| 1 | M | 46.1 | Very low | 57.9 | Low | 248 Ų | 248 | 118.4 Ų | 118.4 | 100% | 1.222 | 67% | 0.674 | S | S | * | * | | | | 0 | 111.7 | 0 | -66 | 167.8 | 99.4 | 0 | 0 | 106.9 | | |
| 2 | S | 57.4 | Low | 59 | Low | 114 Ų | 114 | 114.5 Ų | 114.5 | 80% | 0.797 | 65% | 0.649 | S | S | * | * | | | trans | -89 | 112 | -171.1 | 47.7 | 0 | 0 | 0 | 0 | 111 | | |
| 3 | H | 57 | Low | 59.7 | Low | 175 Ų | 175 | 115 Ų | 115 | 81% | 0.81 | 65% | 0.649 | S | S | * | * | | | trans | -106.4 | 101.8 | 159 | -175.7 | -81 | 0 | 0 | 0 | 107.7 | | |
| 4 | V | 60.4 | Low | 61 | Low | 101 Ų | 101 | 116.9 Ų | 116.9 | 61% | 0.612 | 65% | 0.65 | S | S | * | * | | | trans | -84.3 | 108.8 | -180 | 171.3 | 0 | 0 | 0 | 0 | 107.3 | V6 | V4-V6 HydrophobicContact CG1-CB 3.82Å; V4-V6 HydrophobicContact CG1-CG2 3.2Å; V4-V6 PolarHBondContact O-N 2.97Å |
| 5 | A | 64.6 | Low | 61.9 | Low | 81 Ų | 81 | 117.1 Ų | 117.1 | 67% | 0.669 | 64% | 0.644 | S | S | * | * | | | trans | -77.1 | 74.7 | 173.5 | 0 | 0 | 0 | 0 | 0 | 109.8 | | |
| 6 | V | 59.4 | Low | 62.5 | Low | 102 Ų | 102 | 118.3 Ų | 118.3 | 62% | 0.618 | 64% | 0.641 | S | S | * | * | | | trans | -104 | -7.3 | 177.8 | 164.5 | 0 | 0 | 0 | 0 | 112.7 | V4 | V4-V6 HydrophobicContact CG1-CB 3.82Å; V4-V6 HydrophobicContact CG1-CG2 3.2Å; V4-V6 PolarHBondContact O-N 2.97Å |
| 7 | E | 56.8 | Low | 63.2 | Low | 186 Ų | 186 | 116.1 Ų | 116.1 | 87% | 0.869 | 64% | 0.643 | S | S | * | * | S | Bend | trans | -94.7 | -9.2 | -175 | -51.5 | -159.6 | 171.5 | 0 | 0 | 114 | | |
| 8 | N | 57.1 | Low | 63.6 | Low | 95 Ų | 95 | 113.4 Ų | 113.4 | 51% | 0.508 | 65% | 0.646 | S | S | . | * | S | Bend | trans | -104.9 | -4.3 | 178.4 | -163.3 | 45.6 | 0 | 0 | 0 | 114.2 | L10 G11 L12 | N8-L10 VanDerWaalsContact C-N 3.34Å; N8-G11 PolarHBondContact O-N 3.42Å; N8-L12 PolarHBondContact O-N 3.24Å |
| 9 | A | 57.2 | Low | 64.4 | Low | 55 Ų | 55 | 113.7 Ų | 113.7 | 46% | 0.455 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -67 | -38.2 | 177 | 0 | 0 | 0 | 0 | 0 | 111.5 | G11 L12 | A9-G11 PolarHBondContact O-N 3.37Å; A9-L12 PolarHBondContact O-N 3.21Å |
| 10 | L | 56.8 | Low | 65 | Low | 127 Ų | 127 | 113.2 Ų | 113.2 | 67% | 0.665 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -66.3 | -19.3 | 175.2 | -55.9 | 178.5 | 0 | 0 | 0 | 112.7 | N8 Q14 | N8-L10 VanDerWaalsContact C-N 3.34Å; L10-Q14 WeakPolarHBondContact O-CG 3.1Å; L10-Q14 PolarHBondContact O-NE2 3.02Å |
| 11 | G | 64.1 | Low | 65.1 | Low | 18 Ų | 18 | 116.5 Ų | 116.5 | 19% | 0.186 | 66% | 0.655 | C | S | . | * | H | α-helix | trans | -86.6 | -31.4 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | N8 A9 Q15 | N8-G11 PolarHBondContact O-N 3.42Å; A9-G11 PolarHBondContact O-N 3.37Å; G11-Q15 WeakPolarHBondContact O-CB 3.4Å; G11-Q15 WeakPolarHBondContact O-CG 3.38Å; G11-Q15 PolarHBondContact O-N 3.04Å |
| 12 | L | 70.6 | Confident | 66.2 | Low | 72 Ų | 72 | 111.2 Ų | 111.2 | 38% | 0.377 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -72.9 | -46.8 | -174.9 | -66.7 | 175.9 | 0 | 0 | 0 | 111.7 | N8 A9 Q14 Q15 F16 | N8-L12 PolarHBondContact O-N 3.24Å; A9-L12 PolarHBondContact O-N 3.21Å; L12-Q14 VanDerWaalsContact C-N 3.27Å; L12-Q14 PolarHBondContact O-N 2.95Å; L12-Q15 WeakPolarHBondContact O-CB 3.41Å; L12-Q15 PolarHBondContact O-N 3.45Å; L12-Q15 VanDerWaalsContact O-N 3.1Å; L12-F16 HydrophobicContact CB-CE2 4.43Å; L12-F16 WeakPolarHBondContact O-CD2 3.43Å; L12-F16 PolarHBondContact O-N 3.44Å; L12-F16 VanDerWaalsContact O-N 3.12Å |
| 13 | D | 68.8 | Low | 66.5 | Low | 121 Ų | 121 | 110 Ų | 110 | 65% | 0.647 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -65.7 | -34.5 | -178.7 | -57.7 | -31.4 | 0 | 0 | 0 | 111.4 | F16 A17 | D13-F16 PolarHBondContact O-N 3.12Å; D13-A17 WeakPolarHBondContact O-CB 2.99Å; D13-A17 PolarHBondContact O-N 3.1Å |
