| 1 | G | 45.7 | Very low | 55 | Low | 130 Ų | 130 | 151.9 Ų | 151.9 | 100% | 1.34 | 84% | 0.843 | S | S | * | * | | | | 0 | 120.5 | 0 | 0 | 0 | 0 | 0 | 0 | 107.7 | | |
| 2 | E | 50.7 | Low | 54.5 | Low | 179 Ų | 179 | 151.8 Ų | 151.8 | 84% | 0.836 | 85% | 0.849 | S | S | * | * | | | trans | -82.1 | 155.4 | 168.7 | -70.9 | -167.7 | 109.1 | 0 | 0 | 110.4 | | |
| 3 | P | 59.8 | Low | 54.4 | Low | 128 Ų | 128 | 148.5 Ų | 148.5 | 83% | 0.831 | 83% | 0.834 | S | S | * | * | | | trans | -123 | 130.8 | 133.9 | 32.6 | -22.6 | 0 | 0 | 0 | 112.4 | | |
| 4 | L | 59.2 | Low | 54 | Low | 150 Ų | 150 | 144.4 Ų | 144.4 | 79% | 0.785 | 83% | 0.829 | S | S | * | * | | | trans | -65.9 | -172.4 | 171.9 | -152.9 | 81.6 | 0 | 0 | 0 | 111.7 | | |
| 5 | P | 60 | Low | 54 | Low | 99 Ų | 99 | 145.7 Ų | 145.7 | 64% | 0.643 | 83% | 0.831 | S | S | * | * | | | | -111.7 | 149.9 | -110.6 | 40.2 | -21.7 | 0 | 0 | 0 | 113.5 | | |
| 6 | K | 67.2 | Low | 53.5 | Low | 222 Ų | 222 | 145.6 Ų | 145.6 | 97% | 0.965 | 83% | 0.827 | S | S | * | * | | | trans | -93.8 | 109.6 | 166.5 | -69.8 | -176.9 | -175.9 | 177.1 | 0 | 110.1 | | |
| 7 | R | 53.7 | Low | 53.5 | Low | 220 Ų | 220 | 144.3 Ų | 144.3 | 83% | 0.83 | 82% | 0.822 | S | S | * | * | | | trans | -75.5 | 125.3 | -172.7 | -179.8 | 178.2 | 170.6 | 159.2 | -1.8 | 112.8 | | |
| 8 | L | 53.9 | Low | 53.3 | Low | 134 Ų | 134 | 145.2 Ų | 145.2 | 70% | 0.702 | 82% | 0.824 | S | S | * | * | | | trans | 53.9 | 139.6 | 145.4 | -56.4 | 165.5 | 0 | 0 | 0 | 117.7 | | |
| 9 | K | 51.5 | Low | 53.2 | Low | 195 Ų | 195 | 145.5 Ų | 145.5 | 85% | 0.848 | 82% | 0.818 | S | S | * | * | | | | -165.9 | 140 | 60.2 | -70.2 | 156.6 | -164.7 | 177 | 0 | 110.9 | | |
| 10 | S | 54.1 | Low | 53 | Low | 118 Ų | 118 | 144.5 Ų | 144.5 | 83% | 0.825 | 82% | 0.818 | S | S | * | * | | | trans | -60.3 | 140 | 160.5 | 55.1 | 0 | 0 | 0 | 0 | 111.9 | | |
| 11 | S | 48.8 | Very low | 52.8 | Low | 96 Ų | 96 | 140.3 Ų | 140.3 | 67% | 0.671 | 81% | 0.807 | S | S | * | * | | | trans | 175.6 | 92.7 | 133.4 | -173 | 0 | 0 | 0 | 0 | 108.5 | V13 | S11-V13 VanDerWaalsContact C-N 3.26Å; S11-V13 PolarHBondContact O-N 3.1Å; S11-V13 VanDerWaalsContact O-N 3.11Å |
| 12 | V | 49.5 | Very low | 53.1 | Low | 151 Ų | 151 | 138.1 Ų | 138.1 | 92% | 0.915 | 78% | 0.776 | S | S | * | * | | | trans | -76.1 | 90 | 160.2 | 172.8 | 0 | 0 | 0 | 0 | 105.9 | | |
| 13 | V | 53.2 | Low | 53.3 | Low | 108 Ų | 108 | 136.5 Ų | 136.5 | 66% | 0.655 | 77% | 0.773 | S | S | * | * | | | trans | -128 | 85.1 | 158.7 | -176.7 | 0 | 0 | 0 | 0 | 106.1 | S11 L15 | S11-V13 VanDerWaalsContact C-N 3.26Å; S11-V13 PolarHBondContact O-N 3.1Å; S11-V13 VanDerWaalsContact O-N 3.11Å; V13-L15 HydrophobicContact CG1-CD1 4.28Å; V13-L15 HydrophobicContact CG1-CG 4.35Å |
| 14 | A | 48.1 | Very low | 52.7 | Low | 92 Ų | 92 | 140.9 Ų | 140.9 | 76% | 0.76 | 78% | 0.775 | S | S | * | * | | | trans | -112.7 | 96.8 | 149.5 | 0 | 0 | 0 | 0 | 0 | 105 | D16 | A14-D16 PolarHBondContact O-N 2.86Š|
| 15 | L | 54.3 | Low | 52.6 | Low | 163 Ų | 163 | 144.2 Ų | 144.2 | 85% | 0.853 | 78% | 0.777 | S | S | * | * | | | trans | -57 | 110.1 | 162.2 | -81.4 | 149.1 | 0 | 0 | 0 | 107.3 | V13 | V13-L15 HydrophobicContact CG1-CD1 4.28Å; V13-L15 HydrophobicContact CG1-CG 4.35Å |
| 16 | D | 45.4 | Very low | 52.6 | Low | 145 Ų | 145 | 148.9 Ų | 148.9 | 78% | 0.775 | 78% | 0.782 | S | S | * | * | | | trans | -141.9 | 99.1 | 155.1 | -158.6 | -124.9 | 0 | 0 | 0 | 108.8 | A14 D18 | A14-D16 PolarHBondContact O-N 2.86Å; D16-D18 PolarHBondContact O-N 2.92Å |
| 17 | V | 54.4 | Low | 52.2 | Low | 123 Ų | 123 | 141.7 Ų | 141.7 | 75% | 0.745 | 77% | 0.771 | S | S | * | * | | | trans | 19.3 | 93.9 | 143.2 | -174 | 0 | 0 | 0 | 0 | 115.9 | | |
| 18 | D | 50.7 | Low | 52.4 | Low | 160 Ų | 160 | 139.8 Ų | 139.8 | 86% | 0.856 | 77% | 0.765 | S | S | * | * | | | trans | -124.6 | 115.1 | 139.8 | -168.9 | -122.2 | 0 | 0 | 0 | 107.4 | D16 | D16-D18 PolarHBondContact O-N 2.92Š|
| 19 | Q | 50.9 | Low | 52.9 | Low | 152 Ų | 152 | 140.9 Ų | 140.9 | 71% | 0.71 | 77% | 0.771 | S | S | * | * | | | trans | -55.8 | 149 | -174.9 | -76.6 | -148.2 | -13.2 | 0 | 0 | 110.9 | G21 | Q19-G21 PolarHBondContact O-N 2.77Š|
| 20 | P | 49.2 | Very low | 53.7 | Low | 124 Ų | 124 | 137.6 Ų | 137.6 | 81% | 0.805 | 76% | 0.762 | S | S | * | * | | | trans | -64 | 89.5 | 166.9 | 27.2 | -31.6 | 0 | 0 | 0 | 108.4 | A22 | P20-A22 PolarHBondContact O-N 2.94Š|
| 21 | G | 47.9 | Very low | 54.4 | Low | 57 Ų | 57 | 135.9 Ų | 135.9 | 59% | 0.588 | 75% | 0.748 | S | S | * | * | | | trans | -52.7 | 112.2 | 172.3 | 0 | 0 | 0 | 0 | 0 | 107.1 | Q19 N23 | Q19-G21 PolarHBondContact O-N 2.77Å; G21-N23 PolarHBondContact O-N 2.97Å |
