| 1 | M | 77.8 | Confident | 91.7 | Very high | 214 Ų | 214 | 112.5 Ų | 112.5 | 100% | 1.054 | 62% | 0.616 | S | S | * | * | | | | 0 | -49 | 0 | -79.6 | 170.1 | 156.1 | 0 | 0 | 112.7 | G3 A4 L5 | M1-G3 PolarHBondContact O-N 3.08Å; M1-G3 VanDerWaalsContact C-N 3.27Å; M1-A4 PolarHBondContact O-N 2.96Å; M1-L5 PolarHBondContact O-N 3.35Å |
| 2 | L | 90.8 | Very high | 91.7 | Very high | 137 Ų | 137 | 106.4 Ų | 106.4 | 72% | 0.717 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -51.8 | -42.3 | 179.4 | -174.9 | 62.4 | 0 | 0 | 0 | 113.6 | A4 L5 V6 | L2-A4 VanDerWaalsContact C-N 3.32Å; L2-A4 PolarHBondContact O-N 3.18Å; L2-L5 WeakPolarHBondContact O-CB 3.29Å; L2-L5 PolarHBondContact O-N 3.34Å; L2-V6 WeakPolarHBondContact O-CG2 3.47Å; L2-V6 PolarHBondContact O-N 2.65Å |
| 3 | G | 91.1 | Very high | 91.6 | Very high | 43 Ų | 43 | 108.8 Ų | 108.8 | 44% | 0.443 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -58.4 | -39.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | M1 V6 W7 | M1-G3 PolarHBondContact O-N 3.08Å; M1-G3 VanDerWaalsContact C-N 3.27Å; G3-V6 PolarHBondContact O-N 2.78Å; G3-W7 PolarHBondContact O-N 3.24Å |
| 4 | A | 91.4 | Very high | 91.2 | Very high | 69 Ų | 69 | 109.1 Ų | 109.1 | 57% | 0.57 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -68.6 | -38 | 178 | 0 | 0 | 0 | 0 | 0 | 111.9 | M1 L2 W7 M8 | M1-A4 PolarHBondContact O-N 2.96Å; L2-A4 VanDerWaalsContact C-N 3.32Å; L2-A4 PolarHBondContact O-N 3.18Å; A4-W7 PolarHBondContact O-N 2.73Å; A4-M8 WeakPolarHBondContact O-CB 3.47Å; A4-M8 PolarHBondContact O-N 3.03Å |
| 5 | L | 94.6 | Very high | 90.7 | Very high | 110 Ų | 110 | 111.9 Ų | 111.9 | 58% | 0.576 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -62 | -44.5 | 173.8 | -113.2 | 76.4 | 0 | 0 | 0 | 111.3 | M1 L2 W7 M8 L9 | M1-L5 PolarHBondContact O-N 3.35Å; L2-L5 WeakPolarHBondContact O-CB 3.29Å; L2-L5 PolarHBondContact O-N 3.34Å; L5-W7 PolarHBondContact O-N 2.94Å; L5-M8 PolarHBondContact O-N 3.4Å; L5-L9 PolarHBondContact O-N 2.92Å |
| 6 | V | 95.1 | Very high | 90.3 | Very high | 77 Ų | 77 | 109.8 Ų | 109.8 | 47% | 0.467 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -60.4 | -46.5 | 177 | 172.9 | 0 | 0 | 0 | 0 | 110.6 | L2 G3 M8 L9 V10 | L2-V6 WeakPolarHBondContact O-CG2 3.47Å; L2-V6 PolarHBondContact O-N 2.65Å; G3-V6 PolarHBondContact O-N 2.78Å; V6-M8 VanDerWaalsContact C-N 3.32Å; V6-M8 PolarHBondContact O-N 3.27Å; V6-L9 PolarHBondContact O-N 2.82Å; V6-V10 WeakPolarHBondContact O-CG2 3.07Å; V6-V10 PolarHBondContact O-N 3.16Å |
| 7 | W | 94.6 | Very high | 89.8 | Confident | 194 Ų | 194 | 108.4 Ų | 108.4 | 74% | 0.735 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -61.1 | -39.1 | 177.2 | -83.7 | 113.2 | 0 | 0 | 0 | 113.1 | G3 A4 L5 V10 A11 | G3-W7 PolarHBondContact O-N 3.24Å; A4-W7 PolarHBondContact O-N 2.73Å; L5-W7 PolarHBondContact O-N 2.94Å; W7-V10 PolarHBondContact O-N 2.89Å; W7-A11 WeakPolarHBondContact O-CB 3.28Å; W7-A11 PolarHBondContact O-N 3.34Å |
