| 1 | M | 52.8 | Low | 72.1 | Confident | 230 Ų | 230 | 98.8 Ų | 98.8 | 100% | 1.133 | 60% | 0.603 | S | S | * | * | | | | 0 | -26.2 | 0 | -122.9 | 143.9 | 161.2 | 0 | 0 | 114.2 | | |
| 2 | A | 58.9 | Low | 73.2 | Confident | 86 Ų | 86 | 98.6 Ų | 98.6 | 71% | 0.711 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -69.1 | -29.9 | -178.5 | 0 | 0 | 0 | 0 | 0 | 115.8 | L4 A6 | A2-L4 PolarHBondContact O-N 3.37Å; A2-A6 PolarHBondContact O-N 3.22Å |
| 3 | S | 64.4 | Low | 73.9 | Confident | 91 Ų | 91 | 99.1 Ų | 99.1 | 64% | 0.636 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -69.4 | -26.9 | -177.9 | -61.2 | 0 | 0 | 0 | 0 | 114.6 | A6 L7 | S3-A6 PolarHBondContact O-N 3.17Å; S3-L7 WeakPolarHBondContact O-CB 2.96Å; S3-L7 PolarHBondContact O-N 3.03Å; S3-L7 VanDerWaalsContact O-CG 3.29Å; S3-L7 WeakPolarHBondContact O-CG 3.43Å |
| 4 | L | 67.1 | Low | 74 | Confident | 136 Ų | 136 | 106 Ų | 106 | 71% | 0.712 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -67.9 | -42.3 | 179.3 | -167.9 | 86.1 | 0 | 0 | 0 | 111 | A2 L7 A8 | A2-L4 PolarHBondContact O-N 3.37Å; L4-L7 PolarHBondContact O-N 2.77Å; L4-A8 WeakPolarHBondContact O-CB 3.5Å; L4-A8 PolarHBondContact O-N 2.93Å |
| 5 | A | 74.7 | Confident | 74.2 | Confident | 59 Ų | 59 | 107.6 Ų | 107.6 | 49% | 0.488 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -65.8 | -38.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | A8 L9 | A5-A8 PolarHBondContact O-N 2.83Å; A5-L9 WeakPolarHBondContact O-CB 3.03Å; A5-L9 WeakPolarHBondContact O-CG 3.36Å; A5-L9 PolarHBondContact O-N 2.91Å |
| 6 | A | 79.2 | Confident | 74.4 | Confident | 58 Ų | 58 | 110.6 Ų | 110.6 | 48% | 0.479 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -66.7 | -37.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | A2 S3 S10 | A2-A6 PolarHBondContact O-N 3.22Å; S3-A6 PolarHBondContact O-N 3.17Å; A6-S10 WeakPolarHBondContact O-CB 3.17Å; A6-S10 PolarHBondContact O-N 3.25Å; A6-S10 VanDerWaalsContact O-CB 3.25Å |
| 7 | L | 74.5 | Confident | 74.3 | Confident | 119 Ų | 119 | 110.4 Ų | 110.4 | 62% | 0.623 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -66.7 | -44.1 | 173.6 | -77.4 | 167.9 | 0 | 0 | 0 | 111.7 | S3 L4 S10 L11 | S3-L7 WeakPolarHBondContact O-CB 2.96Å; S3-L7 PolarHBondContact O-N 3.03Å; S3-L7 VanDerWaalsContact O-CG 3.29Å; S3-L7 WeakPolarHBondContact O-CG 3.43Å; L4-L7 PolarHBondContact O-N 2.77Å; L7-S10 PolarHBondContact O-N 2.96Å; L7-L11 VanDerWaalsContact O-CB 3.31Å; L7-L11 WeakPolarHBondContact O-CB 3.18Å; L7-L11 PolarHBondContact O-N 2.88Å |