| 14 | Q | 77.5 | Confident | 66.7 | Low | 141 Ų | 141 | 106.8 Ų | 106.8 | 66% | 0.659 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -70.1 | -34.3 | 173.7 | -72.8 | 169.2 | 34.8 | 0 | 0 | 112.5 | L10 L12 F16 A17 | L10-Q14 WeakPolarHBondContact O-CG 3.1Å; L10-Q14 PolarHBondContact O-NE2 3.02Å; L12-Q14 VanDerWaalsContact C-N 3.27Å; L12-Q14 PolarHBondContact O-N 2.95Å; Q14-F16 VanDerWaalsContact C-N 3.32Å; Q14-A17 PolarHBondContact O-N 3.34Å |
| 15 | Q | 74.5 | Confident | 66.9 | Low | 120 Ų | 120 | 108 Ų | 108 | 56% | 0.561 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -65.9 | -34.2 | 174.6 | -78.4 | 169.4 | 13.9 | 0 | 0 | 112.3 | G11 L12 | G11-Q15 WeakPolarHBondContact O-CB 3.4Å; G11-Q15 WeakPolarHBondContact O-CG 3.38Å; G11-Q15 PolarHBondContact O-N 3.04Å; L12-Q15 WeakPolarHBondContact O-CB 3.41Å; L12-Q15 PolarHBondContact O-N 3.45Å; L12-Q15 VanDerWaalsContact O-N 3.1Å |
| 16 | F | 71 | Confident | 66.7 | Low | 136 Ų | 136 | 110.6 Ų | 110.6 | 60% | 0.596 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -84 | -25.1 | 176.7 | -63.3 | -63.5 | 0 | 0 | 0 | 113.4 | L12 D13 Q14 G18 L19 | L12-F16 HydrophobicContact CB-CE2 4.43Å; L12-F16 WeakPolarHBondContact O-CD2 3.43Å; L12-F16 PolarHBondContact O-N 3.44Å; L12-F16 VanDerWaalsContact O-N 3.12Å; D13-F16 PolarHBondContact O-N 3.12Å; Q14-F16 VanDerWaalsContact C-N 3.32Å; F16-G18 PolarHBondContact O-N 3.2Å; F16-L19 HydrophobicContact CD1-CD1 3.78Å; F16-L19 HydrophobicContact CE1-CD1 4.4Å; F16-L19 PolarHBondContact O-N 3.21Å; F16-L19 VanDerWaalsContact O-N 3.12Å |
| 17 | A | 75 | Confident | 66.6 | Low | 82 Ų | 82 | 115.3 Ų | 115.3 | 68% | 0.678 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -62.2 | -23.7 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | D13 Q14 | D13-A17 WeakPolarHBondContact O-CB 2.99Å; D13-A17 PolarHBondContact O-N 3.1Å; Q14-A17 PolarHBondContact O-N 3.34Å |
| 18 | G | 71.2 | Confident | 66.9 | Low | 67 Ų | 67 | 111.5 Ų | 111.5 | 69% | 0.691 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.4 | -1.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | F16 D20 | F16-G18 PolarHBondContact O-N 3.2Å; G18-D20 VanDerWaalsContact C-N 3.26Å; G18-D20 PolarHBondContact O-N 3.12Å |
| 19 | L | 77.9 | Confident | 67 | Low | 119 Ų | 119 | 110.4 Ų | 110.4 | 62% | 0.623 | 65% | 0.647 | S | S | * | * | | | trans | -93.4 | 37.6 | -177.7 | -61.9 | 175.7 | 0 | 0 | 0 | 112.1 | F16 L21 | F16-L19 HydrophobicContact CD1-CD1 3.78Å; F16-L19 HydrophobicContact CE1-CD1 4.4Å; F16-L19 PolarHBondContact O-N 3.21Å; F16-L19 VanDerWaalsContact O-N 3.12Å; L19-L21 PolarHBondContact O-N 3.33Å |
| 20 | D | 76.4 | Confident | 66.9 | Low | 104 Ų | 104 | 109.8 Ų | 109.8 | 56% | 0.556 | 65% | 0.646 | S | S | * | * | | | trans | -67.5 | 115.7 | 175.3 | -178 | 21.5 | 0 | 0 | 0 | 110.5 | G18 N22 S23 | G18-D20 VanDerWaalsContact C-N 3.26Å; G18-D20 PolarHBondContact O-N 3.12Å; D20-N22 PolarHBondContact O-N 2.93Å; D20-N22 VanDerWaalsContact OD1-CB 3.31Å; D20-N22 WeakPolarHBondContact OD1-CB 3.31Å; D20-N22 PolarHBondContact OD1-N 3.3Å; D20-S23 PolarHBondContact O-N 3.38Å |
| 21 | L | 68.2 | Low | 66.8 | Low | 182 Ų | 182 | 107.7 Ų | 107.7 | 95% | 0.953 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.7 | -9.5 | 176 | -64.3 | 173.5 | 0 | 0 | 0 | 112.7 | L19 | L19-L21 PolarHBondContact O-N 3.33Š|
| 22 | N | 67.6 | Low | 66.4 | Low | 137 Ų | 137 | 113.6 Ų | 113.6 | 73% | 0.733 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.2 | 6.9 | 177 | -120.6 | -23.9 | 0 | 0 | 0 | 113.6 | D20 S24 | D20-N22 PolarHBondContact O-N 2.93Å; D20-N22 VanDerWaalsContact OD1-CB 3.31Å; D20-N22 WeakPolarHBondContact OD1-CB 3.31Å; D20-N22 PolarHBondContact OD1-N 3.3Å; N22-S24 PolarHBondContact O-N 2.85Å |
| 23 | S | 63.7 | Low | 65.8 | Low | 88 Ų | 88 | 112.6 Ų | 112.6 | 62% | 0.615 | 68% | 0.676 | S | S | * | * | | | trans | -64.9 | 94 | 173.8 | -172.3 | 0 | 0 | 0 | 0 | 110.3 | D20 D25 | D20-S23 PolarHBondContact O-N 3.38Å; S23-D25 PolarHBondContact O-N 3.21Å |
| 24 | S | 62.6 | Low | 65.4 | Low | 108 Ų | 108 | 110.7 Ų | 110.7 | 76% | 0.755 | 67% | 0.673 | S | S | * | * | | | trans | -83.3 | 15.9 | -178.1 | 64.4 | 0 | 0 | 0 | 0 | 113.8 | N22 N26 | N22-S24 PolarHBondContact O-N 2.85Å; S24-N26 PolarHBondContact O-N 3.45Å |
