| 1 | M | 56.8 | Low | 59.5 | Low | 228 Ų | 228 | 155.5 Ų | 155.5 | 100% | 1.123 | 83% | 0.832 | S | S | * | * | | | | 0 | 130.5 | 0 | -56.8 | -143.8 | -58 | 0 | 0 | 106.2 | | |
| 2 | R | 53.1 | Low | 59.7 | Low | 247 Ų | 247 | 155.7 Ų | 155.7 | 93% | 0.932 | 83% | 0.833 | S | S | * | * | | | trans | -100.1 | 121.9 | -178.9 | -65.6 | -179.2 | -172.1 | 170.7 | 2.5 | 106.9 | D4 | R2-D4 PolarHBondContact O-N 3.41Š|
| 3 | D | 59.9 | Low | 59.9 | Low | 147 Ų | 147 | 155.4 Ų | 155.4 | 79% | 0.786 | 82% | 0.824 | S | S | * | * | | | trans | -80.4 | 98.8 | 178.8 | -58.1 | -50 | 0 | 0 | 0 | 108.5 | S5 | D3-S5 PolarHBondContact O-N 3.37Š|
| 4 | D | 59.8 | Low | 60.7 | Low | 162 Ų | 162 | 150.7 Ų | 150.7 | 87% | 0.866 | 82% | 0.818 | S | S | * | * | | | trans | -81.4 | 91.8 | 171.4 | -156.9 | 72 | 0 | 0 | 0 | 107.2 | R2 | R2-D4 PolarHBondContact O-N 3.41Š|
| 5 | S | 62 | Low | 61.6 | Low | 112 Ų | 112 | 156.1 Ų | 156.1 | 78% | 0.783 | 82% | 0.822 | S | S | * | * | | | trans | -119.8 | 79 | 171.2 | -63 | 0 | 0 | 0 | 0 | 107.7 | D3 | D3-S5 PolarHBondContact O-N 3.37Š|
| 6 | G | 65.6 | Low | 62.9 | Low | 57 Ų | 57 | 153.3 Ų | 153.3 | 59% | 0.588 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -61.6 | 153.5 | 166.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | | |
| 7 | P | 62.2 | Low | 64.2 | Low | 118 Ų | 118 | 151.8 Ų | 151.8 | 77% | 0.766 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -63 | 148.8 | -178.1 | 27.3 | -33.8 | 0 | 0 | 0 | 111.1 | L9 | P7-L9 PolarHBondContact O-N 3.47Š|
| 8 | P | 55.7 | Low | 65.4 | Low | 125 Ų | 125 | 156.8 Ų | 156.8 | 81% | 0.812 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 135.3 | -178.6 | 26.2 | -32.5 | 0 | 0 | 0 | 110 | E10 | P8-E10 PolarHBondContact O-N 3.2Š|
| 9 | L | 59.5 | Low | 66.5 | Low | 173 Ų | 173 | 153.6 Ų | 153.6 | 91% | 0.906 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 126.9 | 175.5 | -68.6 | 170.6 | 0 | 0 | 0 | 109.2 | P7 E11 | P7-L9 PolarHBondContact O-N 3.47Å; L9-E11 PolarHBondContact O-N 3.01Å |
| 10 | E | 58.8 | Low | 67.5 | Low | 156 Ų | 156 | 153.8 Ų | 153.8 | 73% | 0.729 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -49.7 | 119.3 | -174.5 | -60.8 | -162.1 | 165.4 | 0 | 0 | 111.9 | P8 D12 Q13 | P8-E10 PolarHBondContact O-N 3.2Å; E10-D12 PolarHBondContact O-N 3.36Å; E10-Q13 PolarHBondContact OE2-NE2 3.35Å |
| 11 | E | 60.9 | Low | 68.5 | Low | 185 Ų | 185 | 151.2 Ų | 151.2 | 86% | 0.864 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -57 | 126.8 | 169.7 | -150.4 | 157.9 | -161 | 0 | 0 | 108.5 | L9 Q13 | L9-E11 PolarHBondContact O-N 3.01Å; E11-Q13 PolarHBondContact O-N 3.15Å |
| 12 | D | 62.7 | Low | 69.9 | Low | 158 Ų | 158 | 146.3 Ų | 146.3 | 85% | 0.845 | 80% | 0.798 | S | S | * | * | | | trans | -29.3 | 96.4 | -171.9 | -83.7 | -48.8 | 0 | 0 | 0 | 113.8 | E10 A14 | E10-D12 PolarHBondContact O-N 3.36Å; D12-A14 PolarHBondContact O-N 3.12Å |
| 13 | Q | 61.2 | Low | 71.1 | Confident | 152 Ų | 152 | 140.2 Ų | 140.2 | 71% | 0.71 | 79% | 0.787 | S | S | * | * | | | trans | -67.2 | 80.9 | 160.5 | -65.6 | -167.8 | 33.4 | 0 | 0 | 107.3 | E10 E11 R15 | E10-Q13 PolarHBondContact OE2-NE2 3.35Å; E11-Q13 PolarHBondContact O-N 3.15Å; Q13-R15 PolarHBondContact O-N 3.3Å |
| 14 | A | 71.3 | Confident | 72.1 | Confident | 90 Ų | 90 | 138.9 Ų | 138.9 | 74% | 0.744 | 79% | 0.787 | S | S | * | * | | | trans | -57.6 | 106.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 107.8 | D12 | D12-A14 PolarHBondContact O-N 3.12Š|
| 15 | R | 74.7 | Confident | 72.7 | Confident | 231 Ų | 231 | 136.2 Ų | 136.2 | 87% | 0.872 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 138.7 | 179.9 | -68.2 | -178.5 | -175.1 | 176.7 | 2 | 108.5 | Q13 | Q13-R15 PolarHBondContact O-N 3.3Š|
| 16 | P | 82.9 | Confident | 72.9 | Confident | 112 Ų | 112 | 135.1 Ų | 135.1 | 73% | 0.727 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 146.3 | 175.9 | 24.5 | -33.4 | 0 | 0 | 0 | 109.6 | R18 | P16-R18 PolarHBondContact O-N 3.45Š|
| 17 | P | 84.5 | Confident | 72.9 | Confident | 127 Ų | 127 | 139.8 Ų | 139.8 | 83% | 0.825 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -56.3 | 135.6 | -179.2 | 24 | -33.7 | 0 | 0 | 0 | 109.8 | A19 | P17-A19 PolarHBondContact O-N 3.44Š|
| 18 | R | 85.9 | Confident | 73 | Confident | 242 Ų | 242 | 142.5 Ų | 142.5 | 91% | 0.913 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 129.2 | -179.3 | -153.1 | 173.2 | -173.6 | 171.2 | 0.5 | 108.7 | P16 | P16-R18 PolarHBondContact O-N 3.45Š|
| 19 | A | 86.3 | Confident | 73.5 | Confident | 97 Ų | 97 | 143.6 Ų | 143.6 | 80% | 0.802 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 137.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | P17 | P17-A19 PolarHBondContact O-N 3.44Š|
| 20 | L | 86.3 | Confident | 73.8 | Confident | 156 Ų | 156 | 142.6 Ų | 142.6 | 82% | 0.817 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -73 | 147.7 | 174.8 | -64.2 | 178.3 | 0 | 0 | 0 | 110.2 | | |
| 21 | P | 88.9 | Confident | 74.3 | Confident | 101 Ų | 101 | 142.6 Ų | 142.6 | 66% | 0.656 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 152.5 | 172.1 | 28.4 | -34.7 | 0 | 0 | 0 | 110.4 | V23 | P21-V23 PolarHBondContact O-N 3.4Š|
