| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 39.2 | Very low | 45.6 | Very low | 242 Ų | 242 | 148.2 Ų | 148.2 | 100% | 1.192 | 80% | 0.8 | S | S | * | * | 0 | 127.1 | 0 | -65.6 | 150.5 | 73.8 | 0 | 0 | 106.9 | |||||
| 2 | S | 42.5 | Very low | 45.7 | Very low | 104 Ų | 104 | 148.6 Ų | 148.6 | 73% | 0.727 | 79% | 0.793 | S | S | * | * | cis | -165.9 | 122 | 1.5 | -113.6 | 0 | 0 | 0 | 0 | 104.3 | ||||
| 3 | S | 41.5 | Very low | 45.1 | Very low | 105 Ų | 105 | 148.3 Ų | 148.3 | 73% | 0.734 | 78% | 0.784 | S | S | * | * | 68.3 | 125.2 | 108.8 | 69 | 0 | 0 | 0 | 0 | 116.5 | |||||
| 4 | Y | 44.8 | Very low | 45 | Very low | 224 Ų | 224 | 145.9 Ų | 145.9 | 88% | 0.878 | 78% | 0.778 | S | S | * | * | trans | -12.2 | 148.8 | 157 | -72.6 | -94.3 | 0 | 0 | 0 | 117 | ||||
| 5 | V | 55.3 | Low | 45 | Very low | 127 Ų | 127 | 146.9 Ų | 146.9 | 77% | 0.77 | 78% | 0.776 | S | S | * | * | -158.7 | 130.6 | 85.9 | 159.7 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 6 | A | 51.9 | Low | 44.6 | Very low | 85 Ų | 85 | 148.6 Ų | 148.6 | 70% | 0.702 | 78% | 0.778 | S | S | * | * | trans | -73.4 | 143 | 162.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 7 | N | 38 | Very low | 44.7 | Very low | 143 Ų | 143 | 145.2 Ų | 145.2 | 77% | 0.765 | 78% | 0.777 | S | S | * | * | trans | -124.3 | 89.6 | 161.8 | -95.2 | -17.7 | 0 | 0 | 0 | 109.7 | ||||
| 8 | S | 47.1 | Very low | 44.6 | Very low | 114 Ų | 114 | 143.8 Ų | 143.8 | 80% | 0.797 | 78% | 0.78 | S | S | * | * | trans | -98.5 | 108.8 | 149.8 | -172.1 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 9 | I | 45.6 | Very low | 44.2 | Very low | 144 Ų | 144 | 141.8 Ų | 141.8 | 74% | 0.738 | 78% | 0.778 | S | S | * | * | trans | -130.9 | 98.8 | 167.6 | -65.8 | -178.3 | 0 | 0 | 0 | 108 | ||||
| 10 | F | 47.2 | Very low | 44 | Very low | 155 Ų | 155 | 141.4 Ų | 141.4 | 68% | 0.68 | 78% | 0.784 | S | S | * | * | trans | -10.4 | 134.6 | 142.5 | -109.3 | -107.5 | 0 | 0 | 0 | 115.4 | Q12 | F10-Q12 HydrophobicContact CE1-CG 4.33Š| ||
| 11 | K | 48.3 | Very low | 43.9 | Very low | 187 Ų | 187 | 139.8 Ų | 139.8 | 81% | 0.813 | 78% | 0.783 | S | S | * | * | -158.1 | 105.7 | 120.9 | -107.8 | 173.1 | -173.6 | -172.4 | 0 | 110.5 | |||||
| 12 | Q | 47.3 | Very low | 44.2 | Very low | 153 Ų | 153 | 132.7 Ų | 132.7 | 72% | 0.715 | 76% | 0.762 | S | S | * | * | trans | -53.6 | 136.8 | 146.9 | -71.9 | 172 | 5.1 | 0 | 0 | 108.3 | F10 | F10-Q12 HydrophobicContact CE1-CG 4.33Š| ||
| 13 | Q | 37.9 | Very low | 44.9 | Very low | 145 Ų | 145 | 136.3 Ų | 136.3 | 68% | 0.678 | 77% | 0.77 | S | S | * | * | trans | -137.9 | 95.7 | 160.9 | -166.3 | 109.6 | 32.3 | 0 | 0 | 107.7 | H15 | Q13-H15 PolarHBondContact NE2-NE2 3.1Š| ||
| 14 | T | 43.4 | Very low | 45.1 | Very low | 115 Ų | 115 | 138.9 Ų | 138.9 | 71% | 0.706 | 78% | 0.776 | S | S | * | * | trans | -67 | 129.1 | 159 | 45.6 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 15 | H | 45.7 | Very low | 44.9 | Very low | 161 Ų | 161 | 134 Ų | 134 | 75% | 0.745 | 77% | 0.774 | S | S | * | * | trans | -125.4 | 112 | 153.2 | -84.1 | -80.4 | 0 | 0 | 0 | 109.4 | Q13 | Q13-H15 PolarHBondContact NE2-NE2 3.1Š| ||
| 16 | E | 38.4 | Very low | 44.5 | Very low | 174 Ų | 174 | 136.3 Ų | 136.3 | 81% | 0.813 | 78% | 0.781 | S | S | * | * | trans | -46.9 | 155.4 | 165.7 | -70.4 | -75.4 | 148.1 | 0 | 0 | 113.1 | ||||
| 17 | A | 45.5 | Very low | 43.8 | Very low | 91 Ų | 91 | 135.8 Ų | 135.8 | 75% | 0.752 | 78% | 0.784 | S | S | * | * | trans | -53.7 | 143.4 | 171.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 18 | S | 43.3 | Very low | 44.2 | Very low | 120 Ų | 120 | 134.7 Ų | 134.7 | 84% | 0.839 | 79% | 0.787 | S | S | * | * | trans | -150.7 | 109.9 | 158.7 | -90.7 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 19 | S | 36.3 | Very low | 44 | Very low | 106 Ų | 106 | 140.3 Ų | 140.3 | 74% | 0.741 | 79% | 0.793 | S | S | * | * | trans | 53.7 | 91.9 | 134.2 | -139.1 | 0 | 0 | 0 | 0 | 117.9 | S21 | S19-S21 PolarHBondContact O-N 3.25Š| ||
| 20 | C | 41.5 | Very low | 43.6 | Very low | 133 Ų | 133 | 136.4 Ų | 136.4 | 90% | 0.899 | 79% | 0.788 | S | S | * | * | trans | -73.8 | 102.5 | 154.7 | 52.4 | 0 | 0 | 0 | 0 | 108.8 | A22 | C20-A22 PolarHBondContact O-N 3.41Š| ||
| 21 | S | 41.8 | Very low | 43.4 | Very low | 108 Ų | 108 | 134.6 Ų | 134.6 | 76% | 0.755 | 80% | 0.795 | S | S | * | * | trans | -58 | 127.1 | 173.3 | -65.7 | 0 | 0 | 0 | 0 | 111.7 | S19 | S19-S21 PolarHBondContact O-N 3.25Š| ||
| 22 | A | 45.8 | Very low | 42.8 | Very low | 92 Ų | 92 | 134 Ų | 134 | 76% | 0.76 | 80% | 0.8 | S | S | * | * | trans | -73.3 | 133.9 | 163.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | C20 | C20-A22 PolarHBondContact O-N 3.41Š| ||
| 23 | M | 55.3 | Low | 42.5 | Very low | 181 Ų | 181 | 131.4 Ų | 131.4 | 89% | 0.892 | 80% | 0.798 | S | S | * | * | trans | -139.6 | 112.4 | 154.7 | -71.9 | -162.2 | 74.7 | 0 | 0 | 109.2 | ||||
| 24 | N | 46.4 | Very low | 42.6 | Very low | 159 Ų | 159 | 131.6 Ų | 131.6 | 85% | 0.85 | 80% | 0.804 | S | S | * | * | trans | -76.8 | 141.5 | 161.9 | -67.7 | -36.2 | 0 | 0 | 0 | 108.7 | ||||
| 25 | S | 41 | Very low | 42.2 | Very low | 120 Ų | 120 | 134.9 Ų | 134.9 | 84% | 0.839 | 81% | 0.808 | S | S | * | * | trans | -157.1 | 127.3 | 144.1 | -169.2 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 26 | L | 47.1 | Very low | 41.7 | Very low | 177 Ų | 177 | 134.2 Ų | 134.2 | 93% | 0.927 | 81% | 0.81 | S | S | * | * | trans | -58.6 | 143.4 | 169.5 | -75.1 | 139.2 | 0 | 0 | 0 | 110.8 | ||||
| 27 | G | 36.6 | Very low | 41.7 | Very low | 73 Ų | 73 | 134.8 Ų | 134.8 | 75% | 0.753 | 81% | 0.813 | S | S | * | * | trans | -155.5 | 79.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 28 | S | 46.8 | Very low | 41.5 | Very low | 120 Ų | 120 | 133.7 Ų | 133.7 | 84% | 0.839 | 80% | 0.804 | S | S | * | * | trans | -71.9 | 116.4 | 163.3 | -172 | 0 | 0 | 0 | 0 | 108 | ||||
| 29 | Y | 42.2 | Very low | 41.4 | Very low | 232 Ų | 232 | 135.8 Ų | 135.8 | 91% | 0.91 | 81% | 0.806 | S | S | * | * | trans | -130.3 | 117.2 | 163 | -116.5 | -92.2 | 0 | 0 | 0 | 108 | ||||
| 30 | G | 37.9 | Very low | 41.6 | Very low | 62 Ų | 62 | 141.1 Ų | 141.1 | 64% | 0.639 | 81% | 0.811 | S | S | * | * | trans | -82.2 | 165.7 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 31 | S | 43.5 | Very low | 41.5 | Very low | 118 Ų | 118 | 138.8 Ų | 138.8 | 83% | 0.825 | 80% | 0.802 | S | S | * | * | trans | 52.9 | 101.3 | 137.9 | -161.9 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 32 | L | 34.5 | Very low | 41.4 | Very low | 175 Ų | 175 | 144 Ų | 144 | 92% | 0.916 | 81% | 0.806 | S | S | * | * | trans | -124.7 | 117.7 | 148.6 | -94.4 | 164.9 | 0 | 0 | 0 | 109.3 | ||||
| 33 | S | 41.7 | Very low | 41.5 | Very low | 97 Ų | 97 | 147.1 Ų | 147.1 | 68% | 0.678 | 81% | 0.81 | S | S | * | * | trans | -69.4 | 139.6 | 167.7 | 44.9 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 34 | D | 39 | Very low | 40.8 | Very low | 150 Ų | 150 | 141.5 Ų | 141.5 | 80% | 0.802 | 80% | 0.799 | S | S | * | * | trans | 49.3 | 147.4 | 138.6 | -91.9 | -24.2 | 0 | 0 | 0 | 123.9 | ||||
| 35 | F | 35.4 | Very low | 40.3 | Very low | 183 Ų | 183 | 138 Ų | 138 | 80% | 0.803 | 80% | 0.799 | S | S | * | * | trans | 82.4 | 117.5 | 177.1 | -69.4 | -90.5 | 0 | 0 | 0 | 115.6 | ||||
| 36 | D | 35.4 | Very low | 40.1 | Very low | 147 Ų | 147 | 140 Ų | 140 | 79% | 0.786 | 80% | 0.8 | S | S | * | * | cis | -145.5 | 124.3 | 18 | -97.6 | -49.8 | 0 | 0 | 0 | 111.1 | ||||
| 37 | Q | 39.6 | Very low | 40.3 | Very low | 187 Ų | 187 | 143 Ų | 143 | 87% | 0.874 | 80% | 0.799 | S | S | * | * | trans | -88.4 | 134 | 167.9 | -174.2 | 82.4 | 19.2 | 0 | 0 | 109.1 | ||||
| 38 | A | 39.9 | Very low | 40.7 | Very low | 68 Ų | 68 | 146.3 Ų | 146.3 | 56% | 0.562 | 80% | 0.8 | S | S | * | * | trans | -44.2 | 132.7 | 179.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | Y40 | A38-Y40 HydrophobicContact CB-CD2 4.17Å; A38-Y40 HydrophobicContact CB-CE2 4.4Å; A38-Y40 PolarHBondContact O-N 3.03Å; A38-Y40 VanDerWaalsContact O-N 3.16Å | ||
| 39 | N | 42 | Very low | 40.2 | Very low | 163 Ų | 163 | 150 Ų | 150 | 87% | 0.872 | 80% | 0.801 | S | S | * | * | trans | -65.9 | 99.1 | 157.6 | -95.2 | -57.1 | 0 | 0 | 0 | 110.2 | ||||
| 40 | Y | 39.7 | Very low | 39.9 | Very low | 219 Ų | 219 | 145.7 Ų | 145.7 | 86% | 0.859 | 79% | 0.794 | S | S | * | * | trans | -116.5 | 91.1 | 152.5 | -81.9 | -78 | 0 | 0 | 0 | 108.1 | A38 Y42 | A38-Y40 HydrophobicContact CB-CD2 4.17Å; A38-Y40 HydrophobicContact CB-CE2 4.4Å; A38-Y40 PolarHBondContact O-N 3.03Å; A38-Y40 VanDerWaalsContact O-N 3.16Å; Y40-Y42 PolarHBondContact O-N 3.3Å; Y40-Y42 VanDerWaalsContact O-N 3.16Å | ||
| 41 | A | 41 | Very low | 39.9 | Very low | 84 Ų | 84 | 146 Ų | 146 | 69% | 0.694 | 80% | 0.797 | S | S | * | * | trans | -70.7 | 102.5 | 171.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 42 | Y | 39.7 | Very low | 39.5 | Very low | 218 Ų | 218 | 147.8 Ų | 147.8 | 86% | 0.855 | 80% | 0.803 | S | S | * | * | trans | -92.5 | 99 | 158.2 | -158.8 | -92.2 | 0 | 0 | 0 | 106.9 | Y40 | Y40-Y42 PolarHBondContact O-N 3.3Å; Y40-Y42 VanDerWaalsContact O-N 3.16Å | ||
| 43 | N | 47.2 | Very low | 39.9 | Very low | 157 Ų | 157 | 148.3 Ų | 148.3 | 84% | 0.84 | 80% | 0.798 | S | S | * | * | trans | -86.2 | 116.1 | 169.7 | -81.4 | -61.7 | 0 | 0 | 0 | 108.7 | ||||
| 44 | G | 40.2 | Very low | 39.5 | Very low | 63 Ų | 63 | 149.6 Ų | 149.6 | 65% | 0.649 | 80% | 0.802 | S | S | * | * | trans | -179 | 82.9 | 173.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 45 | G | 35.3 | Very low | 39.3 | Very low | 84 Ų | 84 | 147.9 Ų | 147.9 | 87% | 0.866 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 142.5 | -165.4 | 0 | 0 | 0 | 0 | 0 | 116 | ||
| 46 | L | 38.3 | Very low | 40.1 | Very low | 162 Ų | 162 | 144.3 Ų | 144.3 | 85% | 0.848 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -101 | 122.7 | 162.1 | -165.1 | 71.3 | 0 | 0 | 0 | 107.1 | ||
| 47 | R | 49.7 | Very low | 40 | Very low | 240 Ų | 240 | 144.9 Ų | 144.9 | 91% | 0.906 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -99 | 135.9 | 161.7 | -69.8 | -164.3 | -174.7 | -110 | 4 | 108.2 | ||
| 48 | D | 46.9 | Very low | 39.9 | Very low | 144 Ų | 144 | 140.1 Ų | 140.1 | 77% | 0.77 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 145.8 | -173.9 | -44.8 | -71.4 | 0 | 0 | 0 | 113.4 | ||
| 49 | F | 35.2 | Very low | 40.3 | Very low | 198 Ų | 198 | 142.5 Ų | 142.5 | 87% | 0.868 | 80% | 0.803 | S | S | * | * | -171 | 132.6 | 125.2 | -138.6 | -112 | 0 | 0 | 0 | 113.5 | |||||
| 50 | N | 35 | Very low | 40.3 | Very low | 141 Ų | 141 | 141.6 Ų | 141.6 | 75% | 0.754 | 80% | 0.803 | S | S | * | * | trans | -0.5 | 140.1 | 160.9 | -84.6 | -14.7 | 0 | 0 | 0 | 121.9 | ||||