| 8 | M | 95.1 | Very high | 88.6 | Confident | 151 Ų | 151 | 107.2 Ų | 107.2 | 74% | 0.744 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -66.5 | -40.4 | 178 | -173.8 | 168.5 | 145.4 | 0 | 0 | 112.3 | A4 L5 V6 G12 | A4-M8 WeakPolarHBondContact O-CB 3.47Å; A4-M8 PolarHBondContact O-N 3.03Å; L5-M8 PolarHBondContact O-N 3.4Å; V6-M8 VanDerWaalsContact C-N 3.32Å; V6-M8 PolarHBondContact O-N 3.27Å; M8-G12 PolarHBondContact O-N 3.15Å |
| 9 | L | 94.6 | Very high | 87.4 | Confident | 131 Ų | 131 | 107.2 Ų | 107.2 | 69% | 0.686 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -62.8 | -45.4 | 173.1 | -91.2 | 140.1 | 0 | 0 | 0 | 112 | L5 V6 G12 F13 | L5-L9 PolarHBondContact O-N 2.92Å; V6-L9 PolarHBondContact O-N 2.82Å; L9-G12 PolarHBondContact O-N 3.41Å; L9-F13 WeakPolarHBondContact O-CB 3.35Å; L9-F13 PolarHBondContact O-N 3.4Å |
| 10 | V | 92.9 | Very high | 85.9 | Confident | 63 Ų | 63 | 106.2 Ų | 106.2 | 38% | 0.382 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -62.5 | -45 | 177.6 | 172.5 | 0 | 0 | 0 | 0 | 111.1 | V6 W7 F13 L14 | V6-V10 WeakPolarHBondContact O-CG2 3.07Å; V6-V10 PolarHBondContact O-N 3.16Å; W7-V10 PolarHBondContact O-N 2.89Å; V10-F13 PolarHBondContact O-N 3.02Å; V10-L14 HydrophobicContact CG1-CG 4.36Å; V10-L14 PolarHBondContact O-N 2.91Å; V10-L14 WeakPolarHBondContact O-CG 3.31Å; V10-L14 VanDerWaalsContact O-CG 3.31Å; V10-L14 WeakPolarHBondContact O-CB 3.32Å; V10-L14 HydrophobicContact CG1-CD1 3.94Å |
| 11 | A | 91 | Very high | 84.5 | Confident | 48 Ų | 48 | 112.6 Ų | 112.6 | 40% | 0.397 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -63.1 | -44.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112 | W7 F13 L14 L15 | W7-A11 WeakPolarHBondContact O-CB 3.28Å; W7-A11 PolarHBondContact O-N 3.34Å; A11-F13 VanDerWaalsContact C-N 3.34Å; A11-F13 PolarHBondContact O-N 3.31Å; A11-L14 PolarHBondContact O-N 3.48Å; A11-L15 PolarHBondContact O-N 2.94Å; A11-L15 WeakPolarHBondContact O-CG 3.31Å; A11-L15 WeakPolarHBondContact O-CB 3.48Å; A11-L15 VanDerWaalsContact O-CG 3.31Å |
| 12 | G | 91.8 | Very high | 83.5 | Confident | 40 Ų | 40 | 105.8 Ų | 105.8 | 41% | 0.412 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -61.8 | -40.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | M8 L9 L15 A16 | M8-G12 PolarHBondContact O-N 3.15Å; L9-G12 PolarHBondContact O-N 3.41Å; G12-L15 PolarHBondContact O-N 3.41Å; G12-A16 VanDerWaalsContact O-CB 3.31Å; G12-A16 WeakPolarHBondContact O-CB 3.47Å; G12-A16 PolarHBondContact O-N 3.43Å |
