| 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 | 42.2 | Very low | 44.7 | Very low | 240 Ų | 240 | 157.2 Ų | 157.2 | 100% | 1.182 | 86% | 0.858 | S | S | * | * | 0 | 111.3 | 0 | -69.4 | 178.2 | 172.2 | 0 | 0 | 107 | |||||
| 2 | Y | 37.8 | Very low | 44.8 | Very low | 239 Ų | 239 | 152.8 Ų | 152.8 | 94% | 0.937 | 85% | 0.848 | S | S | * | * | trans | -86.2 | 132.7 | 178.5 | -75.1 | -92.1 | 0 | 0 | 0 | 109.2 | ||||
| 3 | T | 47 | Very low | 45.3 | Very low | 139 Ų | 139 | 149.8 Ų | 149.8 | 85% | 0.853 | 83% | 0.829 | S | S | * | * | trans | -122 | 116.5 | 164.2 | 61.7 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 4 | A | 45.6 | Very low | 45.4 | Very low | 105 Ų | 105 | 153.1 Ų | 153.1 | 87% | 0.868 | 83% | 0.831 | S | S | * | * | trans | -72.1 | 131.3 | 180 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 5 | G | 43 | Very low | 45.6 | Very low | 72 Ų | 72 | 148.7 Ų | 148.7 | 74% | 0.742 | 82% | 0.816 | S | S | * | * | trans | -103.7 | 114.8 | 162.4 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 6 | L | 43.9 | Very low | 45.7 | Very low | 173 Ų | 173 | 147.3 Ų | 147.3 | 91% | 0.906 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 126 | 179.4 | -74.3 | 155 | 0 | 0 | 0 | 110.7 | ||
| 7 | N | 40.8 | Very low | 45.6 | Very low | 146 Ų | 146 | 151.8 Ų | 151.8 | 78% | 0.781 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 138.3 | 167.3 | -81.6 | -48.5 | 0 | 0 | 0 | 110.5 | F9 | N7-F9 PolarHBondContact O-N 3.47Š|
| 8 | P | 53.5 | Low | 45.5 | Very low | 119 Ų | 119 | 148.8 Ų | 148.8 | 77% | 0.773 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 122.4 | 167.8 | 27.9 | -30.1 | 0 | 0 | 0 | 109.6 | Y10 | P8-Y10 PolarHBondContact O-N 3.07Š|
| 9 | F | 46.3 | Very low | 45.5 | Very low | 210 Ų | 210 | 144.9 Ų | 144.9 | 92% | 0.921 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 122.4 | 170.2 | -89.5 | -99.4 | 0 | 0 | 0 | 110.3 | N7 A11 | N7-F9 PolarHBondContact O-N 3.47Å; F9-A11 PolarHBondContact O-N 3.12Å |
| 10 | Y | 46.9 | Very low | 45.5 | Very low | 204 Ų | 204 | 148.5 Ų | 148.5 | 80% | 0.8 | 80% | 0.795 | S | S | * | * | trans | -68.7 | 109.4 | 171.2 | -136.9 | -98.3 | 0 | 0 | 0 | 108.8 | P8 | P8-Y10 PolarHBondContact O-N 3.07Š| ||
| 11 | A | 44.4 | Very low | 45.8 | Very low | 82 Ų | 82 | 146.8 Ų | 146.8 | 68% | 0.678 | 79% | 0.794 | S | S | * | * | trans | -68.6 | 141.9 | 173.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | F9 | F9-A11 PolarHBondContact O-N 3.12Š| ||
| 12 | S | 45.8 | Very low | 46.2 | Very low | 105 Ų | 105 | 139.5 Ų | 139.5 | 73% | 0.734 | 77% | 0.772 | S | S | * | * | trans | -46.6 | 136.3 | -179.9 | -163 | 0 | 0 | 0 | 0 | 113.8 | F14 | S12-F14 PolarHBondContact O-N 3.08Š| ||
| 13 | N | 52.3 | Low | 46.1 | Very low | 113 Ų | 113 | 131.2 Ų | 131.2 | 60% | 0.604 | 76% | 0.76 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.4 | 63.7 | 179.9 | -75.1 | -66.2 | 0 | 0 | 0 | 113.1 | ||
| 14 | F | 46.1 | Very low | 45.8 | Very low | 196 Ų | 196 | 128.3 Ų | 128.3 | 86% | 0.86 | 76% | 0.757 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -122.5 | -13.3 | 161.3 | -147 | -97.2 | 0 | 0 | 0 | 112.3 | S12 | S12-F14 PolarHBondContact O-N 3.08Š|
| 15 | S | 49.1 | Very low | 45.5 | Very low | 87 Ų | 87 | 133.7 Ų | 133.7 | 61% | 0.608 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -95.5 | -4.9 | -178.7 | -58.4 | 0 | 0 | 0 | 0 | 115 | W17 S18 | S15-W17 VanDerWaalsContact C-N 3.27Å; S15-W17 PolarHBondContact O-N 3.43Å; S15-S18 PolarHBondContact O-N 3.16Å |
| 16 | L | 46.5 | Very low | 45.4 | Very low | 126 Ų | 126 | 134.1 Ų | 134.1 | 66% | 0.66 | 76% | 0.758 | S | S | * | * | H | α-helix | trans | -70.8 | -18.1 | -176.8 | -122.9 | 85.1 | 0 | 0 | 0 | 114.2 | ||
| 17 | W | 44.2 | Very low | 45.5 | Very low | 225 Ų | 225 | 132.9 Ų | 132.9 | 85% | 0.852 | 75% | 0.749 | S | S | * | * | H | α-helix | trans | -77.2 | -23.9 | 173.7 | -161.4 | 1.1 | 0 | 0 | 0 | 112.4 | S15 | S15-W17 VanDerWaalsContact C-N 3.27Å; S15-W17 PolarHBondContact O-N 3.43Å |
| 18 | S | 43.2 | Very low | 45.2 | Very low | 98 Ų | 98 | 133.9 Ų | 133.9 | 69% | 0.685 | 75% | 0.754 | S | S | * | * | H | α-helix | trans | -84.7 | -23.3 | 179.3 | -68.1 | 0 | 0 | 0 | 0 | 113.7 | S15 | S15-S18 PolarHBondContact O-N 3.16Å |
| 19 | A | 45.9 | Very low | 45.2 | Very low | 75 Ų | 75 | 133.7 Ų | 133.7 | 62% | 0.62 | 75% | 0.751 | S | S | * | * | H | α-helix | trans | -81.4 | -21.9 | -176.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||
| 20 | Y | 46.3 | Very low | 45.2 | Very low | 215 Ų | 215 | 131.6 Ų | 131.6 | 84% | 0.843 | 75% | 0.748 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.2 | -5.4 | -178.8 | -159.2 | -102.7 | 0 | 0 | 0 | 114.1 | ||
| 21 | C | 51.2 | Low | 45.3 | Very low | 113 Ų | 113 | 131.5 Ų | 131.5 | 76% | 0.764 | 75% | 0.752 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.9 | 2.4 | 175.9 | -67 | 0 | 0 | 0 | 0 | 114 | ||