| 51 | G | 38.8 | Very low | 40.4 | Very low | 69 Ų | 69 | 138.8 Ų | 138.8 | 71% | 0.711 | 80% | 0.803 | S | S | * | * | trans | -83.3 | 178.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 52 | T | 34.3 | Very low | 40.1 | Very low | 154 Ų | 154 | 140.3 Ų | 140.3 | 95% | 0.945 | 81% | 0.808 | S | S | * | * | trans | -165.2 | 149.9 | 150.4 | -7.9 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 53 | F | 43.4 | Very low | 40.4 | Very low | 186 Ų | 186 | 137.5 Ų | 137.5 | 82% | 0.816 | 81% | 0.807 | S | S | * | * | trans | -82 | -178.6 | -174.1 | -171.3 | -105 | 0 | 0 | 0 | 112.4 | ||||
| 54 | T | 34.5 | Very low | 40.1 | Very low | 124 Ų | 124 | 139.4 Ų | 139.4 | 76% | 0.761 | 81% | 0.808 | S | S | * | * | trans | 85.7 | 144.4 | 169.6 | 79.5 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 55 | S | 33.7 | Very low | 40.2 | Very low | 115 Ų | 115 | 147.1 Ų | 147.1 | 80% | 0.804 | 82% | 0.818 | S | S | * | * | cis | -166.8 | 158.1 | -5.2 | 177.6 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 56 | S | 51.6 | Low | 40.7 | Very low | 108 Ų | 108 | 150.6 Ų | 150.6 | 76% | 0.755 | 81% | 0.811 | S | S | * | * | trans | -69.1 | 158.5 | 168.7 | -52.7 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 57 | D | 33.9 | Very low | 41.1 | Very low | 159 Ų | 159 | 151.5 Ų | 151.5 | 85% | 0.85 | 81% | 0.811 | S | S | * | * | trans | 115.3 | 152.1 | 131.8 | -133 | -6.7 | 0 | 0 | 0 | 119.9 | ||||
| 58 | A | 37.7 | Very low | 41.3 | Very low | 86 Ų | 86 | 148.3 Ų | 148.3 | 71% | 0.711 | 81% | 0.809 | S | S | * | * | trans | 104.6 | 86.7 | 166.2 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 59 | T | 47.7 | Very low | 41.2 | Very low | 118 Ų | 118 | 149.2 Ų | 149.2 | 72% | 0.724 | 81% | 0.813 | S | S | * | * | 23.9 | 129.1 | 118 | -35.1 | 0 | 0 | 0 | 0 | 120.6 | |||||
| 60 | V | 43.1 | Very low | 41.7 | Very low | 145 Ų | 145 | 145.6 Ų | 145.6 | 88% | 0.879 | 81% | 0.813 | S | S | * | * | -167.8 | 132.3 | 119.3 | -93.5 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 61 | N | 42.2 | Very low | 42.1 | Very low | 159 Ų | 159 | 143.9 Ų | 143.9 | 85% | 0.85 | 81% | 0.812 | S | S | * | * | trans | -72.4 | 145.8 | 167.6 | -67.2 | -54.2 | 0 | 0 | 0 | 111.4 | ||||
| 62 | S | 33.3 | Very low | 42.3 | Very low | 116 Ų | 116 | 148 Ų | 148 | 81% | 0.811 | 82% | 0.817 | S | S | * | * | trans | -168.5 | 117.9 | 139.5 | -151.8 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 63 | L | 45.7 | Very low | 42.5 | Very low | 160 Ų | 160 | 152.9 Ų | 152.9 | 84% | 0.838 | 82% | 0.818 | S | S | * | * | trans | -7.5 | 131.2 | 149.2 | -70.1 | 146.1 | 0 | 0 | 0 | 121.3 | ||||
| 64 | K | 42.5 | Very low | 42.1 | Very low | 196 Ų | 196 | 147.6 Ų | 147.6 | 85% | 0.852 | 82% | 0.816 | S | S | * | * | 167.1 | 113.5 | 123.1 | -101.6 | 174.7 | 172.3 | 175 | 0 | 109.2 | |||||
| 65 | R | 40.8 | Very low | 42.4 | Very low | 225 Ų | 225 | 151.3 Ų | 151.3 | 85% | 0.849 | 82% | 0.821 | S | S | * | * | 54.4 | 113.9 | 88.9 | -148.1 | -171.2 | -158.4 | -172.7 | 5.8 | 112.4 | |||||
| 66 | E | 45.5 | Very low | 42.7 | Very low | 158 Ų | 158 | 152.5 Ų | 152.5 | 74% | 0.738 | 82% | 0.824 | S | S | * | * | 179.5 | 128.3 | 114 | -75.6 | -114.3 | 139.8 | 0 | 0 | 109.7 | |||||
| 67 | E | 48.2 | Very low | 41.9 | Very low | 181 Ų | 181 | 154.3 Ų | 154.3 | 85% | 0.846 | 83% | 0.825 | S | S | * | * | trans | -76.1 | 141.4 | 166 | -64.5 | 175.8 | 147.6 | 0 | 0 | 108.9 | ||||
| 68 | M | 53.2 | Low | 42.2 | Very low | 173 Ų | 173 | 151.8 Ų | 151.8 | 85% | 0.852 | 82% | 0.816 | S | S | * | * | trans | -137.6 | 110.8 | 152.8 | -78.7 | -166.6 | -158.9 | 0 | 0 | 110.2 | ||||
| 69 | N | 45.5 | Very low | 42.1 | Very low | 162 Ų | 162 | 156.3 Ų | 156.3 | 87% | 0.866 | 82% | 0.822 | S | S | * | * | trans | -68.6 | 135 | 157.8 | -72.4 | -35.8 | 0 | 0 | 0 | 109.5 | ||||
| 70 | S | 46.2 | Very low | 41.6 | Very low | 123 Ų | 123 | 156 Ų | 156 | 86% | 0.86 | 83% | 0.825 | S | S | * | * | trans | -140.7 | 119.4 | 149.7 | 62.6 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 71 | S | 42.7 | Very low | 41.7 | Very low | 104 Ų | 104 | 155 Ų | 155 | 73% | 0.727 | 82% | 0.821 | S | S | * | * | trans | -94.3 | 156.5 | 174 | -173.8 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 72 | L | 43.3 | Very low | 41.4 | Very low | 157 Ų | 157 | 154.2 Ų | 154.2 | 82% | 0.822 | 82% | 0.822 | S | S | * | * | trans | 115.5 | 128.6 | 150.5 | -58 | 175.9 | 0 | 0 | 0 | 118.6 | ||||
| 73 | R | 38.4 | Very low | 41.6 | Very low | 255 Ų | 255 | 157.6 Ų | 157.6 | 96% | 0.962 | 82% | 0.818 | S | S | * | * | trans | 90.5 | 131 | 164.1 | -69.9 | -176.8 | 176 | -111.3 | -0.5 | 116.1 | ||||
| 74 | G | 34.8 | Very low | 41.4 | Very low | 75 Ų | 75 | 155.9 Ų | 155.9 | 77% | 0.773 | 82% | 0.816 | S | S | * | * | cis | -165 | 159.3 | 9.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 75 | K | 40.5 | Very low | 41 | Very low | 202 Ų | 202 | 153.3 Ų | 153.3 | 88% | 0.878 | 81% | 0.807 | S | S | * | * | trans | -69.1 | 142.1 | 175.8 | -60.2 | 173.8 | 172.1 | -178.2 | 0 | 110.8 | ||||
| 76 | T | 41 | Very low | 40.8 | Very low | 141 Ų | 141 | 147.7 Ų | 147.7 | 87% | 0.865 | 80% | 0.802 | S | S | * | * | trans | -154.5 | 150.4 | 133.9 | 45.8 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 77 | D | 34.5 | Very low | 40.4 | Very low | 145 Ų | 145 | 151.1 Ų | 151.1 | 78% | 0.775 | 81% | 0.81 | S | S | * | * | trans | -66.8 | 149.6 | -162.5 | -71.3 | -70.7 | 0 | 0 | 0 | 118.8 | ||||
| 78 | T | 40.5 | Very low | 39.9 | Very low | 106 Ų | 106 | 148 Ų | 148 | 65% | 0.65 | 81% | 0.808 | S | S | * | * | 52.3 | 129.2 | 119.7 | -50.3 | 0 | 0 | 0 | 0 | 121.6 | |||||
| 79 | Q | 35.4 | Very low | 39.3 | Very low | 182 Ų | 182 | 143.7 Ų | 143.7 | 85% | 0.85 | 80% | 0.8 | S | S | * | * | trans | 93.4 | 120.2 | 151 | -86.4 | 165.7 | 51.9 | 0 | 0 | 120.8 | ||||
| 80 | S | 37.3 | Very low | 38.9 | Very low | 111 Ų | 111 | 144.4 Ų | 144.4 | 78% | 0.776 | 80% | 0.803 | S | S | * | * | trans | -87.7 | -176.7 | 161 | -41.5 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 81 | P | 44.8 | Very low | 38.5 | Very low | 124 Ų | 124 | 143.6 Ų | 143.6 | 81% | 0.805 | 80% | 0.797 | S | S | * | * | -109.2 | 152.4 | -86.5 | 35.2 | -20.1 | 0 | 0 | 0 | 112.6 | |||||
| 82 | T | 36.4 | Very low | 38.2 | Very low | 142 Ų | 142 | 144.9 Ų | 144.9 | 87% | 0.871 | 81% | 0.806 | S | S | * | * | trans | -119.6 | 119.6 | 175.2 | -47.6 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 83 | R | 37.5 | Very low | 38 | Very low | 188 Ų | 188 | 148.2 Ų | 148.2 | 71% | 0.709 | 81% | 0.808 | S | S | * | * | trans | -59.6 | 146.5 | 168.5 | 173.6 | -172.3 | -174.8 | -162.6 | 2.7 | 112.3 | ||||
| 84 | P | 41 | Very low | 37.9 | Very low | 123 Ų | 123 | 143 Ų | 143 | 80% | 0.799 | 80% | 0.799 | S | S | * | * | trans | -109.5 | 124.1 | 156.8 | 6.3 | 14.4 | 0 | 0 | 0 | 112.7 | ||||
| 85 | Q | 34.2 | Very low | 38 | Very low | 143 Ų | 143 | 144.4 Ų | 144.4 | 67% | 0.668 | 80% | 0.797 | S | S | * | * | trans | -103.9 | 154.5 | 142 | -73.2 | -166.3 | -34.8 | 0 | 0 | 105.3 | ||||
| 86 | S | 35.2 | Very low | 37.9 | Very low | 106 Ų | 106 | 141.3 Ų | 141.3 | 74% | 0.741 | 80% | 0.795 | S | S | * | * | cis | -179.9 | 146.2 | -2.8 | 40.2 | 0 | 0 | 0 | 0 | 105.2 | ||||
| 87 | Y | 38.4 | Very low | 37.8 | Very low | 230 Ų | 230 | 143 Ų | 143 | 90% | 0.902 | 79% | 0.793 | S | S | * | * | trans | -130.5 | 121.5 | 152.7 | 53.1 | -97.6 | 0 | 0 | 0 | 110.1 | ||||
| 88 | S | 37.2 | Very low | 37.7 | Very low | 115 Ų | 115 | 144.4 Ų | 144.4 | 80% | 0.804 | 80% | 0.8 | S | S | * | * | trans | -61 | 162.3 | 161.8 | 40.2 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 89 | A | 39.8 | Very low | 37.6 | Very low | 84 Ų | 84 | 144.3 Ų | 144.3 | 69% | 0.694 | 80% | 0.803 | S | S | * | * | cis | -161.3 | 157.8 | -3.6 | 0 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 90 | L | 38.5 | Very low | 37.9 | Very low | 176 Ų | 176 | 144 Ų | 144 | 92% | 0.921 | 81% | 0.806 | S | S | * | * | -168.6 | 136.8 | 94.5 | -98.9 | 128.9 | 0 | 0 | 0 | 112.4 | |||||
| 91 | S | 38 | Very low | 38 | Very low | 107 Ų | 107 | 144.6 Ų | 144.6 | 75% | 0.748 | 81% | 0.81 | S | S | * | * | trans | -28.5 | 141.6 | 172.3 | -53.4 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 92 | S | 34.9 | Very low | 37.7 | Very low | 131 Ų | 131 | 146.7 Ų | 146.7 | 92% | 0.916 | 82% | 0.815 | S | S | * | * | -155.8 | 146.2 | 121.2 | -93.6 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 93 | R | 39.7 | Very low | 37.6 | Very low | 226 Ų | 226 | 143.3 Ų | 143.3 | 85% | 0.853 | 81% | 0.808 | S | S | * | * | trans | -81.9 | 150.8 | -155.6 | -73.5 | 167.1 | 157 | -156.3 | -3.7 | 115.9 | ||||
| 94 | N | 35.9 | Very low | 37.6 | Very low | 147 Ų | 147 | 142.6 Ų | 142.6 | 79% | 0.786 | 82% | 0.816 | S | S | * | * | 170.4 | 99.3 | 113.5 | -83.5 | -31.7 | 0 | 0 | 0 | 108.8 | |||||
| 95 | S | 37.9 | Very low | 37.4 | Very low | 103 Ų | 103 | 144.4 Ų | 144.4 | 72% | 0.72 | 82% | 0.818 | S | S | * | * | 50.6 | 110.2 | 100.6 | -158.1 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 96 | V | 37.9 | Very low | 37.4 | Very low | 137 Ų | 137 | 143.2 Ų | 143.2 | 83% | 0.83 | 83% | 0.826 | S | S | * | * | -159.3 | 127.4 | 61.5 | -136.2 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 97 | Q | 38.5 | Very low | 37.5 | Very low | 178 Ų | 178 | 147.1 Ų | 147.1 | 83% | 0.832 | 83% | 0.83 | S | S | * | * | trans | -134.1 | 133.1 | 152.9 | -98.4 | -171.3 | -23.7 | 0 | 0 | 106 | ||||
| 98 | N | 33.3 | Very low | 37.3 | Very low | 173 Ų | 173 | 140 Ų | 140 | 93% | 0.925 | 83% | 0.825 | S | S | * | * | trans | -134.7 | 117.2 | 152.9 | -104.8 | -6.2 | 0 | 0 | 0 | 108.4 | ||||
| 99 | C | 37.5 | Very low | 37.1 | Very low | 104 Ų | 104 | 141.8 Ų | 141.8 | 70% | 0.703 | 83% | 0.826 | S | S | * | * | trans | -100 | 136.2 | 165.2 | 40 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 100 | L | 41.5 | Very low | 36.8 | Very low | 177 Ų | 177 | 145.8 Ų | 145.8 | 93% | 0.927 | 83% | 0.83 | S | S | * | * | trans | 29.6 | 124.9 | 149.3 | -60.8 | 165.2 | 0 | 0 | 0 | 119.9 | ||||
| 101 | S | 38.9 | Very low | 36.7 | Very low | 123 Ų | 123 | 146.1 Ų | 146.1 | 86% | 0.86 | 83% | 0.83 | S | S | * | * | trans | -134.2 | 147.9 | 151 | 52.8 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 102 | D | 39.2 | Very low | 36.3 | Very low | 168 Ų | 168 | 148.8 Ų | 148.8 | 90% | 0.898 | 83% | 0.83 | S | S | * | * | trans | -72.9 | 153.8 | -164.8 | -72 | -56.6 | 0 | 0 | 0 | 117.6 | ||||
| 103 | G | 35.3 | Very low | 36.3 | Very low | 70 Ų | 70 | 150.6 Ų | 150.6 | 72% | 0.722 | 83% | 0.826 | S | S | * | * | trans | 85.9 | 121.6 | 133.3 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 104 | I | 35.8 | Very low | 35.8 | Very low | 174 Ų | 174 | 147.2 Ų | 147.2 | 89% | 0.892 | 82% | 0.82 | S | S | * | * | 175.5 | 136.1 | 108.3 | -74.2 | -147.5 | 0 | 0 | 0 | 110.2 | |||||
| 105 | L | 36.5 | Very low | 35.9 | Very low | 160 Ų | 160 | 146.5 Ų | 146.5 | 84% | 0.838 | 82% | 0.821 | S | S | * | * | trans | -50.8 | 139.7 | 175.7 | -162.1 | 83.2 | 0 | 0 | 0 | 115.6 | ||||