| 22 | P | 85 | Confident | 74.9 | Confident | 125 Ų | 125 | 139 Ų | 139 | 81% | 0.812 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 124.7 | 176 | 25 | -33 | 0 | 0 | 0 | 109.4 | | |
| 23 | V | 79.6 | Confident | 75.3 | Confident | 118 Ų | 118 | 138.5 Ų | 138.5 | 72% | 0.715 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -73.2 | 132.8 | 174.3 | -174.1 | 0 | 0 | 0 | 0 | 107.2 | P21 S25 | P21-V23 PolarHBondContact O-N 3.4Å; V23-S25 PolarHBondContact O-N 2.88Å |
| 24 | P | 80 | Confident | 75.8 | Confident | 119 Ų | 119 | 136.8 Ų | 136.8 | 77% | 0.773 | 78% | 0.783 | S | S | * | * | | | trans | -62.2 | 106 | 172.5 | 25.8 | -32.7 | 0 | 0 | 0 | 108.4 | A26 | P24-A26 PolarHBondContact O-N 3.44Š|
| 25 | S | 71.8 | Confident | 76.1 | Confident | 107 Ų | 107 | 139.9 Ų | 139.9 | 75% | 0.748 | 78% | 0.782 | S | S | * | * | | | trans | -57.8 | 124.6 | 166.3 | -56.8 | 0 | 0 | 0 | 0 | 107.3 | V23 I27 | V23-S25 PolarHBondContact O-N 2.88Å; S25-I27 PolarHBondContact O-N 3.08Å |
| 26 | A | 68.1 | Low | 76.1 | Confident | 88 Ų | 88 | 134.7 Ų | 134.7 | 73% | 0.727 | 78% | 0.778 | S | S | * | * | | | trans | -55.3 | 106.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 108.8 | P24 Q28 | P24-A26 PolarHBondContact O-N 3.44Å; A26-Q28 HydrophobicContact CB-CG 4.46Å; A26-Q28 PolarHBondContact O-N 2.85Å |
| 27 | I | 65.3 | Low | 75.9 | Confident | 155 Ų | 155 | 139.1 Ų | 139.1 | 80% | 0.795 | 79% | 0.786 | S | S | * | * | | | trans | -68.1 | 91.4 | 169.1 | -62.8 | 160.9 | 0 | 0 | 0 | 105.2 | S25 D29 | S25-I27 PolarHBondContact O-N 3.08Å; I27-D29 PolarHBondContact O-N 2.88Å |
| 28 | Q | 63.3 | Low | 75.6 | Confident | 175 Ų | 175 | 143.1 Ų | 143.1 | 82% | 0.818 | 79% | 0.79 | S | S | * | * | | | trans | -90.4 | 60.1 | 167.5 | -68.1 | -165.8 | -71.5 | 0 | 0 | 109.1 | A26 | A26-Q28 HydrophobicContact CB-CG 4.46Å; A26-Q28 PolarHBondContact O-N 2.85Å |
| 29 | D | 66 | Low | 75.3 | Confident | 149 Ų | 149 | 141.2 Ų | 141.2 | 80% | 0.797 | 79% | 0.788 | S | S | * | * | | | trans | -152 | 64.3 | 174.2 | -79.6 | -46.8 | 0 | 0 | 0 | 110.3 | I27 | I27-D29 PolarHBondContact O-N 2.88Š|
| 30 | D | 65.9 | Low | 74.7 | Confident | 151 Ų | 151 | 145.9 Ų | 145.9 | 81% | 0.807 | 79% | 0.791 | S | S | * | * | | | trans | -152 | 50.6 | 155 | -159.9 | 23.8 | 0 | 0 | 0 | 111.3 | P32 | D30-P32 WeakPolarHBondContact O-CD 3.49Š|
| 31 | I | 70.3 | Confident | 73.9 | Confident | 157 Ų | 157 | 143.9 Ų | 143.9 | 81% | 0.805 | 79% | 0.79 | S | S | * | * | | | trans | -92.6 | 112.9 | 162.6 | -57.5 | 171.6 | 0 | 0 | 0 | 105.8 | L33 | I31-L33 PolarHBondContact O-N 2.91Å; I31-L33 VanDerWaalsContact O-N 3.08Å |
| 32 | P | 72.5 | Confident | 73 | Confident | 108 Ų | 108 | 150.4 Ų | 150.4 | 70% | 0.701 | 80% | 0.801 | S | S | * | * | | | trans | -60.5 | 120.7 | 175.1 | 23.5 | -31.5 | 0 | 0 | 0 | 108.6 | D30 S34 | D30-P32 WeakPolarHBondContact O-CD 3.49Å; P32-S34 PolarHBondContact O-N 3.35Å |
| 33 | L | 72 | Confident | 72.1 | Confident | 148 Ų | 148 | 150.4 Ų | 150.4 | 78% | 0.775 | 80% | 0.8 | S | S | * | * | | | trans | -57.5 | 100.5 | 174.3 | -75.8 | 147.2 | 0 | 0 | 0 | 108.7 | I31 H35 | I31-L33 PolarHBondContact O-N 2.91Å; I31-L33 VanDerWaalsContact O-N 3.08Å; L33-H35 VanDerWaalsContact C-N 3.35Å; L33-H35 PolarHBondContact O-CD2 2.91Å; L33-H35 PolarHBondContact O-N 3.18Å |
| 34 | S | 72.3 | Confident | 71.2 | Confident | 117 Ų | 117 | 154.3 Ų | 154.3 | 82% | 0.818 | 81% | 0.807 | S | S | * | * | | | trans | -66.1 | 92 | 177.7 | 179.9 | 0 | 0 | 0 | 0 | 109.1 | P32 | P32-S34 PolarHBondContact O-N 3.35Š|
| 35 | H | 75.9 | Confident | 70.2 | Confident | 154 Ų | 154 | 154.3 Ų | 154.3 | 71% | 0.713 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 128.9 | 175.8 | -65 | -64.4 | 0 | 0 | 0 | 110 | L33 K37 | L33-H35 VanDerWaalsContact C-N 3.35Å; L33-H35 PolarHBondContact O-CD2 2.91Å; L33-H35 PolarHBondContact O-N 3.18Å; H35-K37 PolarHBondContact O-N 3.27Å |
| 36 | P | 76.3 | Confident | 69.3 | Low | 122 Ų | 122 | 154.4 Ų | 154.4 | 79% | 0.792 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 122.2 | -177.1 | 22.9 | -31.1 | 0 | 0 | 0 | 110.7 | K38 | P36-K38 PolarHBondContact O-N 3.15Š|
| 37 | K | 77.3 | Confident | 68.2 | Low | 205 Ų | 205 | 158.2 Ų | 158.2 | 89% | 0.891 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 127.3 | 177.2 | -69.5 | -179.9 | 177.2 | 173.7 | 0 | 109.9 | H35 K39 | H35-K37 PolarHBondContact O-N 3.27Å; K37-K39 PolarHBondContact O-N 2.9Å; K37-K39 VanDerWaalsContact O-N 3.15Å |
| 38 | K | 79 | Confident | 67.1 | Low | 212 Ų | 212 | 154.4 Ų | 154.4 | 92% | 0.922 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 116.1 | 176.7 | -66.3 | -177.3 | 179.2 | 179.1 | 0 | 110.3 | P36 | P36-K38 PolarHBondContact O-N 3.15Š|
| 39 | K | 79.3 | Confident | 66.3 | Low | 201 Ų | 201 | 152.8 Ų | 152.8 | 87% | 0.874 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -74.3 | 126.8 | 173.2 | -172.8 | 176.8 | -179.9 | 177.3 | 0 | 109.3 | K37 | K37-K39 PolarHBondContact O-N 2.9Å; K37-K39 VanDerWaalsContact O-N 3.15Å |
| 40 | K | 74.6 | Confident | 65.1 | Low | 195 Ų | 195 | 150.5 Ų | 150.5 | 85% | 0.848 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 132 | 171.7 | -55 | 178.2 | -175.9 | -178.6 | 0 | 108.3 | R42 | K40-R42 PolarHBondContact O-N 3.34Š|
