| 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 | 49.8 | Very low | 69.1 | Low | 241 Ų | 241 | 169.6 Ų | 169.6 | 100% | 1.187 | 85% | 0.846 | S | S | * | * | 0 | 104.1 | 0 | -84.4 | 161.3 | 55.4 | 0 | 0 | 108.4 | |||||
| 2 | V | 55.3 | Low | 69 | Low | 153 Ų | 153 | 165.9 Ų | 165.9 | 93% | 0.927 | 83% | 0.83 | S | S | * | * | trans | -95.6 | 101.2 | -179.7 | -172.2 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 3 | G | 68.6 | Low | 68.9 | Low | 63 Ų | 63 | 164.8 Ų | 164.8 | 65% | 0.649 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 143.7 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | V5 | G3-V5 PolarHBondContact O-N 3.14Š|
| 4 | K | 74.4 | Confident | 68.5 | Low | 199 Ų | 199 | 164.9 Ų | 164.9 | 87% | 0.865 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 117.1 | 174.9 | -68.6 | -179.6 | 178.9 | 175.1 | 0 | 109.7 | K6 | K4-K6 PolarHBondContact O-N 3.2Š|
| 5 | V | 73.8 | Confident | 68 | Low | 117 Ų | 117 | 166.1 Ų | 166.1 | 71% | 0.709 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -68.8 | 118.8 | 171.7 | -179.6 | 0 | 0 | 0 | 0 | 108.8 | G3 | G3-V5 PolarHBondContact O-N 3.14Š|
| 6 | K | 74.4 | Confident | 67.4 | Low | 193 Ų | 193 | 161 Ų | 161 | 84% | 0.839 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -94.9 | 117.3 | 175.2 | -68.5 | -178.5 | 177.7 | 177.3 | 0 | 108.6 | K4 | K4-K6 PolarHBondContact O-N 3.2Š|
| 7 | H | 72.9 | Confident | 66.9 | Low | 169 Ų | 169 | 157.5 Ų | 157.5 | 78% | 0.782 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -83.5 | 125.7 | 171.9 | -63.5 | 87.8 | 0 | 0 | 0 | 109.5 | R9 | H7-R9 PolarHBondContact O-N 3.31Š|
| 8 | V | 72 | Confident | 66.4 | Low | 140 Ų | 140 | 159.3 Ų | 159.3 | 85% | 0.848 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 120.4 | 174 | 170.2 | 0 | 0 | 0 | 0 | 108.2 | Q10 | V8-Q10 PolarHBondContact O-N 2.93Š|
| 9 | R | 74.1 | Confident | 65.7 | Low | 230 Ų | 230 | 159.3 Ų | 159.3 | 87% | 0.868 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 117.7 | 171.4 | -96.3 | 180 | 165.9 | -101.4 | 0.5 | 108.8 | H7 K11 | H7-R9 PolarHBondContact O-N 3.31Å; R9-K11 PolarHBondContact O-N 3.05Å |
| 10 | Q | 71.7 | Confident | 64.5 | Low | 179 Ų | 179 | 160.3 Ų | 160.3 | 84% | 0.836 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 122.5 | 172.6 | -145 | 174 | 10.4 | 0 | 0 | 109 | V8 L12 | V8-Q10 PolarHBondContact O-N 2.93Å; Q10-L12 PolarHBondContact O-N 2.96Å |
| 11 | K | 73.4 | Confident | 63.9 | Low | 182 Ų | 182 | 155.2 Ų | 155.2 | 79% | 0.791 | 79% | 0.793 | S | S | * | * | trans | -81.8 | 88.4 | 175.8 | -70.2 | -92.2 | -173.3 | 169.4 | 0 | 107.9 | R9 | R9-K11 PolarHBondContact O-N 3.05Š| ||
| 12 | L | 68.1 | Low | 63.7 | Low | 125 Ų | 125 | 148.3 Ų | 148.3 | 65% | 0.654 | 77% | 0.766 | S | S | * | * | trans | -65.6 | 151.9 | 158.2 | -117 | 89.4 | 0 | 0 | 0 | 107.9 | Q10 | Q10-L12 PolarHBondContact O-N 2.96Š| ||
| 13 | H | 67.6 | Low | 62.8 | Low | 152 Ų | 152 | 149.6 Ų | 149.6 | 70% | 0.704 | 76% | 0.762 | S | S | * | * | trans | 90.2 | 42.9 | 179.4 | -34 | -56.9 | 0 | 0 | 0 | 116.9 | ||||
| 14 | Q | 63 | Low | 61.3 | Low | 165 Ų | 165 | 152.2 Ų | 152.2 | 77% | 0.771 | 77% | 0.77 | S | S | * | * | S | Bend | trans | -84 | -30.3 | 156.9 | -66.9 | -163.3 | 71.9 | 0 | 0 | 111.9 | A16 V17 | Q14-A16 VanDerWaalsContact C-N 3.29Å; Q14-A16 PolarHBondContact O-N 3.45Å; Q14-V17 PolarHBondContact O-N 3.04Å |
| 15 | E | 60.3 | Low | 59.7 | Low | 184 Ų | 184 | 150.6 Ų | 150.6 | 86% | 0.86 | 77% | 0.77 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.4 | -12.8 | -178 | -65.6 | -171.5 | 162.9 | 0 | 0 | 115.1 | V17 | E15-V17 VanDerWaalsContact C-N 3.28Å; E15-V17 PolarHBondContact O-N 3.15Å |
| 16 | A | 58.5 | Low | 57.9 | Low | 84 Ų | 84 | 151.6 Ų | 151.6 | 69% | 0.694 | 78% | 0.776 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.6 | -6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q14 | Q14-A16 VanDerWaalsContact C-N 3.29Å; Q14-A16 PolarHBondContact O-N 3.45Å |
| 17 | V | 59.6 | Low | 56.2 | Low | 101 Ų | 101 | 151 Ų | 151 | 61% | 0.612 | 78% | 0.776 | S | S | * | * | trans | -109.8 | 76.5 | 179.3 | -172.5 | 0 | 0 | 0 | 0 | 108.8 | Q14 E15 L19 | Q14-V17 PolarHBondContact O-N 3.04Å; E15-V17 VanDerWaalsContact C-N 3.28Å; E15-V17 PolarHBondContact O-N 3.15Å; V17-L19 HydrophobicContact CG1-CD2 4.13Å; V17-L19 HydrophobicContact CG1-CG 4.12Å; V17-L19 PolarHBondContact O-N 2.87Å | ||
| 18 | K | 58 | Low | 55 | Low | 191 Ų | 191 | 148 Ų | 148 | 83% | 0.83 | 77% | 0.772 | S | S | * | * | trans | -78.1 | 102.5 | 165 | -69.5 | 179.2 | -179.7 | -179.8 | 0 | 107.9 | H20 | K18-H20 PolarHBondContact O-N 3.49Š| ||
| 19 | L | 53.7 | Low | 53.1 | Low | 158 Ų | 158 | 146.8 Ų | 146.8 | 83% | 0.827 | 77% | 0.77 | S | S | * | * | trans | -82.6 | 106.6 | 165.1 | -64.2 | -178.3 | 0 | 0 | 0 | 108 | V17 G21 | V17-L19 HydrophobicContact CG1-CD2 4.13Å; V17-L19 HydrophobicContact CG1-CG 4.12Å; V17-L19 PolarHBondContact O-N 2.87Å; L19-G21 PolarHBondContact O-N 3.07Å | ||
| 20 | H | 41.5 | Very low | 51 | Low | 179 Ų | 179 | 139.3 Ų | 139.3 | 83% | 0.829 | 76% | 0.764 | S | S | * | * | trans | -87.8 | 98.9 | 170.4 | -174.2 | -81.5 | 0 | 0 | 0 | 108.7 | K18 | K18-H20 PolarHBondContact O-N 3.49Š| ||
| 21 | G | 51.6 | Low | 49.1 | Very low | 55 Ų | 55 | 137.1 Ų | 137.1 | 57% | 0.567 | 76% | 0.763 | S | S | * | * | trans | -95.1 | 145.6 | 163.5 | 0 | 0 | 0 | 0 | 0 | 110 | L19 | L19-G21 PolarHBondContact O-N 3.07Š| ||
| 22 | P | 45.7 | Very low | 47.2 | Very low | 95 Ų | 95 | 135.8 Ų | 135.8 | 62% | 0.617 | 76% | 0.76 | S | S | * | * | trans | -77.3 | 156.3 | 177.5 | 32.8 | -31.5 | 0 | 0 | 0 | 110.6 | ||||
| 23 | H | 36.3 | Very low | 45.5 | Very low | 181 Ų | 181 | 136.3 Ų | 136.3 | 84% | 0.838 | 76% | 0.763 | S | S | * | * | trans | 80 | 116.5 | -179.2 | -41.1 | -71.9 | 0 | 0 | 0 | 112.5 | ||||
| 24 | S | 36.8 | Very low | 43.9 | Very low | 117 Ų | 117 | 134.8 Ų | 134.8 | 82% | 0.818 | 77% | 0.769 | S | S | * | * | cis | -155.9 | 143.3 | 45 | 47.5 | 0 | 0 | 0 | 0 | 113 | ||||
| 25 | L | 41.8 | Very low | 42.7 | Very low | 166 Ų | 166 | 135.7 Ų | 135.7 | 87% | 0.869 | 77% | 0.773 | S | S | * | * | trans | -41 | 135.3 | 159.6 | -146.8 | 73.2 | 0 | 0 | 0 | 112.2 | ||||
| 26 | T | 35.4 | Very low | 41.5 | Very low | 138 Ų | 138 | 132.5 Ų | 132.5 | 85% | 0.847 | 77% | 0.771 | S | S | * | * | 178.9 | 121.5 | 125.9 | -46.9 | 0 | 0 | 0 | 0 | 108.5 | |||||
| 27 | Q | 37.5 | Very low | 41 | Very low | 180 Ų | 180 | 133.7 Ų | 133.7 | 84% | 0.841 | 77% | 0.772 | S | S | * | * | trans | -76.5 | -173.7 | 166.7 | -89.3 | -158.8 | -19.5 | 0 | 0 | 110.7 | ||||
| 28 | P | 49.6 | Very low | 39.6 | Very low | 107 Ų | 107 | 137.4 Ų | 137.4 | 70% | 0.695 | 79% | 0.787 | S | S | * | * | cis | -139.8 | -173.7 | 7.5 | 37.3 | -15.6 | 0 | 0 | 0 | 116.2 | ||||
| 29 | S | 31.4 | Very low | 38.5 | Very low | 114 Ų | 114 | 137 Ų | 137 | 80% | 0.797 | 79% | 0.788 | S | S | * | * | trans | 121.6 | 98.7 | 151.3 | -49.7 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 30 | G | 30.1 | Very low | 37.4 | Very low | 72 Ų | 72 | 137.4 Ų | 137.4 | 74% | 0.742 | 79% | 0.79 | S | S | * | * | 90.9 | 130.3 | 93.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | |||||
| 31 | T | 31.8 | Very low | 37.1 | Very low | 134 Ų | 134 | 136.7 Ų | 136.7 | 82% | 0.822 | 79% | 0.787 | S | S | * | * | cis | -177.5 | 131.9 | 39 | -67 | 0 | 0 | 0 | 0 | 107 | ||||
| 32 | E | 33.2 | Very low | 36.2 | Very low | 153 Ų | 153 | 141 Ų | 141 | 72% | 0.715 | 80% | 0.797 | S | S | * | * | trans | 77.6 | 131.7 | 141.6 | -70.3 | -69.5 | 99.7 | 0 | 0 | 125.2 | ||||
| 33 | L | 32.9 | Very low | 35.6 | Very low | 137 Ų | 137 | 142.7 Ų | 142.7 | 72% | 0.717 | 81% | 0.806 | S | S | * | * | trans | 82.3 | 99.9 | 139.4 | -65.5 | 160.7 | 0 | 0 | 0 | 121.1 | ||||
| 34 | S | 33.2 | Very low | 36.5 | Very low | 120 Ų | 120 | 139.8 Ų | 139.8 | 84% | 0.839 | 80% | 0.803 | S | S | * | * | -175.7 | 129.5 | 95.6 | -84.8 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 35 | Q | 37.4 | Very low | 36.2 | Very low | 183 Ų | 183 | 139.3 Ų | 139.3 | 86% | 0.855 | 81% | 0.806 | S | S | * | * | trans | -81.8 | 148.2 | 173.3 | -63.3 | 168.2 | -23.6 | 0 | 0 | 110.5 | ||||
| 36 | S | 35.6 | Very low | 35.9 | Very low | 118 Ų | 118 | 136 Ų | 136 | 83% | 0.825 | 80% | 0.802 | S | S | * | * | 169 | 157.3 | 109.5 | 58.9 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 37 | P | 47.9 | Very low | 36.8 | Very low | 109 Ų | 109 | 134.9 Ų | 134.9 | 71% | 0.708 | 80% | 0.798 | S | S | * | * | trans | -121.4 | 170 | -149.9 | 41.1 | -27.4 | 0 | 0 | 0 | 113.3 | ||||
| 38 | L | 31.4 | Very low | 37.3 | Very low | 178 Ų | 178 | 131.7 Ų | 131.7 | 93% | 0.932 | 79% | 0.793 | S | S | * | * | trans | -143.6 | 122.4 | 152.6 | -74.6 | -179.4 | 0 | 0 | 0 | 111.6 | ||||
| 39 | E | 33.2 | Very low | 36.7 | Very low | 183 Ų | 183 | 132.7 Ų | 132.7 | 86% | 0.855 | 80% | 0.797 | S | S | * | * | trans | -74.6 | 155.6 | 173 | -66.6 | -156.9 | 126.8 | 0 | 0 | 112.7 | ||||
| 40 | L | 31.7 | Very low | 37.1 | Very low | 166 Ų | 166 | 134.2 Ų | 134.2 | 87% | 0.869 | 80% | 0.796 | S | S | * | * | trans | -119.9 | 130.1 | 159.7 | -114.8 | 102.1 | 0 | 0 | 0 | 110.1 | ||||
| 41 | H | 34.4 | Very low | 37.4 | Very low | 165 Ų | 165 | 140.6 Ų | 140.6 | 76% | 0.764 | 80% | 0.803 | S | S | * | * | trans | -87.5 | 147.8 | -177.8 | 47.2 | -88.2 | 0 | 0 | 0 | 112.2 | ||||
| 42 | N | 32.6 | Very low | 37.6 | Very low | 146 Ų | 146 | 142.4 Ų | 142.4 | 78% | 0.781 | 80% | 0.802 | S | S | * | * | trans | -66.9 | 161.1 | 162.9 | -67.1 | -26.7 | 0 | 0 | 0 | 109.7 | ||||
| 43 | T | 34 | Very low | 38.2 | Very low | 130 Ų | 130 | 140 Ų | 140 | 80% | 0.798 | 80% | 0.8 | S | S | * | * | cis | -177.3 | -165 | 47.8 | -25.6 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 44 | P | 55.8 | Low | 38.1 | Very low | 119 Ų | 119 | 138.3 Ų | 138.3 | 77% | 0.773 | 80% | 0.795 | S | S | * | * | -122.3 | 174.6 | -119.9 | 42.7 | -23.3 | 0 | 0 | 0 | 116.3 | |||||
| 45 | A | 29.1 | Very low | 38.4 | Very low | 107 Ų | 107 | 141.8 Ų | 141.8 | 88% | 0.884 | 80% | 0.798 | S | S | * | * | trans | -164.6 | 152.4 | 155.5 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 46 | A | 36.8 | Very low | 38.1 | Very low | 96 Ų | 96 | 136.7 Ų | 136.7 | 79% | 0.793 | 80% | 0.795 | S | S | * | * | trans | -86.7 | 175 | -161.4 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 47 | P | 54.3 | Low | 38.7 | Very low | 116 Ų | 116 | 140.9 Ų | 140.9 | 75% | 0.753 | 80% | 0.802 | S | S | * | * | trans | -89.3 | -171 | -170.6 | 42.4 | -35.4 | 0 | 0 | 0 | 111.2 | ||||
| 48 | P | 47.8 | Very low | 38.3 | Very low | 113 Ų | 113 | 138.9 Ų | 138.9 | 73% | 0.734 | 80% | 0.801 | S | S | * | * | cis | -148.5 | -166.1 | 22.8 | 34.4 | -7.1 | 0 | 0 | 0 | 116.8 | ||||
| 49 | V | 35.3 | Very low | 39 | Very low | 128 Ų | 128 | 138.5 Ų | 138.5 | 78% | 0.776 | 79% | 0.794 | S | S | * | * | trans | 123 | 118.7 | 144 | -173.5 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 50 | D | 41.3 | Very low | 39.3 | Very low | 146 Ų | 146 | 135.4 Ų | 135.4 | 78% | 0.781 | 79% | 0.788 | S | S | * | * | trans | -59.2 | 145.5 | 172 | -53.9 | -73.9 | 0 | 0 | 0 | 114 | ||||
| 51 | K | 36.5 | Very low | 40.5 | Very low | 205 Ų | 205 | 135.8 Ų | 135.8 | 89% | 0.891 | 79% | 0.789 | S | S | * | * | trans | 175 | 111.1 | 137.3 | -94.1 | 160.7 | -168.6 | -168.2 | 0 | 111.4 | ||||
| 52 | E | 34.9 | Very low | 41.4 | Very low | 172 Ų | 172 | 132.2 Ų | 132.2 | 80% | 0.804 | 78% | 0.783 | S | S | * | * | trans | -63.9 | 164.2 | 148.9 | -83.1 | -78.6 | 149.5 | 0 | 0 | 109.3 | ||||
| 53 | P | 46.8 | Very low | 42.7 | Very low | 104 Ų | 104 | 132.7 Ų | 132.7 | 68% | 0.675 | 78% | 0.78 | S | S | * | * | cis | -148.8 | -179.5 | 28.7 | 39.2 | -15.8 | 0 | 0 | 0 | 118 | ||||
| 54 | T | 29.7 | Very low | 44.1 | Very low | 100 Ų | 100 | 135.6 Ų | 135.6 | 61% | 0.613 | 78% | 0.777 | S | S | * | * | trans | 98 | 103.9 | 139.8 | -51.6 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 55 | Q | 40 | Very low | 44.6 | Very low | 193 Ų | 193 | 138.4 Ų | 138.4 | 90% | 0.902 | 78% | 0.777 | S | S | * | * | trans | 53.1 | 120.8 | 132.8 | -58.7 | -179.7 | -19.7 | 0 | 0 | 120.4 | ||||
| 56 | G | 32.2 | Very low | 46.5 | Very low | 77 Ų | 77 | 140.9 Ų | 140.9 | 79% | 0.794 | 77% | 0.768 | S | S | * | * | trans | -168.2 | 109.4 | 159.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 57 | E | 46.9 | Very low | 48.4 | Very low | 206 Ų | 206 | 140.7 Ų | 140.7 | 96% | 0.963 | 76% | 0.759 | S | S | * | * | trans | -62.6 | 141.7 | 179.6 | -59 | -179.7 | 145.4 | 0 | 0 | 111.8 | ||||
