| 1 | M | 53 | Low | 64.1 | Low | 241 Ų | 241 | 178.8 Ų | 178.8 | 100% | 1.187 | 86% | 0.857 | S | S | * | * | | | | 0 | 152 | 0 | -75.6 | -107.7 | -95.2 | 0 | 0 | 107.8 | | |
| 2 | R | 64.7 | Low | 64.8 | Low | 248 Ų | 248 | 179.3 Ų | 179.3 | 94% | 0.936 | 86% | 0.857 | S | S | * | * | | | trans | -75.3 | 157.4 | -140.2 | -65.7 | 170 | 179.3 | -179.5 | -0.4 | 115.1 | | |
| 3 | H | 62.8 | Low | 65.2 | Low | 191 Ų | 191 | 179.3 Ų | 179.3 | 88% | 0.884 | 86% | 0.856 | S | S | * | * | | | trans | -64.5 | 152.2 | -177 | -73.9 | -119 | 0 | 0 | 0 | 113.1 | | |
| 4 | R | 61.7 | Low | 65.8 | Low | 219 Ų | 219 | 173.1 Ų | 173.1 | 83% | 0.826 | 85% | 0.849 | S | S | * | * | | | trans | -24.5 | 132.2 | 171.7 | -63 | 179.1 | 180 | 168.1 | -2 | 115.9 | | |
| 5 | A | 65.6 | Low | 66.4 | Low | 97 Ų | 97 | 173 Ų | 173 | 80% | 0.802 | 85% | 0.846 | S | S | * | * | P | Polyproline II helix | trans | -102 | 117.9 | 142.4 | 0 | 0 | 0 | 0 | 0 | 106 | | |
| 6 | E | 67.1 | Low | 66.8 | Low | 154 Ų | 154 | 169.6 Ų | 169.6 | 72% | 0.72 | 84% | 0.841 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 123.9 | 168.7 | -66.9 | -90.6 | 118 | 0 | 0 | 107 | E8 | E6-E8 PolarHBondContact O-N 3.05Š|
| 7 | P | 66.1 | Low | 67.3 | Low | 116 Ų | 116 | 170.6 Ų | 170.6 | 75% | 0.753 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 120.3 | 175.1 | 26.7 | -29.4 | 0 | 0 | 0 | 108.3 | E9 | P7-E9 PolarHBondContact O-N 3.28Š|
| 8 | E | 69.1 | Low | 67.6 | Low | 183 Ų | 183 | 170.3 Ų | 170.3 | 86% | 0.855 | 85% | 0.845 | S | S | * | * | | | trans | -50.7 | 115.9 | 171.8 | -73.7 | -172.6 | 114.5 | 0 | 0 | 108.9 | E6 S10 | E6-E8 PolarHBondContact O-N 3.05Å; E8-S10 PolarHBondContact O-N 2.88Å; E8-S10 VanDerWaalsContact C-N 3.33Å |
| 9 | E | 61.5 | Low | 67.9 | Low | 185 Ų | 185 | 166.3 Ų | 166.3 | 86% | 0.864 | 83% | 0.827 | S | S | * | * | | | trans | -53 | 103 | 169.5 | -71.1 | 179.3 | 118.1 | 0 | 0 | 107.2 | P7 R11 | P7-E9 PolarHBondContact O-N 3.28Å; E9-R11 PolarHBondContact O-N 2.82Å |
| 10 | S | 66.4 | Low | 68.2 | Low | 105 Ų | 105 | 163.4 Ų | 163.4 | 73% | 0.734 | 82% | 0.823 | S | S | * | * | | | trans | -62.2 | 102.6 | 177.5 | -67.6 | 0 | 0 | 0 | 0 | 106.2 | E8 E12 | E8-S10 PolarHBondContact O-N 2.88Å; E8-S10 VanDerWaalsContact C-N 3.33Å; S10-E12 PolarHBondContact O-N 2.82Å |
| 11 | R | 67 | Low | 68.5 | Low | 228 Ų | 228 | 161.7 Ų | 161.7 | 86% | 0.86 | 82% | 0.817 | S | S | * | * | | | trans | -66.3 | 85.8 | 170.5 | -63.9 | 179.7 | -178.3 | -177.8 | -0.2 | 106.3 | E9 Q13 | E9-R11 PolarHBondContact O-N 2.82Å; R11-Q13 PolarHBondContact O-N 2.79Å |