| 22 | A | 52.9 | Low | 55.4 | Low | 85 Ų | 85 | 140.9 Ų | 140.9 | 70% | 0.702 | 76% | 0.758 | S | S | * | * | | | trans | -62.7 | 70.9 | -173.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | P20 Y24 | P20-A22 PolarHBondContact O-N 2.94Å; A22-Y24 VanDerWaalsContact C-N 3.34Å |
| 23 | N | 54.4 | Low | 56.2 | Low | 145 Ų | 145 | 142.9 Ų | 142.9 | 78% | 0.775 | 75% | 0.75 | S | S | * | * | | | trans | -102.2 | 36 | 177.3 | -88.8 | -56.5 | 0 | 0 | 0 | 111.4 | G21 | G21-N23 PolarHBondContact O-N 2.97Š|
| 24 | Y | 47.8 | Very low | 56.9 | Low | 220 Ų | 220 | 145 Ų | 145 | 86% | 0.863 | 75% | 0.753 | S | S | * | * | | | trans | -96.6 | 38.5 | 154.8 | -63.4 | -77.6 | 0 | 0 | 0 | 110.5 | A22 R26 | A22-Y24 VanDerWaalsContact C-N 3.34Å; Y24-R26 PolarHBondContact O-N 2.83Å |
| 25 | R | 57.2 | Low | 57.7 | Low | 219 Ų | 219 | 149.1 Ų | 149.1 | 83% | 0.826 | 76% | 0.758 | S | S | * | * | | | trans | -68.7 | 65 | 163 | -72.9 | -72.6 | -161.8 | -162.2 | 2.1 | 108.9 | G27 | R25-G27 PolarHBondContact O-N 2.66Š|
| 26 | R | 58.5 | Low | 58.2 | Low | 198 Ų | 198 | 145.7 Ų | 145.7 | 75% | 0.747 | 74% | 0.744 | S | S | * | * | | | trans | -64.2 | 89.9 | 146 | -99.4 | -164.4 | -74.7 | -110.6 | 0.5 | 104.9 | Y24 Y28 | Y24-R26 PolarHBondContact O-N 2.83Å; R26-Y28 HydrophobicContact CB-CD2 4.41Å; R26-Y28 HydrophobicContact CB-CE2 4.34Å; R26-Y28 PolarHBondContact O-N 2.95Å |
| 27 | G | 59.8 | Low | 59.1 | Low | 71 Ų | 71 | 150 Ų | 150 | 73% | 0.732 | 75% | 0.75 | S | S | * | * | | | trans | -64.8 | 86.5 | 168.8 | 0 | 0 | 0 | 0 | 0 | 108.2 | R25 D29 | R25-G27 PolarHBondContact O-N 2.66Å; G27-D29 PolarHBondContact O-N 2.68Å; G27-D29 VanDerWaalsContact O-N 3.1Å |
| 28 | Y | 57.1 | Low | 59.6 | Low | 180 Ų | 180 | 146.3 Ų | 146.3 | 71% | 0.706 | 74% | 0.736 | S | S | * | * | | | trans | -68.8 | 97.3 | 152.1 | -74.9 | -81.5 | 0 | 0 | 0 | 105.3 | R26 L30 | R26-Y28 HydrophobicContact CB-CD2 4.41Å; R26-Y28 HydrophobicContact CB-CE2 4.34Å; R26-Y28 PolarHBondContact O-N 2.95Å; Y28-L30 PolarHBondContact O-N 3.37Å |
| 29 | D | 65.1 | Low | 59.9 | Low | 156 Ų | 156 | 145.3 Ų | 145.3 | 83% | 0.834 | 73% | 0.729 | S | S | * | * | | | trans | -68.8 | 78 | 161.5 | -171 | 35.8 | 0 | 0 | 0 | 106.8 | G27 | G27-D29 PolarHBondContact O-N 2.68Å; G27-D29 VanDerWaalsContact O-N 3.1Å |
| 30 | L | 68.2 | Low | 60.1 | Low | 127 Ų | 127 | 143.3 Ų | 143.3 | 67% | 0.665 | 73% | 0.727 | S | S | * | * | | | trans | -62.7 | 134.7 | 166.7 | -75.7 | 139 | 0 | 0 | 0 | 106 | Y28 K32 | Y28-L30 PolarHBondContact O-N 3.37Å; L30-K32 PolarHBondContact O-N 3.21Å |
| 31 | P | 68.9 | Low | 60.5 | Low | 81 Ų | 81 | 141.4 Ų | 141.4 | 53% | 0.526 | 72% | 0.717 | S | S | . | * | | | trans | -46.9 | 121.7 | 173.6 | -21.5 | 28.1 | 0 | 0 | 0 | 107.5 | Y33 | P31-Y33 HydrophobicContact CB-CD2 4.26Å; P31-Y33 HydrophobicContact CB-CE2 3.87Å; P31-Y33 HydrophobicContact CG-CE2 4.13Å; P31-Y33 WeakPolarHBondContact O-CD2 3.1Å; P31-Y33 PolarHBondContact O-N 2.87Å |
| 32 | K | 70 | Confident | 61.1 | Low | 202 Ų | 202 | 146 Ų | 146 | 88% | 0.878 | 73% | 0.727 | S | S | * | * | | | trans | -68.6 | 79.5 | 178.6 | -169.8 | 176.8 | -176.6 | 178.8 | 0 | 106.9 | L30 H34 | L30-K32 PolarHBondContact O-N 3.21Å; K32-H34 PolarHBondContact O-N 3.11Å |
| 33 | Y | 66 | Low | 61.6 | Low | 193 Ų | 193 | 146.6 Ų | 146.6 | 76% | 0.757 | 72% | 0.718 | S | S | * | * | | | trans | -58.1 | 111.5 | 173.2 | -71 | -79.3 | 0 | 0 | 0 | 105.5 | P31 M35 | P31-Y33 HydrophobicContact CB-CD2 4.26Å; P31-Y33 HydrophobicContact CB-CE2 3.87Å; P31-Y33 HydrophobicContact CG-CE2 4.13Å; P31-Y33 WeakPolarHBondContact O-CD2 3.1Å; P31-Y33 PolarHBondContact O-N 2.87Å; Y33-M35 PolarHBondContact O-N 2.68Å |
| 34 | H | 69.1 | Low | 62 | Low | 153 Ų | 153 | 143.6 Ų | 143.6 | 71% | 0.708 | 71% | 0.706 | S | S | * | * | | | trans | -56.6 | 104.9 | 170.4 | 168.9 | 63.8 | 0 | 0 | 0 | 106.5 | K32 V36 | K32-H34 PolarHBondContact O-N 3.11Å; H34-V36 WeakPolarHBondContact CD2-CG2 3.36Å; H34-V36 PolarHBondContact O-N 3.12Å |
| 35 | M | 64.3 | Low | 62.6 | Low | 177 Ų | 177 | 141.8 Ų | 141.8 | 87% | 0.872 | 71% | 0.706 | S | S | * | * | | | trans | -66.9 | 95.8 | 166.8 | -85.7 | -167.8 | -175 | 0 | 0 | 106.2 | Y33 R37 | Y33-M35 PolarHBondContact O-N 2.68Å; M35-R37 PolarHBondContact O-N 2.88Å; M35-R37 VanDerWaalsContact O-N 3.12Å |
| 36 | V | 64.4 | Low | 62.8 | Low | 91 Ų | 91 | 138.6 Ų | 138.6 | 55% | 0.552 | 71% | 0.705 | S | S | * | * | | | trans | -53.7 | 119.6 | 167.1 | 177.2 | 0 | 0 | 0 | 0 | 106.3 | H34 G38 | H34-V36 WeakPolarHBondContact CD2-CG2 3.36Å; H34-V36 PolarHBondContact O-N 3.12Å; V36-G38 PolarHBondContact O-N 3.23Å |
| 37 | R | 65.4 | Low | 62.7 | Low | 237 Ų | 237 | 133.3 Ų | 133.3 | 89% | 0.894 | 70% | 0.697 | S | S | * | * | S | Bend | trans | -58.2 | 102.9 | -171.1 | -177.6 | 178.5 | 172.6 | 138.8 | -3.3 | 110.6 | M35 | M35-R37 PolarHBondContact O-N 2.88Å; M35-R37 VanDerWaalsContact O-N 3.12Å |
