| 1 | M | 73.4 | Confident | 76.3 | Confident | 239 Ų | 239 | 139.6 Ų | 139.6 | 100% | 1.177 | 79% | 0.786 | S | S | * | * | | | | 0 | 129.4 | 0 | -63 | -174.1 | 84.8 | 0 | 0 | 107.4 | | |
| 2 | T | 82.5 | Confident | 75.8 | Confident | 136 Ų | 136 | 138.5 Ų | 138.5 | 83% | 0.834 | 79% | 0.789 | S | S | * | * | | | trans | -107.5 | 122.2 | 178 | -52.3 | 0 | 0 | 0 | 0 | 107.8 | | |
| 3 | T | 79.7 | Confident | 75.5 | Confident | 139 Ų | 139 | 139.4 Ų | 139.4 | 85% | 0.853 | 79% | 0.79 | S | S | * | * | | | trans | -102.9 | 126 | 174.7 | 46.9 | 0 | 0 | 0 | 0 | 109.3 | | |
| 4 | T | 77.5 | Confident | 75.3 | Confident | 126 Ų | 126 | 134.3 Ų | 134.3 | 77% | 0.773 | 77% | 0.767 | S | S | * | * | | | trans | -105.7 | 121.9 | 173 | -63.5 | 0 | 0 | 0 | 0 | 107.8 | | |
| 5 | T | 78.8 | Confident | 74.9 | Confident | 138 Ų | 138 | 141.1 Ų | 141.1 | 85% | 0.847 | 78% | 0.776 | S | S | * | * | | | trans | -102.9 | 129.3 | 172.2 | -176.1 | 0 | 0 | 0 | 0 | 108.9 | | |
| 6 | T | 77.1 | Confident | 74.2 | Confident | 114 Ų | 114 | 140.1 Ų | 140.1 | 70% | 0.699 | 77% | 0.769 | S | S | * | * | | | trans | -92.5 | 123.5 | 177.5 | -56 | 0 | 0 | 0 | 0 | 108.7 | K8 | T6-K8 PolarHBondContact O-N 3.43Š|
| 7 | F | 78.2 | Confident | 73.2 | Confident | 178 Ų | 178 | 136.5 Ų | 136.5 | 78% | 0.781 | 76% | 0.756 | S | S | * | * | | | trans | -65.7 | 114.2 | 176.7 | -178.6 | -105.8 | 0 | 0 | 0 | 109.9 | | |
| 8 | K | 72.5 | Confident | 72.6 | Confident | 188 Ų | 188 | 130.9 Ų | 130.9 | 82% | 0.817 | 73% | 0.728 | S | S | * | * | | | trans | -97.4 | 127.4 | 162.1 | -62.9 | -165.4 | 176 | -167.9 | 0 | 105.7 | T6 | T6-K8 PolarHBondContact O-N 3.43Š|
| 9 | G | 74.1 | Confident | 72.2 | Confident | 57 Ų | 57 | 136.1 Ų | 136.1 | 59% | 0.588 | 74% | 0.735 | S | S | * | * | | | trans | -54.6 | 179.9 | -169.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | D11 | G9-D11 PolarHBondContact O-N 3.25Š|
| 10 | V | 72.1 | Confident | 71.8 | Confident | 135 Ų | 135 | 135 Ų | 135 | 82% | 0.818 | 73% | 0.733 | S | S | * | * | | | trans | -66.7 | 119.3 | -179.8 | -74.1 | 0 | 0 | 0 | 0 | 111.3 | | |
| 11 | D | 73.7 | Confident | 71.6 | Confident | 86 Ų | 86 | 136 Ų | 136 | 46% | 0.46 | 74% | 0.737 | S | S | . | * | | | trans | -79 | 119.2 | 174.6 | 168.7 | 11.9 | 0 | 0 | 0 | 109.5 | G9 N13 S14 | G9-D11 PolarHBondContact O-N 3.25Å; D11-N13 PolarHBondContact O-N 2.75Å; D11-N13 PolarHBondContact OD1-N 2.88Å; D11-S14 WeakPolarHBondContact O-CB 3.44Å; D11-S14 PolarHBondContact O-N 2.69Å; D11-S14 PolarHBondContact O-OG 2.71Å |
| 12 | P | 70.5 | Confident | 71.4 | Confident | 126 Ų | 126 | 130.8 Ų | 130.8 | 82% | 0.818 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.1 | -19.1 | -177.4 | 27.3 | -35.3 | 0 | 0 | 0 | 113.7 | | |
| 13 | N | 71.1 | Confident | 70.9 | Confident | 150 Ų | 150 | 129 Ų | 129 | 80% | 0.802 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.3 | -2.4 | 174.8 | -67.3 | -56.4 | 0 | 0 | 0 | 112.9 | D11 | D11-N13 PolarHBondContact O-N 2.75Å; D11-N13 PolarHBondContact OD1-N 2.88Å |
| 14 | S | 72.5 | Confident | 70.4 | Confident | 68 Ų | 68 | 129 Ų | 129 | 48% | 0.476 | 70% | 0.698 | S | S | . | * | S | Bend | trans | -67.1 | 140.6 | 176.8 | 69.4 | 0 | 0 | 0 | 0 | 110.3 | D11 N16 | D11-S14 WeakPolarHBondContact O-CB 3.44Å; D11-S14 PolarHBondContact O-N 2.69Å; D11-S14 PolarHBondContact O-OG 2.71Å; S14-N16 PolarHBondContact O-N 3.39Å |
| 15 | R | 69.7 | Low | 69.9 | Low | 237 Ų | 237 | 125.6 Ų | 125.6 | 89% | 0.894 | 69% | 0.687 | S | S | * | * | | | trans | -46.4 | 118.2 | 179.2 | -164.2 | 178.1 | -162.9 | 170.1 | 5.1 | 108.6 | S17 | R15-S17 PolarHBondContact O-N 3.15Š|
| 16 | N | 63 | Low | 69.4 | Low | 125 Ų | 125 | 121.5 Ų | 121.5 | 67% | 0.668 | 67% | 0.672 | S | S | * | * | | | trans | -50.2 | 106.5 | 177.6 | 54.9 | 77 | 0 | 0 | 0 | 108.1 | S14 S18 | S14-N16 PolarHBondContact O-N 3.39Å; N16-S18 PolarHBondContact O-N 3.3Å |
| 17 | S | 58.6 | Low | 69 | Low | 78 Ų | 78 | 119.7 Ų | 119.7 | 55% | 0.545 | 68% | 0.676 | S | S | . | * | | | trans | -76.5 | 74.5 | 173.1 | 58.7 | 0 | 0 | 0 | 0 | 105 | R15 R19 V20 | R15-S17 PolarHBondContact O-N 3.15Å; S17-R19 PolarHBondContact O-N 3.43Å; S17-V20 PolarHBondContact O-N 3.47Å |
| 18 | S | 62.1 | Low | 68.9 | Low | 37 Ų | 37 | 116.6 Ų | 116.6 | 26% | 0.259 | 68% | 0.677 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -61.4 | 5.5 | -172.8 | 60.9 | 0 | 0 | 0 | 0 | 113.3 | N16 R22 | N16-S18 PolarHBondContact O-N 3.3Å; S18-R22 VanDerWaalsContact CB-NH1 3.32Å; S18-R22 VanDerWaalsContact CB-NH2 3.32Å; S18-R22 WeakPolarHBondContact O-CB 3.39Å; S18-R22 WeakPolarHBondContact O-CD 3.01Å; S18-R22 WeakPolarHBondContact O-CG 3.46Å; S18-R22 PolarHBondContact O-NE 3.07Å; S18-R22 PolarHBondContact O-NH1 3.36Å; S18-R22 VanDerWaalsContact OG-CZ 3.25Å; S18-R22 PolarHBondContact OG-NH1 3.07Å; S18-R22 PolarHBondContact OG-NH2 3.2Å |