| 12 | E | 72.6 | Confident | 69.6 | Low | 184 Ų | 184 | 156.1 Ų | 156.1 | 86% | 0.86 | 79% | 0.792 | S | S | * | * | | | trans | -56.7 | 97.4 | 164.8 | -75 | 172.7 | 123.7 | 0 | 0 | 106 | S10 A14 | S10-E12 PolarHBondContact O-N 2.82Å; E12-A14 VanDerWaalsContact C-N 3.3Å; E12-A14 PolarHBondContact O-N 2.95Å |
| 13 | Q | 70 | Confident | 70.3 | Confident | 180 Ų | 180 | 152.5 Ų | 152.5 | 84% | 0.841 | 79% | 0.786 | S | S | * | * | | | trans | -65.9 | 100.1 | 169.1 | -69.6 | 176.2 | 36.3 | 0 | 0 | 105 | R11 Q15 | R11-Q13 PolarHBondContact O-N 2.79Å; Q13-Q15 PolarHBondContact O-N 3.18Å |
| 14 | A | 74 | Confident | 71.2 | Confident | 92 Ų | 92 | 151.4 Ų | 151.4 | 76% | 0.76 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -51 | 125.7 | 171.1 | 0 | 0 | 0 | 0 | 0 | 107.6 | E12 | E12-A14 VanDerWaalsContact C-N 3.3Å; E12-A14 PolarHBondContact O-N 2.95Å |
| 15 | Q | 75.1 | Confident | 72.4 | Confident | 172 Ų | 172 | 145.8 Ų | 145.8 | 80% | 0.804 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 134.6 | 171.9 | -65.7 | -104.6 | -73.1 | 0 | 0 | 107 | Q13 E17 | Q13-Q15 PolarHBondContact O-N 3.18Å; Q15-E17 PolarHBondContact O-N 3.35Å |
| 16 | P | 72.3 | Confident | 73.4 | Confident | 119 Ų | 119 | 147.9 Ų | 147.9 | 77% | 0.773 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 130.2 | 172.8 | 24.8 | -31.5 | 0 | 0 | 0 | 107.9 | D18 | P16-D18 PolarHBondContact O-N 3.25Š|
| 17 | E | 75 | Confident | 74.4 | Confident | 186 Ų | 186 | 148.8 Ų | 148.8 | 87% | 0.869 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 129.4 | 175.2 | -60.1 | -163.8 | 124.4 | 0 | 0 | 107.8 | Q15 D19 | Q15-E17 PolarHBondContact O-N 3.35Å; E17-D19 PolarHBondContact O-N 2.95Å |
| 18 | D | 73.5 | Confident | 75.5 | Confident | 165 Ų | 165 | 152.1 Ų | 152.1 | 88% | 0.882 | 78% | 0.779 | S | S | * | * | | | trans | -75.1 | 82.4 | 174.9 | -170.7 | 39.2 | 0 | 0 | 0 | 106.8 | P16 S20 | P16-D18 PolarHBondContact O-N 3.25Å; D18-S20 PolarHBondContact O-N 3.12Å; D18-S20 VanDerWaalsContact O-N 3.12Å |
| 19 | D | 73.8 | Confident | 76.4 | Confident | 94 Ų | 94 | 148 Ų | 148 | 50% | 0.503 | 78% | 0.776 | S | S | . | * | | | trans | -72.1 | 105.4 | 178.7 | -149.2 | -13.7 | 0 | 0 | 0 | 107.5 | E17 D21 D22 | E17-D19 PolarHBondContact O-N 2.95Å; D19-D21 PolarHBondContact O-N 3.19Å; D19-D22 PolarHBondContact O-N 2.78Å |
| 20 | S | 72.4 | Confident | 77.6 | Confident | 108 Ų | 108 | 147.5 Ų | 147.5 | 76% | 0.755 | 77% | 0.774 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.7 | -11.1 | -176.4 | 54 | 0 | 0 | 0 | 0 | 113.4 | D18 | D18-S20 PolarHBondContact O-N 3.12Å; D18-S20 VanDerWaalsContact O-N 3.12Å |