| 38 | G | 63 | Low | 62.9 | Low | 44 Ų | 44 | 135.9 Ų | 135.9 | 45% | 0.454 | 70% | 0.699 | S | S | . | * | | | trans | 90.3 | 135.9 | 160.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | V36 T40 S41 | V36-G38 PolarHBondContact O-N 3.23Å; G38-T40 PolarHBondContact O-N 3.39Å; G38-S41 PolarHBondContact O-N 3.15Å; G38-S41 VanDerWaalsContact O-N 3.15Å |
| 39 | I | 57.1 | Low | 63.1 | Low | 140 Ų | 140 | 135.4 Ų | 135.4 | 72% | 0.718 | 70% | 0.697 | S | S | * | * | G | 310 helix | trans | -49.8 | -15.9 | 173.4 | 56.1 | 174.4 | 0 | 0 | 0 | 114.4 | S41 L42 L43 | I39-S41 VanDerWaalsContact C-N 3.28Å; I39-S41 PolarHBondContact O-N 2.88Å; I39-L42 PolarHBondContact O-N 2.97Å; I39-L43 WeakPolarHBondContact O-CD1 3.47Å |
| 40 | T | 55.7 | Low | 62.9 | Low | 109 Ų | 109 | 132.7 Ų | 132.7 | 67% | 0.669 | 69% | 0.688 | S | S | * | * | G | 310 helix | trans | -68.5 | -22.1 | 179 | 53.4 | 0 | 0 | 0 | 0 | 113.5 | G38 L42 | G38-T40 PolarHBondContact O-N 3.39Å; T40-L42 VanDerWaalsContact C-N 3.27Å |
| 41 | S | 57.4 | Low | 62.6 | Low | 84 Ų | 84 | 132.7 Ų | 132.7 | 59% | 0.587 | 70% | 0.698 | S | S | * | * | G | 310 helix | trans | -78.1 | -11.9 | 174.8 | -172.8 | 0 | 0 | 0 | 0 | 113.4 | G38 I39 | G38-S41 PolarHBondContact O-N 3.15Å; G38-S41 VanDerWaalsContact O-N 3.15Å; I39-S41 VanDerWaalsContact C-N 3.28Å; I39-S41 PolarHBondContact O-N 2.88Å |
| 42 | L | 60.3 | Low | 62.4 | Low | 153 Ų | 153 | 135.5 Ų | 135.5 | 80% | 0.801 | 70% | 0.704 | S | S | * | * | S | Bend | trans | -97.7 | -13.4 | 178.2 | -61.2 | 178.4 | 0 | 0 | 0 | 112.6 | I39 T40 | I39-L42 PolarHBondContact O-N 2.97Å; T40-L42 VanDerWaalsContact C-N 3.27Å |
| 43 | L | 63.6 | Low | 62.3 | Low | 99 Ų | 99 | 130.7 Ų | 130.7 | 52% | 0.518 | 70% | 0.702 | S | S | . | * | S | Bend | trans | -78.3 | 132.2 | 169.1 | -80.8 | 110.3 | 0 | 0 | 0 | 108.5 | I39 Q45 | I39-L43 WeakPolarHBondContact O-CD1 3.47Å; L43-Q45 PolarHBondContact O-N 2.99Å |
| 44 | P | 62.3 | Low | 62.6 | Low | 81 Ų | 81 | 129 Ų | 129 | 53% | 0.526 | 71% | 0.706 | S | S | . | * | | | trans | -50.3 | 131.6 | 168.1 | -22.8 | 32.3 | 0 | 0 | 0 | 109.3 | D46 C47 | P44-D46 PolarHBondContact O-N 3.1Å; P44-C47 PolarHBondContact O-N 3.38Å; P44-C47 VanDerWaalsContact O-N 3.1Å |
| 45 | Q | 61.3 | Low | 62.4 | Low | 183 Ų | 183 | 127 Ų | 127 | 86% | 0.855 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.4 | -14 | 177.5 | -70.3 | -174.5 | 8.4 | 0 | 0 | 112.3 | L43 C47 | L43-Q45 PolarHBondContact O-N 2.99Å; Q45-C47 PolarHBondContact O-N 3.29Å |
| 46 | D | 61.2 | Low | 62.7 | Low | 152 Ų | 152 | 124.5 Ų | 124.5 | 81% | 0.813 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.7 | 0.4 | 178 | -53.9 | -70.8 | 0 | 0 | 0 | 114.1 | P44 V48 | P44-D46 PolarHBondContact O-N 3.1Å; D46-V48 VanDerWaalsContact C-N 3.27Å; D46-V48 PolarHBondContact O-N 3.42Å |
| 47 | C | 56.3 | Low | 62.9 | Low | 86 Ų | 86 | 129 Ų | 129 | 58% | 0.581 | 72% | 0.715 | S | S | * | * | | | trans | -89.9 | 33.6 | 175.9 | -62.5 | 0 | 0 | 0 | 0 | 113.5 | P44 Q45 Y49 | P44-C47 PolarHBondContact O-N 3.38Å; P44-C47 VanDerWaalsContact O-N 3.1Å; Q45-C47 PolarHBondContact O-N 3.29Å; C47-Y49 PolarHBondContact O-N 2.91Å |
| 48 | V | 64.1 | Low | 63.1 | Low | 125 Ų | 125 | 122.8 Ų | 122.8 | 76% | 0.758 | 71% | 0.705 | S | S | * | * | | | trans | -85 | 92.5 | 167.4 | -177.1 | 0 | 0 | 0 | 0 | 108.2 | D46 | D46-V48 VanDerWaalsContact C-N 3.27Å; D46-V48 PolarHBondContact O-N 3.42Å |
| 49 | Y | 60.6 | Low | 63.5 | Low | 170 Ų | 170 | 131.8 Ų | 131.8 | 67% | 0.667 | 73% | 0.726 | S | S | * | * | | | trans | -75 | 130.6 | 174.5 | -153.9 | -92.1 | 0 | 0 | 0 | 109.4 | C47 S51 Q52 | C47-Y49 PolarHBondContact O-N 2.91Å; Y49-S51 PolarHBondContact O-N 3.33Å; Y49-Q52 HydrophobicContact CD1-CG 4.44Å; Y49-Q52 HydrophobicContact CE1-CG 3.8Å; Y49-Q52 PolarHBondContact OH-NE2 3.36Å; Y49-Q52 VanDerWaalsContact OH-NE2 3.16Å |
| 50 | P | 60.9 | Low | 63.7 | Low | 100 Ų | 100 | 134.7 Ų | 134.7 | 65% | 0.649 | 73% | 0.734 | S | S | * | * | | | trans | -62.4 | 125.9 | 173.8 | 25.3 | -31.6 | 0 | 0 | 0 | 108.8 | Q52 | P50-Q52 PolarHBondContact O-N 3.18Š|
| 51 | S | 61.7 | Low | 63.8 | Low | 126 Ų | 126 | 137.7 Ų | 137.7 | 88% | 0.881 | 74% | 0.744 | S | S | * | * | | | trans | -52.1 | 113.7 | -178.4 | -119.9 | 0 | 0 | 0 | 0 | 110.5 | Y49 A53 | Y49-S51 PolarHBondContact O-N 3.33Å; S51-A53 PolarHBondContact O-N 3.1Å; S51-A53 VanDerWaalsContact O-N 3.13Å |
| 52 | Q | 65 | Low | 63.4 | Low | 140 Ų | 140 | 139.2 Ų | 139.2 | 65% | 0.654 | 76% | 0.755 | S | S | * | * | | | trans | -70.9 | 109.2 | 175.8 | -68.9 | -175.2 | -11.3 | 0 | 0 | 108.3 | Y49 P50 L54 | Y49-Q52 HydrophobicContact CD1-CG 4.44Å; Y49-Q52 HydrophobicContact CE1-CG 3.8Å; Y49-Q52 PolarHBondContact OH-NE2 3.36Å; Y49-Q52 VanDerWaalsContact OH-NE2 3.16Å; P50-Q52 PolarHBondContact O-N 3.18Å; Q52-L54 PolarHBondContact O-N 2.82Å |