| 58 | G | 40.7 | Very low | 49.4 | Very low | 66 Ų | 66 | 141.2 Ų | 141.2 | 68% | 0.68 | 77% | 0.765 | S | S | * | * | trans | 149.9 | 54.7 | 175 | 0 | 0 | 0 | 0 | 0 | 113.3 | T60 | G58-T60 PolarHBondContact O-N 3.15Š| ||
| 59 | Q | 44.3 | Very low | 50.9 | Low | 171 Ų | 171 | 138.1 Ų | 138.1 | 80% | 0.799 | 75% | 0.753 | S | S | * | * | trans | -77.7 | 82 | 170.5 | -80 | -179.1 | 33.9 | 0 | 0 | 109.7 | I61 | Q59-I61 PolarHBondContact O-N 3.33Š| ||
| 60 | T | 41.3 | Very low | 53.1 | Low | 118 Ų | 118 | 136.1 Ų | 136.1 | 72% | 0.724 | 74% | 0.738 | S | S | * | * | trans | -48 | 132.3 | 141.6 | 44.6 | 0 | 0 | 0 | 0 | 107.6 | G58 S62 | G58-T60 PolarHBondContact O-N 3.15Å; T60-S62 PolarHBondContact O-N 3.16Å | ||
| 61 | I | 56.3 | Low | 55 | Low | 173 Ų | 173 | 136.8 Ų | 136.8 | 89% | 0.887 | 73% | 0.734 | S | S | * | * | trans | -64.8 | 80.7 | 179.6 | -57.8 | 165.1 | 0 | 0 | 0 | 107.7 | Q59 Q63 | Q59-I61 PolarHBondContact O-N 3.33Å; I61-Q63 PolarHBondContact O-N 3.29Å | ||
| 62 | S | 52.4 | Low | 57.2 | Low | 91 Ų | 91 | 131.3 Ų | 131.3 | 64% | 0.636 | 73% | 0.727 | S | S | * | * | trans | -60.3 | 121.2 | 162.8 | -79.4 | 0 | 0 | 0 | 0 | 105.5 | T60 R64 | T60-S62 PolarHBondContact O-N 3.16Å; S62-R64 VanDerWaalsContact C-N 3.31Å; S62-R64 PolarHBondContact O-N 2.96Å | ||
| 63 | Q | 60.5 | Low | 59.3 | Low | 155 Ų | 155 | 127.5 Ų | 127.5 | 72% | 0.724 | 73% | 0.725 | S | S | * | * | trans | -42.9 | 104.4 | 161.6 | -74.9 | 178.8 | -24.9 | 0 | 0 | 107.1 | I61 F65 | I61-Q63 PolarHBondContact O-N 3.29Å; Q63-F65 HydrophobicContact CB-CD2 4.49Å; Q63-F65 HydrophobicContact CB-CE2 4.15Å; Q63-F65 WeakPolarHBondContact O-CD2 3.27Å; Q63-F65 PolarHBondContact O-N 2.94Å | ||
| 64 | R | 62.4 | Low | 61.1 | Low | 191 Ų | 191 | 126.3 Ų | 126.3 | 72% | 0.721 | 72% | 0.716 | S | S | * | * | trans | -68.3 | 93.5 | 174.4 | -74.9 | -171.2 | -179.2 | 166.5 | 1.5 | 105.3 | S62 F66 | S62-R64 VanDerWaalsContact C-N 3.31Å; S62-R64 PolarHBondContact O-N 2.96Å; R64-F66 VanDerWaalsContact C-N 3.3Å; R64-F66 PolarHBondContact O-N 2.84Å | ||
| 65 | F | 66.6 | Low | 63.8 | Low | 178 Ų | 178 | 131.5 Ų | 131.5 | 78% | 0.781 | 73% | 0.73 | S | S | * | * | trans | -61.1 | 102.9 | 160.8 | -72.4 | -84.4 | 0 | 0 | 0 | 105.6 | Q63 P67 | Q63-F65 HydrophobicContact CB-CD2 4.49Å; Q63-F65 HydrophobicContact CB-CE2 4.15Å; Q63-F65 WeakPolarHBondContact O-CD2 3.27Å; Q63-F65 PolarHBondContact O-N 2.94Å; F65-P67 WeakPolarHBondContact O-CD 3.45Å | ||
| 66 | F | 70.1 | Confident | 65.9 | Low | 160 Ų | 160 | 127.7 Ų | 127.7 | 70% | 0.702 | 71% | 0.714 | S | S | * | * | trans | -60.9 | 124.7 | 172 | -71.7 | -81.6 | 0 | 0 | 0 | 106.9 | R64 S68 I70 | R64-F66 VanDerWaalsContact C-N 3.3Å; R64-F66 PolarHBondContact O-N 2.84Å; F66-S68 PolarHBondContact O-N 2.69Å; F66-S68 VanDerWaalsContact O-N 3.15Å; F66-I70 HydrophobicContact CB-CD1 3.9Å; F66-I70 HydrophobicContact CD1-CD1 3.75Å; F66-I70 HydrophobicContact CG-CD1 4.31Å | ||
| 67 | P | 76.3 | Confident | 68.4 | Low | 92 Ų | 92 | 127.4 Ų | 127.4 | 60% | 0.597 | 70% | 0.7 | S | S | * | * | trans | -54.5 | 127.1 | 174.6 | 16.5 | -28.1 | 0 | 0 | 0 | 108.9 | F65 G69 I70 | F65-P67 WeakPolarHBondContact O-CD 3.45Å; P67-G69 PolarHBondContact O-N 2.87Å; P67-I70 HydrophobicContact CG-CD1 4.05Å; P67-I70 HydrophobicContact CG-CG1 3.78Å; P67-I70 WeakPolarHBondContact O-CG1 3.43Å; P67-I70 PolarHBondContact O-N 3.22Å | ||
| 68 | S | 75.8 | Confident | 70 | Confident | 127 Ų | 127 | 121.5 Ų | 121.5 | 89% | 0.888 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.9 | 113.3 | 175.1 | 56.8 | 0 | 0 | 0 | 0 | 107.8 | F66 | F66-S68 PolarHBondContact O-N 2.69Å; F66-S68 VanDerWaalsContact O-N 3.15Å |
| 69 | G | 77.8 | Confident | 71.9 | Confident | 47 Ų | 47 | 126 Ų | 126 | 49% | 0.485 | 69% | 0.69 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 114.5 | 14.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 116.6 | P67 F71 A72 | P67-G69 PolarHBondContact O-N 2.87Å; G69-F71 PolarHBondContact O-N 3.46Å; G69-A72 VanDerWaalsContact O-CB 3.27Å; G69-A72 WeakPolarHBondContact O-CB 3.4Å; G69-A72 PolarHBondContact O-N 2.78Å |
| 70 | I | 83.1 | Confident | 73.5 | Confident | 87 Ų | 87 | 121.8 Ų | 121.8 | 45% | 0.446 | 68% | 0.679 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -49.6 | -34.3 | 170.9 | -65.6 | 162.2 | 0 | 0 | 0 | 112.1 | F66 P67 | F66-I70 HydrophobicContact CB-CD1 3.9Å; F66-I70 HydrophobicContact CD1-CD1 3.75Å; F66-I70 HydrophobicContact CG-CD1 4.31Å; P67-I70 HydrophobicContact CG-CD1 4.05Å; P67-I70 HydrophobicContact CG-CG1 3.78Å; P67-I70 WeakPolarHBondContact O-CG1 3.43Å; P67-I70 PolarHBondContact O-N 3.22Å |
| 71 | F | 80.9 | Confident | 75.2 | Confident | 160 Ų | 160 | 122.7 Ų | 122.7 | 70% | 0.702 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.7 | 6.5 | 179.8 | -57.3 | -72.1 | 0 | 0 | 0 | 114 | G69 A73 T74 | G69-F71 PolarHBondContact O-N 3.46Å; F71-A73 PolarHBondContact O-N 3.22Å; F71-T74 WeakPolarHBondContact O-CB 3.33Å; F71-T74 PolarHBondContact O-N 3.07Å |
| 72 | A | 81.7 | Confident | 76.4 | Confident | 90 Ų | 90 | 118.8 Ų | 118.8 | 74% | 0.744 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.7 | -26.7 | -175 | 0 | 0 | 0 | 0 | 0 | 112.9 | G69 | G69-A72 VanDerWaalsContact O-CB 3.27Å; G69-A72 WeakPolarHBondContact O-CB 3.4Å; G69-A72 PolarHBondContact O-N 2.78Å |
| 73 | A | 80 | Confident | 77.6 | Confident | 92 Ų | 92 | 122.3 Ų | 122.3 | 76% | 0.76 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.6 | -6.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | F71 K75 | F71-A73 PolarHBondContact O-N 3.22Å; A73-K75 PolarHBondContact O-N 2.87Å; A73-K75 VanDerWaalsContact O-N 3.14Å |
| 74 | T | 85.3 | Confident | 78.1 | Confident | 78 Ų | 78 | 120.4 Ų | 120.4 | 48% | 0.479 | 67% | 0.669 | S | S | . | * | trans | -82 | 99.2 | -175.3 | -47.1 | 0 | 0 | 0 | 0 | 110 | F71 I76 | F71-T74 WeakPolarHBondContact O-CB 3.33Å; F71-T74 PolarHBondContact O-N 3.07Å; T74-I76 HydrophobicContact CG2-CD1 4.3Å; T74-I76 HydrophobicContact CG2-CG1 3.85Å; T74-I76 PolarHBondContact O-N 3.22Å | ||
| 75 | K | 86.2 | Confident | 78 | Confident | 210 Ų | 210 | 117 Ų | 117 | 91% | 0.913 | 66% | 0.664 | S | S | * | * | trans | -85.7 | 95.1 | 174.1 | -62.4 | -169.8 | -179.5 | -176.7 | 0 | 110 | A73 | A73-K75 PolarHBondContact O-N 2.87Å; A73-K75 VanDerWaalsContact O-N 3.14Å | ||
| 76 | I | 82.2 | Confident | 77.7 | Confident | 113 Ų | 113 | 113.7 Ų | 113.7 | 58% | 0.579 | 66% | 0.663 | S | S | * | * | trans | -88.6 | 113 | 173.8 | -50.7 | 177.9 | 0 | 0 | 0 | 107.8 | T74 S80 L81 | T74-I76 HydrophobicContact CG2-CD1 4.3Å; T74-I76 HydrophobicContact CG2-CG1 3.85Å; T74-I76 PolarHBondContact O-N 3.22Å; I76-S80 WeakPolarHBondContact CG2-OG 3.36Å; I76-L81 HydrophobicContact CG2-CD1 3.6Å | ||
| 77 | S | 86.6 | Confident | 76.9 | Confident | 70 Ų | 70 | 114.6 Ų | 114.6 | 49% | 0.49 | 67% | 0.667 | S | S | . | * | trans | -71.2 | 145.8 | 174.5 | 178.8 | 0 | 0 | 0 | 0 | 110.1 | E79 S80 | S77-E79 PolarHBondContact O-N 3.14Å; S77-E79 VanDerWaalsContact O-N 3.16Å; S77-S80 PolarHBondContact O-N 3.44Å; S77-S80 PolarHBondContact O-OG 3Å | ||
| 78 | A | 79.9 | Confident | 76 | Confident | 83 Ų | 83 | 118.5 Ų | 118.5 | 69% | 0.686 | 68% | 0.677 | S | S | * | * | G | 310 helix | trans | -58 | -31.2 | 179 | 0 | 0 | 0 | 0 | 0 | 112.5 | S80 L81 | A78-S80 PolarHBondContact O-N 3.47Å; A78-L81 WeakPolarHBondContact O-CB 3.44Å; A78-L81 PolarHBondContact O-N 3.31Å |
| 79 | E | 79.8 | Confident | 74.8 | Confident | 161 Ų | 161 | 121.3 Ų | 121.3 | 75% | 0.752 | 68% | 0.677 | S | S | * | * | G | 310 helix | trans | -68.3 | -32 | 178.6 | -63.5 | 179.1 | 172.7 | 0 | 0 | 112.6 | S77 L81 V82 | S77-E79 PolarHBondContact O-N 3.14Å; S77-E79 VanDerWaalsContact O-N 3.16Å; E79-L81 PolarHBondContact O-N 3.06Å; E79-V82 PolarHBondContact O-N 3.43Å; E79-V82 VanDerWaalsContact O-N 3.15Å |
| 80 | S | 77.6 | Confident | 73.2 | Confident | 82 Ų | 82 | 124.1 Ų | 124.1 | 57% | 0.573 | 69% | 0.687 | S | S | * | * | G | 310 helix | trans | -74 | -15.2 | 177.7 | 68.9 | 0 | 0 | 0 | 0 | 113.3 | I76 S77 A78 V82 | I76-S80 WeakPolarHBondContact CG2-OG 3.36Å; S77-S80 PolarHBondContact O-N 3.44Å; S77-S80 PolarHBondContact O-OG 3Å; A78-S80 PolarHBondContact O-N 3.47Å; S80-V82 VanDerWaalsContact C-N 3.27Å |
| 81 | L | 78.6 | Confident | 71.4 | Confident | 136 Ų | 136 | 125.8 Ų | 125.8 | 71% | 0.712 | 70% | 0.704 | S | S | * | * | G | 310 helix | trans | -77.8 | -17.2 | 172.7 | -119.9 | 74.3 | 0 | 0 | 0 | 112.2 | I76 A78 E79 Q83 | I76-L81 HydrophobicContact CG2-CD1 3.6Å; A78-L81 WeakPolarHBondContact O-CB 3.44Å; A78-L81 PolarHBondContact O-N 3.31Å; E79-L81 PolarHBondContact O-N 3.06Å; L81-Q83 PolarHBondContact O-N 3.49Å |
| 82 | V | 80.6 | Confident | 69.9 | Low | 91 Ų | 91 | 126.1 Ų | 126.1 | 55% | 0.552 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -87.5 | 89.8 | 177.3 | -169.7 | 0 | 0 | 0 | 0 | 107.7 | E79 S80 T84 | E79-V82 PolarHBondContact O-N 3.43Å; E79-V82 VanDerWaalsContact O-N 3.15Å; S80-V82 VanDerWaalsContact C-N 3.27Å; V82-T84 VanDerWaalsContact C-N 3.28Å; V82-T84 HydrophobicContact CG1-CG2 3.93Å; V82-T84 PolarHBondContact O-N 3.37Å |
| 83 | Q | 77.4 | Confident | 68.3 | Low | 165 Ų | 165 | 128.4 Ų | 128.4 | 77% | 0.771 | 71% | 0.712 | S | S | * | * | trans | -69.6 | 87.1 | 171.7 | -174.3 | 175.5 | -8.2 | 0 | 0 | 109.3 | L81 L85 | L81-Q83 PolarHBondContact O-N 3.49Å; Q83-L85 PolarHBondContact O-N 3.3Å | ||
| 84 | T | 70.6 | Confident | 66.5 | Low | 116 Ų | 116 | 131.6 Ų | 131.6 | 71% | 0.712 | 71% | 0.711 | S | S | * | * | trans | -81 | 108.5 | 167.5 | 46.7 | 0 | 0 | 0 | 0 | 108.4 | V82 S86 | V82-T84 VanDerWaalsContact C-N 3.28Å; V82-T84 HydrophobicContact CG1-CG2 3.93Å; V82-T84 PolarHBondContact O-N 3.37Å; T84-S86 PolarHBondContact O-N 3.31Å | ||
| 85 | L | 60.2 | Low | 64.4 | Low | 118 Ų | 118 | 133.4 Ų | 133.4 | 62% | 0.618 | 72% | 0.724 | S | S | * | * | trans | -71.3 | 98.3 | 166.5 | -68.7 | 175.6 | 0 | 0 | 0 | 107.6 | Q83 F87 | Q83-L85 PolarHBondContact O-N 3.3Å; L85-F87 HydrophobicContact CB-CD2 4.37Å; L85-F87 HydrophobicContact CB-CE2 3.91Å; L85-F87 HydrophobicContact CB-CZ 4.44Å; L85-F87 HydrophobicContact CD1-CZ 4.43Å; L85-F87 WeakPolarHBondContact O-CD2 3.46Å; L85-F87 PolarHBondContact O-N 2.9Å; L85-F87 VanDerWaalsContact O-N 3.14Å | ||
| 86 | S | 60.5 | Low | 62.2 | Low | 109 Ų | 109 | 129.5 Ų | 129.5 | 76% | 0.762 | 72% | 0.718 | S | S | * | * | trans | -71.8 | 101.8 | 166.4 | 54.4 | 0 | 0 | 0 | 0 | 107.9 | T84 E88 | T84-S86 PolarHBondContact O-N 3.31Å; S86-E88 PolarHBondContact O-N 3.14Å | ||
| 87 | F | 54.8 | Low | 60.4 | Low | 179 Ų | 179 | 130.8 Ų | 130.8 | 79% | 0.785 | 73% | 0.725 | S | S | * | * | trans | -72.7 | 106.1 | 165.9 | -70.1 | -87 | 0 | 0 | 0 | 107.3 | L85 E89 | L85-F87 HydrophobicContact CB-CD2 4.37Å; L85-F87 HydrophobicContact CB-CE2 3.91Å; L85-F87 HydrophobicContact CB-CZ 4.44Å; L85-F87 HydrophobicContact CD1-CZ 4.43Å; L85-F87 WeakPolarHBondContact O-CD2 3.46Å; L85-F87 PolarHBondContact O-N 2.9Å; L85-F87 VanDerWaalsContact O-N 3.14Å; F87-E89 PolarHBondContact O-N 3.23Å; F87-E89 VanDerWaalsContact O-N 3.07Å | ||
| 88 | E | 55.6 | Low | 58.6 | Low | 175 Ų | 175 | 134.4 Ų | 134.4 | 82% | 0.818 | 74% | 0.744 | S | S | * | * | trans | -60.7 | 108.4 | 163.6 | -162 | 100.7 | -177.1 | 0 | 0 | 106.9 | S86 C90 | S86-E88 PolarHBondContact O-N 3.14Å; E88-C90 VanDerWaalsContact C-N 3.3Å; E88-C90 PolarHBondContact O-N 3.37Å | ||
| 89 | E | 51.4 | Low | 56.6 | Low | 186 Ų | 186 | 132.8 Ų | 132.8 | 87% | 0.869 | 74% | 0.736 | S | S | * | * | trans | -68 | 88.6 | 179 | -173.2 | 168.9 | -169.5 | 0 | 0 | 109 | F87 | F87-E89 PolarHBondContact O-N 3.23Å; F87-E89 VanDerWaalsContact O-N 3.07Å | ||
| 90 | C | 43.9 | Very low | 54.9 | Low | 105 Ų | 105 | 129.6 Ų | 129.6 | 71% | 0.709 | 73% | 0.729 | S | S | * | * | trans | -63.1 | 132.4 | 164.8 | -75.9 | 0 | 0 | 0 | 0 | 108.8 | E88 Q92 | E88-C90 VanDerWaalsContact C-N 3.3Å; E88-C90 PolarHBondContact O-N 3.37Å; C90-Q92 PolarHBondContact O-N 3.31Å | ||
| 91 | P | 45.5 | Very low | 53.6 | Low | 122 Ų | 122 | 132.1 Ų | 132.1 | 79% | 0.792 | 74% | 0.741 | S | S | * | * | trans | -66.4 | 111.8 | -173.7 | 26 | -32.1 | 0 | 0 | 0 | 110.6 | ||||
| 92 | Q | 50.2 | Low | 52.2 | Low | 167 Ų | 167 | 131.1 Ų | 131.1 | 78% | 0.78 | 73% | 0.732 | S | S | * | * | trans | 44.7 | 85.3 | 140.9 | -153.4 | -174.2 | 42.4 | 0 | 0 | 117.1 | C90 | C90-Q92 PolarHBondContact O-N 3.31Š| ||
| 93 | V | 48.4 | Very low | 50.9 | Low | 139 Ų | 139 | 132.8 Ų | 132.8 | 84% | 0.842 | 74% | 0.742 | S | S | * | * | trans | -131 | 107.3 | 141.4 | -166.6 | 0 | 0 | 0 | 0 | 107 | P95 | V93-P95 WeakPolarHBondContact O-CD 3.33Š| ||