| 25 | D | 63.9 | Low | 64.7 | Low | 127 Ų | 127 | 109.8 Ų | 109.8 | 68% | 0.679 | 67% | 0.666 | S | S | * | * | | | trans | -86.7 | 92.9 | -174.9 | -70.9 | -22.7 | 0 | 0 | 0 | 110.7 | S23 | S23-D25 PolarHBondContact O-N 3.21Š|
| 26 | N | 59.5 | Low | 64.3 | Low | 135 Ų | 135 | 108 Ų | 108 | 72% | 0.722 | 68% | 0.679 | S | S | * | * | | | trans | 85.9 | 83.5 | 153 | -48.7 | -48.6 | 0 | 0 | 0 | 115.7 | S24 S28 | S24-N26 PolarHBondContact O-N 3.45Å; N26-S28 PolarHBondContact O-N 3.3Å |
| 27 | Q | 58.8 | Low | 64.7 | Low | 202 Ų | 202 | 110 Ų | 110 | 94% | 0.944 | 68% | 0.683 | S | S | * | * | | | trans | -65.1 | 47.2 | 149.5 | -61.2 | -176.1 | -61.9 | 0 | 0 | 111.4 | G29 | Q27-G29 PolarHBondContact O-N 3.04Š|
| 28 | S | 63.1 | Low | 65.3 | Low | 105 Ų | 105 | 114.5 Ų | 114.5 | 73% | 0.734 | 68% | 0.684 | S | S | * | * | | | trans | -85.7 | 110 | 174.3 | -171.1 | 0 | 0 | 0 | 0 | 109.2 | N26 | N26-S28 PolarHBondContact O-N 3.3Š|
| 29 | G | 58.6 | Low | 65.9 | Low | 73 Ų | 73 | 115.5 Ų | 115.5 | 75% | 0.753 | 67% | 0.672 | S | S | * | * | S | Bend | trans | 76.1 | 86.1 | 146.8 | 0 | 0 | 0 | 0 | 0 | 117.2 | Q27 | Q27-G29 PolarHBondContact O-N 3.04Š|
| 30 | G | 55 | Low | 66.3 | Low | 42 Ų | 42 | 111.4 Ų | 111.4 | 43% | 0.433 | 65% | 0.653 | S | S | . | * | S | Bend | trans | 159.3 | 86.6 | 150.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | K35 | G30-K35 WeakPolarHBondContact O-CD 3.46Å; G30-K35 WeakPolarHBondContact O-CE 3.19Å; G30-K35 VanDerWaalsContact O-CG 3.3Å; G30-K35 WeakPolarHBondContact O-CG 3.5Å; G30-K35 PolarHBondContact O-NZ 3.49Å |
| 31 | S | 54.8 | Low | 66.5 | Low | 82 Ų | 82 | 110.1 Ų | 110.1 | 57% | 0.573 | 65% | 0.65 | S | S | * | * | | | trans | 32.4 | 105.7 | 163.2 | -163.5 | 0 | 0 | 0 | 0 | 117.7 | A33 S34 | S31-A33 PolarHBondContact O-N 2.77Å; S31-S34 PolarHBondContact O-N 3.06Å; S31-S34 VanDerWaalsContact O-N 3.08Å |
| 32 | T | 56.3 | Low | 67.3 | Low | 143 Ų | 143 | 108.1 Ų | 108.1 | 88% | 0.877 | 64% | 0.636 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.2 | -1.5 | 176.6 | 44.5 | 0 | 0 | 0 | 0 | 115.6 | | |
| 33 | A | 56.8 | Low | 67.9 | Low | 51 Ų | 51 | 104.5 Ų | 104.5 | 42% | 0.421 | 62% | 0.616 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -91.6 | -20.2 | 173.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | S31 R37 | S31-A33 PolarHBondContact O-N 2.77Å; A33-R37 PolarHBondContact O-NE 3.38Å; A33-R37 PolarHBondContact O-NH2 3.29Å |
| 34 | S | 60.8 | Low | 68.8 | Low | 81 Ų | 81 | 106.7 Ų | 106.7 | 57% | 0.566 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -124.3 | -16.5 | -161.9 | -44.6 | 0 | 0 | 0 | 0 | 115.8 | S31 G36 | S31-S34 PolarHBondContact O-N 3.06Å; S31-S34 VanDerWaalsContact O-N 3.08Å; S34-G36 PolarHBondContact O-N 2.81Å |
| 35 | K | 62.6 | Low | 69.4 | Low | 122 Ų | 122 | 107.1 Ų | 107.1 | 53% | 0.53 | 61% | 0.605 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -91.2 | 95.1 | -177.7 | 39.8 | 178.3 | 175.4 | -159.2 | 0 | 110.2 | G30 | G30-K35 WeakPolarHBondContact O-CD 3.46Å; G30-K35 WeakPolarHBondContact O-CE 3.19Å; G30-K35 VanDerWaalsContact O-CG 3.3Å; G30-K35 WeakPolarHBondContact O-CG 3.5Å; G30-K35 PolarHBondContact O-NZ 3.49Å |
| 36 | G | 66.6 | Low | 69.7 | Low | 81 Ų | 81 | 109.3 Ų | 109.3 | 84% | 0.835 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 132.1 | -4.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | S34 | S34-G36 PolarHBondContact O-N 2.81Š|
| 37 | R | 80.4 | Confident | 69.9 | Low | 179 Ų | 179 | 108.8 Ų | 108.8 | 68% | 0.675 | 60% | 0.597 | S | S | * | * | | | trans | -92.2 | 116.5 | 174.1 | -62.5 | -165.6 | -77.2 | -174.5 | 2 | 109.1 | A33 I39 | A33-R37 PolarHBondContact O-NE 3.38Å; A33-R37 PolarHBondContact O-NH2 3.29Å; R37-I39 PolarHBondContact O-N 3.23Å |