| 22 | A | 51.3 | Low | 45.5 | Very low | 87 Ų | 87 | 137.1 Ų | 137.1 | 72% | 0.719 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -119 | 13.3 | -174.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||
| 23 | G | 35.7 | Very low | 45.6 | Very low | 66 Ų | 66 | 137.9 Ų | 137.9 | 68% | 0.68 | 76% | 0.764 | S | S | * | * | trans | -99.5 | 94.4 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 24 | G | 39.3 | Very low | 45.5 | Very low | 78 Ų | 78 | 137.4 Ų | 137.4 | 80% | 0.804 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 129 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||
| 25 | F | 39 | Very low | 45.5 | Very low | 217 Ų | 217 | 136 Ų | 136 | 95% | 0.952 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -94.7 | 121.7 | 152.9 | -91.9 | -87.7 | 0 | 0 | 0 | 108.2 | ||
| 26 | A | 42.5 | Very low | 45.8 | Very low | 81 Ų | 81 | 134.9 Ų | 134.9 | 67% | 0.669 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -79.3 | 148.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||
| 27 | M | 44.8 | Very low | 45.6 | Very low | 147 Ų | 147 | 136.1 Ų | 136.1 | 72% | 0.724 | 76% | 0.76 | S | S | * | * | trans | 71.2 | 98.1 | 160.8 | -55.8 | -57.4 | 139.8 | 0 | 0 | 117.4 | T29 | M27-T29 HydrophobicContact SD-CG2 4.48Š| ||
| 28 | D | 34.6 | Very low | 45.9 | Very low | 167 Ų | 167 | 128.7 Ų | 128.7 | 89% | 0.893 | 75% | 0.747 | S | S | * | * | -142.6 | 121.3 | 106.4 | -87 | -38.5 | 0 | 0 | 0 | 109.6 | I30 | D28-I30 PolarHBondContact O-N 3.42Š| |||
| 29 | T | 53.1 | Low | 46.2 | Very low | 115 Ų | 115 | 128.5 Ų | 128.5 | 71% | 0.706 | 74% | 0.738 | S | S | * | * | trans | -73.7 | 105.8 | 175.6 | 45.9 | 0 | 0 | 0 | 0 | 109.6 | M27 | M27-T29 HydrophobicContact SD-CG2 4.48Š| ||
| 30 | I | 46.9 | Very low | 46.8 | Very low | 166 Ų | 166 | 130.4 Ų | 130.4 | 85% | 0.851 | 74% | 0.736 | S | S | * | * | trans | -156.5 | 119.9 | 143.8 | -83.4 | 123.6 | 0 | 0 | 0 | 108.5 | D28 | D28-I30 PolarHBondContact O-N 3.42Š| ||
| 31 | K | 49.7 | Very low | 46.9 | Very low | 202 Ų | 202 | 127.7 Ų | 127.7 | 88% | 0.878 | 74% | 0.736 | S | S | * | * | trans | 1.1 | 115.8 | 168 | -77.8 | 169.8 | 171.1 | 167.6 | 0 | 117.8 | ||||
| 32 | K | 47.1 | Very low | 46.9 | Very low | 200 Ų | 200 | 130.1 Ų | 130.1 | 87% | 0.87 | 74% | 0.736 | S | S | * | * | trans | -121.1 | 130.4 | 145.9 | -75.5 | 173 | 170.8 | 173.1 | 0 | 108.3 | S34 | K32-S34 PolarHBondContact O-N 2.95Š| ||
| 33 | P | 48.9 | Very low | 46.7 | Very low | 122 Ų | 122 | 132.8 Ų | 132.8 | 79% | 0.792 | 74% | 0.743 | S | S | * | * | trans | -71.9 | 120.5 | 178.8 | 29.5 | -31.1 | 0 | 0 | 0 | 108.9 | F35 | P33-F35 PolarHBondContact O-N 2.98Å; P33-F35 VanDerWaalsContact O-N 3.14Å | ||
| 34 | S | 50.3 | Low | 47.3 | Very low | 103 Ų | 103 | 132.8 Ų | 132.8 | 72% | 0.72 | 74% | 0.743 | S | S | * | * | trans | -68.5 | 103 | 164.9 | 49.6 | 0 | 0 | 0 | 0 | 107.8 | K32 C36 | K32-S34 PolarHBondContact O-N 2.95Å; S34-C36 PolarHBondContact O-N 2.9Å; S34-C36 VanDerWaalsContact O-N 3.11Å | ||
| 35 | F | 45 | Very low | 47.5 | Very low | 166 Ų | 166 | 137.3 Ų | 137.3 | 73% | 0.728 | 75% | 0.748 | S | S | * | * | trans | -75.6 | 95.1 | 173.5 | -149.9 | -97.7 | 0 | 0 | 0 | 108 | P33 I40 | P33-F35 PolarHBondContact O-N 2.98Å; P33-F35 VanDerWaalsContact O-N 3.14Å; F35-I40 HydrophobicContact CE1-CD1 4.07Å; F35-I40 HydrophobicContact CE1-CG1 4.31Å | ||
| 36 | C | 55.9 | Low | 47.5 | Very low | 64 Ų | 64 | 131.1 Ų | 131.1 | 43% | 0.432 | 74% | 0.738 | S | S | . | * | trans | -91.6 | 141.2 | 172.2 | 41.6 | 0 | 0 | 0 | 0 | 109.4 | S34 A38 D39 | S34-C36 PolarHBondContact O-N 2.9Å; S34-C36 VanDerWaalsContact O-N 3.11Å; C36-A38 PolarHBondContact O-N 2.85Å; C36-D39 PolarHBondContact O-N 2.91Å; C36-D39 VanDerWaalsContact O-N 3.08Å | ||
| 37 | I | 42.7 | Very low | 47.4 | Very low | 152 Ų | 152 | 136.1 Ų | 136.1 | 78% | 0.779 | 75% | 0.747 | S | S | * | * | G | 310 helix | trans | -59.4 | -9.8 | -177.1 | -72.8 | 159.3 | 0 | 0 | 0 | 113 | D39 | I37-D39 VanDerWaalsContact C-N 3.33Š|
| 38 | A | 50.5 | Low | 47.2 | Very low | 69 Ų | 69 | 135.9 Ų | 135.9 | 57% | 0.57 | 75% | 0.749 | S | S | * | * | G | 310 helix | trans | -70.3 | -22.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | C36 I40 | C36-A38 PolarHBondContact O-N 2.85Å; A38-I40 VanDerWaalsContact C-N 3.31Å; A38-I40 PolarHBondContact O-N 3.09Å |
| 39 | D | 50.4 | Low | 47.6 | Very low | 93 Ų | 93 | 135.7 Ų | 135.7 | 50% | 0.497 | 75% | 0.746 | S | S | . | * | G | 310 helix | trans | -80.4 | -7.7 | -175.4 | -65.3 | -27 | 0 | 0 | 0 | 114 | C36 I37 | C36-D39 PolarHBondContact O-N 2.91Å; C36-D39 VanDerWaalsContact O-N 3.08Å; I37-D39 VanDerWaalsContact C-N 3.33Å |
| 40 | I | 57.2 | Low | 47.2 | Very low | 115 Ų | 115 | 135.8 Ų | 135.8 | 59% | 0.59 | 75% | 0.749 | S | S | * | * | G | 310 helix | trans | -87.9 | -8.3 | -177.2 | -57.7 | 176.1 | 0 | 0 | 0 | 112.2 | F35 A38 | F35-I40 HydrophobicContact CE1-CD1 4.07Å; F35-I40 HydrophobicContact CE1-CG1 4.31Å; A38-I40 VanDerWaalsContact C-N 3.31Å; A38-I40 PolarHBondContact O-N 3.09Å |
