeakPolarHBondContact O-CD 3.45Å; Y14-P16 VanDerWaalsContact O-N 3.14Å; P16-W18 HydrophobicContact CB-CG 4.32Å; P16-W18 PolarHBondContact O-N 2.92Å; P16-A19 HydrophobicContact CG-CB 4.37Å; P16-A19 VanDerWaalsContact O-CB 3.28Å; P16-A19 WeakPolarHBondContact O-CB 3.49Å; P16-A19 PolarHBondContact O-N 3.22Å | ||
| 17 | L | 83.9 | Confident | 76.9 | Confident | 155 Ų | 155 | 115.3 Ų | 115.3 | 81% | 0.812 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -51.9 | -31.9 | -174 | -72.7 | 169.8 | 0 | 0 | 0 | 113.6 | L15 A19 W20 Y21 | L15-L17 PolarHBondContact O-N 3.42Å; L17-A19 PolarHBondContact O-N 3.34Å; L17-W20 PolarHBondContact O-N 3.05Å; L17-Y21 PolarHBondContact O-N 3.02Å |
| 18 | W | 87.9 | Confident | 78.9 | Confident | 184 Ų | 184 | 109.8 Ų | 109.8 | 70% | 0.697 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -59.6 | -31.1 | 175.6 | 69.6 | -7 | 0 | 0 | 0 | 113.2 | P16 Y21 Y22 | P16-W18 HydrophobicContact CB-CG 4.32Å; P16-W18 PolarHBondContact O-N 2.92Å; W18-Y21 PolarHBondContact O-N 2.98Å; W18-Y22 VanDerWaalsContact O-CD2 3.24Å; W18-Y22 WeakPolarHBondContact O-CD2 3.3Å; W18-Y22 PolarHBondContact O-N 3.08Å |
| 19 | A | 87.8 | Confident | 80.7 | Confident | 21 Ų | 21 | 108.2 Ų | 108.2 | 17% | 0.174 | 56% | 0.558 | C | S | . | * | H | α-helix | trans | -77.3 | -36.5 | -175.2 | 0 | 0 | 0 | 0 | 0 | 109.5 | L15 P16 L17 Y22 L23 | L15-A19 HydrophobicContact CD2-CB 4.17Å; P16-A19 HydrophobicContact CG-CB 4.37Å; P16-A19 VanDerWaalsContact O-CB 3.28Å; P16-A19 WeakPolarHBondContact O-CB 3.49Å; P16-A19 PolarHBondContact O-N 3.22Å; L17-A19 PolarHBondContact O-N 3.34Å; A19-Y22 PolarHBondContact O-N 3.49Å; A19-L23 WeakPolarHBondContact O-CB 2.95Å; A19-L23 WeakPolarHBondContact O-CG 3.46Å; A19-L23 PolarHBondContact O-N 3.43Å |
| 20 | W | 87.4 | Confident | 82.6 | Confident | 153 Ų | 153 | 109.6 Ų | 109.6 | 58% | 0.58 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -61.6 | -43.7 | 169.6 | -71.6 | 103.2 | 0 | 0 | 0 | 111.9 | L15 L17 L23 Y24 | L15-W20 HydrophobicContact CD1-CZ2 4.22Å; L15-W20 PolarHBondContact O-NE1 3.3Å; L17-W20 PolarHBondContact O-N 3.05Å; W20-L23 PolarHBondContact O-N 3.04Å; W20-Y24 WeakPolarHBondContact O-CB 3.47Å; W20-Y24 PolarHBondContact O-N 3.02Å |
| 21 | Y | 90.6 | Very high | 84.4 | Confident | 152 Ų | 152 | 109.9 Ų | 109.9 | 60% | 0.596 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -63.4 | -44.5 | 176.2 | -175.7 | -106 | 0 | 0 | 0 | 112.2 | L17 W18 Y24 I25 | L17-Y21 PolarHBondContact O-N 3.02Å; W18-Y21 PolarHBondContact O-N 2.98Å; Y21-Y24 PolarHBondContact O-N 2.93Å; Y21-I25 HydrophobicContact CD1-CD1 3.71Å; Y21-I25 HydrophobicContact CE1-CD1 3.19Å; Y21-I25 HydrophobicContact CE1-CG1 4.34Å; Y21-I25 HydrophobicContact CE2-CD1 4.13Å; Y21-I25 HydrophobicContact CG-CD1 4.38Å; Y21-I25 VanDerWaalsContact CZ-CD1 3.43Å; Y21-I25 WeakPolarHBondContact O-CG1 3.41Å; Y21-I25 PolarHBondContact O-N 3.41Å |
| 22 | Y | 91.3 | Very high | 86.2 | Confident | 160 Ų | 160 | 108.4 Ų | 108.4 | 63% | 0.627 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -61.8 | -44.1 | 174.1 | -91.7 | -75.3 | 0 | 0 | 0 | 112.7 | W18 A19 Y24 I25 T26 | W18-Y22 VanDerWaalsContact O-CD2 3.24Å; W18-Y22 WeakPolarHBondContact O-CD2 3.3Å; W18-Y22 PolarHBondContact O-N 3.08Å; A19-Y22 PolarHBondContact O-N 3.49Å; Y22-Y24 VanDerWaalsContact C-N 3.3Å; Y22-Y24 PolarHBondContact O-N 3.34Å; Y22-I25 PolarHBondContact O-N 3.49Å; Y22-T26 WeakPolarHBondContact O-CB 3.42Å; Y22-T26 VanDerWaalsContact O-CG2 3.3Å; Y22-T26 WeakPolarHBondContact O-CG2 3.27Å; Y22-T26 PolarHBondContact O-N 2.92Å; Y22-T26 PolarHBondContact O-OG1 3.49Å |
| 23 | L | 90.4 | Very high | 88 | Confident | 101 Ų | 101 | 107.7 Ų | 107.7 | 53% | 0.529 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -61.5 | -39.8 | 176.2 | -78.4 | 171.8 | 0 | 0 | 0 | 111.8 | A19 W20 T26 G27 | A19-L23 WeakPolarHBondContact O-CB 2.95Å; A19-L23 WeakPolarHBondContact O-CG 3.46Å; A19-L23 PolarHBondContact O-N 3.43Å; W20-L23 PolarHBondContact O-N 3.04Å; L23-T26 VanDerWaalsContact CA-OG1 3.32Å; L23-T26 WeakPolarHBondContact CA-OG1 3.37Å; L23-T26 PolarHBondContact O-OG1 2.78Å; L23-G27 PolarHBondContact O-N 3.2Å |