| 8 | A | 81.8 | Confident | 73.6 | Confident | 49 Ų | 49 | 109.9 Ų | 109.9 | 41% | 0.405 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -62.9 | -44.6 | 176 | 0 | 0 | 0 | 0 | 0 | 111.4 | L4 A5 L11 L12 | L4-A8 WeakPolarHBondContact O-CB 3.5Å; L4-A8 PolarHBondContact O-N 2.93Å; A5-A8 PolarHBondContact O-N 2.83Å; A8-L11 PolarHBondContact O-N 3.34Å; A8-L12 WeakPolarHBondContact O-CB 3.35Å; A8-L12 WeakPolarHBondContact O-CG 3.32Å; A8-L12 PolarHBondContact O-N 2.87Å |
| 9 | L | 78.3 | Confident | 73.2 | Confident | 108 Ų | 108 | 110.6 Ų | 110.6 | 57% | 0.565 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -62.1 | -44.8 | 173.5 | -77.4 | 169.8 | 0 | 0 | 0 | 111.3 | A5 L11 L12 L13 | A5-L9 WeakPolarHBondContact O-CB 3.03Å; A5-L9 WeakPolarHBondContact O-CG 3.36Å; A5-L9 PolarHBondContact O-N 2.91Å; L9-L11 PolarHBondContact O-N 3.18Å; L9-L11 VanDerWaalsContact C-N 3.29Å; L9-L12 PolarHBondContact O-N 3.49Å; L9-L13 WeakPolarHBondContact O-CB 3.3Å; L9-L13 WeakPolarHBondContact O-CG 3.25Å; L9-L13 PolarHBondContact O-N 2.85Å |
| 10 | S | 82.1 | Confident | 72.6 | Confident | 49 Ų | 49 | 112.2 Ų | 112.2 | 34% | 0.343 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -63.6 | -34.7 | 176.7 | -175 | 0 | 0 | 0 | 0 | 112.5 | A6 L7 R14 | A6-S10 WeakPolarHBondContact O-CB 3.17Å; A6-S10 PolarHBondContact O-N 3.25Å; A6-S10 VanDerWaalsContact O-CB 3.25Å; L7-S10 PolarHBondContact O-N 2.96Å; S10-R14 WeakPolarHBondContact O-CB 3.15Å; S10-R14 WeakPolarHBondContact O-CG 3.37Å; S10-R14 PolarHBondContact O-N 3.47Å |
| 11 | L | 79.6 | Confident | 72 | Confident | 102 Ų | 102 | 112.5 Ų | 112.5 | 53% | 0.534 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -71.1 | -45.9 | 176.8 | -177.2 | 67.8 | 0 | 0 | 0 | 110.9 | L7 A8 L9 L13 R14 L15 | L7-L11 VanDerWaalsContact O-CB 3.31Å; L7-L11 WeakPolarHBondContact O-CB 3.18Å; L7-L11 PolarHBondContact O-N 2.88Å; A8-L11 PolarHBondContact O-N 3.34Å; L9-L11 PolarHBondContact O-N 3.18Å; L9-L11 VanDerWaalsContact C-N 3.29Å; L11-L13 VanDerWaalsContact C-N 3.31Å; L11-L13 PolarHBondContact O-N 3.46Å; L11-R14 PolarHBondContact O-N 2.82Å; L11-L15 HydrophobicContact CG-CD1 4.11Å; L11-L15 PolarHBondContact O-N 3.41Å; L11-L15 WeakPolarHBondContact O-CG 3.16Å; L11-L15 VanDerWaalsContact O-CG 3.32Å; L11-L15 WeakPolarHBondContact O-CB 3.34Å; L11-L15 HydrophobicContact CD1-CD1 4.43Å |
