| 1 | M | 55.8 | Low | 75.5 | Confident | 233 Ų | 233 | 127.6 Ų | 127.6 | 100% | 1.148 | 67% | 0.668 | S | S | * | * | | | | 0 | 104.1 | 0 | -83 | 170.4 | 169.5 | 0 | 0 | 106 | | |
| 2 | D | 63.8 | Low | 76.6 | Confident | 124 Ų | 124 | 123 Ų | 123 | 66% | 0.663 | 65% | 0.649 | S | S | * | * | | | trans | -177.1 | -14.9 | 168.1 | -105.6 | -53.5 | 0 | 0 | 0 | 115 | S6 | D2-S6 VanDerWaalsContact O-OG 3.09Å; D2-S6 PolarHBondContact O-OG 3.07Å |
| 3 | M | 61.5 | Low | 77.6 | Confident | 183 Ų | 183 | 118.7 Ų | 118.7 | 90% | 0.901 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -73.2 | -33.8 | 178.6 | -86.6 | 163.7 | 145.9 | 0 | 0 | 113.9 | G7 | M3-G7 PolarHBondContact O-N 3.21Å |
| 4 | Q | 65.8 | Low | 78.5 | Confident | 171 Ų | 171 | 119.6 Ų | 119.6 | 80% | 0.799 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -70.7 | -43.5 | -179.6 | -110.8 | -177.9 | 59.3 | 0 | 0 | 112.2 | S6 G7 V8 | Q4-S6 PolarHBondContact O-N 3.36Å; Q4-G7 PolarHBondContact O-N 3.36Å; Q4-V8 WeakPolarHBondContact O-CG2 3.25Å; Q4-V8 PolarHBondContact O-N 3.49Å; Q4-V8 VanDerWaalsContact O-N 3.13Å |
| 5 | T | 75.8 | Confident | 79.3 | Confident | 90 Ų | 90 | 120.3 Ų | 120.3 | 55% | 0.552 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -64.6 | -41.6 | -178.7 | -48.3 | 0 | 0 | 0 | 0 | 112 | G7 V8 L9 | T5-G7 PolarHBondContact O-N 3.03Å; T5-V8 PolarHBondContact O-N 3.39Å; T5-L9 HydrophobicContact CG2-CD1 4.46Å; T5-L9 PolarHBondContact O-N 3.12Å; T5-L9 VanDerWaalsContact O-N 3.11Å |
| 6 | S | 77.3 | Confident | 79.9 | Confident | 64 Ų | 64 | 116.5 Ų | 116.5 | 45% | 0.448 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -64 | -39.8 | 177.7 | -61.5 | 0 | 0 | 0 | 0 | 112.4 | D2 Q4 L10 | D2-S6 VanDerWaalsContact O-OG 3.09Å; D2-S6 PolarHBondContact O-OG 3.07Å; Q4-S6 PolarHBondContact O-N 3.36Å; S6-L10 PolarHBondContact O-N 3.45Å; S6-L10 VanDerWaalsContact O-N 3.14Å |
| 7 | G | 83.8 | Confident | 80.5 | Confident | 39 Ų | 39 | 115 Ų | 115 | 40% | 0.402 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -66.6 | -39.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | M3 Q4 T5 W11 | M3-G7 PolarHBondContact O-N 3.21Å; Q4-G7 PolarHBondContact O-N 3.36Å; T5-G7 PolarHBondContact O-N 3.03Å; G7-W11 WeakPolarHBondContact O-CB 3.48Å; G7-W11 PolarHBondContact O-N 3.4Å |
| 8 | V | 85.9 | Confident | 80.9 | Confident | 91 Ų | 91 | 110.6 Ų | 110.6 | 55% | 0.552 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -65.5 | -43.9 | 177.6 | 173.9 | 0 | 0 | 0 | 0 | 111.2 | Q4 T5 W11 T12 | Q4-V8 WeakPolarHBondContact O-CG2 3.25Å; Q4-V8 PolarHBondContact O-N 3.49Å; Q4-V8 VanDerWaalsContact O-N 3.13Å; T5-V8 PolarHBondContact O-N 3.39Å; V8-W11 PolarHBondContact O-N 3.1Å; V8-T12 PolarHBondContact O-OG1 3.44Å; V8-T12 WeakPolarHBondContact O-CG2 3.31Å; V8-T12 HydrophobicContact CG1-CG2 4.5Å; V8-T12 PolarHBondContact O-N 3.04Å |