| 24 | Y | 92.2 | Very high | 89.5 | Confident | 161 Ų | 161 | 105.9 Ų | 105.9 | 63% | 0.631 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -64.4 | -48.2 | 177.4 | -176.8 | -104 | 0 | 0 | 0 | 112.2 | W20 Y21 Y22 G27 I28 | W20-Y24 WeakPolarHBondContact O-CB 3.47Å; W20-Y24 PolarHBondContact O-N 3.02Å; Y21-Y24 PolarHBondContact O-N 2.93Å; Y22-Y24 VanDerWaalsContact C-N 3.3Å; Y22-Y24 PolarHBondContact O-N 3.34Å; Y24-G27 PolarHBondContact O-N 2.96Å; Y24-I28 HydrophobicContact CD1-CD1 3.8Å; Y24-I28 HydrophobicContact CE1-CD1 3.28Å; Y24-I28 HydrophobicContact CE1-CG1 4.43Å; Y24-I28 HydrophobicContact CE2-CD1 4.27Å; Y24-I28 HydrophobicContact CG-CD1 4.48Å; Y24-I28 WeakPolarHBondContact O-CG1 3.41Å; Y24-I28 PolarHBondContact O-N 3.43Å |
| 25 | I | 94.3 | Very high | 90.6 | Very high | 58 Ų | 58 | 100.4 Ų | 100.4 | 30% | 0.297 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.4 | -47.8 | 177.9 | -69.3 | 172.7 | 0 | 0 | 0 | 111.1 | Y21 Y22 G27 I28 I29 | Y21-I25 HydrophobicContact CD1-CD1 3.71Å; Y21-I25 HydrophobicContact CE1-CD1 3.19Å; Y21-I25 HydrophobicContact CE1-CG1 4.34Å; Y21-I25 HydrophobicContact CE2-CD1 4.13Å; Y21-I25 HydrophobicContact CG-CD1 4.38Å; Y21-I25 VanDerWaalsContact CZ-CD1 3.43Å; Y21-I25 WeakPolarHBondContact O-CG1 3.41Å; Y21-I25 PolarHBondContact O-N 3.41Å; Y22-I25 PolarHBondContact O-N 3.49Å; I25-G27 VanDerWaalsContact C-N 3.28Å; I25-G27 PolarHBondContact O-N 3.43Å; I25-I28 PolarHBondContact O-N 3.47Å; I25-I29 HydrophobicContact CG2-CD1 3.68Å; I25-I29 HydrophobicContact CG2-CG1 4.31Å; I25-I29 WeakPolarHBondContact O-CG1 3.49Å; I25-I29 PolarHBondContact O-N 3.37Å |
| 26 | T | 93.8 | Very high | 91.7 | Very high | 74 Ų | 74 | 101.1 Ų | 101.1 | 45% | 0.454 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.5 | -37.6 | -179.9 | 50.2 | 0 | 0 | 0 | 0 | 111.5 | Y22 L23 I29 F30 | Y22-T26 WeakPolarHBondContact O-CB 3.42Å; Y22-T26 VanDerWaalsContact O-CG2 3.3Å; Y22-T26 WeakPolarHBondContact O-CG2 3.27Å; Y22-T26 PolarHBondContact O-N 2.92Å; Y22-T26 PolarHBondContact O-OG1 3.49Å; L23-T26 VanDerWaalsContact CA-OG1 3.32Å; L23-T26 WeakPolarHBondContact CA-OG1 3.37Å; L23-T26 PolarHBondContact O-OG1 2.78Å; T26-I29 PolarHBondContact O-N 2.99Å; T26-F30 WeakPolarHBondContact O-CB 3.33Å; T26-F30 PolarHBondContact O-N 3.3Å |
| 27 | G | 93.9 | Very high | 92.2 | Very high | 31 Ų | 31 | 103 Ų | 103 | 32% | 0.32 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60.7 | -45.1 | 172.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | L23 Y24 I25 F30 L31 | L23-G27 PolarHBondContact O-N 3.2Å; Y24-G27 PolarHBondContact O-N 2.96Å; I25-G27 VanDerWaalsContact C-N 3.28Å; I25-G27 PolarHBondContact O-N 3.43Å; G27-F30 PolarHBondContact O-N 3.19Å; G27-L31 WeakPolarHBondContact O-CG 3.43Å; G27-L31 PolarHBondContact O-N 2.99Å |
| 28 | I | 94.9 | Very high | 92.5 | Very high | 74 Ų | 74 | 99.1 Ų | 99.1 | 38% | 0.379 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.5 | -47.7 | 176.1 | -69.7 | 169.6 | 0 | 0 | 0 | 110.9 | Y24 I25 F30 L31 C32 | Y24-I28 HydrophobicContact CD1-CD1 3.8Å; Y24-I28 HydrophobicContact CE1-CD1 3.28Å; Y24-I28 HydrophobicContact CE1-CG1 4.43Å; Y24-I28 HydrophobicContact CE2-CD1 4.27Å; Y24-I28 HydrophobicContact CG-CD1 4.48Å; Y24-I28 WeakPolarHBondContact O-CG1 3.41Å; Y24-I28 PolarHBondContact O-N 3.43Å; I25-I28 PolarHBondContact O-N 3.47Å; I28-F30 VanDerWaalsContact C-N 3.28Å; I28-F30 PolarHBondContact O-N 3.07Å; I28-L31 PolarHBondContact O-N 3.35Å; I28-C32 PolarHBondContact O-N 3.37Å; I28-C32 PolarHBondContact O-SG 2.98Å; I28-C32 VanDerWaalsContact O-SG 3.39Å |
| 29 | I | 95.4 | Very high | 92.6 | Very high | 97 Ų | 97 | 98.5 Ų | 98.5 | 50% | 0.497 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -58.7 | -44.8 | 178.7 | -67.3 | 169.5 | 0 | 0 | 0 | 109.9 | I25 T26 L31 C32 T33 | I25-I29 HydrophobicContact CG2-CD1 3.68Å; I25-I29 HydrophobicContact CG2-CG1 4.31Å; I25-I29 WeakPolarHBondContact O-CG1 3.49Å; I25-I29 PolarHBondContact O-N 3.37Å; T26-I29 PolarHBondContact O-N 2.99Å; I29-L31 PolarHBondContact O-N 3.4Å; I29-C32 WeakPolarHBondContact O-CB 3.44Å; I29-C32 PolarHBondContact O-N 3.46Å; I29-T33 HydrophobicContact CG2-CG2 4.44Å; I29-T33 WeakPolarHBondContact O-CG2 3.47Å; I29-T33 PolarHBondContact O-N 2.99Å; I29-T33 PolarHBondContact O-OG1 3.26Å |
| 30 | F | 94.6 | Very high | 92.7 | Very high | 128 Ų | 128 | 101.1 Ų | 101.1 | 56% | 0.561 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -59.7 | -48.2 | 177.7 | -175.3 | -104.4 | 0 | 0 | 0 | 111.9 | T26 G27 I28 C32 T33 L34 | T26-F30 WeakPolarHBondContact O-CB 3.33Å; T26-F30 PolarHBondContact O-N 3.3Å; G27-F30 PolarHBondContact O-N 3.19Å; I28-F30 VanDerWaalsContact C-N 3.28Å; I28-F30 PolarHBondContact O-N 3.07Å; F30-C32 VanDerWaalsContact C-N 3.34Å; F30-C32 PolarHBondContact O-N 2.88Å; F30-T33 WeakPolarHBondContact CA-OG1 3.37Å; F30-T33 PolarHBondContact O-N 3.39Å; F30-T33 PolarHBondContact O-OG1 3.16Å; F30-L34 HydrophobicContact CD1-CD1 3.89Å; F30-L34 HydrophobicContact CD1-CG 4.4Å; F30-L34 HydrophobicContact CE1-CD1 3.42Å; F30-L34 VanDerWaalsContact CE1-CD1 3.42Å; F30-L34 HydrophobicContact CE1-CG 4.09Å; F30-L34 HydrophobicContact CZ-CD1 3.92Å; F30-L34 HydrophobicContact CZ-CD2 4.32Å; F30-L34 HydrophobicContact CZ-CG 4.22Å; F30-L34 WeakPolarHBondContact O-CG 3.37Å; F30-L34 PolarHBondContact O-N 3.37Å |