| 106 | S | 35.1 | Very low | 35.8 | Very low | 119 Ų | 119 | 147.9 Ų | 147.9 | 83% | 0.832 | 83% | 0.825 | S | S | * | * | trans | -164.6 | 147.6 | 134.1 | -143.6 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 107 | K | 37.8 | Very low | 35.7 | Very low | 188 Ų | 188 | 149.9 Ų | 149.9 | 82% | 0.817 | 83% | 0.825 | S | S | * | * | trans | -61.6 | 136.5 | -166.8 | -68.2 | 162.3 | 167.7 | 177.4 | 0 | 114.5 | ||||
| 108 | G | 33.4 | Very low | 35.4 | Very low | 79 Ų | 79 | 149 Ų | 149 | 81% | 0.814 | 83% | 0.826 | S | S | * | * | trans | -101.3 | 114 | 159.4 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 109 | N | 33.4 | Very low | 35.7 | Very low | 154 Ų | 154 | 146.3 Ų | 146.3 | 82% | 0.824 | 82% | 0.818 | S | S | * | * | trans | -69 | 139.7 | 177.7 | -75.7 | -12.2 | 0 | 0 | 0 | 111.7 | ||||
| 110 | E | 34.3 | Very low | 35.3 | Very low | 167 Ų | 167 | 152.3 Ų | 152.3 | 78% | 0.78 | 83% | 0.826 | S | S | * | * | trans | -60.9 | 136.8 | 159.9 | -66.1 | 171.9 | 123.2 | 0 | 0 | 111 | ||||
| 111 | M | 36.2 | Very low | 34.7 | Very low | 184 Ų | 184 | 149.6 Ų | 149.6 | 91% | 0.906 | 82% | 0.817 | S | S | * | * | trans | -141.5 | 113.4 | 137.5 | -79.1 | -165.7 | 75 | 0 | 0 | 108.3 | ||||
| 112 | Q | 29.4 | Very low | 34.2 | Very low | 163 Ų | 163 | 150.7 Ų | 150.7 | 76% | 0.762 | 82% | 0.819 | S | S | * | * | trans | -85.3 | 142.6 | 163.4 | -63.4 | 175.1 | 18.6 | 0 | 0 | 108.6 | ||||
| 113 | M | 34.2 | Very low | 33.7 | Very low | 168 Ų | 168 | 148.9 Ų | 148.9 | 83% | 0.828 | 81% | 0.814 | S | S | * | * | trans | 178.4 | 145.3 | 150.4 | -107.1 | -175.1 | 86.3 | 0 | 0 | 105.9 | ||||
| 114 | E | 29.6 | Very low | 33.5 | Very low | 155 Ų | 155 | 154.2 Ų | 154.2 | 72% | 0.724 | 82% | 0.82 | S | S | * | * | cis | -169 | 144.3 | -23.4 | -178.7 | 175.9 | -165.4 | 0 | 0 | 102.1 | ||||
| 115 | V | 38.1 | Very low | 33.4 | Very low | 132 Ų | 132 | 154.7 Ų | 154.7 | 80% | 0.8 | 82% | 0.818 | S | S | * | * | trans | -75.4 | 123.3 | 178 | 172.2 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 116 | V | 35.9 | Very low | 33.2 | Very low | 133 Ų | 133 | 152.8 Ų | 152.8 | 81% | 0.806 | 82% | 0.818 | S | S | * | * | trans | -144.6 | 131.7 | 153.3 | 177.1 | 0 | 0 | 0 | 0 | 111 | ||||
| 117 | E | 35.2 | Very low | 33.3 | Very low | 178 Ų | 178 | 151.3 Ų | 151.3 | 83% | 0.832 | 81% | 0.813 | S | S | * | * | trans | -62.9 | 157.5 | 177.2 | -71.5 | 173.8 | 127.4 | 0 | 0 | 114.5 | ||||
| 118 | N | 33.4 | Very low | 33.2 | Very low | 160 Ų | 160 | 149.8 Ų | 149.8 | 86% | 0.856 | 81% | 0.813 | S | S | * | * | trans | -96.6 | 130.9 | 174 | -166.4 | 57.1 | 0 | 0 | 0 | 110.4 | ||||
| 119 | P | 38.7 | Very low | 33.5 | Very low | 117 Ų | 117 | 154.7 Ų | 154.7 | 76% | 0.76 | 81% | 0.812 | S | S | * | * | trans | -120.1 | 159.3 | 157 | 34.2 | -21.2 | 0 | 0 | 0 | 114.4 | ||||
| 120 | R | 29.5 | Very low | 33.9 | Very low | 229 Ų | 229 | 153.9 Ų | 153.9 | 86% | 0.864 | 81% | 0.812 | S | S | * | * | trans | -50.9 | 143.6 | -176.5 | -99.9 | 175.8 | 173.5 | -179.2 | -3.4 | 117.5 | ||||
| 121 | T | 28 | Very low | 34.1 | Very low | 121 Ų | 121 | 153.4 Ų | 153.4 | 74% | 0.742 | 81% | 0.809 | S | S | * | * | trans | 12.6 | 122.7 | 132.4 | 61.1 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 122 | T | 28.3 | Very low | 34.5 | Very low | 146 Ų | 146 | 149.8 Ų | 149.8 | 90% | 0.896 | 80% | 0.798 | S | S | * | * | trans | -149.6 | 144.4 | 139.6 | 32.9 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 123 | T | 29.3 | Very low | 35.1 | Very low | 130 Ų | 130 | 149.9 Ų | 149.9 | 80% | 0.798 | 80% | 0.8 | S | S | * | * | trans | -56.3 | 150.9 | 179.5 | -50.1 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 124 | E | 31 | Very low | 35.8 | Very low | 181 Ų | 181 | 150 Ų | 150 | 85% | 0.846 | 80% | 0.799 | S | S | * | * | trans | 164.2 | 103.9 | 133.7 | -88.6 | 178.5 | -153.4 | 0 | 0 | 108.6 | ||||
| 125 | E | 33.1 | Very low | 36.4 | Very low | 184 Ų | 184 | 148.5 Ų | 148.5 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | 54.1 | 104.5 | 96 | -163.1 | 171.1 | -165.9 | 0 | 0 | 115.1 | |||||
| 126 | S | 34.1 | Very low | 36.6 | Very low | 120 Ų | 120 | 147.8 Ų | 147.8 | 84% | 0.839 | 80% | 0.798 | S | S | * | * | trans | -173 | 126.9 | 139.8 | -78.9 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 127 | A | 35.8 | Very low | 37.1 | Very low | 88 Ų | 88 | 151.1 Ų | 151.1 | 73% | 0.727 | 80% | 0.802 | S | S | * | * | trans | -64.1 | 158.8 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 128 | I | 37.4 | Very low | 37.5 | Very low | 157 Ų | 157 | 150.1 Ų | 150.1 | 81% | 0.805 | 80% | 0.797 | S | S | * | * | 171.7 | 134.6 | 119.8 | -84.2 | 154.2 | 0 | 0 | 0 | 112 | |||||
| 129 | K | 37.8 | Very low | 38.1 | Very low | 182 Ų | 182 | 151 Ų | 151 | 79% | 0.791 | 80% | 0.796 | S | S | * | * | trans | 64.2 | 107.9 | 156.1 | -93.3 | 178.4 | 166.6 | -172.9 | 0 | 121.8 | ||||
| 130 | V | 43.1 | Very low | 38.4 | Very low | 136 Ų | 136 | 152.4 Ų | 152.4 | 82% | 0.824 | 80% | 0.796 | S | S | * | * | trans | -59.5 | 121.1 | 146.5 | -179.1 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 131 | E | 37.8 | Very low | 39.3 | Very low | 157 Ų | 157 | 149.1 Ų | 149.1 | 73% | 0.734 | 79% | 0.79 | S | S | * | * | trans | -137 | 115 | 157.6 | -167.4 | 158.7 | -177.8 | 0 | 0 | 109.9 | M133 | E131-M133 PolarHBondContact O-N 2.64Š| ||
| 132 | T | 45.2 | Very low | 40.1 | Very low | 109 Ų | 109 | 149.1 Ų | 149.1 | 67% | 0.669 | 80% | 0.795 | S | S | * | * | trans | -60.7 | 117.7 | 177.9 | -60.9 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 133 | M | 41 | Very low | 41.1 | Very low | 164 Ų | 164 | 151 Ų | 151 | 81% | 0.808 | 79% | 0.791 | S | S | * | * | trans | -120.9 | 120.7 | 162.9 | -73.3 | -82.4 | 95.5 | 0 | 0 | 109.6 | E131 | E131-M133 PolarHBondContact O-N 2.64Š| ||
| 134 | Q | 49.6 | Very low | 41.6 | Very low | 170 Ų | 170 | 154.5 Ų | 154.5 | 79% | 0.794 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 143.6 | -177.6 | -55.6 | 178.1 | 30.6 | 0 | 0 | 110.7 | V136 | Q134-V136 PolarHBondContact O-N 2.8Š|
| 135 | P | 42.8 | Very low | 42.3 | Very low | 125 Ų | 125 | 154.6 Ų | 154.6 | 81% | 0.812 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -77.2 | 117.2 | 173.4 | 29.3 | -29.2 | 0 | 0 | 0 | 110.2 | K137 | P135-K137 PolarHBondContact O-N 3.02Š|
| 136 | V | 41.9 | Very low | 43 | Very low | 116 Ų | 116 | 154 Ų | 154 | 70% | 0.703 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 123.4 | 167.2 | 173.8 | 0 | 0 | 0 | 0 | 108.8 | Q134 H138 | Q134-V136 PolarHBondContact O-N 2.8Å; V136-H138 PolarHBondContact O-N 3.31Å |
| 137 | K | 46.1 | Very low | 43.6 | Very low | 204 Ų | 204 | 154.4 Ų | 154.4 | 89% | 0.887 | 79% | 0.785 | S | S | * | * | trans | -63.3 | 98.8 | 178.3 | -63.1 | 175.6 | -178 | 176.9 | 0 | 110.1 | P135 | P135-K137 PolarHBondContact O-N 3.02Š| ||
| 138 | H | 43.9 | Very low | 44.4 | Very low | 157 Ų | 157 | 155.7 Ų | 155.7 | 73% | 0.727 | 78% | 0.779 | S | S | * | * | trans | -87.5 | 109.3 | 158.7 | -73.8 | 88.9 | 0 | 0 | 0 | 108.2 | V136 I140 | V136-H138 PolarHBondContact O-N 3.31Å; H138-I140 VanDerWaalsContact C-N 3.27Å; H138-I140 PolarHBondContact O-N 3.21Å | ||
| 139 | Q | 46.2 | Very low | 45.6 | Very low | 178 Ų | 178 | 155.6 Ų | 155.6 | 83% | 0.832 | 78% | 0.775 | S | S | * | * | trans | -67.5 | 83.9 | 174.6 | -168.2 | 176.5 | 34.8 | 0 | 0 | 109.1 | H141 | Q139-H141 PolarHBondContact O-N 3.45Š| ||
| 140 | I | 45.6 | Very low | 46.8 | Very low | 146 Ų | 146 | 154.4 Ų | 154.4 | 75% | 0.749 | 77% | 0.773 | S | S | * | * | trans | -75 | 116.8 | 168.3 | -60.3 | -174.1 | 0 | 0 | 0 | 107 | H138 S142 | H138-I140 VanDerWaalsContact C-N 3.27Å; H138-I140 PolarHBondContact O-N 3.21Å; I140-S142 PolarHBondContact O-N 3.4Å; I140-S142 VanDerWaalsContact O-N 3.14Å | ||
| 141 | H | 46.5 | Very low | 47.6 | Very low | 161 Ų | 161 | 156 Ų | 156 | 75% | 0.745 | 77% | 0.771 | S | S | * | * | trans | -53.4 | 117.2 | 172.3 | -86.1 | 56 | 0 | 0 | 0 | 110.1 | Q139 K143 | Q139-H141 PolarHBondContact O-N 3.45Å; H141-K143 VanDerWaalsContact C-N 3.32Å; H141-K143 PolarHBondContact O-N 3.01Å | ||
| 142 | S | 46.1 | Very low | 49.4 | Very low | 121 Ų | 121 | 153.8 Ų | 153.8 | 85% | 0.846 | 77% | 0.77 | S | S | * | * | trans | -65.7 | 85.3 | 172.7 | -39.8 | 0 | 0 | 0 | 0 | 110.3 | I140 K144 | I140-S142 PolarHBondContact O-N 3.4Å; I140-S142 VanDerWaalsContact O-N 3.14Å; S142-K144 PolarHBondContact O-N 3.09Å | ||
| 143 | K | 48.7 | Very low | 51.1 | Low | 186 Ų | 186 | 156.2 Ų | 156.2 | 81% | 0.809 | 77% | 0.774 | S | S | * | * | trans | -74.3 | 111 | 157.7 | -82.8 | -173.6 | 177.4 | 176.1 | 0 | 107.3 | H141 H145 | H141-K143 VanDerWaalsContact C-N 3.32Å; H141-K143 PolarHBondContact O-N 3.01Å; K143-H145 PolarHBondContact O-N 3Å | ||
| 144 | K | 40.2 | Very low | 53.2 | Low | 202 Ų | 202 | 153.9 Ų | 153.9 | 88% | 0.878 | 76% | 0.763 | S | S | * | * | trans | -50.1 | 108.2 | 168.9 | -72.1 | 178.5 | 176.3 | 178.4 | 0 | 108.6 | S142 Q146 | S142-K144 PolarHBondContact O-N 3.09Å; K144-Q146 VanDerWaalsContact C-N 3.35Å; K144-Q146 PolarHBondContact O-N 2.79Å | ||
| 145 | H | 45.6 | Very low | 54.9 | Low | 184 Ų | 184 | 151.2 Ų | 151.2 | 85% | 0.852 | 75% | 0.75 | S | S | * | * | trans | -71.2 | 98.8 | 163.7 | -86.9 | -82.3 | 0 | 0 | 0 | 107 | K143 D147 | K143-H145 PolarHBondContact O-N 3Å; H145-D147 PolarHBondContact O-N 3.47Å | ||
| 146 | Q | 46.9 | Very low | 57 | Low | 171 Ų | 171 | 150.7 Ų | 150.7 | 80% | 0.799 | 75% | 0.746 | S | S | * | * | trans | -63.8 | 111.9 | 163.8 | -150.7 | 177.6 | 2 | 0 | 0 | 105.7 | K144 N148 | K144-Q146 VanDerWaalsContact C-N 3.35Å; K144-Q146 PolarHBondContact O-N 2.79Å; Q146-N148 PolarHBondContact O-N 3.38Å | ||
| 147 | D | 48.1 | Very low | 59.1 | Low | 129 Ų | 129 | 154.8 Ų | 154.8 | 69% | 0.69 | 75% | 0.749 | S | S | * | * | trans | -68.1 | 84.1 | -178.5 | -152.8 | -5.3 | 0 | 0 | 0 | 108.4 | H145 H149 | H145-D147 PolarHBondContact O-N 3.47Å; D147-H149 VanDerWaalsContact CG-CE1 3.5Å; D147-H149 PolarHBondContact O-N 2.86Å; D147-H149 IonicContact OD1-CE1 3.89Å; D147-H149 IonicContact OD1-ND1 2.94Å; D147-H149 IonicContact OD2-CE1 3Å; D147-H149 PolarHBondContact OD2-CE1 3.41Å | ||
| 148 | N | 51.3 | Low | 60.9 | Low | 114 Ų | 114 | 149 Ų | 149 | 61% | 0.61 | 73% | 0.726 | S | S | * | * | trans | -86.3 | 87.1 | -178.1 | -144.4 | -9.4 | 0 | 0 | 0 | 105.4 | Q146 Q150 | Q146-N148 PolarHBondContact O-N 3.38Å; N148-Q150 PolarHBondContact O-N 3.08Å | ||
| 149 | H | 63 | Low | 62.6 | Low | 155 Ų | 155 | 144.9 Ų | 144.9 | 72% | 0.718 | 71% | 0.712 | S | S | * | * | trans | -61.9 | 82.7 | 174.6 | -65.2 | -40.2 | 0 | 0 | 0 | 109.9 | D147 Q151 | D147-H149 VanDerWaalsContact CG-CE1 3.5Å; D147-H149 PolarHBondContact O-N 2.86Å; D147-H149 IonicContact OD1-CE1 3.89Å; D147-H149 IonicContact OD1-ND1 2.94Å; D147-H149 IonicContact OD2-CE1 3Å; D147-H149 PolarHBondContact OD2-CE1 3.41Å; H149-Q151 PolarHBondContact O-N 3.47Å; H149-Q151 VanDerWaalsContact O-N 3.15Å | ||