| 21 | D | 75.4 | Confident | 78.4 | Confident | 129 Ų | 129 | 147.6 Ų | 147.6 | 69% | 0.69 | 77% | 0.772 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.9 | 4.5 | -176.6 | -62.2 | -24.5 | 0 | 0 | 0 | 113.3 | D19 E23 | D19-D21 PolarHBondContact O-N 3.19Å; D21-E23 PolarHBondContact O-N 2.99Å |
| 22 | D | 75.4 | Confident | 79.2 | Confident | 123 Ų | 123 | 146 Ų | 146 | 66% | 0.658 | 77% | 0.771 | S | S | * | * | | | trans | -70.5 | 68.9 | 172.1 | -81.6 | -26.4 | 0 | 0 | 0 | 111.3 | D19 L24 | D19-D22 PolarHBondContact O-N 2.78Å; D22-L24 PolarHBondContact O-N 3.11Å; D22-L24 VanDerWaalsContact O-N 3.11Å |
| 23 | E | 80.4 | Confident | 79.7 | Confident | 173 Ų | 173 | 143.8 Ų | 143.8 | 81% | 0.808 | 77% | 0.77 | S | S | * | * | | | trans | -65.8 | 110.9 | 171.1 | -75 | -164.6 | 131.6 | 0 | 0 | 109.8 | D21 V25 | D21-E23 PolarHBondContact O-N 2.99Å; E23-V25 PolarHBondContact O-N 3Å |
| 24 | L | 82 | Confident | 80.1 | Confident | 168 Ų | 168 | 143.6 Ų | 143.6 | 88% | 0.88 | 77% | 0.769 | S | S | * | * | | | trans | -66.3 | 103.2 | 174.5 | -61.4 | 176.9 | 0 | 0 | 0 | 110.3 | D22 | D22-L24 PolarHBondContact O-N 3.11Å; D22-L24 VanDerWaalsContact O-N 3.11Å |
| 25 | V | 86.3 | Confident | 80.2 | Confident | 101 Ų | 101 | 144.3 Ų | 144.3 | 61% | 0.612 | 77% | 0.769 | S | S | * | * | | | trans | -84.8 | 118.7 | 176.7 | -176.8 | 0 | 0 | 0 | 0 | 110.6 | E23 | E23-V25 PolarHBondContact O-N 3Š|
| 26 | L | 86.3 | Confident | 80.3 | Confident | 140 Ų | 140 | 144 Ų | 144 | 73% | 0.733 | 77% | 0.769 | S | S | * | * | | | trans | -82.5 | 116.1 | 172.5 | -69.5 | 172.6 | 0 | 0 | 0 | 110.8 | F28 | L26-F28 HydrophobicContact CB-CZ 4.43Å; L26-F28 HydrophobicContact CD1-CZ 4.5Å; L26-F28 HydrophobicContact CB-CE2 4.07Å |
| 27 | H | 87.7 | Confident | 80.3 | Confident | 173 Ų | 173 | 143.5 Ų | 143.5 | 80% | 0.801 | 77% | 0.766 | S | S | * | * | | | trans | -92.9 | 112.1 | 173.1 | -63.9 | -72.7 | 0 | 0 | 0 | 110.9 | | |
| 28 | F | 88.4 | Confident | 80.3 | Confident | 186 Ų | 186 | 144.1 Ų | 144.1 | 82% | 0.816 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -90 | 122.1 | 170.5 | -64.2 | -82.5 | 0 | 0 | 0 | 110.1 | L26 | L26-F28 HydrophobicContact CB-CZ 4.43Å; L26-F28 HydrophobicContact CD1-CZ 4.5Å; L26-F28 HydrophobicContact CB-CE2 4.07Å |
| 29 | A | 88.4 | Confident | 80.1 | Confident | 96 Ų | 96 | 145.2 Ų | 145.2 | 79% | 0.793 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -77.6 | 134.2 | 169.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | | |
| 30 | Q | 86.9 | Confident | 79.8 | Confident | 175 Ų | 175 | 149.3 Ų | 149.3 | 82% | 0.818 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 127.4 | 174.1 | -171.5 | 176.7 | 1.1 | 0 | 0 | 109.4 | K32 | Q30-K32 PolarHBondContact O-N 3.28Š|