| 41 | L | 49.2 | Very low | 46.9 | Very low | 158 Ų | 158 | 131 Ų | 131 | 83% | 0.827 | 74% | 0.741 | S | S | * | * | G | 310 helix | trans | -104.6 | 9.4 | 180 | -87.2 | 159.4 | 0 | 0 | 0 | 114.4 | ||
| 42 | Q | 51.4 | Low | 46.2 | Very low | 165 Ų | 165 | 127.1 Ų | 127.1 | 77% | 0.771 | 74% | 0.739 | S | S | * | * | trans | -108 | 16.1 | 176.5 | -122.2 | 103.9 | 36.6 | 0 | 0 | 114.3 | ||||
| 43 | V | 46.4 | Very low | 45.9 | Very low | 143 Ų | 143 | 123.2 Ų | 123.2 | 87% | 0.867 | 74% | 0.736 | S | S | * | * | trans | -107.6 | 77.9 | 168.8 | -178.6 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 44 | G | 47.8 | Very low | 45.4 | Very low | 66 Ų | 66 | 121.5 Ų | 121.5 | 68% | 0.68 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -162 | 104.4 | 173.2 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||
| 45 | D | 43.3 | Very low | 44.9 | Very low | 172 Ų | 172 | 124.2 Ų | 124.2 | 92% | 0.92 | 74% | 0.738 | S | S | * | * | trans | 66.4 | 97 | 172.1 | -77.6 | -33.9 | 0 | 0 | 0 | 118.8 | ||||
| 46 | A | 39.6 | Very low | 45 | Very low | 88 Ų | 88 | 124.5 Ų | 124.5 | 73% | 0.727 | 74% | 0.744 | S | S | * | * | -161.8 | 112.9 | 125.7 | 0 | 0 | 0 | 0 | 0 | 108.4 | |||||
| 47 | E | 39.6 | Very low | 44.3 | Very low | 186 Ų | 186 | 128.3 Ų | 128.3 | 87% | 0.869 | 77% | 0.766 | S | S | * | * | S | Bend | -167.8 | 127.2 | 125.1 | -85.3 | -49.8 | 102.2 | 0 | 0 | 108.3 | |||
| 48 | N | 42.5 | Very low | 44.4 | Very low | 142 Ų | 142 | 128.7 Ų | 128.7 | 76% | 0.759 | 76% | 0.764 | S | S | * | * | trans | 100.9 | 82.3 | 156.5 | -152.3 | -15.7 | 0 | 0 | 0 | 119.4 | ||||
| 49 | I | 42.5 | Very low | 44 | Very low | 163 Ų | 163 | 134.1 Ų | 134.1 | 84% | 0.836 | 78% | 0.78 | S | S | * | * | trans | -148.8 | 123.9 | 130.5 | -54 | -175.5 | 0 | 0 | 0 | 108.7 | ||||
| 50 | P | 44.5 | Very low | 43.3 | Very low | 117 Ų | 117 | 132.5 Ų | 132.5 | 76% | 0.76 | 78% | 0.784 | S | S | * | * | trans | -92.2 | 129.3 | 170.3 | 33.6 | -26.4 | 0 | 0 | 0 | 111 | ||||
| 51 | G | 40.1 | Very low | 42.3 | Very low | 66 Ų | 66 | 136 Ų | 136 | 68% | 0.68 | 80% | 0.798 | S | S | * | * | trans | 108.2 | 105.3 | 159.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 52 | S | 35.8 | Very low | 41.7 | Very low | 120 Ų | 120 | 138.5 Ų | 138.5 | 84% | 0.839 | 80% | 0.796 | S | S | * | * | trans | 179.9 | 106.9 | 133.4 | -82.6 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 53 | S | 39.3 | Very low | 40.9 | Very low | 117 Ų | 117 | 136.6 Ų | 136.6 | 82% | 0.818 | 80% | 0.802 | S | S | * | * | trans | 24.2 | 117.4 | 130.3 | -42.8 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 54 | A | 38.3 | Very low | 40.5 | Very low | 87 Ų | 87 | 137.4 Ų | 137.4 | 72% | 0.719 | 80% | 0.796 | S | S | * | * | 79.6 | 147.7 | 117 | 0 | 0 | 0 | 0 | 0 | 122.2 | |||||
| 55 | L | 41.4 | Very low | 40 | Very low | 159 Ų | 159 | 139.6 Ų | 139.6 | 83% | 0.832 | 80% | 0.796 | S | S | * | * | trans | 87.2 | 100.5 | 159.5 | -44 | -177.5 | 0 | 0 | 0 | 115.4 | ||||
| 56 | M | 45.9 | Very low | 39.6 | Very low | 173 Ų | 173 | 139.7 Ų | 139.7 | 85% | 0.852 | 79% | 0.79 | S | S | * | * | 57.9 | 107.5 | 77.1 | -166.6 | 154.3 | -168.3 | 0 | 0 | 113.2 | |||||
| 57 | T | 42 | Very low | 39.5 | Very low | 144 Ų | 144 | 139.8 Ų | 139.8 | 88% | 0.883 | 79% | 0.791 | S | S | * | * | trans | -158.8 | 130.6 | 137.4 | -60.7 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 58 | H | 45.3 | Very low | 39.5 | Very low | 160 Ų | 160 | 136.4 Ų | 136.4 | 74% | 0.741 | 79% | 0.788 | S | S | * | * | trans | -85.8 | 141 | 176.7 | 175.7 | -96.5 | 0 | 0 | 0 | 110 | ||||
| 59 | M | 41.8 | Very low | 39.4 | Very low | 183 Ų | 183 | 133.4 Ų | 133.4 | 90% | 0.901 | 79% | 0.791 | S | S | * | * | trans | -178.3 | 117.3 | 141 | -102.2 | 158.2 | 106.8 | 0 | 0 | 111.1 | ||||
| 60 | G | 35.5 | Very low | 39.2 | Very low | 58 Ų | 58 | 131.4 Ų | 131.4 | 60% | 0.598 | 79% | 0.791 | S | S | * | * | trans | -89.9 | 145.5 | 154.6 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 61 | H | 36.9 | Very low | 39.6 | Very low | 189 Ų | 189 | 131.1 Ų | 131.1 | 88% | 0.875 | 79% | 0.79 | S | S | * | * | -175.1 | 119 | 129.9 | -104.3 | 86.9 | 0 | 0 | 0 | 111.3 | |||||
| 62 | R | 35.8 | Very low | 39.9 | Very low | 210 Ų | 210 | 136 Ų | 136 | 79% | 0.792 | 80% | 0.799 | S | S | * | * | trans | 14 | 117.2 | 138.6 | -160.3 | 174.7 | -171.9 | -101.1 | 1.5 | 117.6 | ||||
| 63 | S | 34.9 | Very low | 40.1 | Very low | 126 Ų | 126 | 142 Ų | 142 | 88% | 0.881 | 80% | 0.803 | S | S | * | * | trans | -153.5 | 129.3 | 135.2 | -83.6 | 0 | 0 | 0 | 0 | 112 | ||||
| 64 | Q | 38 | Very low | 40.6 | Very low | 159 Ų | 159 | 142 Ų | 142 | 74% | 0.743 | 80% | 0.8 | S | S | * | * | trans | -66.7 | 137.3 | 173.8 | -178.7 | -174.3 | -0 | 0 | 0 | 109.7 | ||||