| 38 | Y | 85.6 | Confident | 69.8 | Low | 176 Ų | 176 | 103.4 Ų | 103.4 | 69% | 0.69 | 59% | 0.587 | S | S | * | * | | | trans | -59.3 | 121.1 | 172 | 172.8 | -98.9 | 0 | 0 | 0 | 109.7 | P40 P41 | Y38-P40 HydrophobicContact CD1-CG 4.4Å; Y38-P40 HydrophobicContact CE1-CB 4.25Å; Y38-P40 HydrophobicContact CE1-CG 4.03Å; Y38-P41 WeakPolarHBondContact OH-CD 3.3Å |
| 39 | I | 83.9 | Confident | 69.5 | Low | 88 Ų | 88 | 102.5 Ų | 102.5 | 45% | 0.451 | 58% | 0.577 | S | S | . | * | | | trans | -101.4 | 114.6 | 172.6 | -54.5 | 177.3 | 0 | 0 | 0 | 107.5 | R37 L43 R44 | R37-I39 PolarHBondContact O-N 3.23Å; I39-L43 HydrophobicContact CG2-CB 3.85Å; I39-R44 HydrophobicContact CB-CG 4.44Å; I39-R44 HydrophobicContact CG2-CG 4.02Å; I39-R44 PolarHBondContact O-NE 3.09Å |
| 40 | P | 86.5 | Confident | 69.4 | Low | 33 Ų | 33 | 105.3 Ų | 105.3 | 21% | 0.214 | 57% | 0.568 | C | S | . | * | | | trans | -51.2 | 142.9 | 175.8 | -25.3 | 31.1 | 0 | 0 | 0 | 111.5 | Y38 H42 L43 R44 | Y38-P40 HydrophobicContact CD1-CG 4.4Å; Y38-P40 HydrophobicContact CE1-CB 4.25Å; Y38-P40 HydrophobicContact CE1-CG 4.03Å; P40-H42 WeakPolarHBondContact CB-CE1 2.73Å; P40-H42 WeakPolarHBondContact CB-ND1 2.92Å; P40-H42 PolarHBondContact O-N 3.45Å; P40-L43 HydrophobicContact CB-CD1 4.39Å; P40-L43 HydrophobicContact CB-CG 4.27Å; P40-L43 HydrophobicContact CG-CD1 3.95Å; P40-L43 HydrophobicContact CG-CG 4.37Å; P40-L43 WeakPolarHBondContact O-CA 3.48Å; P40-L43 PolarHBondContact O-N 2.88Å; P40-R44 PolarHBondContact O-N 3.34Å |
| 41 | P | 82 | Confident | 69.4 | Low | 77 Ų | 77 | 106.9 Ų | 106.9 | 50% | 0.5 | 59% | 0.585 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -55.9 | -32.6 | -173.5 | 21.9 | -33.7 | 0 | 0 | 0 | 113.5 | Y38 L43 | Y38-P41 WeakPolarHBondContact OH-CD 3.3Å; P41-L43 VanDerWaalsContact C-N 3.29Å; P41-L43 PolarHBondContact O-N 2.77Å |
| 42 | H | 84.6 | Confident | 69.3 | Low | 141 Ų | 141 | 112 Ų | 112 | 65% | 0.653 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.7 | -14.2 | 177.2 | 62.6 | -90.5 | 0 | 0 | 0 | 114.1 | P40 | P40-H42 WeakPolarHBondContact CB-CE1 2.73Å; P40-H42 WeakPolarHBondContact CB-ND1 2.92Å; P40-H42 PolarHBondContact O-N 3.45Å |
| 43 | L | 80.3 | Confident | 69.1 | Low | 60 Ų | 60 | 112.9 Ų | 112.9 | 31% | 0.314 | 59% | 0.586 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -98.4 | -13.3 | 177.5 | -63.5 | -174.2 | 0 | 0 | 0 | 113.4 | I39 P40 P41 N45 R46 | I39-L43 HydrophobicContact CG2-CB 3.85Å; P40-L43 HydrophobicContact CB-CD1 4.39Å; P40-L43 HydrophobicContact CB-CG 4.27Å; P40-L43 HydrophobicContact CG-CD1 3.95Å; P40-L43 HydrophobicContact CG-CG 4.37Å; P40-L43 WeakPolarHBondContact O-CA 3.48Å; P40-L43 PolarHBondContact O-N 2.88Å; P41-L43 VanDerWaalsContact C-N 3.29Å; P41-L43 PolarHBondContact O-N 2.77Å; L43-N45 PolarHBondContact O-N 2.99Å; L43-N45 VanDerWaalsContact O-N 3.15Å; L43-R46 PolarHBondContact O-N 3.06Å |
| 44 | R | 82.3 | Confident | 69.1 | Low | 134 Ų | 134 | 115.8 Ų | 115.8 | 51% | 0.506 | 59% | 0.594 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -60.1 | -27.3 | -174.3 | -66.2 | 178.1 | -174.3 | 158.8 | -2.5 | 114.6 | I39 P40 | I39-R44 HydrophobicContact CB-CG 4.44Å; I39-R44 HydrophobicContact CG2-CG 4.02Å; I39-R44 PolarHBondContact O-NE 3.09Å; P40-R44 PolarHBondContact O-N 3.34Å |
| 45 | N | 74.6 | Confident | 68.9 | Low | 118 Ų | 118 | 121.5 Ų | 121.5 | 63% | 0.631 | 61% | 0.609 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -126.4 | 10.4 | -175.4 | -61.6 | -19.9 | 0 | 0 | 0 | 113.2 | L43 E47 A48 T49 | L43-N45 PolarHBondContact O-N 2.99Å; L43-N45 VanDerWaalsContact O-N 3.15Å; N45-E47 PolarHBondContact O-N 3.44Å; N45-E47 VanDerWaalsContact O-N 3.11Å; N45-A48 PolarHBondContact O-N 3.41Å; N45-T49 PolarHBondContact O-N 3.15Å; N45-T49 PolarHBondContact O-OG1 2.83Å |
| 46 | R | 71.5 | Confident | 68.7 | Low | 172 Ų | 172 | 122.3 Ų | 122.3 | 65% | 0.649 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -62 | -22.4 | -179.9 | -169 | 172 | -174.5 | 168.1 | 1.9 | 111.6 | L43 T49 K50 | L43-R46 PolarHBondContact O-N 3.06Å; R46-T49 PolarHBondContact O-OG1 2.91Å; R46-K50 PolarHBondContact O-N 2.66Å |