| 31 | P | 83.8 | Confident | 79.8 | Confident | 108 Ų | 108 | 152.6 Ų | 152.6 | 70% | 0.701 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 128.4 | 177.2 | 23.5 | -31.3 | 0 | 0 | 0 | 109.4 | V33 | P31-V33 PolarHBondContact O-N 2.99Å; P31-V33 VanDerWaalsContact O-N 3.12Å |
| 32 | K | 84.4 | Confident | 79.3 | Confident | 194 Ų | 194 | 152.1 Ų | 152.1 | 84% | 0.843 | 79% | 0.789 | S | S | * | * | | | trans | -63.3 | 114.5 | 172.3 | -67.2 | 177.8 | -177.9 | 175.9 | 0 | 107.7 | Q30 Q34 | Q30-K32 PolarHBondContact O-N 3.28Å; K32-Q34 PolarHBondContact O-N 3.12Å |
| 33 | V | 81.4 | Confident | 79 | Confident | 137 Ų | 137 | 153.6 Ų | 153.6 | 83% | 0.83 | 80% | 0.796 | S | S | * | * | | | trans | -64.7 | 103.7 | 171.7 | -179.7 | 0 | 0 | 0 | 0 | 107.1 | P31 | P31-V33 PolarHBondContact O-N 2.99Å; P31-V33 VanDerWaalsContact O-N 3.12Å |
| 34 | Q | 79.5 | Confident | 78.2 | Confident | 177 Ų | 177 | 151.8 Ų | 151.8 | 83% | 0.827 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -75.5 | 123.5 | 166.8 | -64.9 | -173.1 | 47.5 | 0 | 0 | 106.6 | K32 M36 | K32-Q34 PolarHBondContact O-N 3.12Å; Q34-M36 PolarHBondContact O-N 3.24Å |
| 35 | S | 76.9 | Confident | 77.4 | Confident | 107 Ų | 107 | 149.9 Ų | 149.9 | 75% | 0.748 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -57 | 126.2 | 171.2 | 50.9 | 0 | 0 | 0 | 0 | 108.2 | | |
| 36 | M | 76.9 | Confident | 76.4 | Confident | 166 Ų | 166 | 150.2 Ų | 150.2 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -51.3 | 133.1 | 168.7 | -70.8 | -63.1 | -65.4 | 0 | 0 | 108.2 | Q34 K38 | Q34-M36 PolarHBondContact O-N 3.24Å; M36-K38 VanDerWaalsContact O-N 3.12Å; M36-K38 PolarHBondContact O-N 3.12Å |
| 37 | P | 72.6 | Confident | 75.3 | Confident | 107 Ų | 107 | 149 Ų | 149 | 70% | 0.695 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 126.6 | 170.8 | 22.7 | -30.1 | 0 | 0 | 0 | 106.9 | E39 | P37-E39 PolarHBondContact O-N 3.45Š|
| 38 | K | 73.6 | Confident | 74.2 | Confident | 199 Ų | 199 | 148.5 Ų | 148.5 | 87% | 0.865 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -48.8 | 118.6 | 174.9 | -176.3 | 177.8 | -178.1 | -178.7 | 0 | 106.1 | M36 E40 | M36-K38 VanDerWaalsContact O-N 3.12Å; M36-K38 PolarHBondContact O-N 3.12Å; K38-E40 PolarHBondContact O-N 3Å |
| 39 | E | 70.6 | Confident | 72.6 | Confident | 189 Ų | 189 | 142 Ų | 142 | 88% | 0.883 | 79% | 0.786 | S | S | * | * | | | trans | -43.7 | 108.4 | 179.9 | -70.8 | 162.8 | 156.5 | 0 | 0 | 107.9 | P37 | P37-E39 PolarHBondContact O-N 3.45Š|