| 150 | Q | 63.1 | Low | 63.9 | Low | 158 Ų | 158 | 141.8 Ų | 141.8 | 74% | 0.738 | 70% | 0.696 | S | S | * | * | trans | -74.4 | 102.4 | 172.2 | -78.6 | 160.8 | 15.3 | 0 | 0 | 107.5 | N148 | N148-Q150 PolarHBondContact O-N 3.08Š| ||
| 151 | Q | 60.2 | Low | 64.8 | Low | 169 Ų | 169 | 142.2 Ų | 142.2 | 79% | 0.79 | 70% | 0.699 | S | S | * | * | trans | -54.4 | 134.5 | 170.4 | -68.8 | -170.9 | -1.1 | 0 | 0 | 108.9 | H149 Q153 | H149-Q151 PolarHBondContact O-N 3.47Å; H149-Q151 VanDerWaalsContact O-N 3.15Å; Q151-Q153 PolarHBondContact O-N 3.09Å | ||
| 152 | P | 74.6 | Confident | 65.3 | Low | 110 Ų | 110 | 140 Ų | 140 | 71% | 0.714 | 69% | 0.689 | S | S | * | * | trans | -58.8 | 130.7 | -178.4 | 23.3 | -32.4 | 0 | 0 | 0 | 109.9 | I154 | P152-I154 PolarHBondContact O-N 2.85Š| ||
| 153 | Q | 81.8 | Confident | 65.8 | Low | 160 Ų | 160 | 140.7 Ų | 140.7 | 75% | 0.748 | 68% | 0.68 | S | S | * | * | trans | -66.3 | 103.4 | 177.8 | -66.4 | -69.4 | -36.8 | 0 | 0 | 109.4 | Q151 F155 M158 | Q151-Q153 PolarHBondContact O-N 3.09Å; Q153-F155 PolarHBondContact O-N 3.37Å; Q153-M158 WeakPolarHBondContact O-CE 3.31Å | ||
| 154 | I | 84.6 | Confident | 66 | Low | 115 Ų | 115 | 139.6 Ų | 139.6 | 59% | 0.59 | 68% | 0.681 | S | S | * | * | trans | -85.2 | 104 | 176.6 | -55.7 | 177.5 | 0 | 0 | 0 | 108.9 | P152 M158 T159 | P152-I154 PolarHBondContact O-N 2.85Å; I154-M158 HydrophobicContact CG2-CB 4.04Å; I154-M158 HydrophobicContact CG2-CE 4.47Å; I154-T159 HydrophobicContact CG2-CG2 3.73Å | ||
| 155 | F | 86.4 | Confident | 66.7 | Low | 115 Ų | 115 | 136.9 Ų | 136.9 | 50% | 0.504 | 67% | 0.671 | S | S | . | * | trans | -64.8 | 147.4 | 173.9 | -60.9 | -68 | 0 | 0 | 0 | 111.9 | Q153 W157 M158 T159 | Q153-F155 PolarHBondContact O-N 3.37Å; F155-W157 VanDerWaalsContact CB-CD1 3.46Å; F155-W157 HydrophobicContact CB-CG 4.35Å; F155-W157 VanDerWaalsContact CB-NE1 3.25Å; F155-W157 HydrophobicContact CD2-CZ2 4.46Å; F155-W157 AromaticContact CD2-NE1 3.89Å; F155-W157 AromaticContact CG-NE1 3.75Å; F155-W157 PolarHBondContact O-N 3.3Å; F155-M158 HydrophobicContact CB-CE 3.99Å; F155-M158 HydrophobicContact CB-CG 4.49Å; F155-M158 HydrophobicContact CD2-CE 3.46Å; F155-M158 VanDerWaalsContact CD2-CE 3.46Å; F155-M158 HydrophobicContact CD2-SD 4.4Å; F155-M158 HydrophobicContact CE2-CE 4.32Å; F155-M158 HydrophobicContact CG-CE 4.11Å; F155-M158 WeakPolarHBondContact O-CA 3.37Å; F155-M158 WeakPolarHBondContact O-CB 3.37Å; F155-M158 PolarHBondContact O-N 2.99Å; F155-T159 PolarHBondContact O-N 3.19Å | ||
| 156 | P | 85.3 | Confident | 66.8 | Low | 113 Ų | 113 | 137.7 Ų | 137.7 | 73% | 0.734 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.8 | -18.9 | -178.3 | -27.9 | 35.4 | 0 | 0 | 0 | 116.1 | T159 | P156-T159 PolarHBondContact O-OG1 3.44Š|
| 157 | W | 86.8 | Confident | 67.1 | Low | 203 Ų | 203 | 132.5 Ų | 132.5 | 77% | 0.769 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.7 | -21.4 | 174.2 | 65.3 | -94.4 | 0 | 0 | 0 | 113 | F155 | F155-W157 VanDerWaalsContact CB-CD1 3.46Å; F155-W157 HydrophobicContact CB-CG 4.35Å; F155-W157 VanDerWaalsContact CB-NE1 3.25Å; F155-W157 HydrophobicContact CD2-CZ2 4.46Å; F155-W157 AromaticContact CD2-NE1 3.89Å; F155-W157 AromaticContact CG-NE1 3.75Å; F155-W157 PolarHBondContact O-N 3.3Å |
| 158 | M | 84.9 | Confident | 67.4 | Low | 82 Ų | 82 | 132 Ų | 132 | 40% | 0.404 | 67% | 0.665 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -83.1 | -16.8 | 176 | -65.1 | -166.1 | -60.1 | 0 | 0 | 112.1 | Q153 I154 F155 K160 | Q153-M158 WeakPolarHBondContact O-CE 3.31Å; I154-M158 HydrophobicContact CG2-CB 4.04Å; I154-M158 HydrophobicContact CG2-CE 4.47Å; F155-M158 HydrophobicContact CB-CE 3.99Å; F155-M158 HydrophobicContact CB-CG 4.49Å; F155-M158 HydrophobicContact CD2-CE 3.46Å; F155-M158 VanDerWaalsContact CD2-CE 3.46Å; F155-M158 HydrophobicContact CD2-SD 4.4Å; F155-M158 HydrophobicContact CE2-CE 4.32Å; F155-M158 HydrophobicContact CG-CE 4.11Å; F155-M158 WeakPolarHBondContact O-CA 3.37Å; F155-M158 WeakPolarHBondContact O-CB 3.37Å; F155-M158 PolarHBondContact O-N 2.99Å; M158-K160 PolarHBondContact O-N 3.48Å; M158-K160 VanDerWaalsContact O-N 3.13Å |
| 159 | T | 78.4 | Confident | 67.6 | Low | 71 Ų | 71 | 133.3 Ų | 133.3 | 44% | 0.436 | 67% | 0.672 | S | S | . | * | S | Bend | trans | -71.3 | 112.3 | 173 | 58.9 | 0 | 0 | 0 | 0 | 108.6 | I154 F155 P156 L161 | I154-T159 HydrophobicContact CG2-CG2 3.73Å; F155-T159 PolarHBondContact O-N 3.19Å; P156-T159 PolarHBondContact O-OG1 3.44Å; T159-L161 PolarHBondContact O-N 3.06Å |
| 160 | K | 73.7 | Confident | 67.5 | Low | 112 Ų | 112 | 128.1 Ų | 128.1 | 49% | 0.487 | 66% | 0.66 | S | S | . | * | trans | -65.9 | 105.3 | 177.9 | -167.9 | 176.9 | -174.2 | 177 | 0 | 107.6 | M158 H162 M163 | M158-K160 PolarHBondContact O-N 3.48Å; M158-K160 VanDerWaalsContact O-N 3.13Å; K160-H162 HydrophobicContact CG-CB 4.12Å; K160-H162 PolarHBondContact O-N 2.95Å; K160-M163 HydrophobicContact CB-CG 4.09Å; K160-M163 VanDerWaalsContact O-CG 3.23Å; K160-M163 WeakPolarHBondContact O-CG 3.45Å; K160-M163 PolarHBondContact O-N 2.67Å | ||
| 161 | L | 64.6 | Low | 67.7 | Low | 156 Ų | 156 | 128.4 Ų | 128.4 | 82% | 0.817 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.8 | 10.7 | 174.2 | -68.6 | 174.2 | 0 | 0 | 0 | 114.9 | T159 | T159-L161 PolarHBondContact O-N 3.06Š|
| 162 | H | 57.8 | Low | 68.5 | Low | 114 Ų | 114 | 130.6 Ų | 130.6 | 53% | 0.528 | 66% | 0.66 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -106 | 11.6 | 177 | -57.1 | 82.1 | 0 | 0 | 0 | 112.9 | K160 | K160-H162 HydrophobicContact CG-CB 4.12Å; K160-H162 PolarHBondContact O-N 2.95Å |
| 163 | M | 55.6 | Low | 69.1 | Low | 135 Ų | 135 | 130.4 Ų | 130.4 | 67% | 0.665 | 66% | 0.661 | S | S | * | * | trans | -92 | 7.3 | -176 | -56.7 | -83.2 | 63.6 | 0 | 0 | 114.7 | K160 | K160-M163 HydrophobicContact CB-CG 4.09Å; K160-M163 VanDerWaalsContact O-CG 3.23Å; K160-M163 WeakPolarHBondContact O-CG 3.45Å; K160-M163 PolarHBondContact O-N 2.67Å | ||
| 164 | I | 54.2 | Low | 69.5 | Low | 163 Ų | 163 | 134 Ų | 134 | 84% | 0.836 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -98.1 | 15 | -178 | -55.3 | 170.1 | 0 | 0 | 0 | 112.6 | ||
| 165 | H | 53.8 | Low | 69.9 | Low | 145 Ų | 145 | 134.2 Ų | 134.2 | 67% | 0.671 | 68% | 0.675 | S | S | * | * | trans | -128.6 | 93 | 164.1 | -139 | -84.8 | 0 | 0 | 0 | 108.9 | S167 | H165-S167 PolarHBondContact ND1-OG 3.41Å; H165-S167 PolarHBondContact O-N 2.82Å | ||
| 166 | E | 48.9 | Very low | 70.4 | Confident | 202 Ų | 202 | 133.9 Ų | 133.9 | 94% | 0.944 | 69% | 0.687 | S | S | * | * | trans | -70.7 | 68.9 | 177.1 | -161.7 | 179.8 | -168 | 0 | 0 | 109.9 | ||||
| 167 | S | 51.3 | Low | 71.1 | Confident | 62 Ų | 62 | 131.3 Ų | 131.3 | 43% | 0.434 | 66% | 0.663 | S | S | . | * | S | Bend | trans | -153.9 | 83.1 | 171 | 58.5 | 0 | 0 | 0 | 0 | 107.9 | H165 D169 | H165-S167 PolarHBondContact ND1-OG 3.41Å; H165-S167 PolarHBondContact O-N 2.82Å; S167-D169 VanDerWaalsContact C-N 3.26Å; S167-D169 PolarHBondContact O-N 3.26Å |
| 168 | S | 54.6 | Low | 71.6 | Confident | 118 Ų | 118 | 125.2 Ų | 125.2 | 83% | 0.825 | 65% | 0.648 | S | S | * | * | S | Bend | trans | 34.7 | -11.8 | 160 | 61.4 | 0 | 0 | 0 | 0 | 124.1 | ||
| 169 | D | 55.7 | Low | 72.3 | Confident | 141 Ų | 141 | 130.1 Ų | 130.1 | 75% | 0.754 | 66% | 0.662 | S | S | * | * | trans | -142.7 | 27.7 | -171.9 | -71.7 | -65.1 | 0 | 0 | 0 | 114 | S167 K171 | S167-D169 VanDerWaalsContact C-N 3.26Å; S167-D169 PolarHBondContact O-N 3.26Å; D169-K171 PolarHBondContact O-N 3.43Å | ||
| 170 | G | 61 | Low | 73.2 | Confident | 46 Ų | 46 | 132.7 Ų | 132.7 | 47% | 0.474 | 67% | 0.665 | S | S | . | * | trans | -69.3 | 20.3 | -167.8 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 171 | K | 67.4 | Low | 74.4 | Confident | 164 Ų | 164 | 128.6 Ų | 128.6 | 71% | 0.713 | 65% | 0.647 | S | S | * | * | S | Bend | trans | -88.5 | 106.1 | 165.2 | -70.8 | 171.9 | -176.1 | 169.2 | 0 | 107.2 | D169 S173 | D169-K171 PolarHBondContact O-N 3.43Å; K171-S173 PolarHBondContact O-N 3Å |
| 172 | R | 77.6 | Confident | 76 | Confident | 215 Ų | 215 | 123.2 Ų | 123.2 | 81% | 0.811 | 62% | 0.621 | S | S | * | * | trans | -53.8 | 103.8 | 172.3 | -168.3 | 177.4 | -165.8 | 156.6 | 9.7 | 108.9 | R174 | R172-R174 PolarHBondContact O-N 3.45Š| ||
| 173 | S | 85.9 | Confident | 78 | Confident | 107 Ų | 107 | 121.8 Ų | 121.8 | 75% | 0.748 | 62% | 0.617 | S | S | * | * | P | Polyproline II helix | trans | -62 | 134.2 | -177.9 | -175 | 0 | 0 | 0 | 0 | 109.4 | K171 | K171-S173 PolarHBondContact O-N 3Š|
| 174 | R | 90.6 | Very high | 80 | Confident | 236 Ų | 236 | 117.4 Ų | 117.4 | 89% | 0.891 | 59% | 0.594 | S | S | * | * | P | Polyproline II helix | trans | -84.8 | 116.2 | 179.1 | -61.8 | -179.5 | 108 | -138.9 | 7.4 | 108 | R172 | R172-R174 PolarHBondContact O-N 3.45Š|
| 175 | T | 94.3 | Very high | 82.1 | Confident | 118 Ų | 118 | 109.6 Ų | 109.6 | 72% | 0.724 | 56% | 0.555 | S | S | * | * | P | Polyproline II helix | trans | -74.2 | 129.3 | 170.3 | -45.2 | 0 | 0 | 0 | 0 | 109.8 | ||
| 176 | S | 96.6 | Very high | 84.3 | Confident | 108 Ų | 108 | 104.9 Ų | 104.9 | 76% | 0.755 | 53% | 0.533 | S | S | * | . | P | Polyproline II helix | trans | -82.5 | 143.4 | 170.7 | -173.4 | 0 | 0 | 0 | 0 | 110.5 | ||
| 177 | Y | 98.4 | Very high | 86.6 | Confident | 60 Ų | 60 | 100.3 Ų | 100.3 | 24% | 0.235 | 51% | 0.51 | C | S | . | . | P | Polyproline II helix | trans | -76.5 | 149.7 | 169.7 | -59.6 | -47.4 | 0 | 0 | 0 | 110.7 | L209 W217 | Y177-L209 HydrophobicContact CD1-CD1 4.1Å; Y177-L209 HydrophobicContact CD1-CD2 3.93Å; Y177-L209 HydrophobicContact CE1-CD1 3.99Å; Y177-L209 HydrophobicContact CE1-CD2 3.72Å; Y177-W217 AromaticContact CD2-CD1 3.92Å; Y177-W217 AromaticContact CE2-CD1 3.62Å |
| 178 | T | 98.7 | Very high | 88.9 | Confident | 74 Ų | 74 | 98.1 Ų | 98.1 | 45% | 0.454 | 49% | 0.493 | S | S | . | . | P | Polyproline II helix | trans | -69.6 | 165.2 | 173.2 | 73.4 | 0 | 0 | 0 | 0 | 110.5 | Y180 Q181 T182 | T178-Y180 VanDerWaalsContact C-N 3.32Å; T178-Y180 PolarHBondContact O-N 3.04Å; T178-Q181 PolarHBondContact O-N 2.99Å; T178-Q181 VanDerWaalsContact OG1-CG 3.31Å; T178-Q181 WeakPolarHBondContact OG1-CG 3.41Å; T178-Q181 PolarHBondContact OG1-N 2.79Å; T178-T182 PolarHBondContact O-N 3.08Å; T178-T182 VanDerWaalsContact O-N 3.09Å; T178-T182 PolarHBondContact O-OG1 3.49Å |
| 179 | R | 98.5 | Very high | 91 | Very high | 185 Ų | 185 | 92.5 Ų | 92.5 | 70% | 0.698 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -59.5 | -45.1 | 175.8 | -177.4 | 59 | 179.8 | -177 | 2 | 111.5 | T182 L183 | R179-T182 PolarHBondContact O-N 3.33Å; R179-L183 HydrophobicContact CG-CD1 4.12Å; R179-L183 WeakPolarHBondContact O-CG 3.39Å; R179-L183 PolarHBondContact O-N 3.16Å |