| 47 | E | 62 | Low | 68.2 | Low | 125 Ų | 125 | 122.2 Ų | 122.2 | 58% | 0.584 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -73.4 | -31.8 | 174.5 | -45.2 | 153.8 | -129.2 | 0 | 0 | 113.4 | N45 T49 K50 | N45-E47 PolarHBondContact O-N 3.44Å; N45-E47 VanDerWaalsContact O-N 3.11Å; E47-T49 VanDerWaalsContact C-N 3.34Å; E47-K50 WeakPolarHBondContact O-CG 3.16Å |
| 48 | A | 57.2 | Low | 67.2 | Low | 89 Ų | 89 | 118.2 Ų | 118.2 | 74% | 0.736 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -81 | -18.1 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | N45 | N45-A48 PolarHBondContact O-N 3.41Å |
| 49 | T | 57 | Low | 66.2 | Low | 86 Ų | 86 | 113.3 Ų | 113.3 | 53% | 0.528 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -97.8 | -11.3 | 179.2 | 40.7 | 0 | 0 | 0 | 0 | 113.6 | N45 R46 E47 G51 Y53 | N45-T49 PolarHBondContact O-N 3.15Å; N45-T49 PolarHBondContact O-OG1 2.83Å; R46-T49 PolarHBondContact O-OG1 2.91Å; E47-T49 VanDerWaalsContact C-N 3.34Å; T49-G51 VanDerWaalsContact C-N 3.32Å; T49-G51 PolarHBondContact O-N 3.08Å; T49-Y53 PolarHBondContact O-OH 3.12Å; T49-Y53 VanDerWaalsContact O-OH 3.14Å |
| 50 | K | 56.6 | Low | 64.7 | Low | 131 Ų | 131 | 120.3 Ų | 120.3 | 57% | 0.57 | 63% | 0.629 | S | S | * | * | | | trans | -91.3 | 27.3 | -178.8 | 72.7 | -175.9 | -173.6 | -154.1 | 0 | 114.6 | R46 E47 F52 | R46-K50 PolarHBondContact O-N 2.66Å; E47-K50 WeakPolarHBondContact O-CG 3.16Å; K50-F52 VanDerWaalsContact C-N 3.28Å; K50-F52 PolarHBondContact O-N 3.42Å |
| 51 | G | 55 | Low | 63.2 | Low | 75 Ų | 75 | 123.7 Ų | 123.7 | 77% | 0.773 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -75 | -7.6 | 179.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | T49 | T49-G51 VanDerWaalsContact C-N 3.32Å; T49-G51 PolarHBondContact O-N 3.08Å |
| 52 | F | 52.8 | Low | 61.9 | Low | 191 Ų | 191 | 125.2 Ų | 125.2 | 84% | 0.838 | 67% | 0.665 | S | S | * | * | S | Bend | trans | -141 | -1.3 | -170 | -156.3 | -101.8 | 0 | 0 | 0 | 117 | K50 | K50-F52 VanDerWaalsContact C-N 3.28Å; K50-F52 PolarHBondContact O-N 3.42Å |
| 53 | Y | 52.5 | Low | 60.5 | Low | 161 Ų | 161 | 121.7 Ų | 121.7 | 63% | 0.631 | 66% | 0.657 | S | S | * | * | S | Bend | trans | -153.9 | 64.8 | -176.7 | 31.7 | -99.2 | 0 | 0 | 0 | 111.6 | T49 | T49-Y53 PolarHBondContact O-OH 3.12Å; T49-Y53 VanDerWaalsContact O-OH 3.14Å |
| 54 | D | 56.7 | Low | 59.4 | Low | 112 Ų | 112 | 128.6 Ų | 128.6 | 60% | 0.599 | 68% | 0.684 | S | S | * | * | | | trans | 174.5 | 74.5 | 150 | -96.2 | -36.2 | 0 | 0 | 0 | 109.7 | D56 S57 | D54-D56 VanDerWaalsContact C-N 3.28Å; D54-S57 VanDerWaalsContact CG-CB 3.4Å; D54-S57 VanDerWaalsContact CG-OG 3.22Å; D54-S57 WeakPolarHBondContact OD1-CB 3.39Å; D54-S57 PolarHBondContact OD1-OG 3.24Å |
| 55 | K | 56.6 | Low | 58.3 | Low | 201 Ų | 201 | 129.4 Ų | 129.4 | 87% | 0.874 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -85 | -7.8 | 160.1 | -81.8 | -157.2 | -174.3 | -179.7 | 0 | 112.5 | | |
| 56 | D | 57.2 | Low | 57.8 | Low | 139 Ų | 139 | 130.7 Ų | 130.7 | 74% | 0.743 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -109.7 | -11 | -172.1 | -46.9 | -33.8 | 0 | 0 | 0 | 112.4 | D54 S58 | D54-D56 VanDerWaalsContact C-N 3.28Å; D56-S58 VanDerWaalsContact C-N 3.32Å; D56-S58 PolarHBondContact O-N 3.41Å |
| 57 | S | 57.1 | Low | 57.7 | Low | 78 Ų | 78 | 128.6 Ų | 128.6 | 55% | 0.545 | 70% | 0.7 | S | S | . | * | | | trans | -96.8 | 35.9 | 179.3 | -58.3 | 0 | 0 | 0 | 0 | 112.9 | D54 G59 | D54-S57 VanDerWaalsContact CG-CB 3.4Å; D54-S57 VanDerWaalsContact CG-OG 3.22Å; D54-S57 WeakPolarHBondContact OD1-CB 3.39Å; D54-S57 PolarHBondContact OD1-OG 3.24Å; S57-G59 PolarHBondContact O-N 3.31Å |
| 58 | S | 58.7 | Low | 57.8 | Low | 95 Ų | 95 | 127.6 Ų | 127.6 | 66% | 0.664 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -71.7 | 83.6 | 168.8 | 61.8 | 0 | 0 | 0 | 0 | 109.8 | D56 W60 | D56-S58 VanDerWaalsContact C-N 3.32Å; D56-S58 PolarHBondContact O-N 3.41Å; S58-W60 PolarHBondContact O-N 3.11Å |