| 65 | V | 36.8 | Very low | 40.8 | Very low | 113 Ų | 113 | 142.8 Ų | 142.8 | 69% | 0.685 | 80% | 0.801 | S | S | * | * | 171.6 | 141.9 | 121.2 | -83.5 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 66 | H | 35.6 | Very low | 41.2 | Very low | 173 Ų | 173 | 141.1 Ų | 141.1 | 80% | 0.801 | 80% | 0.799 | S | S | * | * | trans | 63.5 | 108.6 | 160.3 | -52.7 | -60.6 | 0 | 0 | 0 | 120.6 | ||||
| 67 | A | 36.9 | Very low | 41.3 | Very low | 91 Ų | 91 | 139.6 Ų | 139.6 | 75% | 0.752 | 80% | 0.8 | S | S | * | * | 168.5 | 111.3 | 100.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 68 | S | 40.5 | Very low | 41.6 | Very low | 114 Ų | 114 | 135.4 Ų | 135.4 | 80% | 0.797 | 79% | 0.785 | S | S | * | * | trans | 42.4 | 93.3 | 142.9 | 60.4 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 69 | G | 40.5 | Very low | 41.8 | Very low | 79 Ų | 79 | 134.4 Ų | 134.4 | 81% | 0.814 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 131.2 | 145.8 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||
| 70 | S | 37.3 | Very low | 41.4 | Very low | 122 Ų | 122 | 134.4 Ų | 134.4 | 85% | 0.853 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -101.7 | 121.2 | 170.4 | -117.7 | 0 | 0 | 0 | 0 | 109.8 | ||
| 71 | P | 52.7 | Low | 41.6 | Very low | 111 Ų | 111 | 140 Ų | 140 | 72% | 0.721 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -88.5 | 152 | 178.8 | 34 | -31.8 | 0 | 0 | 0 | 112.8 | ||
| 72 | L | 46.3 | Very low | 41.8 | Very low | 169 Ų | 169 | 136.5 Ų | 136.5 | 89% | 0.885 | 80% | 0.798 | S | S | * | * | trans | 18 | 118.9 | 148.4 | -56.4 | 172.6 | 0 | 0 | 0 | 118.3 | ||||
| 73 | R | 39.9 | Very low | 42 | Very low | 245 Ų | 245 | 134.6 Ų | 134.6 | 93% | 0.925 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 126 | 172.4 | -172 | -179.1 | -176.4 | 179.5 | 1.8 | 111.2 | ||
| 74 | P | 49.7 | Very low | 42.3 | Very low | 116 Ų | 116 | 139.6 Ų | 139.6 | 75% | 0.753 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -90.1 | 155.2 | 172.4 | 33 | -29.2 | 0 | 0 | 0 | 113.1 | ||
| 75 | S | 43.6 | Very low | 42.2 | Very low | 104 Ų | 104 | 135.6 Ų | 135.6 | 73% | 0.727 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 147.7 | 175.9 | -171.9 | 0 | 0 | 0 | 0 | 112.3 | ||
| 76 | P | 49.9 | Very low | 42.2 | Very low | 124 Ų | 124 | 133.9 Ų | 133.9 | 81% | 0.805 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -80.3 | 124.8 | 178.7 | 31.2 | -30.7 | 0 | 0 | 0 | 111.9 | ||
| 77 | V | 47.7 | Very low | 42.2 | Very low | 142 Ų | 142 | 136.8 Ų | 136.8 | 86% | 0.861 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -94.8 | 135.7 | 172.1 | -178 | 0 | 0 | 0 | 0 | 108.7 | ||
| 78 | G | 47.3 | Very low | 42.3 | Very low | 56 Ų | 56 | 138.7 Ų | 138.7 | 58% | 0.577 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 166.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||
| 79 | P | 50.1 | Low | 42.3 | Very low | 139 Ų | 139 | 140.1 Ų | 140.1 | 90% | 0.903 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -82.1 | 124.5 | -174.3 | 31.6 | -31.1 | 0 | 0 | 0 | 111.6 | ||
| 80 | E | 33.7 | Very low | 42.9 | Very low | 182 Ų | 182 | 142.5 Ų | 142.5 | 85% | 0.85 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -95.9 | 142.3 | 167 | -124.2 | -83 | 133 | 0 | 0 | 109.2 | ||
| 81 | Q | 39.3 | Very low | 42.7 | Very low | 176 Ų | 176 | 139.9 Ų | 139.9 | 82% | 0.822 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -85.5 | 141.9 | -177.5 | -65.7 | 178.6 | -14.5 | 0 | 0 | 109.9 | ||
| 82 | S | 41.1 | Very low | 42 | Very low | 115 Ų | 115 | 140.1 Ų | 140.1 | 80% | 0.804 | 81% | 0.812 | S | S | * | * | trans | -125.9 | 114.1 | 163.9 | -97.2 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 83 | I | 40.5 | Very low | 41.9 | Very low | 171 Ų | 171 | 136.3 Ų | 136.3 | 88% | 0.877 | 80% | 0.797 | S | S | * | * | trans | -140.7 | 123.2 | 154.5 | -64.1 | -171.6 | 0 | 0 | 0 | 109.3 | ||||
| 84 | Y | 40.5 | Very low | 41.7 | Very low | 230 Ų | 230 | 134.7 Ų | 134.7 | 90% | 0.902 | 79% | 0.793 | S | S | * | * | trans | -64.9 | 149.2 | 167.9 | -93.2 | -98.8 | 0 | 0 | 0 | 112.6 | ||||
| 85 | G | 35.2 | Very low | 41.3 | Very low | 76 Ų | 76 | 137.6 Ų | 137.6 | 78% | 0.784 | 80% | 0.796 | S | S | * | * | trans | 98.5 | 106.4 | 139.9 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 86 | G | 36.8 | Very low | 41.1 | Very low | 77 Ų | 77 | 142.9 Ų | 142.9 | 79% | 0.794 | 80% | 0.8 | S | S | * | * | trans | -75.3 | 154.7 | 173.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 87 | R | 36.2 | Very low | 40.5 | Very low | 233 Ų | 233 | 145.6 Ų | 145.6 | 88% | 0.879 | 80% | 0.801 | S | S | * | * | trans | -151.5 | 118.2 | 153 | -86.5 | -133.4 | -177.5 | -107.3 | 1 | 110.9 | ||||
| 88 | V | 39.5 | Very low | 40.4 | Very low | 131 Ų | 131 | 142.5 Ų | 142.5 | 79% | 0.794 | 80% | 0.799 | S | S | * | * | trans | 38.5 | 118.2 | 145.9 | -61.2 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 89 | N | 40.9 | Very low | 40 | Very low | 145 Ų | 145 | 147.6 Ų | 147.6 | 78% | 0.775 | 81% | 0.811 | S | S | * | * | trans | -57.8 | 157.1 | 154.9 | -151.9 | 20.2 | 0 | 0 | 0 | 110.3 | ||||