| 31 | L | 94 | Very high | 92.8 | Very high | 112 Ų | 112 | 99.5 Ų | 99.5 | 59% | 0.586 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -59.4 | -42.7 | 175.3 | -71.2 | 171.8 | 0 | 0 | 0 | 112.2 | G27 I28 I29 T33 L34 C35 | G27-L31 WeakPolarHBondContact O-CG 3.43Å; G27-L31 PolarHBondContact O-N 2.99Å; I28-L31 PolarHBondContact O-N 3.35Å; I29-L31 PolarHBondContact O-N 3.4Å; L31-T33 PolarHBondContact O-N 3.15Å; L31-L34 PolarHBondContact O-N 2.97Å; L31-C35 PolarHBondContact O-N 2.96Å; L31-C35 PolarHBondContact O-SG 2.93Å; L31-C35 VanDerWaalsContact O-SG 3.38Å |
| 32 | C | 95.1 | Very high | 92.6 | Very high | 69 Ų | 69 | 99.7 Ų | 99.7 | 47% | 0.466 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.6 | -43.8 | 175 | -72.7 | 0 | 0 | 0 | 0 | 112 | I28 I29 F30 L34 C35 I36 | I28-C32 PolarHBondContact O-N 3.37Å; I28-C32 PolarHBondContact O-SG 2.98Å; I28-C32 VanDerWaalsContact O-SG 3.39Å; I29-C32 WeakPolarHBondContact O-CB 3.44Å; I29-C32 PolarHBondContact O-N 3.46Å; F30-C32 VanDerWaalsContact C-N 3.34Å; F30-C32 PolarHBondContact O-N 2.88Å; C32-L34 PolarHBondContact O-N 3.39Å; C32-C35 WeakPolarHBondContact O-CB 3.45Å; C32-C35 PolarHBondContact O-N 3.33Å; C32-I36 WeakPolarHBondContact O-CG1 3.49Å; C32-I36 PolarHBondContact O-N 3.25Å |
| 33 | T | 94.5 | Very high | 92.4 | Very high | 61 Ų | 61 | 98.2 Ų | 98.2 | 37% | 0.374 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.3 | -40.9 | 177.4 | 59.5 | 0 | 0 | 0 | 0 | 112.2 | I29 F30 L31 C35 I36 L37 | I29-T33 HydrophobicContact CG2-CG2 4.44Å; I29-T33 WeakPolarHBondContact O-CG2 3.47Å; I29-T33 PolarHBondContact O-N 2.99Å; I29-T33 PolarHBondContact O-OG1 3.26Å; F30-T33 WeakPolarHBondContact CA-OG1 3.37Å; F30-T33 PolarHBondContact O-N 3.39Å; F30-T33 PolarHBondContact O-OG1 3.16Å; L31-T33 PolarHBondContact O-N 3.15Å; T33-C35 VanDerWaalsContact C-N 3.34Å; T33-C35 PolarHBondContact O-N 2.92Å; T33-I36 PolarHBondContact O-N 3.37Å; T33-L37 WeakPolarHBondContact O-CG 3.47Å; T33-L37 PolarHBondContact O-N 3.5Å |
| 34 | L | 94.1 | Very high | 92.2 | Very high | 72 Ų | 72 | 97.6 Ų | 97.6 | 38% | 0.377 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.3 | -40.6 | 175.2 | -70.9 | -179.6 | 0 | 0 | 0 | 112 | F30 L31 C32 L37 C38 | F30-L34 HydrophobicContact CD1-CD1 3.89Å; F30-L34 HydrophobicContact CD1-CG 4.4Å; F30-L34 HydrophobicContact CE1-CD1 3.42Å; F30-L34 VanDerWaalsContact CE1-CD1 3.42Å; F30-L34 HydrophobicContact CE1-CG 4.09Å; F30-L34 HydrophobicContact CZ-CD1 3.92Å; F30-L34 HydrophobicContact CZ-CD2 4.32Å; F30-L34 HydrophobicContact CZ-CG 4.22Å; F30-L34 WeakPolarHBondContact O-CG 3.37Å; F30-L34 PolarHBondContact O-N 3.37Å; L31-L34 PolarHBondContact O-N 2.97Å; C32-L34 PolarHBondContact O-N 3.39Å; L34-L37 PolarHBondContact O-N 3.38Å; L34-C38 WeakPolarHBondContact O-CB 3.35Å; L34-C38 PolarHBondContact O-N 3.4Å; L34-C38 PolarHBondContact O-SG 3.02Å |
| 35 | C | 93.7 | Very high | 91.9 | Very high | 88 Ų | 88 | 92.6 Ų | 92.6 | 60% | 0.595 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -62 | -43.7 | 175.6 | -73.6 | 0 | 0 | 0 | 0 | 112.3 | L31 C32 T33 C38 Y39 | L31-C35 PolarHBondContact O-N 2.96Å; L31-C35 PolarHBondContact O-SG 2.93Å; L31-C35 VanDerWaalsContact O-SG 3.38Å; C32-C35 WeakPolarHBondContact O-CB 3.45Å; C32-C35 PolarHBondContact O-N 3.33Å; T33-C35 VanDerWaalsContact C-N 3.34Å; T33-C35 PolarHBondContact O-N 2.92Å; C35-C38 PolarHBondContact O-N 3.14Å; C35-Y39 PolarHBondContact O-N 3.43Å |
| 36 | I | 93.4 | Very high | 91.5 | Very high | 106 Ų | 106 | 95.9 Ų | 95.9 | 54% | 0.544 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.1 | -44.7 | 177.4 | -65.4 | 164.9 | 0 | 0 | 0 | 110.5 | C32 T33 C38 Y39 L40 | C32-I36 WeakPolarHBondContact O-CG1 3.49Å; C32-I36 PolarHBondContact O-N 3.25Å; T33-I36 PolarHBondContact O-N 3.37Å; I36-C38 PolarHBondContact O-N 3.34Å; I36-Y39 WeakPolarHBondContact O-CB 3.48Å; I36-Y39 PolarHBondContact O-N 2.92Å; I36-L40 HydrophobicContact CG2-CD1 4.21Å; I36-L40 WeakPolarHBondContact O-CG 3.49Å; I36-L40 PolarHBondContact O-N 3.39Å |
