| 1 | M | 73.4 | Confident | 84.9 | Confident | 210 Ų | 210 | 125.3 Ų | 125.3 | 100% | 1.034 | 64% | 0.638 | S | S | * | * | | | | 0 | -37.3 | 0 | -69 | -177.5 | 127.8 | 0 | 0 | 113.9 | | |
| 2 | V | 83.6 | Confident | 84.3 | Confident | 113 Ų | 113 | 121.3 Ų | 121.3 | 69% | 0.685 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -64.8 | -43.6 | -179.6 | 179.7 | 0 | 0 | 0 | 0 | 112.6 | L4 R5 V6 | V2-L4 PolarHBondContact O-N 2.99Å; V2-L4 VanDerWaalsContact C-N 3.3Å; V2-R5 PolarHBondContact O-N 3.49Å; V2-R5 VanDerWaalsContact O-N 3.09Å; V2-R5 WeakPolarHBondContact O-CB 3.43Å; V2-V6 HydrophobicContact CG1-CG2 4.35Å; V2-V6 WeakPolarHBondContact O-CG2 3.33Å; V2-V6 PolarHBondContact O-N 2.9Å; V2-V6 VanDerWaalsContact O-N 3.09Å |
| 3 | L | 87.4 | Confident | 83.9 | Confident | 147 Ų | 147 | 126.1 Ų | 126.1 | 77% | 0.77 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -57.8 | -40.1 | -178.7 | -169.9 | 68.9 | 0 | 0 | 0 | 113.2 | R5 V6 L7 | L3-R5 PolarHBondContact O-N 3Å; L3-V6 PolarHBondContact O-N 3.12Å; L3-L7 PolarHBondContact O-N 3.31Å |
| 4 | L | 87.6 | Confident | 83.4 | Confident | 114 Ų | 114 | 121.6 Ų | 121.6 | 60% | 0.597 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -64.7 | -40.1 | 178.2 | -175.5 | 65.9 | 0 | 0 | 0 | 111.7 | V2 L7 I8 | V2-L4 PolarHBondContact O-N 2.99Å; V2-L4 VanDerWaalsContact C-N 3.3Å; L4-L7 PolarHBondContact O-N 3.22Å; L4-I8 HydrophobicContact CD1-CD1 4.5Å; L4-I8 HydrophobicContact CG-CD1 4.09Å; L4-I8 WeakPolarHBondContact O-CD1 3.06Å; L4-I8 VanDerWaalsContact O-CG1 3.27Å; L4-I8 WeakPolarHBondContact O-CG1 3.42Å; L4-I8 PolarHBondContact O-N 3.29Å |
| 5 | R | 84 | Confident | 82.4 | Confident | 186 Ų | 186 | 118.4 Ų | 118.4 | 70% | 0.702 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -65.4 | -41.6 | 177.4 | -69.9 | -178 | 166.9 | 171.5 | -3.5 | 111.6 | V2 L3 L7 I8 L9 | V2-R5 PolarHBondContact O-N 3.49Å; V2-R5 VanDerWaalsContact O-N 3.09Å; V2-R5 WeakPolarHBondContact O-CB 3.43Å; L3-R5 PolarHBondContact O-N 3Å; R5-L7 VanDerWaalsContact C-N 3.34Å; R5-I8 PolarHBondContact O-N 2.74Å; R5-L9 PolarHBondContact O-N 3.41Å; R5-L9 WeakPolarHBondContact O-CG 3.44Å; R5-L9 WeakPolarHBondContact O-CB 3.35Å; R5-L9 WeakPolarHBondContact O-CD1 3.43Å |
| 6 | V | 88.5 | Confident | 81.2 | Confident | 71 Ų | 71 | 114.4 Ų | 114.4 | 43% | 0.43 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -63.5 | -41.9 | 176.6 | 176 | 0 | 0 | 0 | 0 | 110.9 | V2 L3 L9 L10 | V2-V6 HydrophobicContact CG1-CG2 4.35Å; V2-V6 WeakPolarHBondContact O-CG2 3.33Å; V2-V6 PolarHBondContact O-N 2.9Å; V2-V6 VanDerWaalsContact O-N 3.09Å; L3-V6 PolarHBondContact O-N 3.12Å; V6-L9 PolarHBondContact O-N 3.02Å; V6-L10 HydrophobicContact CG1-CD1 3.92Å; V6-L10 PolarHBondContact O-N 3.01Å |