| 9 | L | 85.8 | Confident | 81.3 | Confident | 107 Ų | 107 | 110.8 Ų | 110.8 | 56% | 0.56 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -62.2 | -43.4 | 177.4 | -95.5 | 158.8 | 0 | 0 | 0 | 112.9 | T5 T12 S13 | T5-L9 HydrophobicContact CG2-CD1 4.46Å; T5-L9 PolarHBondContact O-N 3.12Å; T5-L9 VanDerWaalsContact O-N 3.11Å; L9-T12 WeakPolarHBondContact CA-OG1 3.38Å; L9-T12 PolarHBondContact O-OG1 3.08Å; L9-S13 WeakPolarHBondContact O-CB 3.32Å; L9-S13 PolarHBondContact O-N 3.48Å; L9-S13 VanDerWaalsContact O-N 3.07Å; L9-S13 PolarHBondContact O-OG 3.43Å |
| 10 | L | 87.1 | Confident | 81.6 | Confident | 125 Ų | 125 | 114.5 Ų | 114.5 | 65% | 0.654 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -62.4 | -45.4 | 175.1 | -87 | 160.4 | 0 | 0 | 0 | 111.3 | S6 S13 L14 | S6-L10 PolarHBondContact O-N 3.45Å; S6-L10 VanDerWaalsContact O-N 3.14Å; L10-S13 PolarHBondContact O-N 3.29Å; L10-L14 PolarHBondContact O-N 3.42Å |
| 11 | W | 87.9 | Confident | 81.8 | Confident | 177 Ų | 177 | 113.1 Ų | 113.1 | 67% | 0.67 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -60.9 | -46.3 | 178.8 | 179.2 | -100.9 | 0 | 0 | 0 | 112.6 | G7 V8 S13 L14 K15 | G7-W11 WeakPolarHBondContact O-CB 3.48Å; G7-W11 PolarHBondContact O-N 3.4Å; V8-W11 PolarHBondContact O-N 3.1Å; W11-S13 VanDerWaalsContact C-N 3.32Å; W11-S13 PolarHBondContact O-N 3Å; W11-L14 PolarHBondContact O-N 2.99Å; W11-K15 WeakPolarHBondContact O-CB 3.49Å; W11-K15 PolarHBondContact O-N 3.41Å; W11-K15 VanDerWaalsContact O-N 3.1Å |
| 12 | T | 88.6 | Confident | 83 | Confident | 72 Ų | 72 | 108 Ų | 108 | 44% | 0.442 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -64.6 | -38.4 | 178.4 | 51.1 | 0 | 0 | 0 | 0 | 112.2 | V8 L9 K15 A16 | V8-T12 PolarHBondContact O-OG1 3.44Å; V8-T12 WeakPolarHBondContact O-CG2 3.31Å; V8-T12 HydrophobicContact CG1-CG2 4.5Å; V8-T12 PolarHBondContact O-N 3.04Å; L9-T12 WeakPolarHBondContact CA-OG1 3.38Å; L9-T12 PolarHBondContact O-OG1 3.08Å; T12-K15 PolarHBondContact O-N 3.46Å; T12-A16 PolarHBondContact O-N 3.1Å |
| 13 | S | 89.3 | Confident | 83.4 | Confident | 67 Ų | 67 | 107 Ų | 107 | 47% | 0.469 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -66.2 | -44.4 | 179.3 | -56.6 | 0 | 0 | 0 | 0 | 111.2 | L9 L10 W11 K15 A16 V17 | L9-S13 WeakPolarHBondContact O-CB 3.32Å; L9-S13 PolarHBondContact O-N 3.48Å; L9-S13 VanDerWaalsContact O-N 3.07Å; L9-S13 PolarHBondContact O-OG 3.43Å; L10-S13 PolarHBondContact O-N 3.29Å; W11-S13 VanDerWaalsContact C-N 3.32Å; W11-S13 PolarHBondContact O-N 3Å; S13-K15 VanDerWaalsContact C-N 3.31Å; S13-K15 PolarHBondContact O-N 3.42Å; S13-A16 PolarHBondContact O-N 3.07Å; S13-V17 WeakPolarHBondContact O-CG2 3.49Å; S13-V17 PolarHBondContact O-N 3.32Å; S13-V17 VanDerWaalsContact O-N 3.08Å |