| 12 | L | 85.1 | Confident | 72.3 | Confident | 96 Ų | 96 | 104.6 Ų | 104.6 | 50% | 0.503 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -59.4 | -43.8 | 174.8 | -70.7 | 171 | 0 | 0 | 0 | 110.8 | A8 L9 L15 Q16 | A8-L12 WeakPolarHBondContact O-CB 3.35Å; A8-L12 WeakPolarHBondContact O-CG 3.32Å; A8-L12 PolarHBondContact O-N 2.87Å; L9-L12 PolarHBondContact O-N 3.49Å; L12-L15 PolarHBondContact O-N 3.37Å; L12-Q16 VanDerWaalsContact O-CB 3.3Å; L12-Q16 WeakPolarHBondContact O-CB 3.31Å; L12-Q16 WeakPolarHBondContact O-CG 3.47Å; L12-Q16 PolarHBondContact O-N 3.32Å |
| 13 | L | 83.1 | Confident | 72.1 | Confident | 105 Ų | 105 | 104.7 Ų | 104.7 | 55% | 0.55 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -63.8 | -41.3 | 174.9 | -69 | 171.7 | 0 | 0 | 0 | 111.7 | L9 L11 L15 Q16 L17 | L9-L13 WeakPolarHBondContact O-CB 3.3Å; L9-L13 WeakPolarHBondContact O-CG 3.25Å; L9-L13 PolarHBondContact O-N 2.85Å; L11-L13 VanDerWaalsContact C-N 3.31Å; L11-L13 PolarHBondContact O-N 3.46Å; L13-L15 VanDerWaalsContact C-N 3.34Å; L13-L15 PolarHBondContact O-N 2.92Å; L13-Q16 PolarHBondContact O-N 3.36Å; L13-L17 WeakPolarHBondContact O-CB 3.33Å; L13-L17 HydrophobicContact CB-CD1 4.44Å; L13-L17 PolarHBondContact O-N 2.86Å; L13-L17 WeakPolarHBondContact O-CD1 3.34Å |
| 14 | R | 75.3 | Confident | 71.7 | Confident | 196 Ų | 196 | 110.5 Ų | 110.5 | 74% | 0.74 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -67.3 | -31.8 | 176.9 | -78.3 | 173.8 | 177.2 | -162.1 | 0.6 | 113.6 | S10 L11 | S10-R14 WeakPolarHBondContact O-CB 3.15Å; S10-R14 WeakPolarHBondContact O-CG 3.37Å; S10-R14 PolarHBondContact O-N 3.47Å; L11-R14 PolarHBondContact O-N 2.82Å |
| 15 | L | 76.4 | Confident | 71 | Confident | 130 Ų | 130 | 106.4 Ų | 106.4 | 68% | 0.681 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -81.1 | -33 | 176.7 | -69.6 | 173.2 | 0 | 0 | 0 | 112.4 | L11 L12 L13 | L11-L15 HydrophobicContact CG-CD1 4.11Å; L11-L15 PolarHBondContact O-N 3.41Å; L11-L15 WeakPolarHBondContact O-CG 3.16Å; L11-L15 VanDerWaalsContact O-CG 3.32Å; L11-L15 WeakPolarHBondContact O-CB 3.34Å; L11-L15 HydrophobicContact CD1-CD1 4.43Å; L12-L15 PolarHBondContact O-N 3.37Å; L13-L15 VanDerWaalsContact C-N 3.34Å; L13-L15 PolarHBondContact O-N 2.92Å |
| 16 | Q | 76.9 | Confident | 70.1 | Confident | 155 Ų | 155 | 111.6 Ų | 111.6 | 72% | 0.724 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -85.1 | -20.7 | 178.3 | -70.6 | -161.1 | -4.2 | 0 | 0 | 113.7 | L12 L13 P18 | L12-Q16 VanDerWaalsContact O-CB 3.3Å; L12-Q16 WeakPolarHBondContact O-CB 3.31Å; L12-Q16 WeakPolarHBondContact O-CG 3.47Å; L12-Q16 PolarHBondContact O-N 3.32Å; L13-Q16 PolarHBondContact O-N 3.36Å; Q16-P18 WeakPolarHBondContact O-CD 3.32Å |