| 40 | E | 67.6 | Low | 71.3 | Confident | 180 Ų | 180 | 145.7 Ų | 145.7 | 84% | 0.841 | 79% | 0.787 | S | S | * | * | | | trans | -59.1 | 142.1 | 173.3 | -155.4 | 179.3 | 145.3 | 0 | 0 | 106.3 | K38 | K38-E40 PolarHBondContact O-N 3Š|
| 41 | E | 70.5 | Confident | 70 | Confident | 176 Ų | 176 | 146.6 Ų | 146.6 | 82% | 0.822 | 79% | 0.788 | S | S | * | * | S | Bend | trans | -43.2 | 139.5 | -173.7 | -77.4 | -179.2 | 123.2 | 0 | 0 | 111.4 | L43 | E41-L43 PolarHBondContact O-N 3.35Š|
| 42 | P | 65.8 | Low | 68.9 | Low | 119 Ų | 119 | 149 Ų | 149 | 77% | 0.773 | 79% | 0.79 | S | S | * | * | | | trans | -51.5 | 113.8 | -174.2 | 20.3 | -31.6 | 0 | 0 | 0 | 108.3 | T44 | P42-T44 PolarHBondContact O-N 2.06Š|
| 43 | L | 68.3 | Low | 67.7 | Low | 154 Ų | 154 | 144.2 Ų | 144.2 | 81% | 0.806 | 79% | 0.787 | S | S | * | * | | | trans | -41.5 | 115.1 | 172.5 | -72.9 | 167.3 | 0 | 0 | 0 | 105.8 | E41 T45 | E41-L43 PolarHBondContact O-N 3.35Å; L43-T45 PolarHBondContact O-N 2.84Å |
| 44 | T | 63.8 | Low | 66.8 | Low | 135 Ų | 135 | 144.8 Ų | 144.8 | 83% | 0.828 | 78% | 0.784 | S | S | * | * | | | trans | -51.4 | 95.5 | -175.7 | 36.2 | 0 | 0 | 0 | 0 | 107.6 | P42 C46 | P42-T44 PolarHBondContact O-N 2.06Å; T44-C46 VanDerWaalsContact C-N 3.33Å; T44-C46 PolarHBondContact O-N 3.02Å |
| 45 | T | 66.4 | Low | 65.9 | Low | 128 Ų | 128 | 141.1 Ų | 141.1 | 79% | 0.785 | 78% | 0.776 | S | S | * | * | | | trans | -68.4 | 102.6 | 178 | 46.2 | 0 | 0 | 0 | 0 | 104.2 | L43 P47 | L43-T45 PolarHBondContact O-N 2.84Å; T45-P47 WeakPolarHBondContact O-CD 3.17Å |
| 46 | C | 65.4 | Low | 65.3 | Low | 108 Ų | 108 | 140.3 Ų | 140.3 | 73% | 0.73 | 78% | 0.775 | S | S | * | * | | | trans | -50.8 | 119.8 | 169 | -61.8 | 0 | 0 | 0 | 0 | 106.3 | T44 I48 | T44-C46 VanDerWaalsContact C-N 3.33Å; T44-C46 PolarHBondContact O-N 3.02Å; C46-I48 PolarHBondContact O-N 2.94Å |
| 47 | P | 62.8 | Low | 64.7 | Low | 115 Ų | 115 | 142.8 Ų | 142.8 | 75% | 0.747 | 78% | 0.776 | S | S | * | * | | | trans | -58.5 | 130.3 | 178 | 23.1 | -30.9 | 0 | 0 | 0 | 107.2 | T45 G49 | T45-P47 WeakPolarHBondContact O-CD 3.17Å; P47-G49 PolarHBondContact O-N 3.13Å |
| 48 | I | 63.5 | Low | 64.6 | Low | 163 Ų | 163 | 145.2 Ų | 145.2 | 84% | 0.836 | 78% | 0.782 | S | S | * | * | S | Bend | trans | -73.7 | 60.1 | 174.7 | -50.5 | 168.6 | 0 | 0 | 0 | 107.6 | C46 F51 | C46-I48 PolarHBondContact O-N 2.94Å; I48-F51 HydrophobicContact CG2-CD2 4.46Å |
| 49 | G | 56.1 | Low | 64.6 | Low | 50 Ų | 50 | 145.5 Ų | 145.5 | 52% | 0.515 | 78% | 0.783 | S | S | . | * | | | trans | -119.8 | 101.6 | 155 | 0 | 0 | 0 | 0 | 0 | 102.5 | P47 | P47-G49 PolarHBondContact O-N 3.13Š|