| 13 | F | 89.5 | Confident | 81.8 | Confident | 137 Ų | 137 | 103 Ų | 103 | 60% | 0.601 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -63.9 | -47.8 | 176.1 | -175.3 | -105.5 | 0 | 0 | 0 | 112 | L9 V10 A11 L15 A16 L17 | L9-F13 WeakPolarHBondContact O-CB 3.35Å; L9-F13 PolarHBondContact O-N 3.4Å; V10-F13 PolarHBondContact O-N 3.02Å; A11-F13 VanDerWaalsContact C-N 3.34Å; A11-F13 PolarHBondContact O-N 3.31Å; F13-L15 VanDerWaalsContact C-N 3.27Å; F13-L15 PolarHBondContact O-N 3.31Å; F13-A16 PolarHBondContact O-N 3.05Å; F13-A16 VanDerWaalsContact O-N 3.15Å; F13-L17 HydrophobicContact CE1-CD1 3.4Å; F13-L17 PolarHBondContact O-N 3Å; F13-L17 WeakPolarHBondContact O-CD1 3.31Å; F13-L17 HydrophobicContact CZ-CD1 3.51Å; F13-L17 HydrophobicContact CG-CD1 3.97Å; F13-L17 HydrophobicContact CE2-CD1 3.83Å; F13-L17 VanDerWaalsContact CE1-CD1 3.4Å; F13-L17 HydrophobicContact CD2-CD1 4.05Å; F13-L17 HydrophobicContact CD1-CD1 3.64Å |
| 14 | L | 86.9 | Confident | 80.1 | Confident | 114 Ų | 114 | 103.9 Ų | 103.9 | 60% | 0.597 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -60.7 | -35.7 | 177.1 | -72.4 | 172.7 | 0 | 0 | 0 | 112.8 | V10 A11 | V10-L14 HydrophobicContact CG1-CG 4.36Å; V10-L14 PolarHBondContact O-N 2.91Å; V10-L14 WeakPolarHBondContact O-CG 3.31Å; V10-L14 VanDerWaalsContact O-CG 3.31Å; V10-L14 WeakPolarHBondContact O-CB 3.32Å; V10-L14 HydrophobicContact CG1-CD1 3.94Å; A11-L14 PolarHBondContact O-N 3.48Å |
| 15 | L | 83.1 | Confident | 78.5 | Confident | 150 Ų | 150 | 103.9 Ų | 103.9 | 79% | 0.785 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -74.8 | -32.6 | 175.6 | -72 | 171.2 | 0 | 0 | 0 | 113 | A11 G12 F13 L17 | A11-L15 PolarHBondContact O-N 2.94Å; A11-L15 WeakPolarHBondContact O-CG 3.31Å; A11-L15 WeakPolarHBondContact O-CB 3.48Å; A11-L15 VanDerWaalsContact O-CG 3.31Å; G12-L15 PolarHBondContact O-N 3.41Å; F13-L15 VanDerWaalsContact C-N 3.27Å; F13-L15 PolarHBondContact O-N 3.31Å; L15-L17 VanDerWaalsContact C-N 3.33Å |
| 16 | A | 84.8 | Confident | 76.6 | Confident | 78 Ų | 78 | 103.9 Ų | 103.9 | 65% | 0.645 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -75.4 | -23.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | G12 F13 P18 | G12-A16 VanDerWaalsContact O-CB 3.31Å; G12-A16 WeakPolarHBondContact O-CB 3.47Å; G12-A16 PolarHBondContact O-N 3.43Å; F13-A16 PolarHBondContact O-N 3.05Å; F13-A16 VanDerWaalsContact O-N 3.15Å; A16-P18 VanDerWaalsContact O-CD 3.28Å; A16-P18 WeakPolarHBondContact O-CD 3.38Å |
| 17 | L | 80.9 | Confident | 74.9 | Confident | 86 Ų | 86 | 109.9 Ų | 109.9 | 45% | 0.45 | 63% | 0.626 | S | S | . | * | S | Bend | trans | -64.7 | 118 | 169.9 | -96.7 | 75.8 | 0 | 0 | 0 | 108.6 | F13 L15 | F13-L17 HydrophobicContact CE1-CD1 3.4Å; F13-L17 PolarHBondContact O-N 3Å; F13-L17 WeakPolarHBondContact O-CD1 3.31Å; F13-L17 HydrophobicContact CZ-CD1 3.51Å; F13-L17 HydrophobicContact CG-CD1 3.97Å; F13-L17 HydrophobicContact CE2-CD1 3.83Å; F13-L17 VanDerWaalsContact CE1-CD1 3.4Å; F13-L17 HydrophobicContact CD2-CD1 4.05Å; F13-L17 HydrophobicContact CD1-CD1 3.64Å; L15-L17 VanDerWaalsContact C-N 3.33Å |