| 59 | G | 64.8 | Low | 57.8 | Low | 74 Ų | 74 | 132 Ų | 132 | 76% | 0.763 | 71% | 0.713 | S | S | * | * | S | Bend | trans | 68.9 | -31.8 | 142.9 | 0 | 0 | 0 | 0 | 0 | 119.4 | S57 | S57-G59 PolarHBondContact O-N 3.31Š|
| 60 | W | 53.8 | Low | 58 | Low | 235 Ų | 235 | 130.1 Ų | 130.1 | 89% | 0.89 | 70% | 0.703 | S | S | * | * | S | Bend | trans | -160.7 | 98.3 | 173.8 | -86.1 | -4 | 0 | 0 | 0 | 105.8 | S58 S62 | S58-W60 PolarHBondContact O-N 3.11Å; W60-S62 PolarHBondContact O-N 3.48Å |
| 61 | S | 53.8 | Low | 58.2 | Low | 104 Ų | 104 | 129.4 Ų | 129.4 | 73% | 0.727 | 71% | 0.714 | S | S | * | * | | | trans | -68.7 | 86.5 | 172.3 | 47.3 | 0 | 0 | 0 | 0 | 109.2 | S63 | S61-S63 PolarHBondContact O-N 2.97Å; S61-S63 VanDerWaalsContact O-N 3.14Å |
| 62 | S | 54.4 | Low | 58.6 | Low | 108 Ų | 108 | 131.7 Ų | 131.7 | 76% | 0.755 | 70% | 0.703 | S | S | * | * | | | trans | -79.1 | 74.9 | 157 | 52.9 | 0 | 0 | 0 | 0 | 107.5 | W60 K64 | W60-S62 PolarHBondContact O-N 3.48Å; S62-K64 PolarHBondContact O-N 3.14Å |
| 63 | S | 56.1 | Low | 58.9 | Low | 68 Ų | 68 | 124.3 Ų | 124.3 | 48% | 0.476 | 68% | 0.681 | S | S | . | * | | | trans | -54.7 | 108.6 | 161.8 | -57.5 | 0 | 0 | 0 | 0 | 106.1 | S61 D65 K66 | S61-S63 PolarHBondContact O-N 2.97Å; S61-S63 VanDerWaalsContact O-N 3.14Å; S63-D65 PolarHBondContact O-N 3.22Å; S63-K66 PolarHBondContact O-N 3.34Å |
| 64 | K | 56.7 | Low | 59.1 | Low | 204 Ų | 204 | 121.6 Ų | 121.6 | 89% | 0.887 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.5 | -8.1 | -175.6 | -125.8 | 171.1 | 179.4 | 177.3 | 0 | 113 | S62 | S62-K64 PolarHBondContact O-N 3.14Š|
| 65 | D | 60.3 | Low | 59.4 | Low | 152 Ų | 152 | 126.2 Ų | 126.2 | 81% | 0.813 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.1 | 3.9 | -177.2 | -42.3 | -56.5 | 0 | 0 | 0 | 113.3 | S63 | S63-D65 PolarHBondContact O-N 3.22Š|
| 66 | K | 63.6 | Low | 59.4 | Low | 144 Ų | 144 | 121.4 Ų | 121.4 | 63% | 0.626 | 69% | 0.686 | S | S | * | * | S | Bend | trans | -94.9 | 104.4 | 171.4 | -116.7 | -172.9 | 179.9 | 179.9 | 0 | 108.7 | S63 A68 | S63-K66 PolarHBondContact O-N 3.34Å; K66-A68 PolarHBondContact O-N 2.54Å |
| 67 | D | 68.5 | Low | 59.6 | Low | 128 Ų | 128 | 121.5 Ų | 121.5 | 68% | 0.684 | 69% | 0.686 | S | S | * | * | | | trans | -50.9 | 140.4 | 170.9 | -65.9 | -46.5 | 0 | 0 | 0 | 109.8 | Y69 S70 | D67-Y69 PolarHBondContact O-N 2.85Å; D67-S70 WeakPolarHBondContact O-CB 3.46Å; D67-S70 PolarHBondContact O-N 2.79Å; D67-S70 PolarHBondContact O-OG 2.79Å |
| 68 | A | 65.1 | Low | 59.7 | Low | 105 Ų | 105 | 123.1 Ų | 123.1 | 87% | 0.868 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53 | -14.4 | -173 | 0 | 0 | 0 | 0 | 0 | 114.7 | K66 | K66-A68 PolarHBondContact O-N 2.54Š|
| 69 | Y | 56.2 | Low | 59.7 | Low | 182 Ų | 182 | 130.4 Ų | 130.4 | 71% | 0.714 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.9 | 11.1 | -178.5 | -106.2 | -127.1 | 0 | 0 | 0 | 113.3 | D67 S71 F72 | D67-Y69 PolarHBondContact O-N 2.85Å; Y69-S71 PolarHBondContact O-N 3.41Å; Y69-S71 VanDerWaalsContact O-N 3.15Å; Y69-F72 HydrophobicContact CD1-CD1 4.14Å; Y69-F72 AromaticContact CD1-CE1 2.98Å; Y69-F72 HydrophobicContact CD1-CE1 2.98Å; Y69-F72 AromaticContact CD1-CZ 3.3Å; Y69-F72 HydrophobicContact CD1-CZ 3.3Å; Y69-F72 HydrophobicContact CD2-CE1 4.25Å; Y69-F72 HydrophobicContact CE1-CD1 4.32Å; Y69-F72 AromaticContact CE1-CE1 3.47Å; Y69-F72 HydrophobicContact CE1-CE1 3.47Å; Y69-F72 VanDerWaalsContact CE1-CE1 3.47Å; Y69-F72 AromaticContact CE1-CZ 3.98Å; Y69-F72 HydrophobicContact CE1-CZ 3.98Å; Y69-F72 HydrophobicContact CG-CD1 4.45Å; Y69-F72 AromaticContact CG-CE1 3.36Å; Y69-F72 HydrophobicContact CG-CE1 3.36Å; Y69-F72 AromaticContact CG-CZ 3.93Å; Y69-F72 HydrophobicContact CG-CZ 3.93Å; Y69-F72 VanDerWaalsContact O-CD1 3.3Å; Y69-F72 WeakPolarHBondContact O-CD1 3.03Å; Y69-F72 WeakPolarHBondContact O-CE1 2.73Å; Y69-F72 WeakPolarHBondContact O-CZ 3.3Å |