| 50 | E | 60 | Low | 64.8 | Low | 173 Ų | 173 | 148.1 Ų | 148.1 | 81% | 0.808 | 79% | 0.785 | S | S | * | * | | | | -179 | 47.1 | 103.9 | -83.1 | 159.3 | -158.2 | 0 | 0 | 106.9 | E52 | E50-E52 PolarHBondContact O-N 2.86Š|
| 51 | F | 60.9 | Low | 65.2 | Low | 193 Ų | 193 | 143.4 Ų | 143.4 | 85% | 0.846 | 77% | 0.772 | S | S | * | * | | | trans | -72.3 | 65.7 | 149.9 | -67.1 | -79.9 | 0 | 0 | 0 | 106.3 | I48 A53 | I48-F51 HydrophobicContact CG2-CD2 4.46Å; F51-A53 PolarHBondContact O-N 3.43Å; F51-A53 VanDerWaalsContact O-N 3.09Å |
| 52 | E | 60.1 | Low | 65.4 | Low | 159 Ų | 159 | 140.8 Ų | 140.8 | 74% | 0.743 | 77% | 0.773 | S | S | * | * | | | trans | -37.5 | 123.4 | 154 | -81 | -173.9 | 142.1 | 0 | 0 | 104.7 | E50 L54 | E50-E52 PolarHBondContact O-N 2.86Å; E52-L54 PolarHBondContact O-N 3.29Å |
| 53 | A | 60 | Low | 66.1 | Low | 93 Ų | 93 | 145.4 Ų | 145.4 | 77% | 0.769 | 78% | 0.775 | S | S | * | * | | | trans | -56.2 | 83 | 179.1 | 0 | 0 | 0 | 0 | 0 | 108 | F51 P55 | F51-A53 PolarHBondContact O-N 3.43Å; F51-A53 VanDerWaalsContact O-N 3.09Å; A53-P55 WeakPolarHBondContact O-CD 3.13Å |
| 54 | L | 61.5 | Low | 66.5 | Low | 150 Ų | 150 | 144.7 Ų | 144.7 | 79% | 0.785 | 78% | 0.777 | S | S | * | * | | | trans | -54.3 | 111.8 | 164.6 | -76.1 | 174.8 | 0 | 0 | 0 | 101.6 | E52 A56 | E52-L54 PolarHBondContact O-N 3.29Å; L54-A56 PolarHBondContact O-N 2.87Å |
| 55 | P | 60.8 | Low | 67.2 | Low | 99 Ų | 99 | 148.6 Ų | 148.6 | 64% | 0.643 | 78% | 0.777 | S | S | * | * | | | trans | -63.7 | 104.7 | 176 | -13.3 | 28 | 0 | 0 | 0 | 102.8 | A53 R57 | A53-P55 WeakPolarHBondContact O-CD 3.13Å; P55-R57 HydrophobicContact CB-CG 3.82Å; P55-R57 PolarHBondContact O-N 2.66Å; P55-R57 HydrophobicContact CB-CB 4.46Å |
| 56 | A | 64 | Low | 67.8 | Low | 90 Ų | 90 | 151.3 Ų | 151.3 | 74% | 0.744 | 78% | 0.781 | S | S | * | * | | | trans | -69.1 | 52.2 | 165.1 | 0 | 0 | 0 | 0 | 0 | 107.2 | L54 L58 | L54-A56 PolarHBondContact O-N 2.87Å; A56-L58 PolarHBondContact O-N 2.91Å |
| 57 | R | 64.9 | Low | 68.4 | Low | 218 Ų | 218 | 150.4 Ų | 150.4 | 82% | 0.823 | 78% | 0.78 | S | S | * | * | | | trans | -69.7 | 80 | 164.7 | -73.2 | -175.3 | 171.8 | -161.4 | -1.3 | 104 | P55 K59 | P55-R57 HydrophobicContact CB-CG 3.82Å; P55-R57 PolarHBondContact O-N 2.66Å; P55-R57 HydrophobicContact CB-CB 4.46Å; R57-K59 VanDerWaalsContact C-N 3.33Å; R57-K59 PolarHBondContact O-N 3.2Å |
| 58 | L | 70.2 | Confident | 69.3 | Low | 158 Ų | 158 | 156.9 Ų | 156.9 | 83% | 0.827 | 79% | 0.79 | S | S | * | * | | | trans | -44.4 | 103.7 | 165.7 | -71.5 | 158.7 | 0 | 0 | 0 | 105.9 | A56 R60 | A56-L58 PolarHBondContact O-N 2.91Å; L58-R60 PolarHBondContact O-N 3.24Å |