| 17 | L | 72.6 | Confident | 68.9 | Low | 108 Ų | 108 | 112.9 Ų | 112.9 | 57% | 0.565 | 63% | 0.628 | S | S | * | * | S | Bend | trans | -67.4 | 114.4 | 171.2 | -102.2 | 97.4 | 0 | 0 | 0 | 108.7 | L13 | L13-L17 WeakPolarHBondContact O-CB 3.33Å; L13-L17 HydrophobicContact CB-CD1 4.44Å; L13-L17 PolarHBondContact O-N 2.86Å; L13-L17 WeakPolarHBondContact O-CD1 3.34Å |
| 18 | P | 62.5 | Low | 67.9 | Low | 101 Ų | 101 | 110.4 Ų | 110.4 | 66% | 0.656 | 63% | 0.625 | S | S | * | * | | | trans | -59.3 | 140.6 | 171.2 | -14.3 | 28.9 | 0 | 0 | 0 | 108.3 | Q16 L20 | Q16-P18 WeakPolarHBondContact O-CD 3.32Å; P18-L20 PolarHBondContact O-N 2.82Å |
| 19 | P | 65.2 | Low | 66.5 | Low | 123 Ų | 123 | 112 Ų | 112 | 80% | 0.799 | 64% | 0.638 | S | S | * | * | | | trans | -60.9 | 109.9 | 175.4 | 24.9 | -32.1 | 0 | 0 | 0 | 108.7 | P21 | P19-P21 WeakPolarHBondContact O-CD 3.21Š|
| 20 | L | 61.6 | Low | 65.1 | Low | 142 Ų | 142 | 109.3 Ų | 109.3 | 74% | 0.743 | 64% | 0.637 | S | S | * | * | | | trans | -52.2 | 121.4 | 177.5 | -76.1 | 162.9 | 0 | 0 | 0 | 109.8 | P18 G22 | P18-L20 PolarHBondContact O-N 2.82Å; L20-G22 PolarHBondContact O-N 3.44Å |
| 21 | P | 59.4 | Low | 63.6 | Low | 120 Ų | 120 | 111.9 Ų | 111.9 | 78% | 0.779 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79 | 107.3 | 177.5 | 31.2 | -29.2 | 0 | 0 | 0 | 107.5 | P19 | P19-P21 WeakPolarHBondContact O-CD 3.21Š|
| 22 | G | 59.4 | Low | 62.3 | Low | 64 Ų | 64 | 111 Ų | 111 | 66% | 0.66 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 174.1 | -35.6 | 172 | 0 | 0 | 0 | 0 | 0 | 115.6 | L20 | L20-G22 PolarHBondContact O-N 3.44Š|
| 23 | A | 55.9 | Low | 60.8 | Low | 87 Ų | 87 | 110.7 Ų | 110.7 | 72% | 0.719 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -129.6 | -24.1 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | | |
| 24 | R | 54.4 | Low | 59.2 | Low | 213 Ų | 213 | 111 Ų | 111 | 80% | 0.804 | 67% | 0.667 | S | S | * | * | S | Bend | trans | -101.2 | -18.8 | 175.8 | -72.7 | -172.4 | 172.7 | 168.6 | -1.2 | 114.2 | Q26 S27 A28 | R24-Q26 PolarHBondContact O-N 2.82Å; R24-S27 PolarHBondContact O-N 3.28Å; R24-A28 PolarHBondContact O-N 3.37Å |
| 25 | A | 53.3 | Low | 58.5 | Low | 51 Ų | 51 | 108 Ų | 108 | 42% | 0.421 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -65.8 | -26.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | A29 | A25-A29 WeakPolarHBondContact O-CA 3.29Å; A25-A29 WeakPolarHBondContact O-CB 3.42Å; A25-A29 PolarHBondContact O-N 3.3Å |