| 19 | R | 65.2 | Low | 69.1 | Low | 228 Ų | 228 | 114.4 Ų | 114.4 | 86% | 0.86 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.6 | -17.5 | 171.8 | -54.5 | -178.3 | 93.7 | 163.9 | 7.4 | 112.8 | S17 | S17-R19 PolarHBondContact O-N 3.43Š|
| 20 | V | 63.9 | Low | 69.1 | Low | 114 Ų | 114 | 119.1 Ų | 119.1 | 69% | 0.691 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.2 | -30.4 | -178.1 | -171 | 0 | 0 | 0 | 0 | 111.8 | S17 | S17-V20 PolarHBondContact O-N 3.47Š|
| 21 | L | 67.5 | Low | 69.4 | Low | 157 Ų | 157 | 118 Ų | 118 | 82% | 0.822 | 68% | 0.677 | S | S | * | * | S | Bend | trans | -96.4 | -4.6 | 177.1 | -62 | 178.4 | 0 | 0 | 0 | 114 | | |
| 22 | R | 68.7 | Low | 69.5 | Low | 130 Ų | 130 | 120.9 Ų | 120.9 | 49% | 0.491 | 69% | 0.692 | S | S | . | * | S | Bend | trans | -83.2 | 139.4 | 172.6 | -81 | 179.3 | -163.7 | 120.7 | -3.2 | 108.8 | S18 | S18-R22 VanDerWaalsContact CB-NH1 3.32Å; S18-R22 VanDerWaalsContact CB-NH2 3.32Å; S18-R22 WeakPolarHBondContact O-CB 3.39Å; S18-R22 WeakPolarHBondContact O-CD 3.01Å; S18-R22 WeakPolarHBondContact O-CG 3.46Å; S18-R22 PolarHBondContact O-NE 3.07Å; S18-R22 PolarHBondContact O-NH1 3.36Å; S18-R22 VanDerWaalsContact OG-CZ 3.25Å; S18-R22 PolarHBondContact OG-NH1 3.07Å; S18-R22 PolarHBondContact OG-NH2 3.2Å |
| 23 | P | 71.6 | Confident | 69.2 | Low | 98 Ų | 98 | 117.9 Ų | 117.9 | 64% | 0.636 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 146.2 | 171.4 | 22.7 | -31.8 | 0 | 0 | 0 | 109.7 | G25 G26 | P23-G25 PolarHBondContact O-N 3.15Å; P23-G25 VanDerWaalsContact O-N 3.08Å; P23-G26 PolarHBondContact O-N 3.01Å; P23-G26 VanDerWaalsContact O-N 3.09Å |
| 24 | P | 70.1 | Confident | 68.9 | Low | 139 Ų | 139 | 121 Ų | 121 | 90% | 0.903 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -49 | 121.7 | 167.6 | -20.3 | 30.1 | 0 | 0 | 0 | 108.2 | | |
| 25 | G | 66.9 | Low | 68.3 | Low | 54 Ų | 54 | 125 Ų | 125 | 56% | 0.557 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 108.5 | 5.6 | -173.7 | 0 | 0 | 0 | 0 | 0 | 116.1 | P23 G27 S28 | P23-G25 PolarHBondContact O-N 3.15Å; P23-G25 VanDerWaalsContact O-N 3.08Å; G25-G27 PolarHBondContact O-N 3.45Å; G25-G27 VanDerWaalsContact O-N 3.08Å; G25-S28 PolarHBondContact O-N 3.1Å; G25-S28 VanDerWaalsContact O-N 3.16Å; G25-S28 PolarHBondContact O-OG 2.83Å |
| 26 | G | 68 | Low | 67.9 | Low | 52 Ų | 52 | 121.2 Ų | 121.2 | 54% | 0.536 | 70% | 0.699 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 34.2 | 67 | 151.1 | 0 | 0 | 0 | 0 | 0 | 116.5 | P23 S28 | P23-G26 PolarHBondContact O-N 3.01Å; P23-G26 VanDerWaalsContact O-N 3.09Å; G26-S28 VanDerWaalsContact C-N 3.33Å; G26-S28 PolarHBondContact O-N 2.9Å |
| 27 | G | 68.3 | Low | 67.7 | Low | 76 Ų | 76 | 121.1 Ų | 121.1 | 78% | 0.784 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 70.5 | 18.1 | 167.6 | 0 | 0 | 0 | 0 | 0 | 116.4 | G25 N29 | G25-G27 PolarHBondContact O-N 3.45Å; G25-G27 VanDerWaalsContact O-N 3.08Å; G27-N29 PolarHBondContact O-N 2.68Å; G27-N29 VanDerWaalsContact O-N 3.1Å |
| 28 | S | 77.3 | Confident | 67.9 | Low | 113 Ų | 113 | 123.6 Ų | 123.6 | 79% | 0.79 | 72% | 0.717 | S | S | * | * | | | trans | -61.9 | 112 | 171.1 | -69.2 | 0 | 0 | 0 | 0 | 110.7 | G25 G26 | G25-S28 PolarHBondContact O-N 3.1Å; G25-S28 VanDerWaalsContact O-N 3.16Å; G25-S28 PolarHBondContact O-OG 2.83Å; G26-S28 VanDerWaalsContact C-N 3.33Å; G26-S28 PolarHBondContact O-N 2.9Å |
| 29 | N | 76.9 | Confident | 67.7 | Low | 142 Ų | 142 | 130.5 Ų | 130.5 | 76% | 0.759 | 75% | 0.745 | S | S | * | * | | | trans | -116.4 | 130.2 | 170.6 | -170.6 | 12 | 0 | 0 | 0 | 107.7 | G27 | G27-N29 PolarHBondContact O-N 2.68Å; G27-N29 VanDerWaalsContact O-N 3.1Å |
| 30 | F | 73.9 | Confident | 67.5 | Low | 156 Ų | 156 | 127.5 Ų | 127.5 | 68% | 0.684 | 74% | 0.741 | S | S | * | * | | | trans | -103.8 | 126.1 | 171.8 | 61.7 | -86.5 | 0 | 0 | 0 | 108.3 | L32 | F30-L32 HydrophobicContact CD2-CD2 3.76Å; F30-L32 HydrophobicContact CD2-CG 3.82Å; F30-L32 HydrophobicContact CE2-CD1 4.05Å; F30-L32 HydrophobicContact CE2-CD2 3.9Å; F30-L32 HydrophobicContact CE2-CG 3.75Å |
| 31 | S | 77.6 | Confident | 67.6 | Low | 112 Ų | 112 | 127.1 Ų | 127.1 | 78% | 0.783 | 74% | 0.741 | S | S | * | * | | | trans | -85.8 | 115.8 | 167.2 | -58.7 | 0 | 0 | 0 | 0 | 107.6 | G33 | S31-G33 PolarHBondContact O-N 2.99Š|
| 32 | L | 76.7 | Confident | 67.4 | Low | 147 Ų | 147 | 126 Ų | 126 | 77% | 0.77 | 74% | 0.74 | S | S | * | * | | | trans | -73.6 | 88.3 | 160.8 | -60.9 | 177.6 | 0 | 0 | 0 | 105.7 | F30 F34 | F30-L32 HydrophobicContact CD2-CD2 3.76Å; F30-L32 HydrophobicContact CD2-CG 3.82Å; F30-L32 HydrophobicContact CE2-CD1 4.05Å; F30-L32 HydrophobicContact CE2-CD2 3.9Å; F30-L32 HydrophobicContact CE2-CG 3.75Å; L32-F34 PolarHBondContact O-N 2.75Å |