| 7 | L | 88.4 | Confident | 80 | Confident | 99 Ų | 99 | 115.9 Ų | 115.9 | 52% | 0.518 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -64.1 | -42.9 | 178 | -171.4 | 68.2 | 0 | 0 | 0 | 112.5 | L3 L4 R5 L10 L11 | L3-L7 PolarHBondContact O-N 3.31Å; L4-L7 PolarHBondContact O-N 3.22Å; R5-L7 VanDerWaalsContact C-N 3.34Å; L7-L10 PolarHBondContact O-N 3.49Å; L7-L11 HydrophobicContact CG-CD1 4.13Å; L7-L11 WeakPolarHBondContact O-CG 3.5Å; L7-L11 PolarHBondContact O-N 3.45Å |
| 8 | I | 85.6 | Confident | 78.6 | Confident | 93 Ų | 93 | 112.8 Ų | 112.8 | 48% | 0.477 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -62.9 | -44.9 | 176.7 | -66.4 | 163.2 | 0 | 0 | 0 | 110.5 | L4 R5 L10 L11 S12 | L4-I8 HydrophobicContact CD1-CD1 4.5Å; L4-I8 HydrophobicContact CG-CD1 4.09Å; L4-I8 WeakPolarHBondContact O-CD1 3.06Å; L4-I8 VanDerWaalsContact O-CG1 3.27Å; L4-I8 WeakPolarHBondContact O-CG1 3.42Å; L4-I8 PolarHBondContact O-N 3.29Å; R5-I8 PolarHBondContact O-N 2.74Å; I8-L10 VanDerWaalsContact C-N 3.34Å; I8-L10 PolarHBondContact O-N 2.75Å; I8-L11 PolarHBondContact O-N 3.48Å; I8-S12 WeakPolarHBondContact O-CB 3.45Å; I8-S12 PolarHBondContact O-N 3.48Å; I8-S12 PolarHBondContact O-OG 3.46Å; I8-S12 VanDerWaalsContact O-OG 3.08Å |
| 9 | L | 85.3 | Confident | 77.3 | Confident | 125 Ų | 125 | 110.6 Ų | 110.6 | 65% | 0.654 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -58.7 | -43.8 | 176.7 | -82.9 | 156.9 | 0 | 0 | 0 | 112.1 | R5 V6 W13 | R5-L9 PolarHBondContact O-N 3.41Å; R5-L9 WeakPolarHBondContact O-CG 3.44Å; R5-L9 WeakPolarHBondContact O-CB 3.35Å; R5-L9 WeakPolarHBondContact O-CD1 3.43Å; V6-L9 PolarHBondContact O-N 3.02Å; L9-W13 WeakPolarHBondContact O-CB 3.45Å; L9-W13 PolarHBondContact O-N 3.12Å |
| 10 | L | 86.4 | Confident | 75.9 | Confident | 109 Ų | 109 | 109.6 Ų | 109.6 | 57% | 0.571 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -64 | -44.7 | 177.1 | -102.6 | 138 | 0 | 0 | 0 | 112.5 | V6 L7 I8 W13 A14 | V6-L10 HydrophobicContact CG1-CD1 3.92Å; V6-L10 PolarHBondContact O-N 3.01Å; L7-L10 PolarHBondContact O-N 3.49Å; I8-L10 VanDerWaalsContact C-N 3.34Å; I8-L10 PolarHBondContact O-N 2.75Å; L10-W13 PolarHBondContact O-N 3.03Å; L10-A14 WeakPolarHBondContact O-CB 3.47Å; L10-A14 PolarHBondContact O-N 3.2Å |
| 11 | L | 83.6 | Confident | 75 | Confident | 111 Ų | 111 | 108.9 Ų | 108.9 | 58% | 0.581 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -66.6 | -41.3 | 179 | -73.8 | 167.4 | 0 | 0 | 0 | 111.9 | L7 I8 W13 A14 A15 | L7-L11 HydrophobicContact CG-CD1 4.13Å; L7-L11 WeakPolarHBondContact O-CG 3.5Å; L7-L11 PolarHBondContact O-N 3.45Å; I8-L11 PolarHBondContact O-N 3.48Å; L11-W13 VanDerWaalsContact C-N 3.34Å; L11-A14 PolarHBondContact O-N 3.44Å; L11-A15 PolarHBondContact O-N 3.03Å; L11-A15 WeakPolarHBondContact O-CB 3.49Å |