| 94 | Q | 42.1 | Very low | 50.2 | Low | 159 Ų | 159 | 132 Ų | 132 | 74% | 0.743 | 74% | 0.736 | S | S | * | * | trans | -59.7 | 121.2 | -170.7 | -63.4 | -163.8 | -1.1 | 0 | 0 | 111.9 | T96 | Q94-T96 PolarHBondContact O-N 2.84Š| ||
| 95 | P | 40.4 | Very low | 50.4 | Low | 116 Ų | 116 | 134.7 Ų | 134.7 | 75% | 0.753 | 75% | 0.746 | S | S | * | * | trans | -74.3 | 115.8 | 161.6 | 29.3 | -27.8 | 0 | 0 | 0 | 107.4 | V93 I97 | V93-P95 WeakPolarHBondContact O-CD 3.33Å; P95-I97 PolarHBondContact O-N 3.41Å | ||
| 96 | T | 40.3 | Very low | 51.4 | Low | 127 Ų | 127 | 132.7 Ų | 132.7 | 78% | 0.779 | 73% | 0.732 | S | S | * | * | trans | -55.8 | 108 | 166 | -57.4 | 0 | 0 | 0 | 0 | 107.9 | Q94 T98 | Q94-T96 PolarHBondContact O-N 2.84Å; T96-T98 PolarHBondContact O-N 3.09Å; T96-T98 PolarHBondContact O-OG1 3.08Å | ||
| 97 | I | 45.2 | Very low | 52.7 | Low | 140 Ų | 140 | 130.7 Ų | 130.7 | 72% | 0.718 | 72% | 0.718 | S | S | * | * | trans | -46.3 | 101.1 | 170.2 | -59.2 | 163.3 | 0 | 0 | 0 | 107.1 | P95 G99 | P95-I97 PolarHBondContact O-N 3.41Å; I97-G99 PolarHBondContact O-N 2.93Å | ||
| 98 | T | 48.5 | Very low | 54.6 | Low | 147 Ų | 147 | 130.7 Ų | 130.7 | 90% | 0.902 | 72% | 0.718 | S | S | * | * | trans | -79.6 | 81.7 | 168.6 | -15.9 | 0 | 0 | 0 | 0 | 106.5 | T96 | T96-T98 PolarHBondContact O-N 3.09Å; T96-T98 PolarHBondContact O-OG1 3.08Å | ||
| 99 | G | 37.7 | Very low | 56.5 | Low | 49 Ų | 49 | 131 Ų | 131 | 51% | 0.505 | 72% | 0.716 | S | S | . | * | trans | 68 | 114 | 163.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | I97 V101 | I97-G99 PolarHBondContact O-N 2.93Å; G99-V101 PolarHBondContact O-N 3.25Å; G99-V101 VanDerWaalsContact O-N 3.08Å | ||
| 100 | P | 43 | Very low | 58.4 | Low | 93 Ų | 93 | 126.9 Ų | 126.9 | 60% | 0.604 | 70% | 0.697 | S | S | * | * | trans | -54.9 | 122.1 | 153.7 | -4.8 | 19.4 | 0 | 0 | 0 | 106.1 | E102 | P100-E102 HydrophobicContact CB-CG 4Å; P100-E102 PolarHBondContact O-N 3.19Å | ||
| 101 | V | 51.8 | Low | 60.9 | Low | 136 Ų | 136 | 128 Ų | 128 | 82% | 0.824 | 69% | 0.69 | S | S | * | * | trans | -68.2 | 79.2 | 157.4 | 177.6 | 0 | 0 | 0 | 0 | 104.2 | G99 T103 | G99-V101 PolarHBondContact O-N 3.25Å; G99-V101 VanDerWaalsContact O-N 3.08Å; V101-T103 PolarHBondContact O-N 2.92Å | ||
| 102 | E | 48.4 | Very low | 63.3 | Low | 115 Ų | 115 | 127.6 Ų | 127.6 | 54% | 0.537 | 68% | 0.679 | S | S | . | * | trans | -52.2 | 113.2 | 170.6 | -65.7 | -177.8 | 162 | 0 | 0 | 104.3 | P100 K104 | P100-E102 HydrophobicContact CB-CG 4Å; P100-E102 PolarHBondContact O-N 3.19Å; E102-K104 HydrophobicContact CB-CG 3.84Å; E102-K104 PolarHBondContact O-N 2.92Å; E102-K104 WeakPolarHBondContact OE2-CE 3.31Å; E102-K104 IonicContact OE2-NZ 3.01Å; E102-K104 PolarHBondContact OE2-NZ 3.31Å | ||
| 103 | T | 54 | Low | 65.5 | Low | 125 Ų | 125 | 126.3 Ų | 126.3 | 77% | 0.767 | 67% | 0.671 | S | S | * | * | trans | -67.2 | 58.8 | 162.9 | 53.2 | 0 | 0 | 0 | 0 | 107.4 | V101 L105 | V101-T103 PolarHBondContact O-N 2.92Å; T103-L105 PolarHBondContact O-N 3.31Å | ||
| 104 | K | 62.1 | Low | 67.7 | Low | 148 Ų | 148 | 122 Ų | 122 | 64% | 0.643 | 64% | 0.641 | S | S | * | * | trans | -52.4 | 127.7 | 159.4 | -62.8 | -142.5 | -178.2 | -170 | 0 | 104.3 | E102 K106 | E102-K104 HydrophobicContact CB-CG 3.84Å; E102-K104 PolarHBondContact O-N 2.92Å; E102-K104 WeakPolarHBondContact OE2-CE 3.31Å; E102-K104 IonicContact OE2-NZ 3.01Å; E102-K104 PolarHBondContact OE2-NZ 3.31Å; K104-K106 WeakPolarHBondContact O-CG 3.35Å; K104-K106 PolarHBondContact O-N 3.11Å | ||
| 105 | L | 74.9 | Confident | 70.3 | Confident | 174 Ų | 174 | 122.7 Ų | 122.7 | 91% | 0.911 | 64% | 0.637 | S | S | * | * | trans | -53.4 | 92 | 177.6 | -69.2 | 166 | 0 | 0 | 0 | 107.8 | T103 S107 | T103-L105 PolarHBondContact O-N 3.31Å; L105-S107 PolarHBondContact O-N 3.15Å | ||
| 106 | K | 80.5 | Confident | 73 | Confident | 76 Ų | 76 | 124.4 Ų | 124.4 | 33% | 0.33 | 63% | 0.628 | S | S | . | * | trans | -56.8 | 128.4 | -171.9 | -53.1 | -173 | -162.5 | -176.1 | 0 | 107.1 | K104 E110 K111 E114 | K104-K106 WeakPolarHBondContact O-CG 3.35Å; K104-K106 PolarHBondContact O-N 3.11Å; K106-E110 HydrophobicContact CB-CB 4.32Å; K106-E110 HydrophobicContact CB-CG 4.33Å; K106-K111 HydrophobicContact CB-CD 4.24Å; K106-K111 HydrophobicContact CB-CG 3.65Å; K106-K111 HydrophobicContact CD-CG 4.41Å; K106-E114 IonicContact NZ-OE1 2.72Å; K106-E114 PolarHBondContact NZ-OE1 3Å; K106-E114 IonicContact NZ-OE2 3.6Å; K106-E114 PolarHBondContact NZ-OE2 3.47Å | ||
| 107 | S | 89.1 | Confident | 75.7 | Confident | 66 Ų | 66 | 122.2 Ų | 122.2 | 46% | 0.462 | 61% | 0.61 | S | S | . | * | trans | -56.5 | 150.1 | 177.7 | 69.6 | 0 | 0 | 0 | 0 | 109.6 | L105 K109 E110 K111 | L105-S107 PolarHBondContact O-N 3.15Å; S107-K109 PolarHBondContact O-N 3.26Å; S107-E110 WeakPolarHBondContact O-CA 3.17Å; S107-E110 WeakPolarHBondContact O-CB 3.44Å; S107-E110 PolarHBondContact O-N 3.21Å; S107-E110 WeakPolarHBondContact OG-CB 3.05Å; S107-E110 PolarHBondContact OG-N 3.14Å; S107-K111 PolarHBondContact O-N 3.34Å | ||
| 108 | K | 94.2 | Very high | 78.2 | Confident | 180 Ų | 180 | 122.8 Ų | 122.8 | 78% | 0.783 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -50.8 | -35.5 | 176.6 | -177.1 | 178.4 | 178.4 | -179.6 | 0 | 112 | M112 | K108-M112 WeakPolarHBondContact O-CB 3.38Å; K108-M112 PolarHBondContact O-N 3.48Å |
| 109 | K | 94.2 | Very high | 80.5 | Confident | 181 Ų | 181 | 124.1 Ų | 124.1 | 79% | 0.787 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -62.6 | -44.4 | 175.6 | -175.5 | 176.7 | -179.4 | 179 | 0 | 112.1 | S107 M112 K113 | S107-K109 PolarHBondContact O-N 3.26Å; K109-M112 PolarHBondContact O-N 3.43Å; K109-K113 PolarHBondContact O-N 3.4Å |
| 110 | E | 93.1 | Very high | 83.4 | Confident | 99 Ų | 99 | 125.1 Ų | 125.1 | 46% | 0.463 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -67.8 | -44.4 | 177.9 | -172.6 | -178.5 | -179.4 | 0 | 0 | 111.8 | K106 S107 M112 K113 E114 | K106-E110 HydrophobicContact CB-CB 4.32Å; K106-E110 HydrophobicContact CB-CG 4.33Å; S107-E110 WeakPolarHBondContact O-CA 3.17Å; S107-E110 WeakPolarHBondContact O-CB 3.44Å; S107-E110 PolarHBondContact O-N 3.21Å; S107-E110 WeakPolarHBondContact OG-CB 3.05Å; S107-E110 PolarHBondContact OG-N 3.14Å; E110-M112 VanDerWaalsContact C-N 3.27Å; E110-M112 PolarHBondContact O-N 3.34Å; E110-K113 PolarHBondContact O-N 2.83Å; E110-K113 VanDerWaalsContact O-N 3.16Å; E110-E114 WeakPolarHBondContact O-CB 3.42Å; E110-E114 PolarHBondContact O-N 2.97Å |
| 111 | K | 95.4 | Very high | 86 | Confident | 129 Ų | 129 | 123.9 Ų | 123.9 | 56% | 0.561 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -61.2 | -37.2 | 175.7 | -60.6 | -175.6 | 95.3 | 164.4 | 0 | 111.9 | K106 S107 R115 | K106-K111 HydrophobicContact CB-CD 4.24Å; K106-K111 HydrophobicContact CB-CG 3.65Å; K106-K111 HydrophobicContact CD-CG 4.41Å; S107-K111 PolarHBondContact O-N 3.34Å; K111-R115 WeakPolarHBondContact O-CB 3.4Å; K111-R115 PolarHBondContact O-N 3.3Å |
| 112 | M | 95 | Very high | 88.2 | Confident | 114 Ų | 114 | 124.2 Ų | 124.2 | 56% | 0.562 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -65.9 | -45.4 | 174.7 | -174.4 | 64.3 | 75.7 | 0 | 0 | 111.6 | K108 K109 E110 R115 R116 | K108-M112 WeakPolarHBondContact O-CB 3.38Å; K108-M112 PolarHBondContact O-N 3.48Å; K109-M112 PolarHBondContact O-N 3.43Å; E110-M112 VanDerWaalsContact C-N 3.27Å; E110-M112 PolarHBondContact O-N 3.34Å; M112-R115 PolarHBondContact O-N 3.24Å; M112-R116 PolarHBondContact O-N 2.85Å |
| 113 | K | 96.4 | Very high | 90.6 | Very high | 140 Ų | 140 | 122.7 Ų | 122.7 | 61% | 0.609 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -60.8 | -47.9 | 176.2 | -173.3 | -177 | 177.3 | -170.5 | 0 | 110.7 | K109 E110 R115 R116 E117 | K109-K113 PolarHBondContact O-N 3.4Å; E110-K113 PolarHBondContact O-N 2.83Å; E110-K113 VanDerWaalsContact O-N 3.16Å; K113-R115 VanDerWaalsContact C-N 3.3Å; K113-R115 PolarHBondContact O-N 2.91Å; K113-R116 CarbonylContact O-C 3.6Å; K113-R116 WeakPolarHBondContact O-CB 3.47Å; K113-R116 PolarHBondContact O-N 3.5Å; K113-E117 HydrophobicContact CG-CG 4.21Å; K113-E117 WeakPolarHBondContact O-CG 2.64Å; K113-E117 PolarHBondContact O-N 3.35Å |
| 114 | E | 96.1 | Very high | 92.7 | Very high | 47 Ų | 47 | 119.3 Ų | 119.3 | 22% | 0.22 | 55% | 0.545 | C | S | . | . | H | α-helix | trans | -58.3 | -41.6 | 178.6 | -167.6 | -174.6 | -160.2 | 0 | 0 | 111.8 | K106 E110 E117 R118 | K106-E114 IonicContact NZ-OE1 2.72Å; K106-E114 PolarHBondContact NZ-OE1 3Å; K106-E114 IonicContact NZ-OE2 3.6Å; K106-E114 PolarHBondContact NZ-OE2 3.47Å; E110-E114 WeakPolarHBondContact O-CB 3.42Å; E110-E114 PolarHBondContact O-N 2.97Å; E114-E117 PolarHBondContact O-N 2.87Å; E114-R118 VanDerWaalsContact CG-NH1 3.31Å; E114-R118 WeakPolarHBondContact O-CB 3.32Å; E114-R118 VanDerWaalsContact O-CG 3.28Å; E114-R118 WeakPolarHBondContact O-CG 3.41Å; E114-R118 PolarHBondContact O-N 3.32Å; E114-R118 IonicContact OE1-CZ 3.89Å; E114-R118 IonicContact OE1-NH1 3.23Å; E114-R118 PolarHBondContact OE1-NH1 3.48Å; E114-R118 IonicContact OE1-NH2 3.82Å; E114-R118 PolarHBondContact OE1-NH2 2.73Å; E114-R118 IonicContact OE2-CZ 3.77Å; E114-R118 IonicContact OE2-NH1 3Å; E114-R118 PolarHBondContact OE2-NH1 2.89Å; E114-R118 IonicContact OE2-NH2 3.72Å |
| 115 | R | 96.7 | Very high | 94.3 | Very high | 175 Ų | 175 | 119.2 Ų | 119.2 | 66% | 0.66 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -62 | -44.3 | 174.1 | -174.1 | -177.4 | -68.4 | -179.6 | -3.7 | 111.8 | K111 M112 K113 W119 | K111-R115 WeakPolarHBondContact O-CB 3.4Å; K111-R115 PolarHBondContact O-N 3.3Å; M112-R115 PolarHBondContact O-N 3.24Å; K113-R115 VanDerWaalsContact C-N 3.3Å; K113-R115 PolarHBondContact O-N 2.91Å; R115-W119 WeakPolarHBondContact O-CB 3.45Å; R115-W119 PolarHBondContact O-N 3.47Å |
| 116 | R | 97.1 | Very high | 95.4 | Very high | 151 Ų | 151 | 114.5 Ų | 114.5 | 57% | 0.57 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -64.2 | -45.6 | 177.4 | -177.7 | 179.2 | 178.7 | -82.7 | -0.8 | 111.6 | M112 K113 W119 L120 | M112-R116 PolarHBondContact O-N 2.85Å; K113-R116 CarbonylContact O-C 3.6Å; K113-R116 WeakPolarHBondContact O-CB 3.47Å; K113-R116 PolarHBondContact O-N 3.5Å; R116-W119 PolarHBondContact O-N 3.35Å; R116-L120 HydrophobicContact CG-CD1 4.15Å; R116-L120 HydrophobicContact CG-CG 4.43Å; R116-L120 VanDerWaalsContact NH1-CD1 3.27Å; R116-L120 WeakPolarHBondContact O-CG 3.47Å; R116-L120 PolarHBondContact O-N 3.42Å |
| 117 | E | 96.8 | Very high | 96.2 | Very high | 82 Ų | 82 | 119.2 Ų | 119.2 | 38% | 0.383 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -63.1 | -44.3 | 178.4 | -68.7 | -55.3 | 140.8 | 0 | 0 | 111.3 | K113 E114 W119 L120 S121 | K113-E117 HydrophobicContact CG-CG 4.21Å; K113-E117 WeakPolarHBondContact O-CG 2.64Å; K113-E117 PolarHBondContact O-N 3.35Å; E114-E117 PolarHBondContact O-N 2.87Å; E117-W119 VanDerWaalsContact C-N 3.32Å; E117-W119 PolarHBondContact O-N 2.96Å; E117-L120 PolarHBondContact O-N 3.07Å; E117-S121 VanDerWaalsContact O-CB 3.28Å; E117-S121 WeakPolarHBondContact O-CB 3.34Å; E117-S121 PolarHBondContact O-N 3.45Å; E117-S121 PolarHBondContact O-OG 2.78Å |
| 118 | R | 97.4 | Very high | 96.6 | Very high | 152 Ų | 152 | 120.4 Ų | 120.4 | 57% | 0.574 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -58.7 | -43.6 | 173.5 | -77.2 | -179.9 | 178.5 | 124.8 | 2.1 | 112 | E114 K122 | E114-R118 VanDerWaalsContact CG-NH1 3.31Å; E114-R118 WeakPolarHBondContact O-CB 3.32Å; E114-R118 VanDerWaalsContact O-CG 3.28Å; E114-R118 WeakPolarHBondContact O-CG 3.41Å; E114-R118 PolarHBondContact O-N 3.32Å; E114-R118 IonicContact OE1-CZ 3.89Å; E114-R118 IonicContact OE1-NH1 3.23Å; E114-R118 PolarHBondContact OE1-NH1 3.48Å; E114-R118 IonicContact OE1-NH2 3.82Å; E114-R118 PolarHBondContact OE1-NH2 2.73Å; E114-R118 IonicContact OE2-CZ 3.77Å; E114-R118 IonicContact OE2-NH1 3Å; E114-R118 PolarHBondContact OE2-NH1 2.89Å; E114-R118 IonicContact OE2-NH2 3.72Å; R118-K122 WeakPolarHBondContact O-CB 3.27Å; R118-K122 PolarHBondContact O-N 3.01Å |
| 119 | W | 97.7 | Very high | 96.7 | Very high | 174 Ų | 174 | 114 Ų | 114 | 66% | 0.659 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -63.4 | -51.8 | 176.4 | -174.4 | -10.2 | 0 | 0 | 0 | 110.7 | R115 R116 E117 S121 K122 I123 | R115-W119 WeakPolarHBondContact O-CB 3.45Å; R115-W119 PolarHBondContact O-N 3.47Å; R116-W119 PolarHBondContact O-N 3.35Å; E117-W119 VanDerWaalsContact C-N 3.32Å; E117-W119 PolarHBondContact O-N 2.96Å; W119-S121 VanDerWaalsContact C-N 3.29Å; W119-S121 PolarHBondContact O-N 2.63Å; W119-K122 WeakPolarHBondContact O-CA 3.4Å; W119-K122 WeakPolarHBondContact O-CB 3.37Å; W119-K122 PolarHBondContact O-N 2.64Å; W119-I123 HydrophobicContact CG-CD1 4.4Å; W119-I123 PolarHBondContact O-N 3.19Å |