| 18 | P | 68.9 | Low | 72.9 | Confident | 88 Ų | 88 | 105.4 Ų | 105.4 | 57% | 0.571 | 63% | 0.631 | S | S | * | * | | | trans | -58 | 150.9 | 175.4 | 22 | -30.6 | 0 | 0 | 0 | 109.7 | A16 S20 | A16-P18 VanDerWaalsContact O-CD 3.28Å; A16-P18 WeakPolarHBondContact O-CD 3.38Å; P18-S20 PolarHBondContact O-N 3.02Å; P18-S20 PolarHBondContact O-OG 3.41Å |
| 19 | P | 64.9 | Low | 71.2 | Confident | 106 Ų | 106 | 101.6 Ų | 101.6 | 69% | 0.688 | 63% | 0.629 | S | S | * | * | G | 310 helix | trans | -69.2 | 24.8 | 179.9 | 30.9 | -37 | 0 | 0 | 0 | 113 | W21 A22 A23 | P19-W21 PolarHBondContact O-N 3.01Å; P19-A22 HydrophobicContact CB-CB 4.38Å; P19-A22 WeakPolarHBondContact O-CA 3.45Å; P19-A22 WeakPolarHBondContact O-CB 3.45Å; P19-A22 PolarHBondContact O-N 3.37Å; P19-A23 PolarHBondContact O-N 3.21Å |
| 20 | S | 58.5 | Low | 69.6 | Low | 88 Ų | 88 | 105 Ų | 105 | 62% | 0.615 | 63% | 0.633 | S | S | * | * | G | 310 helix | trans | -54.7 | -21.9 | 175.7 | 45.8 | 0 | 0 | 0 | 0 | 112.6 | P18 | P18-S20 PolarHBondContact O-N 3.02Å; P18-S20 PolarHBondContact O-OG 3.41Å |
| 21 | W | 57 | Low | 68 | Low | 240 Ų | 240 | 113.5 Ų | 113.5 | 91% | 0.909 | 66% | 0.658 | S | S | * | * | G | 310 helix | trans | -76.8 | -30.1 | 171.5 | -133.4 | 89.3 | 0 | 0 | 0 | 113.8 | P19 A23 G24 | P19-W21 PolarHBondContact O-N 3.01Å; W21-A23 VanDerWaalsContact C-N 3.35Å; W21-G24 PolarHBondContact O-N 3.33Å |
| 22 | A | 56 | Low | 66.5 | Low | 72 Ų | 72 | 116.5 Ų | 116.5 | 60% | 0.595 | 67% | 0.674 | S | S | * | * | G | 310 helix | trans | -79.2 | -17.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | P19 G24 A25 | P19-A22 HydrophobicContact CB-CB 4.38Å; P19-A22 WeakPolarHBondContact O-CA 3.45Å; P19-A22 WeakPolarHBondContact O-CB 3.45Å; P19-A22 PolarHBondContact O-N 3.37Å; A22-G24 PolarHBondContact O-N 3Å; A22-A25 PolarHBondContact O-N 3.18Å |
| 23 | A | 56.1 | Low | 64.9 | Low | 77 Ų | 77 | 119.9 Ų | 119.9 | 64% | 0.636 | 70% | 0.698 | S | S | * | * | G | 310 helix | trans | -74.2 | -4.1 | 170.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | P19 W21 | P19-A23 PolarHBondContact O-N 3.21Å; W21-A23 VanDerWaalsContact C-N 3.35Å |
| 24 | G | 54.7 | Low | 63.3 | Low | 63 Ų | 63 | 124.3 Ų | 124.3 | 65% | 0.649 | 71% | 0.711 | S | S | * | * | G | 310 helix | trans | -83.1 | -6 | 169.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | W21 A22 P26 | W21-G24 PolarHBondContact O-N 3.33Å; A22-G24 PolarHBondContact O-N 3Å; G24-P26 VanDerWaalsContact O-CD 3.29Å; G24-P26 WeakPolarHBondContact O-CD 3.41Å |