| 33 | G | 63.9 | Low | 67.4 | Low | 62 Ų | 62 | 129.5 Ų | 129.5 | 64% | 0.639 | 75% | 0.754 | S | S | * | * | | | trans | -57.4 | 96.7 | -178.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | S31 | S31-G33 PolarHBondContact O-N 2.99Š|
| 34 | F | 63.9 | Low | 67.4 | Low | 217 Ų | 217 | 133.6 Ų | 133.6 | 95% | 0.952 | 76% | 0.761 | S | S | * | * | | | trans | -92.4 | 23.3 | 154.3 | -122.6 | -83.9 | 0 | 0 | 0 | 110.3 | L32 | L32-F34 PolarHBondContact O-N 2.75Š|
| 35 | D | 61.2 | Low | 67.5 | Low | 152 Ų | 152 | 132.9 Ų | 132.9 | 81% | 0.813 | 75% | 0.75 | S | S | * | * | S | Bend | trans | -80 | 122 | 164.8 | -150.1 | 13.6 | 0 | 0 | 0 | 106.1 | | |
| 36 | E | 60.2 | Low | 68 | Low | 156 Ų | 156 | 140.6 Ų | 140.6 | 73% | 0.729 | 77% | 0.768 | S | S | * | * | | | trans | -1 | 129.1 | -178.7 | -169.7 | 179.7 | 170.8 | 0 | 0 | 117.3 | T38 | E36-T38 VanDerWaalsContact C-N 3.3Å; E36-T38 PolarHBondContact O-N 2.78Å |
| 37 | P | 60.1 | Low | 68.7 | Low | 124 Ų | 124 | 147 Ų | 147 | 81% | 0.805 | 79% | 0.786 | S | S | * | * | | | trans | -62.1 | 94.7 | 176.6 | 28.7 | -34.1 | 0 | 0 | 0 | 109.1 | E39 | P37-E39 VanDerWaalsContact C-N 3.34Å; P37-E39 PolarHBondContact O-N 2.74Å |
| 38 | T | 61.1 | Low | 69.2 | Low | 130 Ų | 130 | 146.3 Ų | 146.3 | 80% | 0.798 | 77% | 0.773 | S | S | * | * | | | trans | -61.6 | 106 | 165.3 | -48.7 | 0 | 0 | 0 | 0 | 104.6 | E36 Q40 | E36-T38 VanDerWaalsContact C-N 3.3Å; E36-T38 PolarHBondContact O-N 2.78Å; T38-Q40 PolarHBondContact O-N 3.08Å |
| 39 | E | 59.5 | Low | 69.3 | Low | 181 Ų | 181 | 145.2 Ų | 145.2 | 85% | 0.846 | 77% | 0.765 | S | S | * | * | | | trans | -43 | 97.1 | -176.4 | -166.4 | -167.3 | 179 | 0 | 0 | 109.5 | P37 P41 | P37-E39 VanDerWaalsContact C-N 3.34Å; P37-E39 PolarHBondContact O-N 2.74Å; E39-P41 WeakPolarHBondContact O-CD 3.03Å |
| 40 | Q | 61.2 | Low | 69.4 | Low | 165 Ų | 165 | 144.7 Ų | 144.7 | 77% | 0.771 | 76% | 0.763 | S | S | * | * | | | trans | -68.6 | 127.9 | -179 | -130 | -179.6 | 40 | 0 | 0 | 105.9 | T38 V42 | T38-Q40 PolarHBondContact O-N 3.08Å; Q40-V42 WeakPolarHBondContact O-CG2 3.45Å; Q40-V42 PolarHBondContact O-N 3.1Å |
| 41 | P | 64.6 | Low | 69.8 | Low | 107 Ų | 107 | 143.6 Ų | 143.6 | 70% | 0.695 | 76% | 0.762 | S | S | * | * | | | trans | -58.9 | 103.9 | 178.5 | -22.2 | 31.3 | 0 | 0 | 0 | 109 | E39 R43 | E39-P41 WeakPolarHBondContact O-CD 3.03Å; P41-R43 PolarHBondContact O-N 3.16Å |
| 42 | V | 63.9 | Low | 70.1 | Confident | 133 Ų | 133 | 148.1 Ų | 148.1 | 81% | 0.806 | 77% | 0.768 | S | S | * | * | | | trans | -70.7 | 79.2 | 179.9 | -171.2 | 0 | 0 | 0 | 0 | 107.5 | Q40 K44 | Q40-V42 WeakPolarHBondContact O-CG2 3.45Å; Q40-V42 PolarHBondContact O-N 3.1Å; V42-K44 PolarHBondContact O-N 3.31Å; V42-K44 VanDerWaalsContact O-N 3.15Å |
| 43 | R | 69.7 | Low | 70 | Confident | 204 Ų | 204 | 143.2 Ų | 143.2 | 77% | 0.77 | 75% | 0.753 | S | S | * | * | | | trans | -67.5 | 113.3 | 170.1 | -75.7 | -171.5 | -109.7 | 121.8 | -3.8 | 107 | P41 N45 | P41-R43 PolarHBondContact O-N 3.16Å; R43-N45 PolarHBondContact O-N 3.27Å |
| 44 | K | 71.2 | Confident | 70.4 | Confident | 183 Ų | 183 | 146 Ų | 146 | 80% | 0.796 | 76% | 0.758 | S | S | * | * | | | trans | -59.6 | 105.7 | 177.2 | -58.4 | -177.9 | -179 | -172.4 | 0 | 108.9 | V42 K46 | V42-K44 PolarHBondContact O-N 3.31Å; V42-K44 VanDerWaalsContact O-N 3.15Å; K44-K46 PolarHBondContact O-N 3.08Å |
| 45 | N | 71.1 | Confident | 70.6 | Confident | 124 Ų | 124 | 141.7 Ų | 141.7 | 66% | 0.663 | 75% | 0.752 | S | S | * | * | | | trans | -73.9 | 120.2 | 175.7 | -75.5 | -33.6 | 0 | 0 | 0 | 109.4 | R43 M47 A48 | R43-N45 PolarHBondContact O-N 3.27Å; N45-M47 PolarHBondContact O-N 3.22Å; N45-M47 VanDerWaalsContact O-N 3.1Å; N45-A48 HydrophobicContact CB-CB 3.95Å; N45-A48 WeakPolarHBondContact O-CB 3.34Å; N45-A48 PolarHBondContact O-N 3.09Å; N45-A48 VanDerWaalsContact O-N 3.07Å |
| 46 | K | 77.6 | Confident | 70.8 | Confident | 216 Ų | 216 | 141.6 Ų | 141.6 | 94% | 0.939 | 75% | 0.747 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64 | -15.3 | -177.8 | -65.3 | -178.4 | 69.3 | -178.5 | 0 | 114.8 | K44 | K44-K46 PolarHBondContact O-N 3.08Š|
| 47 | M | 83.6 | Confident | 70.6 | Confident | 187 Ų | 187 | 143.3 Ų | 143.3 | 92% | 0.921 | 76% | 0.755 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108 | 4 | 178.4 | -60.3 | -174.7 | -65.6 | 0 | 0 | 112.8 | N45 S49 | N45-M47 PolarHBondContact O-N 3.22Å; N45-M47 VanDerWaalsContact O-N 3.1Å; M47-S49 PolarHBondContact O-N 3.31Å |
| 48 | A | 79 | Confident | 70.4 | Confident | 61 Ų | 61 | 143.3 Ų | 143.3 | 50% | 0.504 | 75% | 0.748 | S | S | . | * | | | trans | -72 | 129.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 109.9 | N45 | N45-A48 HydrophobicContact CB-CB 3.95Å; N45-A48 WeakPolarHBondContact O-CB 3.34Å; N45-A48 PolarHBondContact O-N 3.09Å; N45-A48 VanDerWaalsContact O-N 3.07Å |