| 120 | L | 98 | Very high | 96.9 | Very high | 70 Ų | 70 | 111.9 Ų | 111.9 | 37% | 0.366 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -58.7 | -41.6 | 179.5 | -71.4 | 177.4 | 0 | 0 | 0 | 112.5 | R116 E117 K122 I123 S124 | R116-L120 HydrophobicContact CG-CD1 4.15Å; R116-L120 HydrophobicContact CG-CG 4.43Å; R116-L120 VanDerWaalsContact NH1-CD1 3.27Å; R116-L120 WeakPolarHBondContact O-CG 3.47Å; R116-L120 PolarHBondContact O-N 3.42Å; E117-L120 PolarHBondContact O-N 3.07Å; L120-K122 VanDerWaalsContact C-N 3.32Å; L120-K122 PolarHBondContact O-N 2.69Å; L120-I123 PolarHBondContact O-N 3.23Å; L120-S124 PolarHBondContact O-N 3.29Å; L120-S124 PolarHBondContact O-OG 3.26Å |
| 121 | S | 97.5 | Very high | 97 | Very high | 67 Ų | 67 | 113.5 Ų | 113.5 | 47% | 0.469 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62 | -39.8 | 175.4 | -56.3 | 0 | 0 | 0 | 0 | 111.5 | E117 W119 S124 F125 | E117-S121 VanDerWaalsContact O-CB 3.28Å; E117-S121 WeakPolarHBondContact O-CB 3.34Å; E117-S121 PolarHBondContact O-N 3.45Å; E117-S121 PolarHBondContact O-OG 2.78Å; W119-S121 VanDerWaalsContact C-N 3.29Å; W119-S121 PolarHBondContact O-N 2.63Å; S121-S124 WeakPolarHBondContact CA-OG 3.09Å; S121-S124 PolarHBondContact O-N 3.34Å; S121-S124 PolarHBondContact O-OG 3.3Å; S121-F125 VanDerWaalsContact O-CB 3.28Å; S121-F125 WeakPolarHBondContact O-CB 3.31Å; S121-F125 PolarHBondContact O-N 3.04Å |
| 122 | K | 98.3 | Very high | 96.9 | Very high | 143 Ų | 143 | 112.8 Ų | 112.8 | 62% | 0.622 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -64.6 | -43.3 | 174.3 | -175.3 | 175.3 | -177.9 | 178.3 | 0 | 111.8 | R118 W119 L120 I126 | R118-K122 WeakPolarHBondContact O-CB 3.27Å; R118-K122 PolarHBondContact O-N 3.01Å; W119-K122 WeakPolarHBondContact O-CA 3.4Å; W119-K122 WeakPolarHBondContact O-CB 3.37Å; W119-K122 PolarHBondContact O-N 2.64Å; L120-K122 VanDerWaalsContact C-N 3.32Å; L120-K122 PolarHBondContact O-N 2.69Å; K122-I126 HydrophobicContact CG-CD1 4.02Å; K122-I126 VanDerWaalsContact O-CG1 3.27Å; K122-I126 WeakPolarHBondContact O-CG1 3.3Å; K122-I126 PolarHBondContact O-N 2.91Å |
| 123 | I | 98 | Very high | 96.9 | Very high | 84 Ų | 84 | 113.9 Ų | 113.9 | 43% | 0.431 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.5 | -46.9 | 176.8 | -69.7 | 164.3 | 0 | 0 | 0 | 110.6 | W119 L120 F125 I126 R127 | W119-I123 HydrophobicContact CG-CD1 4.4Å; W119-I123 PolarHBondContact O-N 3.19Å; L120-I123 PolarHBondContact O-N 3.23Å; I123-F125 VanDerWaalsContact C-N 3.32Å; I123-F125 PolarHBondContact O-N 3.32Å; I123-I126 PolarHBondContact O-N 2.92Å; I123-R127 WeakPolarHBondContact O-CB 3.44Å; I123-R127 PolarHBondContact O-N 2.72Å |
| 124 | S | 97.3 | Very high | 96.9 | Very high | 54 Ų | 54 | 109.4 Ų | 109.4 | 38% | 0.378 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.1 | -42.9 | -179.3 | 61.1 | 0 | 0 | 0 | 0 | 111.1 | L120 S121 R127 E128 | L120-S124 PolarHBondContact O-N 3.29Å; L120-S124 PolarHBondContact O-OG 3.26Å; S121-S124 WeakPolarHBondContact CA-OG 3.09Å; S121-S124 PolarHBondContact O-N 3.34Å; S121-S124 PolarHBondContact O-OG 3.3Å; S124-R127 PolarHBondContact O-N 3.37Å; S124-E128 WeakPolarHBondContact O-CB 3.49Å; S124-E128 PolarHBondContact O-N 2.85Å |
| 125 | F | 97.6 | Very high | 96.7 | Very high | 146 Ų | 146 | 108.4 Ų | 108.4 | 64% | 0.64 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -59.4 | -47.6 | 176 | -177.5 | -95.1 | 0 | 0 | 0 | 112 | S121 I123 R127 E128 A129 | S121-F125 VanDerWaalsContact O-CB 3.28Å; S121-F125 WeakPolarHBondContact O-CB 3.31Å; S121-F125 PolarHBondContact O-N 3.04Å; I123-F125 VanDerWaalsContact C-N 3.32Å; I123-F125 PolarHBondContact O-N 3.32Å; F125-R127 VanDerWaalsContact C-N 3.33Å; F125-R127 PolarHBondContact O-N 3Å; F125-E128 PolarHBondContact O-N 3.09Å; F125-A129 WeakPolarHBondContact O-CB 3.32Å; F125-A129 PolarHBondContact O-N 2.96Å |
| 126 | I | 97.3 | Very high | 96.4 | Very high | 75 Ų | 75 | 104.7 Ų | 104.7 | 39% | 0.385 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.3 | -42.1 | 177.8 | -67.7 | 165.5 | 0 | 0 | 0 | 111 | K122 I123 A129 K130 | K122-I126 HydrophobicContact CG-CD1 4.02Å; K122-I126 VanDerWaalsContact O-CG1 3.27Å; K122-I126 WeakPolarHBondContact O-CG1 3.3Å; K122-I126 PolarHBondContact O-N 2.91Å; I123-I126 PolarHBondContact O-N 2.92Å; I126-A129 PolarHBondContact O-N 2.91Å; I126-K130 HydrophobicContact CG2-CD 4.25Å; I126-K130 WeakPolarHBondContact O-CB 3.35Å; I126-K130 WeakPolarHBondContact O-CG 3.29Å; I126-K130 PolarHBondContact O-N 2.87Å |
| 127 | R | 98 | Very high | 96.2 | Very high | 175 Ų | 175 | 100.3 Ų | 100.3 | 66% | 0.66 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -64.6 | -45.9 | -180 | -172.5 | -178.8 | 67.8 | 166.9 | 3.3 | 111.2 | I123 S124 F125 K130 E131 | I123-R127 WeakPolarHBondContact O-CB 3.44Å; I123-R127 PolarHBondContact O-N 2.72Å; S124-R127 PolarHBondContact O-N 3.37Å; F125-R127 VanDerWaalsContact C-N 3.33Å; F125-R127 PolarHBondContact O-N 3Å; R127-K130 PolarHBondContact O-N 2.9Å; R127-E131 WeakPolarHBondContact O-CB 3.48Å; R127-E131 PolarHBondContact O-N 3.47Å |
| 128 | E | 96.8 | Very high | 95.9 | Very high | 91 Ų | 91 | 105.2 Ų | 105.2 | 43% | 0.425 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.9 | -42.6 | 178.4 | -169.6 | -175.6 | 154.8 | 0 | 0 | 111.4 | S124 F125 K130 E131 K132 | S124-E128 WeakPolarHBondContact O-CB 3.49Å; S124-E128 PolarHBondContact O-N 2.85Å; F125-E128 PolarHBondContact O-N 3.09Å; E128-K130 PolarHBondContact O-N 3.43Å; E128-E131 PolarHBondContact O-N 3.35Å; E128-K132 HydrophobicContact CG-CD 4.23Å; E128-K132 WeakPolarHBondContact O-CB 3.31Å; E128-K132 WeakPolarHBondContact O-CG 3.39Å; E128-K132 PolarHBondContact O-N 2.88Å; E128-K132 VanDerWaalsContact OE1-CE 3.3Å; E128-K132 WeakPolarHBondContact OE1-CE 3.34Å; E128-K132 IonicContact OE1-NZ 3.3Å; E128-K132 PolarHBondContact OE1-NZ 2.9Å |
| 129 | A | 96.3 | Very high | 95.5 | Very high | 46 Ų | 46 | 102.2 Ų | 102.2 | 38% | 0.38 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.8 | -44.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | F125 I126 K132 Q133 | F125-A129 WeakPolarHBondContact O-CB 3.32Å; F125-A129 PolarHBondContact O-N 2.96Å; I126-A129 PolarHBondContact O-N 2.91Å; A129-K132 PolarHBondContact O-N 3.3Å; A129-Q133 WeakPolarHBondContact O-CB 3.3Å; A129-Q133 PolarHBondContact O-N 3.31Å |
| 130 | K | 97.6 | Very high | 95 | Very high | 136 Ų | 136 | 103.1 Ų | 103.1 | 59% | 0.591 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -65.2 | -40.7 | 176.1 | -75.2 | -177.5 | 176.2 | -172.6 | 0 | 112.6 | I126 R127 E128 Q133 A134 | I126-K130 HydrophobicContact CG2-CD 4.25Å; I126-K130 WeakPolarHBondContact O-CB 3.35Å; I126-K130 WeakPolarHBondContact O-CG 3.29Å; I126-K130 PolarHBondContact O-N 2.87Å; R127-K130 PolarHBondContact O-N 2.9Å; E128-K130 PolarHBondContact O-N 3.43Å; K130-Q133 PolarHBondContact O-N 3.49Å; K130-A134 WeakPolarHBondContact O-CB 3.28Å; K130-A134 PolarHBondContact O-N 3.47Å |
| 131 | E | 96.3 | Very high | 94.7 | Very high | 133 Ų | 133 | 103.6 Ų | 103.6 | 62% | 0.621 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -64.4 | -44.2 | 177.2 | -177.6 | 172.1 | -167.5 | 0 | 0 | 111.3 | R127 E128 A134 A135 | R127-E131 WeakPolarHBondContact O-CB 3.48Å; R127-E131 PolarHBondContact O-N 3.47Å; E128-E131 PolarHBondContact O-N 3.35Å; E131-A134 PolarHBondContact O-N 3.39Å; E131-A135 VanDerWaalsContact O-CB 3.31Å; E131-A135 WeakPolarHBondContact O-CB 3.4Å; E131-A135 PolarHBondContact O-N 3.42Å |
| 132 | K | 92.9 | Very high | 94.2 | Very high | 113 Ų | 113 | 104.6 Ų | 104.6 | 49% | 0.491 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -58.3 | -48.3 | 173.2 | -76.5 | 172.4 | 168 | 170.5 | 0 | 111.4 | E128 A129 A134 A135 E136 | E128-K132 HydrophobicContact CG-CD 4.23Å; E128-K132 WeakPolarHBondContact O-CB 3.31Å; E128-K132 WeakPolarHBondContact O-CG 3.39Å; E128-K132 PolarHBondContact O-N 2.88Å; E128-K132 VanDerWaalsContact OE1-CE 3.3Å; E128-K132 WeakPolarHBondContact OE1-CE 3.34Å; E128-K132 IonicContact OE1-NZ 3.3Å; E128-K132 PolarHBondContact OE1-NZ 2.9Å; A129-K132 PolarHBondContact O-N 3.3Å; K132-A134 PolarHBondContact O-N 2.87Å; K132-A135 PolarHBondContact O-N 3.46Å; K132-E136 PolarHBondContact O-N 2.95Å |
| 133 | Q | 94.9 | Very high | 93.3 | Very high | 138 Ų | 138 | 103.1 Ų | 103.1 | 65% | 0.645 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -61 | -44.7 | 177.3 | -173.1 | -175.1 | 16.4 | 0 | 0 | 112.4 | A129 K130 E136 A137 | A129-Q133 WeakPolarHBondContact O-CB 3.3Å; A129-Q133 PolarHBondContact O-N 3.31Å; K130-Q133 PolarHBondContact O-N 3.49Å; Q133-E136 PolarHBondContact O-N 2.91Å; Q133-A137 WeakPolarHBondContact O-CB 3.28Å; Q133-A137 PolarHBondContact O-N 3.29Å |
| 134 | A | 95.4 | Very high | 92.5 | Very high | 45 Ų | 45 | 104 Ų | 104 | 37% | 0.372 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -66.1 | -38.6 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | K130 E131 K132 A137 R138 | K130-A134 WeakPolarHBondContact O-CB 3.28Å; K130-A134 PolarHBondContact O-N 3.47Å; E131-A134 PolarHBondContact O-N 3.39Å; K132-A134 PolarHBondContact O-N 2.87Å; A134-A137 PolarHBondContact O-N 3.48Å; A134-R138 WeakPolarHBondContact O-CB 3.37Å; A134-R138 VanDerWaalsContact O-CG 3.29Å; A134-R138 WeakPolarHBondContact O-CG 3.49Å; A134-R138 PolarHBondContact O-N 2.74Å |
| 135 | A | 91.9 | Very high | 92.1 | Very high | 27 Ų | 27 | 108.5 Ų | 108.5 | 22% | 0.223 | 55% | 0.552 | C | S | . | * | H | α-helix | trans | -64.4 | -42.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | E131 K132 R138 R139 | E131-A135 VanDerWaalsContact O-CB 3.31Å; E131-A135 WeakPolarHBondContact O-CB 3.4Å; E131-A135 PolarHBondContact O-N 3.42Å; K132-A135 PolarHBondContact O-N 3.46Å; A135-R138 PolarHBondContact O-N 3.35Å; A135-R139 VanDerWaalsContact O-CG 3.3Å; A135-R139 WeakPolarHBondContact O-CG 3.42Å; A135-R139 PolarHBondContact O-N 3Å; A135-R139 VanDerWaalsContact O-N 3.09Å |
| 136 | E | 90.6 | Very high | 91.7 | Very high | 96 Ų | 96 | 104.6 Ų | 104.6 | 45% | 0.449 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -63.7 | -47.1 | 174.8 | -170.6 | 177.1 | -178.2 | 0 | 0 | 111.3 | K132 Q133 R138 R139 R140 | K132-E136 PolarHBondContact O-N 2.95Å; Q133-E136 PolarHBondContact O-N 2.91Å; E136-R138 VanDerWaalsContact C-N 3.3Å; E136-R138 PolarHBondContact O-N 3.27Å; E136-R139 WeakPolarHBondContact O-CB 3.36Å; E136-R139 PolarHBondContact O-N 2.91Å; E136-R140 HydrophobicContact CG-CG 4.32Å; E136-R140 VanDerWaalsContact O-CG 3.32Å; E136-R140 WeakPolarHBondContact O-CG 3.4Å; E136-R140 PolarHBondContact O-N 2.92Å; E136-R140 IonicContact OE1-CZ 3.92Å; E136-R140 IonicContact OE1-NE 3.63Å; E136-R140 IonicContact OE1-NH2 3.25Å; E136-R140 PolarHBondContact OE1-NH2 2.86Å |
| 137 | A | 92.8 | Very high | 91.1 | Very high | 59 Ų | 59 | 104 Ų | 104 | 49% | 0.488 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -58.4 | -41 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q133 A134 R140 A141 | Q133-A137 WeakPolarHBondContact O-CB 3.28Å; Q133-A137 PolarHBondContact O-N 3.29Å; A134-A137 PolarHBondContact O-N 3.48Å; A137-R140 PolarHBondContact O-N 3.31Å; A137-A141 WeakPolarHBondContact O-CB 3.41Å; A137-A141 PolarHBondContact O-N 2.92Å |
| 138 | R | 92.1 | Very high | 90.7 | Very high | 185 Ų | 185 | 101.4 Ų | 101.4 | 70% | 0.698 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -60.4 | -45.6 | 173.8 | -75.9 | 173.9 | -179.1 | 167.3 | 0.9 | 111.5 | A134 A135 E136 R140 A141 T142 | A134-R138 WeakPolarHBondContact O-CB 3.37Å; A134-R138 VanDerWaalsContact O-CG 3.29Å; A134-R138 WeakPolarHBondContact O-CG 3.49Å; A134-R138 PolarHBondContact O-N 2.74Å; A135-R138 PolarHBondContact O-N 3.35Å; E136-R138 VanDerWaalsContact C-N 3.3Å; E136-R138 PolarHBondContact O-N 3.27Å; R138-R140 PolarHBondContact O-N 3.05Å; R138-A141 PolarHBondContact O-N 3.22Å; R138-T142 PolarHBondContact O-N 3.04Å; R138-T142 PolarHBondContact O-OG1 3.46Å |
| 139 | R | 89.2 | Confident | 90.3 | Very high | 89 Ų | 89 | 102.6 Ų | 102.6 | 34% | 0.336 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -65.2 | -38 | 177.6 | -66.6 | 168.3 | -166 | 161.5 | 6.8 | 112.6 | A135 E136 A141 T142 D147 R149 D153 | A135-R139 VanDerWaalsContact O-CG 3.3Å; A135-R139 WeakPolarHBondContact O-CG 3.42Å; A135-R139 PolarHBondContact O-N 3Å; A135-R139 VanDerWaalsContact O-N 3.09Å; E136-R139 WeakPolarHBondContact O-CB 3.36Å; E136-R139 PolarHBondContact O-N 2.91Å; R139-A141 VanDerWaalsContact C-N 3.33Å; R139-T142 CarbonylContact O-C 3.18Å; R139-D147 WeakPolarHBondContact CD-OD2 3.47Å; R139-R149 VanDerWaalsContact CZ-CG 3.44Å; R139-D153 IonicContact NH1-OD2 3.21Å |