| 70 | S | 62.5 | Low | 59.5 | Low | 46 Ų | 46 | 130.5 Ų | 130.5 | 32% | 0.322 | 71% | 0.712 | S | S | . | * | G | 310 helix | trans | -75.1 | 1.5 | 176.7 | -68.8 | 0 | 0 | 0 | 0 | 114.7 | D67 | D67-S70 WeakPolarHBondContact O-CB 3.46Å; D67-S70 PolarHBondContact O-N 2.79Å; D67-S70 PolarHBondContact O-OG 2.79Å |
| 71 | S | 60.3 | Low | 59.8 | Low | 115 Ų | 115 | 128.8 Ų | 128.8 | 80% | 0.804 | 71% | 0.71 | S | S | * | * | G | 310 helix | trans | -81.3 | -31.2 | -173.5 | -166 | 0 | 0 | 0 | 0 | 114.1 | Y69 G73 | Y69-S71 PolarHBondContact O-N 3.41Å; Y69-S71 VanDerWaalsContact O-N 3.15Å; S71-G73 PolarHBondContact O-N 2.86Å |
| 72 | F | 62.5 | Low | 60 | Low | 124 Ų | 124 | 126.5 Ų | 126.5 | 54% | 0.544 | 69% | 0.694 | S | S | . | * | G | 310 helix | trans | -84.1 | 13.5 | 179.8 | 54.3 | -93.2 | 0 | 0 | 0 | 114 | Y69 | Y69-F72 HydrophobicContact CD1-CD1 4.14Å; Y69-F72 AromaticContact CD1-CE1 2.98Å; Y69-F72 HydrophobicContact CD1-CE1 2.98Å; Y69-F72 AromaticContact CD1-CZ 3.3Å; Y69-F72 HydrophobicContact CD1-CZ 3.3Å; Y69-F72 HydrophobicContact CD2-CE1 4.25Å; Y69-F72 HydrophobicContact CE1-CD1 4.32Å; Y69-F72 AromaticContact CE1-CE1 3.47Å; Y69-F72 HydrophobicContact CE1-CE1 3.47Å; Y69-F72 VanDerWaalsContact CE1-CE1 3.47Å; Y69-F72 AromaticContact CE1-CZ 3.98Å; Y69-F72 HydrophobicContact CE1-CZ 3.98Å; Y69-F72 HydrophobicContact CG-CD1 4.45Å; Y69-F72 AromaticContact CG-CE1 3.36Å; Y69-F72 HydrophobicContact CG-CE1 3.36Å; Y69-F72 AromaticContact CG-CZ 3.93Å; Y69-F72 HydrophobicContact CG-CZ 3.93Å; Y69-F72 VanDerWaalsContact O-CD1 3.3Å; Y69-F72 WeakPolarHBondContact O-CD1 3.03Å; Y69-F72 WeakPolarHBondContact O-CE1 2.73Å; Y69-F72 WeakPolarHBondContact O-CZ 3.3Å |
| 73 | G | 60.4 | Low | 60.3 | Low | 35 Ų | 35 | 125.1 Ų | 125.1 | 36% | 0.361 | 69% | 0.685 | S | S | . | * | | | trans | 75.3 | 121 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | S71 R75 | S71-G73 PolarHBondContact O-N 2.86Å; G73-R75 WeakPolarHBondContact O-CG 3.44Å; G73-R75 PolarHBondContact O-N 2.82Å |
| 74 | S | 56.4 | Low | 60.6 | Low | 105 Ų | 105 | 129.9 Ų | 129.9 | 73% | 0.734 | 70% | 0.697 | S | S | * | * | | | trans | -53.7 | 96.9 | 155 | -50 | 0 | 0 | 0 | 0 | 106.8 | S76 | S74-S76 PolarHBondContact O-N 3.15Š|
| 75 | R | 62.8 | Low | 60.8 | Low | 208 Ų | 208 | 128.2 Ų | 128.2 | 79% | 0.785 | 69% | 0.69 | S | S | * | * | | | trans | -73 | 70.3 | 169.8 | -54.9 | -173.9 | -171.9 | -176.5 | 1.9 | 105.8 | G73 D77 | G73-R75 WeakPolarHBondContact O-CG 3.44Å; G73-R75 PolarHBondContact O-N 2.82Å; R75-D77 PolarHBondContact O-N 3.14Å |
| 76 | S | 56.8 | Low | 60.8 | Low | 100 Ų | 100 | 125 Ų | 125 | 70% | 0.699 | 68% | 0.679 | S | S | * | * | | | trans | -72.7 | 82.4 | 163.2 | -65.4 | 0 | 0 | 0 | 0 | 106 | S74 | S74-S76 PolarHBondContact O-N 3.15Š|
| 77 | D | 60.6 | Low | 60.5 | Low | 141 Ų | 141 | 125.3 Ų | 125.3 | 75% | 0.754 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 8.3 | 122.4 | 143.1 | -58.1 | -54.6 | 0 | 0 | 0 | 114.1 | R75 | R75-D77 PolarHBondContact O-N 3.14Š|
| 78 | S | 58.5 | Low | 60.2 | Low | 113 Ų | 113 | 130.3 Ų | 130.3 | 79% | 0.79 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 107.5 | -13.4 | 159 | 77.7 | 0 | 0 | 0 | 0 | 120.7 | | |
| 79 | R | 60.8 | Low | 60.1 | Low | 248 Ų | 248 | 128.4 Ų | 128.4 | 94% | 0.936 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -99.1 | 1.1 | -178.4 | -64.6 | -175.5 | -177.3 | 156.1 | 1.3 | 116.3 | | |
| 80 | G | 59.8 | Low | 60.4 | Low | 75 Ų | 75 | 125.5 Ų | 125.5 | 77% | 0.773 | 70% | 0.695 | S | S | * | * | | | trans | -107.3 | 14.9 | -172 | 0 | 0 | 0 | 0 | 0 | 116.4 | S82 | G80-S82 PolarHBondContact O-N 2.71Å; G80-S82 VanDerWaalsContact O-N 3.12Å |
| 81 | K | 60.2 | Low | 60.1 | Low | 199 Ų | 199 | 126.3 Ų | 126.3 | 87% | 0.865 | 71% | 0.71 | S | S | * | * | | | trans | -82.2 | 91.4 | 173 | -71.6 | -174.8 | 179.5 | -179.8 | 0 | 109 | | |
| 82 | S | 58 | Low | 60.1 | Low | 56 Ų | 56 | 127 Ų | 127 | 39% | 0.392 | 72% | 0.715 | S | S | . | * | | | trans | -67.4 | 136.1 | 163.8 | 64.5 | 0 | 0 | 0 | 0 | 109 | G80 F84 | G80-S82 PolarHBondContact O-N 2.71Å; G80-S82 VanDerWaalsContact O-N 3.12Å; S82-F84 VanDerWaalsContact CB-CD2 3.47Å; S82-F84 PolarHBondContact O-N 2.83Å; S82-F84 VanDerWaalsContact O-N 3.09Å |