| 37 | L | 92.6 | Very high | 91.1 | Very high | 106 Ų | 106 | 96.8 Ų | 96.8 | 56% | 0.555 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -61.1 | -42.6 | 176.5 | -72.2 | 172.5 | 0 | 0 | 0 | 111.9 | T33 L34 Y39 L40 Q41 | T33-L37 WeakPolarHBondContact O-CG 3.47Å; T33-L37 PolarHBondContact O-N 3.5Å; L34-L37 PolarHBondContact O-N 3.38Å; L37-Y39 VanDerWaalsContact C-N 3.3Å; L37-Y39 PolarHBondContact O-N 3.45Å; L37-L40 PolarHBondContact O-N 3.19Å; L37-Q41 WeakPolarHBondContact O-CB 3.46Å; L37-Q41 PolarHBondContact O-N 3.16Å |
| 38 | C | 91.5 | Very high | 90.6 | Very high | 74 Ų | 74 | 99.7 Ų | 99.7 | 50% | 0.5 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.5 | -40.4 | 174.7 | -72.4 | 0 | 0 | 0 | 0 | 112.1 | L34 C35 I36 Q41 K42 | L34-C38 WeakPolarHBondContact O-CB 3.35Å; L34-C38 PolarHBondContact O-N 3.4Å; L34-C38 PolarHBondContact O-SG 3.02Å; C35-C38 PolarHBondContact O-N 3.14Å; I36-C38 PolarHBondContact O-N 3.34Å; C38-Q41 PolarHBondContact O-N 2.94Å; C38-K42 WeakPolarHBondContact O-CG 3.48Å; C38-K42 PolarHBondContact O-N 3Å |
| 39 | Y | 90.2 | Very high | 90 | Very high | 170 Ų | 170 | 100.4 Ų | 100.4 | 67% | 0.667 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -66.1 | -45.1 | 177.5 | -173.2 | -97.1 | 0 | 0 | 0 | 111.9 | C35 I36 L37 Q41 K42 W43 | C35-Y39 PolarHBondContact O-N 3.43Å; I36-Y39 WeakPolarHBondContact O-CB 3.48Å; I36-Y39 PolarHBondContact O-N 2.92Å; L37-Y39 VanDerWaalsContact C-N 3.3Å; L37-Y39 PolarHBondContact O-N 3.45Å; Y39-Q41 VanDerWaalsContact C-N 3.34Å; Y39-Q41 PolarHBondContact O-N 3.47Å; Y39-K42 PolarHBondContact O-N 3.25Å; Y39-W43 WeakPolarHBondContact O-CB 3.37Å; Y39-W43 PolarHBondContact O-N 3.02Å |
| 40 | L | 89.8 | Confident | 89.2 | Confident | 77 Ų | 77 | 99.7 Ų | 99.7 | 40% | 0.403 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.8 | -42.1 | 175.3 | -72.4 | 172.5 | 0 | 0 | 0 | 111.8 | I36 L37 W43 L44 | I36-L40 HydrophobicContact CG2-CD1 4.21Å; I36-L40 WeakPolarHBondContact O-CG 3.49Å; I36-L40 PolarHBondContact O-N 3.39Å; L37-L40 PolarHBondContact O-N 3.19Å; L40-W43 HydrophobicContact CD2-CE3 4.49Å; L40-W43 WeakPolarHBondContact O-CB 3.44Å; L40-W43 PolarHBondContact O-N 2.95Å; L40-L44 WeakPolarHBondContact O-CG 3.34Å; L40-L44 PolarHBondContact O-N 3.28Å |
| 41 | Q | 89.1 | Confident | 88.5 | Confident | 118 Ų | 118 | 102.9 Ų | 102.9 | 55% | 0.551 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62.5 | -44.9 | 176.9 | -172.9 | 66.4 | 4.1 | 0 | 0 | 111.6 | L37 C38 Y39 W43 L44 C45 | L37-Q41 WeakPolarHBondContact O-CB 3.46Å; L37-Q41 PolarHBondContact O-N 3.16Å; C38-Q41 PolarHBondContact O-N 2.94Å; Y39-Q41 VanDerWaalsContact C-N 3.34Å; Y39-Q41 PolarHBondContact O-N 3.47Å; Q41-W43 VanDerWaalsContact C-N 3.3Å; Q41-W43 PolarHBondContact O-N 3.45Å; Q41-L44 PolarHBondContact O-N 3.41Å; Q41-C45 WeakPolarHBondContact O-CB 3.48Å; Q41-C45 PolarHBondContact O-N 3.43Å; Q41-C45 PolarHBondContact O-SG 3.22Å |
| 42 | K | 86.3 | Confident | 87.7 | Confident | 157 Ų | 157 | 104.6 Ų | 104.6 | 68% | 0.683 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -60.8 | -40.4 | 174.5 | -74.8 | -179.7 | 179.2 | -177.5 | 0 | 111.7 | C38 Y39 C45 F46 | C38-K42 WeakPolarHBondContact O-CG 3.48Å; C38-K42 PolarHBondContact O-N 3Å; Y39-K42 PolarHBondContact O-N 3.25Å; K42-C45 PolarHBondContact O-N 2.92Å; K42-F46 WeakPolarHBondContact O-CB 3.4Å; K42-F46 PolarHBondContact O-N 3.39Å |
| 43 | W | 86.7 | Confident | 86.9 | Confident | 129 Ų | 129 | 107.6 Ų | 107.6 | 49% | 0.489 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.2 | -42 | 177.7 | -171.3 | 56.6 | 0 | 0 | 0 | 112.7 | Y39 L40 Q41 F46 K47 | Y39-W43 WeakPolarHBondContact O-CB 3.37Å; Y39-W43 PolarHBondContact O-N 3.02Å; L40-W43 HydrophobicContact CD2-CE3 4.49Å; L40-W43 WeakPolarHBondContact O-CB 3.44Å; L40-W43 PolarHBondContact O-N 2.95Å; Q41-W43 VanDerWaalsContact C-N 3.3Å; Q41-W43 PolarHBondContact O-N 3.45Å; W43-F46 PolarHBondContact O-N 3.05Å; W43-K47 VanDerWaalsContact CE2-CE 3.48Å; W43-K47 PolarHBondContact O-N 3.41Å |
| 44 | L | 86.8 | Confident | 86.3 | Confident | 87 Ų | 87 | 112.9 Ų | 112.9 | 46% | 0.455 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -63 | -46.2 | 173.5 | -72.1 | 170.1 | 0 | 0 | 0 | 111.5 | L40 Q41 F46 K47 I48 | L40-L44 WeakPolarHBondContact O-CG 3.34Å; L40-L44 PolarHBondContact O-N 3.28Å; Q41-L44 PolarHBondContact O-N 3.41Å; L44-F46 VanDerWaalsContact C-N 3.33Å; L44-F46 PolarHBondContact O-N 3.02Å; L44-K47 PolarHBondContact O-N 3.29Å; L44-I48 WeakPolarHBondContact O-CG1 3.33Å; L44-I48 PolarHBondContact O-N 3.34Å |