| 180 | Y | 98.6 | Very high | 93 | Very high | 125 Ų | 125 | 91.2 Ų | 91.2 | 49% | 0.49 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -58.4 | -49.8 | 177.6 | 173.4 | -107.4 | 0 | 0 | 0 | 112.1 | T178 T182 L183 E184 L207 | T178-Y180 VanDerWaalsContact C-N 3.32Å; T178-Y180 PolarHBondContact O-N 3.04Å; Y180-T182 VanDerWaalsContact C-N 3.29Å; Y180-T182 PolarHBondContact O-N 3.31Å; Y180-L183 PolarHBondContact O-N 2.69Å; Y180-E184 HydrophobicContact CD2-CG 4.17Å; Y180-E184 HydrophobicContact CE1-CG 4.29Å; Y180-E184 HydrophobicContact CE2-CG 3.67Å; Y180-E184 PolarHBondContact O-N 3Å; Y180-L207 HydrophobicContact CD1-CD2 4.15Å; Y180-L207 HydrophobicContact CE1-CD2 3.61Å |
| 181 | Q | 98.7 | Very high | 94.8 | Very high | 27 Ų | 27 | 97 Ų | 97 | 13% | 0.126 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -56.7 | -44.3 | 177.7 | -73.1 | 172.6 | -24.6 | 0 | 0 | 111.8 | T178 L185 L207 L209 | T178-Q181 PolarHBondContact O-N 2.99Å; T178-Q181 VanDerWaalsContact OG1-CG 3.31Å; T178-Q181 WeakPolarHBondContact OG1-CG 3.41Å; T178-Q181 PolarHBondContact OG1-N 2.79Å; Q181-L185 WeakPolarHBondContact O-CB 3.41Å; Q181-L185 WeakPolarHBondContact O-CD1 3.45Å; Q181-L185 WeakPolarHBondContact O-CG 3.36Å; Q181-L185 PolarHBondContact O-N 3.21Å; Q181-L207 HydrophobicContact CG-CB 4.27Å; Q181-L207 PolarHBondContact NE2-O 3.2Å; Q181-L209 HydrophobicContact CG-CD1 4.47Å |
| 182 | T | 98.6 | Very high | 96.3 | Very high | 43 Ų | 43 | 92.6 Ų | 92.6 | 26% | 0.264 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -64.2 | -43.2 | 179.8 | -55.6 | 0 | 0 | 0 | 0 | 111.7 | T178 R179 Y180 L185 E186 | T178-T182 PolarHBondContact O-N 3.08Å; T178-T182 VanDerWaalsContact O-N 3.09Å; T178-T182 PolarHBondContact O-OG1 3.49Å; R179-T182 PolarHBondContact O-N 3.33Å; Y180-T182 VanDerWaalsContact C-N 3.29Å; Y180-T182 PolarHBondContact O-N 3.31Å; T182-L185 PolarHBondContact O-N 2.85Å; T182-E186 WeakPolarHBondContact O-CG 3.35Å; T182-E186 PolarHBondContact O-N 3.42Å |
| 183 | L | 98.6 | Very high | 97.2 | Very high | 84 Ų | 84 | 86.5 Ų | 86.5 | 44% | 0.44 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -64.1 | -45.4 | 179.8 | -72.4 | 173.2 | 0 | 0 | 0 | 112 | R179 Y180 L185 E186 K187 | R179-L183 HydrophobicContact CG-CD1 4.12Å; R179-L183 WeakPolarHBondContact O-CG 3.39Å; R179-L183 PolarHBondContact O-N 3.16Å; Y180-L183 PolarHBondContact O-N 2.69Å; L183-L185 VanDerWaalsContact C-N 3.34Å; L183-L185 PolarHBondContact O-N 3.06Å; L183-E186 PolarHBondContact O-N 2.89Å; L183-K187 WeakPolarHBondContact O-CB 3.45Å; L183-K187 PolarHBondContact O-N 2.76Å |
| 184 | E | 98.6 | Very high | 97.8 | Very high | 42 Ų | 42 | 88.5 Ų | 88.5 | 20% | 0.196 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -64.4 | -39.4 | 178.4 | -74 | -63.9 | 115 | 0 | 0 | 112.1 | Y180 K187 E188 L207 | Y180-E184 HydrophobicContact CD2-CG 4.17Å; Y180-E184 HydrophobicContact CE1-CG 4.29Å; Y180-E184 HydrophobicContact CE2-CG 3.67Å; Y180-E184 PolarHBondContact O-N 3Å; E184-K187 PolarHBondContact O-N 3.13Å; E184-K187 IonicContact OE1-NZ 2.8Å; E184-K187 PolarHBondContact OE1-NZ 3.02Å; E184-K187 WeakPolarHBondContact OE2-CE 3.15Å; E184-K187 IonicContact OE2-NZ 2.64Å; E184-K187 PolarHBondContact OE2-NZ 2.92Å; E184-E188 WeakPolarHBondContact O-CG 3.2Å; E184-E188 PolarHBondContact O-N 3.22Å; E184-L207 HydrophobicContact CB-CD1 4.03Å; E184-L207 HydrophobicContact CB-CD2 3.68Å; E184-L207 HydrophobicContact CB-CG 4.43Å; E184-L207 HydrophobicContact CG-CD2 3.92Å |
| 185 | L | 98.8 | Very high | 98.2 | Very high | 0 Ų | 0 | 78.6 Ų | 78.6 | 0% | 0 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -64.6 | -41.7 | 174.9 | -71.2 | 167.1 | 0 | 0 | 0 | 112.5 | Q181 T182 L183 F189 I203 L207 L209 I214 W217 F218 | Q181-L185 WeakPolarHBondContact O-CB 3.41Å; Q181-L185 WeakPolarHBondContact O-CD1 3.45Å; Q181-L185 WeakPolarHBondContact O-CG 3.36Å; Q181-L185 PolarHBondContact O-N 3.21Å; T182-L185 PolarHBondContact O-N 2.85Å; L183-L185 VanDerWaalsContact C-N 3.34Å; L183-L185 PolarHBondContact O-N 3.06Å; L185-F189 WeakPolarHBondContact O-CB 3.15Å; L185-F189 PolarHBondContact O-N 3.32Å; L185-I203 HydrophobicContact CD2-CG2 4.23Å; L185-L207 HydrophobicContact CD1-CD1 4.45Å; L185-L207 HydrophobicContact CD2-CD1 3.97Å; L185-L207 HydrophobicContact CG-CD1 3.77Å; L185-L209 HydrophobicContact CD1-CD1 4.37Å; L185-I214 HydrophobicContact CD2-CD1 3.81Å; L185-W217 VanDerWaalsContact C-CH2 3.46Å; L185-W217 HydrophobicContact CB-CD2 3.89Å; L185-W217 HydrophobicContact CB-CE3 3.89Å; L185-W217 HydrophobicContact CB-CH2 3.61Å; L185-W217 HydrophobicContact CB-CZ2 3.58Å; L185-W217 HydrophobicContact CB-CZ3 3.76Å; L185-W217 HydrophobicContact CD1-CD2 3.86Å; L185-W217 HydrophobicContact CD1-CG 3.83Å; L185-W217 HydrophobicContact CD2-CD2 4.3Å; L185-W217 HydrophobicContact CD2-CE3 4.21Å; L185-W217 HydrophobicContact CG-CD2 4.24Å; L185-W217 HydrophobicContact CG-CE3 4.44Å; L185-W217 WeakPolarHBondContact O-CH2 3.35Å; L185-W217 WeakPolarHBondContact O-CZ3 3.28Å; L185-F218 HydrophobicContact CD2-CE2 4.08Å |
| 186 | E | 98.7 | Very high | 98.4 | Very high | 46 Ų | 46 | 76.1 Ų | 76.1 | 22% | 0.215 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -64.9 | -44.5 | 174.4 | -71.1 | -69.4 | 167.2 | 0 | 0 | 111 | T182 L183 E188 F189 H190 W217 R221 | T182-E186 WeakPolarHBondContact O-CG 3.35Å; T182-E186 PolarHBondContact O-N 3.42Å; L183-E186 PolarHBondContact O-N 2.89Å; E186-E188 PolarHBondContact O-N 3.43Å; E186-F189 WeakPolarHBondContact O-CB 3.29Å; E186-F189 PolarHBondContact O-N 2.94Å; E186-F189 VanDerWaalsContact O-N 3.13Å; E186-H190 PolarHBondContact O-CD2 2.84Å; E186-H190 PolarHBondContact O-N 3.47Å; E186-W217 HydrophobicContact CG-CH2 4.1Å; E186-W217 HydrophobicContact CG-CZ2 4.09Å; E186-R221 VanDerWaalsContact CD-NE 3.28Å; E186-R221 WeakPolarHBondContact OE1-CD 3.42Å; E186-R221 IonicContact OE1-CZ 3.15Å; E186-R221 IonicContact OE1-NE 3.87Å; E186-R221 PolarHBondContact OE1-NE 2.96Å; E186-R221 IonicContact OE1-NH2 2.82Å; E186-R221 IonicContact OE2-CZ 2.92Å; E186-R221 VanDerWaalsContact OE2-CZ 3.3Å; E186-R221 IonicContact OE2-NE 3.45Å; E186-R221 PolarHBondContact OE2-NE 3.08Å; E186-R221 IonicContact OE2-NH2 3.81Å; E186-R221 PolarHBondContact OE2-NH2 3.21Å |
| 187 | K | 98.6 | Very high | 98.5 | Very high | 106 Ų | 106 | 78.2 Ų | 78.2 | 46% | 0.461 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -54.7 | -51.3 | 175.7 | -174.8 | -175.1 | 76 | -165.5 | 0 | 111.1 | L183 E184 F189 H190 F191 | L183-K187 WeakPolarHBondContact O-CB 3.45Å; L183-K187 PolarHBondContact O-N 2.76Å; E184-K187 PolarHBondContact O-N 3.13Å; E184-K187 IonicContact OE1-NZ 2.8Å; E184-K187 PolarHBondContact OE1-NZ 3.02Å; E184-K187 WeakPolarHBondContact OE2-CE 3.15Å; E184-K187 IonicContact OE2-NZ 2.64Å; E184-K187 PolarHBondContact OE2-NZ 2.92Å; K187-F189 VanDerWaalsContact C-N 3.33Å; K187-F189 PolarHBondContact O-N 3.42Å; K187-H190 PolarHBondContact O-N 3.41Å; K187-F191 PolarHBondContact O-N 3.3Å |
| 188 | E | 98.6 | Very high | 98.5 | Very high | 15 Ų | 15 | 84.8 Ų | 84.8 | 7% | 0.07 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -63 | -38.6 | 177.4 | -72.7 | -63.8 | 135.2 | 0 | 0 | 112.2 | E184 E186 H190 F191 N192 R199 I203 F218 | E184-E188 WeakPolarHBondContact O-CG 3.2Å; E184-E188 PolarHBondContact O-N 3.22Å; E186-E188 PolarHBondContact O-N 3.43Å; E188-H190 VanDerWaalsContact C-N 3.29Å; E188-H190 PolarHBondContact O-N 3.15Å; E188-F191 WeakPolarHBondContact O-CB 3.48Å; E188-F191 PolarHBondContact O-N 3.43Å; E188-N192 PolarHBondContact O-N 2.92Å; E188-N192 VanDerWaalsContact O-O 3.06Å; E188-R199 IonicContact OE1-CZ 3.3Å; E188-R199 IonicContact OE1-NE 3.98Å; E188-R199 IonicContact OE1-NH2 2.76Å; E188-R199 PolarHBondContact OE1-NH2 3.15Å; E188-R199 IonicContact OE2-CZ 2.67Å; E188-R199 IonicContact OE2-NE 3.82Å; E188-R199 PolarHBondContact OE2-NE 2.82Å; E188-R199 IonicContact OE2-NH2 3.31Å; E188-R199 PolarHBondContact OE2-NH2 2.99Å; E188-R199 VanDerWaalsContact OE2-NH2 3.15Å; E188-I203 HydrophobicContact CB-CD1 4.04Å; E188-I203 HydrophobicContact CG-CD1 3.65Å; E188-I203 HydrophobicContact CG-CG1 4.09Å; E188-F218 HydrophobicContact CB-CZ 4.05Å |
| 189 | F | 98.8 | Very high | 98.5 | Very high | 1 Ų | 1 | 85.6 Ų | 85.6 | 0% | 0.004 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -65.1 | -33.7 | 176.5 | -176.8 | -101.3 | 0 | 0 | 0 | 112.8 | L185 E186 K187 N192 R193 W217 F218 R221 R222 W225 | L185-F189 WeakPolarHBondContact O-CB 3.15Å; L185-F189 PolarHBondContact O-N 3.32Å; E186-F189 WeakPolarHBondContact O-CB 3.29Å; E186-F189 PolarHBondContact O-N 2.94Å; E186-F189 VanDerWaalsContact O-N 3.13Å; K187-F189 VanDerWaalsContact C-N 3.33Å; K187-F189 PolarHBondContact O-N 3.42Å; F189-N192 CarbonylContact O-C 3.42Å; F189-R193 HydrophobicContact CE1-CG 4.3Å; F189-R193 HydrophobicContact CE2-CB 3.94Å; F189-R193 HydrophobicContact CE2-CG 4.06Å; F189-R193 HydrophobicContact CZ-CB 4.24Å; F189-R193 HydrophobicContact CZ-CG 3.9Å; F189-R193 WeakPolarHBondContact O-CD 3.5Å; F189-R193 PolarHBondContact O-NH1 3.2Å; F189-W217 HydrophobicContact CB-CH2 4.27Å; F189-W217 HydrophobicContact CB-CZ3 4Å; F189-W217 HydrophobicContact CG-CZ3 4.48Å; F189-F218 HydrophobicContact CB-CE1 4.2Å; F189-F218 HydrophobicContact CB-CZ 4.32Å; F189-F218 AromaticContact CD2-CD1 3.97Å; F189-F218 HydrophobicContact CD2-CD1 3.97Å; F189-F218 AromaticContact CD2-CE1 3.92Å; F189-F218 HydrophobicContact CD2-CE1 3.92Å; F189-R221 HydrophobicContact CB-CG 4.33Å; F189-R221 HydrophobicContact CD1-CG 3.66Å; F189-R221 HydrophobicContact CD2-CB 4.24Å; F189-R221 HydrophobicContact CD2-CG 3.61Å; F189-R221 HydrophobicContact CE1-CG 3.79Å; F189-R221 HydrophobicContact CE2-CB 4.26Å; F189-R221 HydrophobicContact CE2-CG 3.75Å; F189-R221 HydrophobicContact CG-CG 3.57Å; F189-R221 HydrophobicContact CZ-CG 3.84Å; F189-R222 HydrophobicContact CE2-CG 3.72Å; F189-R222 HydrophobicContact CZ-CG 4.23Å; F189-W225 HydrophobicContact CE1-CB 4.3Å; F189-W225 HydrophobicContact CE1-CG 4.39Å; F189-W225 HydrophobicContact CZ-CB 4.11Å; F189-W225 HydrophobicContact CZ-CG 4.33Å |
| 190 | H | 98.3 | Very high | 98.5 | Very high | 113 Ų | 113 | 79.4 Ų | 79.4 | 52% | 0.523 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -68 | -41.2 | 173.1 | -79.7 | -72.5 | 0 | 0 | 0 | 111.8 | E186 K187 E188 | E186-H190 PolarHBondContact O-CD2 2.84Å; E186-H190 PolarHBondContact O-N 3.47Å; K187-H190 PolarHBondContact O-N 3.41Å; E188-H190 VanDerWaalsContact C-N 3.29Å; E188-H190 PolarHBondContact O-N 3.15Å |
| 191 | F | 98.4 | Very high | 98.5 | Very high | 167 Ų | 167 | 76.3 Ų | 76.3 | 73% | 0.732 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -64.5 | -51.7 | 175.4 | 179.6 | -104.1 | 0 | 0 | 0 | 112.2 | K187 E188 | K187-F191 PolarHBondContact O-N 3.3Å; E188-F191 WeakPolarHBondContact O-CB 3.48Å; E188-F191 PolarHBondContact O-N 3.43Å |
| 192 | N | 97.8 | Very high | 98.5 | Very high | 73 Ų | 73 | 78 Ų | 78 | 39% | 0.39 | 35% | 0.351 | S | S | . | . | trans | -145.8 | 126.9 | 177.4 | -171.8 | -8.6 | 0 | 0 | 0 | 111.3 | E188 F189 Y194 F218 | E188-N192 PolarHBondContact O-N 2.92Å; E188-N192 VanDerWaalsContact O-O 3.06Å; F189-N192 CarbonylContact O-C 3.42Å; N192-Y194 PolarHBondContact ND2-O 3.45Å; N192-Y194 PolarHBondContact O-N 3.31Å; N192-Y194 PolarHBondContact OD1-N 3.2Å; N192-Y194 VanDerWaalsContact OD1-N 3.07Å; N192-Y194 PolarHBondContact OD1-O 3.12Å; N192-F218 WeakPolarHBondContact O-CE1 3.33Å | ||