| 140 | R | 87.1 | Confident | 89.8 | Confident | 193 Ų | 193 | 104.2 Ų | 104.2 | 73% | 0.728 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -64.6 | -39.2 | 174.2 | -65.5 | -65.4 | -179.3 | 178.9 | -0.3 | 111.5 | E136 A137 R138 | E136-R140 HydrophobicContact CG-CG 4.32Å; E136-R140 VanDerWaalsContact O-CG 3.32Å; E136-R140 WeakPolarHBondContact O-CG 3.4Å; E136-R140 PolarHBondContact O-N 2.92Å; E136-R140 IonicContact OE1-CZ 3.92Å; E136-R140 IonicContact OE1-NE 3.63Å; E136-R140 IonicContact OE1-NH2 3.25Å; E136-R140 PolarHBondContact OE1-NH2 2.86Å; A137-R140 PolarHBondContact O-N 3.31Å; R138-R140 PolarHBondContact O-N 3.05Å |
| 141 | A | 90.2 | Very high | 89.3 | Confident | 80 Ų | 80 | 103.4 Ų | 103.4 | 66% | 0.661 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -73 | -39 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | A137 R138 R139 P143 | A137-A141 WeakPolarHBondContact O-CB 3.41Å; A137-A141 PolarHBondContact O-N 2.92Å; R138-A141 PolarHBondContact O-N 3.22Å; R139-A141 VanDerWaalsContact C-N 3.33Å; A141-P143 VanDerWaalsContact O-CD 3.31Å; A141-P143 WeakPolarHBondContact O-CD 3.49Å |
| 142 | T | 88 | Confident | 88.9 | Confident | 89 Ų | 89 | 100.6 Ų | 100.6 | 55% | 0.546 | 55% | 0.549 | S | S | . | . | S | Bend | trans | -113.5 | 86.2 | 175.7 | 58.2 | 0 | 0 | 0 | 0 | 109.3 | R138 R139 V144 | R138-T142 PolarHBondContact O-N 3.04Å; R138-T142 PolarHBondContact O-OG1 3.46Å; R139-T142 CarbonylContact O-C 3.18Å; T142-V144 PolarHBondContact O-N 2.97Å |
| 143 | P | 79.3 | Confident | 88.6 | Confident | 112 Ų | 112 | 99.8 Ų | 99.8 | 73% | 0.727 | 55% | 0.55 | S | S | * | * | trans | -66.1 | 106.9 | 178.4 | 26.2 | -32.8 | 0 | 0 | 0 | 109.5 | A141 | A141-P143 VanDerWaalsContact O-CD 3.31Å; A141-P143 WeakPolarHBondContact O-CD 3.49Å | ||
| 144 | V | 81.6 | Confident | 88.2 | Confident | 101 Ų | 101 | 97.2 Ų | 97.2 | 61% | 0.612 | 55% | 0.552 | S | S | * | * | trans | -90.4 | 120.7 | 176.5 | -178.3 | 0 | 0 | 0 | 0 | 108.4 | T142 G146 D147 | T142-V144 PolarHBondContact O-N 2.97Å; V144-G146 PolarHBondContact O-N 3.31Å; V144-D147 PolarHBondContact O-N 2.83Å | ||
| 145 | V | 88.1 | Confident | 87.9 | Confident | 149 Ų | 149 | 100.8 Ų | 100.8 | 90% | 0.903 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.9 | 125.3 | 174.6 | -178 | 0 | 0 | 0 | 0 | 108.8 | ||
| 146 | G | 88.8 | Confident | 87.5 | Confident | 64 Ų | 64 | 102.9 Ų | 102.9 | 66% | 0.66 | 58% | 0.576 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 85.8 | 18.9 | 179.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | V144 L148 | V144-G146 PolarHBondContact O-N 3.31Å; G146-L148 PolarHBondContact O-N 3.26Å |
| 147 | D | 86.3 | Confident | 87 | Confident | 63 Ų | 63 | 103.6 Ų | 103.6 | 34% | 0.337 | 58% | 0.58 | S | S | . | * | trans | -60.3 | 110.4 | 170.7 | -173.5 | 7.8 | 0 | 0 | 0 | 110.8 | R139 V144 R149 P150 | R139-D147 WeakPolarHBondContact CD-OD2 3.47Å; V144-D147 PolarHBondContact O-N 2.83Å; D147-R149 PolarHBondContact O-N 3.42Å; D147-R149 WeakPolarHBondContact OD1-CB 3.35Å; D147-R149 PolarHBondContact OD1-N 2.99Å; D147-P150 WeakPolarHBondContact O-CD 3.28Å | ||
| 148 | L | 89.1 | Confident | 86.1 | Confident | 120 Ų | 120 | 107 Ų | 107 | 63% | 0.628 | 59% | 0.589 | S | S | * | * | trans | -80 | -7.3 | 177.9 | -61.8 | -179.8 | 0 | 0 | 0 | 112.6 | G146 L151 V152 | G146-L148 PolarHBondContact O-N 3.26Å; L148-L151 HydrophobicContact CD2-CD1 4.18Å; L148-L151 WeakPolarHBondContact O-CB 3.48Å; L148-L151 PolarHBondContact O-N 3.34Å; L148-L151 VanDerWaalsContact O-N 3.15Å; L148-V152 PolarHBondContact O-N 2.89Å | ||
| 149 | R | 86.9 | Confident | 85 | Confident | 117 Ų | 117 | 102.2 Ų | 102.2 | 44% | 0.442 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -67.3 | -37.3 | -171 | -161.2 | 63.4 | -173.5 | -154.1 | 3.1 | 115 | R139 D147 L151 V152 D153 | R139-R149 VanDerWaalsContact CZ-CG 3.44Å; D147-R149 PolarHBondContact O-N 3.42Å; D147-R149 WeakPolarHBondContact OD1-CB 3.35Å; D147-R149 PolarHBondContact OD1-N 2.99Å; R149-L151 PolarHBondContact O-N 3.35Å; R149-V152 PolarHBondContact O-N 3.45Å; R149-V152 VanDerWaalsContact O-N 3.14Å; R149-D153 IonicContact CZ-OD1 2.63Å; R149-D153 IonicContact NE-OD1 2.78Å; R149-D153 PolarHBondContact NE-OD1 3.04Å; R149-D153 IonicContact NH2-OD1 3.34Å; R149-D153 WeakPolarHBondContact O-CB 3.35Å; R149-D153 VanDerWaalsContact O-CG 3.26Å; R149-D153 PolarHBondContact O-N 3.32Å |
| 150 | P | 87.2 | Confident | 84.3 | Confident | 79 Ų | 79 | 104.3 Ų | 104.3 | 51% | 0.513 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -56.3 | -34.7 | 171.1 | -26 | 35.8 | 0 | 0 | 0 | 113.2 | D147 A154 | D147-P150 WeakPolarHBondContact O-CD 3.28Å; P150-A154 VanDerWaalsContact O-CB 3.31Å; P150-A154 WeakPolarHBondContact O-CB 3.41Å; P150-A154 PolarHBondContact O-N 2.89Å; P150-A154 VanDerWaalsContact O-N 3.09Å |
| 151 | L | 87.4 | Confident | 83.5 | Confident | 119 Ų | 119 | 101 Ų | 101 | 62% | 0.623 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -68.8 | -44.8 | 176.6 | -58.9 | 176.7 | 0 | 0 | 0 | 111 | L148 R149 A154 L155 | L148-L151 HydrophobicContact CD2-CD1 4.18Å; L148-L151 WeakPolarHBondContact O-CB 3.48Å; L148-L151 PolarHBondContact O-N 3.34Å; L148-L151 VanDerWaalsContact O-N 3.15Å; R149-L151 PolarHBondContact O-N 3.35Å; L151-A154 PolarHBondContact O-N 3.02Å; L151-L155 WeakPolarHBondContact O-CG 3.47Å; L151-L155 PolarHBondContact O-N 3.21Å |
| 152 | V | 87.7 | Confident | 82.5 | Confident | 75 Ų | 75 | 102.3 Ų | 102.3 | 46% | 0.455 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -63.9 | -42.4 | 177.8 | 176.9 | 0 | 0 | 0 | 0 | 111.4 | L148 R149 A154 L155 | L148-V152 PolarHBondContact O-N 2.89Å; R149-V152 PolarHBondContact O-N 3.45Å; R149-V152 VanDerWaalsContact O-N 3.14Å; V152-A154 VanDerWaalsContact C-N 3.27Å; V152-A154 PolarHBondContact O-N 3Å; V152-L155 PolarHBondContact O-N 2.69Å |
| 153 | D | 85.7 | Confident | 81 | Confident | 96 Ų | 96 | 102.7 Ų | 102.7 | 51% | 0.513 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -71.5 | -23.7 | -178.3 | -64.7 | -13.7 | 0 | 0 | 0 | 111.6 | R139 R149 | R139-D153 IonicContact NH1-OD2 3.21Å; R149-D153 IonicContact CZ-OD1 2.63Å; R149-D153 IonicContact NE-OD1 2.78Å; R149-D153 PolarHBondContact NE-OD1 3.04Å; R149-D153 IonicContact NH2-OD1 3.34Å; R149-D153 WeakPolarHBondContact O-CB 3.35Å; R149-D153 VanDerWaalsContact O-CG 3.26Å; R149-D153 PolarHBondContact O-N 3.32Å |
| 154 | A | 87.1 | Confident | 79.7 | Confident | 83 Ų | 83 | 102.8 Ų | 102.8 | 69% | 0.686 | 59% | 0.594 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81 | -11.4 | 173.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | P150 L151 V152 | P150-A154 VanDerWaalsContact O-CB 3.31Å; P150-A154 WeakPolarHBondContact O-CB 3.41Å; P150-A154 PolarHBondContact O-N 2.89Å; P150-A154 VanDerWaalsContact O-N 3.09Å; L151-A154 PolarHBondContact O-N 3.02Å; V152-A154 VanDerWaalsContact C-N 3.27Å; V152-A154 PolarHBondContact O-N 3Å |
| 155 | L | 89.8 | Confident | 77.9 | Confident | 120 Ų | 120 | 102.3 Ų | 102.3 | 63% | 0.628 | 59% | 0.593 | S | S | * | * | S | Bend | trans | -81.6 | 143.3 | 176.1 | -68.6 | 173.8 | 0 | 0 | 0 | 110.9 | L151 V152 E157 | L151-L155 WeakPolarHBondContact O-CG 3.47Å; L151-L155 PolarHBondContact O-N 3.21Å; V152-L155 PolarHBondContact O-N 2.69Å; L155-E157 PolarHBondContact O-N 2.81Å |
| 156 | P | 82.2 | Confident | 76 | Confident | 72 Ų | 72 | 99.7 Ų | 99.7 | 47% | 0.468 | 59% | 0.587 | S | S | . | * | P | Polyproline II helix | trans | -56.2 | 132.3 | 171.4 | -23 | 32.5 | 0 | 0 | 0 | 111 | L158 L161 | P156-L158 PolarHBondContact O-N 2.85Å; P156-L161 HydrophobicContact CB-CD1 4.46Å; P156-L161 HydrophobicContact CB-CD2 4.41Å; P156-L161 HydrophobicContact CB-CG 4.29Å |
| 157 | E | 81.3 | Confident | 74.1 | Confident | 111 Ų | 111 | 101.4 Ų | 101.4 | 52% | 0.519 | 60% | 0.595 | S | S | . | * | P | Polyproline II helix | trans | -64.4 | 138.1 | 172.7 | -64.5 | -173 | 168.4 | 0 | 0 | 109.1 | L155 C159 Q160 | L155-E157 PolarHBondContact O-N 2.81Å; E157-C159 WeakPolarHBondContact CB-SG 3.38Å; E157-C159 PolarHBondContact O-N 3.06Å; E157-C159 PolarHBondContact OE2-SG 3.05Å; E157-Q160 HydrophobicContact CB-CG 4.42Å; E157-Q160 WeakPolarHBondContact O-CB 3.36Å; E157-Q160 PolarHBondContact O-N 2.81Å |
| 158 | L | 73.1 | Confident | 72 | Confident | 130 Ų | 130 | 106.1 Ų | 106.1 | 68% | 0.681 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -54.9 | -26.5 | -176.9 | -69 | 173.5 | 0 | 0 | 0 | 113.4 | P156 Q160 L161 I162 | P156-L158 PolarHBondContact O-N 2.85Å; L158-Q160 VanDerWaalsContact C-N 3.26Å; L158-Q160 PolarHBondContact O-N 3.16Å; L158-L161 PolarHBondContact O-N 2.99Å; L158-I162 HydrophobicContact CB-CD1 4.28Å; L158-I162 WeakPolarHBondContact O-CB 3.38Å; L158-I162 WeakPolarHBondContact O-CD1 3.49Å; L158-I162 WeakPolarHBondContact O-CG1 3.46Å; L158-I162 PolarHBondContact O-N 3.25Å |
| 159 | C | 70 | Confident | 69.7 | Low | 84 Ų | 84 | 103.6 Ų | 103.6 | 57% | 0.568 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -65.3 | -25.4 | 174.5 | 55.9 | 0 | 0 | 0 | 0 | 113.8 | E157 | E157-C159 WeakPolarHBondContact CB-SG 3.38Å; E157-C159 PolarHBondContact O-N 3.06Å; E157-C159 PolarHBondContact OE2-SG 3.05Å |
| 160 | Q | 72.6 | Confident | 67.7 | Low | 134 Ų | 134 | 103.5 Ų | 103.5 | 63% | 0.626 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -79.4 | -32 | 176.5 | -58 | 175 | 25 | 0 | 0 | 111.1 | E157 L158 | E157-Q160 HydrophobicContact CB-CG 4.42Å; E157-Q160 WeakPolarHBondContact O-CB 3.36Å; E157-Q160 PolarHBondContact O-N 2.81Å; L158-Q160 VanDerWaalsContact C-N 3.26Å; L158-Q160 PolarHBondContact O-N 3.16Å |
| 161 | L | 71.1 | Confident | 65.6 | Low | 122 Ų | 122 | 111.1 Ų | 111.1 | 64% | 0.639 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -80.4 | -32.1 | 176.8 | -62.7 | 177.5 | 0 | 0 | 0 | 112.1 | P156 L158 S163 | P156-L161 HydrophobicContact CB-CD1 4.46Å; P156-L161 HydrophobicContact CB-CD2 4.41Å; P156-L161 HydrophobicContact CB-CG 4.29Å; L158-L161 PolarHBondContact O-N 2.99Å; L161-S163 VanDerWaalsContact C-N 3.28Å; L161-S163 PolarHBondContact O-N 3.33Å; L161-S163 VanDerWaalsContact O-N 3.14Å |
| 162 | I | 69.9 | Low | 63.7 | Low | 108 Ų | 108 | 116 Ų | 116 | 55% | 0.554 | 67% | 0.668 | S | S | * | * | trans | -88.1 | 71.3 | 174.2 | -52.7 | 159.6 | 0 | 0 | 0 | 107.8 | L158 | L158-I162 HydrophobicContact CB-CD1 4.28Å; L158-I162 WeakPolarHBondContact O-CB 3.38Å; L158-I162 WeakPolarHBondContact O-CD1 3.49Å; L158-I162 WeakPolarHBondContact O-CG1 3.46Å; L158-I162 PolarHBondContact O-N 3.25Å | ||
| 163 | S | 56 | Low | 62 | Low | 97 Ų | 97 | 122.1 Ų | 122.1 | 68% | 0.678 | 69% | 0.689 | S | S | * | * | trans | -56.4 | 133.1 | 157.2 | -157.6 | 0 | 0 | 0 | 0 | 107 | L161 P165 | L161-S163 VanDerWaalsContact C-N 3.28Å; L161-S163 PolarHBondContact O-N 3.33Å; L161-S163 VanDerWaalsContact O-N 3.14Å; S163-P165 WeakPolarHBondContact O-CD 3.42Å | ||
| 164 | P | 52.2 | Low | 60 | Low | 115 Ų | 115 | 122.9 Ų | 122.9 | 75% | 0.747 | 70% | 0.697 | S | S | * | * | trans | -61 | 111.5 | -166 | 23.3 | -31.4 | 0 | 0 | 0 | 109.5 | A166 | P164-A166 PolarHBondContact O-N 3.45Š| ||
| 165 | P | 43.9 | Very low | 58.3 | Low | 91 Ų | 91 | 130.2 Ų | 130.2 | 59% | 0.591 | 71% | 0.707 | S | S | * | * | trans | -67.7 | 130.4 | 168.7 | 28.8 | -30.2 | 0 | 0 | 0 | 106.7 | S163 A167 | S163-P165 WeakPolarHBondContact O-CD 3.42Å; P165-A167 PolarHBondContact O-N 3.01Å; P165-A167 VanDerWaalsContact O-N 3.11Å | ||
| 166 | A | 48 | Very low | 56.4 | Low | 94 Ų | 94 | 133.1 Ų | 133.1 | 78% | 0.777 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -42.8 | 123 | 161.8 | 0 | 0 | 0 | 0 | 0 | 109 | P164 L168 | P164-A166 PolarHBondContact O-N 3.45Å; A166-L168 PolarHBondContact O-N 3.34Å |
| 167 | A | 49.1 | Very low | 55 | Low | 99 Ų | 99 | 137 Ų | 137 | 82% | 0.818 | 73% | 0.731 | S | S | * | * | trans | 25.9 | 80.4 | 162.5 | 0 | 0 | 0 | 0 | 0 | 116.8 | P165 | P165-A167 PolarHBondContact O-N 3.01Å; P165-A167 VanDerWaalsContact O-N 3.11Å | ||
| 168 | L | 42.7 | Very low | 53.8 | Low | 162 Ų | 162 | 140.9 Ų | 140.9 | 85% | 0.848 | 75% | 0.746 | S | S | * | * | trans | -122.2 | 102.8 | 148.5 | -78 | 171.8 | 0 | 0 | 0 | 109.4 | A166 | A166-L168 PolarHBondContact O-N 3.34Š| ||
| 169 | G | 39.5 | Very low | 52.9 | Low | 67 Ų | 67 | 140.3 Ų | 140.3 | 69% | 0.691 | 75% | 0.748 | S | S | * | * | trans | 67.7 | 95.2 | 151.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | R171 | G169-R171 PolarHBondContact O-N 2.82Š| ||
| 170 | S | 45.4 | Very low | 52 | Low | 116 Ų | 116 | 142 Ų | 142 | 81% | 0.811 | 76% | 0.758 | S | S | * | * | trans | -50.4 | 85 | 146.7 | 179 | 0 | 0 | 0 | 0 | 109.5 | R172 | S170-R172 PolarHBondContact O-N 2.84Š| ||