| 26 | Q | 54.8 | Low | 57.7 | Low | 167 Ų | 167 | 110.5 Ų | 110.5 | 78% | 0.78 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -74.4 | -32.3 | 172.9 | -118.8 | 160 | 12.8 | 0 | 0 | 112.6 | R24 G30 | R24-Q26 PolarHBondContact O-N 2.82Å; Q26-G30 PolarHBondContact O-N 2.89Å |
| 27 | S | 54.6 | Low | 56.8 | Low | 86 Ų | 86 | 107.1 Ų | 107.1 | 60% | 0.601 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -79 | -24.6 | 173.9 | -170.9 | 0 | 0 | 0 | 0 | 113.2 | R24 V31 | R24-S27 PolarHBondContact O-N 3.28Å; S27-V31 WeakPolarHBondContact O-CG2 3.4Å |
| 28 | A | 54.3 | Low | 56.1 | Low | 66 Ų | 66 | 106.9 Ų | 106.9 | 55% | 0.545 | 67% | 0.673 | S | S | . | * | H | α-helix | trans | -90.3 | -33.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | R24 V31 A32 | R24-A28 PolarHBondContact O-N 3.37Å; A28-V31 CarbonylContact O-C 3.33Å; A28-V31 PolarHBondContact O-N 3.43Å; A28-A32 PolarHBondContact O-N 3.45Å |
| 29 | A | 51.5 | Low | 56 | Low | 83 Ų | 83 | 106.7 Ų | 106.7 | 69% | 0.686 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -80 | -19.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113 | A25 V31 | A25-A29 WeakPolarHBondContact O-CA 3.29Å; A25-A29 WeakPolarHBondContact O-CB 3.42Å; A25-A29 PolarHBondContact O-N 3.3Å; A29-V31 VanDerWaalsContact C-N 3.3Å |
| 30 | G | 49.4 | Very low | 55.7 | Low | 52 Ų | 52 | 103.4 Ų | 103.4 | 54% | 0.536 | 65% | 0.653 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -81.1 | -7.6 | 164.9 | 0 | 0 | 0 | 0 | 0 | 114 | Q26 | Q26-G30 PolarHBondContact O-N 2.89Š|
| 31 | V | 50.3 | Low | 55.5 | Low | 103 Ų | 103 | 100.5 Ų | 100.5 | 62% | 0.624 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.7 | 40.9 | 177.5 | -169.8 | 0 | 0 | 0 | 0 | 109.7 | S27 A28 A29 | S27-V31 WeakPolarHBondContact O-CG2 3.4Å; A28-V31 CarbonylContact O-C 3.33Å; A28-V31 PolarHBondContact O-N 3.43Å; A29-V31 VanDerWaalsContact C-N 3.3Å |
| 32 | A | 52 | Low | 55.7 | Low | 84 Ų | 84 | 99.2 Ų | 99.2 | 69% | 0.694 | 63% | 0.631 | S | S | * | * | | | trans | -95.4 | 49.5 | 144 | 0 | 0 | 0 | 0 | 0 | 107.8 | A28 P34 | A28-A32 PolarHBondContact O-N 3.45Å; A32-P34 WeakPolarHBondContact O-CD 3.42Å |
| 33 | V | 53.7 | Low | 55.9 | Low | 88 Ų | 88 | 100.1 Ų | 100.1 | 53% | 0.533 | 62% | 0.624 | S | S | . | * | | | trans | -66.6 | 121.6 | 163.9 | 174.9 | 0 | 0 | 0 | 0 | 105.4 | L35 | V33-L35 VanDerWaalsContact C-N 3.31Å; V33-L35 PolarHBondContact O-N 2.86Å |