| 193 | R | 98.1 | Very high | 98.5 | Very high | 87 Ų | 87 | 76.4 Ų | 76.4 | 33% | 0.328 | 34% | 0.34 | S | S | . | . | S | Bend | trans | -78.3 | -11.5 | -172.7 | -69.3 | 57.1 | 167.7 | 65.5 | -5.4 | 111.4 | F189 R222 | F189-R193 HydrophobicContact CE1-CG 4.3Å; F189-R193 HydrophobicContact CE2-CB 3.94Å; F189-R193 HydrophobicContact CE2-CG 4.06Å; F189-R193 HydrophobicContact CZ-CB 4.24Å; F189-R193 HydrophobicContact CZ-CG 3.9Å; F189-R193 WeakPolarHBondContact O-CD 3.5Å; F189-R193 PolarHBondContact O-NH1 3.2Å; R193-R222 WeakPolarHBondContact O-CD 3.42Å |
| 194 | Y | 98.4 | Very high | 98.5 | Very high | 149 Ų | 149 | 72.6 Ų | 72.6 | 58% | 0.584 | 32% | 0.322 | S | S | * | . | S | Bend | trans | -135.6 | 126.4 | -178.1 | -64.1 | -108.7 | 0 | 0 | 0 | 109.7 | N192 R222 | N192-Y194 PolarHBondContact ND2-O 3.45Å; N192-Y194 PolarHBondContact O-N 3.31Å; N192-Y194 PolarHBondContact OD1-N 3.2Å; N192-Y194 VanDerWaalsContact OD1-N 3.07Å; N192-Y194 PolarHBondContact OD1-O 3.12Å; Y194-R222 VanDerWaalsContact CD1-NH1 3.26Å |
| 195 | L | 98.4 | Very high | 98.5 | Very high | 27 Ų | 27 | 76.3 Ų | 76.3 | 14% | 0.141 | 34% | 0.342 | C | S | . | . | trans | -93.7 | 131.8 | 179.2 | -63.6 | 179.8 | 0 | 0 | 0 | 112.5 | R199 I203 I214 F218 | L195-R199 HydrophobicContact CD2-CG 3.88Å; L195-I203 HydrophobicContact CD1-CD1 3.76Å; L195-I203 HydrophobicContact CD2-CD1 3.83Å; L195-I203 HydrophobicContact CG-CD1 4.47Å; L195-I214 HydrophobicContact CD1-CG2 3.54Å; L195-F218 HydrophobicContact CD1-CD1 4.18Å; L195-F218 HydrophobicContact CD1-CD2 3.64Å; L195-F218 HydrophobicContact CD1-CE1 3.93Å; L195-F218 HydrophobicContact CD1-CE2 3.37Å; L195-F218 HydrophobicContact CD1-CG 4.05Å; L195-F218 HydrophobicContact CD1-CZ 3.53Å; L195-F218 HydrophobicContact CD2-CE1 3.85Å; L195-F218 HydrophobicContact CD2-CE2 4.5Å; L195-F218 HydrophobicContact CD2-CZ 3.79Å; L195-F218 HydrophobicContact CG-CD1 3.84Å; L195-F218 HydrophobicContact CG-CD2 4.22Å; L195-F218 HydrophobicContact CG-CE1 3.52Å; L195-F218 HydrophobicContact CG-CE2 3.97Å; L195-F218 HydrophobicContact CG-CG 4.18Å; L195-F218 HydrophobicContact CG-CZ 3.6Å | ||
| 196 | A | 98.4 | Very high | 98.5 | Very high | 66 Ų | 66 | 80.3 Ų | 80.3 | 55% | 0.545 | 37% | 0.367 | S | S | . | . | trans | -69.8 | 161.9 | 162 | 0 | 0 | 0 | 0 | 0 | 111.2 | R198 R199 R200 | A196-R198 PolarHBondContact O-N 3.04Å; A196-R199 PolarHBondContact O-N 3.43Å; A196-R200 PolarHBondContact O-N 2.82Å | ||
| 197 | R | 98.4 | Very high | 98.4 | Very high | 153 Ų | 153 | 78.5 Ų | 78.5 | 58% | 0.577 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -58.6 | -49.8 | -176.6 | 177 | 150.1 | 179.6 | 64.7 | 1.1 | 112.5 | R199 R200 I201 E211 | R197-R199 PolarHBondContact O-N 3.39Å; R197-R200 WeakPolarHBondContact O-CB 3.43Å; R197-R200 PolarHBondContact O-N 3.02Å; R197-I201 HydrophobicContact CG-CD1 4.11Å; R197-I201 WeakPolarHBondContact O-CG1 3.45Å; R197-I201 PolarHBondContact O-N 3.31Å; R197-E211 IonicContact CZ-OE1 3.52Å; R197-E211 IonicContact CZ-OE2 3.58Å; R197-E211 IonicContact NH1-OE1 3.57Å; R197-E211 PolarHBondContact NH1-OE1 3.48Å; R197-E211 IonicContact NH1-OE2 2.93Å; R197-E211 PolarHBondContact NH1-OE2 3.34Å; R197-E211 IonicContact NH2-OE1 3.43Å; R197-E211 PolarHBondContact NH2-OE1 2.92Å |
| 198 | R | 98.4 | Very high | 98.4 | Very high | 197 Ų | 197 | 79 Ų | 79 | 74% | 0.743 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -55.9 | -50.6 | 179.2 | -178.8 | -178.5 | 164.5 | 158.4 | 0.9 | 111.8 | A196 R200 I201 E202 | A196-R198 PolarHBondContact O-N 3.04Å; R198-R200 VanDerWaalsContact C-N 3.29Å; R198-R200 PolarHBondContact O-N 2.67Å; R198-I201 WeakPolarHBondContact O-CB 3.29Å; R198-I201 PolarHBondContact O-N 2.93Å; R198-I201 VanDerWaalsContact O-N 3.12Å; R198-E202 WeakPolarHBondContact CG-OE1 3.47Å; R198-E202 IonicContact CZ-OE1 3.85Å; R198-E202 IonicContact NE-OE1 3.02Å; R198-E202 PolarHBondContact NE-OE1 3.07Å; R198-E202 IonicContact NH2-OE1 2.67Å; R198-E202 PolarHBondContact O-N 2.91Å; R198-E202 VanDerWaalsContact O-N 3.16Å |
| 199 | R | 98.6 | Very high | 98.4 | Very high | 91 Ų | 91 | 79 Ų | 79 | 34% | 0.343 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -62 | -36.2 | -180 | -172.4 | 58.5 | -178.5 | 163.5 | -1.8 | 112.8 | E188 L195 A196 R197 I201 E202 I203 | E188-R199 IonicContact OE1-CZ 3.3Å; E188-R199 IonicContact OE1-NE 3.98Å; E188-R199 IonicContact OE1-NH2 2.76Å; E188-R199 PolarHBondContact OE1-NH2 3.15Å; E188-R199 IonicContact OE2-CZ 2.67Å; E188-R199 IonicContact OE2-NE 3.82Å; E188-R199 PolarHBondContact OE2-NE 2.82Å; E188-R199 IonicContact OE2-NH2 3.31Å; E188-R199 PolarHBondContact OE2-NH2 2.99Å; E188-R199 VanDerWaalsContact OE2-NH2 3.15Å; L195-R199 HydrophobicContact CD2-CG 3.88Å; A196-R199 PolarHBondContact O-N 3.43Å; R197-R199 PolarHBondContact O-N 3.39Å; R199-I201 VanDerWaalsContact C-N 3.32Å; R199-I201 PolarHBondContact O-N 2.85Å; R199-E202 VanDerWaalsContact CD-OE2 3.29Å; R199-E202 WeakPolarHBondContact CD-OE2 3.42Å; R199-E202 IonicContact CZ-OE2 3.96Å; R199-E202 IonicContact NH1-OE2 3.7Å; R199-E202 PolarHBondContact NH1-OE2 3.46Å; R199-E202 PolarHBondContact O-N 3.38Å; R199-I203 HydrophobicContact CG-CD1 3.9Å; R199-I203 HydrophobicContact CG-CG1 4.48Å; R199-I203 WeakPolarHBondContact O-CG1 3.38Å; R199-I203 PolarHBondContact O-N 3.28Å; R199-I203 VanDerWaalsContact O-N 3.08Å |
| 200 | R | 98.6 | Very high | 98.4 | Very high | 56 Ų | 56 | 84.6 Ų | 84.6 | 21% | 0.211 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -60.3 | -42.2 | 175.4 | -170.8 | -172 | -55.5 | 170.6 | 7.5 | 112.1 | A196 R197 R198 A204 E211 I214 | A196-R200 PolarHBondContact O-N 2.82Å; R197-R200 WeakPolarHBondContact O-CB 3.43Å; R197-R200 PolarHBondContact O-N 3.02Å; R198-R200 VanDerWaalsContact C-N 3.29Å; R198-R200 PolarHBondContact O-N 2.67Å; R200-A204 WeakPolarHBondContact O-CB 3.45Å; R200-A204 PolarHBondContact O-N 3.36Å; R200-E211 HydrophobicContact CG-CB 4.36Å; R200-I214 HydrophobicContact CG-CB 4.03Å; R200-I214 HydrophobicContact CG-CG2 3.87Å |
| 201 | I | 98.7 | Very high | 98.4 | Very high | 60 Ų | 60 | 81.9 Ų | 81.9 | 31% | 0.308 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -64.7 | -44.7 | 178.1 | -62.6 | 163.2 | 0 | 0 | 0 | 110.1 | R197 R198 R199 I203 A204 N205 E211 | R197-I201 HydrophobicContact CG-CD1 4.11Å; R197-I201 WeakPolarHBondContact O-CG1 3.45Å; R197-I201 PolarHBondContact O-N 3.31Å; R198-I201 WeakPolarHBondContact O-CB 3.29Å; R198-I201 PolarHBondContact O-N 2.93Å; R198-I201 VanDerWaalsContact O-N 3.12Å; R199-I201 VanDerWaalsContact C-N 3.32Å; R199-I201 PolarHBondContact O-N 2.85Å; I201-I203 PolarHBondContact O-N 2.96Å; I201-A204 WeakPolarHBondContact O-CB 3.34Å; I201-A204 PolarHBondContact O-N 3.04Å; I201-N205 VanDerWaalsContact O-CG 3.3Å; I201-N205 PolarHBondContact O-N 2.79Å; I201-E211 HydrophobicContact CG1-CG 4.3Å; I201-E211 WeakPolarHBondContact CG1-OE2 3.48Å |
| 202 | E | 98.6 | Very high | 98.4 | Very high | 63 Ų | 63 | 81.8 Ų | 81.8 | 29% | 0.294 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -59.1 | -47.1 | 179 | -66.8 | 167.9 | -171.8 | 0 | 0 | 112.2 | R198 R199 N205 T206 | R198-E202 WeakPolarHBondContact CG-OE1 3.47Å; R198-E202 IonicContact CZ-OE1 3.85Å; R198-E202 IonicContact NE-OE1 3.02Å; R198-E202 PolarHBondContact NE-OE1 3.07Å; R198-E202 IonicContact NH2-OE1 2.67Å; R198-E202 PolarHBondContact O-N 2.91Å; R198-E202 VanDerWaalsContact O-N 3.16Å; R199-E202 VanDerWaalsContact CD-OE2 3.29Å; R199-E202 WeakPolarHBondContact CD-OE2 3.42Å; R199-E202 IonicContact CZ-OE2 3.96Å; R199-E202 IonicContact NH1-OE2 3.7Å; R199-E202 PolarHBondContact NH1-OE2 3.46Å; R199-E202 PolarHBondContact O-N 3.38Å; E202-N205 PolarHBondContact O-N 3Å; E202-T206 PolarHBondContact O-N 3.24Å; E202-T206 VanDerWaalsContact O-N 3.08Å; E202-T206 PolarHBondContact O-OG1 2.91Å |
| 203 | I | 98.6 | Very high | 98.4 | Very high | 8 Ų | 8 | 81.1 Ų | 81.1 | 4% | 0.041 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -67.5 | -41.7 | 178.8 | -62.8 | 164.1 | 0 | 0 | 0 | 110.9 | L185 E188 L195 R199 I201 N205 T206 L207 I214 | L185-I203 HydrophobicContact CD2-CG2 4.23Å; E188-I203 HydrophobicContact CB-CD1 4.04Å; E188-I203 HydrophobicContact CG-CD1 3.65Å; E188-I203 HydrophobicContact CG-CG1 4.09Å; L195-I203 HydrophobicContact CD1-CD1 3.76Å; L195-I203 HydrophobicContact CD2-CD1 3.83Å; L195-I203 HydrophobicContact CG-CD1 4.47Å; R199-I203 HydrophobicContact CG-CD1 3.9Å; R199-I203 HydrophobicContact CG-CG1 4.48Å; R199-I203 WeakPolarHBondContact O-CG1 3.38Å; R199-I203 PolarHBondContact O-N 3.28Å; R199-I203 VanDerWaalsContact O-N 3.08Å; I201-I203 PolarHBondContact O-N 2.96Å; I203-N205 VanDerWaalsContact C-N 3.31Å; I203-N205 PolarHBondContact O-N 3.5Å; I203-T206 PolarHBondContact O-N 3.1Å; I203-L207 HydrophobicContact CG2-CD1 3.71Å; I203-L207 HydrophobicContact CG2-CG 4.18Å; I203-L207 WeakPolarHBondContact O-CB 3.44Å; I203-L207 WeakPolarHBondContact O-CG 3.19Å; I203-L207 PolarHBondContact O-N 3.34Å; I203-I214 HydrophobicContact CG2-CD1 3.96Å |
| 204 | A | 98.7 | Very high | 98.5 | Very high | 5 Ų | 5 | 77 Ų | 77 | 4% | 0.041 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -54.7 | -48.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | R200 I201 L207 C208 L209 E211 I214 | R200-A204 WeakPolarHBondContact O-CB 3.45Å; R200-A204 PolarHBondContact O-N 3.36Å; I201-A204 WeakPolarHBondContact O-CB 3.34Å; I201-A204 PolarHBondContact O-N 3.04Å; A204-L207 PolarHBondContact O-N 3.34Å; A204-C208 PolarHBondContact O-N 3.49Å; A204-C208 VanDerWaalsContact O-N 3.09Å; A204-L209 CarbonylContact C-O 3.52Å; A204-L209 VanDerWaalsContact CA-O 3.29Å; A204-L209 WeakPolarHBondContact CA-O 3.35Å; A204-L209 WeakPolarHBondContact CB-O 3.44Å; A204-L209 PolarHBondContact O-N 2.79Å; A204-L209 VanDerWaalsContact O-O 3.13Å; A204-E211 HydrophobicContact CB-CG 4.26Å; A204-I214 HydrophobicContact CB-CG1 4.04Å |
| 205 | N | 98.6 | Very high | 98.5 | Very high | 119 Ų | 119 | 75.5 Ų | 75.5 | 64% | 0.636 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -65.3 | -43 | 178.7 | -66.3 | -13.1 | 0 | 0 | 0 | 112 | I201 E202 I203 L207 C208 | I201-N205 VanDerWaalsContact O-CG 3.3Å; I201-N205 PolarHBondContact O-N 2.79Å; E202-N205 PolarHBondContact O-N 3Å; I203-N205 VanDerWaalsContact C-N 3.31Å; I203-N205 PolarHBondContact O-N 3.5Å; N205-L207 VanDerWaalsContact C-N 3.3Å; N205-L207 PolarHBondContact O-N 3.47Å; N205-C208 PolarHBondContact O-N 3.39Å |
| 206 | T | 98.3 | Very high | 98.5 | Very high | 85 Ų | 85 | 77 Ų | 77 | 52% | 0.521 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -65.2 | -33.8 | -178.5 | -54.3 | 0 | 0 | 0 | 0 | 112.6 | E202 I203 | E202-T206 PolarHBondContact O-N 3.24Å; E202-T206 VanDerWaalsContact O-N 3.08Å; E202-T206 PolarHBondContact O-OG1 2.91Å; I203-T206 PolarHBondContact O-N 3.1Å |