| 53 | A | 68.4 | Low | 62.6 | Low | 101 Ų | 101 | 137.1 Ų | 137.1 | 84% | 0.835 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 120.9 | 173.5 | 0 | 0 | 0 | 0 | 0 | 109 | S51 | S51-A53 PolarHBondContact O-N 3.1Å; S51-A53 VanDerWaalsContact O-N 3.13Å |
| 54 | L | 71.9 | Confident | 62.1 | Low | 159 Ų | 159 | 136.8 Ų | 136.8 | 83% | 0.832 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -65 | 138.2 | -177 | -65.8 | 174 | 0 | 0 | 0 | 110.6 | Q52 | Q52-L54 PolarHBondContact O-N 2.82Š|
| 55 | P | 65.3 | Low | 62 | Low | 111 Ų | 111 | 142 Ų | 142 | 72% | 0.721 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 141.8 | 175.2 | 24.2 | -31.3 | 0 | 0 | 0 | 110.5 | K57 | P55-K57 PolarHBondContact O-N 2.91Š|
| 56 | P | 69.8 | Low | 61.3 | Low | 123 Ų | 123 | 139.7 Ų | 139.7 | 80% | 0.799 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 136.3 | -175.1 | 23.7 | -32.2 | 0 | 0 | 0 | 111.2 | P58 | P56-P58 WeakPolarHBondContact O-CD 3.49Š|
| 57 | K | 70.4 | Confident | 61 | Low | 187 Ų | 187 | 139.5 Ų | 139.5 | 81% | 0.813 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 120.2 | -173.6 | -172.2 | 166.4 | -178.8 | 163.5 | 0 | 111.4 | P55 R59 | P55-K57 PolarHBondContact O-N 2.91Å; K57-R59 PolarHBondContact O-N 3.36Å |
| 58 | P | 68.2 | Low | 60.5 | Low | 105 Ų | 105 | 140.3 Ų | 140.3 | 68% | 0.682 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 124.5 | 173.8 | 24.7 | -30.3 | 0 | 0 | 0 | 109.4 | P56 | P56-P58 WeakPolarHBondContact O-CD 3.49Š|
| 59 | R | 71.4 | Confident | 60.4 | Low | 233 Ų | 233 | 139.8 Ų | 139.8 | 88% | 0.879 | 78% | 0.78 | S | S | * | * | | | trans | -83.2 | 113.4 | 175 | -67 | -175.2 | 178.8 | 99.4 | -2.1 | 107.8 | K57 L61 | K57-R59 PolarHBondContact O-N 3.36Å; R59-L61 PolarHBondContact O-N 3.15Å |
| 60 | F | 61.5 | Low | 59.3 | Low | 202 Ų | 202 | 138.7 Ų | 138.7 | 89% | 0.886 | 79% | 0.785 | S | S | * | * | | | trans | -60.2 | 126.7 | 174.8 | -73.8 | -95.1 | 0 | 0 | 0 | 109.9 | | |
| 61 | L | 58.8 | Low | 58.7 | Low | 171 Ų | 171 | 139.3 Ų | 139.3 | 90% | 0.895 | 79% | 0.787 | S | S | * | * | | | trans | -112.1 | 119.1 | 163.8 | -65 | 178.9 | 0 | 0 | 0 | 108.2 | R59 | R59-L61 PolarHBondContact O-N 3.15Š|
| 62 | S | 49 | Very low | 58.1 | Low | 117 Ų | 117 | 140.5 Ų | 140.5 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | | | trans | -80.7 | 139.7 | 169 | 51.5 | 0 | 0 | 0 | 0 | 110.8 | | |
| 63 | S | 43.5 | Very low | 57.3 | Low | 108 Ų | 108 | 139.5 Ų | 139.5 | 76% | 0.755 | 79% | 0.786 | S | S | * | * | | | trans | 170.3 | 110.9 | 139.3 | -131.7 | 0 | 0 | 0 | 0 | 109 | | |
| 64 | S | 51.9 | Low | 56.1 | Low | 92 Ų | 92 | 141.1 Ų | 141.1 | 64% | 0.643 | 79% | 0.786 | S | S | * | * | | | | 74.3 | 102 | 97.8 | 75.6 | 0 | 0 | 0 | 0 | 114.7 | | |
| 65 | E | 60.3 | Low | 55.4 | Low | 190 Ų | 190 | 141.9 Ų | 141.9 | 89% | 0.888 | 79% | 0.785 | S | S | * | * | | | trans | 27 | 116.8 | 141 | -51.1 | 179 | 112.7 | 0 | 0 | 118.9 | | |
| 66 | V | 47.5 | Very low | 54.6 | Low | 136 Ų | 136 | 144 Ų | 144 | 82% | 0.824 | 78% | 0.783 | S | S | * | * | | | trans | -171.7 | 118.3 | 131.6 | 132.1 | 0 | 0 | 0 | 0 | 110.3 | | |
| 67 | D | 55 | Low | 54.1 | Low | 148 Ų | 148 | 143 Ų | 143 | 79% | 0.791 | 78% | 0.776 | S | S | * | * | | | trans | -81.3 | 131.5 | 160.2 | 177.6 | -93.4 | 0 | 0 | 0 | 108 | | |
| 68 | S | 44.8 | Very low | 52.9 | Low | 102 Ų | 102 | 143.7 Ų | 143.7 | 71% | 0.713 | 78% | 0.775 | S | S | * | * | | | trans | -162.9 | 130.1 | 154.8 | -72.9 | 0 | 0 | 0 | 0 | 110.7 | | |
| 69 | P | 62.1 | Low | 52 | Low | 115 Ų | 115 | 142.6 Ų | 142.6 | 75% | 0.747 | 78% | 0.783 | S | S | * | * | | | trans | -89.2 | 151.7 | 179.8 | 36.6 | -32.6 | 0 | 0 | 0 | 110.8 | | |
| 70 | N | 37.8 | Very low | 50.8 | Low | 146 Ų | 146 | 135.1 Ų | 135.1 | 78% | 0.781 | 78% | 0.779 | S | S | * | * | | | trans | 151.2 | 102.5 | 140.9 | -163 | -7.5 | 0 | 0 | 0 | 111.6 | | |
| 71 | V | 48.1 | Very low | 50.8 | Low | 114 Ų | 114 | 132.1 Ų | 132.1 | 69% | 0.691 | 78% | 0.783 | S | S | * | * | | | trans | 39.1 | 134.5 | 132.8 | -161.9 | 0 | 0 | 0 | 0 | 119.8 | | |
| 72 | L | 49.1 | Very low | 51 | Low | 151 Ų | 151 | 126.6 Ų | 126.6 | 79% | 0.791 | 77% | 0.767 | S | S | * | * | | | trans | 134.7 | 124 | 139.2 | -70.4 | 165.4 | 0 | 0 | 0 | 106.6 | | |
| 73 | T | 48.5 | Very low | 51.3 | Low | 118 Ų | 118 | 127.2 Ų | 127.2 | 72% | 0.724 | 77% | 0.768 | S | S | * | * | | | cis | -170 | 144.8 | 10.6 | 27.8 | 0 | 0 | 0 | 0 | 102.6 | | |
| 74 | V | 44.1 | Very low | 52 | Low | 136 Ų | 136 | 130.1 Ų | 130.1 | 82% | 0.824 | 78% | 0.775 | S | S | * | * | | | | -174.6 | 131.1 | 91.6 | 161.4 | 0 | 0 | 0 | 0 | 107.7 | | |
| 75 | Q | 57.1 | Low | 51.8 | Low | 174 Ų | 174 | 136.4 Ų | 136.4 | 81% | 0.813 | 79% | 0.786 | S | S | * | * | | | trans | -53 | 152.3 | 172.9 | -58.5 | -106.3 | -44.2 | 0 | 0 | 111.7 | | |