| 25 | A | 56.7 | Low | 62.2 | Low | 68 Ų | 68 | 128.4 Ų | 128.4 | 56% | 0.562 | 74% | 0.744 | S | S | * | * | S | Bend | trans | -73.6 | 111.9 | 159.1 | 0 | 0 | 0 | 0 | 0 | 106.2 | A22 R27 | A22-A25 PolarHBondContact O-N 3.18Å; A25-R27 PolarHBondContact O-N 3.5Å; A25-R27 VanDerWaalsContact O-N 3.08Å |
| 26 | P | 55 | Low | 61.1 | Low | 110 Ų | 110 | 127.3 Ų | 127.3 | 71% | 0.714 | 74% | 0.742 | S | S | * | * | | | trans | -53.8 | 130.1 | 172.8 | -7.1 | 18.8 | 0 | 0 | 0 | 105.4 | G24 A28 | G24-P26 VanDerWaalsContact O-CD 3.29Å; G24-P26 WeakPolarHBondContact O-CD 3.41Å; P26-A28 HydrophobicContact CB-CB 4.32Å; P26-A28 PolarHBondContact O-N 3.38Å |
| 27 | R | 59 | Low | 59.9 | Low | 203 Ų | 203 | 129.9 Ų | 129.9 | 77% | 0.766 | 75% | 0.747 | S | S | * | * | | | trans | -62.2 | 64.9 | 157.8 | -72.5 | -177.9 | 170.8 | 104 | -3.9 | 107.7 | A25 G29 R30 | A25-R27 PolarHBondContact O-N 3.5Å; A25-R27 VanDerWaalsContact O-N 3.08Å; R27-G29 PolarHBondContact O-N 3.35Å; R27-R30 PolarHBondContact O-N 3.27Å |
| 28 | A | 54.3 | Low | 58.7 | Low | 101 Ų | 101 | 132.3 Ų | 132.3 | 84% | 0.835 | 76% | 0.764 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.9 | 44.9 | 170.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | P26 | P26-A28 HydrophobicContact CB-CB 4.32Å; P26-A28 PolarHBondContact O-N 3.38Å |
| 29 | G | 58.4 | Low | 58.1 | Low | 70 Ų | 70 | 134.9 Ų | 134.9 | 72% | 0.722 | 78% | 0.775 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -161.1 | 8.1 | -174.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | R27 | R27-G29 PolarHBondContact O-N 3.35Š|
| 30 | R | 60.3 | Low | 57.7 | Low | 203 Ų | 203 | 136.8 Ų | 136.8 | 77% | 0.766 | 78% | 0.78 | S | S | * | * | | | trans | -142.2 | 53.7 | 172.7 | -70.6 | -156.4 | -160.2 | 169 | 4.3 | 114.1 | R27 | R27-R30 PolarHBondContact O-N 3.27Š|
| 31 | R | 60.3 | Low | 57.6 | Low | 241 Ų | 241 | 140 Ų | 140 | 91% | 0.909 | 79% | 0.791 | S | S | * | * | | | trans | -111.7 | 105 | 144.5 | -120.4 | -178.5 | -177.2 | 176.4 | 1.2 | 106.7 | A33 | R31-A33 PolarHBondContact O-N 2.99Š|
| 32 | P | 59.8 | Low | 57.7 | Low | 112 Ų | 112 | 132.9 Ų | 132.9 | 73% | 0.727 | 78% | 0.783 | S | S | * | * | | | trans | -58.1 | 122.9 | 163.5 | 1.1 | 11.5 | 0 | 0 | 0 | 105.8 | R34 | P32-R34 PolarHBondContact O-N 3.05Š|
| 33 | A | 57.9 | Low | 57.8 | Low | 111 Ų | 111 | 137.5 Ų | 137.5 | 92% | 0.917 | 80% | 0.797 | S | S | * | * | | | trans | -57.7 | 107.1 | 166.5 | 0 | 0 | 0 | 0 | 0 | 107.5 | R31 | R31-A33 PolarHBondContact O-N 2.99Š|
| 34 | R | 56.4 | Low | 58 | Low | 230 Ų | 230 | 142.6 Ų | 142.6 | 87% | 0.868 | 81% | 0.811 | S | S | * | * | | | trans | -136.2 | 115 | 164.3 | -155.6 | 176.4 | -167.1 | 160.8 | 5.4 | 103.1 | P32 | P32-R34 PolarHBondContact O-N 3.05Š|
| 35 | P | 62.9 | Low | 58.3 | Low | 199 Ų | 199 | 149.8 Ų | 149.8 | 100% | 1.292 | 83% | 0.825 | S | S | * | * | | | | -111.7 | 0 | 62.3 | 3.3 | 18.6 | 0 | 0 | 0 | 114.6 | | |