| 207 | L | 98.4 | Very high | 98.5 | Very high | 7 Ų | 7 | 75.2 Ų | 75.2 | 4% | 0.037 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -100.1 | 0.2 | -175.4 | -61.5 | -173 | 0 | 0 | 0 | 113.9 | Y180 Q181 E184 L185 I203 A204 N205 L209 | Y180-L207 HydrophobicContact CD1-CD2 4.15Å; Y180-L207 HydrophobicContact CE1-CD2 3.61Å; Q181-L207 HydrophobicContact CG-CB 4.27Å; Q181-L207 PolarHBondContact NE2-O 3.2Å; E184-L207 HydrophobicContact CB-CD1 4.03Å; E184-L207 HydrophobicContact CB-CD2 3.68Å; E184-L207 HydrophobicContact CB-CG 4.43Å; E184-L207 HydrophobicContact CG-CD2 3.92Å; L185-L207 HydrophobicContact CD1-CD1 4.45Å; L185-L207 HydrophobicContact CD2-CD1 3.97Å; L185-L207 HydrophobicContact CG-CD1 3.77Å; I203-L207 HydrophobicContact CG2-CD1 3.71Å; I203-L207 HydrophobicContact CG2-CG 4.18Å; I203-L207 WeakPolarHBondContact O-CB 3.44Å; I203-L207 WeakPolarHBondContact O-CG 3.19Å; I203-L207 PolarHBondContact O-N 3.34Å; A204-L207 PolarHBondContact O-N 3.34Å; N205-L207 VanDerWaalsContact C-N 3.3Å; N205-L207 PolarHBondContact O-N 3.47Å; L207-L209 VanDerWaalsContact C-N 3.28Å; L207-L209 HydrophobicContact CB-CD1 4.17Å; L207-L209 HydrophobicContact CB-CG 4.16Å; L207-L209 PolarHBondContact O-N 3.04Å |
| 208 | C | 98.4 | Very high | 98.5 | Very high | 117 Ų | 117 | 68.3 Ų | 68.3 | 79% | 0.791 | 32% | 0.324 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.3 | 45.8 | -172.1 | -57.3 | 0 | 0 | 0 | 0 | 112.2 | A204 N205 | A204-C208 PolarHBondContact O-N 3.49Å; A204-C208 VanDerWaalsContact O-N 3.09Å; N205-C208 PolarHBondContact O-N 3.39Å |
| 209 | L | 98.1 | Very high | 98.5 | Very high | 16 Ų | 16 | 63.8 Ų | 63.8 | 8% | 0.084 | 31% | 0.311 | C | S | . | . | trans | -122.9 | 150.3 | 177.7 | -66.5 | 178.7 | 0 | 0 | 0 | 110 | Y177 Q181 L185 A204 L207 Q213 I214 | Y177-L209 HydrophobicContact CD1-CD1 4.1Å; Y177-L209 HydrophobicContact CD1-CD2 3.93Å; Y177-L209 HydrophobicContact CE1-CD1 3.99Å; Y177-L209 HydrophobicContact CE1-CD2 3.72Å; Q181-L209 HydrophobicContact CG-CD1 4.47Å; L185-L209 HydrophobicContact CD1-CD1 4.37Å; A204-L209 CarbonylContact C-O 3.52Å; A204-L209 VanDerWaalsContact CA-O 3.29Å; A204-L209 WeakPolarHBondContact CA-O 3.35Å; A204-L209 WeakPolarHBondContact CB-O 3.44Å; A204-L209 PolarHBondContact O-N 2.79Å; A204-L209 VanDerWaalsContact O-O 3.13Å; L207-L209 VanDerWaalsContact C-N 3.28Å; L207-L209 HydrophobicContact CB-CD1 4.17Å; L207-L209 HydrophobicContact CB-CG 4.16Å; L207-L209 PolarHBondContact O-N 3.04Å; L209-Q213 HydrophobicContact CB-CB 4.45Å; L209-I214 HydrophobicContact CB-CD1 3.93Å; L209-I214 HydrophobicContact CB-CG1 4.48Å; L209-I214 HydrophobicContact CD1-CD1 3.94Å | ||
| 210 | N | 98.3 | Very high | 98.5 | Very high | 118 Ų | 118 | 64.4 Ų | 64.4 | 63% | 0.631 | 32% | 0.321 | S | S | * | . | trans | -72 | 148.1 | 175.6 | -70.5 | -1.6 | 0 | 0 | 0 | 111 | R212 Q213 I214 | N210-R212 PolarHBondContact O-N 2.91Å; N210-Q213 HydrophobicContact CB-CG 4.43Å; N210-Q213 WeakPolarHBondContact O-CA 3.44Å; N210-Q213 WeakPolarHBondContact O-CB 3.26Å; N210-Q213 PolarHBondContact O-N 2.71Å; N210-I214 PolarHBondContact O-N 2.93Å; N210-I214 VanDerWaalsContact O-N 3.15Å | ||
| 211 | E | 98.6 | Very high | 98.5 | Very high | 56 Ų | 56 | 63.4 Ų | 63.4 | 26% | 0.262 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -50.7 | -36 | 175.2 | -69.1 | -158.8 | -105.2 | 0 | 0 | 113 | R197 R200 I201 A204 I214 K215 | R197-E211 IonicContact CZ-OE1 3.52Å; R197-E211 IonicContact CZ-OE2 3.58Å; R197-E211 IonicContact NH1-OE1 3.57Å; R197-E211 PolarHBondContact NH1-OE1 3.48Å; R197-E211 IonicContact NH1-OE2 2.93Å; R197-E211 PolarHBondContact NH1-OE2 3.34Å; R197-E211 IonicContact NH2-OE1 3.43Å; R197-E211 PolarHBondContact NH2-OE1 2.92Å; R200-E211 HydrophobicContact CG-CB 4.36Å; I201-E211 HydrophobicContact CG1-CG 4.3Å; I201-E211 WeakPolarHBondContact CG1-OE2 3.48Å; A204-E211 HydrophobicContact CB-CG 4.26Å; E211-I214 PolarHBondContact O-N 3.15Å; E211-K215 WeakPolarHBondContact O-CB 3.45Å; E211-K215 PolarHBondContact O-N 3.06Å |
| 212 | R | 98.1 | Very high | 98.5 | Very high | 165 Ų | 165 | 64.3 Ų | 64.3 | 62% | 0.623 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -62 | -42.5 | 175.5 | -176.5 | 178.4 | -173.5 | -104 | 1.5 | 112 | N210 K215 I216 | N210-R212 PolarHBondContact O-N 2.91Å; R212-K215 PolarHBondContact O-N 3.43Å; R212-I216 HydrophobicContact CG-CD1 3.87Å; R212-I216 HydrophobicContact CG-CG1 4.5Å; R212-I216 WeakPolarHBondContact O-CB 3.34Å; R212-I216 VanDerWaalsContact O-CG1 3.28Å; R212-I216 WeakPolarHBondContact O-CG1 3.48Å; R212-I216 PolarHBondContact O-N 2.98Å |
| 213 | Q | 98.4 | Very high | 98.5 | Very high | 59 Ų | 59 | 66.4 Ų | 66.4 | 28% | 0.276 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -64.8 | -44.2 | 177.9 | -70.3 | 170.3 | -53.8 | 0 | 0 | 110.4 | L209 N210 K215 I216 W217 | L209-Q213 HydrophobicContact CB-CB 4.45Å; N210-Q213 HydrophobicContact CB-CG 4.43Å; N210-Q213 WeakPolarHBondContact O-CA 3.44Å; N210-Q213 WeakPolarHBondContact O-CB 3.26Å; N210-Q213 PolarHBondContact O-N 2.71Å; Q213-K215 VanDerWaalsContact C-N 3.34Å; Q213-K215 PolarHBondContact O-N 3.13Å; Q213-I216 PolarHBondContact O-N 3.41Å; Q213-W217 WeakPolarHBondContact O-CB 3.5Å; Q213-W217 PolarHBondContact O-N 3.28Å |
| 214 | I | 98.7 | Very high | 98.4 | Very high | 0 Ų | 0 | 71.7 Ų | 71.7 | 0% | 0 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -58.1 | -47.1 | 174 | -53.8 | -58.8 | 0 | 0 | 0 | 110.7 | L185 L195 R200 I203 A204 L209 N210 E211 I216 W217 F218 | L185-I214 HydrophobicContact CD2-CD1 3.81Å; L195-I214 HydrophobicContact CD1-CG2 3.54Å; R200-I214 HydrophobicContact CG-CB 4.03Å; R200-I214 HydrophobicContact CG-CG2 3.87Å; I203-I214 HydrophobicContact CG2-CD1 3.96Å; A204-I214 HydrophobicContact CB-CG1 4.04Å; L209-I214 HydrophobicContact CB-CD1 3.93Å; L209-I214 HydrophobicContact CB-CG1 4.48Å; L209-I214 HydrophobicContact CD1-CD1 3.94Å; N210-I214 PolarHBondContact O-N 2.93Å; N210-I214 VanDerWaalsContact O-N 3.15Å; E211-I214 PolarHBondContact O-N 3.15Å; I214-I216 PolarHBondContact O-N 3.24Å; I214-W217 PolarHBondContact O-N 3.3Å; I214-F218 HydrophobicContact CG2-CD2 4.06Å; I214-F218 HydrophobicContact CG2-CE2 4.23Å; I214-F218 WeakPolarHBondContact O-CD2 3.47Å; I214-F218 PolarHBondContact O-N 3.35Å |
| 215 | K | 98.4 | Very high | 98.3 | Very high | 118 Ų | 118 | 77.6 Ų | 77.6 | 51% | 0.513 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -58.4 | -48.6 | 177.4 | -177.3 | -175.3 | 177.3 | -177.3 | 0 | 112 | E211 R212 Q213 F218 Q219 | E211-K215 WeakPolarHBondContact O-CB 3.45Å; E211-K215 PolarHBondContact O-N 3.06Å; R212-K215 PolarHBondContact O-N 3.43Å; Q213-K215 VanDerWaalsContact C-N 3.34Å; Q213-K215 PolarHBondContact O-N 3.13Å; K215-F218 PolarHBondContact O-N 2.92Å; K215-Q219 PolarHBondContact O-N 3.17Å |
| 216 | I | 98.6 | Very high | 98.1 | Very high | 57 Ų | 57 | 76.7 Ų | 76.7 | 29% | 0.292 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -63.7 | -43.3 | 179.6 | -70.5 | 168.5 | 0 | 0 | 0 | 110.3 | R212 Q213 I214 F218 Q219 N220 | R212-I216 HydrophobicContact CG-CD1 3.87Å; R212-I216 HydrophobicContact CG-CG1 4.5Å; R212-I216 WeakPolarHBondContact O-CB 3.34Å; R212-I216 VanDerWaalsContact O-CG1 3.28Å; R212-I216 WeakPolarHBondContact O-CG1 3.48Å; R212-I216 PolarHBondContact O-N 2.98Å; Q213-I216 PolarHBondContact O-N 3.41Å; I214-I216 PolarHBondContact O-N 3.24Å; I216-F218 PolarHBondContact O-N 3.32Å; I216-Q219 WeakPolarHBondContact O-CB 3.49Å; I216-Q219 PolarHBondContact O-N 3.3Å; I216-N220 VanDerWaalsContact O-CG 3.3Å; I216-N220 PolarHBondContact O-N 3.49Å; I216-N220 PolarHBondContact O-ND2 3.4Å |
| 217 | W | 98.6 | Very high | 98 | Very high | 30 Ų | 30 | 79.3 Ų | 79.3 | 11% | 0.114 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -60.2 | -48.3 | 178.9 | -169.7 | 99.1 | 0 | 0 | 0 | 111.3 | Y177 L185 E186 F189 Q213 I214 Q219 N220 R221 | Y177-W217 AromaticContact CD2-CD1 3.92Å; Y177-W217 AromaticContact CE2-CD1 3.62Å; L185-W217 VanDerWaalsContact C-CH2 3.46Å; L185-W217 HydrophobicContact CB-CD2 3.89Å; L185-W217 HydrophobicContact CB-CE3 3.89Å; L185-W217 HydrophobicContact CB-CH2 3.61Å; L185-W217 HydrophobicContact CB-CZ2 3.58Å; L185-W217 HydrophobicContact CB-CZ3 3.76Å; L185-W217 HydrophobicContact CD1-CD2 3.86Å; L185-W217 HydrophobicContact CD1-CG 3.83Å; L185-W217 HydrophobicContact CD2-CD2 4.3Å; L185-W217 HydrophobicContact CD2-CE3 4.21Å; L185-W217 HydrophobicContact CG-CD2 4.24Å; L185-W217 HydrophobicContact CG-CE3 4.44Å; L185-W217 WeakPolarHBondContact O-CH2 3.35Å; L185-W217 WeakPolarHBondContact O-CZ3 3.28Å; E186-W217 HydrophobicContact CG-CH2 4.1Å; E186-W217 HydrophobicContact CG-CZ2 4.09Å; F189-W217 HydrophobicContact CB-CH2 4.27Å; F189-W217 HydrophobicContact CB-CZ3 4Å; F189-W217 HydrophobicContact CG-CZ3 4.48Å; Q213-W217 WeakPolarHBondContact O-CB 3.5Å; Q213-W217 PolarHBondContact O-N 3.28Å; I214-W217 PolarHBondContact O-N 3.3Å; W217-Q219 VanDerWaalsContact C-N 3.29Å; W217-Q219 PolarHBondContact O-N 3.28Å; W217-N220 PolarHBondContact O-N 2.95Å; W217-R221 HydrophobicContact CD2-CB 4.48Å; W217-R221 HydrophobicContact CE3-CB 3.93Å; W217-R221 HydrophobicContact CE3-CG 4.4Å; W217-R221 HydrophobicContact CH2-CB 4.02Å; W217-R221 HydrophobicContact CH2-CG 3.66Å; W217-R221 HydrophobicContact CZ2-CG 4.43Å; W217-R221 HydrophobicContact CZ3-CB 3.67Å; W217-R221 HydrophobicContact CZ3-CG 3.65Å; W217-R221 VanDerWaalsContact O-CB 3.26Å; W217-R221 WeakPolarHBondContact O-CB 3.48Å; W217-R221 PolarHBondContact O-N 2.95Å |
| 218 | F | 98.8 | Very high | 97.7 | Very high | 8 Ų | 8 | 81.6 Ų | 81.6 | 4% | 0.035 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -63.9 | -32.2 | 176.9 | -91.3 | -103.4 | 0 | 0 | 0 | 113 | L185 E188 F189 N192 L195 I214 K215 I216 R222 | L185-F218 HydrophobicContact CD2-CE2 4.08Å; E188-F218 HydrophobicContact CB-CZ 4.05Å; F189-F218 HydrophobicContact CB-CE1 4.2Å; F189-F218 HydrophobicContact CB-CZ 4.32Å; F189-F218 AromaticContact CD2-CD1 3.97Å; F189-F218 HydrophobicContact CD2-CD1 3.97Å; F189-F218 AromaticContact CD2-CE1 3.92Å; F189-F218 HydrophobicContact CD2-CE1 3.92Å; N192-F218 WeakPolarHBondContact O-CE1 3.33Å; L195-F218 HydrophobicContact CD1-CD1 4.18Å; L195-F218 HydrophobicContact CD1-CD2 3.64Å; L195-F218 HydrophobicContact CD1-CE1 3.93Å; L195-F218 HydrophobicContact CD1-CE2 3.37Å; L195-F218 HydrophobicContact CD1-CG 4.05Å; L195-F218 HydrophobicContact CD1-CZ 3.53Å; L195-F218 HydrophobicContact CD2-CE1 3.85Å; L195-F218 HydrophobicContact CD2-CE2 4.5Å; L195-F218 HydrophobicContact CD2-CZ 3.79Å; L195-F218 HydrophobicContact CG-CD1 3.84Å; L195-F218 HydrophobicContact CG-CD2 4.22Å; L195-F218 HydrophobicContact CG-CE1 3.52Å; L195-F218 HydrophobicContact CG-CE2 3.97Å; L195-F218 HydrophobicContact CG-CG 4.18Å; L195-F218 HydrophobicContact CG-CZ 3.6Å; I214-F218 HydrophobicContact CG2-CD2 4.06Å; I214-F218 HydrophobicContact CG2-CE2 4.23Å; I214-F218 WeakPolarHBondContact O-CD2 3.47Å; I214-F218 PolarHBondContact O-N 3.35Å; K215-F218 PolarHBondContact O-N 2.92Å; I216-F218 PolarHBondContact O-N 3.32Å; F218-R222 WeakPolarHBondContact O-CG 3.23Å; F218-R222 PolarHBondContact O-N 3.16Å; F218-R222 VanDerWaalsContact O-N 3.1Å; F218-R222 PolarHBondContact O-NE 2.97Å |