| 90 | P | 51.6 | Low | 39.5 | Very low | 129 Ų | 129 | 149 Ų | 149 | 84% | 0.838 | 81% | 0.805 | S | S | * | * | -150 | 152.5 | 68.7 | 36.6 | -15.7 | 0 | 0 | 0 | 116.2 | |||||
| 91 | G | 33.2 | Very low | 39.7 | Very low | 66 Ų | 66 | 148.4 Ų | 148.4 | 68% | 0.68 | 81% | 0.807 | S | S | * | * | trans | 164.4 | 56.2 | 162.6 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 92 | S | 38.3 | Very low | 39.7 | Very low | 117 Ų | 117 | 145 Ų | 145 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | trans | -132.6 | 108.4 | 163.3 | -170 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 93 | P | 45.4 | Very low | 39.8 | Very low | 89 Ų | 89 | 144.8 Ų | 144.8 | 58% | 0.578 | 80% | 0.797 | S | S | * | * | trans | -119.9 | 127.2 | 142.8 | 36.2 | -24.2 | 0 | 0 | 0 | 106 | ||||
| 94 | Y | 35.8 | Very low | 39.7 | Very low | 210 Ų | 210 | 142.5 Ų | 142.5 | 82% | 0.824 | 79% | 0.79 | S | S | * | * | -164.2 | 119.8 | 58.4 | -71 | -90.4 | 0 | 0 | 0 | 106.3 | |||||
| 95 | H | 39.6 | Very low | 39.9 | Very low | 178 Ų | 178 | 136.8 Ų | 136.8 | 82% | 0.824 | 78% | 0.784 | S | S | * | * | 13.6 | 117 | 113 | -96.9 | 58.5 | 0 | 0 | 0 | 117.2 | |||||
| 96 | R | 39.6 | Very low | 40.1 | Very low | 215 Ų | 215 | 144.7 Ų | 144.7 | 81% | 0.811 | 79% | 0.79 | S | S | * | * | 67.6 | 106.9 | 126.2 | -164.7 | -173 | -146.7 | -146.4 | 5.9 | 116.9 | |||||
| 97 | H | 37.5 | Very low | 40.3 | Very low | 180 Ų | 180 | 147 Ų | 147 | 83% | 0.833 | 79% | 0.789 | S | S | * | * | trans | -156.2 | 115.6 | 130.8 | -87.7 | -65.9 | 0 | 0 | 0 | 109.9 | ||||
| 98 | G | 45.8 | Very low | 40.7 | Very low | 78 Ų | 78 | 141.6 Ų | 141.6 | 80% | 0.804 | 79% | 0.787 | S | S | * | * | trans | -69.2 | 136.2 | 163.6 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 99 | I | 40.2 | Very low | 40.8 | Very low | 162 Ų | 162 | 143.1 Ų | 143.1 | 83% | 0.831 | 79% | 0.79 | S | S | * | * | trans | -121.4 | 116.3 | 172 | 44.2 | 174.6 | 0 | 0 | 0 | 109.3 | ||||
| 100 | H | 38.8 | Very low | 41.2 | Very low | 168 Ų | 168 | 141.8 Ų | 141.8 | 78% | 0.778 | 79% | 0.792 | S | S | * | * | trans | -47.3 | 122.4 | 172.9 | -177.6 | -107.1 | 0 | 0 | 0 | 111.5 | T102 | H100-T102 PolarHBondContact O-N 3.37Š| ||
| 101 | L | 37.8 | Very low | 40.9 | Very low | 171 Ų | 171 | 140.6 Ų | 140.6 | 90% | 0.895 | 79% | 0.787 | S | S | * | * | trans | -67 | 104.1 | 168.3 | -72.8 | 164.6 | 0 | 0 | 0 | 108 | S103 | L101-S103 PolarHBondContact O-N 2.7Š| ||
| 102 | T | 40 | Very low | 41.9 | Very low | 103 Ų | 103 | 146.5 Ų | 146.5 | 63% | 0.632 | 80% | 0.796 | S | S | * | * | trans | -73.1 | 123.9 | 167.2 | 63.1 | 0 | 0 | 0 | 0 | 107.8 | H100 V104 | H100-T102 PolarHBondContact O-N 3.37Å; T102-V104 PolarHBondContact O-N 2.94Å; T102-V104 VanDerWaalsContact O-N 3.12Å | ||
| 103 | S | 43.5 | Very low | 42.5 | Very low | 112 Ų | 112 | 149.8 Ų | 149.8 | 78% | 0.783 | 80% | 0.799 | S | S | * | * | trans | -63 | 109.3 | 170.6 | 56.3 | 0 | 0 | 0 | 0 | 108.7 | L101 | L101-S103 PolarHBondContact O-N 2.7Š| ||
| 104 | V | 36.7 | Very low | 43.3 | Very low | 122 Ų | 122 | 149.4 Ų | 149.4 | 74% | 0.739 | 80% | 0.803 | S | S | * | * | trans | -90.8 | 106.8 | 166.9 | -166.2 | 0 | 0 | 0 | 0 | 107.3 | T102 R106 | T102-V104 PolarHBondContact O-N 2.94Å; T102-V104 VanDerWaalsContact O-N 3.12Å; V104-R106 PolarHBondContact O-N 3.1Å; V104-R106 VanDerWaalsContact O-N 3.08Å | ||
| 105 | S | 45 | Very low | 45 | Very low | 110 Ų | 110 | 144.8 Ų | 144.8 | 77% | 0.769 | 80% | 0.799 | S | S | * | * | trans | -55.4 | 109.3 | 171.5 | -55.5 | 0 | 0 | 0 | 0 | 109.6 | T107 | S105-T107 PolarHBondContact O-N 3.44Š| ||
| 106 | R | 40.5 | Very low | 46.3 | Very low | 242 Ų | 242 | 141.8 Ų | 141.8 | 91% | 0.913 | 80% | 0.795 | S | S | * | * | trans | -76.4 | 119.1 | 166.5 | -70.7 | -174 | -177.2 | -111.8 | 0.9 | 107.9 | V104 | V104-R106 PolarHBondContact O-N 3.1Å; V104-R106 VanDerWaalsContact O-N 3.08Å | ||
| 107 | T | 41.1 | Very low | 47.7 | Very low | 126 Ų | 126 | 136.2 Ų | 136.2 | 77% | 0.773 | 79% | 0.787 | S | S | * | * | trans | -56.6 | 134.4 | 170.5 | 46.7 | 0 | 0 | 0 | 0 | 110.1 | S105 L109 | S105-T107 PolarHBondContact O-N 3.44Å; T107-L109 PolarHBondContact O-N 3.03Å; T107-L109 VanDerWaalsContact O-N 3.1Å | ||
| 108 | S | 44.3 | Very low | 49.7 | Very low | 119 Ų | 119 | 129.9 Ų | 129.9 | 83% | 0.832 | 76% | 0.763 | S | S | * | * | trans | -71.1 | 98.9 | 178 | 58.3 | 0 | 0 | 0 | 0 | 110.3 | S110 | S108-S110 PolarHBondContact O-N 3.35Š| ||
| 109 | L | 41 | Very low | 51.2 | Low | 164 Ų | 164 | 127.9 Ų | 127.9 | 86% | 0.859 | 74% | 0.737 | S | S | * | * | trans | -85.7 | 101.1 | 157.7 | -81.4 | 156.1 | 0 | 0 | 0 | 107.3 | T107 S111 | T107-L109 PolarHBondContact O-N 3.03Å; T107-L109 VanDerWaalsContact O-N 3.1Å; L109-S111 VanDerWaalsContact C-N 3.32Å; L109-S111 PolarHBondContact O-N 2.84Å | ||