| 49 | S | 79.2 | Confident | 70.3 | Confident | 90 Ų | 90 | 141.8 Ų | 141.8 | 63% | 0.629 | 74% | 0.74 | S | S | * | * | | | trans | -89.2 | 131.8 | 173.3 | 74 | 0 | 0 | 0 | 0 | 110.2 | M47 I51 | M47-S49 PolarHBondContact O-N 3.31Å; S49-I51 VanDerWaalsContact C-N 3.35Å; S49-I51 PolarHBondContact O-N 2.87Å |
| 50 | N | 78.3 | Confident | 70.1 | Confident | 132 Ų | 132 | 138 Ų | 138 | 71% | 0.706 | 73% | 0.731 | S | S | * | * | | | trans | -95.3 | 32 | 179 | -70.7 | -12.8 | 0 | 0 | 0 | 113 | F52 G53 | N50-F52 VanDerWaalsContact C-N 3.27Å; N50-F52 PolarHBondContact O-N 3.06Å; N50-G53 PolarHBondContact O-N 2.72Å |
| 51 | I | 81.8 | Confident | 69.8 | Low | 132 Ų | 132 | 135.6 Ų | 135.6 | 68% | 0.677 | 73% | 0.733 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.7 | -36.3 | -170.7 | -64.2 | 166.9 | 0 | 0 | 0 | 112.7 | S49 | S49-I51 VanDerWaalsContact C-N 3.35Å; S49-I51 PolarHBondContact O-N 2.87Å |
| 52 | F | 83.7 | Confident | 69 | Low | 207 Ų | 207 | 141.9 Ų | 141.9 | 91% | 0.908 | 74% | 0.743 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.4 | 10.6 | 176.9 | -56.7 | -72.5 | 0 | 0 | 0 | 113.1 | N50 | N50-F52 VanDerWaalsContact C-N 3.27Å; N50-F52 PolarHBondContact O-N 3.06Å |
| 53 | G | 74.4 | Confident | 68 | Low | 44 Ų | 44 | 139.4 Ų | 139.4 | 45% | 0.454 | 74% | 0.737 | S | S | . | * | S | Bend | trans | -72.3 | 155.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | N50 | N50-G53 PolarHBondContact O-N 2.72Š|
| 54 | T | 73.7 | Confident | 67 | Low | 121 Ų | 121 | 139.1 Ų | 139.1 | 74% | 0.742 | 74% | 0.741 | S | S | * | * | | | trans | -56.7 | 142.5 | 163.9 | 48.9 | 0 | 0 | 0 | 0 | 108.6 | E56 | T54-E56 PolarHBondContact O-N 2.75Š|
| 55 | P | 67.9 | Low | 65.9 | Low | 127 Ų | 127 | 135.8 Ų | 135.8 | 83% | 0.825 | 74% | 0.741 | S | S | * | * | | | trans | -63.7 | 89.9 | 171.3 | 28.2 | -32.9 | 0 | 0 | 0 | 107 | E57 | P55-E57 PolarHBondContact O-N 2.72Š|
| 56 | E | 65.4 | Low | 64.4 | Low | 150 Ų | 150 | 135.1 Ų | 135.1 | 70% | 0.701 | 75% | 0.753 | S | S | * | * | | | trans | -61.5 | 129.8 | 177.6 | -173.9 | 162.1 | 146.5 | 0 | 0 | 107.2 | T54 N58 | T54-E56 PolarHBondContact O-N 2.75Å; E56-N58 PolarHBondContact O-N 2.89Å |
| 57 | E | 55.1 | Low | 62.5 | Low | 191 Ų | 191 | 128.6 Ų | 128.6 | 89% | 0.893 | 75% | 0.747 | S | S | * | * | | | trans | -58.7 | 73.1 | 171.2 | -78.6 | 171.8 | 124.8 | 0 | 0 | 110 | P55 | P55-E57 PolarHBondContact O-N 2.72Š|
| 58 | N | 56.4 | Low | 60.7 | Low | 125 Ų | 125 | 123.1 Ų | 123.1 | 67% | 0.668 | 74% | 0.738 | S | S | * | * | | | trans | -99.5 | 100.3 | 154.9 | -154.1 | -50.1 | 0 | 0 | 0 | 105.3 | E56 | E56-N58 PolarHBondContact O-N 2.89Š|
| 59 | P | 59.9 | Low | 59.1 | Low | 98 Ų | 98 | 131.4 Ų | 131.4 | 64% | 0.636 | 76% | 0.756 | S | S | * | * | | | trans | -55.7 | 137.7 | 173.8 | 25.4 | -32.8 | 0 | 0 | 0 | 107.1 | S61 | P59-S61 PolarHBondContact O-N 2.91Š|
| 60 | P | 55.2 | Low | 57.7 | Low | 101 Ų | 101 | 136.1 Ų | 136.1 | 66% | 0.656 | 77% | 0.768 | S | S | * | * | | | trans | -55.7 | 106.2 | 176.1 | 22.6 | -31.6 | 0 | 0 | 0 | 107.7 | W62 A63 | P60-W62 HydrophobicContact CB-CB 4.37Å; P60-W62 PolarHBondContact O-N 2.81Å; P60-A63 PolarHBondContact O-N 3.21Å; P60-A63 VanDerWaalsContact O-N 3.15Å |
| 61 | S | 53.3 | Low | 55.9 | Low | 115 Ų | 115 | 137.1 Ų | 137.1 | 80% | 0.804 | 77% | 0.774 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.4 | 4.3 | 174.5 | 58.5 | 0 | 0 | 0 | 0 | 112.2 | P59 A63 | P59-S61 PolarHBondContact O-N 2.91Å; S61-A63 PolarHBondContact O-N 3Å |
| 62 | W | 47.8 | Very low | 54.4 | Low | 238 Ų | 238 | 136.3 Ų | 136.3 | 90% | 0.902 | 78% | 0.78 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.1 | -15.6 | 165.2 | -170.8 | -111.7 | 0 | 0 | 0 | 114 | P60 K64 | P60-W62 HydrophobicContact CB-CB 4.37Å; P60-W62 PolarHBondContact O-N 2.81Å; W62-K64 PolarHBondContact O-N 2.7Å |
| 63 | A | 44.2 | Very low | 52.4 | Low | 82 Ų | 82 | 135.1 Ų | 135.1 | 68% | 0.678 | 78% | 0.777 | S | S | * | * | | | trans | -94.1 | 47.3 | -174.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | P60 S61 | P60-A63 PolarHBondContact O-N 3.21Å; P60-A63 VanDerWaalsContact O-N 3.15Å; S61-A63 PolarHBondContact O-N 3Å |
| 64 | K | 47.2 | Very low | 51.4 | Low | 198 Ų | 198 | 138.1 Ų | 138.1 | 86% | 0.861 | 79% | 0.791 | S | S | * | * | S | Bend | trans | -151.9 | 71.7 | 167.9 | -74.6 | -164.9 | 173.4 | 176.1 | 0 | 114.2 | W62 | W62-K64 PolarHBondContact O-N 2.7Š|
| 65 | S | 49.4 | Very low | 50.1 | Low | 113 Ų | 113 | 138.8 Ų | 138.8 | 79% | 0.79 | 80% | 0.797 | S | S | * | * | | | | -177.3 | 98.3 | 128.5 | 54.6 | 0 | 0 | 0 | 0 | 110.3 | G67 | S65-G67 PolarHBondContact O-N 3.02Š|