| 45 | C | 85.7 | Confident | 85.4 | Confident | 57 Ų | 57 | 113.2 Ų | 113.2 | 39% | 0.385 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -58.1 | -44.2 | 175 | -76.1 | 0 | 0 | 0 | 0 | 111.9 | Q41 K42 K47 I48 I49 | Q41-C45 WeakPolarHBondContact O-CB 3.48Å; Q41-C45 PolarHBondContact O-N 3.43Å; Q41-C45 PolarHBondContact O-SG 3.22Å; K42-C45 PolarHBondContact O-N 2.92Å; C45-K47 PolarHBondContact O-N 3.45Å; C45-I48 PolarHBondContact O-N 2.89Å; C45-I48 VanDerWaalsContact O-N 3.16Å; C45-I49 WeakPolarHBondContact O-CG1 3.48Å; C45-I49 PolarHBondContact O-N 2.92Å |
| 46 | F | 86.5 | Confident | 84.8 | Confident | 126 Ų | 126 | 114 Ų | 114 | 55% | 0.553 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -62 | -43.2 | 178 | -169.1 | -106.7 | 0 | 0 | 0 | 111.9 | K42 W43 L44 I48 I49 I50 | K42-F46 WeakPolarHBondContact O-CB 3.4Å; K42-F46 PolarHBondContact O-N 3.39Å; W43-F46 PolarHBondContact O-N 3.05Å; L44-F46 VanDerWaalsContact C-N 3.33Å; L44-F46 PolarHBondContact O-N 3.02Å; F46-I48 VanDerWaalsContact C-N 3.3Å; F46-I48 PolarHBondContact O-N 3.39Å; F46-I49 PolarHBondContact O-N 3.47Å; F46-I50 HydrophobicContact CD1-CD1 3.67Å; F46-I50 HydrophobicContact CD1-CG1 4.49Å; F46-I50 HydrophobicContact CE1-CD1 3.25Å; F46-I50 HydrophobicContact CE1-CG1 4.25Å; F46-I50 HydrophobicContact CG-CD1 4.5Å; F46-I50 HydrophobicContact CZ-CD1 3.75Å; F46-I50 HydrophobicContact CZ-CG1 4.41Å; F46-I50 PolarHBondContact O-N 3.33Å |
| 47 | K | 84.3 | Confident | 84.2 | Confident | 93 Ų | 93 | 115.2 Ų | 115.2 | 40% | 0.404 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -59.8 | -38.7 | 173.6 | -78.2 | -177.9 | 172.2 | 177.9 | 0 | 112.6 | W43 L44 C45 R51 | W43-K47 VanDerWaalsContact CE2-CE 3.48Å; W43-K47 PolarHBondContact O-N 3.41Å; L44-K47 PolarHBondContact O-N 3.29Å; C45-K47 PolarHBondContact O-N 3.45Å; K47-R51 WeakPolarHBondContact O-CG 3.48Å; K47-R51 PolarHBondContact O-N 3.4Å; K47-R51 VanDerWaalsContact O-N 3.14Å |
| 48 | I | 83.6 | Confident | 83.4 | Confident | 92 Ų | 92 | 112.6 Ų | 112.6 | 47% | 0.472 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -68.3 | -42.8 | 177.7 | -66.8 | 164.6 | 0 | 0 | 0 | 110.9 | L44 C45 F46 R51 K52 | L44-I48 WeakPolarHBondContact O-CG1 3.33Å; L44-I48 PolarHBondContact O-N 3.34Å; C45-I48 PolarHBondContact O-N 2.89Å; C45-I48 VanDerWaalsContact O-N 3.16Å; F46-I48 VanDerWaalsContact C-N 3.3Å; F46-I48 PolarHBondContact O-N 3.39Å; I48-R51 PolarHBondContact O-N 2.93Å; I48-K52 HydrophobicContact CG2-CD 4.35Å; I48-K52 HydrophobicContact CG2-CG 4.49Å; I48-K52 WeakPolarHBondContact O-CG 3.49Å; I48-K52 PolarHBondContact O-N 2.91Å |
| 49 | I | 82 | Confident | 82.7 | Confident | 89 Ų | 89 | 111.3 Ų | 111.3 | 46% | 0.456 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62.3 | -46.2 | 179.2 | -67.3 | 165.3 | 0 | 0 | 0 | 110.7 | C45 F46 R51 K52 Q53 | C45-I49 WeakPolarHBondContact O-CG1 3.48Å; C45-I49 PolarHBondContact O-N 2.92Å; F46-I49 PolarHBondContact O-N 3.47Å; I49-R51 PolarHBondContact O-N 3.38Å; I49-K52 PolarHBondContact O-N 3.2Å; I49-Q53 PolarHBondContact O-N 3.3Å |
| 50 | I | 79.4 | Confident | 82.1 | Confident | 83 Ų | 83 | 107.3 Ų | 107.3 | 43% | 0.426 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.6 | -45.6 | 177.3 | -69.1 | 174.2 | 0 | 0 | 0 | 110.8 | F46 K52 Q53 W54 | F46-I50 HydrophobicContact CD1-CD1 3.67Å; F46-I50 HydrophobicContact CD1-CG1 4.49Å; F46-I50 HydrophobicContact CE1-CD1 3.25Å; F46-I50 HydrophobicContact CE1-CG1 4.25Å; F46-I50 HydrophobicContact CG-CD1 4.5Å; F46-I50 HydrophobicContact CZ-CD1 3.75Å; F46-I50 HydrophobicContact CZ-CG1 4.41Å; F46-I50 PolarHBondContact O-N 3.33Å; I50-K52 VanDerWaalsContact C-N 3.31Å; I50-K52 PolarHBondContact O-N 3.48Å; I50-Q53 PolarHBondContact O-N 2.94Å; I50-W54 PolarHBondContact O-N 3.19Å |
| 51 | R | 78.8 | Confident | 81.5 | Confident | 194 Ų | 194 | 107.3 Ų | 107.3 | 73% | 0.732 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -60.2 | -41.1 | 176.6 | -78.9 | -174.8 | 175.7 | 165.9 | -1.8 | 112.1 | K47 I48 I49 W54 C55 | K47-R51 WeakPolarHBondContact O-CG 3.48Å; K47-R51 PolarHBondContact O-N 3.4Å; K47-R51 VanDerWaalsContact O-N 3.14Å; I48-R51 PolarHBondContact O-N 2.93Å; I49-R51 PolarHBondContact O-N 3.38Å; R51-W54 PolarHBondContact O-N 3.02Å; R51-C55 PolarHBondContact O-N 2.98Å; R51-C55 PolarHBondContact O-SG 2.98Å; R51-C55 VanDerWaalsContact O-SG 3.37Å |