| 12 | S | 77.4 | Confident | 74.1 | Confident | 77 Ų | 77 | 108.8 Ų | 108.8 | 54% | 0.538 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -64.7 | -38.4 | 175.5 | -62.9 | 0 | 0 | 0 | 0 | 112.3 | I8 G16 | I8-S12 WeakPolarHBondContact O-CB 3.45Å; I8-S12 PolarHBondContact O-N 3.48Å; I8-S12 PolarHBondContact O-OG 3.46Å; I8-S12 VanDerWaalsContact O-OG 3.08Å; S12-G16 PolarHBondContact O-N 3.46Å |
| 13 | W | 80.1 | Confident | 72.5 | Confident | 184 Ų | 184 | 114.6 Ų | 114.6 | 70% | 0.697 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -65.5 | -46.4 | 175.5 | -174.3 | -94 | 0 | 0 | 0 | 112 | L9 L10 L11 A15 G16 M17 | L9-W13 WeakPolarHBondContact O-CB 3.45Å; L9-W13 PolarHBondContact O-N 3.12Å; L10-W13 PolarHBondContact O-N 3.03Å; L11-W13 VanDerWaalsContact C-N 3.34Å; W13-A15 VanDerWaalsContact C-N 3.34Å; W13-A15 PolarHBondContact O-N 2.88Å; W13-G16 PolarHBondContact O-N 2.97Å; W13-M17 HydrophobicContact CZ2-SD 4.39Å; W13-M17 PolarHBondContact NE1-SD 3.36Å; W13-M17 PolarHBondContact O-N 3.44Å |
| 14 | A | 76.8 | Confident | 70.8 | Confident | 64 Ų | 64 | 119.5 Ų | 119.5 | 53% | 0.529 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -62.4 | -39.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | L10 L11 G18 | L10-A14 WeakPolarHBondContact O-CB 3.47Å; L10-A14 PolarHBondContact O-N 3.2Å; L11-A14 PolarHBondContact O-N 3.44Å; A14-G18 PolarHBondContact O-N 3Å |
| 15 | A | 67.8 | Low | 69.2 | Low | 73 Ų | 73 | 120.8 Ų | 120.8 | 60% | 0.603 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -68 | -34 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | L11 W13 | L11-A15 PolarHBondContact O-N 3.03Å; L11-A15 WeakPolarHBondContact O-CB 3.49Å; W13-A15 VanDerWaalsContact C-N 3.34Å; W13-A15 PolarHBondContact O-N 2.88Å |
| 16 | G | 64 | Low | 67.4 | Low | 55 Ų | 55 | 117 Ų | 117 | 57% | 0.567 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -72.9 | -31.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114 | S12 W13 | S12-G16 PolarHBondContact O-N 3.46Å; W13-G16 PolarHBondContact O-N 2.97Å |
| 17 | M | 61 | Low | 65.6 | Low | 139 Ų | 139 | 123.7 Ų | 123.7 | 69% | 0.685 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -78.7 | -20.2 | 177.1 | -77.9 | -177.2 | 46 | 0 | 0 | 114 | W13 | W13-M17 HydrophobicContact CZ2-SD 4.39Å; W13-M17 PolarHBondContact NE1-SD 3.36Å; W13-M17 PolarHBondContact O-N 3.44Å |
| 18 | G | 54.4 | Low | 64 | Low | 60 Ų | 60 | 123.7 Ų | 123.7 | 62% | 0.619 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.8 | -3.6 | -178.4 | 0 | 0 | 0 | 0 | 0 | 115.6 | A14 P20 | A14-G18 PolarHBondContact O-N 3Å; G18-P20 WeakPolarHBondContact O-CD 3.48Å |