| 14 | L | 90.3 | Very high | 83.6 | Confident | 131 Ų | 131 | 105.9 Ų | 105.9 | 69% | 0.686 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -62.6 | -40.1 | 177.8 | -144.5 | 76.8 | 0 | 0 | 0 | 111.6 | L10 W11 V17 G18 | L10-L14 PolarHBondContact O-N 3.42Å; W11-L14 PolarHBondContact O-N 2.99Å; L14-V17 PolarHBondContact O-N 2.92Å; L14-G18 PolarHBondContact O-N 2.96Å |
| 15 | K | 90.4 | Very high | 84.5 | Confident | 131 Ų | 131 | 102.7 Ų | 102.7 | 57% | 0.57 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -65.2 | -41 | 177.9 | -140.8 | -172.9 | 179.3 | -153.2 | 0 | 112 | W11 T12 S13 G18 I19 | W11-K15 WeakPolarHBondContact O-CB 3.49Å; W11-K15 PolarHBondContact O-N 3.41Å; W11-K15 VanDerWaalsContact O-N 3.1Å; T12-K15 PolarHBondContact O-N 3.46Å; S13-K15 VanDerWaalsContact C-N 3.31Å; S13-K15 PolarHBondContact O-N 3.42Å; K15-G18 PolarHBondContact O-N 3Å; K15-I19 WeakPolarHBondContact O-CD1 3.38Å; K15-I19 VanDerWaalsContact O-N 3.1Å; K15-I19 PolarHBondContact O-N 3.31Å; K15-I19 WeakPolarHBondContact O-CG1 3.41Å; K15-I19 VanDerWaalsContact O-CG1 3.31Å |
| 16 | A | 89 | Confident | 84.9 | Confident | 59 Ų | 59 | 103.3 Ų | 103.3 | 49% | 0.488 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -65 | -43.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | T12 S13 I19 W20 | T12-A16 PolarHBondContact O-N 3.1Å; S13-A16 PolarHBondContact O-N 3.07Å; A16-I19 PolarHBondContact O-N 3Å; A16-W20 PolarHBondContact O-N 3.11Å; A16-W20 VanDerWaalsContact O-N 3.07Å |
| 17 | V | 90 | Very high | 85.3 | Confident | 91 Ų | 91 | 105.5 Ų | 105.5 | 55% | 0.552 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -63.5 | -42.6 | 175.6 | 175.3 | 0 | 0 | 0 | 0 | 111 | S13 L14 I19 W20 V21 | S13-V17 WeakPolarHBondContact O-CG2 3.49Å; S13-V17 PolarHBondContact O-N 3.32Å; S13-V17 VanDerWaalsContact O-N 3.08Å; L14-V17 PolarHBondContact O-N 2.92Å; V17-I19 PolarHBondContact O-N 3.37Å; V17-W20 PolarHBondContact O-N 3.48Å; V17-V21 HydrophobicContact CG1-CG2 4.37Å; V17-V21 WeakPolarHBondContact O-CG2 3.4Å; V17-V21 PolarHBondContact O-N 3.14Å |
| 18 | G | 88.5 | Confident | 85.4 | Confident | 36 Ų | 36 | 109.4 Ų | 109.4 | 37% | 0.371 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -59.9 | -42.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | L14 K15 W20 V21 V22 | L14-G18 PolarHBondContact O-N 2.96Å; K15-G18 PolarHBondContact O-N 3Å; G18-W20 VanDerWaalsContact C-N 3.34Å; G18-V21 PolarHBondContact O-N 2.7Å; G18-V22 VanDerWaalsContact O-N 3.12Å; G18-V22 PolarHBondContact O-N 3.34Å; G18-V22 WeakPolarHBondContact O-CG2 3.36Å |