| 52 | K | 78.6 | Confident | 80.9 | Confident | 149 Ų | 149 | 108.2 Ų | 108.2 | 65% | 0.648 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -62.7 | -43.7 | 175.9 | -77.3 | -175.7 | 176.6 | -173.6 | 0 | 112.2 | I48 I49 I50 W54 C55 N56 | I48-K52 HydrophobicContact CG2-CD 4.35Å; I48-K52 HydrophobicContact CG2-CG 4.49Å; I48-K52 WeakPolarHBondContact O-CG 3.49Å; I48-K52 PolarHBondContact O-N 2.91Å; I49-K52 PolarHBondContact O-N 3.2Å; I50-K52 VanDerWaalsContact C-N 3.31Å; I50-K52 PolarHBondContact O-N 3.48Å; K52-W54 VanDerWaalsContact C-N 3.33Å; K52-W54 PolarHBondContact O-N 3.45Å; K52-C55 PolarHBondContact O-N 2.95Å; K52-N56 WeakPolarHBondContact O-CB 3.36Å; K52-N56 PolarHBondContact O-N 3.25Å |
| 53 | Q | 77.6 | Confident | 80.6 | Confident | 132 Ų | 132 | 105.4 Ų | 105.4 | 62% | 0.617 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -63.3 | -40.3 | 176.5 | -73.5 | -176.5 | -15.6 | 0 | 0 | 111.9 | I49 I50 N56 K57 | I49-Q53 PolarHBondContact O-N 3.3Å; I50-Q53 PolarHBondContact O-N 2.94Å; Q53-N56 PolarHBondContact O-N 3.5Å; Q53-K57 PolarHBondContact O-N 3.38Å |
| 54 | W | 80.8 | Confident | 80.3 | Confident | 171 Ų | 171 | 102.9 Ų | 102.9 | 65% | 0.648 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -65.5 | -44.3 | 177.6 | -164.4 | 71.1 | 0 | 0 | 0 | 112.2 | I50 R51 K52 N56 K57 N58 | I50-W54 PolarHBondContact O-N 3.19Å; R51-W54 PolarHBondContact O-N 3.02Å; K52-W54 VanDerWaalsContact C-N 3.33Å; K52-W54 PolarHBondContact O-N 3.45Å; W54-N56 VanDerWaalsContact C-N 3.35Å; W54-N56 PolarHBondContact O-N 3.17Å; W54-K57 PolarHBondContact O-N 3.02Å; W54-N58 WeakPolarHBondContact CH2-ND2 3.32Å; W54-N58 WeakPolarHBondContact CZ2-ND2 3.33Å; W54-N58 WeakPolarHBondContact CZ3-ND2 3.39Å; W54-N58 VanDerWaalsContact O-CG 3.3Å; W54-N58 PolarHBondContact O-N 3.27Å; W54-N58 PolarHBondContact O-OD1 3.47Å |
| 55 | C | 75.8 | Confident | 79.9 | Confident | 79 Ų | 79 | 102.5 Ų | 102.5 | 53% | 0.534 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.4 | -40.8 | 174.1 | -67.8 | 0 | 0 | 0 | 0 | 112.4 | R51 K52 K57 N58 A59 | R51-C55 PolarHBondContact O-N 2.98Å; R51-C55 PolarHBondContact O-SG 2.98Å; R51-C55 VanDerWaalsContact O-SG 3.37Å; K52-C55 PolarHBondContact O-N 2.95Å; C55-K57 VanDerWaalsContact C-N 3.35Å; C55-N58 PolarHBondContact O-N 3.49Å; C55-A59 PolarHBondContact O-N 3.32Å |
| 56 | N | 81.8 | Confident | 79.5 | Confident | 104 Ų | 104 | 105.1 Ų | 105.1 | 56% | 0.556 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -64.3 | -41.3 | 178.7 | -165.1 | 32.2 | 0 | 0 | 0 | 111.4 | K52 Q53 W54 A59 I60 | K52-N56 WeakPolarHBondContact O-CB 3.36Å; K52-N56 PolarHBondContact O-N 3.25Å; Q53-N56 PolarHBondContact O-N 3.5Å; W54-N56 VanDerWaalsContact C-N 3.35Å; W54-N56 PolarHBondContact O-N 3.17Å; N56-A59 PolarHBondContact O-N 3.4Å; N56-I60 WeakPolarHBondContact O-CD1 3.3Å; N56-I60 VanDerWaalsContact O-CG1 3.27Å; N56-I60 WeakPolarHBondContact O-CG1 3.39Å; N56-I60 PolarHBondContact O-N 2.68Å; N56-I60 VanDerWaalsContact O-N 3.15Å |
| 57 | K | 80.4 | Confident | 79.2 | Confident | 133 Ų | 133 | 104 Ų | 104 | 58% | 0.578 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -62.8 | -45.8 | 175.6 | -170.6 | 175.7 | 179.4 | -179.3 | 0 | 111.8 | Q53 W54 C55 A59 I60 D61 | Q53-K57 PolarHBondContact O-N 3.38Å; W54-K57 PolarHBondContact O-N 3.02Å; C55-K57 VanDerWaalsContact C-N 3.35Å; K57-A59 VanDerWaalsContact C-N 3.31Å; K57-A59 PolarHBondContact O-N 2.91Å; K57-I60 PolarHBondContact O-N 2.89Å; K57-D61 PolarHBondContact O-N 3.01Å |
| 58 | N | 75.8 | Confident | 78.9 | Confident | 51 Ų | 51 | 104.9 Ų | 104.9 | 27% | 0.273 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.4 | -34.7 | 179.3 | -67.8 | -1.1 | 0 | 0 | 0 | 112.7 | W54 C55 M62 | W54-N58 WeakPolarHBondContact CH2-ND2 3.32Å; W54-N58 WeakPolarHBondContact CZ2-ND2 3.33Å; W54-N58 WeakPolarHBondContact CZ3-ND2 3.39Å; W54-N58 VanDerWaalsContact O-CG 3.3Å; W54-N58 PolarHBondContact O-N 3.27Å; W54-N58 PolarHBondContact O-OD1 3.47Å; C55-N58 PolarHBondContact O-N 3.49Å; N58-M62 WeakPolarHBondContact O-CG 3.35Å; N58-M62 PolarHBondContact O-N 3.46Å |
| 59 | A | 76.1 | Confident | 78.5 | Confident | 46 Ų | 46 | 108 Ų | 108 | 38% | 0.38 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -64.8 | -46.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | C55 N56 K57 D61 M62 D63 | C55-A59 PolarHBondContact O-N 3.32Å; N56-A59 PolarHBondContact O-N 3.4Å; K57-A59 VanDerWaalsContact C-N 3.31Å; K57-A59 PolarHBondContact O-N 2.91Å; A59-D61 VanDerWaalsContact C-N 3.33Å; A59-D61 PolarHBondContact O-N 3.38Å; A59-M62 PolarHBondContact O-N 3.43Å; A59-D63 PolarHBondContact O-N 3.38Å |