| 66 | A | 39.8 | Very low | 49 | Very low | 110 Ų | 110 | 135.9 Ų | 135.9 | 91% | 0.909 | 79% | 0.791 | S | S | * | * | | | trans | -68.3 | 120.2 | 156.5 | 0 | 0 | 0 | 0 | 0 | 108.2 | | |
| 67 | G | 37.1 | Very low | 48.6 | Very low | 79 Ų | 79 | 135.1 Ų | 135.1 | 81% | 0.814 | 80% | 0.797 | S | S | * | * | | | trans | 102.6 | 114 | 161 | 0 | 0 | 0 | 0 | 0 | 116.8 | S65 | S65-G67 PolarHBondContact O-N 3.02Š|
| 68 | G | 45 | Very low | 48.3 | Very low | 72 Ų | 72 | 133.6 Ų | 133.6 | 74% | 0.742 | 79% | 0.789 | S | S | * | * | | | trans | 146.7 | 82.3 | 168.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | | |
| 69 | R | 46.3 | Very low | 48.2 | Very low | 234 Ų | 234 | 137.8 Ų | 137.8 | 88% | 0.883 | 80% | 0.796 | S | S | * | * | | | | 48.5 | 104.5 | 103.6 | -78.4 | -173.1 | 84.4 | -168.4 | 6.2 | 115.1 | | |
| 70 | E | 49.1 | Very low | 47.7 | Very low | 189 Ų | 189 | 138.2 Ų | 138.2 | 88% | 0.883 | 80% | 0.801 | S | S | * | * | | | trans | 153.4 | 90.4 | 142.1 | 59.9 | -149.6 | 123 | 0 | 0 | 109.2 | | |
| 71 | D | 40.3 | Very low | 47.7 | Very low | 153 Ų | 153 | 141.8 Ų | 141.8 | 82% | 0.818 | 81% | 0.814 | S | S | * | * | | | | 60.9 | 102.9 | 94.9 | -158.1 | 29.9 | 0 | 0 | 0 | 114.4 | | |
| 72 | S | 51.8 | Low | 47.2 | Very low | 115 Ų | 115 | 141.8 Ų | 141.8 | 80% | 0.804 | 82% | 0.815 | S | S | * | * | | | trans | 164.9 | 120.3 | 141.2 | -73.8 | 0 | 0 | 0 | 0 | 113.1 | | |
| 73 | E | 40.5 | Very low | 48.1 | Very low | 183 Ų | 183 | 136.3 Ų | 136.3 | 86% | 0.855 | 81% | 0.813 | S | S | * | * | | | trans | -47.2 | 146.1 | 168.1 | -74.3 | 160.6 | 46 | 0 | 0 | 113.3 | | |
| 74 | S | 55 | Low | 48.4 | Very low | 107 Ų | 107 | 141.9 Ų | 141.9 | 75% | 0.748 | 83% | 0.825 | S | S | * | * | | | | 179 | 154.4 | 77.5 | -54.6 | 0 | 0 | 0 | 0 | 111 | | |
| 75 | P | 45.3 | Very low | 49.1 | Very low | 134 Ų | 134 | 137.3 Ų | 137.3 | 87% | 0.87 | 82% | 0.824 | S | S | * | * | | | trans | -99.9 | 154.7 | -176.3 | 37.8 | -30.6 | 0 | 0 | 0 | 113.4 | | |
| 76 | G | 45.7 | Very low | 49.8 | Very low | 67 Ų | 67 | 137.6 Ų | 137.6 | 69% | 0.691 | 83% | 0.826 | S | S | * | * | | | trans | 175.7 | 124.8 | 166 | 0 | 0 | 0 | 0 | 0 | 118 | | |
| 77 | T | 55.6 | Low | 50.6 | Low | 134 Ų | 134 | 137.8 Ų | 137.8 | 82% | 0.822 | 82% | 0.82 | S | S | * | * | | | trans | 84.6 | 89.9 | 148.5 | -20.9 | 0 | 0 | 0 | 0 | 116.7 | | |
| 78 | Q | 49.5 | Very low | 51.4 | Low | 158 Ų | 158 | 137.2 Ų | 137.2 | 74% | 0.738 | 82% | 0.815 | S | S | * | * | | | | 74.3 | 127 | 70.2 | -148 | -161 | -57.8 | 0 | 0 | 113.8 | | |
| 79 | R | 54.2 | Low | 52.8 | Low | 214 Ų | 214 | 142 Ų | 142 | 81% | 0.808 | 82% | 0.823 | S | S | * | * | | | trans | 114.7 | 99.1 | 141.5 | -53.8 | -174.9 | 87.6 | 178.3 | -1.8 | 118.6 | | |
| 80 | S | 49.3 | Very low | 53.2 | Low | 106 Ų | 106 | 139.9 Ų | 139.9 | 74% | 0.741 | 82% | 0.821 | S | S | * | * | | | trans | -25.1 | 157.6 | 152.7 | -34.3 | 0 | 0 | 0 | 0 | 118.5 | | |
| 81 | N | 56.4 | Low | 54.3 | Low | 176 Ų | 176 | 138.5 Ų | 138.5 | 94% | 0.941 | 82% | 0.818 | S | S | * | * | | | trans | -160.8 | 130.1 | 135 | -77.7 | -29.8 | 0 | 0 | 0 | 110.3 | | |
| 82 | S | 41.8 | Very low | 55.2 | Low | 116 Ų | 116 | 136.7 Ų | 136.7 | 81% | 0.811 | 81% | 0.809 | S | S | * | * | | | trans | -129.2 | 134.7 | 176.8 | 48.2 | 0 | 0 | 0 | 0 | 108.8 | | |
| 83 | S | 65.8 | Low | 56.1 | Low | 123 Ų | 123 | 138.7 Ų | 138.7 | 86% | 0.86 | 81% | 0.81 | S | S | * | * | | | trans | -161.2 | 121.7 | 160.5 | 60.6 | 0 | 0 | 0 | 0 | 112.3 | | |
| 84 | E | 51.7 | Low | 56.8 | Low | 198 Ų | 198 | 139.4 Ų | 139.4 | 93% | 0.925 | 81% | 0.81 | S | S | * | * | | | trans | -67.9 | 148.9 | 164.6 | -80.9 | 159.8 | 65.6 | 0 | 0 | 113.1 | | |
| 85 | A | 62.5 | Low | 57.1 | Low | 103 Ų | 103 | 137.2 Ų | 137.2 | 85% | 0.851 | 80% | 0.804 | S | S | * | * | | | trans | 162.7 | 142.7 | 151.8 | 0 | 0 | 0 | 0 | 0 | 107.2 | | |
| 86 | S | 62.9 | Low | 57.7 | Low | 118 Ų | 118 | 139.5 Ų | 139.5 | 83% | 0.825 | 80% | 0.803 | S | S | * | * | | | cis | -166 | 146.3 | 7.1 | 173.9 | 0 | 0 | 0 | 0 | 106.3 | | |
| 87 | S | 57.1 | Low | 57.9 | Low | 114 Ų | 114 | 141.4 Ų | 141.4 | 80% | 0.797 | 81% | 0.806 | S | S | * | * | | | trans | -86.4 | 148.9 | -171.3 | 43.3 | 0 | 0 | 0 | 0 | 114.9 | | |
| 88 | G | 54.6 | Low | 58.2 | Low | 67 Ų | 67 | 142 Ų | 142 | 69% | 0.691 | 80% | 0.804 | S | S | * | * | | | trans | 101.4 | 122.5 | 141.4 | 0 | 0 | 0 | 0 | 0 | 117 | | |
| 89 | D | 72.8 | Confident | 58.5 | Low | 172 Ų | 172 | 140.7 Ų | 140.7 | 92% | 0.92 | 81% | 0.807 | S | S | * | * | | | trans | -165.8 | 109.2 | 135 | -90.8 | -18.4 | 0 | 0 | 0 | 108.7 | | |