| 41 | S | 68.6 | Low | 64.1 | Low | 115 Ų | 115 | 148.8 Ų | 148.8 | 80% | 0.804 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 124.1 | 173 | 47.3 | 0 | 0 | 0 | 0 | 109.1 | T43 | S41-T43 PolarHBondContact O-N 3.31Š|
| 42 | R | 70.4 | Confident | 63.1 | Low | 237 Ų | 237 | 146.3 Ų | 146.3 | 89% | 0.894 | 81% | 0.81 | S | S | * | * | | | trans | -80.8 | 105.4 | 169.9 | -178.9 | 173 | 177 | 172.3 | -1.3 | 106.9 | K40 K44 | K40-R42 PolarHBondContact O-N 3.34Å; R42-K44 PolarHBondContact O-N 3.43Å; R42-K44 VanDerWaalsContact O-N 3.12Å |
| 43 | T | 66.4 | Low | 61.7 | Low | 126 Ų | 126 | 150.2 Ų | 150.2 | 77% | 0.773 | 82% | 0.819 | S | S | * | * | | | trans | -56.5 | 115.6 | 174 | -37 | 0 | 0 | 0 | 0 | 108.7 | S41 S45 | S41-T43 PolarHBondContact O-N 3.31Å; T43-S45 PolarHBondContact O-N 3.05Å |
| 44 | K | 59.9 | Low | 60.1 | Low | 199 Ų | 199 | 146 Ų | 146 | 87% | 0.865 | 81% | 0.812 | S | S | * | * | | | trans | -81.6 | 104.3 | 163.7 | -74.2 | -175.4 | 178.6 | -179.6 | 0 | 106.6 | R42 S46 | R42-K44 PolarHBondContact O-N 3.43Å; R42-K44 VanDerWaalsContact O-N 3.12Å; K44-S46 PolarHBondContact O-N 2.76Å |
| 45 | S | 58.1 | Low | 58.7 | Low | 120 Ų | 120 | 149.8 Ų | 149.8 | 84% | 0.839 | 82% | 0.816 | S | S | * | * | | | trans | -81.6 | 105.4 | 164.7 | 57.8 | 0 | 0 | 0 | 0 | 108.4 | T43 | T43-S45 PolarHBondContact O-N 3.05Š|
| 46 | S | 53 | Low | 57.1 | Low | 109 Ų | 109 | 147 Ų | 147 | 76% | 0.762 | 82% | 0.819 | S | S | * | * | | | trans | -114.3 | 105.4 | 166.3 | 63.3 | 0 | 0 | 0 | 0 | 109.4 | K44 | K44-S46 PolarHBondContact O-N 2.76Š|
| 47 | L | 46.8 | Very low | 55.8 | Low | 167 Ų | 167 | 149.2 Ų | 149.2 | 87% | 0.874 | 82% | 0.819 | S | S | * | * | | | trans | -177.3 | 100.8 | 148.1 | -151.1 | 56.5 | 0 | 0 | 0 | 106.5 | | |
| 48 | A | 40.8 | Very low | 54.4 | Low | 75 Ų | 75 | 145.3 Ų | 145.3 | 62% | 0.62 | 82% | 0.815 | S | S | * | * | | | | 74.2 | 127 | 93 | 0 | 0 | 0 | 0 | 0 | 114.9 | | |
| 49 | T | 47.2 | Very low | 53 | Low | 142 Ų | 142 | 140.8 Ų | 140.8 | 87% | 0.871 | 81% | 0.805 | S | S | * | * | | | trans | 67.7 | 105.5 | 149.3 | 56 | 0 | 0 | 0 | 0 | 120.7 | | |
| 50 | A | 41 | Very low | 51.2 | Low | 101 Ų | 101 | 136.6 Ų | 136.6 | 84% | 0.835 | 80% | 0.795 | S | S | * | * | | | | 177.7 | 114.3 | 129.3 | 0 | 0 | 0 | 0 | 0 | 107.6 | | |
| 51 | S | 45.3 | Very low | 49.8 | Very low | 115 Ų | 115 | 134.2 Ų | 134.2 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | | | | 100.8 | 127.4 | 63 | -174.5 | 0 | 0 | 0 | 0 | 111.5 | | |
| 52 | S | 49.2 | Very low | 49 | Very low | 105 Ų | 105 | 140.5 Ų | 140.5 | 73% | 0.734 | 80% | 0.798 | S | S | * | * | | | trans | 76.5 | 107.2 | 160.2 | -161.8 | 0 | 0 | 0 | 0 | 116.7 | | |
| 53 | E | 43.5 | Very low | 47.8 | Very low | 189 Ų | 189 | 141.3 Ų | 141.3 | 88% | 0.883 | 80% | 0.801 | S | S | * | * | | | | 75.8 | 123.6 | 63.9 | -170.1 | 166.4 | -166.8 | 0 | 0 | 114.5 | | |
| 54 | G | 38.2 | Very low | 46.9 | Very low | 61 Ų | 61 | 140 Ų | 140 | 63% | 0.629 | 80% | 0.803 | S | S | * | * | | | trans | 113.4 | 102.4 | 141.6 | 0 | 0 | 0 | 0 | 0 | 119.3 | | |
| 55 | H | 41.3 | Very low | 46.4 | Very low | 196 Ų | 196 | 140.2 Ų | 140.2 | 91% | 0.907 | 81% | 0.807 | S | S | * | * | | | | 48.5 | 120.2 | 126.8 | -73.7 | -82.9 | 0 | 0 | 0 | 121.7 | | |
| 56 | A | 43.2 | Very low | 45.7 | Very low | 94 Ų | 94 | 137.9 Ų | 137.9 | 78% | 0.777 | 80% | 0.803 | S | S | * | * | | | | 149.1 | 116.6 | 106 | 0 | 0 | 0 | 0 | 0 | 112.8 | | |
| 57 | E | 49 | Very low | 45.4 | Very low | 170 Ų | 170 | 138.2 Ų | 138.2 | 79% | 0.794 | 81% | 0.805 | S | S | * | * | | | trans | -73 | 147.8 | 151.5 | -79.1 | -99.4 | 154.9 | 0 | 0 | 109 | | |
| 58 | P | 48.1 | Very low | 45.4 | Very low | 123 Ų | 123 | 138.5 Ų | 138.5 | 80% | 0.799 | 80% | 0.802 | S | S | * | * | | | | -136.7 | 136.8 | 122 | 34.5 | -23.1 | 0 | 0 | 0 | 114.5 | | |
| 59 | V | 48.3 | Very low | 46.3 | Very low | 117 Ų | 117 | 140.3 Ų | 140.3 | 71% | 0.709 | 81% | 0.807 | S | S | * | * | | | trans | -62.8 | 149 | 163.9 | 172.9 | 0 | 0 | 0 | 0 | 111.1 | | |
| 60 | V | 43.5 | Very low | 46.2 | Very low | 112 Ų | 112 | 139.5 Ų | 139.5 | 68% | 0.679 | 80% | 0.804 | S | S | * | * | | | trans | 137.9 | 105 | 144 | 178.7 | 0 | 0 | 0 | 0 | 114 | | |
| 61 | N | 44 | Very low | 46.1 | Very low | 146 Ų | 146 | 139.2 Ų | 139.2 | 78% | 0.781 | 80% | 0.802 | S | S | * | * | | | trans | 73.4 | 107.5 | 143 | -59.7 | -9 | 0 | 0 | 0 | 122.7 | | |
| 62 | R | 52.5 | Low | 46.2 | Very low | 246 Ų | 246 | 137.5 Ų | 137.5 | 93% | 0.928 | 80% | 0.795 | S | S | * | * | | | | -165.2 | 121.5 | 109.5 | -107.6 | -169.2 | -85.7 | -169.7 | -2.8 | 111.3 | | |
| 63 | R | 44.3 | Very low | 45.9 | Very low | 254 Ų | 254 | 140.9 Ų | 140.9 | 96% | 0.958 | 80% | 0.799 | S | S | * | * | | | trans | -67.1 | 130.9 | 164.1 | -73.4 | 178.5 | 177.1 | 148.8 | -1.5 | 108.5 | | |
| 64 | A | 48.3 | Very low | 46 | Very low | 99 Ų | 99 | 139.1 Ų | 139.1 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | | | trans | -140.4 | 101.6 | 161.8 | 0 | 0 | 0 | 0 | 0 | 107.7 | | |