| 60 | I | 77.8 | Confident | 78.4 | Confident | 87 Ų | 87 | 107.8 Ų | 107.8 | 45% | 0.446 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -62.2 | -40.9 | 177.2 | -63.9 | 163 | 0 | 0 | 0 | 111.2 | N56 K57 M62 D63 T64 | N56-I60 WeakPolarHBondContact O-CD1 3.3Å; N56-I60 VanDerWaalsContact O-CG1 3.27Å; N56-I60 WeakPolarHBondContact O-CG1 3.39Å; N56-I60 PolarHBondContact O-N 2.68Å; N56-I60 VanDerWaalsContact O-N 3.15Å; K57-I60 PolarHBondContact O-N 2.89Å; I60-M62 VanDerWaalsContact C-N 3.34Å; I60-M62 PolarHBondContact O-N 3.24Å; I60-D63 PolarHBondContact O-N 2.85Å; I60-T64 WeakPolarHBondContact O-CB 3.41Å; I60-T64 PolarHBondContact O-N 2.9Å; I60-T64 PolarHBondContact O-OG1 3.05Å |
| 61 | D | 78.5 | Confident | 78.3 | Confident | 76 Ų | 76 | 108.2 Ų | 108.2 | 41% | 0.406 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -64.4 | -38.1 | 177 | -71.4 | -21.1 | 0 | 0 | 0 | 111.4 | K57 A59 N65 | K57-D61 PolarHBondContact O-N 3.01Å; A59-D61 VanDerWaalsContact C-N 3.33Å; A59-D61 PolarHBondContact O-N 3.38Å; D61-N65 VanDerWaalsContact O-CG 3.31Å; D61-N65 PolarHBondContact O-N 2.78Å; D61-N65 VanDerWaalsContact O-N 3.16Å; D61-N65 PolarHBondContact O-ND2 3.37Å |
| 62 | M | 75.9 | Confident | 78.2 | Confident | 137 Ų | 137 | 102.9 Ų | 102.9 | 68% | 0.675 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -66.6 | -43.7 | 174.2 | -72 | -162.3 | -155.6 | 0 | 0 | 112.6 | N58 A59 I60 T64 N65 L66 | N58-M62 WeakPolarHBondContact O-CG 3.35Å; N58-M62 PolarHBondContact O-N 3.46Å; A59-M62 PolarHBondContact O-N 3.43Å; I60-M62 VanDerWaalsContact C-N 3.34Å; I60-M62 PolarHBondContact O-N 3.24Å; M62-T64 VanDerWaalsContact C-N 3.33Å; M62-T64 PolarHBondContact O-N 3.18Å; M62-N65 PolarHBondContact O-N 2.93Å; M62-L66 PolarHBondContact O-N 3.41Å |
| 63 | D | 79.4 | Confident | 77.8 | Confident | 98 Ų | 98 | 100.5 Ų | 100.5 | 52% | 0.524 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.3 | -40.5 | 178.8 | -71.7 | -22.8 | 0 | 0 | 0 | 111.5 | A59 I60 L66 I67 | A59-D63 PolarHBondContact O-N 3.38Å; I60-D63 PolarHBondContact O-N 2.85Å; D63-L66 PolarHBondContact O-N 3.04Å; D63-I67 VanDerWaalsContact O-CG1 3.3Å; D63-I67 WeakPolarHBondContact O-CG1 3.26Å; D63-I67 PolarHBondContact O-N 2.94Å |
| 64 | T | 81.6 | Confident | 77.6 | Confident | 76 Ų | 76 | 99.6 Ų | 99.6 | 47% | 0.466 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.7 | -46 | 178.2 | -53.5 | 0 | 0 | 0 | 0 | 111.3 | I60 M62 L66 I67 E68 | I60-T64 WeakPolarHBondContact O-CB 3.41Å; I60-T64 PolarHBondContact O-N 2.9Å; I60-T64 PolarHBondContact O-OG1 3.05Å; M62-T64 VanDerWaalsContact C-N 3.33Å; M62-T64 PolarHBondContact O-N 3.18Å; T64-L66 VanDerWaalsContact C-N 3.32Å; T64-L66 PolarHBondContact O-N 3.36Å; T64-I67 PolarHBondContact O-N 3.39Å; T64-E68 PolarHBondContact O-N 2.78Å |
| 65 | N | 77.2 | Confident | 76.8 | Confident | 80 Ų | 80 | 96.6 Ų | 96.6 | 43% | 0.428 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.4 | -44.5 | 175.6 | -74 | -43.9 | 0 | 0 | 0 | 111 | D61 M62 I67 E68 Y69 | D61-N65 VanDerWaalsContact O-CG 3.31Å; D61-N65 PolarHBondContact O-N 2.78Å; D61-N65 VanDerWaalsContact O-N 3.16Å; D61-N65 PolarHBondContact O-ND2 3.37Å; M62-N65 PolarHBondContact O-N 2.93Å; N65-I67 VanDerWaalsContact C-N 3.34Å; N65-I67 PolarHBondContact O-N 2.88Å; N65-E68 PolarHBondContact O-N 2.83Å; N65-Y69 HydrophobicContact CB-CD2 4.43Å; N65-Y69 HydrophobicContact CB-CE2 4.2Å; N65-Y69 WeakPolarHBondContact O-CD2 3.28Å; N65-Y69 PolarHBondContact O-N 3.4Å |
| 66 | L | 78.5 | Confident | 76.3 | Confident | 111 Ų | 111 | 99.3 Ų | 99.3 | 58% | 0.581 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.1 | -39.8 | 179.9 | -167.3 | 71.9 | 0 | 0 | 0 | 112.5 | M62 D63 T64 Y69 T70 | M62-L66 PolarHBondContact O-N 3.41Å; D63-L66 PolarHBondContact O-N 3.04Å; T64-L66 VanDerWaalsContact C-N 3.32Å; T64-L66 PolarHBondContact O-N 3.36Å; L66-Y69 PolarHBondContact O-N 2.93Å; L66-T70 WeakPolarHBondContact O-CB 3.41Å; L66-T70 PolarHBondContact O-N 2.89Å; L66-T70 PolarHBondContact O-OG1 2.95Å |
| 67 | I | 80.1 | Confident | 75.3 | Confident | 103 Ų | 103 | 102.1 Ų | 102.1 | 53% | 0.528 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -64.6 | -42.9 | 175.4 | -66.7 | 163.8 | 0 | 0 | 0 | 110.5 | D63 T64 N65 T70 N71 | D63-I67 VanDerWaalsContact O-CG1 3.3Å; D63-I67 WeakPolarHBondContact O-CG1 3.26Å; D63-I67 PolarHBondContact O-N 2.94Å; T64-I67 PolarHBondContact O-N 3.39Å; N65-I67 VanDerWaalsContact C-N 3.34Å; N65-I67 PolarHBondContact O-N 2.88Å; I67-T70 PolarHBondContact O-N 3.32Å; I67-N71 PolarHBondContact O-N 3.32Å |