| 19 | I | 87.4 | Confident | 85.4 | Confident | 114 Ų | 114 | 110.6 Ų | 110.6 | 59% | 0.585 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -63.7 | -42.4 | 176.2 | -66.9 | 162.2 | 0 | 0 | 0 | 110.8 | K15 A16 V17 V21 V22 S23 | K15-I19 WeakPolarHBondContact O-CD1 3.38Å; K15-I19 VanDerWaalsContact O-N 3.1Å; K15-I19 PolarHBondContact O-N 3.31Å; K15-I19 WeakPolarHBondContact O-CG1 3.41Å; K15-I19 VanDerWaalsContact O-CG1 3.31Å; A16-I19 PolarHBondContact O-N 3Å; V17-I19 PolarHBondContact O-N 3.37Å; I19-V21 PolarHBondContact O-N 3.13Å; I19-V22 PolarHBondContact O-N 3.49Å; I19-S23 VanDerWaalsContact O-CB 3.25Å; I19-S23 WeakPolarHBondContact O-CB 3.34Å; I19-S23 PolarHBondContact O-N 3.33Å |
| 20 | W | 87 | Confident | 85.4 | Confident | 184 Ų | 184 | 110.8 Ų | 110.8 | 70% | 0.697 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -61.9 | -43.9 | 179.1 | -174.9 | 72.9 | 0 | 0 | 0 | 112.3 | A16 V17 G18 S23 V24 | A16-W20 PolarHBondContact O-N 3.11Å; A16-W20 VanDerWaalsContact O-N 3.07Å; V17-W20 PolarHBondContact O-N 3.48Å; G18-W20 VanDerWaalsContact C-N 3.34Å; W20-S23 PolarHBondContact O-N 3.14Å; W20-V24 PolarHBondContact O-N 3.09Å |
| 21 | V | 86.5 | Confident | 85.3 | Confident | 86 Ų | 86 | 109.8 Ų | 109.8 | 52% | 0.521 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -67 | -37 | 178.8 | 173.5 | 0 | 0 | 0 | 0 | 112.6 | V17 G18 I19 S23 | V17-V21 HydrophobicContact CG1-CG2 4.37Å; V17-V21 WeakPolarHBondContact O-CG2 3.4Å; V17-V21 PolarHBondContact O-N 3.14Å; G18-V21 PolarHBondContact O-N 2.7Å; I19-V21 PolarHBondContact O-N 3.13Å; V21-S23 VanDerWaalsContact C-N 3.32Å |
| 22 | V | 80.9 | Confident | 85 | Confident | 126 Ų | 126 | 104.6 Ų | 104.6 | 76% | 0.764 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -76.3 | -23.1 | 178.9 | 173.7 | 0 | 0 | 0 | 0 | 112.3 | G18 I19 | G18-V22 VanDerWaalsContact O-N 3.12Å; G18-V22 PolarHBondContact O-N 3.34Å; G18-V22 WeakPolarHBondContact O-CG2 3.36Å; I19-V22 PolarHBondContact O-N 3.49Å |
| 23 | S | 73.1 | Confident | 84.8 | Confident | 103 Ų | 103 | 107.3 Ų | 107.3 | 72% | 0.72 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -89 | -8.4 | -178.3 | -160.1 | 0 | 0 | 0 | 0 | 113.9 | I19 W20 V21 | I19-S23 VanDerWaalsContact O-CB 3.25Å; I19-S23 WeakPolarHBondContact O-CB 3.34Å; I19-S23 PolarHBondContact O-N 3.33Å; W20-S23 PolarHBondContact O-N 3.14Å; V21-S23 VanDerWaalsContact C-N 3.32Å |
| 24 | V | 64.6 | Low | 84.3 | Confident | 160 Ų | 160 | 111 Ų | 111 | 97% | 0.97 | 63% | 0.629 | S | S | * | * | | | trans | -91.1 | 0 | 169.1 | 168.3 | 0 | 0 | 0 | 0 | 109.2 | W20 | W20-V24 PolarHBondContact O-N 3.09Š|