| 90 | F | 56 | Low | 59 | Low | 191 Ų | 191 | 139 Ų | 139 | 84% | 0.838 | 81% | 0.808 | S | S | * | * | | | trans | -106.4 | 112.7 | 175.1 | -163.5 | -91 | 0 | 0 | 0 | 107.4 | D92 | F90-D92 HydrophobicContact CD1-CB 4.32Å; F90-D92 HydrophobicContact CE1-CB 4.5Å; F90-D92 PolarHBondContact O-N 2.78Å |
| 91 | L | 72.2 | Confident | 59 | Low | 159 Ų | 159 | 142.5 Ų | 142.5 | 83% | 0.832 | 81% | 0.812 | S | S | * | * | | | trans | -85 | 100 | 171.4 | -79.7 | 151.8 | 0 | 0 | 0 | 108.4 | L93 | L91-L93 HydrophobicContact CD2-CD1 4.24Š|
| 92 | D | 59.5 | Low | 59.3 | Low | 115 Ų | 115 | 141 Ų | 141 | 62% | 0.615 | 80% | 0.804 | S | S | * | * | | | trans | -84.6 | 108.4 | 166.1 | -178.7 | 30.4 | 0 | 0 | 0 | 109.1 | F90 | F90-D92 HydrophobicContact CD1-CB 4.32Å; F90-D92 HydrophobicContact CE1-CB 4.5Å; F90-D92 PolarHBondContact O-N 2.78Å |
| 93 | L | 70.6 | Confident | 60.4 | Low | 157 Ų | 157 | 140.9 Ų | 140.9 | 82% | 0.822 | 80% | 0.798 | S | S | * | * | | | trans | -133.4 | 84.5 | 162 | -80.7 | 96.5 | 0 | 0 | 0 | 109.5 | L91 | L91-L93 HydrophobicContact CD2-CD1 4.24Š|
| 94 | K | 54.3 | Low | 59.7 | Low | 199 Ų | 199 | 142.2 Ų | 142.2 | 87% | 0.865 | 80% | 0.796 | S | S | * | * | | | trans | -59.3 | 127.8 | 150.7 | -91.5 | -82.2 | -157.1 | -179.4 | 0 | 110.6 | | |
| 95 | G | 60.8 | Low | 60.3 | Low | 61 Ų | 61 | 137.6 Ų | 137.6 | 63% | 0.629 | 78% | 0.781 | S | S | * | * | | | trans | -179.8 | 85.3 | 161.7 | 0 | 0 | 0 | 0 | 0 | 109.1 | | |
| 96 | E | 58.3 | Low | 59.6 | Low | 182 Ų | 182 | 140 Ų | 140 | 85% | 0.85 | 78% | 0.78 | S | S | * | * | | | | 58.1 | 92.7 | 100 | 86.2 | 170.7 | 114.4 | 0 | 0 | 112 | | |
| 97 | S | 50.6 | Low | 59.6 | Low | 106 Ų | 106 | 143.6 Ų | 143.6 | 74% | 0.741 | 78% | 0.781 | S | S | * | * | | | | 55.2 | 103.3 | 100.4 | 67.8 | 0 | 0 | 0 | 0 | 114.1 | | |
| 98 | D | 61.4 | Low | 58.9 | Low | 148 Ų | 148 | 147.1 Ų | 147.1 | 79% | 0.791 | 79% | 0.785 | S | S | * | * | | | trans | -150.5 | 134.3 | 136 | -160.6 | 31.1 | 0 | 0 | 0 | 110.6 | | |
| 99 | V | 55.2 | Low | 58.6 | Low | 130 Ų | 130 | 147.9 Ų | 147.9 | 79% | 0.788 | 79% | 0.785 | S | S | * | * | | | trans | -98.5 | 129 | -174.3 | -95.7 | 0 | 0 | 0 | 0 | 107.7 | | |
| 100 | H | 64.5 | Low | 57.5 | Low | 178 Ų | 178 | 145 Ų | 145 | 82% | 0.824 | 78% | 0.777 | S | S | * | * | | | trans | -127.5 | 102.6 | 170.8 | -134 | -78.6 | 0 | 0 | 0 | 110.6 | | |
| 101 | E | 49.4 | Very low | 56.9 | Low | 180 Ų | 180 | 143.6 Ų | 143.6 | 84% | 0.841 | 78% | 0.778 | S | S | * | * | | | trans | -84.3 | 139.8 | 165.8 | 59.2 | -171.2 | 170.1 | 0 | 0 | 109.4 | | |
| 102 | N | 63.2 | Low | 55.4 | Low | 144 Ų | 144 | 140.3 Ų | 140.3 | 77% | 0.77 | 77% | 0.774 | S | S | * | * | | | trans | -160.1 | 99.9 | 156.9 | -162.2 | 27.8 | 0 | 0 | 0 | 113.2 | | |
| 103 | V | 65.7 | Low | 54.5 | Low | 113 Ų | 113 | 143.8 Ų | 143.8 | 69% | 0.685 | 79% | 0.786 | S | S | * | * | | | trans | 32.3 | 110.9 | 137 | -175.4 | 0 | 0 | 0 | 0 | 119.8 | | |
| 104 | D | 49.9 | Very low | 53.8 | Low | 152 Ų | 152 | 142.8 Ų | 142.8 | 81% | 0.813 | 79% | 0.787 | S | S | * | * | | | trans | -67 | 131.9 | 156.5 | -69.5 | -70.4 | 0 | 0 | 0 | 110.9 | | |
| 105 | T | 64.7 | Low | 53.2 | Low | 100 Ų | 100 | 141.8 Ų | 141.8 | 61% | 0.613 | 79% | 0.785 | S | S | * | * | | | trans | -111.4 | 112.1 | 172.9 | -60.5 | 0 | 0 | 0 | 0 | 109.9 | F107 | T105-F107 HydrophobicContact CG2-CD2 3.7Å; T105-F107 HydrophobicContact CG2-CE2 3.37Å; T105-F107 HydrophobicContact CG2-CZ 4.19Å |
| 106 | D | 48.9 | Very low | 52.4 | Low | 153 Ų | 153 | 147 Ų | 147 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | | | trans | -75.3 | 121.7 | 171.1 | -56.7 | -46 | 0 | 0 | 0 | 110.6 | | |
| 107 | F | 61.8 | Low | 51.9 | Low | 195 Ų | 195 | 146 Ų | 146 | 86% | 0.855 | 79% | 0.786 | S | S | * | * | | | trans | -114.8 | 94.5 | 164.1 | -83.7 | -77.5 | 0 | 0 | 0 | 110.5 | T105 | T105-F107 HydrophobicContact CG2-CD2 3.7Å; T105-F107 HydrophobicContact CG2-CE2 3.37Å; T105-F107 HydrophobicContact CG2-CZ 4.19Å |
| 108 | Q | 42.2 | Very low | 51.6 | Low | 188 Ų | 188 | 147 Ų | 147 | 88% | 0.879 | 79% | 0.789 | S | S | * | * | | | trans | -68.4 | 130.7 | 158.2 | 176.1 | -162 | 84.5 | 0 | 0 | 109.6 | | |
| 109 | A | 49.1 | Very low | 51.5 | Low | 83 Ų | 83 | 145.5 Ų | 145.5 | 69% | 0.686 | 79% | 0.786 | S | S | * | * | | | trans | 176.7 | 134.3 | 141.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | | |
| 110 | S | 49.6 | Very low | 51.3 | Low | 110 Ų | 110 | 145 Ų | 145 | 77% | 0.769 | 79% | 0.785 | S | S | * | * | | | trans | 62.5 | 111 | 154.5 | 61.6 | 0 | 0 | 0 | 0 | 117.6 | | |
| 111 | L | 43.6 | Very low | 50.5 | Low | 163 Ų | 163 | 141.6 Ų | 141.6 | 85% | 0.853 | 79% | 0.788 | S | S | * | * | | | cis | 49.6 | 83 | 49.3 | -152.9 | 138.7 | 0 | 0 | 0 | 113.8 | | |