| 34 | P | 50 | Low | 56.3 | Low | 111 Ų | 111 | 101.8 Ų | 101.8 | 72% | 0.721 | 62% | 0.619 | S | S | * | * | | | trans | -63 | 99.8 | 168.9 | 26 | -30.7 | 0 | 0 | 0 | 107.3 | A32 M36 | A32-P34 WeakPolarHBondContact O-CD 3.42Å; P34-M36 PolarHBondContact O-N 2.86Å |
| 35 | L | 60.4 | Low | 56.8 | Low | 135 Ų | 135 | 97.1 Ų | 97.1 | 71% | 0.707 | 61% | 0.614 | S | S | * | * | | | trans | -70.1 | 36.2 | 173.4 | -83.5 | 160.9 | 0 | 0 | 0 | 111.7 | V33 | V33-L35 VanDerWaalsContact C-N 3.31Å; V33-L35 PolarHBondContact O-N 2.86Å |
| 36 | M | 60.5 | Low | 57 | Low | 181 Ų | 181 | 105.2 Ų | 105.2 | 89% | 0.892 | 63% | 0.634 | S | S | * | * | | | trans | -130.3 | 58.8 | -170.3 | -139.8 | 150.1 | 144.2 | 0 | 0 | 109.3 | P34 | P34-M36 PolarHBondContact O-N 2.86Š|
| 37 | S | 56.1 | Low | 57.5 | Low | 84 Ų | 84 | 106.4 Ų | 106.4 | 59% | 0.587 | 64% | 0.644 | S | S | * | * | S | Bend | trans | -154.8 | -48.9 | 162.4 | -163.2 | 0 | 0 | 0 | 0 | 111.8 | A40 T41 | S37-A40 PolarHBondContact O-N 3.46Å; S37-T41 VanDerWaalsContact O-OG1 3.11Å; S37-T41 PolarHBondContact O-OG1 3.42Å |
| 38 | T | 59.3 | Low | 57.6 | Low | 104 Ų | 104 | 107.4 Ų | 107.4 | 64% | 0.638 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -74.1 | -34.7 | -173 | 31.5 | 0 | 0 | 0 | 0 | 114.6 | A40 T41 | T38-A40 VanDerWaalsContact C-N 3.29Å; T38-A40 PolarHBondContact O-N 3.11Å; T38-T41 PolarHBondContact O-N 3.47Å |
| 39 | T | 59.4 | Low | 57.8 | Low | 97 Ų | 97 | 109.6 Ų | 109.6 | 60% | 0.595 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -69 | -29.7 | 178.7 | -38.6 | 0 | 0 | 0 | 0 | 112.1 | | |
| 40 | A | 60.2 | Low | 58.1 | Low | 54 Ų | 54 | 111.1 Ų | 111.1 | 45% | 0.446 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -73.7 | -36.1 | 179 | 0 | 0 | 0 | 0 | 0 | 112.2 | S37 T38 V42 V43 I44 | S37-A40 PolarHBondContact O-N 3.46Å; T38-A40 VanDerWaalsContact C-N 3.29Å; T38-A40 PolarHBondContact O-N 3.11Å; A40-V42 VanDerWaalsContact C-N 3.3Å; A40-V42 PolarHBondContact O-N 3.24Å; A40-V43 PolarHBondContact O-N 3.24Å; A40-I44 WeakPolarHBondContact O-CD1 3.44Å; A40-I44 WeakPolarHBondContact O-CG1 3.46Å; A40-I44 PolarHBondContact O-N 3.37Å; A40-I44 VanDerWaalsContact O-N 3.16Å |
| 41 | T | 57.5 | Low | 58.6 | Low | 81 Ų | 81 | 114.5 Ų | 114.5 | 50% | 0.497 | 66% | 0.656 | S | S | . | * | H | α-helix | trans | -64 | -35.3 | -179.4 | -41.2 | 0 | 0 | 0 | 0 | 112.4 | S37 T38 V43 I44 V45 | S37-T41 VanDerWaalsContact O-OG1 3.11Å; S37-T41 PolarHBondContact O-OG1 3.42Å; T38-T41 PolarHBondContact O-N 3.47Å; T41-V43 VanDerWaalsContact C-N 3.34Å; T41-I44 PolarHBondContact O-N 3.38Å; T41-V45 WeakPolarHBondContact O-CG2 3.36Å; T41-V45 PolarHBondContact O-N 3.16Å |