| 65 | E | 49.9 | Very low | 46.3 | Very low | 203 Ų | 203 | 144.3 Ų | 144.3 | 95% | 0.949 | 80% | 0.8 | S | S | * | * | | | trans | -68.5 | 134.8 | 162.6 | -70.2 | 173.7 | 161.1 | 0 | 0 | 108.3 | | |
| 66 | G | 41.7 | Very low | 46.3 | Very low | 72 Ų | 72 | 144.3 Ų | 144.3 | 74% | 0.742 | 80% | 0.8 | S | S | * | * | | | trans | 168 | 70.6 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | | |
| 67 | S | 47.2 | Very low | 46.5 | Very low | 116 Ų | 116 | 146.9 Ų | 146.9 | 81% | 0.811 | 80% | 0.796 | S | S | * | * | | | trans | 29.7 | 127.6 | 137.1 | -174.3 | 0 | 0 | 0 | 0 | 120.9 | | |
| 68 | E | 47.6 | Very low | 46.6 | Very low | 172 Ų | 172 | 144.6 Ų | 144.6 | 80% | 0.804 | 80% | 0.796 | S | S | * | * | | | trans | 105.7 | 114.2 | 145.6 | -159.4 | 170.6 | 179.4 | 0 | 0 | 117.7 | | |
| 69 | P | 59.8 | Low | 46.1 | Very low | 114 Ų | 114 | 148 Ų | 148 | 74% | 0.74 | 80% | 0.802 | S | S | * | * | | | trans | -83.5 | 147.6 | 168.7 | 32.5 | -31.4 | 0 | 0 | 0 | 112.6 | | |
| 70 | P | 45.1 | Very low | 45.9 | Very low | 124 Ų | 124 | 146.9 Ų | 146.9 | 81% | 0.805 | 80% | 0.804 | S | S | * | * | | | trans | -86.3 | 138.5 | -172.1 | 34.1 | -34.5 | 0 | 0 | 0 | 114.3 | | |
| 71 | A | 37.5 | Very low | 46.2 | Very low | 95 Ų | 95 | 147.6 Ų | 147.6 | 79% | 0.785 | 81% | 0.811 | S | S | * | * | | | | 45.5 | 133.5 | 127.6 | 0 | 0 | 0 | 0 | 0 | 122.5 | | |
| 72 | A | 48 | Very low | 46.3 | Very low | 80 Ų | 80 | 144.9 Ų | 144.9 | 66% | 0.661 | 81% | 0.809 | S | S | * | * | | | trans | 81.1 | 105.4 | 141.6 | 0 | 0 | 0 | 0 | 0 | 117.1 | | |
| 73 | E | 43.6 | Very low | 46.1 | Very low | 175 Ų | 175 | 138.7 Ų | 138.7 | 82% | 0.818 | 80% | 0.801 | S | S | * | * | | | | 81.6 | 123 | 95.8 | -76.3 | -179.6 | -175.1 | 0 | 0 | 112.4 | | |
| 74 | L | 46 | Very low | 46.9 | Very low | 153 Ų | 153 | 138 Ų | 138 | 80% | 0.801 | 80% | 0.798 | S | S | * | * | | | | 174.7 | 110.4 | 115.7 | -88.1 | 170.1 | 0 | 0 | 0 | 110.5 | | |
| 75 | K | 43.3 | Very low | 47.4 | Very low | 170 Ų | 170 | 144.8 Ų | 144.8 | 74% | 0.739 | 80% | 0.803 | S | S | * | * | | | trans | 28.9 | 93.7 | 143.8 | -73.8 | 173.6 | 173.2 | 170.9 | 0 | 117 | | |
| 76 | E | 42.1 | Very low | 47.9 | Very low | 195 Ų | 195 | 144 Ų | 144 | 91% | 0.911 | 80% | 0.799 | S | S | * | * | | | trans | -87.3 | 103.2 | 153.1 | -164.2 | 174.1 | 167.5 | 0 | 0 | 107.9 | | |
| 77 | H | 46.4 | Very low | 49 | Very low | 149 Ų | 149 | 150.5 Ų | 150.5 | 69% | 0.69 | 81% | 0.807 | S | S | * | * | | | trans | -68.4 | 137.7 | 177.1 | -78.7 | -94.7 | 0 | 0 | 0 | 110.9 | | |
| 78 | P | 52.3 | Low | 49.9 | Very low | 122 Ų | 122 | 154.8 Ų | 154.8 | 79% | 0.792 | 81% | 0.811 | S | S | * | * | | | trans | -90.5 | 115.9 | 167.1 | 33.3 | -25.7 | 0 | 0 | 0 | 109.2 | | |
| 79 | E | 37 | Very low | 50.8 | Low | 195 Ų | 195 | 154.3 Ų | 154.3 | 91% | 0.911 | 81% | 0.812 | S | S | * | * | | | trans | -154.8 | 104.4 | 161.1 | -151.8 | 167.4 | 159.6 | 0 | 0 | 113.6 | | |
| 80 | A | 44.8 | Very low | 51.3 | Low | 93 Ų | 93 | 159.5 Ų | 159.5 | 77% | 0.769 | 82% | 0.817 | S | S | * | * | | | trans | -154.9 | 156.1 | 158.4 | 0 | 0 | 0 | 0 | 0 | 108.4 | | |
| 81 | P | 47.9 | Very low | 52.1 | Low | 126 Ų | 126 | 158.6 Ų | 158.6 | 82% | 0.818 | 81% | 0.811 | S | S | * | * | | | cis | -132.6 | 174.1 | -23.6 | 35.5 | -17.5 | 0 | 0 | 0 | 114.5 | | |
| 82 | A | 47.8 | Very low | 53.4 | Low | 90 Ų | 90 | 159.5 Ų | 159.5 | 74% | 0.744 | 81% | 0.809 | S | S | * | * | | | trans | 106.9 | 136.2 | 152.4 | 0 | 0 | 0 | 0 | 0 | 118.4 | | |
| 83 | P | 47.8 | Very low | 54.2 | Low | 116 Ų | 116 | 161 Ų | 161 | 75% | 0.753 | 81% | 0.812 | S | S | * | * | | | | -136.2 | 129.7 | 95.1 | 34.4 | -20.8 | 0 | 0 | 0 | 115.6 | | |
| 84 | R | 60 | Low | 55.1 | Low | 240 Ų | 240 | 162.2 Ų | 162.2 | 91% | 0.906 | 82% | 0.818 | S | S | * | * | | | trans | 17.5 | 113 | 139.5 | -57 | 172.7 | 72.3 | 174.4 | 2.1 | 117.1 | | |
| 85 | R | 59.1 | Low | 55.7 | Low | 240 Ų | 240 | 162 Ų | 162 | 91% | 0.906 | 82% | 0.817 | S | S | * | * | | | trans | -125.8 | 108.7 | 160.6 | -71.3 | 178.4 | 66.4 | -145.9 | 1.1 | 111.3 | | |
| 86 | Q | 61.8 | Low | 55.8 | Low | 188 Ų | 188 | 163.4 Ų | 163.4 | 88% | 0.879 | 83% | 0.826 | S | S | * | * | | | trans | 10.6 | 113.8 | 157 | -60.7 | 169.4 | -10.3 | 0 | 0 | 118 | K88 | Q86-K88 PolarHBondContact O-N 3.05Š|
| 87 | K | 64.8 | Low | 56.5 | Low | 207 Ų | 207 | 160.5 Ų | 160.5 | 90% | 0.9 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -68 | 118.1 | 163.1 | -62.7 | -179.1 | 178.9 | -178 | 0 | 108.3 | I89 | K87-I89 PolarHBondContact O-N 2.94Š|
| 88 | K | 65.9 | Low | 56.7 | Low | 206 Ų | 206 | 158.6 Ų | 158.6 | 90% | 0.896 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -73.1 | 121.2 | 166.6 | -70.9 | -166 | 177.1 | -171.3 | 0 | 108.4 | Q86 | Q86-K88 PolarHBondContact O-N 3.05Š|
| 89 | I | 65.9 | Low | 56.8 | Low | 162 Ų | 162 | 160.7 Ų | 160.7 | 83% | 0.831 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 127.3 | 177 | -66.3 | 158.7 | 0 | 0 | 0 | 108 | K87 | K87-I89 PolarHBondContact O-N 2.94Š|
| 90 | R | 71.2 | Confident | 57.2 | Low | 224 Ų | 224 | 157.5 Ų | 157.5 | 85% | 0.845 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 130.9 | 173.2 | -175.7 | -178.5 | -176.6 | 175.2 | 2.6 | 108.5 | | |