| 59 | K | 73.6 | Confident | 70 | Confident | 205 Ų | 205 | 154.9 Ų | 154.9 | 89% | 0.891 | 79% | 0.786 | S | S | * | * | | | trans | -56.2 | 114.1 | 178.2 | -79.6 | -179.4 | 177.4 | 175.5 | 0 | 106 | R57 S61 | R57-K59 VanDerWaalsContact C-N 3.33Å; R57-K59 PolarHBondContact O-N 3.2Å; K59-S61 PolarHBondContact O-N 3.38Å; K59-S61 VanDerWaalsContact O-N 3.11Å |
| 60 | R | 74.4 | Confident | 71.3 | Confident | 244 Ų | 244 | 155.3 Ų | 155.3 | 92% | 0.921 | 78% | 0.78 | S | S | * | * | | | trans | -59.4 | 119.1 | 174 | -69.5 | -178.8 | 178.5 | 158.8 | -1.1 | 106.7 | L58 S62 | L58-R60 PolarHBondContact O-N 3.24Å; R60-S62 PolarHBondContact O-N 2.95Å |
| 61 | S | 75.7 | Confident | 72.2 | Confident | 82 Ų | 82 | 151.3 Ų | 151.3 | 57% | 0.573 | 78% | 0.776 | S | S | * | * | | | trans | -63.1 | 120.6 | 174.7 | 63.5 | 0 | 0 | 0 | 0 | 108.4 | K59 R63 | K59-S61 PolarHBondContact O-N 3.38Å; K59-S61 VanDerWaalsContact O-N 3.11Å; S61-R63 PolarHBondContact O-N 3.11Å |
| 62 | S | 75.6 | Confident | 73.2 | Confident | 121 Ų | 121 | 146 Ų | 146 | 85% | 0.846 | 76% | 0.763 | S | S | * | * | | | trans | -77.6 | -2.3 | 175.5 | 56.4 | 0 | 0 | 0 | 0 | 113.5 | R60 V64 | R60-S62 PolarHBondContact O-N 2.95Å; S62-V64 PolarHBondContact O-N 2.83Å |
| 63 | R | 80.1 | Confident | 73.8 | Confident | 215 Ų | 215 | 143 Ų | 143 | 81% | 0.811 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -62 | 125.1 | 179.8 | -66.2 | -174.6 | -178.5 | -179.4 | 0.3 | 109.4 | S61 R65 | S61-R63 PolarHBondContact O-N 3.11Å; R63-R65 PolarHBondContact O-N 2.79Å |
| 64 | V | 77.6 | Confident | 74.2 | Confident | 140 Ų | 140 | 144.8 Ų | 144.8 | 85% | 0.848 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -55.8 | 123.9 | 169.8 | -179.3 | 0 | 0 | 0 | 0 | 107.3 | S62 | S62-V64 PolarHBondContact O-N 2.83Š|
| 65 | R | 78.3 | Confident | 73.9 | Confident | 216 Ų | 216 | 146.1 Ų | 146.1 | 82% | 0.815 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -82.2 | 122.8 | 170.5 | -66.4 | -174.1 | 178 | -163.4 | -1.2 | 106.8 | R63 A67 | R63-R65 PolarHBondContact O-N 2.79Å; R65-A67 PolarHBondContact O-N 2.69Å |
| 66 | E | 79 | Confident | 74.5 | Confident | 186 Ų | 186 | 148.5 Ų | 148.5 | 87% | 0.869 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 126.9 | 166.8 | -69 | 177 | 173.3 | 0 | 0 | 108.1 | R68 | E66-R68 PolarHBondContact O-N 2.7Š|
| 67 | A | 77.7 | Confident | 75.1 | Confident | 88 Ų | 88 | 151.5 Ų | 151.5 | 73% | 0.727 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 131.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 108.1 | R65 T69 | R65-A67 PolarHBondContact O-N 2.69Å; A67-T69 PolarHBondContact O-N 2.57Å; A67-T69 VanDerWaalsContact O-N 3.13Å |