| 110 | S | 49.4 | Very low | 52.8 | Low | 116 Ų | 116 | 127 Ų | 127 | 81% | 0.811 | 73% | 0.727 | S | S | * | * | trans | -60.9 | 92.9 | 169.7 | -177.8 | 0 | 0 | 0 | 0 | 109 | S108 | S108-S110 PolarHBondContact O-N 3.35Š| ||
| 111 | S | 45.7 | Very low | 54.7 | Low | 105 Ų | 105 | 124 Ų | 124 | 73% | 0.734 | 72% | 0.716 | S | S | * | * | trans | -105.8 | 109.7 | 156.7 | -163.9 | 0 | 0 | 0 | 0 | 105.1 | L109 Q113 | L109-S111 VanDerWaalsContact C-N 3.32Å; L109-S111 PolarHBondContact O-N 2.84Å; S111-Q113 VanDerWaalsContact C-N 3.25Å; S111-Q113 PolarHBondContact O-N 2.93Å | ||
| 112 | Q | 53.1 | Low | 56.9 | Low | 189 Ų | 189 | 119.7 Ų | 119.7 | 88% | 0.883 | 69% | 0.694 | S | S | * | * | trans | -58.1 | 94.4 | 172.2 | -86.1 | -169.6 | 1.4 | 0 | 0 | 108.3 | A114 | Q112-A114 PolarHBondContact O-N 2.96Š| ||
| 113 | Q | 52.3 | Low | 58.6 | Low | 187 Ų | 187 | 117.9 Ų | 117.9 | 87% | 0.874 | 68% | 0.677 | S | S | * | * | trans | -81.4 | 96.9 | 171.8 | -165.3 | 161.4 | 10.9 | 0 | 0 | 106.5 | S111 | S111-Q113 VanDerWaalsContact C-N 3.25Å; S111-Q113 PolarHBondContact O-N 2.93Å | ||
| 114 | A | 61.3 | Low | 60.3 | Low | 81 Ų | 81 | 120.3 Ų | 120.3 | 67% | 0.669 | 67% | 0.674 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 140.3 | 172.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | Q112 | Q112-A114 PolarHBondContact O-N 2.96Š|
| 115 | P | 72.2 | Confident | 62.7 | Low | 113 Ų | 113 | 114.7 Ų | 114.7 | 73% | 0.734 | 64% | 0.641 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 147.5 | 176.9 | 24.6 | -32.8 | 0 | 0 | 0 | 110.2 | ||
| 116 | P | 66.6 | Low | 64.6 | Low | 114 Ų | 114 | 115.1 Ų | 115.1 | 74% | 0.74 | 63% | 0.633 | S | S | * | * | P | Polyproline II helix | trans | -56.6 | 138.8 | 177.9 | 24.3 | -33.1 | 0 | 0 | 0 | 109.9 | S118 | P116-S118 PolarHBondContact O-N 2.74Š|
| 117 | P | 69.1 | Low | 66.8 | Low | 99 Ų | 99 | 107.6 Ų | 107.6 | 64% | 0.643 | 61% | 0.611 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 129.3 | -178.6 | 24.9 | -33.4 | 0 | 0 | 0 | 109.1 | L122 | P117-L122 HydrophobicContact CB-CD1 4.29Å; P117-L122 HydrophobicContact CG-CD1 4.48Å |
| 118 | S | 78.8 | Confident | 68.6 | Low | 46 Ų | 46 | 108 Ų | 108 | 32% | 0.322 | 60% | 0.599 | S | S | . | * | P | Polyproline II helix | trans | -77.7 | 155.4 | -178.4 | 86.2 | 0 | 0 | 0 | 0 | 109.7 | P116 K120 D121 L122 | P116-S118 PolarHBondContact O-N 2.74Å; S118-K120 PolarHBondContact O-N 3.36Å; S118-K120 WeakPolarHBondContact OG-CD 3.41Å; S118-K120 WeakPolarHBondContact OG-CE 3.26Å; S118-K120 VanDerWaalsContact OG-CG 3.26Å; S118-K120 WeakPolarHBondContact OG-CG 2.99Å; S118-D121 WeakPolarHBondContact CB-OD2 3.05Å; S118-D121 PolarHBondContact N-OD2 3.34Å; S118-D121 VanDerWaalsContact N-OD2 3.14Å; S118-D121 WeakPolarHBondContact O-CA 3.35Å; S118-D121 WeakPolarHBondContact O-CB 3.48Å; S118-D121 PolarHBondContact O-N 3.14Å; S118-D121 PolarHBondContact OG-OD2 2.77Å; S118-L122 WeakPolarHBondContact O-CD1 3.36Å |
| 119 | S | 77.5 | Confident | 70.4 | Confident | 36 Ų | 36 | 107.6 Ų | 107.6 | 25% | 0.252 | 59% | 0.586 | S | S | . | * | G | 310 helix | trans | -57.7 | -26.1 | -172.7 | 159.7 | 0 | 0 | 0 | 0 | 113.5 | D121 L122 G125 I126 D127 | S119-D121 VanDerWaalsContact C-N 3.26Å; S119-D121 PolarHBondContact O-N 3.19Å; S119-L122 PolarHBondContact O-N 2.84Å; S119-G125 WeakPolarHBondContact O-CA 3.23Å; S119-I126 PolarHBondContact OG-N 3.05Å; S119-D127 WeakPolarHBondContact CB-OD2 3.21Å; S119-D127 PolarHBondContact OG-N 2.59Å; S119-D127 PolarHBondContact OG-OD2 2.82Å |
| 120 | K | 74.8 | Confident | 72.2 | Confident | 145 Ų | 145 | 105.9 Ų | 105.9 | 63% | 0.63 | 58% | 0.577 | S | S | * | * | G | 310 helix | trans | -66.5 | -22.7 | 172.2 | 79.6 | -156.2 | 176.7 | 172.1 | 0 | 114.7 | S118 | S118-K120 PolarHBondContact O-N 3.36Å; S118-K120 WeakPolarHBondContact OG-CD 3.41Å; S118-K120 WeakPolarHBondContact OG-CE 3.26Å; S118-K120 VanDerWaalsContact OG-CG 3.26Å; S118-K120 WeakPolarHBondContact OG-CG 2.99Å |
| 121 | D | 78.2 | Confident | 73.6 | Confident | 104 Ų | 104 | 102.8 Ų | 102.8 | 56% | 0.556 | 56% | 0.556 | S | S | * | * | G | 310 helix | trans | -90.7 | -12.9 | -177.6 | -49.5 | -53 | 0 | 0 | 0 | 111.6 | S118 S119 | S118-D121 WeakPolarHBondContact CB-OD2 3.05Å; S118-D121 PolarHBondContact N-OD2 3.34Å; S118-D121 VanDerWaalsContact N-OD2 3.14Å; S118-D121 WeakPolarHBondContact O-CA 3.35Å; S118-D121 WeakPolarHBondContact O-CB 3.48Å; S118-D121 PolarHBondContact O-N 3.14Å; S118-D121 PolarHBondContact OG-OD2 2.77Å; S119-D121 VanDerWaalsContact C-N 3.26Å; S119-D121 PolarHBondContact O-N 3.19Å |
| 122 | L | 83.1 | Confident | 74.4 | Confident | 81 Ų | 81 | 104.3 Ų | 104.3 | 42% | 0.424 | 56% | 0.561 | S | S | . | * | S | Bend | trans | -80.8 | 131.2 | 175.7 | -80.3 | 91.7 | 0 | 0 | 0 | 110.6 | P117 S118 S119 F124 G125 | P117-L122 HydrophobicContact CB-CD1 4.29Å; P117-L122 HydrophobicContact CG-CD1 4.48Å; S118-L122 WeakPolarHBondContact O-CD1 3.36Å; S119-L122 PolarHBondContact O-N 2.84Å; L122-F124 PolarHBondContact O-N 3.23Å; L122-G125 PolarHBondContact O-N 2.88Å |