| 19 | A | 52.8 | Low | 62.5 | Low | 72 Ų | 72 | 123.9 Ų | 123.9 | 60% | 0.595 | 68% | 0.683 | S | S | * | * | | | trans | -101.6 | 93 | 179 | 0 | 0 | 0 | 0 | 0 | 110.4 | A21 | A19-A21 PolarHBondContact O-N 2.98Š|
| 20 | P | 50.5 | Low | 61.1 | Low | 89 Ų | 89 | 123.4 Ų | 123.4 | 58% | 0.578 | 69% | 0.687 | S | S | * | * | | | trans | -63.4 | 115.4 | 163.6 | 26.8 | -30.6 | 0 | 0 | 0 | 107 | G18 R22 | G18-P20 WeakPolarHBondContact O-CD 3.48Å; P20-R22 HydrophobicContact CB-CG 4.46Å; P20-R22 PolarHBondContact O-N 2.95Å |
| 21 | A | 56.9 | Low | 59.7 | Low | 96 Ų | 96 | 123.8 Ų | 123.8 | 79% | 0.793 | 70% | 0.696 | S | S | * | * | | | trans | -52.4 | 90.9 | 163.9 | 0 | 0 | 0 | 0 | 0 | 109 | A19 W23 | A19-A21 PolarHBondContact O-N 2.98Å; A21-W23 PolarHBondContact O-N 3.37Å |
| 22 | R | 54.4 | Low | 57.9 | Low | 208 Ų | 208 | 124.6 Ų | 124.6 | 79% | 0.785 | 71% | 0.708 | S | S | * | * | | | trans | -96.5 | 85.3 | 168.1 | -66.5 | -164.5 | -148.1 | -148.3 | 6.4 | 108.9 | P20 R24 | P20-R22 HydrophobicContact CB-CG 4.46Å; P20-R22 PolarHBondContact O-N 2.95Å; R22-R24 PolarHBondContact O-N 3.39Å |
| 23 | W | 49.1 | Very low | 56.6 | Low | 235 Ų | 235 | 131.9 Ų | 131.9 | 89% | 0.89 | 72% | 0.723 | S | S | * | * | | | trans | 46.7 | 73.4 | 140.2 | -66.3 | 82.2 | 0 | 0 | 0 | 116.3 | A21 I25 | A21-W23 PolarHBondContact O-N 3.37Å; W23-I25 PolarHBondContact O-N 3.05Å |
| 24 | R | 51.5 | Low | 55.1 | Low | 250 Ų | 250 | 129.3 Ų | 129.3 | 94% | 0.943 | 73% | 0.731 | S | S | * | * | | | trans | -85.2 | 99.1 | 151.5 | -81.1 | -173.3 | -178.8 | -174.4 | 1.7 | 107.9 | R22 | R22-R24 PolarHBondContact O-N 3.39Š|
| 25 | I | 54.5 | Low | 53.4 | Low | 140 Ų | 140 | 131 Ų | 131 | 72% | 0.718 | 75% | 0.745 | S | S | * | * | | | trans | -32.6 | 135.5 | 168.4 | -63 | 150.7 | 0 | 0 | 0 | 110.8 | W23 K27 | W23-I25 PolarHBondContact O-N 3.05Å; I25-K27 PolarHBondContact O-N 3.31Å |
| 26 | P | 46.9 | Very low | 52.6 | Low | 108 Ų | 108 | 131.8 Ų | 131.8 | 70% | 0.701 | 75% | 0.751 | S | S | * | * | | | trans | -61.1 | 113.4 | -179.5 | 24.3 | -31.7 | 0 | 0 | 0 | 109.1 | S28 | P26-S28 PolarHBondContact O-N 2.92Š|
| 27 | K | 51 | Low | 51.8 | Low | 211 Ų | 211 | 137.9 Ų | 137.9 | 92% | 0.917 | 76% | 0.764 | S | S | * | * | | | trans | -81.1 | 59.3 | 176.7 | -143.8 | 159.9 | -172.2 | 169.9 | 0 | 109 | I25 | I25-K27 PolarHBondContact O-N 3.31Š|
| 28 | S | 54.6 | Low | 50.9 | Low | 98 Ų | 98 | 136.8 Ų | 136.8 | 69% | 0.685 | 77% | 0.766 | S | S | * | * | | | trans | -99.6 | 72.3 | 170.2 | 61.8 | 0 | 0 | 0 | 0 | 109 | P26 | P26-S28 PolarHBondContact O-N 2.92Š|
| 29 | S | 53.6 | Low | 50.5 | Low | 98 Ų | 98 | 145.8 Ų | 145.8 | 69% | 0.685 | 78% | 0.781 | S | S | * | * | S | Bend | trans | -177.5 | 134.6 | 146.2 | 38.9 | 0 | 0 | 0 | 0 | 109.2 | | |