| 91 | P | 62.1 | Low | 57.8 | Low | 104 Ų | 104 | 160.9 Ų | 160.9 | 68% | 0.675 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -71 | 143.7 | 171.6 | 28.1 | -30.7 | 0 | 0 | 0 | 110.3 | | |
| 92 | P | 64.3 | Low | 58.1 | Low | 115 Ų | 115 | 165.8 Ų | 165.8 | 75% | 0.747 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -70 | 148.4 | 174.9 | 29.2 | -32 | 0 | 0 | 0 | 110.7 | E94 | P92-E94 PolarHBondContact O-N 2.9Š|
| 93 | P | 64.9 | Low | 58.3 | Low | 112 Ų | 112 | 167.8 Ų | 167.8 | 73% | 0.727 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 126.8 | 173.1 | 28.4 | -31.2 | 0 | 0 | 0 | 110 | L95 | P93-L95 PolarHBondContact O-N 2.89Š|
| 94 | E | 61.2 | Low | 58.5 | Low | 200 Ų | 200 | 168.1 Ų | 168.1 | 94% | 0.935 | 84% | 0.835 | S | S | * | * | | | trans | -64.4 | 101.7 | 174.8 | -65 | -177.7 | 171.6 | 0 | 0 | 109.4 | P92 | P92-E94 PolarHBondContact O-N 2.9Š|
| 95 | L | 58.8 | Low | 58.4 | Low | 149 Ų | 149 | 161.9 Ų | 161.9 | 78% | 0.78 | 83% | 0.828 | S | S | * | * | | | trans | -87.9 | 122 | 158.3 | -64.8 | 173.8 | 0 | 0 | 0 | 105.7 | P93 | P93-L95 PolarHBondContact O-N 2.89Š|
| 96 | E | 46.5 | Very low | 58.4 | Low | 198 Ų | 198 | 156.7 Ų | 156.7 | 93% | 0.925 | 83% | 0.826 | S | S | * | * | | | trans | -178.4 | 137.7 | 138.2 | -97.8 | 158.6 | 179.6 | 0 | 0 | 113.5 | | |
| 97 | T | 55.7 | Low | 58.1 | Low | 134 Ų | 134 | 153 Ų | 153 | 82% | 0.822 | 82% | 0.82 | S | S | * | * | | | trans | -76.7 | 140.4 | -175 | 48.4 | 0 | 0 | 0 | 0 | 112.3 | | |
| 98 | S | 50 | Low | 57.7 | Low | 110 Ų | 110 | 150.4 Ų | 150.4 | 77% | 0.769 | 82% | 0.816 | S | S | * | * | | | trans | -134.6 | 86.6 | 155.4 | 63.3 | 0 | 0 | 0 | 0 | 110.2 | T100 | S98-T100 PolarHBondContact O-N 2.75Š|
| 99 | L | 54.5 | Low | 57.5 | Low | 166 Ų | 166 | 148 Ų | 148 | 87% | 0.869 | 81% | 0.812 | S | S | * | * | | | trans | -74.3 | 102.4 | 158.4 | 176.3 | 74.1 | 0 | 0 | 0 | 106.8 | | |
| 100 | T | 47.4 | Very low | 56.9 | Low | 128 Ų | 128 | 150.2 Ų | 150.2 | 79% | 0.785 | 81% | 0.81 | S | S | * | * | | | trans | -107.4 | 121.8 | 166.4 | 41.9 | 0 | 0 | 0 | 0 | 109.8 | S98 | S98-T100 PolarHBondContact O-N 2.75Š|
| 101 | E | 56.2 | Low | 56.3 | Low | 163 Ų | 163 | 144.5 Ų | 144.5 | 76% | 0.762 | 80% | 0.796 | S | S | * | * | | | trans | -63.2 | 138 | -178.6 | -57.7 | 165.4 | 120.1 | 0 | 0 | 112.5 | | |
| 102 | R | 54.7 | Low | 56.1 | Low | 230 Ų | 230 | 145.8 Ų | 145.8 | 87% | 0.868 | 79% | 0.793 | S | S | * | * | | | | 157.9 | 136 | 116.2 | -82.9 | 170.3 | -165.3 | -167.6 | 4.4 | 111.5 | | |
| 103 | P | 52.3 | Low | 55.7 | Low | 131 Ų | 131 | 148.1 Ų | 148.1 | 85% | 0.851 | 80% | 0.799 | S | S | * | * | | | trans | -85.9 | 136.3 | 168.9 | 33.4 | -29.7 | 0 | 0 | 0 | 110.7 | | |
| 104 | S | 52.2 | Low | 55.2 | Low | 124 Ų | 124 | 146.4 Ų | 146.4 | 87% | 0.867 | 80% | 0.802 | S | S | * | * | | | trans | -112.2 | 123.8 | 161.1 | -175.4 | 0 | 0 | 0 | 0 | 108 | | |
| 105 | S | 57.6 | Low | 54.7 | Low | 108 Ų | 108 | 144.4 Ų | 144.4 | 76% | 0.755 | 80% | 0.796 | S | S | * | * | | | trans | -57.4 | 153.4 | -167.3 | -40.5 | 0 | 0 | 0 | 0 | 115.2 | | |
| 106 | P | 58.4 | Low | 54.5 | Low | 132 Ų | 132 | 144.1 Ų | 144.1 | 86% | 0.857 | 80% | 0.795 | S | S | * | * | | | trans | -83.2 | 134.4 | 172.2 | 34.2 | -29.2 | 0 | 0 | 0 | 109.6 | | |
| 107 | S | 55.8 | Low | 55.1 | Low | 109 Ų | 109 | 138.2 Ų | 138.2 | 76% | 0.762 | 78% | 0.78 | S | S | * | * | | | trans | -120.8 | 134.7 | 170.4 | -173.8 | 0 | 0 | 0 | 0 | 110.7 | | |
| 108 | L | 56.1 | Low | 55 | Low | 154 Ų | 154 | 138.5 Ų | 138.5 | 81% | 0.806 | 77% | 0.772 | S | S | * | * | | | trans | 79 | 76.5 | 163.3 | -101.4 | 151.3 | 0 | 0 | 0 | 117.2 | R110 | L108-R110 PolarHBondContact O-N 3.22Š|
| 109 | L | 60.9 | Low | 55.1 | Low | 154 Ų | 154 | 138.9 Ų | 138.9 | 81% | 0.806 | 77% | 0.772 | S | S | * | * | | | trans | -42.5 | 119 | 140.1 | -63.7 | 168 | 0 | 0 | 0 | 110.5 | | |
| 110 | R | 53.1 | Low | 54.4 | Low | 209 Ų | 209 | 140.7 Ų | 140.7 | 79% | 0.789 | 77% | 0.767 | S | S | * | * | | | trans | -119.3 | 80.2 | 145.4 | -164.5 | 177.5 | -174.7 | -97.1 | -7.1 | 108.4 | L108 | L108-R110 PolarHBondContact O-N 3.22Š|
| 111 | N | 59 | Low | 54.9 | Low | 105 Ų | 105 | 143.5 Ų | 143.5 | 56% | 0.561 | 77% | 0.771 | S | S | * | * | | | trans | -42.3 | 130.2 | 145.6 | 44.8 | -58.5 | 0 | 0 | 0 | 110.3 | | |
| 112 | E | 58.9 | Low | 54.9 | Low | 131 Ų | 131 | 143.8 Ų | 143.8 | 61% | 0.612 | 77% | 0.773 | S | S | * | * | | | | 158.7 | 120.2 | 109.6 | 67.7 | -153.5 | 161.5 | 0 | 0 | 112.3 | | |
| 113 | N | 56.2 | Low | 55.2 | Low | 164 Ų | 164 | 137.4 Ų | 137.4 | 88% | 0.877 | 77% | 0.769 | S | S | * | * | | | trans | 56.7 | 109.6 | 136 | -61.1 | 57.7 | 0 | 0 | 0 | 119.3 | | |
| 114 | G | 53.7 | Low | 55.7 | Low | 76 Ų | 76 | 136.1 Ų | 136.1 | 78% | 0.784 | 76% | 0.759 | S | S | * | * | | | trans | -164.1 | 40.4 | 163 | 0 | 0 | 0 | 0 | 0 | 112.6 | D116 | G114-D116 PolarHBondContact O-N 3.29Å; G114-D116 VanDerWaalsContact O-N 3.07Å |
| 115 | I | 51 | Low | 56.2 | Low | 157 Ų | 157 | 137.6 Ų | 137.6 | 81% | 0.805 | 76% | 0.756 | S | S | * | * | | | trans | -74.1 | 90.3 | 159.5 | 59.3 | 117.8 | 0 | 0 | 0 | 106.5 | A117 | I115-A117 HydrophobicContact CD1-CB 3.97Å; I115-A117 PolarHBondContact O-N 3.44Å |