| 76 | K | 47 | Very low | 51.4 | Low | 156 Ų | 156 | 132.3 Ų | 132.3 | 68% | 0.678 | 77% | 0.774 | S | S | * | * | | | | -158.8 | 142.4 | 51.4 | -177.1 | 174 | 179.7 | 176.4 | 0 | 111.2 | Y78 | K76-Y78 HydrophobicContact CD-CE2 4.14Š|
| 77 | P | 60.1 | Low | 51.2 | Low | 102 Ų | 102 | 131.7 Ų | 131.7 | 66% | 0.662 | 77% | 0.774 | S | S | * | * | | | trans | -86.6 | 144.9 | 175.9 | 34.6 | -33.4 | 0 | 0 | 0 | 112 | | |
| 78 | Y | 45.1 | Very low | 50.9 | Low | 201 Ų | 201 | 130.8 Ų | 130.8 | 79% | 0.788 | 77% | 0.774 | S | S | * | * | | | trans | -136.4 | 115.7 | 157.7 | -97.5 | -83.1 | 0 | 0 | 0 | 109.9 | K76 | K76-Y78 HydrophobicContact CD-CE2 4.14Š|
| 79 | G | 49.1 | Very low | 51.1 | Low | 83 Ų | 83 | 132 Ų | 132 | 86% | 0.856 | 78% | 0.779 | S | S | * | * | | | trans | 62 | 118 | 150.4 | 0 | 0 | 0 | 0 | 0 | 117.4 | | |
| 80 | G | 47.4 | Very low | 50.6 | Low | 76 Ų | 76 | 130.9 Ų | 130.9 | 78% | 0.784 | 78% | 0.78 | S | S | * | * | | | cis | -174 | 170.5 | 13.5 | 0 | 0 | 0 | 0 | 0 | 111 | G82 | G80-G82 PolarHBondContact O-N 3.43Š|
| 81 | S | 60.4 | Low | 50.8 | Low | 139 Ų | 139 | 127.2 Ų | 127.2 | 97% | 0.972 | 78% | 0.776 | S | S | * | * | | | trans | -61.4 | 113.4 | 174.7 | -176.7 | 0 | 0 | 0 | 0 | 110.1 | | |
| 82 | G | 62.2 | Low | 50.8 | Low | 55 Ų | 55 | 127.7 Ų | 127.7 | 57% | 0.567 | 79% | 0.785 | S | S | * | * | | | trans | -133.3 | 149.8 | 167.9 | 0 | 0 | 0 | 0 | 0 | 108.3 | G80 L84 | G80-G82 PolarHBondContact O-N 3.43Å; G82-L84 PolarHBondContact O-N 3.05Å |
| 83 | P | 56.7 | Low | 51.2 | Low | 129 Ų | 129 | 126.6 Ų | 126.6 | 84% | 0.838 | 79% | 0.787 | S | S | * | * | | | trans | -59 | 135.1 | -155.4 | 22.3 | -32.7 | 0 | 0 | 0 | 113 | Y85 | P83-Y85 VanDerWaalsContact C-N 3.27Å; P83-Y85 PolarHBondContact O-N 3.44Å |
| 84 | L | 57.5 | Low | 50.8 | Low | 170 Ų | 170 | 125.4 Ų | 125.4 | 89% | 0.89 | 79% | 0.788 | S | S | * | * | | | trans | -58.7 | 85 | 169.8 | -65.5 | 167.5 | 0 | 0 | 0 | 109.6 | G82 | G82-L84 PolarHBondContact O-N 3.05Š|
| 85 | Y | 47.4 | Very low | 50.8 | Low | 223 Ų | 223 | 123.8 Ų | 123.8 | 88% | 0.875 | 78% | 0.783 | S | S | * | * | | | trans | -94.7 | 104.3 | 159 | -126.6 | -90.5 | 0 | 0 | 0 | 108.4 | P83 | P83-Y85 VanDerWaalsContact C-N 3.27Å; P83-Y85 PolarHBondContact O-N 3.44Å |
| 86 | T | 52.9 | Low | 50.6 | Low | 104 Ų | 104 | 121.4 Ų | 121.4 | 64% | 0.638 | 79% | 0.786 | S | S | * | * | | | trans | -66.1 | 149.5 | 173 | 52.1 | 0 | 0 | 0 | 0 | 110.8 | | |
| 87 | C | 42.3 | Very low | 50.4 | Low | 124 Ų | 124 | 118.7 Ų | 118.7 | 84% | 0.838 | 79% | 0.787 | S | S | * | * | | | trans | 98.8 | 98.7 | 162.8 | -49.8 | 0 | 0 | 0 | 0 | 117 | | |
| 88 | V | 50.1 | Low | 49.8 | Very low | 128 Ų | 128 | 119.8 Ų | 119.8 | 78% | 0.776 | 79% | 0.792 | S | S | * | * | | | trans | -133.9 | 137.5 | 162 | 173.5 | 0 | 0 | 0 | 0 | 106.1 | A90 | V88-A90 HydrophobicContact CG1-CB 3.87Š|
| 89 | P | 49 | Very low | 49.7 | Very low | 129 Ų | 129 | 117.2 Ų | 117.2 | 84% | 0.838 | 79% | 0.791 | S | S | * | * | | | | -126.5 | 118.3 | 85.1 | 6.6 | 16.9 | 0 | 0 | 0 | 112.6 | | |
| 90 | A | 51.5 | Low | 49.6 | Very low | 91 Ų | 91 | 121.4 Ų | 121.4 | 75% | 0.752 | 79% | 0.788 | S | S | * | * | | | | 85.1 | 99.1 | 74.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | V88 | V88-A90 HydrophobicContact CG1-CB 3.87Š|
| 91 | G | 41.6 | Very low | 49.8 | Very low | 68 Ų | 68 | 120.9 Ų | 120.9 | 70% | 0.701 | 78% | 0.782 | S | S | * | * | | | trans | -163 | 97.6 | 171.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | | |
| 92 | S | 47.5 | Very low | 49 | Very low | 125 Ų | 125 | 122.7 Ų | 122.7 | 87% | 0.874 | 78% | 0.78 | S | S | * | * | | | trans | 98.1 | 109.3 | 163.4 | -41.7 | 0 | 0 | 0 | 0 | 117.3 | | |
| 93 | P | 57.8 | Low | 48.2 | Very low | 128 Ų | 128 | 124.3 Ų | 124.3 | 83% | 0.831 | 80% | 0.797 | S | S | * | * | | | trans | -120.1 | 117.5 | 145 | 34.1 | -20.5 | 0 | 0 | 0 | 109.3 | | |
| 94 | A | 39.9 | Very low | 47.2 | Very low | 92 Ų | 92 | 121.3 Ų | 121.3 | 76% | 0.76 | 79% | 0.79 | S | S | * | * | | | trans | 170.8 | 124.9 | 153.5 | 0 | 0 | 0 | 0 | 0 | 105.8 | | |
| 95 | S | 45 | Very low | 46.5 | Very low | 102 Ų | 102 | 119.2 Ų | 119.2 | 71% | 0.713 | 79% | 0.788 | S | S | * | * | | | cis | -157.9 | 127.3 | 31.9 | -53.1 | 0 | 0 | 0 | 0 | 107.8 | S97 | S95-S97 VanDerWaalsContact C-N 3.34Å; S95-S97 PolarHBondContact O-N 3.34Å |
| 96 | S | 52.4 | Low | 46.2 | Very low | 124 Ų | 124 | 116.4 Ų | 116.4 | 87% | 0.867 | 78% | 0.782 | S | S | * | * | | | trans | -81.4 | 93.8 | 148.5 | 70.1 | 0 | 0 | 0 | 0 | 106.5 | | |
| 97 | S | 43.5 | Very low | 45.6 | Very low | 100 Ų | 100 | 117 Ų | 117 | 70% | 0.699 | 79% | 0.789 | S | S | * | * | | | trans | -102.8 | 96.2 | 154.9 | 58.8 | 0 | 0 | 0 | 0 | 106.5 | S95 L99 | S95-S97 VanDerWaalsContact C-N 3.34Å; S95-S97 PolarHBondContact O-N 3.34Å; S97-L99 PolarHBondContact O-N 3.2Å; S97-L99 VanDerWaalsContact O-N 3.1Å |