| 68 | R | 80.3 | Confident | 75.7 | Confident | 251 Ų | 251 | 147.8 Ų | 147.8 | 95% | 0.947 | 78% | 0.775 | S | S | * | * | | | trans | -65.6 | 115.3 | 171.6 | -67.5 | -176.2 | 179.1 | -175.2 | -1.1 | 107.4 | E66 | E66-R68 PolarHBondContact O-N 2.7Š|
| 69 | T | 80 | Confident | 76 | Confident | 122 Ų | 122 | 147.2 Ų | 147.2 | 75% | 0.748 | 77% | 0.772 | S | S | * | * | | | trans | -73.1 | 131.7 | 170 | 49 | 0 | 0 | 0 | 0 | 108.4 | A67 | A67-T69 PolarHBondContact O-N 2.57Å; A67-T69 VanDerWaalsContact O-N 3.13Å |
| 70 | C | 81.9 | Confident | 76.1 | Confident | 58 Ų | 58 | 143.6 Ų | 143.6 | 39% | 0.392 | 76% | 0.764 | S | S | . | * | | | trans | -95 | 129.2 | 168.7 | -176.3 | 0 | 0 | 0 | 0 | 107.6 | C72 C73 | C70-C72 PolarHBondContact O-N 2.8Å; C70-C72 PolarHBondContact SG-SG 3.26Å; C70-C72 CovalentContact SG-SG 2.06Å; C70-C72 PolarHBondContact SG-N 2.76Å; C70-C72 WeakPolarHBondContact SG-CB 3.38Å; C70-C72 WeakPolarHBondContact CB-SG 3.04Å; C70-C72 HydrophobicContact CB-CB 4.43Å; C70-C73 PolarHBondContact O-N 3.09Å |
| 71 | A | 78.6 | Confident | 76.2 | Confident | 89 Ų | 89 | 136.9 Ų | 136.9 | 74% | 0.736 | 75% | 0.754 | S | S | * | * | G | 310 helix | trans | -57.3 | -19.1 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113 | C73 | A71-C73 VanDerWaalsContact C-N 3.31Š|
| 72 | C | 83 | Confident | 76.3 | Confident | 83 Ų | 83 | 140.9 Ų | 140.9 | 56% | 0.561 | 77% | 0.766 | S | S | * | * | G | 310 helix | trans | -73.4 | -16.4 | 175.3 | 65.1 | 0 | 0 | 0 | 0 | 114.7 | C70 T75 | C70-C72 PolarHBondContact O-N 2.8Å; C70-C72 PolarHBondContact SG-SG 3.26Å; C70-C72 CovalentContact SG-SG 2.06Å; C70-C72 PolarHBondContact SG-N 2.76Å; C70-C72 WeakPolarHBondContact SG-CB 3.38Å; C70-C72 WeakPolarHBondContact CB-SG 3.04Å; C70-C72 HydrophobicContact CB-CB 4.43Å; C72-T75 PolarHBondContact O-OG1 3.2Å |
| 73 | C | 73.3 | Confident | 76.3 | Confident | 95 Ų | 95 | 142.4 Ų | 142.4 | 64% | 0.642 | 76% | 0.76 | S | S | * | * | G | 310 helix | trans | -99.8 | -4.8 | -176.4 | -62 | 0 | 0 | 0 | 0 | 113.4 | C70 A71 T75 | C70-C73 PolarHBondContact O-N 3.09Å; A71-C73 VanDerWaalsContact C-N 3.31Å; C73-T75 VanDerWaalsContact C-N 3.33Å |
| 74 | D | 66.6 | Low | 76 | Confident | 130 Ų | 130 | 136.3 Ų | 136.3 | 70% | 0.695 | 76% | 0.756 | S | S | * | * | | | trans | -93.7 | 11.6 | 179.2 | -63.6 | -35 | 0 | 0 | 0 | 112.7 | | |
| 75 | T | 55.9 | Low | 75.9 | Confident | 178 Ų | 178 | 136 Ų | 136 | 100% | 1.092 | 75% | 0.748 | S | S | * | * | | | trans | -101.9 | 0 | 172.8 | 57.8 | 0 | 0 | 0 | 0 | 111.3 | C72 C73 | C72-T75 PolarHBondContact O-OG1 3.2Å; C73-T75 VanDerWaalsContact C-N 3.33Å |