| 112 | A | 40.3 | Very low | 50.9 | Low | 90 Ų | 90 | 137 Ų | 137 | 74% | 0.744 | 78% | 0.781 | S | S | * | * | | | trans | -151.7 | 108.1 | 155.1 | 0 | 0 | 0 | 0 | 0 | 109.3 | | |
| 113 | Q | 40.8 | Very low | 50.6 | Low | 187 Ų | 187 | 136 Ų | 136 | 87% | 0.874 | 78% | 0.782 | S | S | * | * | | | trans | -68.6 | 125 | 171.9 | -61.6 | 170.4 | -98.9 | 0 | 0 | 108.7 | | |
| 114 | V | 56.7 | Low | 50.5 | Low | 137 Ų | 137 | 137.1 Ų | 137.1 | 83% | 0.83 | 79% | 0.789 | S | S | * | * | | | trans | -132.7 | 119.5 | 161.6 | 179.7 | 0 | 0 | 0 | 0 | 108.5 | | |
| 115 | E | 40.6 | Very low | 51.2 | Low | 178 Ų | 178 | 135.9 Ų | 135.9 | 83% | 0.832 | 79% | 0.789 | S | S | * | * | | | trans | -53.9 | 130.8 | 172.4 | -176.1 | -147.2 | 153.9 | 0 | 0 | 112.1 | | |
| 116 | E | 43.4 | Very low | 51.2 | Low | 169 Ų | 169 | 136 Ų | 136 | 79% | 0.79 | 79% | 0.794 | S | S | * | * | | | trans | -139 | 106.2 | 164.7 | -159.5 | -161.9 | 143.3 | 0 | 0 | 112.4 | | |
| 117 | K | 48.6 | Very low | 52 | Low | 162 Ų | 162 | 134.9 Ų | 134.9 | 70% | 0.704 | 80% | 0.795 | S | S | * | * | | | trans | 6.9 | 131.5 | 143.9 | -151.7 | 83.6 | 168.1 | -174 | 0 | 118.6 | V119 | K117-V119 PolarHBondContact O-N 3.3Š|
| 118 | P | 44 | Very low | 52.2 | Low | 126 Ų | 126 | 132.2 Ų | 132.2 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -77.1 | 123.5 | 176.6 | 30.5 | -31.7 | 0 | 0 | 0 | 112.5 | | |
| 119 | V | 60 | Low | 53.6 | Low | 118 Ų | 118 | 127.1 Ų | 127.1 | 72% | 0.715 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -92 | 140.7 | 175.2 | -179.1 | 0 | 0 | 0 | 0 | 109.6 | K117 | K117-V119 PolarHBondContact O-N 3.3Š|
| 120 | P | 51.5 | Low | 54.4 | Low | 119 Ų | 119 | 129.1 Ų | 129.1 | 77% | 0.773 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -71.3 | 150 | -167.9 | 29 | -35.6 | 0 | 0 | 0 | 113.7 | A122 | P120-A122 PolarHBondContact O-N 3.2Š|
| 121 | A | 46.7 | Very low | 55.3 | Low | 107 Ų | 107 | 128 Ų | 128 | 88% | 0.884 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 118.4 | -173 | 0 | 0 | 0 | 0 | 0 | 113.6 | | |
| 122 | A | 57.6 | Low | 56.6 | Low | 83 Ų | 83 | 126.2 Ų | 126.2 | 69% | 0.686 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -81.4 | 156 | 168.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | P120 V124 | P120-A122 PolarHBondContact O-N 3.2Å; A122-V124 PolarHBondContact O-N 2.97Å |
| 123 | P | 58.1 | Low | 58 | Low | 124 Ų | 124 | 126.1 Ų | 126.1 | 81% | 0.805 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 132.7 | -171.2 | -12.6 | 27 | 0 | 0 | 0 | 111.5 | P125 | P123-P125 WeakPolarHBondContact O-CD 3.45Š|
| 124 | V | 62.2 | Low | 59.4 | Low | 136 Ų | 136 | 123 Ų | 123 | 82% | 0.824 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 122.9 | 174.3 | -76.6 | 0 | 0 | 0 | 0 | 110.3 | A122 S126 | A122-V124 PolarHBondContact O-N 2.97Å; V124-S126 PolarHBondContact O-N 3.12Å |
| 125 | P | 65 | Low | 59.9 | Low | 125 Ų | 125 | 121.4 Ų | 121.4 | 81% | 0.812 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 129.5 | 168.4 | 28.1 | -30.2 | 0 | 0 | 0 | 109.2 | P123 | P123-P125 WeakPolarHBondContact O-CD 3.45Š|
| 126 | S | 65.5 | Low | 61.2 | Low | 102 Ų | 102 | 124.9 Ų | 124.9 | 71% | 0.713 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 146.6 | 173.6 | -58.5 | 0 | 0 | 0 | 0 | 111.5 | V124 V128 | V124-S126 PolarHBondContact O-N 3.12Å; S126-V128 PolarHBondContact O-N 3.19Å |
| 127 | P | 64.1 | Low | 62.3 | Low | 131 Ų | 131 | 126.9 Ų | 126.9 | 85% | 0.851 | 78% | 0.782 | S | S | * | * | | | trans | -62.6 | 114 | -179.9 | 25.6 | -32.8 | 0 | 0 | 0 | 110 | A129 | P127-A129 PolarHBondContact O-N 3.2Š|
| 128 | V | 67.8 | Low | 62.9 | Low | 139 Ų | 139 | 125.6 Ų | 125.6 | 84% | 0.842 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -71.2 | 121.1 | 166.2 | 171.4 | 0 | 0 | 0 | 0 | 107.1 | S126 | S126-V128 PolarHBondContact O-N 3.19Š|
| 129 | A | 70.5 | Confident | 63.8 | Low | 80 Ų | 80 | 124.4 Ų | 124.4 | 66% | 0.661 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -57.5 | 138.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 110.4 | P127 A131 | P127-A129 PolarHBondContact O-N 3.2Å; A129-A131 PolarHBondContact O-N 3.18Å |
| 130 | P | 66.2 | Low | 64 | Low | 126 Ų | 126 | 125.7 Ų | 125.7 | 82% | 0.818 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 126.6 | 179.5 | 24.6 | -31.5 | 0 | 0 | 0 | 109.9 | | |
| 131 | A | 68.1 | Low | 64.6 | Low | 86 Ų | 86 | 122.9 Ų | 122.9 | 71% | 0.711 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 143.6 | 173.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | A129 A133 | A129-A131 PolarHBondContact O-N 3.18Å; A131-A133 PolarHBondContact O-N 3.26Å |
| 132 | P | 71.7 | Confident | 65.6 | Low | 126 Ų | 126 | 121.4 Ų | 121.4 | 82% | 0.818 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -59 | 124.3 | -179.7 | 22.8 | -31.4 | 0 | 0 | 0 | 110.1 | | |