| 171 | R | 42.5 | Very low | 51.1 | Low | 238 Ų | 238 | 144 Ų | 144 | 90% | 0.898 | 77% | 0.77 | S | S | * | * | trans | -74.2 | 87.8 | 168.2 | -161.3 | 175.9 | -163.8 | -175.7 | 5.6 | 105.3 | G169 K173 | G169-R171 PolarHBondContact O-N 2.82Å; R171-K173 PolarHBondContact O-N 3.34Å | ||
| 172 | R | 48.8 | Very low | 50.5 | Low | 223 Ų | 223 | 147.7 Ų | 147.7 | 84% | 0.842 | 78% | 0.781 | S | S | * | * | trans | -40.8 | 104.5 | 169.6 | -69.6 | 178.1 | -166.3 | 158.7 | 4.3 | 107.4 | S170 T174 | S170-R172 PolarHBondContact O-N 2.84Å; R172-T174 VanDerWaalsContact C-N 3.26Å; R172-T174 PolarHBondContact O-N 2.9Å | ||
| 173 | K | 50.9 | Low | 50 | Low | 203 Ų | 203 | 153.4 Ų | 153.4 | 88% | 0.883 | 80% | 0.795 | S | S | * | * | trans | -61.8 | 102.7 | 164.3 | -93.1 | 176.1 | 171.5 | 173.6 | 0 | 104.9 | R171 R175 | R171-K173 PolarHBondContact O-N 3.34Å; K173-R175 PolarHBondContact O-N 2.71Å; K173-R175 VanDerWaalsContact O-N 3.09Å | ||
| 174 | T | 45.2 | Very low | 50.4 | Low | 111 Ų | 111 | 154.4 Ų | 154.4 | 68% | 0.681 | 80% | 0.799 | S | S | * | * | trans | -36.9 | 117.3 | 167.5 | 49.7 | 0 | 0 | 0 | 0 | 107.8 | R172 K176 | R172-T174 VanDerWaalsContact C-N 3.26Å; R172-T174 PolarHBondContact O-N 2.9Å; T174-K176 PolarHBondContact O-N 3.09Å | ||
| 175 | R | 49.7 | Very low | 51 | Low | 238 Ų | 238 | 154.1 Ų | 154.1 | 90% | 0.898 | 79% | 0.788 | S | S | * | * | trans | -56.9 | 84.8 | 164.1 | -76.3 | 175.1 | 158.4 | -177 | -6 | 106.7 | K173 N177 | K173-R175 PolarHBondContact O-N 2.71Å; K173-R175 VanDerWaalsContact O-N 3.09Å; R175-N177 PolarHBondContact O-N 3.08Å; R175-N177 VanDerWaalsContact O-N 3.08Å | ||
| 176 | K | 50.4 | Low | 52.1 | Low | 181 Ų | 181 | 152.5 Ų | 152.5 | 79% | 0.787 | 78% | 0.778 | S | S | * | * | trans | -64.8 | 110.7 | 159 | -72.5 | -170.6 | 179.7 | -173 | 0 | 103.7 | T174 K178 | T174-K176 PolarHBondContact O-N 3.09Å; K176-K178 PolarHBondContact O-N 2.74Å | ||
| 177 | N | 52.6 | Low | 53 | Low | 154 Ų | 154 | 154.4 Ų | 154.4 | 82% | 0.824 | 78% | 0.779 | S | S | * | * | trans | -48.6 | 95.2 | 166.2 | -68 | -43.2 | 0 | 0 | 0 | 106.7 | R175 T179 | R175-N177 PolarHBondContact O-N 3.08Å; R175-N177 VanDerWaalsContact O-N 3.08Å; N177-T179 PolarHBondContact O-N 3.46Å | ||
| 178 | K | 55.5 | Low | 54.7 | Low | 192 Ų | 192 | 154 Ų | 154 | 84% | 0.835 | 76% | 0.763 | S | S | * | * | trans | -70.5 | 99.7 | 162.6 | -69 | -164.3 | 175.8 | -167.1 | 0 | 103 | K176 | K176-K178 PolarHBondContact O-N 2.74Š| ||
| 179 | T | 56.1 | Low | 56.7 | Low | 117 Ų | 117 | 151 Ų | 151 | 72% | 0.718 | 74% | 0.744 | S | S | * | * | trans | -35.3 | 124.8 | 151.4 | -1.9 | 0 | 0 | 0 | 0 | 106.3 | N177 M181 | N177-T179 PolarHBondContact O-N 3.46Å; T179-M181 PolarHBondContact O-N 3.15Å | ||
| 180 | P | 49.4 | Very low | 58.9 | Low | 120 Ų | 120 | 152.1 Ų | 152.1 | 78% | 0.779 | 74% | 0.741 | S | S | * | * | trans | -64.5 | 94.1 | -175.2 | 24.7 | -31 | 0 | 0 | 0 | 107.1 | K182 | P180-K182 VanDerWaalsContact C-N 3.34Å; P180-K182 PolarHBondContact O-N 2.96Å | ||
| 181 | M | 55.1 | Low | 60.8 | Low | 176 Ų | 176 | 153.1 Ų | 153.1 | 87% | 0.867 | 73% | 0.733 | S | S | * | * | trans | -58.9 | 109.2 | 162.7 | -71.7 | -166.5 | -179.3 | 0 | 0 | 104.1 | T179 R183 | T179-M181 PolarHBondContact O-N 3.15Å; M181-R183 PolarHBondContact O-N 3.46Å | ||
| 182 | K | 58 | Low | 63 | Low | 200 Ų | 200 | 142.3 Ų | 142.3 | 87% | 0.87 | 69% | 0.693 | S | S | * | * | trans | -50.9 | 109.5 | 172.1 | -78.4 | -172 | 177.4 | -179.1 | 0 | 105.5 | P180 | P180-K182 VanDerWaalsContact C-N 3.34Å; P180-K182 PolarHBondContact O-N 2.96Å | ||
| 183 | R | 58.9 | Low | 65 | Low | 228 Ų | 228 | 139.4 Ų | 139.4 | 86% | 0.86 | 69% | 0.686 | S | S | * | * | P | Polyproline II helix | trans | -56 | 133.6 | 169.7 | -72.4 | -168.4 | 176.5 | 148.9 | -0.4 | 106.1 | M181 E185 | M181-R183 PolarHBondContact O-N 3.46Å; R183-E185 PolarHBondContact O-N 3.02Å |
| 184 | P | 64.3 | Low | 67.1 | Low | 117 Ų | 117 | 137.9 Ų | 137.9 | 76% | 0.76 | 68% | 0.682 | S | S | * | * | P | Polyproline II helix | trans | -51.6 | 131.9 | 174.8 | 20.6 | -29.9 | 0 | 0 | 0 | 107.5 | P186 | P184-P186 WeakPolarHBondContact O-CD 3.48Å; P184-P186 VanDerWaalsContact O-N 3.17Å |
| 185 | E | 65.3 | Low | 69.3 | Low | 110 Ų | 110 | 136.9 Ų | 136.9 | 51% | 0.514 | 68% | 0.68 | S | S | . | * | P | Polyproline II helix | trans | -48.6 | 122.6 | 179.7 | 177.3 | 132.3 | -152 | 0 | 0 | 108.2 | R183 T187 Q196 | R183-E185 PolarHBondContact O-N 3.02Å; E185-T187 PolarHBondContact O-N 3.25Å; E185-T187 PolarHBondContact O-OG1 3.22Å; E185-Q196 WeakPolarHBondContact OE1-CG 3.48Å; E185-Q196 PolarHBondContact OE1-NE2 3.26Å |
| 186 | P | 66.3 | Low | 71.3 | Confident | 57 Ų | 57 | 127.5 Ų | 127.5 | 37% | 0.37 | 65% | 0.646 | S | S | . | * | trans | -50.8 | 107.1 | 179.6 | -28.8 | 33.6 | 0 | 0 | 0 | 109.9 | P184 D188 Q191 M192 | P184-P186 WeakPolarHBondContact O-CD 3.48Å; P184-P186 VanDerWaalsContact O-N 3.17Å; P186-D188 PolarHBondContact O-N 3.06Å; P186-Q191 HydrophobicContact CB-CB 4.37Å; P186-M192 HydrophobicContact CB-CG 4.16Å; P186-M192 VanDerWaalsContact O-CG 3.24Å; P186-M192 WeakPolarHBondContact O-CG 3.3Å | ||
| 187 | T | 67.8 | Low | 73.3 | Confident | 133 Ų | 133 | 121.9 Ų | 121.9 | 82% | 0.816 | 62% | 0.622 | S | S | * | * | trans | -75.7 | -19.2 | -175.8 | -41.8 | 0 | 0 | 0 | 0 | 111.2 | E185 | E185-T187 PolarHBondContact O-N 3.25Å; E185-T187 PolarHBondContact O-OG1 3.22Å | ||
| 188 | D | 85.4 | Confident | 75.3 | Confident | 90 Ų | 90 | 123.5 Ų | 123.5 | 48% | 0.481 | 62% | 0.617 | S | S | . | * | trans | -83.1 | 115 | 175.3 | -177.9 | 1.3 | 0 | 0 | 0 | 111.1 | P186 S190 Q191 M192 | P186-D188 PolarHBondContact O-N 3.06Å; D188-S190 PolarHBondContact O-N 2.87Å; D188-S190 VanDerWaalsContact O-N 3.15Å; D188-S190 WeakPolarHBondContact OD1-CB 3.45Å; D188-S190 PolarHBondContact OD1-N 3.21Å; D188-Q191 HydrophobicContact CB-CG 4.09Å; D188-Q191 PolarHBondContact O-N 3.03Å; D188-M192 PolarHBondContact O-N 2.68Å | ||
| 189 | F | 83.3 | Confident | 77.1 | Confident | 99 Ų | 99 | 120.7 Ų | 120.7 | 43% | 0.434 | 60% | 0.604 | S | S | . | * | G | 310 helix | trans | -49.5 | -38.6 | 175.6 | -119 | -105.5 | 0 | 0 | 0 | 112.7 | Q191 M192 K197 L200 L201 | F189-Q191 PolarHBondContact O-N 3.21Å; F189-M192 PolarHBondContact O-N 2.83Å; F189-K197 HydrophobicContact CD1-CD 4.04Å; F189-K197 HydrophobicContact CD1-CG 4.02Å; F189-K197 HydrophobicContact CE1-CB 4.4Å; F189-K197 HydrophobicContact CE1-CD 4.44Å; F189-K197 HydrophobicContact CE1-CG 4.3Å; F189-K197 WeakPolarHBondContact O-CE 2.67Å; F189-K197 PolarHBondContact O-NZ 2.93Å; F189-L200 HydrophobicContact CD2-CD2 3.81Å; F189-L200 HydrophobicContact CE2-CD2 3.57Å; F189-L201 HydrophobicContact CE1-CD1 3.8Å; F189-L201 HydrophobicContact CE2-CD1 3.94Å; F189-L201 HydrophobicContact CZ-CD1 3.1Å; F189-L201 HydrophobicContact CZ-CG 4.47Å |
| 190 | S | 86.1 | Confident | 78.8 | Confident | 91 Ų | 91 | 117.6 Ų | 117.6 | 64% | 0.636 | 58% | 0.583 | S | S | * | * | G | 310 helix | trans | -60.9 | -33.3 | -178.1 | -174.2 | 0 | 0 | 0 | 0 | 112.3 | D188 | D188-S190 PolarHBondContact O-N 2.87Å; D188-S190 VanDerWaalsContact O-N 3.15Å; D188-S190 WeakPolarHBondContact OD1-CB 3.45Å; D188-S190 PolarHBondContact OD1-N 3.21Å |
| 191 | Q | 86.4 | Confident | 80.9 | Confident | 138 Ų | 138 | 115.9 Ų | 115.9 | 65% | 0.645 | 57% | 0.567 | S | S | * | * | G | 310 helix | trans | -87.1 | -13.2 | -176.1 | -54.7 | -62 | -27.7 | 0 | 0 | 113.7 | P186 D188 F189 | P186-Q191 HydrophobicContact CB-CB 4.37Å; D188-Q191 HydrophobicContact CB-CG 4.09Å; D188-Q191 PolarHBondContact O-N 3.03Å; F189-Q191 PolarHBondContact O-N 3.21Å |
| 192 | M | 87.2 | Confident | 82.8 | Confident | 11 Ų | 11 | 113.7 Ų | 113.7 | 5% | 0.054 | 56% | 0.555 | C | S | . | * | S | Bend | trans | -80.5 | 143.7 | -176.4 | -68.2 | 173.8 | 85.6 | 0 | 0 | 112.6 | P186 D188 F189 Q196 K197 L200 | P186-M192 HydrophobicContact CB-CG 4.16Å; P186-M192 VanDerWaalsContact O-CG 3.24Å; P186-M192 WeakPolarHBondContact O-CG 3.3Å; D188-M192 PolarHBondContact O-N 2.68Å; F189-M192 PolarHBondContact O-N 2.83Å; M192-Q196 HydrophobicContact CB-CB 4.32Å; M192-Q196 HydrophobicContact CE-CB 3.95Å; M192-Q196 HydrophobicContact CE-CG 3.45Å; M192-Q196 VanDerWaalsContact CE-CG 3.45Å; M192-K197 HydrophobicContact CB-CG 3.81Å; M192-K197 VanDerWaalsContact O-CE 3.3Å; M192-K197 WeakPolarHBondContact O-CE 3.24Å; M192-L200 HydrophobicContact CE-CB 4.04Å; M192-L200 HydrophobicContact CE-CD2 3.97Å; M192-L200 HydrophobicContact SD-CD2 3.9Å |
| 193 | K | 91.8 | Very high | 84.6 | Confident | 161 Ų | 161 | 107.5 Ų | 107.5 | 70% | 0.7 | 53% | 0.534 | S | S | * | . | trans | -65.2 | 153.5 | 167.9 | -68.6 | -177.6 | 178.6 | 179.5 | 0 | 110.2 | S195 Q196 K197 | K193-S195 VanDerWaalsContact C-N 3.31Å; K193-S195 PolarHBondContact O-N 2.77Å; K193-Q196 HydrophobicContact CB-CB 4.42Å; K193-Q196 WeakPolarHBondContact O-CA 3.36Å; K193-Q196 VanDerWaalsContact O-CB 3.31Å; K193-Q196 WeakPolarHBondContact O-CB 3.31Å; K193-Q196 PolarHBondContact O-N 2.94Å; K193-K197 PolarHBondContact O-N 3.22Å | ||
| 194 | Q | 93.6 | Very high | 86.3 | Confident | 171 Ų | 171 | 101.5 Ų | 101.5 | 80% | 0.799 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -56.8 | -39.3 | -179.1 | -72.5 | -171.9 | -10.6 | 0 | 0 | 113.9 | Q196 K197 R198 | Q194-Q196 VanDerWaalsContact C-N 3.3Å; Q194-Q196 PolarHBondContact O-N 3Å; Q194-K197 WeakPolarHBondContact O-CB 3.48Å; Q194-K197 PolarHBondContact O-N 3.4Å; Q194-R198 PolarHBondContact O-N 2.9Å |
| 195 | S | 92.3 | Very high | 87.8 | Confident | 90 Ų | 90 | 99.5 Ų | 99.5 | 63% | 0.629 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -63.3 | -37.7 | 175.5 | 54.1 | 0 | 0 | 0 | 0 | 112.5 | K193 R198 K199 | K193-S195 VanDerWaalsContact C-N 3.31Å; K193-S195 PolarHBondContact O-N 2.77Å; S195-R198 PolarHBondContact O-N 3.37Å; S195-K199 PolarHBondContact O-N 3.1Å |
| 196 | Q | 91.9 | Very high | 89.3 | Confident | 42 Ų | 42 | 97.1 Ų | 97.1 | 20% | 0.196 | 50% | 0.5 | C | S | . | . | H | α-helix | trans | -70.6 | -40.5 | 178.7 | -153.9 | -170.6 | -7.7 | 0 | 0 | 111.1 | E185 M192 K193 Q194 K199 L200 | E185-Q196 WeakPolarHBondContact OE1-CG 3.48Å; E185-Q196 PolarHBondContact OE1-NE2 3.26Å; M192-Q196 HydrophobicContact CB-CB 4.32Å; M192-Q196 HydrophobicContact CE-CB 3.95Å; M192-Q196 HydrophobicContact CE-CG 3.45Å; M192-Q196 VanDerWaalsContact CE-CG 3.45Å; K193-Q196 HydrophobicContact CB-CB 4.42Å; K193-Q196 WeakPolarHBondContact O-CA 3.36Å; K193-Q196 VanDerWaalsContact O-CB 3.31Å; K193-Q196 WeakPolarHBondContact O-CB 3.31Å; K193-Q196 PolarHBondContact O-N 2.94Å; Q194-Q196 VanDerWaalsContact C-N 3.3Å; Q194-Q196 PolarHBondContact O-N 3Å; Q196-K199 PolarHBondContact O-N 2.97Å; Q196-L200 PolarHBondContact O-N 3.3Å |
| 197 | K | 92.6 | Very high | 90.7 | Very high | 62 Ų | 62 | 102.8 Ų | 102.8 | 27% | 0.27 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -56.5 | -52.4 | 170.6 | -68.2 | 176.2 | 173.6 | -179.4 | 0 | 110.8 | F189 M192 K193 Q194 K199 L200 L201 | F189-K197 HydrophobicContact CD1-CD 4.04Å; F189-K197 HydrophobicContact CD1-CG 4.02Å; F189-K197 HydrophobicContact CE1-CB 4.4Å; F189-K197 HydrophobicContact CE1-CD 4.44Å; F189-K197 HydrophobicContact CE1-CG 4.3Å; F189-K197 WeakPolarHBondContact O-CE 2.67Å; F189-K197 PolarHBondContact O-NZ 2.93Å; M192-K197 HydrophobicContact CB-CG 3.81Å; M192-K197 VanDerWaalsContact O-CE 3.3Å; M192-K197 WeakPolarHBondContact O-CE 3.24Å; K193-K197 PolarHBondContact O-N 3.22Å; Q194-K197 WeakPolarHBondContact O-CB 3.48Å; Q194-K197 PolarHBondContact O-N 3.4Å; K197-K199 VanDerWaalsContact C-N 3.29Å; K197-K199 PolarHBondContact O-N 3.34Å; K197-L200 WeakPolarHBondContact O-CB 3.46Å; K197-L200 PolarHBondContact O-N 3.44Å; K197-L200 VanDerWaalsContact O-N 3.1Å; K197-L201 WeakPolarHBondContact O-CD1 3.37Å; K197-L201 PolarHBondContact O-N 2.99Å |
| 198 | R | 93.7 | Very high | 92.1 | Very high | 189 Ų | 189 | 103.4 Ų | 103.4 | 71% | 0.713 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -55.4 | -45.4 | 179.1 | -176.8 | 177 | 173.5 | 169.7 | -0.2 | 111.8 | Q194 S195 L200 L201 E202 | Q194-R198 PolarHBondContact O-N 2.9Å; S195-R198 PolarHBondContact O-N 3.37Å; R198-L200 PolarHBondContact O-N 3.46Å; R198-L201 PolarHBondContact O-N 2.89Å; R198-E202 WeakPolarHBondContact O-CB 3.41Å; R198-E202 PolarHBondContact O-N 3.48Å |
| 199 | K | 93.6 | Very high | 92.6 | Very high | 132 Ų | 132 | 101.4 Ų | 101.4 | 57% | 0.574 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -61.7 | -41.8 | 177.3 | -171.2 | -177 | 178.2 | -171.2 | 0 | 112.5 | S195 Q196 K197 E202 T203 | S195-K199 PolarHBondContact O-N 3.1Å; Q196-K199 PolarHBondContact O-N 2.97Å; K197-K199 VanDerWaalsContact C-N 3.29Å; K197-K199 PolarHBondContact O-N 3.34Å; K199-E202 PolarHBondContact O-N 3.06Å; K199-T203 WeakPolarHBondContact O-CB 3.43Å; K199-T203 PolarHBondContact O-N 2.98Å; K199-T203 PolarHBondContact O-OG1 3.01Å |