| 42 | V | 62.8 | Low | 59.2 | Low | 93 Ų | 93 | 115.3 Ų | 115.3 | 56% | 0.564 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -66.4 | -38 | 177.8 | -179.6 | 0 | 0 | 0 | 0 | 111.5 | A40 W46 | A40-V42 VanDerWaalsContact C-N 3.3Å; A40-V42 PolarHBondContact O-N 3.24Å; V42-W46 PolarHBondContact O-N 3.46Å |
| 43 | V | 63 | Low | 59.6 | Low | 83 Ų | 83 | 117.3 Ų | 117.3 | 50% | 0.503 | 66% | 0.656 | S | S | . | * | H | α-helix | trans | -71 | -36.7 | 179.7 | 178.8 | 0 | 0 | 0 | 0 | 111.4 | A40 T41 W46 L47 | A40-V43 PolarHBondContact O-N 3.24Å; T41-V43 VanDerWaalsContact C-N 3.34Å; V43-W46 PolarHBondContact O-N 3.36Å; V43-L47 HydrophobicContact CG1-CD1 3.94Å; V43-L47 HydrophobicContact CG1-CG 4.44Å; V43-L47 WeakPolarHBondContact O-CG 3.42Å; V43-L47 PolarHBondContact O-N 3.15Å; V43-L47 VanDerWaalsContact O-N 3.15Å |
| 44 | I | 65.1 | Low | 60.1 | Low | 121 Ų | 121 | 119.4 Ų | 119.4 | 62% | 0.621 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -71.9 | -30.9 | -179.7 | -63.4 | 159.4 | 0 | 0 | 0 | 112.2 | A40 T41 W46 | A40-I44 WeakPolarHBondContact O-CD1 3.44Å; A40-I44 WeakPolarHBondContact O-CG1 3.46Å; A40-I44 PolarHBondContact O-N 3.37Å; A40-I44 VanDerWaalsContact O-N 3.16Å; T41-I44 PolarHBondContact O-N 3.38Å; I44-W46 VanDerWaalsContact C-N 3.33Å |
| 45 | V | 65.6 | Low | 60.8 | Low | 115 Ų | 115 | 120.1 Ų | 120.1 | 70% | 0.697 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -75.3 | -24.5 | 175.7 | 169.3 | 0 | 0 | 0 | 0 | 112.3 | T41 | T41-V45 WeakPolarHBondContact O-CG2 3.36Å; T41-V45 PolarHBondContact O-N 3.16Å |
| 46 | W | 57.1 | Low | 60.9 | Low | 222 Ų | 222 | 118.8 Ų | 118.8 | 84% | 0.841 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -96.1 | -8.2 | -179 | -92.5 | 84 | 0 | 0 | 0 | 114.6 | V42 V43 I44 | V42-W46 PolarHBondContact O-N 3.46Å; V43-W46 PolarHBondContact O-N 3.36Å; I44-W46 VanDerWaalsContact C-N 3.33Å |
| 47 | L | 63.9 | Low | 60.9 | Low | 191 Ų | 191 | 113.2 Ų | 113.2 | 100% | 1 | 64% | 0.635 | S | S | * | * | | | trans | -90.9 | 0 | 169.8 | -78 | 169.3 | 0 | 0 | 0 | 110.2 | V43 | V43-L47 HydrophobicContact CG1-CD1 3.94Å; V43-L47 HydrophobicContact CG1-CG 4.44Å; V43-L47 WeakPolarHBondContact O-CG 3.42Å; V43-L47 PolarHBondContact O-N 3.15Å; V43-L47 VanDerWaalsContact O-N 3.15Å |