| 30 | P | 56.2 | Low | 50.1 | Low | 115 Ų | 115 | 145.2 Ų | 145.2 | 75% | 0.747 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 146.2 | 172.7 | 27.3 | -32 | 0 | 0 | 0 | 109.7 | | |
| 31 | P | 56.1 | Low | 50.1 | Low | 117 Ų | 117 | 150.3 Ų | 150.3 | 76% | 0.76 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 131.2 | 176.7 | 26.2 | -32.7 | 0 | 0 | 0 | 109.1 | R33 | P31-R33 PolarHBondContact O-N 2.99Š|
| 32 | P | 46.9 | Very low | 49.7 | Very low | 127 Ų | 127 | 150.2 Ų | 150.2 | 83% | 0.825 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 125.3 | 166.8 | 26.7 | -29.1 | 0 | 0 | 0 | 107.2 | | |
| 33 | R | 49 | Very low | 49.4 | Very low | 230 Ų | 230 | 145.5 Ų | 145.5 | 87% | 0.868 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -48.3 | 151.1 | 170.3 | -78.7 | 178.2 | 174.5 | 167.9 | -2.3 | 110.4 | P31 A35 | P31-R33 PolarHBondContact O-N 2.99Å; R33-A35 PolarHBondContact O-N 3.43Å |
| 34 | P | 49.5 | Very low | 49.5 | Very low | 131 Ų | 131 | 138 Ų | 138 | 85% | 0.851 | 76% | 0.762 | S | S | * | * | | | trans | -71.5 | 104.3 | -175.7 | 30.6 | -31.7 | 0 | 0 | 0 | 109 | A36 | P34-A36 PolarHBondContact O-N 3.36Š|
| 35 | A | 41.5 | Very low | 49.4 | Very low | 100 Ų | 100 | 133.4 Ų | 133.4 | 83% | 0.826 | 76% | 0.755 | S | S | * | * | | | trans | -78.7 | 118.3 | 161.8 | 0 | 0 | 0 | 0 | 0 | 107.3 | R33 | R33-A35 PolarHBondContact O-N 3.43Š|
| 36 | A | 49.1 | Very low | 49.1 | Very low | 88 Ų | 88 | 134.8 Ų | 134.8 | 73% | 0.727 | 76% | 0.758 | S | S | * | * | | | trans | -55 | 165.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | P34 | P34-A36 PolarHBondContact O-N 3.36Š|
| 37 | Q | 47.8 | Very low | 49.1 | Very low | 183 Ų | 183 | 137.1 Ų | 137.1 | 86% | 0.855 | 76% | 0.764 | S | S | * | * | | | trans | 76.4 | 122.4 | 170.9 | -63.7 | 175.2 | -17.1 | 0 | 0 | 113.6 | | |
| 38 | T | 42.5 | Very low | 49.6 | Very low | 117 Ų | 117 | 130.9 Ų | 130.9 | 72% | 0.718 | 76% | 0.759 | S | S | * | * | | | | -166.6 | 134.3 | 68.3 | -59.4 | 0 | 0 | 0 | 0 | 111.4 | | |
| 39 | R | 45.6 | Very low | 49.5 | Very low | 248 Ų | 248 | 132.2 Ų | 132.2 | 94% | 0.936 | 77% | 0.769 | S | S | * | * | | | trans | 56.2 | 103.2 | 154.1 | -75.8 | 175.2 | 168.6 | -174.5 | -3.3 | 119.4 | | |
| 40 | G | 44.1 | Very low | 49 | Very low | 61 Ų | 61 | 131.9 Ų | 131.9 | 63% | 0.629 | 77% | 0.766 | S | S | * | * | | | trans | 150.5 | 105.3 | 147.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | L42 | G40-L42 PolarHBondContact O-N 3.01Š|
| 41 | K | 51.3 | Low | 48.9 | Very low | 196 Ų | 196 | 132.3 Ų | 132.3 | 85% | 0.852 | 76% | 0.76 | S | S | * | * | | | trans | -64.7 | 78.8 | 169.8 | -81.4 | 179.8 | 174.1 | -176.8 | 0 | 108.6 | A56 | K41-A56 WeakPolarHBondContact O-CB 3.27Š|