| 200 | L | 92.5 | Very high | 93.1 | Very high | 52 Ų | 52 | 99.5 Ų | 99.5 | 27% | 0.272 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.4 | -47 | 176 | -177.2 | 67.5 | 0 | 0 | 0 | 111 | F189 M192 Q196 K197 R198 E202 T203 E204 | F189-L200 HydrophobicContact CD2-CD2 3.81Å; F189-L200 HydrophobicContact CE2-CD2 3.57Å; M192-L200 HydrophobicContact CE-CB 4.04Å; M192-L200 HydrophobicContact CE-CD2 3.97Å; M192-L200 HydrophobicContact SD-CD2 3.9Å; Q196-L200 PolarHBondContact O-N 3.3Å; K197-L200 WeakPolarHBondContact O-CB 3.46Å; K197-L200 PolarHBondContact O-N 3.44Å; K197-L200 VanDerWaalsContact O-N 3.1Å; R198-L200 PolarHBondContact O-N 3.46Å; L200-E202 VanDerWaalsContact C-N 3.33Å; L200-E202 PolarHBondContact O-N 3.31Å; L200-T203 PolarHBondContact O-N 2.94Å; L200-E204 HydrophobicContact CD1-CG 4.48Å; L200-E204 WeakPolarHBondContact O-CG 3.49Å; L200-E204 PolarHBondContact O-N 2.97Å |
| 201 | L | 93.2 | Very high | 93.4 | Very high | 85 Ų | 85 | 97.3 Ų | 97.3 | 45% | 0.445 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -58.8 | -44.4 | 177.5 | -96.2 | 59.7 | 0 | 0 | 0 | 111.9 | F189 K197 R198 T203 E204 S205 | F189-L201 HydrophobicContact CE1-CD1 3.8Å; F189-L201 HydrophobicContact CE2-CD1 3.94Å; F189-L201 HydrophobicContact CZ-CD1 3.1Å; F189-L201 HydrophobicContact CZ-CG 4.47Å; K197-L201 WeakPolarHBondContact O-CD1 3.37Å; K197-L201 PolarHBondContact O-N 2.99Å; R198-L201 PolarHBondContact O-N 2.89Å; L201-T203 VanDerWaalsContact C-N 3.34Å; L201-E204 PolarHBondContact O-N 3.46Å; L201-S205 VanDerWaalsContact O-CB 3.23Å; L201-S205 WeakPolarHBondContact O-CB 3.34Å; L201-S205 PolarHBondContact O-N 2.85Å; L201-S205 PolarHBondContact O-OG 2.81Å |
| 202 | E | 95.7 | Very high | 93.7 | Very high | 130 Ų | 130 | 94 Ų | 94 | 61% | 0.607 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -63.7 | -42 | 179.2 | -172.1 | 171.1 | -170 | 0 | 0 | 111.2 | R198 K199 L200 S205 S206 | R198-E202 WeakPolarHBondContact O-CB 3.41Å; R198-E202 PolarHBondContact O-N 3.48Å; K199-E202 PolarHBondContact O-N 3.06Å; L200-E202 VanDerWaalsContact C-N 3.33Å; L200-E202 PolarHBondContact O-N 3.31Å; E202-S205 PolarHBondContact O-N 3.44Å; E202-S206 WeakPolarHBondContact O-CB 3.23Å; E202-S206 PolarHBondContact O-N 3.43Å |
| 203 | T | 95.3 | Very high | 93.9 | Very high | 70 Ų | 70 | 100.4 Ų | 100.4 | 43% | 0.429 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.1 | -45.3 | 176.6 | -50.9 | 0 | 0 | 0 | 0 | 111.6 | K199 L200 L201 S206 R207 | K199-T203 WeakPolarHBondContact O-CB 3.43Å; K199-T203 PolarHBondContact O-N 2.98Å; K199-T203 PolarHBondContact O-OG1 3.01Å; L200-T203 PolarHBondContact O-N 2.94Å; L201-T203 VanDerWaalsContact C-N 3.34Å; T203-S206 PolarHBondContact O-N 3.41Å; T203-R207 PolarHBondContact O-N 2.74Å |
| 204 | E | 94.4 | Very high | 93.7 | Very high | 102 Ų | 102 | 96.6 Ų | 96.6 | 48% | 0.477 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -67.4 | -40.5 | 177.8 | -72.3 | -59.9 | 125.2 | 0 | 0 | 111.8 | L200 L201 S206 R207 F208 | L200-E204 HydrophobicContact CD1-CG 4.48Å; L200-E204 WeakPolarHBondContact O-CG 3.49Å; L200-E204 PolarHBondContact O-N 2.97Å; L201-E204 PolarHBondContact O-N 3.46Å; E204-S206 VanDerWaalsContact C-N 3.31Å; E204-S206 PolarHBondContact O-N 3.35Å; E204-R207 PolarHBondContact O-N 3.43Å; E204-F208 WeakPolarHBondContact O-CB 3.48Å; E204-F208 PolarHBondContact O-N 3.3Å |
| 205 | S | 96.1 | Very high | 93.4 | Very high | 74 Ų | 74 | 94.6 Ų | 94.6 | 52% | 0.517 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -62.4 | -40.6 | 176.3 | -58.7 | 0 | 0 | 0 | 0 | 110.9 | L201 E202 S209 | L201-S205 VanDerWaalsContact O-CB 3.23Å; L201-S205 WeakPolarHBondContact O-CB 3.34Å; L201-S205 PolarHBondContact O-N 2.85Å; L201-S205 PolarHBondContact O-OG 2.81Å; E202-S205 PolarHBondContact O-N 3.44Å; S205-S209 VanDerWaalsContact O-CB 3.31Å; S205-S209 WeakPolarHBondContact O-CB 3.45Å; S205-S209 PolarHBondContact O-N 3.38Å; S205-S209 PolarHBondContact O-OG 3.03Å |
| 206 | S | 96.2 | Very high | 92.9 | Very high | 61 Ų | 61 | 94.8 Ų | 94.8 | 43% | 0.427 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -63.2 | -51.2 | 174.2 | -170.2 | 0 | 0 | 0 | 0 | 111.3 | E202 T203 E204 F208 S209 D210 | E202-S206 WeakPolarHBondContact O-CB 3.23Å; E202-S206 PolarHBondContact O-N 3.43Å; T203-S206 PolarHBondContact O-N 3.41Å; E204-S206 VanDerWaalsContact C-N 3.31Å; E204-S206 PolarHBondContact O-N 3.35Å; S206-F208 VanDerWaalsContact C-N 3.3Å; S206-F208 PolarHBondContact O-N 3.15Å; S206-S209 PolarHBondContact O-N 3.1Å; S206-S209 VanDerWaalsContact O-N 3.16Å; S206-S209 PolarHBondContact O-OG 2.94Å; S206-D210 PolarHBondContact O-N 3.32Å |
| 207 | R | 96.3 | Very high | 92.3 | Very high | 175 Ų | 175 | 97 Ų | 97 | 66% | 0.66 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -55.9 | -45.1 | 177.8 | -82.7 | -177.5 | 125 | -113.6 | -2.2 | 112 | T203 E204 D210 A211 | T203-R207 PolarHBondContact O-N 2.74Å; E204-R207 PolarHBondContact O-N 3.43Å; R207-D210 PolarHBondContact O-N 2.68Å; R207-A211 WeakPolarHBondContact O-CB 3.4Å; R207-A211 PolarHBondContact O-N 2.95Å |
| 208 | F | 96.8 | Very high | 91.7 | Very high | 147 Ų | 147 | 97.8 Ų | 97.8 | 65% | 0.645 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -64.2 | -46.5 | 177.7 | 179.5 | -101.1 | 0 | 0 | 0 | 111.2 | E204 S206 D210 A211 V212 | E204-F208 WeakPolarHBondContact O-CB 3.48Å; E204-F208 PolarHBondContact O-N 3.3Å; S206-F208 VanDerWaalsContact C-N 3.3Å; S206-F208 PolarHBondContact O-N 3.15Å; F208-D210 VanDerWaalsContact C-N 3.29Å; F208-D210 PolarHBondContact O-N 2.94Å; F208-A211 PolarHBondContact O-N 3.11Å; F208-V212 HydrophobicContact CD1-CG2 4.09Å; F208-V212 HydrophobicContact CD2-CG2 4.44Å; F208-V212 HydrophobicContact CE1-CG2 3.64Å; F208-V212 HydrophobicContact CE2-CG2 4.02Å; F208-V212 HydrophobicContact CG-CG2 4.48Å; F208-V212 HydrophobicContact CZ-CG2 3.6Å; F208-V212 WeakPolarHBondContact O-CG2 3.45Å; F208-V212 PolarHBondContact O-N 3.3Å |
| 209 | S | 95.6 | Very high | 90.9 | Very high | 47 Ų | 47 | 98.2 Ų | 98.2 | 33% | 0.329 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.5 | -37.6 | 179.1 | 77.5 | 0 | 0 | 0 | 0 | 112.6 | S205 S206 R213 | S205-S209 VanDerWaalsContact O-CB 3.31Å; S205-S209 WeakPolarHBondContact O-CB 3.45Å; S205-S209 PolarHBondContact O-N 3.38Å; S205-S209 PolarHBondContact O-OG 3.03Å; S206-S209 PolarHBondContact O-N 3.1Å; S206-S209 VanDerWaalsContact O-N 3.16Å; S206-S209 PolarHBondContact O-OG 2.94Å; S209-R213 WeakPolarHBondContact O-CB 3.47Å; S209-R213 PolarHBondContact O-N 3.38Å |
| 210 | D | 94.5 | Very high | 90.4 | Very high | 60 Ų | 60 | 95.5 Ų | 95.5 | 32% | 0.321 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -69.8 | -42.7 | 176.4 | -73.2 | -24.6 | 0 | 0 | 0 | 110.9 | S206 R207 F208 V212 R213 I214 | S206-D210 PolarHBondContact O-N 3.32Å; R207-D210 PolarHBondContact O-N 2.68Å; F208-D210 VanDerWaalsContact C-N 3.29Å; F208-D210 PolarHBondContact O-N 2.94Å; D210-V212 VanDerWaalsContact C-N 3.34Å; D210-V212 PolarHBondContact O-N 2.87Å; D210-R213 PolarHBondContact O-N 3.33Å; D210-R213 IonicContact OD1-CZ 3.42Å; D210-R213 IonicContact OD1-NH1 2.73Å; D210-R213 PolarHBondContact OD1-NH1 3.35Å; D210-R213 IonicContact OD1-NH2 3.41Å; D210-R213 PolarHBondContact OD1-NH2 2.87Å; D210-I214 WeakPolarHBondContact O-CB 3.42Å; D210-I214 WeakPolarHBondContact O-CD1 3.27Å; D210-I214 WeakPolarHBondContact O-CG1 3.48Å; D210-I214 PolarHBondContact O-N 3.21Å |
| 211 | A | 92.4 | Very high | 90.1 | Very high | 44 Ų | 44 | 97 Ų | 97 | 36% | 0.364 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.2 | -44.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | R207 F208 R213 I214 L215 | R207-A211 WeakPolarHBondContact O-CB 3.4Å; R207-A211 PolarHBondContact O-N 2.95Å; F208-A211 PolarHBondContact O-N 3.11Å; A211-R213 VanDerWaalsContact C-N 3.34Å; A211-R213 PolarHBondContact O-N 3.43Å; A211-I214 PolarHBondContact O-N 2.97Å; A211-L215 WeakPolarHBondContact O-CB 3.43Å; A211-L215 VanDerWaalsContact O-CG 3.27Å; A211-L215 WeakPolarHBondContact O-CG 3.39Å; A211-L215 PolarHBondContact O-N 3.47Å |
| 212 | V | 92.6 | Very high | 89.8 | Confident | 68 Ų | 68 | 99.2 Ų | 99.2 | 41% | 0.412 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -61.6 | -43.1 | 174.7 | 172.1 | 0 | 0 | 0 | 0 | 110.7 | F208 D210 I214 L215 S216 | F208-V212 HydrophobicContact CD1-CG2 4.09Å; F208-V212 HydrophobicContact CD2-CG2 4.44Å; F208-V212 HydrophobicContact CE1-CG2 3.64Å; F208-V212 HydrophobicContact CE2-CG2 4.02Å; F208-V212 HydrophobicContact CG-CG2 4.48Å; F208-V212 HydrophobicContact CZ-CG2 3.6Å; F208-V212 WeakPolarHBondContact O-CG2 3.45Å; F208-V212 PolarHBondContact O-N 3.3Å; D210-V212 VanDerWaalsContact C-N 3.34Å; D210-V212 PolarHBondContact O-N 2.87Å; V212-I214 PolarHBondContact O-N 3.36Å; V212-L215 PolarHBondContact O-N 3.16Å; V212-S216 VanDerWaalsContact O-CB 3.32Å; V212-S216 WeakPolarHBondContact O-CB 3.34Å; V212-S216 PolarHBondContact O-N 2.78Å; V212-S216 PolarHBondContact O-OG 3.41Å |
| 213 | R | 91.9 | Very high | 89.5 | Confident | 146 Ų | 146 | 98.8 Ų | 98.8 | 55% | 0.551 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -61 | -46 | 176.6 | -163.6 | -175.5 | -56.3 | 122.3 | 11.1 | 111.4 | S209 D210 A211 L215 S216 S217 | S209-R213 WeakPolarHBondContact O-CB 3.47Å; S209-R213 PolarHBondContact O-N 3.38Å; D210-R213 PolarHBondContact O-N 3.33Å; D210-R213 IonicContact OD1-CZ 3.42Å; D210-R213 IonicContact OD1-NH1 2.73Å; D210-R213 PolarHBondContact OD1-NH1 3.35Å; D210-R213 IonicContact OD1-NH2 3.41Å; D210-R213 PolarHBondContact OD1-NH2 2.87Å; A211-R213 VanDerWaalsContact C-N 3.34Å; A211-R213 PolarHBondContact O-N 3.43Å; R213-L215 PolarHBondContact O-N 2.91Å; R213-S216 WeakPolarHBondContact CA-OG 3.49Å; R213-S216 PolarHBondContact O-N 3.49Å; R213-S216 PolarHBondContact O-OG 2.86Å; R213-S217 WeakPolarHBondContact O-CB 3.35Å; R213-S217 PolarHBondContact O-N 3.44Å; R213-S217 PolarHBondContact O-OG 3.47Å |
| 214 | I | 87.4 | Confident | 89 | Confident | 82 Ų | 82 | 97.9 Ų | 97.9 | 42% | 0.421 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.1 | -44 | 176.9 | -69.6 | 164.8 | 0 | 0 | 0 | 110.9 | D210 A211 V212 S216 S217 K218 | D210-I214 WeakPolarHBondContact O-CB 3.42Å; D210-I214 WeakPolarHBondContact O-CD1 3.27Å; D210-I214 WeakPolarHBondContact O-CG1 3.48Å; D210-I214 PolarHBondContact O-N 3.21Å; A211-I214 PolarHBondContact O-N 2.97Å; V212-I214 PolarHBondContact O-N 3.36Å; I214-S216 VanDerWaalsContact C-N 3.34Å; I214-S217 PolarHBondContact O-N 3Å; I214-S217 PolarHBondContact O-OG 2.9Å; I214-S217 VanDerWaalsContact O-OG 3.08Å; I214-K218 HydrophobicContact CG2-CD 3.81Å; I214-K218 VanDerWaalsContact CG2-CE 3.46Å; I214-K218 WeakPolarHBondContact O-CB 3.31Å; I214-K218 WeakPolarHBondContact O-CD 3.38Å; I214-K218 WeakPolarHBondContact O-CG 3.49Å; I214-K218 PolarHBondContact O-N 2.89Å; I214-K218 VanDerWaalsContact O-N 3.15Å |
| 215 | L | 85.9 | Confident | 88.7 | Confident | 129 Ų | 129 | 97.5 Ų | 97.5 | 68% | 0.675 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -66.8 | -37.7 | 177 | -71.5 | 169.9 | 0 | 0 | 0 | 111.6 | A211 V212 R213 | A211-L215 WeakPolarHBondContact O-CB 3.43Å; A211-L215 VanDerWaalsContact O-CG 3.27Å; A211-L215 WeakPolarHBondContact O-CG 3.39Å; A211-L215 PolarHBondContact O-N 3.47Å; V212-L215 PolarHBondContact O-N 3.16Å; R213-L215 PolarHBondContact O-N 2.91Å |
| 216 | S | 83.4 | Confident | 88.6 | Confident | 94 Ų | 94 | 96 Ų | 96 | 66% | 0.657 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -71.2 | -29.2 | 178.1 | 71.1 | 0 | 0 | 0 | 0 | 113.6 | V212 R213 I214 | V212-S216 VanDerWaalsContact O-CB 3.32Å; V212-S216 WeakPolarHBondContact O-CB 3.34Å; V212-S216 PolarHBondContact O-N 2.78Å; V212-S216 PolarHBondContact O-OG 3.41Å; R213-S216 WeakPolarHBondContact CA-OG 3.49Å; R213-S216 PolarHBondContact O-N 3.49Å; R213-S216 PolarHBondContact O-OG 2.86Å; I214-S216 VanDerWaalsContact C-N 3.34Å |
| 217 | S | 78.5 | Confident | 88.4 | Confident | 88 Ų | 88 | 100 Ų | 100 | 62% | 0.615 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -84.5 | -20 | 177.9 | 65.1 | 0 | 0 | 0 | 0 | 113 | R213 I214 Q219 | R213-S217 WeakPolarHBondContact O-CB 3.35Å; R213-S217 PolarHBondContact O-N 3.44Å; R213-S217 PolarHBondContact O-OG 3.47Å; I214-S217 PolarHBondContact O-N 3Å; I214-S217 PolarHBondContact O-OG 2.9Å; I214-S217 VanDerWaalsContact O-OG 3.08Å; S217-Q219 PolarHBondContact O-N 3.14Å |