| 68 | E | 76.6 | Confident | 73.8 | Confident | 112 Ų | 112 | 105.4 Ų | 105.4 | 52% | 0.523 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -63.2 | -43.5 | 177.6 | -168 | 174.2 | -179.8 | 0 | 0 | 111.9 | T64 N65 T70 N71 N72 | T64-E68 PolarHBondContact O-N 2.78Å; N65-E68 PolarHBondContact O-N 2.83Å; E68-T70 VanDerWaalsContact C-N 3.32Å; E68-T70 PolarHBondContact O-N 3.42Å; E68-N71 PolarHBondContact O-N 3.43Å; E68-N72 WeakPolarHBondContact O-CB 3.45Å; E68-N72 PolarHBondContact O-N 2.92Å; E68-N72 PolarHBondContact O-ND2 3.34Å |
| 69 | Y | 75.9 | Confident | 73.8 | Confident | 158 Ų | 158 | 108.2 Ų | 108.2 | 62% | 0.62 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -60.6 | -40.1 | 172.8 | -75.4 | -66.7 | 0 | 0 | 0 | 112.4 | N65 L66 N73 | N65-Y69 HydrophobicContact CB-CD2 4.43Å; N65-Y69 HydrophobicContact CB-CE2 4.2Å; N65-Y69 WeakPolarHBondContact O-CD2 3.28Å; N65-Y69 PolarHBondContact O-N 3.4Å; L66-Y69 PolarHBondContact O-N 2.93Å; Y69-N73 WeakPolarHBondContact O-CB 3.46Å; Y69-N73 PolarHBondContact O-N 3.03Å |
| 70 | T | 79.4 | Confident | 73.6 | Confident | 84 Ų | 84 | 111.4 Ų | 111.4 | 52% | 0.515 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -68.4 | -43.3 | -179.8 | -55 | 0 | 0 | 0 | 0 | 111.5 | L66 I67 E68 N73 H74 | L66-T70 WeakPolarHBondContact O-CB 3.41Å; L66-T70 PolarHBondContact O-N 2.89Å; L66-T70 PolarHBondContact O-OG1 2.95Å; I67-T70 PolarHBondContact O-N 3.32Å; E68-T70 VanDerWaalsContact C-N 3.32Å; E68-T70 PolarHBondContact O-N 3.42Å; T70-N73 PolarHBondContact O-N 2.99Å; T70-H74 WeakPolarHBondContact O-CB 3.24Å; T70-H74 PolarHBondContact O-N 2.82Å |
| 71 | N | 77.2 | Confident | 73.4 | Confident | 91 Ų | 91 | 112.8 Ų | 112.8 | 49% | 0.487 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -65.7 | -40.9 | 177 | -77.1 | -22.8 | 0 | 0 | 0 | 112.2 | I67 E68 N73 H74 N75 | I67-N71 PolarHBondContact O-N 3.32Å; E68-N71 PolarHBondContact O-N 3.43Å; N71-N73 PolarHBondContact O-N 3.26Å; N71-H74 PolarHBondContact O-N 3.18Å; N71-N75 PolarHBondContact O-N 2.92Å; N71-N75 VanDerWaalsContact O-N 3.08Å |
| 72 | N | 77 | Confident | 73.1 | Confident | 83 Ų | 83 | 114.9 Ų | 114.9 | 44% | 0.444 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -63.1 | -41.5 | 175.9 | -75.5 | -23.2 | 0 | 0 | 0 | 111.7 | E68 I76 | E68-N72 WeakPolarHBondContact O-CB 3.45Å; E68-N72 PolarHBondContact O-N 2.92Å; E68-N72 PolarHBondContact O-ND2 3.34Å; N72-I76 WeakPolarHBondContact O-CD1 3.13Å; N72-I76 WeakPolarHBondContact O-CG1 3.38Å; N72-I76 PolarHBondContact O-N 2.82Å |
| 73 | N | 70.8 | Confident | 72.9 | Confident | 98 Ų | 98 | 113.6 Ų | 113.6 | 52% | 0.524 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -69.8 | -35.4 | 176.4 | -75.4 | -15.9 | 0 | 0 | 0 | 112.9 | Y69 T70 N71 I76 | Y69-N73 WeakPolarHBondContact O-CB 3.46Å; Y69-N73 PolarHBondContact O-N 3.03Å; T70-N73 PolarHBondContact O-N 2.99Å; N71-N73 PolarHBondContact O-N 3.26Å; N73-I76 PolarHBondContact O-N 2.75Å |
| 74 | H | 72.1 | Confident | 72.5 | Confident | 114 Ų | 114 | 114.6 Ų | 114.6 | 53% | 0.528 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -65.9 | -39.8 | 177.2 | -167.4 | 8.8 | 0 | 0 | 0 | 112 | T70 N71 I76 M77 | T70-H74 WeakPolarHBondContact O-CB 3.24Å; T70-H74 PolarHBondContact O-N 2.82Å; N71-H74 PolarHBondContact O-N 3.18Å; H74-I76 PolarHBondContact O-N 3.49Å; H74-M77 PolarHBondContact O-N 3.5Å |
| 75 | N | 65.2 | Low | 71.8 | Confident | 108 Ų | 108 | 117.4 Ų | 117.4 | 58% | 0.578 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -65.4 | -21.5 | 176.5 | -79.4 | -14 | 0 | 0 | 0 | 113.9 | N71 | N71-N75 PolarHBondContact O-N 2.92Å; N71-N75 VanDerWaalsContact O-N 3.08Å |
| 76 | I | 65.9 | Low | 71.4 | Confident | 135 Ų | 135 | 120.2 Ų | 120.2 | 69% | 0.692 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -82.2 | -18.3 | 177.4 | -64.5 | 164.3 | 0 | 0 | 0 | 111.7 | N72 N73 H74 | N72-I76 WeakPolarHBondContact O-CD1 3.13Å; N72-I76 WeakPolarHBondContact O-CG1 3.38Å; N72-I76 PolarHBondContact O-N 2.82Å; N73-I76 PolarHBondContact O-N 2.75Å; H74-I76 PolarHBondContact O-N 3.49Å |
| 77 | M | 59.8 | Low | 70.8 | Confident | 164 Ų | 164 | 121 Ų | 121 | 81% | 0.808 | 60% | 0.599 | S | S | * | * | trans | -96.5 | -2.6 | -179.6 | -64.3 | -167.1 | -168.5 | 0 | 0 | 114.5 | H74 | H74-M77 PolarHBondContact O-N 3.5Š| ||
| 78 | Q | 50 | Low | 70 | Confident | 202 Ų | 202 | 122.6 Ų | 122.6 | 94% | 0.944 | 61% | 0.606 | S | S | * | * | trans | -95.6 | 0 | 170.5 | -71.6 | -167.5 | -32.7 | 0 | 0 | 110.6 |
Retrieved 78 of 78 residues in 24 ms
(Link to these results)