| 42 | L | 47.8 | Very low | 48.7 | Very low | 94 Ų | 94 | 130 Ų | 130 | 49% | 0.492 | 74% | 0.744 | S | S | . | * | | | trans | -100.2 | 101 | 162.2 | -82.8 | 149.4 | 0 | 0 | 0 | 105 | G40 C44 L53 | G40-L42 PolarHBondContact O-N 3.01Å; L42-C44 VanDerWaalsContact C-N 3.35Å; L42-C44 PolarHBondContact O-N 3.28Å; L42-L53 HydrophobicContact CD2-CD2 4.39Å |
| 43 | C | 48.7 | Very low | 49 | Very low | 109 Ų | 109 | 129.5 Ų | 129.5 | 74% | 0.736 | 73% | 0.733 | S | S | * | * | | | trans | -69 | 97.5 | 170.5 | -78.4 | 0 | 0 | 0 | 0 | 107.6 | L45 | C43-L45 PolarHBondContact O-N 3.08Š|
| 44 | C | 51 | Low | 49.3 | Very low | 78 Ų | 78 | 126.3 Ų | 126.3 | 53% | 0.527 | 72% | 0.723 | S | S | . | * | | | trans | -82.6 | 111 | 171.8 | -64.7 | 0 | 0 | 0 | 0 | 108.9 | L42 | L42-C44 VanDerWaalsContact C-N 3.35Å; L42-C44 PolarHBondContact O-N 3.28Å |
| 45 | L | 50.5 | Low | 49.3 | Very low | 152 Ų | 152 | 125.7 Ų | 125.7 | 80% | 0.796 | 72% | 0.719 | S | S | * | * | | | trans | -91.4 | 111.1 | 162.7 | -76.7 | 164.9 | 0 | 0 | 0 | 107.6 | C43 L47 | C43-L45 PolarHBondContact O-N 3.08Å; L45-L47 PolarHBondContact O-N 3.09Å |
| 46 | Q | 48.1 | Very low | 50 | Low | 170 Ų | 170 | 124 Ų | 124 | 79% | 0.794 | 70% | 0.704 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -78.5 | 113.8 | 171.5 | -86.7 | -177 | -44.3 | 0 | 0 | 109.4 | | |
| 47 | L | 45.6 | Very low | 49.9 | Very low | 157 Ų | 157 | 131.3 Ų | 131.3 | 82% | 0.822 | 71% | 0.713 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -110.7 | 96.8 | 164.2 | -142.7 | 85.2 | 0 | 0 | 0 | 108.4 | L45 S49 C50 | L45-L47 PolarHBondContact O-N 3.09Å; L47-S49 PolarHBondContact O-N 3.09Å; L47-C50 PolarHBondContact O-N 3.37Å |
| 48 | G | 63.1 | Low | 50.2 | Low | 79 Ų | 79 | 134.6 Ų | 134.6 | 81% | 0.814 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 66.4 | -87.6 | 173.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | | |
| 49 | S | 52.5 | Low | 50.3 | Low | 126 Ų | 126 | 138 Ų | 138 | 88% | 0.881 | 75% | 0.746 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -138 | 11.6 | -171.5 | -76.2 | 0 | 0 | 0 | 0 | 115.2 | L47 | L47-S49 PolarHBondContact O-N 3.09Š|
| 50 | C | 41.9 | Very low | 50.5 | Low | 92 Ų | 92 | 132.5 Ų | 132.5 | 62% | 0.622 | 74% | 0.736 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -119.8 | 122.9 | 173.3 | -69.6 | 0 | 0 | 0 | 0 | 110.4 | L47 V52 | L47-C50 PolarHBondContact O-N 3.37Å; C50-V52 PolarHBondContact O-N 2.99Å |
| 51 | I | 55.2 | Low | 50.9 | Low | 124 Ų | 124 | 136.2 Ų | 136.2 | 64% | 0.636 | 74% | 0.742 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -87.6 | 105.1 | 169.9 | -56.7 | 174.6 | 0 | 0 | 0 | 106.6 | L53 | I51-L53 HydrophobicContact CG2-CD2 4.11Å; I51-L53 HydrophobicContact CG2-CG 4.2Å |