| 116 | D | 53.3 | Low | 56.8 | Low | 144 Ų | 144 | 137.5 Ų | 137.5 | 77% | 0.77 | 75% | 0.752 | S | S | * | * | | | trans | -70 | 81.3 | 162.9 | -176.3 | 30.6 | 0 | 0 | 0 | 107.4 | G114 E118 | G114-D116 PolarHBondContact O-N 3.29Å; G114-D116 VanDerWaalsContact O-N 3.07Å; D116-E118 VanDerWaalsContact C-N 3.34Å; D116-E118 PolarHBondContact O-N 3.05Å |
| 117 | A | 59.2 | Low | 57.6 | Low | 73 Ų | 73 | 140.1 Ų | 140.1 | 60% | 0.603 | 75% | 0.75 | S | S | * | * | | | trans | -93.9 | 70.4 | 168.9 | 0 | 0 | 0 | 0 | 0 | 108 | I115 P119 | I115-A117 HydrophobicContact CD1-CB 3.97Å; I115-A117 PolarHBondContact O-N 3.44Å; A117-P119 WeakPolarHBondContact O-CD 3.26Å |
| 118 | E | 54 | Low | 58.3 | Low | 141 Ų | 141 | 141.4 Ų | 141.4 | 66% | 0.659 | 76% | 0.756 | S | S | * | * | | | trans | -91.6 | 106.5 | 152.3 | -92.9 | -154.9 | 161.2 | 0 | 0 | 109.3 | D116 | D116-E118 VanDerWaalsContact C-N 3.34Å; D116-E118 PolarHBondContact O-N 3.05Å |
| 119 | P | 53.3 | Low | 59.2 | Low | 117 Ų | 117 | 144.8 Ų | 144.8 | 76% | 0.76 | 76% | 0.758 | S | S | * | * | | | trans | -96.9 | 78.7 | 137.6 | 30.8 | -25.6 | 0 | 0 | 0 | 106.4 | A117 E121 | A117-P119 WeakPolarHBondContact O-CD 3.26Å; P119-E121 PolarHBondContact O-N 2.88Å |
| 120 | R | 38.3 | Very low | 59.9 | Low | 205 Ų | 205 | 149.1 Ų | 149.1 | 77% | 0.774 | 76% | 0.763 | S | S | * | * | | | trans | -58.5 | 121.2 | 170.2 | -178 | 170.9 | 179.6 | -108.9 | -0.3 | 108.2 | E122 | R120-E122 PolarHBondContact O-N 2.98Š|
| 121 | E | 58.6 | Low | 60.8 | Low | 186 Ų | 186 | 148.9 Ų | 148.9 | 87% | 0.869 | 77% | 0.768 | S | S | * | * | | | trans | -45.1 | 106.7 | 177.1 | -59.8 | 176.4 | 163.5 | 0 | 0 | 112 | P119 | P119-E121 PolarHBondContact O-N 2.88Š|
| 122 | E | 56.3 | Low | 61.4 | Low | 169 Ų | 169 | 148.1 Ų | 148.1 | 79% | 0.79 | 78% | 0.776 | S | S | * | * | | | trans | -113.9 | 85.2 | 158.6 | -151.5 | -177.2 | -168.5 | 0 | 0 | 107.9 | R120 V124 | R120-E122 PolarHBondContact O-N 2.98Å; E122-V124 HydrophobicContact CG-CG2 3.87Å; E122-V124 PolarHBondContact O-N 2.75Å |
| 123 | A | 61 | Low | 62.2 | Low | 97 Ų | 97 | 151.3 Ų | 151.3 | 80% | 0.802 | 79% | 0.788 | S | S | * | * | | | trans | -69.9 | 75.2 | 172.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | I125 | A123-I125 PolarHBondContact O-N 3.27Š|
| 124 | V | 62.1 | Low | 63 | Low | 103 Ų | 103 | 153.5 Ų | 153.5 | 62% | 0.624 | 79% | 0.79 | S | S | * | * | | | trans | -82.6 | 98.6 | 167.2 | -175.8 | 0 | 0 | 0 | 0 | 107.8 | E122 P126 | E122-V124 HydrophobicContact CG-CG2 3.87Å; E122-V124 PolarHBondContact O-N 2.75Å; V124-P126 WeakPolarHBondContact O-CD 3.34Å; V124-P126 VanDerWaalsContact O-N 3.16Å |
| 125 | I | 64.2 | Low | 63.9 | Low | 156 Ų | 156 | 156 Ų | 156 | 80% | 0.8 | 79% | 0.79 | S | S | * | * | | | trans | -61.3 | 113.7 | 174.2 | -60.2 | 163.9 | 0 | 0 | 0 | 108.5 | A123 | A123-I125 PolarHBondContact O-N 3.27Š|
| 126 | P | 68.4 | Low | 65 | Low | 106 Ų | 106 | 156.2 Ų | 156.2 | 69% | 0.688 | 79% | 0.788 | S | S | * | * | | | trans | -77.9 | 132.9 | -179.9 | 30.1 | -30.8 | 0 | 0 | 0 | 110.4 | V124 | V124-P126 WeakPolarHBondContact O-CD 3.34Å; V124-P126 VanDerWaalsContact O-N 3.16Å |
| 127 | K | 75.3 | Confident | 65.7 | Low | 186 Ų | 186 | 154.3 Ų | 154.3 | 81% | 0.809 | 78% | 0.783 | S | S | * | * | | | trans | -52 | 146.3 | 170.9 | -66.5 | 179.4 | 179.2 | 175.3 | 0 | 110.4 | R129 | K127-R129 PolarHBondContact O-N 3.43Š|
| 128 | P | 71.4 | Confident | 66.3 | Low | 136 Ų | 136 | 155.2 Ų | 155.2 | 88% | 0.883 | 79% | 0.791 | S | S | * | * | | | trans | -66.4 | 96.1 | 174.9 | 26.4 | -32.3 | 0 | 0 | 0 | 110 | | |
| 129 | R | 74.3 | Confident | 67.2 | Low | 225 Ų | 225 | 156.8 Ų | 156.8 | 85% | 0.849 | 80% | 0.798 | S | S | * | * | | | trans | -71 | 134.4 | 173.2 | -70 | 174.7 | 67.5 | 171.6 | -0.1 | 108.6 | K127 K131 | K127-R129 PolarHBondContact O-N 3.43Å; R129-K131 PolarHBondContact O-N 3.32Å |
| 130 | R | 75.7 | Confident | 67.8 | Low | 245 Ų | 245 | 155.6 Ų | 155.6 | 93% | 0.925 | 79% | 0.79 | S | S | * | * | | | trans | -45.1 | 128.4 | 171.1 | -85 | 173.3 | 66.6 | 168.8 | -0 | 108.7 | A132 | R130-A132 PolarHBondContact O-N 3.21Š|
| 131 | K | 72.6 | Confident | 69.1 | Low | 204 Ų | 204 | 155 Ų | 155 | 89% | 0.887 | 80% | 0.796 | S | S | * | * | | | trans | -56.8 | 110.3 | 176 | -60 | -65.9 | -176.3 | 177.9 | 0 | 107.7 | R129 | R129-K131 PolarHBondContact O-N 3.32Š|
| 132 | A | 72.4 | Confident | 69.4 | Low | 89 Ų | 89 | 155.7 Ų | 155.7 | 74% | 0.736 | 79% | 0.793 | S | S | * | * | | | trans | -62 | 143.3 | 167.9 | 0 | 0 | 0 | 0 | 0 | 107.8 | R130 K134 | R130-A132 PolarHBondContact O-N 3.21Å; A132-K134 PolarHBondContact O-N 3.44Å |
| 133 | K | 75.6 | Confident | 69.8 | Low | 199 Ų | 199 | 150.9 Ų | 150.9 | 87% | 0.865 | 78% | 0.781 | S | S | * | * | | | trans | -55.7 | 133.1 | 167.1 | -69.8 | -169 | 176.6 | -175.1 | 0 | 107 | T135 | K133-T135 PolarHBondContact O-N 2.94Š|
| 134 | K | 72.8 | Confident | 70.2 | Confident | 209 Ų | 209 | 150 Ų | 150 | 91% | 0.909 | 77% | 0.77 | S | S | * | * | | | trans | -58.2 | 104.4 | 169.9 | -71.5 | -178.9 | 175 | -176.9 | 0 | 106.6 | A132 Q136 | A132-K134 PolarHBondContact O-N 3.44Å; K134-Q136 PolarHBondContact O-N 2.8Å |