| 98 | T | 47.2 | Very low | 46 | Very low | 125 Ų | 125 | 117.7 Ų | 117.7 | 77% | 0.767 | 78% | 0.784 | S | S | * | * | | | trans | -60.3 | 105.5 | 160.9 | -46.1 | 0 | 0 | 0 | 0 | 106.9 | | |
| 99 | L | 41.4 | Very low | 45.9 | Very low | 147 Ų | 147 | 118.7 Ų | 118.7 | 77% | 0.77 | 79% | 0.785 | S | S | * | * | | | trans | -148.1 | 80.4 | 159.7 | -154.8 | 144.3 | 0 | 0 | 0 | 108.1 | S97 | S97-L99 PolarHBondContact O-N 3.2Å; S97-L99 VanDerWaalsContact O-N 3.1Å |
| 100 | E | 47.5 | Very low | 45.7 | Very low | 170 Ų | 170 | 118.6 Ų | 118.6 | 79% | 0.794 | 78% | 0.784 | S | S | * | * | | | trans | 9.3 | 114.1 | 134.1 | 17.6 | -168.5 | 101.9 | 0 | 0 | 115.7 | | |
| 101 | G | 51.5 | Low | 45.4 | Very low | 65 Ų | 65 | 120.5 Ų | 120.5 | 67% | 0.67 | 78% | 0.779 | S | S | * | * | | | trans | 92.3 | 96.5 | 156.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | | |
| 102 | L | 44.4 | Very low | 45.6 | Very low | 178 Ų | 178 | 125.9 Ų | 125.9 | 93% | 0.932 | 78% | 0.783 | S | S | * | * | | | trans | 149.1 | 119.9 | 137.4 | -78.9 | 159.3 | 0 | 0 | 0 | 107.9 | G104 | L102-G104 PolarHBondContact O-N 2.96Š|
| 103 | G | 45.7 | Very low | 45.4 | Very low | 89 Ų | 89 | 125.9 Ų | 125.9 | 92% | 0.918 | 77% | 0.772 | S | S | * | * | | | trans | -53.7 | 101.4 | -172.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | | |
| 104 | G | 35 | Very low | 44.6 | Very low | 66 Ų | 66 | 126.4 Ų | 126.4 | 68% | 0.68 | 77% | 0.768 | S | S | * | * | | | trans | -91.4 | 118.8 | 170.8 | 0 | 0 | 0 | 0 | 0 | 110 | L102 Q106 | L102-G104 PolarHBondContact O-N 2.96Å; G104-Q106 PolarHBondContact O-N 3.24Å; G104-Q106 VanDerWaalsContact O-N 3.07Å |
| 105 | C | 42.8 | Very low | 44.5 | Very low | 125 Ų | 125 | 129.4 Ų | 129.4 | 85% | 0.845 | 76% | 0.764 | S | S | * | * | | | trans | -65.3 | 103.9 | 164.7 | -63.8 | 0 | 0 | 0 | 0 | 108.4 | C107 | C105-C107 PolarHBondContact O-N 3.27Š|
| 106 | Q | 41.4 | Very low | 44.4 | Very low | 164 Ų | 164 | 131.1 Ų | 131.1 | 77% | 0.766 | 77% | 0.771 | S | S | * | * | | | trans | -78.5 | 102.2 | 167.7 | -80.2 | -167.8 | 64 | 0 | 0 | 109 | G104 L108 | G104-Q106 PolarHBondContact O-N 3.24Å; G104-Q106 VanDerWaalsContact O-N 3.07Å; Q106-L108 HydrophobicContact CB-CG 4.42Å; Q106-L108 PolarHBondContact O-N 3.25Å; Q106-L108 VanDerWaalsContact O-N 3.11Å |
| 107 | C | 40.7 | Very low | 43.6 | Very low | 116 Ų | 116 | 129.9 Ų | 129.9 | 78% | 0.784 | 76% | 0.762 | S | S | * | * | | | trans | -77.4 | 90.1 | 167.1 | -61.6 | 0 | 0 | 0 | 0 | 108.8 | C105 L109 | C105-C107 PolarHBondContact O-N 3.27Å; C107-L109 PolarHBondContact O-N 2.89Å |
| 108 | L | 50.8 | Low | 43.3 | Very low | 140 Ų | 140 | 130.4 Ų | 130.4 | 73% | 0.733 | 77% | 0.765 | S | S | * | * | | | trans | -86.1 | 68.8 | 175 | -71.1 | 172 | 0 | 0 | 0 | 111.1 | Q106 | Q106-L108 HydrophobicContact CB-CG 4.42Å; Q106-L108 PolarHBondContact O-N 3.25Å; Q106-L108 VanDerWaalsContact O-N 3.11Å |
| 109 | L | 46.7 | Very low | 43.1 | Very low | 149 Ų | 149 | 134 Ų | 134 | 78% | 0.78 | 77% | 0.771 | S | S | * | * | | | trans | -143.2 | 128.3 | 161.1 | -75.2 | 175.6 | 0 | 0 | 0 | 110.9 | C107 M111 | C107-L109 PolarHBondContact O-N 2.89Å; L109-M111 PolarHBondContact O-N 3.09Å; L109-M111 VanDerWaalsContact O-N 3.08Å |
| 110 | P | 44.5 | Very low | 43.1 | Very low | 127 Ų | 127 | 134.9 Ų | 134.9 | 83% | 0.825 | 77% | 0.771 | S | S | * | * | | | trans | -70.5 | 105.7 | 171.4 | 28.8 | -31.1 | 0 | 0 | 0 | 108.6 | K112 | P110-K112 PolarHBondContact O-N 3.36Š|
| 111 | M | 46.2 | Very low | 42.6 | Very low | 130 Ų | 130 | 135.9 Ų | 135.9 | 64% | 0.64 | 77% | 0.773 | S | S | * | * | | | trans | -64.2 | 102.1 | 173.7 | -65.6 | -132.7 | -158.6 | 0 | 0 | 109.7 | L109 L113 I129 | L109-M111 PolarHBondContact O-N 3.09Å; L109-M111 VanDerWaalsContact O-N 3.08Å; M111-L113 PolarHBondContact O-N 3.16Å; M111-L113 VanDerWaalsContact O-N 3.15Å; M111-I129 HydrophobicContact SD-CG2 4.42Å |
| 112 | K | 44.9 | Very low | 42.2 | Very low | 182 Ų | 182 | 145.1 Ų | 145.1 | 79% | 0.791 | 79% | 0.788 | S | S | * | * | | | trans | -83 | 84.1 | 171.7 | -159.8 | 95.5 | 173.5 | -178.8 | 0 | 108.4 | P110 N114 | P110-K112 PolarHBondContact O-N 3.36Å; K112-N114 PolarHBondContact O-N 3.02Å |
| 113 | L | 44.6 | Very low | 41.7 | Very low | 125 Ų | 125 | 144.4 Ų | 144.4 | 65% | 0.654 | 78% | 0.781 | S | S | * | * | | | trans | -76.5 | 112.5 | 173.6 | -75.3 | 165.5 | 0 | 0 | 0 | 109.5 | M111 | M111-L113 PolarHBondContact O-N 3.16Å; M111-L113 VanDerWaalsContact O-N 3.15Å |
| 114 | N | 41.1 | Very low | 41.4 | Very low | 138 Ų | 138 | 145.3 Ų | 145.3 | 74% | 0.738 | 77% | 0.769 | S | S | * | * | | | trans | -96.6 | 107.5 | 170 | -67.9 | -61.1 | 0 | 0 | 0 | 108.8 | K112 | K112-N114 PolarHBondContact O-N 3.02Š|