| 52 | V | 52.1 | Low | 50.9 | Low | 68 Ų | 68 | 132.9 Ų | 132.9 | 41% | 0.412 | 74% | 0.736 | S | S | . | * | | | trans | -95.7 | 111.3 | 173.1 | -164.9 | 0 | 0 | 0 | 0 | 108.4 | C50 Y54 | C50-V52 PolarHBondContact O-N 2.99Å; V52-Y54 HydrophobicContact CB-CD2 4.32Å; V52-Y54 WeakPolarHBondContact CG1-OH 3.37Å; V52-Y54 HydrophobicContact CG1-CE2 3.23Å; V52-Y54 HydrophobicContact CG1-CE1 4.04Å; V52-Y54 HydrophobicContact CG1-CD2 3.93Å; V52-Y54 HydrophobicContact CB-CE2 3.67Å |
| 53 | L | 53 | Low | 51 | Low | 116 Ų | 116 | 135.2 Ų | 135.2 | 61% | 0.607 | 75% | 0.75 | S | S | * | * | | | trans | -87.3 | 111.6 | 177.9 | -66.2 | 168.8 | 0 | 0 | 0 | 108.8 | L42 I51 | L42-L53 HydrophobicContact CD2-CD2 4.39Å; I51-L53 HydrophobicContact CG2-CD2 4.11Å; I51-L53 HydrophobicContact CG2-CG 4.2Å |
| 54 | Y | 54.9 | Low | 51.2 | Low | 164 Ų | 164 | 136.8 Ų | 136.8 | 64% | 0.643 | 75% | 0.751 | S | S | * | * | | | trans | -106 | 136.1 | 171 | -63.9 | -82.6 | 0 | 0 | 0 | 110.1 | V52 A56 | V52-Y54 HydrophobicContact CB-CD2 4.32Å; V52-Y54 WeakPolarHBondContact CG1-OH 3.37Å; V52-Y54 HydrophobicContact CG1-CE2 3.23Å; V52-Y54 HydrophobicContact CG1-CE1 4.04Å; V52-Y54 HydrophobicContact CG1-CD2 3.93Å; V52-Y54 HydrophobicContact CB-CE2 3.67Å; Y54-A56 PolarHBondContact O-N 3.36Å |
| 55 | P | 49.6 | Very low | 51.2 | Low | 118 Ų | 118 | 140.7 Ų | 140.7 | 77% | 0.766 | 77% | 0.766 | S | S | * | * | | | trans | -66.7 | 122.4 | 168.6 | 26.7 | -30.5 | 0 | 0 | 0 | 108.9 | R57 | P55-R57 PolarHBondContact O-N 3.49Š|
| 56 | A | 55 | Low | 51.2 | Low | 63 Ų | 63 | 139.9 Ų | 139.9 | 52% | 0.521 | 76% | 0.764 | S | S | . | * | | | trans | -65.3 | 105.1 | 172.3 | 0 | 0 | 0 | 0 | 0 | 108.8 | K41 Y54 R58 | K41-A56 WeakPolarHBondContact O-CB 3.27Å; Y54-A56 PolarHBondContact O-N 3.36Å; A56-R58 PolarHBondContact O-N 3.43Å; A56-R58 VanDerWaalsContact O-N 3.12Å |
| 57 | R | 48.9 | Very low | 51.5 | Low | 243 Ų | 243 | 137.6 Ų | 137.6 | 92% | 0.917 | 76% | 0.762 | S | S | * | * | | | trans | -65.3 | 111.7 | 175.1 | -147.7 | -178.4 | -154 | -141 | 5.9 | 107.7 | P55 S59 | P55-R57 PolarHBondContact O-N 3.49Å; R57-S59 PolarHBondContact O-N 3.05Å |
| 58 | R | 53 | Low | 52 | Low | 252 Ų | 252 | 136 Ų | 136 | 95% | 0.951 | 76% | 0.757 | S | S | * | * | | | trans | -67.2 | 115.7 | 169.2 | -99.9 | 179.6 | 174.5 | 165.7 | -3.2 | 108.2 | A56 | A56-R58 PolarHBondContact O-N 3.43Å; A56-R58 VanDerWaalsContact O-N 3.12Å |
| 59 | S | 44.8 | Very low | 51 | Low | 187 Ų | 187 | 141.2 Ų | 141.2 | 100% | 1.308 | 75% | 0.751 | S | S | * | * | | | trans | -143.1 | 0 | 152.1 | -173.2 | 0 | 0 | 0 | 0 | 108.7 | R57 | R57-S59 PolarHBondContact O-N 3.05Š|