| 218 | K | 79.4 | Confident | 88.2 | Confident | 78 Ų | 78 | 98 Ų | 98 | 34% | 0.339 | 52% | 0.524 | S | S | . | . | trans | -84.7 | 92.8 | 178.3 | -74.6 | 174.9 | 176 | -174.9 | 0 | 110.3 | I214 N220 D224 | I214-K218 HydrophobicContact CG2-CD 3.81Å; I214-K218 VanDerWaalsContact CG2-CE 3.46Å; I214-K218 WeakPolarHBondContact O-CB 3.31Å; I214-K218 WeakPolarHBondContact O-CD 3.38Å; I214-K218 WeakPolarHBondContact O-CG 3.49Å; I214-K218 PolarHBondContact O-N 2.89Å; I214-K218 VanDerWaalsContact O-N 3.15Å; K218-N220 PolarHBondContact O-N 3.44Å; K218-D224 HydrophobicContact CD-CB 4.35Å; K218-D224 VanDerWaalsContact CE-OD1 3.28Å; K218-D224 WeakPolarHBondContact CE-OD1 3.46Å; K218-D224 WeakPolarHBondContact CE-OD2 3.44Å; K218-D224 IonicContact NZ-OD1 2.89Å; K218-D224 PolarHBondContact NZ-OD1 3.35Å; K218-D224 IonicContact NZ-OD2 2.68Å; K218-D224 PolarHBondContact NZ-OD2 2.88Å | ||
| 219 | Q | 77.2 | Confident | 88 | Confident | 199 Ų | 199 | 96.2 Ų | 96.2 | 93% | 0.93 | 52% | 0.52 | S | S | * | . | S | Bend | trans | -62.1 | -25.3 | 177.2 | -164.5 | 109.3 | 52.8 | 0 | 0 | 113.2 | S217 | S217-Q219 PolarHBondContact O-N 3.14Š|
| 220 | N | 83.8 | Confident | 88 | Confident | 75 Ų | 75 | 100.5 Ų | 100.5 | 40% | 0.401 | 53% | 0.533 | S | S | . | . | trans | -139.3 | 104.2 | -179.9 | -169.6 | -28.6 | 0 | 0 | 0 | 112.1 | K218 L222 L223 | K218-N220 PolarHBondContact O-N 3.44Å; N220-L222 VanDerWaalsContact C-N 3.3Å; N220-L222 PolarHBondContact O-N 3.13Å; N220-L222 WeakPolarHBondContact OD1-CB 3.38Å; N220-L222 PolarHBondContact OD1-N 3.27Å; N220-L223 HydrophobicContact CB-CD1 4.04Å; N220-L223 HydrophobicContact CB-CG 4.23Å; N220-L223 PolarHBondContact O-N 2.96Å | ||
| 221 | P | 85.8 | Confident | 87.9 | Confident | 82 Ų | 82 | 104.8 Ų | 104.8 | 53% | 0.532 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -69.6 | -23.7 | -177.4 | 28.3 | -35.1 | 0 | 0 | 0 | 113.6 | D224 I225 | P221-D224 PolarHBondContact O-N 3.35Å; P221-I225 WeakPolarHBondContact O-CG1 3.43Å; P221-I225 PolarHBondContact O-N 3.3Å; P221-I225 VanDerWaalsContact O-N 3.17Å |
| 222 | L | 87.6 | Confident | 88 | Confident | 133 Ų | 133 | 110.8 Ų | 110.8 | 70% | 0.696 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -70.8 | -36.8 | -179.6 | -64.9 | 176 | 0 | 0 | 0 | 111.9 | N220 G226 | N220-L222 VanDerWaalsContact C-N 3.3Å; N220-L222 PolarHBondContact O-N 3.13Å; N220-L222 WeakPolarHBondContact OD1-CB 3.38Å; N220-L222 PolarHBondContact OD1-N 3.27Å; L222-G226 PolarHBondContact O-N 2.96Å |
| 223 | L | 87.4 | Confident | 88 | Confident | 120 Ų | 120 | 113.9 Ų | 113.9 | 63% | 0.628 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -65.4 | -40.7 | 176.2 | -67.5 | 178.8 | 0 | 0 | 0 | 111.4 | N220 G226 E227 | N220-L223 HydrophobicContact CB-CD1 4.04Å; N220-L223 HydrophobicContact CB-CG 4.23Å; N220-L223 PolarHBondContact O-N 2.96Å; L223-G226 PolarHBondContact O-N 3.46Å; L223-E227 PolarHBondContact O-N 2.96Å |
| 224 | D | 85 | Confident | 88 | Confident | 52 Ų | 52 | 112.6 Ų | 112.6 | 28% | 0.278 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -63.2 | -44.3 | 177.8 | -176.7 | 58.9 | 0 | 0 | 0 | 112.2 | K218 P221 G226 E227 Q228 | K218-D224 HydrophobicContact CD-CB 4.35Å; K218-D224 VanDerWaalsContact CE-OD1 3.28Å; K218-D224 WeakPolarHBondContact CE-OD1 3.46Å; K218-D224 WeakPolarHBondContact CE-OD2 3.44Å; K218-D224 IonicContact NZ-OD1 2.89Å; K218-D224 PolarHBondContact NZ-OD1 3.35Å; K218-D224 IonicContact NZ-OD2 2.68Å; K218-D224 PolarHBondContact NZ-OD2 2.88Å; P221-D224 PolarHBondContact O-N 3.35Å; D224-G226 VanDerWaalsContact C-N 3.3Å; D224-G226 PolarHBondContact O-N 2.9Å; D224-E227 PolarHBondContact O-N 3.35Å; D224-Q228 WeakPolarHBondContact O-CB 3.28Å; D224-Q228 PolarHBondContact O-N 2.91Å |
| 225 | I | 89.6 | Confident | 88.2 | Confident | 94 Ų | 94 | 113.6 Ų | 113.6 | 48% | 0.482 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -61 | -42.1 | 173.7 | -66.2 | 166 | 0 | 0 | 0 | 110.4 | P221 Q228 L229 | P221-I225 WeakPolarHBondContact O-CG1 3.43Å; P221-I225 PolarHBondContact O-N 3.3Å; P221-I225 VanDerWaalsContact O-N 3.17Å; I225-Q228 PolarHBondContact O-N 3.44Å; I225-L229 HydrophobicContact CG2-CD1 4.26Å; I225-L229 WeakPolarHBondContact O-CB 3.47Å; I225-L229 PolarHBondContact O-N 3.2Å |
| 226 | G | 92.8 | Very high | 88.2 | Confident | 41 Ų | 41 | 112.7 Ų | 112.7 | 42% | 0.423 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -61.5 | -45.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | L222 L223 D224 L229 K230 | L222-G226 PolarHBondContact O-N 2.96Å; L223-G226 PolarHBondContact O-N 3.46Å; D224-G226 VanDerWaalsContact C-N 3.3Å; D224-G226 PolarHBondContact O-N 2.9Å; G226-L229 PolarHBondContact O-N 3.37Å; G226-K230 WeakPolarHBondContact O-CB 3.49Å; G226-K230 PolarHBondContact O-N 3.04Å |
| 227 | E | 91.6 | Very high | 88.2 | Confident | 145 Ų | 145 | 116 Ų | 116 | 68% | 0.678 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -64.1 | -41.4 | 175.4 | -72.3 | -158.6 | 164.1 | 0 | 0 | 112.4 | L223 D224 K230 K231 | L223-E227 PolarHBondContact O-N 2.96Å; D224-E227 PolarHBondContact O-N 3.35Å; E227-K230 PolarHBondContact O-N 3.17Å; E227-K231 WeakPolarHBondContact O-CB 3.2Å; E227-K231 PolarHBondContact O-N 3.48Å |
| 228 | Q | 92.5 | Very high | 88.4 | Confident | 134 Ų | 134 | 119.4 Ų | 119.4 | 63% | 0.626 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -65.2 | -42.3 | 177.9 | -174.5 | 165.4 | 1 | 0 | 0 | 111.9 | D224 I225 K231 R232 | D224-Q228 WeakPolarHBondContact O-CB 3.28Å; D224-Q228 PolarHBondContact O-N 2.91Å; I225-Q228 PolarHBondContact O-N 3.44Å; Q228-K231 PolarHBondContact O-N 3.5Å; Q228-R232 WeakPolarHBondContact O-CB 3.44Å; Q228-R232 PolarHBondContact O-N 2.89Å |
| 229 | L | 93.9 | Very high | 88.3 | Confident | 109 Ų | 109 | 122.5 Ų | 122.5 | 57% | 0.571 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -58.9 | -48.3 | 172.4 | -115.9 | 79.1 | 0 | 0 | 0 | 110.8 | I225 G226 K231 R232 M233 | I225-L229 HydrophobicContact CG2-CD1 4.26Å; I225-L229 WeakPolarHBondContact O-CB 3.47Å; I225-L229 PolarHBondContact O-N 3.2Å; G226-L229 PolarHBondContact O-N 3.37Å; L229-K231 VanDerWaalsContact C-N 3.29Å; L229-K231 PolarHBondContact O-N 2.68Å; L229-R232 PolarHBondContact O-N 3.41Å; L229-R232 VanDerWaalsContact O-N 3.13Å; L229-M233 WeakPolarHBondContact O-CG 3.46Å; L229-M233 PolarHBondContact O-N 3.38Å |
| 230 | K | 93.9 | Very high | 87.7 | Confident | 138 Ų | 138 | 115 Ų | 115 | 60% | 0.6 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -60.1 | -39.5 | 179.5 | -166.8 | -176.9 | 178.7 | 173.6 | 0 | 111.9 | G226 E227 R234 | G226-K230 WeakPolarHBondContact O-CB 3.49Å; G226-K230 PolarHBondContact O-N 3.04Å; E227-K230 PolarHBondContact O-N 3.17Å; K230-R234 WeakPolarHBondContact O-CG 3.18Å; K230-R234 PolarHBondContact O-N 3.46Å |
| 231 | K | 94.3 | Very high | 86.7 | Confident | 149 Ų | 149 | 118.1 Ų | 118.1 | 65% | 0.648 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -67.2 | -40.5 | 175.9 | -172 | 176.6 | -179.6 | 177.4 | 0 | 111.8 | E227 Q228 L229 H235 | E227-K231 WeakPolarHBondContact O-CB 3.2Å; E227-K231 PolarHBondContact O-N 3.48Å; Q228-K231 PolarHBondContact O-N 3.5Å; L229-K231 VanDerWaalsContact C-N 3.29Å; L229-K231 PolarHBondContact O-N 2.68Å; K231-H235 PolarHBondContact O-N 2.91Å; K231-H235 VanDerWaalsContact O-N 3.14Å |
| 232 | R | 94 | Very high | 85.2 | Confident | 171 Ų | 171 | 123.5 Ų | 123.5 | 65% | 0.645 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -66.7 | -42.8 | 177.6 | -167.4 | -169.9 | 179.5 | 138.3 | 5.8 | 112 | Q228 L229 R234 H235 E236 | Q228-R232 WeakPolarHBondContact O-CB 3.44Å; Q228-R232 PolarHBondContact O-N 2.89Å; L229-R232 PolarHBondContact O-N 3.41Å; L229-R232 VanDerWaalsContact O-N 3.13Å; R232-R234 VanDerWaalsContact C-N 3.34Å; R232-R234 PolarHBondContact O-N 2.73Å; R232-H235 WeakPolarHBondContact O-CB 3.41Å; R232-H235 PolarHBondContact O-N 3.06Å; R232-H235 VanDerWaalsContact O-N 3.11Å; R232-E236 IonicContact CZ-OE1 3.83Å; R232-E236 IonicContact NE-OE1 2.89Å; R232-E236 PolarHBondContact NE-OE1 3.08Å; R232-E236 IonicContact NH2-OE1 3.91Å; R232-E236 PolarHBondContact O-N 3.5Å |
| 233 | M | 92.6 | Very high | 85 | Confident | 132 Ų | 132 | 123 Ų | 123 | 65% | 0.65 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -59.1 | -43.8 | 176.4 | -73.5 | -164 | 74.2 | 0 | 0 | 112.1 | L229 H235 E236 E237 | L229-M233 WeakPolarHBondContact O-CG 3.46Å; L229-M233 PolarHBondContact O-N 3.38Å; M233-H235 VanDerWaalsContact C-N 3.32Å; M233-H235 PolarHBondContact O-N 3.26Å; M233-E236 PolarHBondContact O-N 3.31Å; M233-E237 WeakPolarHBondContact O-CB 3.36Å; M233-E237 PolarHBondContact O-N 3.15Å |
| 234 | R | 92.4 | Very high | 84.9 | Confident | 120 Ų | 120 | 123.2 Ų | 123.2 | 45% | 0.453 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -62.4 | -38.8 | 174.4 | -68.6 | -160.9 | -57.2 | -90 | 7.4 | 112.6 | K230 R232 E237 E238 | K230-R234 WeakPolarHBondContact O-CG 3.18Å; K230-R234 PolarHBondContact O-N 3.46Å; R232-R234 VanDerWaalsContact C-N 3.34Å; R232-R234 PolarHBondContact O-N 2.73Å; R234-E237 PolarHBondContact O-N 3.5Å; R234-E238 WeakPolarHBondContact O-CG 3.32Å; R234-E238 PolarHBondContact O-N 3.25Å |
| 235 | H | 89.9 | Confident | 84.9 | Confident | 103 Ų | 103 | 127.1 Ų | 127.1 | 48% | 0.477 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -67.3 | -37.7 | 178.3 | -168.1 | -12.8 | 0 | 0 | 0 | 112.4 | K231 R232 M233 Q239 | K231-H235 PolarHBondContact O-N 2.91Å; K231-H235 VanDerWaalsContact O-N 3.14Å; R232-H235 WeakPolarHBondContact O-CB 3.41Å; R232-H235 PolarHBondContact O-N 3.06Å; R232-H235 VanDerWaalsContact O-N 3.11Å; M233-H235 VanDerWaalsContact C-N 3.32Å; M233-H235 PolarHBondContact O-N 3.26Å; H235-Q239 PolarHBondContact CE1-NE2 3.25Å; H235-Q239 PolarHBondContact ND1-NE2 3.19Å; H235-Q239 WeakPolarHBondContact O-CB 3.48Å; H235-Q239 WeakPolarHBondContact O-CG 3.5Å; H235-Q239 PolarHBondContact O-N 2.71Å; H235-Q239 VanDerWaalsContact O-N 3.1Å |
| 236 | E | 85.6 | Confident | 84.6 | Confident | 110 Ų | 110 | 129.1 Ų | 129.1 | 51% | 0.514 | 66% | 0.657 | S | S | . | * | H | α-helix | trans | -69.5 | -35.4 | 176.2 | -72.6 | 173 | -169.7 | 0 | 0 | 111.4 | R232 M233 Q239 G240 | R232-E236 IonicContact CZ-OE1 3.83Å; R232-E236 IonicContact NE-OE1 2.89Å; R232-E236 PolarHBondContact NE-OE1 3.08Å; R232-E236 IonicContact NH2-OE1 3.91Å; R232-E236 PolarHBondContact O-N 3.5Å; M233-E236 PolarHBondContact O-N 3.31Å; E236-Q239 CarbonylContact O-C 3.58Å; E236-Q239 PolarHBondContact O-N 3.23Å; E236-G240 PolarHBondContact O-N 2.82Å; E236-G240 VanDerWaalsContact O-N 3.15Å |
| 237 | E | 84.4 | Confident | 84.1 | Confident | 162 Ų | 162 | 134.6 Ų | 134.6 | 76% | 0.757 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -65.5 | -42.6 | 173.2 | -171.6 | 173.6 | -161.1 | 0 | 0 | 112.3 | M233 R234 Q239 | M233-E237 WeakPolarHBondContact O-CB 3.36Å; M233-E237 PolarHBondContact O-N 3.15Å; R234-E237 PolarHBondContact O-N 3.5Å; E237-Q239 VanDerWaalsContact C-N 3.3Å; E237-Q239 PolarHBondContact O-N 2.83Å |
| 238 | E | 83.1 | Confident | 83.6 | Confident | 160 Ų | 160 | 133.9 Ų | 133.9 | 75% | 0.748 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -72 | -19.2 | 176.2 | -71.8 | 172.5 | -171.1 | 0 | 0 | 113.8 | R234 | R234-E238 WeakPolarHBondContact O-CG 3.32Å; R234-E238 PolarHBondContact O-N 3.25Å |
| 239 | Q | 76.1 | Confident | 83 | Confident | 144 Ų | 144 | 133.9 Ų | 133.9 | 67% | 0.673 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.5 | 14.4 | 178.7 | -69.2 | -152.4 | 112.7 | 0 | 0 | 114.2 | H235 E236 E237 | H235-Q239 PolarHBondContact CE1-NE2 3.25Å; H235-Q239 PolarHBondContact ND1-NE2 3.19Å; H235-Q239 WeakPolarHBondContact O-CB 3.48Å; H235-Q239 WeakPolarHBondContact O-CG 3.5Å; H235-Q239 PolarHBondContact O-N 2.71Å; H235-Q239 VanDerWaalsContact O-N 3.1Å; E236-Q239 CarbonylContact O-C 3.58Å; E236-Q239 PolarHBondContact O-N 3.23Å; E237-Q239 VanDerWaalsContact C-N 3.3Å; E237-Q239 PolarHBondContact O-N 2.83Å |
| 240 | G | 65.4 | Low | 82.2 | Confident | 42 Ų | 42 | 135.8 Ų | 135.8 | 43% | 0.433 | 68% | 0.682 | S | S | . | * | S | Bend | trans | -60.1 | 151.7 | 168.4 | 0 | 0 | 0 | 0 | 0 | 112 | E236 S242 | E236-G240 PolarHBondContact O-N 2.82Å; E236-G240 VanDerWaalsContact O-N 3.15Å; G240-S242 PolarHBondContact O-N 3.23Å |
| 241 | P | 63.4 | Low | 81.2 | Confident | 139 Ų | 139 | 135.6 Ų | 135.6 | 90% | 0.903 | 69% | 0.689 | S | S | * | * | trans | -67.3 | 123.8 | -170.1 | 29.5 | -33.3 | 0 | 0 | 0 | 110.9 | ||||
| 242 | S | 52.9 | Low | 80 | Confident | 195 Ų | 195 | 134.4 Ų | 134.4 | 100% | 1.364 | 69% | 0.692 | S | S | * | * | trans | -103.1 | 0 | 160 | -166.8 | 0 | 0 | 0 | 0 | 108 | G240 | G240-S242 PolarHBondContact O-N 3.23Š|
Retrieved 242 of 242 residues in 41.7 ms
(Link to these results)