| 83 | S | 60.7 | Low | 59.9 | Low | 79 Ų | 79 | 132.6 Ų | 132.6 | 55% | 0.552 | 73% | 0.732 | S | S | * | * | G | 310 helix | trans | -64.9 | -7.9 | 179.4 | 49.2 | 0 | 0 | 0 | 0 | 113.6 | F85 S86 | S83-F85 PolarHBondContact O-N 2.77Å; S83-S86 PolarHBondContact O-N 3.39Å |
| 84 | F | 61.3 | Low | 59.8 | Low | 169 Ų | 169 | 134.1 Ų | 134.1 | 74% | 0.741 | 75% | 0.748 | S | S | * | * | G | 310 helix | trans | -59.9 | -21 | -177.4 | -60 | -61.5 | 0 | 0 | 0 | 114.2 | S82 | S82-F84 VanDerWaalsContact CB-CD2 3.47Å; S82-F84 PolarHBondContact O-N 2.83Å; S82-F84 VanDerWaalsContact O-N 3.09Å |
| 85 | F | 60.9 | Low | 60 | Low | 169 Ų | 169 | 134.6 Ų | 134.6 | 74% | 0.741 | 75% | 0.751 | S | S | * | * | G | 310 helix | trans | -109.1 | -2.7 | 175.4 | -61.9 | -76.2 | 0 | 0 | 0 | 114 | S83 D87 | S83-F85 PolarHBondContact O-N 2.77Å; F85-D87 VanDerWaalsContact C-N 3.33Å; F85-D87 PolarHBondContact O-N 3.37Å |
| 86 | S | 61 | Low | 59.8 | Low | 83 Ų | 83 | 131.3 Ų | 131.3 | 58% | 0.58 | 75% | 0.754 | S | S | * | * | G | 310 helix | trans | -71 | -28.4 | -176.8 | -62.8 | 0 | 0 | 0 | 0 | 112.8 | S83 | S83-S86 PolarHBondContact O-N 3.39Š|
| 87 | D | 57.4 | Low | 59.8 | Low | 151 Ų | 151 | 132.6 Ų | 132.6 | 81% | 0.807 | 76% | 0.757 | S | S | * | * | G | 310 helix | trans | -86.9 | -10.5 | -173.5 | -59 | -35.1 | 0 | 0 | 0 | 114.1 | F85 | F85-D87 VanDerWaalsContact C-N 3.33Å; F85-D87 PolarHBondContact O-N 3.37Å |
| 88 | R | 61.7 | Low | 59.2 | Low | 233 Ų | 233 | 137.1 Ų | 137.1 | 88% | 0.879 | 78% | 0.781 | S | S | * | * | G | 310 helix | trans | -91 | 7.4 | -176.6 | -73.5 | -84.8 | -163.9 | 171.5 | 3.1 | 113.9 | | |
| 89 | G | 63 | Low | 59.2 | Low | 66 Ų | 66 | 138.3 Ų | 138.3 | 68% | 0.68 | 78% | 0.781 | S | S | * | * | S | Bend | trans | -140.1 | 17 | -158.7 | 0 | 0 | 0 | 0 | 0 | 118.8 | | |
| 90 | S | 62.5 | Low | 59.2 | Low | 121 Ų | 121 | 132.5 Ų | 132.5 | 85% | 0.846 | 77% | 0.773 | S | S | * | * | | | trans | -134.6 | 63.6 | 168.5 | -168.3 | 0 | 0 | 0 | 0 | 111.1 | | |
| 91 | G | 56 | Low | 59.1 | Low | 62 Ų | 62 | 135.7 Ų | 135.7 | 64% | 0.639 | 77% | 0.773 | S | S | * | * | | | trans | -126.2 | 72.9 | 173.1 | 0 | 0 | 0 | 0 | 0 | 109.3 | R93 | G91-R93 PolarHBondContact O-N 2.97Š|
| 92 | S | 60.3 | Low | 59.1 | Low | 130 Ų | 130 | 132 Ų | 132 | 91% | 0.909 | 77% | 0.767 | S | S | * | * | | | trans | -66 | 73.3 | 165 | -60.7 | 0 | 0 | 0 | 0 | 109.2 | G94 | S92-G94 PolarHBondContact O-N 2.9Š|
| 93 | R | 59.5 | Low | 59.1 | Low | 242 Ų | 242 | 136.8 Ų | 136.8 | 91% | 0.913 | 79% | 0.791 | S | S | * | * | | | trans | -93 | 95.9 | 171.1 | -67.9 | -173.9 | 100.7 | 115.2 | -1.1 | 108.8 | G91 | G91-R93 PolarHBondContact O-N 2.97Š|
| 94 | G | 58.1 | Low | 59 | Low | 67 Ų | 67 | 140.6 Ų | 140.6 | 69% | 0.691 | 81% | 0.807 | S | S | * | * | | | trans | 81.5 | 91.5 | 144 | 0 | 0 | 0 | 0 | 0 | 116.7 | S92 V96 | S92-G94 PolarHBondContact O-N 2.9Å; G94-V96 PolarHBondContact O-N 2.89Å |
| 95 | S | 60.6 | Low | 58.9 | Low | 114 Ų | 114 | 138.6 Ų | 138.6 | 80% | 0.797 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 117.4 | 142 | 56.3 | 0 | 0 | 0 | 0 | 107.4 | V97 | S95-V97 PolarHBondContact O-N 3.44Š|
| 96 | V | 57.8 | Low | 58.7 | Low | 139 Ų | 139 | 136.2 Ų | 136.2 | 84% | 0.842 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 119.5 | 164.9 | 176.7 | 0 | 0 | 0 | 0 | 107.1 | G94 | G94-V96 PolarHBondContact O-N 2.89Š|
| 97 | V | 56.5 | Low | 58.5 | Low | 128 Ų | 128 | 140.7 Ų | 140.7 | 78% | 0.776 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 130.4 | 169.2 | -68.7 | 0 | 0 | 0 | 0 | 108 | S95 | S95-V97 PolarHBondContact O-N 3.44Š|
| 98 | N | 49 | Very low | 58.6 | Low | 235 Ų | 235 | 139.7 Ų | 139.7 | 100% | 1.257 | 84% | 0.839 | S | S | * | * | | | trans | -83.3 | 0 | 168.9 | -131.3 | 25.7 | 0 | 0 | 0 | 109.4 | | |