| 133 | A | 69.7 | Low | 66.2 | Low | 88 Ų | 88 | 127.5 Ų | 127.5 | 73% | 0.727 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 137.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 110 | A131 S135 | A131-A133 PolarHBondContact O-N 3.26Å; A133-S135 PolarHBondContact O-N 3.46Å |
| 134 | P | 68.9 | Low | 66.9 | Low | 122 Ų | 122 | 127.6 Ų | 127.6 | 79% | 0.792 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -59 | 125 | 178.6 | 23.1 | -31.6 | 0 | 0 | 0 | 109.7 | R136 | P134-R136 PolarHBondContact O-N 3.32Š|
| 135 | S | 68.1 | Low | 67.5 | Low | 102 Ų | 102 | 126.2 Ų | 126.2 | 71% | 0.713 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 118.8 | -179.6 | -175.3 | 0 | 0 | 0 | 0 | 109.9 | A133 R137 | A133-S135 PolarHBondContact O-N 3.46Å; S135-R137 PolarHBondContact O-N 3.04Å; S135-R137 WeakPolarHBondContact OG-CB 3.42Å |
| 136 | R | 67.5 | Low | 68.3 | Low | 251 Ų | 251 | 127.2 Ų | 127.2 | 95% | 0.947 | 78% | 0.783 | S | S | * | * | | | trans | -69.9 | 15 | 173.5 | -75.5 | -176 | 172 | -105.3 | -1.6 | 113.3 | P134 N138 | P134-R136 PolarHBondContact O-N 3.32Å; R136-N138 PolarHBondContact O-N 3.46Å; R136-N138 VanDerWaalsContact O-N 3.12Å |
| 137 | R | 66 | Low | 68.8 | Low | 211 Ų | 211 | 128.1 Ų | 128.1 | 80% | 0.796 | 78% | 0.784 | S | S | * | * | S | Bend | trans | -86.8 | 93.9 | -174.4 | -144.7 | 175.4 | -171.3 | -157 | 2 | 108.9 | S135 | S135-R137 PolarHBondContact O-N 3.04Å; S135-R137 WeakPolarHBondContact OG-CB 3.42Å |
| 138 | N | 61.4 | Low | 69.4 | Low | 135 Ų | 135 | 128.9 Ų | 128.9 | 72% | 0.722 | 78% | 0.779 | S | S | * | * | S | Bend | trans | 78.1 | 129.3 | 179.1 | -50.3 | -53.3 | 0 | 0 | 0 | 114.5 | R136 | R136-N138 PolarHBondContact O-N 3.46Å; R136-N138 VanDerWaalsContact O-N 3.12Å |
| 139 | P | 62.7 | Low | 70.2 | Confident | 102 Ų | 102 | 129.5 Ų | 129.5 | 66% | 0.662 | 81% | 0.814 | S | S | * | * | | | trans | -58.3 | 150.1 | 164.5 | 27.2 | -32.5 | 0 | 0 | 0 | 109.3 | G141 | P139-G141 VanDerWaalsContact C-N 3.29Å; P139-G141 PolarHBondContact O-N 3.49Å |
| 140 | P | 65.7 | Low | 70.2 | Confident | 144 Ų | 144 | 132 Ų | 132 | 94% | 0.935 | 82% | 0.822 | S | S | * | * | S | Bend | trans | -60.8 | 96.9 | 168 | 25.4 | -31.2 | 0 | 0 | 0 | 108 | | |
| 141 | G | 62.9 | Low | 70.4 | Confident | 60 Ų | 60 | 132.3 Ų | 132.3 | 62% | 0.619 | 82% | 0.822 | S | S | * | * | | | trans | 162.4 | 73.6 | -166.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | P139 | P139-G141 VanDerWaalsContact C-N 3.29Å; P139-G141 PolarHBondContact O-N 3.49Å |
| 142 | G | 67.6 | Low | 70.5 | Confident | 77 Ų | 77 | 134.8 Ų | 134.8 | 79% | 0.794 | 83% | 0.828 | S | S | * | * | | | trans | -60.2 | 149.3 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113 | S144 | G142-S144 PolarHBondContact O-N 3.42Š|
| 143 | K | 70.3 | Confident | 70.5 | Confident | 211 Ų | 211 | 135.4 Ų | 135.4 | 92% | 0.917 | 83% | 0.828 | S | S | * | * | | | trans | -18.4 | 109.9 | 176.2 | -49.7 | -178 | -176.5 | -167 | 0 | 115 | | |
| 144 | S | 72.9 | Confident | 70.5 | Confident | 125 Ų | 125 | 138.3 Ų | 138.3 | 87% | 0.874 | 84% | 0.835 | S | S | * | * | | | trans | -74.1 | 125.1 | 162.7 | 52.3 | 0 | 0 | 0 | 0 | 109.6 | G142 | G142-S144 PolarHBondContact O-N 3.42Š|
| 145 | S | 75 | Confident | 70.6 | Confident | 108 Ų | 108 | 139.4 Ų | 139.4 | 76% | 0.755 | 84% | 0.838 | S | S | * | * | | | trans | -104.1 | 121.5 | 173.6 | 169.8 | 0 | 0 | 0 | 0 | 108.9 | | |
| 146 | L | 81.7 | Confident | 70.8 | Confident | 146 Ų | 146 | 142.1 Ų | 142.1 | 76% | 0.764 | 85% | 0.847 | S | S | * | * | P | Polyproline II helix | trans | -97.8 | 122.1 | 171.9 | -178.7 | 64.5 | 0 | 0 | 0 | 108.9 | L148 | L146-L148 HydrophobicContact CD1-CD2 4.49Å; L146-L148 HydrophobicContact CD2-CD2 4.05Å; L146-L148 HydrophobicContact CD2-CG 4.49Å; L146-L148 HydrophobicContact CG-CD2 4.14Å; L146-L148 HydrophobicContact CG-CG 4.45Å |
| 147 | V | 76.6 | Confident | 71.1 | Confident | 121 Ų | 121 | 133.7 Ų | 133.7 | 73% | 0.733 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -103.3 | 122.4 | 170.5 | -179.8 | 0 | 0 | 0 | 0 | 107.2 | | |
| 148 | L | 76.6 | Confident | 71.5 | Confident | 146 Ų | 146 | 127.3 Ų | 127.3 | 76% | 0.764 | 84% | 0.842 | S | S | * | * | P | Polyproline II helix | trans | -96.2 | 124.9 | 170.6 | -61.4 | 176.3 | 0 | 0 | 0 | 107.3 | L146 | L146-L148 HydrophobicContact CD1-CD2 4.49Å; L146-L148 HydrophobicContact CD2-CD2 4.05Å; L146-L148 HydrophobicContact CD2-CG 4.49Å; L146-L148 HydrophobicContact CG-CD2 4.14Å; L146-L148 HydrophobicContact CG-CG 4.45Å |
| 149 | G | 84.4 | Confident | 72.4 | Confident | 152 Ų | 152 | 126.5 Ų | 126.5 | 100% | 1.567 | 85% | 0.853 | S | S | * | * | | | trans | -75.1 | 0 | 174 | 0 | 0 | 0 | 0 | 0 | 112.8 | | |