| 115 | F | 37.4 | Very low | 41.8 | Very low | 155 Ų | 155 | 150.5 Ų | 150.5 | 68% | 0.68 | 77% | 0.772 | S | S | * | * | | | trans | -95.7 | 109.9 | 172.7 | -112.5 | -98.5 | 0 | 0 | 0 | 109.3 | S117 V124 | F115-S117 PolarHBondContact O-N 3.11Å; F115-V124 HydrophobicContact CE1-CG1 3.71Å; F115-V124 HydrophobicContact CE1-CG2 4.14Å; F115-V124 HydrophobicContact CZ-CG1 3.64Å |
| 116 | T | 42.4 | Very low | 41.9 | Very low | 139 Ų | 139 | 148.9 Ų | 148.9 | 85% | 0.853 | 77% | 0.768 | S | S | * | * | | | trans | -90.7 | 96.5 | 167 | 48.3 | 0 | 0 | 0 | 0 | 108.6 | S118 | T116-S118 PolarHBondContact O-N 3.07Š|
| 117 | S | 35.2 | Very low | 42.3 | Very low | 98 Ų | 98 | 146.8 Ų | 146.8 | 69% | 0.685 | 77% | 0.767 | S | S | * | * | | | trans | -80.9 | 104.9 | 175.5 | 172.3 | 0 | 0 | 0 | 0 | 109.9 | F115 | F115-S117 PolarHBondContact O-N 3.11Š|
| 118 | S | 37 | Very low | 42.4 | Very low | 110 Ų | 110 | 150.3 Ų | 150.3 | 77% | 0.769 | 77% | 0.771 | S | S | * | * | | | trans | -101.1 | 119.7 | 159.8 | -172 | 0 | 0 | 0 | 0 | 108.5 | T116 E120 | T116-S118 PolarHBondContact O-N 3.07Å; S118-E120 PolarHBondContact O-N 3.22Å; S118-E120 VanDerWaalsContact O-N 3.09Å |
| 119 | F | 43.4 | Very low | 42.1 | Very low | 202 Ų | 202 | 149 Ų | 149 | 89% | 0.886 | 76% | 0.764 | S | S | * | * | | | trans | -77.4 | 10.1 | -163.2 | -150.9 | -97.8 | 0 | 0 | 0 | 114.8 | | |
| 120 | E | 41.6 | Very low | 41.8 | Very low | 164 Ų | 164 | 147.1 Ų | 147.1 | 77% | 0.766 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -112.7 | 108 | 177 | -94.3 | -177.9 | 120.7 | 0 | 0 | 111.6 | S118 | S118-E120 PolarHBondContact O-N 3.22Å; S118-E120 VanDerWaalsContact O-N 3.09Å |
| 121 | K | 36.7 | Very low | 41.7 | Very low | 191 Ų | 191 | 145 Ų | 145 | 83% | 0.83 | 75% | 0.751 | S | S | * | * | S | Bend | trans | 81.1 | 101 | 169.7 | -52.2 | 172.3 | -171.9 | 174.9 | 0 | 113.4 | M123 | K121-M123 PolarHBondContact O-N 3.08Š|
| 122 | R | 43.5 | Very low | 41.4 | Very low | 260 Ų | 260 | 145.9 Ų | 145.9 | 98% | 0.981 | 76% | 0.758 | S | S | * | * | | | trans | -43.5 | 100.4 | 172.8 | -67.7 | 174.8 | -147.6 | 177.3 | 5.8 | 111.6 | | |
| 123 | M | 33.9 | Very low | 41.1 | Very low | 163 Ų | 163 | 141.8 Ų | 141.8 | 80% | 0.803 | 75% | 0.752 | S | S | * | * | | | trans | -152.7 | 89.4 | 151.3 | -161.9 | 167.3 | 65.8 | 0 | 0 | 106.8 | K121 K125 | K121-M123 PolarHBondContact O-N 3.08Å; M123-K125 VanDerWaalsContact C-N 3.32Å; M123-K125 PolarHBondContact O-N 3.15Å |
| 124 | V | 40.7 | Very low | 40.9 | Very low | 107 Ų | 107 | 141.4 Ų | 141.4 | 65% | 0.648 | 75% | 0.754 | S | S | * | * | | | trans | -67.1 | 100.3 | 166.8 | 177.9 | 0 | 0 | 0 | 0 | 105.4 | F115 A126 | F115-V124 HydrophobicContact CE1-CG1 3.71Å; F115-V124 HydrophobicContact CE1-CG2 4.14Å; F115-V124 HydrophobicContact CZ-CG1 3.64Å; V124-A126 PolarHBondContact O-N 2.96Å |
| 125 | K | 43.2 | Very low | 40.8 | Very low | 175 Ų | 175 | 139.8 Ų | 139.8 | 76% | 0.761 | 75% | 0.749 | S | S | * | * | | | trans | -73.2 | 98 | 171.3 | -170.6 | 169 | -179 | 167.3 | 0 | 106.6 | M123 T127 | M123-K125 VanDerWaalsContact C-N 3.32Å; M123-K125 PolarHBondContact O-N 3.15Å; K125-T127 PolarHBondContact O-N 3.37Å |
| 126 | A | 45.1 | Very low | 40.8 | Very low | 91 Ų | 91 | 140.6 Ų | 140.6 | 75% | 0.752 | 76% | 0.755 | S | S | * | * | | | trans | -69.3 | 109 | 168.7 | 0 | 0 | 0 | 0 | 0 | 107.4 | V124 | V124-A126 PolarHBondContact O-N 2.96Š|
| 127 | T | 49.3 | Very low | 40.5 | Very low | 120 Ų | 120 | 141.1 Ų | 141.1 | 74% | 0.736 | 75% | 0.745 | S | S | * | * | | | trans | -76.1 | 131.6 | 168.4 | -41.8 | 0 | 0 | 0 | 0 | 107.2 | K125 I129 | K125-T127 PolarHBondContact O-N 3.37Å; T127-I129 PolarHBondContact O-N 3.45Å |
| 128 | E | 42.1 | Very low | 41 | Very low | 190 Ų | 190 | 142.8 Ų | 142.8 | 89% | 0.888 | 75% | 0.751 | S | S | * | * | | | trans | -42.8 | 128.2 | -176.3 | -83.2 | 176.1 | 132.4 | 0 | 0 | 112.9 | S130 | E128-S130 PolarHBondContact O-N 3.13Š|
| 129 | I | 45.6 | Very low | 40.9 | Very low | 112 Ų | 112 | 146.1 Ų | 146.1 | 57% | 0.574 | 75% | 0.749 | S | S | * | * | | | trans | -89.3 | 98.8 | 167.2 | -58.4 | 171.4 | 0 | 0 | 0 | 105.6 | M111 T127 C131 | M111-I129 HydrophobicContact SD-CG2 4.42Å; T127-I129 PolarHBondContact O-N 3.45Å; I129-C131 PolarHBondContact O-N 3.2Å |
| 130 | S | 39.9 | Very low | 40.8 | Very low | 111 Ų | 111 | 145 Ų | 145 | 78% | 0.776 | 75% | 0.746 | S | S | * | * | | | trans | -78.4 | 113 | 168.7 | -175.9 | 0 | 0 | 0 | 0 | 108.4 | E128 | E128-S130 PolarHBondContact O-N 3.13Š|
| 131 | C | 41.3 | Very low | 40.8 | Very low | 83 Ų | 83 | 146.3 Ų | 146.3 | 56% | 0.561 | 75% | 0.752 | S | S | * | * | | | trans | -105.3 | 109.2 | 167.8 | -67.9 | 0 | 0 | 0 | 0 | 107.8 | I129 C133 | I129-C131 PolarHBondContact O-N 3.2Å; C131-C133 PolarHBondContact O-N 3.1Å; C131-C133 VanDerWaalsContact O-N 3.15Å |