| 219 | Q | 98.8 | Very high | 97.1 | Very high | 102 Ų | 102 | 78.3 Ų | 78.3 | 48% | 0.477 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -66.8 | -50.2 | 173.4 | -172.7 | 167.9 | 14.6 | 0 | 0 | 111.3 | K215 I216 W217 R221 R222 M223 | K215-Q219 PolarHBondContact O-N 3.17Å; I216-Q219 WeakPolarHBondContact O-CB 3.49Å; I216-Q219 PolarHBondContact O-N 3.3Å; W217-Q219 VanDerWaalsContact C-N 3.29Å; W217-Q219 PolarHBondContact O-N 3.28Å; Q219-R221 VanDerWaalsContact C-N 3.28Å; Q219-R221 PolarHBondContact O-N 3.11Å; Q219-R222 PolarHBondContact O-N 3.25Å; Q219-M223 WeakPolarHBondContact O-CG 3.37Å; Q219-M223 PolarHBondContact O-N 3.43Å; Q219-M223 VanDerWaalsContact O-N 3.11Å |
| 220 | N | 98.4 | Very high | 96 | Very high | 103 Ų | 103 | 84.3 Ų | 84.3 | 55% | 0.551 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -59.7 | -41.7 | 176.5 | -68.3 | -18.2 | 0 | 0 | 0 | 111.3 | I216 W217 R222 M223 K224 | I216-N220 VanDerWaalsContact O-CG 3.3Å; I216-N220 PolarHBondContact O-N 3.49Å; I216-N220 PolarHBondContact O-ND2 3.4Å; W217-N220 PolarHBondContact O-N 2.95Å; N220-R222 PolarHBondContact O-N 3.3Å; N220-M223 PolarHBondContact O-N 3.38Å; N220-K224 PolarHBondContact O-N 3.2Å |
| 221 | R | 98.6 | Very high | 94.8 | Very high | 35 Ų | 35 | 82.8 Ų | 82.8 | 13% | 0.132 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -64 | -42.4 | -178.8 | -173.9 | 62.7 | -175.8 | 98.3 | -6.3 | 112.5 | E186 F189 W217 Q219 K224 W225 | E186-R221 VanDerWaalsContact CD-NE 3.28Å; E186-R221 WeakPolarHBondContact OE1-CD 3.42Å; E186-R221 IonicContact OE1-CZ 3.15Å; E186-R221 IonicContact OE1-NE 3.87Å; E186-R221 PolarHBondContact OE1-NE 2.96Å; E186-R221 IonicContact OE1-NH2 2.82Å; E186-R221 IonicContact OE2-CZ 2.92Å; E186-R221 VanDerWaalsContact OE2-CZ 3.3Å; E186-R221 IonicContact OE2-NE 3.45Å; E186-R221 PolarHBondContact OE2-NE 3.08Å; E186-R221 IonicContact OE2-NH2 3.81Å; E186-R221 PolarHBondContact OE2-NH2 3.21Å; F189-R221 HydrophobicContact CB-CG 4.33Å; F189-R221 HydrophobicContact CD1-CG 3.66Å; F189-R221 HydrophobicContact CD2-CB 4.24Å; F189-R221 HydrophobicContact CD2-CG 3.61Å; F189-R221 HydrophobicContact CE1-CG 3.79Å; F189-R221 HydrophobicContact CE2-CB 4.26Å; F189-R221 HydrophobicContact CE2-CG 3.75Å; F189-R221 HydrophobicContact CG-CG 3.57Å; F189-R221 HydrophobicContact CZ-CG 3.84Å; W217-R221 HydrophobicContact CD2-CB 4.48Å; W217-R221 HydrophobicContact CE3-CB 3.93Å; W217-R221 HydrophobicContact CE3-CG 4.4Å; W217-R221 HydrophobicContact CH2-CB 4.02Å; W217-R221 HydrophobicContact CH2-CG 3.66Å; W217-R221 HydrophobicContact CZ2-CG 4.43Å; W217-R221 HydrophobicContact CZ3-CB 3.67Å; W217-R221 HydrophobicContact CZ3-CG 3.65Å; W217-R221 VanDerWaalsContact O-CB 3.26Å; W217-R221 WeakPolarHBondContact O-CB 3.48Å; W217-R221 PolarHBondContact O-N 2.95Å; Q219-R221 VanDerWaalsContact C-N 3.28Å; Q219-R221 PolarHBondContact O-N 3.11Å; R221-K224 PolarHBondContact O-N 3.21Å; R221-W225 WeakPolarHBondContact O-CB 3.4Å; R221-W225 PolarHBondContact O-N 3.13Å |
| 222 | R | 98.3 | Very high | 93.6 | Very high | 79 Ų | 79 | 87.1 Ų | 87.1 | 30% | 0.298 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -63.5 | -39.9 | 173.2 | -75.1 | -176.6 | -67.2 | 159.9 | 1.1 | 112.2 | F189 R193 Y194 F218 Q219 N220 W225 K226 | F189-R222 HydrophobicContact CE2-CG 3.72Å; F189-R222 HydrophobicContact CZ-CG 4.23Å; R193-R222 WeakPolarHBondContact O-CD 3.42Å; Y194-R222 VanDerWaalsContact CD1-NH1 3.26Å; F218-R222 WeakPolarHBondContact O-CG 3.23Å; F218-R222 PolarHBondContact O-N 3.16Å; F218-R222 VanDerWaalsContact O-N 3.1Å; F218-R222 PolarHBondContact O-NE 2.97Å; Q219-R222 PolarHBondContact O-N 3.25Å; N220-R222 PolarHBondContact O-N 3.3Å; R222-W225 PolarHBondContact O-N 3.45Å; R222-K226 WeakPolarHBondContact O-CB 3.43Å; R222-K226 PolarHBondContact O-N 2.84Å |
| 223 | M | 98.3 | Very high | 91.9 | Very high | 108 Ų | 108 | 83.1 Ų | 83.1 | 53% | 0.532 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -62.9 | -43.2 | 176.4 | -67.5 | -60.2 | -76.4 | 0 | 0 | 111.7 | Q219 N220 K226 K227 | Q219-M223 WeakPolarHBondContact O-CG 3.37Å; Q219-M223 PolarHBondContact O-N 3.43Å; Q219-M223 VanDerWaalsContact O-N 3.11Å; N220-M223 PolarHBondContact O-N 3.38Å; M223-K226 PolarHBondContact O-N 2.98Å; M223-K227 PolarHBondContact O-N 3.02Å |
| 224 | K | 96.8 | Very high | 90.2 | Very high | 119 Ų | 119 | 88 Ų | 88 | 52% | 0.517 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -61.9 | -50.1 | 173.9 | -175.4 | -179.8 | 176.9 | -173.7 | 0 | 111.6 | N220 R221 K226 K227 D228 | N220-K224 PolarHBondContact O-N 3.2Å; R221-K224 PolarHBondContact O-N 3.21Å; K224-K226 VanDerWaalsContact C-N 3.31Å; K224-K226 PolarHBondContact O-N 3.38Å; K224-K227 WeakPolarHBondContact O-CA 3.49Å; K224-K227 WeakPolarHBondContact O-CB 3.44Å; K224-K227 PolarHBondContact O-N 3.15Å; K224-D228 VanDerWaalsContact O-CG 3.25Å; K224-D228 PolarHBondContact O-N 2.87Å |
| 225 | W | 96.6 | Very high | 88.4 | Confident | 128 Ų | 128 | 94.6 Ų | 94.6 | 49% | 0.485 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -55.1 | -45.6 | 178 | 177.3 | 77.8 | 0 | 0 | 0 | 112.3 | F189 R221 R222 K227 D228 S229 | F189-W225 HydrophobicContact CE1-CB 4.3Å; F189-W225 HydrophobicContact CE1-CG 4.39Å; F189-W225 HydrophobicContact CZ-CB 4.11Å; F189-W225 HydrophobicContact CZ-CG 4.33Å; R221-W225 WeakPolarHBondContact O-CB 3.4Å; R221-W225 PolarHBondContact O-N 3.13Å; R222-W225 PolarHBondContact O-N 3.45Å; W225-K227 VanDerWaalsContact C-N 3.28Å; W225-K227 PolarHBondContact O-N 3.43Å; W225-D228 PolarHBondContact O-N 3.16Å; W225-S229 PolarHBondContact O-N 2.99Å; W225-S229 PolarHBondContact O-OG 3.29Å; W225-S229 VanDerWaalsContact O-OG 3.06Å |
| 226 | K | 95.8 | Very high | 86.5 | Confident | 101 Ų | 101 | 94 Ų | 94 | 44% | 0.439 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -60 | -35.9 | 175.8 | -176.4 | -178 | 68.2 | 178.9 | 0 | 112.7 | R222 M223 K224 K230 | R222-K226 WeakPolarHBondContact O-CB 3.43Å; R222-K226 PolarHBondContact O-N 2.84Å; M223-K226 PolarHBondContact O-N 2.98Å; K224-K226 VanDerWaalsContact C-N 3.31Å; K224-K226 PolarHBondContact O-N 3.38Å; K226-K230 WeakPolarHBondContact O-CG 3.4Å |
| 227 | K | 95.1 | Very high | 84.2 | Confident | 140 Ų | 140 | 101.2 Ų | 101.2 | 61% | 0.609 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -71 | -46.8 | 177.5 | -172.3 | -179.2 | 177.2 | -177.2 | 0 | 110.6 | M223 K224 W225 S229 K230 L231 | M223-K227 PolarHBondContact O-N 3.02Å; K224-K227 WeakPolarHBondContact O-CA 3.49Å; K224-K227 WeakPolarHBondContact O-CB 3.44Å; K224-K227 PolarHBondContact O-N 3.15Å; W225-K227 VanDerWaalsContact C-N 3.28Å; W225-K227 PolarHBondContact O-N 3.43Å; K227-S229 VanDerWaalsContact C-N 3.34Å; K227-S229 PolarHBondContact O-N 3.35Å; K227-K230 PolarHBondContact O-N 2.73Å; K227-L231 HydrophobicContact CG-CD1 4.31Å; K227-L231 PolarHBondContact O-N 3.19Å |
| 228 | D | 91.5 | Very high | 83.4 | Confident | 55 Ų | 55 | 104.8 Ų | 104.8 | 29% | 0.294 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.8 | -37.7 | -177.2 | -59.7 | -12.7 | 0 | 0 | 0 | 111.8 | K224 W225 K230 L231 K232 | K224-D228 VanDerWaalsContact O-CG 3.25Å; K224-D228 PolarHBondContact O-N 2.87Å; W225-D228 PolarHBondContact O-N 3.16Å; D228-K230 VanDerWaalsContact C-N 3.28Å; D228-K230 PolarHBondContact O-N 2.99Å; D228-L231 PolarHBondContact O-N 2.89Å; D228-K232 WeakPolarHBondContact O-CG 3.42Å; D228-K232 PolarHBondContact O-N 3.14Å |
| 229 | S | 86.6 | Confident | 82.6 | Confident | 47 Ų | 47 | 109.9 Ų | 109.9 | 33% | 0.329 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -63.4 | -31.1 | 176.4 | -59.9 | 0 | 0 | 0 | 0 | 113.4 | W225 K227 S233 | W225-S229 PolarHBondContact O-N 2.99Å; W225-S229 PolarHBondContact O-OG 3.29Å; W225-S229 VanDerWaalsContact O-OG 3.06Å; K227-S229 VanDerWaalsContact C-N 3.34Å; K227-S229 PolarHBondContact O-N 3.35Å; S229-S233 PolarHBondContact O-OG 2.88Å |
| 230 | K | 75.6 | Confident | 81.7 | Confident | 142 Ų | 142 | 110.3 Ų | 110.3 | 62% | 0.617 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -78.3 | -26.7 | 179.1 | -68.7 | 179.9 | 179.1 | -159.1 | 0 | 113.3 | K226 K227 D228 | K226-K230 WeakPolarHBondContact O-CG 3.4Å; K227-K230 PolarHBondContact O-N 2.73Å; D228-K230 VanDerWaalsContact C-N 3.28Å; D228-K230 PolarHBondContact O-N 2.99Å |
| 231 | L | 73.6 | Confident | 80.7 | Confident | 86 Ų | 86 | 110.8 Ų | 110.8 | 45% | 0.45 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -77.4 | -42.7 | 179.6 | -68.4 | 167 | 0 | 0 | 0 | 110.7 | K227 D228 S233 K234 D235 | K227-L231 HydrophobicContact CG-CD1 4.31Å; K227-L231 PolarHBondContact O-N 3.19Å; D228-L231 PolarHBondContact O-N 2.89Å; L231-S233 PolarHBondContact O-N 2.78Å; L231-S233 VanDerWaalsContact O-N 3.15Å; L231-K234 PolarHBondContact O-N 3.22Å; L231-D235 PolarHBondContact O-N 3.36Å |
| 232 | K | 71.7 | Confident | 79.6 | Confident | 147 Ų | 147 | 115.5 Ų | 115.5 | 64% | 0.639 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -57.7 | -31.1 | 177.6 | -70.2 | 174.6 | 178.9 | -69.1 | 0 | 113.8 | D228 K234 S236 | D228-K232 WeakPolarHBondContact O-CG 3.42Å; D228-K232 PolarHBondContact O-N 3.14Å; K232-K234 VanDerWaalsContact C-N 3.34Å; K232-S236 PolarHBondContact O-OG 3.32Å; K232-S236 VanDerWaalsContact O-OG 3.13Å |
| 233 | S | 64.1 | Low | 78.4 | Confident | 81 Ų | 81 | 117.9 Ų | 117.9 | 57% | 0.566 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.9 | -18.7 | 176.2 | -56.3 | 0 | 0 | 0 | 0 | 114.3 | S229 L231 | S229-S233 PolarHBondContact O-OG 2.88Å; L231-S233 PolarHBondContact O-N 2.78Å; L231-S233 VanDerWaalsContact O-N 3.15Å |
| 234 | K | 60.7 | Low | 77 | Confident | 163 Ų | 163 | 118.6 Ų | 118.6 | 71% | 0.709 | 59% | 0.586 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.8 | -31.2 | 179.8 | -79.4 | -170.7 | 171.5 | -171.6 | 0 | 113.3 | L231 K232 S236 | L231-K234 PolarHBondContact O-N 3.22Å; K232-K234 VanDerWaalsContact C-N 3.34Å; K234-S236 PolarHBondContact O-N 3.06Å |
| 235 | D | 62.1 | Low | 75.4 | Confident | 137 Ų | 137 | 118.6 Ų | 118.6 | 73% | 0.733 | 59% | 0.591 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.9 | -0 | 178.9 | -55.8 | -32.2 | 0 | 0 | 0 | 113 | L231 | L231-D235 PolarHBondContact O-N 3.36Š|
| 236 | S | 58.4 | Low | 73.7 | Confident | 105 Ų | 105 | 117.8 Ų | 117.8 | 73% | 0.734 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.5 | 15.4 | 179.9 | -51.6 | 0 | 0 | 0 | 0 | 113.3 | K232 K234 | K232-S236 PolarHBondContact O-OG 3.32Å; K232-S236 VanDerWaalsContact O-OG 3.13Å; K234-S236 PolarHBondContact O-N 3.06Å |
| 237 | I | 49.3 | Very low | 71.7 | Confident | 210 Ų | 210 | 119.4 Ų | 119.4 | 100% | 1.077 | 61% | 0.614 | S | S | * | * | trans | -116.6 | 0 | 175.9 | -63.2 | 176.1 | 0 | 0 | 0 | 109.1 |
Retrieved 237 of 237 residues in 1001.1 ms
(Link to these results)