| 123 | K | 76.9 | Confident | 74.8 | Confident | 65 Ų | 65 | 101.8 Ų | 101.8 | 28% | 0.283 | 55% | 0.553 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -54.8 | -25.7 | 177.1 | -174.9 | 163.8 | 178.6 | 165.1 | 0 | 113.6 | R128 S143 L147 | K123-R128 WeakPolarHBondContact O-CD 3.5Å; K123-S143 PolarHBondContact NZ-O 3.33Å; K123-L147 VanDerWaalsContact NZ-CD2 3.3Å |
| 124 | F | 79.8 | Confident | 75.1 | Confident | 162 Ų | 162 | 101 Ų | 101 | 71% | 0.711 | 55% | 0.547 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -127.4 | 30 | 176 | -56.7 | -77.7 | 0 | 0 | 0 | 112.4 | L122 | L122-F124 PolarHBondContact O-N 3.23Š|
| 125 | G | 86.4 | Confident | 74.7 | Confident | 5 Ų | 5 | 101.8 Ų | 101.8 | 5% | 0.052 | 54% | 0.54 | C | S | . | . | trans | -68 | 155.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | S119 L122 D127 R128 I129 | S119-G125 WeakPolarHBondContact O-CA 3.23Å; L122-G125 PolarHBondContact O-N 2.88Å; G125-D127 VanDerWaalsContact C-N 3.26Å; G125-D127 PolarHBondContact O-N 2.75Å; G125-R128 PolarHBondContact O-N 3.14Å; G125-R128 VanDerWaalsContact O-N 3.07Å; G125-I129 WeakPolarHBondContact O-CG1 3.19Å; G125-I129 PolarHBondContact O-N 3.27Å | ||
| 126 | I | 85.4 | Confident | 73.9 | Confident | 118 Ų | 118 | 102.1 Ų | 102.1 | 61% | 0.605 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -60.1 | -41.7 | -176 | -65.9 | 132 | 0 | 0 | 0 | 110.2 | S119 R128 I129 L130 | S119-I126 PolarHBondContact OG-N 3.05Å; I126-R128 VanDerWaalsContact C-N 3.28Å; I126-R128 PolarHBondContact O-N 3Å; I126-I129 PolarHBondContact O-N 2.95Å; I126-L130 HydrophobicContact CG2-CD1 3.54Å; I126-L130 HydrophobicContact CG2-CG 4.17Å; I126-L130 WeakPolarHBondContact O-CB 3.37Å; I126-L130 VanDerWaalsContact O-CG 3.23Å; I126-L130 WeakPolarHBondContact O-CG 3.35Å; I126-L130 PolarHBondContact O-N 3.05Å |
| 127 | D | 85.2 | Confident | 72.7 | Confident | 85 Ų | 85 | 105.5 Ų | 105.5 | 46% | 0.455 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -61.2 | -38.7 | 177.7 | -56.9 | -67.9 | 0 | 0 | 0 | 111.5 | S119 G125 L130 S131 | S119-D127 WeakPolarHBondContact CB-OD2 3.21Å; S119-D127 PolarHBondContact OG-N 2.59Å; S119-D127 PolarHBondContact OG-OD2 2.82Å; G125-D127 VanDerWaalsContact C-N 3.26Å; G125-D127 PolarHBondContact O-N 2.75Å; D127-L130 PolarHBondContact O-N 2.82Å; D127-S131 WeakPolarHBondContact O-CB 3.44Å; D127-S131 PolarHBondContact O-N 3.29Å; D127-S131 PolarHBondContact O-OG 2.78Å |
| 128 | R | 80.4 | Confident | 71.7 | Confident | 134 Ų | 134 | 104.5 Ų | 104.5 | 51% | 0.506 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -72.1 | -30.1 | 179.2 | -153.2 | -178.1 | -144.5 | -160.5 | 7.8 | 113.3 | K123 G125 I126 | K123-R128 WeakPolarHBondContact O-CD 3.5Å; G125-R128 PolarHBondContact O-N 3.14Å; G125-R128 VanDerWaalsContact O-N 3.07Å; I126-R128 VanDerWaalsContact C-N 3.28Å; I126-R128 PolarHBondContact O-N 3Å |
| 129 | I | 81.1 | Confident | 70.5 | Confident | 111 Ų | 111 | 111.3 Ų | 111.3 | 57% | 0.569 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -76.2 | -32.6 | 175.6 | -65 | 165.8 | 0 | 0 | 0 | 110.5 | G125 I126 | G125-I129 WeakPolarHBondContact O-CG1 3.19Å; G125-I129 PolarHBondContact O-N 3.27Å; I126-I129 PolarHBondContact O-N 2.95Å |
| 130 | L | 79.6 | Confident | 69.1 | Low | 127 Ų | 127 | 114.3 Ų | 114.3 | 67% | 0.665 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -91.9 | -16.6 | -178.6 | -62.9 | 179.2 | 0 | 0 | 0 | 113.5 | I126 D127 T132 | I126-L130 HydrophobicContact CG2-CD1 3.54Å; I126-L130 HydrophobicContact CG2-CG 4.17Å; I126-L130 WeakPolarHBondContact O-CB 3.37Å; I126-L130 VanDerWaalsContact O-CG 3.23Å; I126-L130 WeakPolarHBondContact O-CG 3.35Å; I126-L130 PolarHBondContact O-N 3.05Å; D127-L130 PolarHBondContact O-N 2.82Å; L130-T132 PolarHBondContact O-N 3.42Å |
| 131 | S | 78.1 | Confident | 67.9 | Low | 52 Ų | 52 | 113.8 Ų | 113.8 | 36% | 0.364 | 58% | 0.577 | S | S | . | * | trans | -58.2 | 125.5 | 170.2 | -79.3 | 0 | 0 | 0 | 0 | 109.6 | D127 D133 | D127-S131 WeakPolarHBondContact O-CB 3.44Å; D127-S131 PolarHBondContact O-N 3.29Å; D127-S131 PolarHBondContact O-OG 2.78Å; S131-D133 PolarHBondContact O-N 2.94Å | ||
| 132 | T | 62.8 | Low | 66.5 | Low | 137 Ų | 137 | 112.6 Ų | 112.6 | 84% | 0.84 | 58% | 0.577 | S | S | * | * | S | Bend | trans | -67.9 | -0.2 | 177.8 | 47.2 | 0 | 0 | 0 | 0 | 113.7 | L130 F134 | L130-T132 PolarHBondContact O-N 3.42Å; T132-F134 PolarHBondContact O-N 3.43Å; T132-F134 VanDerWaalsContact O-N 3.15Å |
| 133 | D | 61.6 | Low | 65.2 | Low | 136 Ų | 136 | 111.6 Ų | 111.6 | 73% | 0.727 | 58% | 0.577 | S | S | * | * | trans | -79.5 | 16.4 | -178 | -52.6 | -48.9 | 0 | 0 | 0 | 113.7 | S131 D135 | S131-D133 PolarHBondContact O-N 2.94Å; D133-D135 PolarHBondContact O-N 3.34Å | ||