| 132 | D | 39.7 | Very low | 40.7 | Very low | 148 Ų | 148 | 142 Ų | 142 | 79% | 0.791 | 75% | 0.746 | S | S | * | * | | | trans | -79.6 | 95.2 | 173.1 | -142.7 | -33.9 | 0 | 0 | 0 | 108.3 | T134 | D132-T134 PolarHBondContact O-N 3.33Š|
| 133 | C | 38.9 | Very low | 40.8 | Very low | 96 Ų | 96 | 133.6 Ų | 133.6 | 65% | 0.649 | 73% | 0.732 | S | S | * | * | | | trans | -85.9 | 96 | 174 | -69.8 | 0 | 0 | 0 | 0 | 108.7 | C131 V135 | C131-C133 PolarHBondContact O-N 3.1Å; C131-C133 VanDerWaalsContact O-N 3.15Å; C133-V135 VanDerWaalsContact C-N 3.32Å; C133-V135 PolarHBondContact O-N 3.44Å |
| 134 | T | 40.9 | Very low | 41.2 | Very low | 116 Ų | 116 | 136.4 Ų | 136.4 | 71% | 0.712 | 73% | 0.734 | S | S | * | * | | | trans | -69.4 | 92.5 | 167.7 | -41.7 | 0 | 0 | 0 | 0 | 108.9 | D132 H136 | D132-T134 PolarHBondContact O-N 3.33Å; T134-H136 PolarHBondContact O-N 3.3Å; T134-H136 VanDerWaalsContact O-N 3.1Å |
| 135 | V | 38.6 | Very low | 41.5 | Very low | 105 Ų | 105 | 139.1 Ų | 139.1 | 64% | 0.636 | 75% | 0.745 | S | S | * | * | | | trans | -71.7 | 103.1 | 171.8 | -173.9 | 0 | 0 | 0 | 0 | 107.4 | C133 K137 | C133-V135 VanDerWaalsContact C-N 3.32Å; C133-V135 PolarHBondContact O-N 3.44Å; V135-K137 HydrophobicContact CB-CG 4.49Å; V135-K137 HydrophobicContact CG1-CG 3.64Å; V135-K137 PolarHBondContact O-N 3.4Å |
| 136 | H | 38.2 | Very low | 41.4 | Very low | 172 Ų | 172 | 136.6 Ų | 136.6 | 80% | 0.796 | 74% | 0.744 | S | S | * | * | | | trans | -66.4 | 83.5 | 161.6 | -99.6 | -97.7 | 0 | 0 | 0 | 108 | T134 T138 | T134-H136 PolarHBondContact O-N 3.3Å; T134-H136 VanDerWaalsContact O-N 3.1Å; H136-T138 PolarHBondContact O-N 2.82Å |
| 137 | K | 35.9 | Very low | 41.1 | Very low | 149 Ų | 149 | 138.3 Ų | 138.3 | 65% | 0.648 | 75% | 0.745 | S | S | * | * | | | trans | -72.9 | 101.1 | 167.1 | -78 | -166 | 178 | -178.9 | 0 | 108 | V135 Y139 | V135-K137 HydrophobicContact CB-CG 4.49Å; V135-K137 HydrophobicContact CG1-CG 3.64Å; V135-K137 PolarHBondContact O-N 3.4Å; K137-Y139 PolarHBondContact O-N 3.48Å |
| 138 | T | 45.3 | Very low | 40.6 | Very low | 133 Ų | 133 | 138.7 Ų | 138.7 | 82% | 0.816 | 75% | 0.747 | S | S | * | * | | | trans | -83.6 | 92.3 | 152.8 | 46.4 | 0 | 0 | 0 | 0 | 108.2 | H136 | H136-T138 PolarHBondContact O-N 2.82Š|
| 139 | Y | 34.7 | Very low | 40.5 | Very low | 181 Ų | 181 | 139.2 Ų | 139.2 | 71% | 0.71 | 76% | 0.763 | S | S | * | * | S | Bend | trans | -167.3 | 147 | 139 | 66.4 | -91.6 | 0 | 0 | 0 | 110.4 | K137 | K137-Y139 PolarHBondContact O-N 3.48Š|
| 140 | E | 41.3 | Very low | 40.2 | Very low | 178 Ų | 178 | 140.6 Ų | 140.6 | 83% | 0.832 | 77% | 0.773 | S | S | * | * | | | trans | -39.1 | 141.8 | 179.4 | -82.2 | 172.4 | 107.1 | 0 | 0 | 115.4 | S142 | E140-S142 PolarHBondContact O-N 3.22Š|
| 141 | E | 42.9 | Very low | 40.3 | Very low | 192 Ų | 192 | 142.1 Ų | 142.1 | 90% | 0.897 | 77% | 0.772 | S | S | * | * | | | trans | -15.7 | 115.1 | 148.5 | -172.9 | 178 | 172.1 | 0 | 0 | 115.8 | | |
| 142 | S | 33.9 | Very low | 40.2 | Very low | 99 Ų | 99 | 145.4 Ų | 145.4 | 69% | 0.692 | 78% | 0.784 | S | S | * | * | | | trans | -156.7 | 103.5 | 138.8 | -158.5 | 0 | 0 | 0 | 0 | 109.5 | E140 | E140-S142 PolarHBondContact O-N 3.22Š|
| 143 | A | 45.8 | Very low | 40.2 | Very low | 85 Ų | 85 | 145.2 Ų | 145.2 | 70% | 0.702 | 78% | 0.784 | S | S | * | * | | | trans | -55.5 | 144.4 | 169.8 | 0 | 0 | 0 | 0 | 0 | 111 | | |
| 144 | R | 42.7 | Very low | 40.3 | Very low | 221 Ų | 221 | 148.3 Ų | 148.3 | 83% | 0.834 | 79% | 0.792 | S | S | * | * | | | trans | -171 | 111.1 | 136.7 | -102.8 | 170.8 | -63.4 | -160.6 | 8.5 | 109.7 | | |
| 145 | N | 46.5 | Very low | 40.3 | Very low | 165 Ų | 165 | 150.5 Ų | 150.5 | 88% | 0.882 | 80% | 0.797 | S | S | * | * | | | trans | -51.3 | 133.3 | 161 | -86.8 | -5.3 | 0 | 0 | 0 | 109.5 | | |
| 146 | T | 40 | Very low | 40.4 | Very low | 121 Ų | 121 | 153.7 Ų | 153.7 | 74% | 0.742 | 81% | 0.809 | S | S | * | * | | | trans | -143.3 | 103.5 | 158.3 | -54.8 | 0 | 0 | 0 | 0 | 109.1 | V148 | T146-V148 HydrophobicContact CG2-CG2 4.43Š|
| 147 | T | 39.3 | Very low | 40.6 | Very low | 127 Ų | 127 | 152.3 Ų | 152.3 | 78% | 0.779 | 81% | 0.81 | S | S | * | * | | | trans | -59.5 | 134 | 160.5 | -52.3 | 0 | 0 | 0 | 0 | 108.8 | | |
| 148 | V | 38.3 | Very low | 41 | Very low | 128 Ų | 128 | 152.6 Ų | 152.6 | 78% | 0.776 | 82% | 0.823 | S | S | * | * | | | trans | -120.1 | 122.5 | 164.6 | -173.2 | 0 | 0 | 0 | 0 | 108 | T146 | T146-V148 HydrophobicContact CG2-CG2 4.43Š|
| 149 | V | 40.8 | Very low | 40.6 | Very low | 201 Ų | 201 | 154.4 Ų | 154.4 | 100% | 1.218 | 82% | 0.824 | S | S | * | * | | | trans | -71.7 | 0 | 174.6 | 176.2 | 0 | 0 | 0 | 0 | 110.2 | | |