| 135 | T | 71.6 | Confident | 70.6 | Confident | 128 Ų | 128 | 153.5 Ų | 153.5 | 79% | 0.785 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 125.2 | 162.2 | -53.8 | 0 | 0 | 0 | 0 | 105.5 | K133 | K133-T135 PolarHBondContact O-N 2.94Š|
| 136 | Q | 75.5 | Confident | 70.9 | Confident | 162 Ų | 162 | 153.4 Ų | 153.4 | 76% | 0.757 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -51.5 | 127.5 | 172.2 | -87 | -74.2 | 6.8 | 0 | 0 | 107.9 | K134 A138 | K134-Q136 PolarHBondContact O-N 2.8Å; Q136-A138 PolarHBondContact O-N 3.07Å |
| 137 | P | 66.8 | Low | 71.1 | Confident | 104 Ų | 104 | 151.4 Ų | 151.4 | 68% | 0.675 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -55 | 130.3 | 166.8 | 23.9 | -31.6 | 0 | 0 | 0 | 107.3 | E139 | P137-E139 PolarHBondContact O-N 2.85Š|
| 138 | A | 72.6 | Confident | 71.1 | Confident | 93 Ų | 93 | 146.5 Ų | 146.5 | 77% | 0.769 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 128.4 | 168.1 | 0 | 0 | 0 | 0 | 0 | 106.9 | Q136 | Q136-A138 PolarHBondContact O-N 3.07Š|
| 139 | E | 72.1 | Confident | 71.4 | Confident | 174 Ų | 174 | 145.8 Ų | 145.8 | 81% | 0.813 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -49.6 | 127.1 | 172.3 | -157.8 | 165.1 | -147 | 0 | 0 | 107 | P137 Q141 | P137-E139 PolarHBondContact O-N 2.85Å; E139-Q141 PolarHBondContact O-N 3.22Å |
| 140 | P | 66.9 | Low | 71.4 | Confident | 91 Ų | 91 | 141.1 Ų | 141.1 | 59% | 0.591 | 74% | 0.74 | S | S | * | * | | | trans | -58.5 | 111.8 | 178 | 24.9 | -31.4 | 0 | 0 | 0 | 105.6 | Y142 | P140-Y142 HydrophobicContact CG-CD2 4.42Å; P140-Y142 HydrophobicContact CG-CE2 4.13Å; P140-Y142 PolarHBondContact O-N 2.9Å |
| 141 | Q | 64.7 | Low | 71.3 | Confident | 192 Ų | 192 | 137.9 Ų | 137.9 | 90% | 0.897 | 74% | 0.736 | S | S | * | * | | | trans | -60.8 | 95 | 167.2 | -69.5 | 177.5 | -47.4 | 0 | 0 | 104.5 | E139 A143 | E139-Q141 PolarHBondContact O-N 3.22Å; Q141-A143 VanDerWaalsContact C-N 3.28Å; Q141-A143 PolarHBondContact O-N 2.71Å |
| 142 | Y | 65.1 | Low | 71.6 | Confident | 202 Ų | 202 | 134 Ų | 134 | 79% | 0.792 | 73% | 0.725 | S | S | * | * | | | trans | -57.6 | 105.2 | 165.6 | -86.6 | -91.5 | 0 | 0 | 0 | 103.8 | P140 S144 | P140-Y142 HydrophobicContact CG-CD2 4.42Å; P140-Y142 HydrophobicContact CG-CE2 4.13Å; P140-Y142 PolarHBondContact O-N 2.9Å; Y142-S144 PolarHBondContact O-N 2.88Å |
| 143 | A | 65.5 | Low | 72 | Confident | 67 Ų | 67 | 134.2 Ų | 134.2 | 55% | 0.554 | 71% | 0.713 | S | S | * | * | | | trans | -56.9 | 121.3 | 170.3 | 0 | 0 | 0 | 0 | 0 | 104.8 | Q141 E145 | Q141-A143 VanDerWaalsContact C-N 3.28Å; Q141-A143 PolarHBondContact O-N 2.71Å; A143-E145 HydrophobicContact CB-CG 3.52Å; A143-E145 VanDerWaalsContact O-CG 3.26Å; A143-E145 WeakPolarHBondContact O-CG 3.17Å; A143-E145 PolarHBondContact O-N 3.49Å |
| 144 | S | 68.2 | Low | 72 | Confident | 80 Ų | 80 | 132.2 Ų | 132.2 | 56% | 0.559 | 71% | 0.71 | S | S | * | * | | | trans | -71.8 | 57.9 | 176.1 | 53.8 | 0 | 0 | 0 | 0 | 109 | Y142 L146 G147 | Y142-S144 PolarHBondContact O-N 2.88Å; S144-L146 PolarHBondContact O-N 3.23Å; S144-G147 PolarHBondContact O-N 3.37Å |
| 145 | E | 70.4 | Confident | 71.9 | Confident | 175 Ų | 175 | 127.1 Ų | 127.1 | 82% | 0.818 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67 | -13.8 | -171.9 | -38.4 | -167 | -140.2 | 0 | 0 | 111.8 | A143 | A143-E145 HydrophobicContact CB-CG 3.52Å; A143-E145 VanDerWaalsContact O-CG 3.26Å; A143-E145 WeakPolarHBondContact O-CG 3.17Å; A143-E145 PolarHBondContact O-N 3.49Å |
| 146 | L | 71.3 | Confident | 71.7 | Confident | 154 Ų | 154 | 127.9 Ų | 127.9 | 81% | 0.806 | 70% | 0.696 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.4 | 3 | 175.8 | -62 | 179.5 | 0 | 0 | 0 | 113.4 | S144 V148 | S144-L146 PolarHBondContact O-N 3.23Å; L146-V148 HydrophobicContact CB-CG2 4.08Å; L146-V148 PolarHBondContact O-N 3.24Å; L146-V148 VanDerWaalsContact O-N 3.15Å |
| 147 | G | 71.6 | Confident | 71.3 | Confident | 64 Ų | 64 | 127.7 Ų | 127.7 | 66% | 0.66 | 70% | 0.695 | S | S | * | * | S | Bend | trans | 63.2 | 15.8 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | S144 | S144-G147 PolarHBondContact O-N 3.37Š|
| 148 | V | 75.7 | Confident | 71.1 | Confident | 83 Ų | 83 | 131.1 Ų | 131.1 | 50% | 0.503 | 70% | 0.702 | S | S | . | * | | | trans | -98.4 | 125.4 | 173.2 | -60.5 | 0 | 0 | 0 | 0 | 108.1 | L146 | L146-V148 HydrophobicContact CB-CG2 4.08Å; L146-V148 PolarHBondContact O-N 3.24Å; L146-V148 VanDerWaalsContact O-N 3.15Å |
| 149 | E | 78.1 | Confident | 70.3 | Confident | 122 Ų | 122 | 131.4 Ų | 131.4 | 57% | 0.57 | 70% | 0.699 | S | S | * | * | | | trans | -88.1 | 148.3 | 175.6 | -63.9 | 178.6 | 125.2 | 0 | 0 | 108.8 | E151 D152 | E149-E151 PolarHBondContact O-N 3.06Å; E149-D152 PolarHBondContact O-N 2.78Å |
| 150 | D | 75.2 | Confident | 69.6 | Low | 127 Ų | 127 | 130.1 Ų | 130.1 | 68% | 0.679 | 70% | 0.703 | S | S | * | * | G | 310 helix | trans | -60.9 | -17.8 | 178.7 | -64.5 | -50.1 | 0 | 0 | 0 | 112.5 | D152 I153 | D150-D152 VanDerWaalsContact C-N 3.27Å; D150-D152 PolarHBondContact O-N 2.91Å; D150-I153 PolarHBondContact O-N 2.84Å |
| 151 | E | 72.9 | Confident | 69.3 | Low | 176 Ų | 176 | 130.8 Ų | 130.8 | 82% | 0.822 | 70% | 0.701 | S | S | * | * | G | 310 helix | trans | -68 | -22.7 | 174.1 | -60.9 | -175.6 | 153.6 | 0 | 0 | 113.3 | E149 | E149-E151 PolarHBondContact O-N 3.06Š|
| 152 | D | 78.5 | Confident | 69.2 | Low | 124 Ų | 124 | 129.5 Ų | 129.5 | 66% | 0.663 | 70% | 0.695 | S | S | * | * | G | 310 helix | trans | -90.6 | -8.9 | 176.2 | -74.4 | -33.4 | 0 | 0 | 0 | 112.8 | E149 D150 L154 | E149-D152 PolarHBondContact O-N 2.78Å; D150-D152 VanDerWaalsContact C-N 3.27Å; D150-D152 PolarHBondContact O-N 2.91Å; D152-L154 PolarHBondContact O-N 3.34Å |
| 153 | I | 80.8 | Confident | 69.1 | Low | 93 Ų | 93 | 127.6 Ų | 127.6 | 48% | 0.477 | 69% | 0.693 | S | S | . | * | S | Bend | trans | -79.8 | 106.1 | 175.8 | -55.2 | 177.9 | 0 | 0 | 0 | 107.2 | D150 T155 | D150-I153 PolarHBondContact O-N 2.84Å; I153-T155 PolarHBondContact O-N 2.75Å |
| 154 | L | 74.9 | Confident | 69.1 | Low | 156 Ų | 156 | 130.4 Ų | 130.4 | 82% | 0.817 | 69% | 0.694 | S | S | * | * | | | trans | -64.1 | 89.6 | 165.8 | -66.6 | 171.8 | 0 | 0 | 0 | 108.2 | D152 D156 | D152-L154 PolarHBondContact O-N 3.34Å; L154-D156 VanDerWaalsContact C-N 3.3Å; L154-D156 PolarHBondContact O-N 3.01Å |
| 155 | T | 70.8 | Confident | 69.3 | Low | 103 Ų | 103 | 131.3 Ų | 131.3 | 63% | 0.632 | 70% | 0.701 | S | S | * | * | | | trans | -63.4 | 99.8 | 160.7 | 24.7 | 0 | 0 | 0 | 0 | 106.3 | I153 E157 | I153-T155 PolarHBondContact O-N 2.75Å; T155-E157 PolarHBondContact O-N 3.39Å |
| 156 | D | 67.6 | Low | 69.3 | Low | 143 Ų | 143 | 133.1 Ų | 133.1 | 77% | 0.765 | 70% | 0.7 | S | S | * | * | | | trans | -65.3 | 70.2 | 168.7 | -91 | -16.1 | 0 | 0 | 0 | 108.7 | L154 Q158 | L154-D156 VanDerWaalsContact C-N 3.3Å; L154-D156 PolarHBondContact O-N 3.01Å; D156-Q158 PolarHBondContact O-N 2.87Å |
| 157 | E | 68.2 | Low | 69 | Low | 159 Ų | 159 | 135.1 Ų | 135.1 | 74% | 0.743 | 70% | 0.703 | S | S | * | * | | | trans | -75.1 | 51.2 | 165.1 | 53.7 | -176.3 | 135.1 | 0 | 0 | 109.6 | T155 | T155-E157 PolarHBondContact O-N 3.39Š|
| 158 | Q | 62.6 | Low | 68.4 | Low | 175 Ų | 175 | 142 Ų | 142 | 82% | 0.818 | 73% | 0.732 | S | S | * | * | | | trans | -176.8 | 94 | 166.4 | -107 | 160.9 | 80.8 | 0 | 0 | 111.4 | D156 | D156-Q158 PolarHBondContact O-N 2.87Š|
| 159 | S | 54.4 | Low | 68 | Low | 99 Ų | 99 | 144.9 Ų | 144.9 | 69% | 0.692 | 74% | 0.743 | S | S | * | * | | | trans | -154.7 | 78.2 | 134.1 | 61.6 | 0 | 0 | 0 | 0 | 110.9 | L161 | S159-L161 PolarHBondContact O-N 3.18Š|
| 160 | T | 58.5 | Low | 67.5 | Low | 148 Ų | 148 | 146.1 Ų | 146.1 | 91% | 0.908 | 75% | 0.752 | S | S | * | * | | | trans | -67.9 | 63.9 | 140.4 | 54.5 | 0 | 0 | 0 | 0 | 107.7 | E162 | T160-E162 PolarHBondContact O-N 3.06Š|
| 161 | L | 60.8 | Low | 67.1 | Low | 104 Ų | 104 | 147.2 Ų | 147.2 | 55% | 0.545 | 76% | 0.756 | S | S | . | * | | | trans | -80.5 | 83.4 | 165.8 | -152.4 | 158.7 | 0 | 0 | 0 | 104.3 | S159 H163 | S159-L161 PolarHBondContact O-N 3.18Å; L161-H163 HydrophobicContact CD2-CB 4.47Å; L161-H163 PolarHBondContact O-CD2 3.31Å; L161-H163 PolarHBondContact O-N 2.84Å |
| 162 | E | 62.1 | Low | 66.8 | Low | 165 Ų | 165 | 145.5 Ų | 145.5 | 77% | 0.771 | 75% | 0.753 | S | S | * | * | | | trans | -53.2 | 92.8 | 159.6 | -172.3 | -170.3 | -166.1 | 0 | 0 | 105.7 | T160 H164 | T160-E162 PolarHBondContact O-N 3.06Å; E162-H164 PolarHBondContact O-N 3.31Å; E162-H164 PolarHBondContact O-ND1 2.82Å |
| 163 | H | 64.1 | Low | 66 | Low | 162 Ų | 162 | 146.8 Ų | 146.8 | 75% | 0.75 | 76% | 0.758 | S | S | * | * | | | trans | -65.1 | 87.7 | 174.9 | -89.7 | -95.6 | 0 | 0 | 0 | 106.6 | L161 S165 | L161-H163 HydrophobicContact CD2-CB 4.47Å; L161-H163 PolarHBondContact O-CD2 3.31Å; L161-H163 PolarHBondContact O-N 2.84Å; H163-S165 VanDerWaalsContact C-N 3.31Å; H163-S165 PolarHBondContact O-N 2.9Å |
| 164 | H | 63.5 | Low | 65 | Low | 126 Ų | 126 | 150.4 Ų | 150.4 | 58% | 0.583 | 78% | 0.777 | S | S | * | * | | | trans | -66.2 | 98 | 169.7 | 38.3 | -71.9 | 0 | 0 | 0 | 106.6 | E162 R166 | E162-H164 PolarHBondContact O-N 3.31Å; E162-H164 PolarHBondContact O-ND1 2.82Å; H164-R166 PolarHBondContact O-N 3.24Å |
| 165 | S | 73.8 | Confident | 64.3 | Low | 99 Ų | 99 | 150 Ų | 150 | 69% | 0.692 | 77% | 0.774 | S | S | * | * | | | trans | -55.9 | 109.6 | 175.6 | -177.2 | 0 | 0 | 0 | 0 | 109.2 | H163 F167 | H163-S165 VanDerWaalsContact C-N 3.31Å; H163-S165 PolarHBondContact O-N 2.9Å; S165-F167 VanDerWaalsContact C-N 3.3Å; S165-F167 PolarHBondContact O-N 2.97Å |
| 166 | R | 69.3 | Low | 63.8 | Low | 214 Ų | 214 | 153.6 Ų | 153.6 | 81% | 0.808 | 79% | 0.785 | S | S | * | * | | | trans | -93 | 62.3 | 170 | -66.4 | -173 | 179.8 | -177.6 | 1.3 | 109.6 | H164 | H164-R166 PolarHBondContact O-N 3.24Š|
| 167 | F | 65.8 | Low | 63.5 | Low | 196 Ų | 196 | 154.5 Ų | 154.5 | 86% | 0.86 | 79% | 0.787 | S | S | * | * | | | trans | -101.5 | 105.4 | 159.9 | -90.4 | -82.5 | 0 | 0 | 0 | 108.3 | S165 | S165-F167 VanDerWaalsContact C-N 3.3Å; S165-F167 PolarHBondContact O-N 2.97Å |
| 168 | T | 59.2 | Low | 63.1 | Low | 207 Ų | 207 | 154.1 Ų | 154.1 | 100% | 1.27 | 79% | 0.791 | S | S | * | * | | | trans | -78.8 | 0 | 159.6 | 49.9 | 0 | 0 | 0 | 0 | 110.5 | | |