| 134 | F | 59.3 | Low | 64 | Low | 171 Ų | 171 | 114.1 Ų | 114.1 | 75% | 0.75 | 59% | 0.593 | S | S | * | * | trans | -73.8 | 77.7 | 167.2 | -114.9 | -87.3 | 0 | 0 | 0 | 108.7 | T132 P136 | T132-F134 PolarHBondContact O-N 3.43Å; T132-F134 VanDerWaalsContact O-N 3.15Å; F134-P136 WeakPolarHBondContact O-CD 3.41Å | ||
| 135 | D | 50.9 | Low | 62.9 | Low | 96 Ų | 96 | 116.2 Ų | 116.2 | 51% | 0.513 | 60% | 0.596 | S | S | . | * | trans | -78.5 | 106.8 | 168.2 | -165.7 | -10.8 | 0 | 0 | 0 | 108.1 | D133 K137 | D133-D135 PolarHBondContact O-N 3.34Å; D135-K137 PolarHBondContact O-N 3.39Å; D135-K137 PolarHBondContact OD1-N 3.19Å | ||
| 136 | P | 56.8 | Low | 61.4 | Low | 120 Ų | 120 | 120.9 Ų | 120.9 | 78% | 0.779 | 62% | 0.62 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.6 | -1.5 | -177.1 | 30.3 | -35.6 | 0 | 0 | 0 | 112.9 | F134 | F134-P136 WeakPolarHBondContact O-CD 3.41Š|
| 137 | K | 41.2 | Very low | 59.8 | Low | 186 Ų | 186 | 119.4 Ų | 119.4 | 81% | 0.809 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.2 | -9.2 | -175.5 | -69.5 | -172.7 | 176.8 | -178.3 | 0 | 115.1 | D135 | D135-K137 PolarHBondContact O-N 3.39Å; D135-K137 PolarHBondContact OD1-N 3.19Å |
| 138 | T | 47.2 | Very low | 58.2 | Low | 77 Ų | 77 | 119.5 Ų | 119.5 | 47% | 0.472 | 62% | 0.616 | S | S | . | * | trans | -93.1 | 107.4 | 172.1 | 56.4 | 0 | 0 | 0 | 0 | 110.1 | D140 | T138-D140 PolarHBondContact O-N 3.34Å; T138-D140 PolarHBondContact OG1-OD2 2.92Å | ||
| 139 | K | 53.8 | Low | 56.6 | Low | 190 Ų | 190 | 116.7 Ų | 116.7 | 83% | 0.826 | 62% | 0.617 | S | S | * | * | trans | -69.5 | 78 | 169.3 | -167 | 175.9 | -175 | -179.9 | 0 | 108.1 | I141 | K139-I141 VanDerWaalsContact C-N 3.34Å; K139-I141 PolarHBondContact O-N 3.17Å | ||
| 140 | D | 48.8 | Very low | 55.3 | Low | 98 Ų | 98 | 117.9 Ų | 117.9 | 52% | 0.524 | 62% | 0.623 | S | S | . | * | trans | -71.1 | 89 | -178.1 | -74 | -51.6 | 0 | 0 | 0 | 111 | T138 S142 S143 | T138-D140 PolarHBondContact O-N 3.34Å; T138-D140 PolarHBondContact OG1-OD2 2.92Å; D140-S142 PolarHBondContact O-N 3.07Å; D140-S142 VanDerWaalsContact O-N 3.08Å; D140-S143 PolarHBondContact O-N 3.34Å; D140-S143 VanDerWaalsContact O-N 3.17Å | ||
| 141 | I | 49.7 | Very low | 53.9 | Low | 134 Ų | 134 | 117.6 Ų | 117.6 | 69% | 0.687 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54 | -20.9 | 168.6 | -69.3 | 148.5 | 0 | 0 | 0 | 111.4 | K139 S143 | K139-I141 VanDerWaalsContact C-N 3.34Å; K139-I141 PolarHBondContact O-N 3.17Å; I141-S143 PolarHBondContact O-N 3.32Å |
| 142 | S | 49.2 | Very low | 52.3 | Low | 80 Ų | 80 | 119.3 Ų | 119.3 | 56% | 0.559 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -62.3 | -35.7 | 176.4 | -40.1 | 0 | 0 | 0 | 0 | 113.5 | D140 L144 R145 | D140-S142 PolarHBondContact O-N 3.07Å; D140-S142 VanDerWaalsContact O-N 3.08Å; S142-L144 VanDerWaalsContact C-N 3.31Å; S142-L144 PolarHBondContact O-N 3.07Å; S142-R145 PolarHBondContact O-N 2.95Å |
| 143 | S | 55.2 | Low | 51.4 | Low | 59 Ų | 59 | 117.8 Ų | 117.8 | 41% | 0.413 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -69.9 | -27.5 | -176.2 | -175.4 | 0 | 0 | 0 | 0 | 113.3 | K123 D140 I141 | K123-S143 PolarHBondContact NZ-O 3.33Å; D140-S143 PolarHBondContact O-N 3.34Å; D140-S143 VanDerWaalsContact O-N 3.17Å; I141-S143 PolarHBondContact O-N 3.32Å |
| 144 | L | 52.2 | Low | 50.4 | Low | 118 Ų | 118 | 118.1 Ų | 118.1 | 62% | 0.618 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -79.4 | -28.7 | 177.9 | -68.7 | 178.8 | 0 | 0 | 0 | 112.9 | S142 D146 L147 T148 | S142-L144 VanDerWaalsContact C-N 3.31Å; S142-L144 PolarHBondContact O-N 3.07Å; L144-D146 VanDerWaalsContact C-N 3.33Å; L144-L147 PolarHBondContact O-N 3.5Å; L144-T148 PolarHBondContact O-N 3.49Å; L144-T148 VanDerWaalsContact O-N 3.13Å; L144-T148 PolarHBondContact O-OG1 2.98Å |
| 145 | R | 55.5 | Low | 49.8 | Very low | 206 Ų | 206 | 121 Ų | 121 | 78% | 0.777 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -65.8 | -38.6 | 176.7 | -129 | 174.4 | -167.1 | 178.5 | 3.1 | 111.3 | S142 L147 T148 S149 | S142-R145 PolarHBondContact O-N 2.95Å; R145-L147 PolarHBondContact O-N 3.26Å; R145-T148 PolarHBondContact O-N 3.19Å; R145-S149 PolarHBondContact O-N 3.22Å |
| 146 | D | 54.8 | Low | 49.2 | Very low | 104 Ų | 104 | 125.3 Ų | 125.3 | 56% | 0.556 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -68.5 | -31.4 | 176.9 | -69.4 | -14.6 | 0 | 0 | 0 | 113.4 | L144 | L144-D146 VanDerWaalsContact C-N 3.33Å |
| 147 | L | 52.3 | Low | 48.4 | Very low | 87 Ų | 87 | 125.2 Ų | 125.2 | 46% | 0.455 | 66% | 0.66 | S | S | . | * | H | α-helix | trans | -76.2 | -33 | 176.2 | -65 | 176.2 | 0 | 0 | 0 | 111.9 | K123 L144 R145 I150 | K123-L147 VanDerWaalsContact NZ-CD2 3.3Å; L144-L147 PolarHBondContact O-N 3.5Å; R145-L147 PolarHBondContact O-N 3.26Å; L147-I150 PolarHBondContact O-N 3.25Å |
| 148 | T | 52.4 | Low | 48.1 | Very low | 86 Ų | 86 | 119.2 Ų | 119.2 | 53% | 0.528 | 65% | 0.651 | S | S | . | * | H | α-helix | trans | -69.3 | -32.5 | 177.3 | -54.4 | 0 | 0 | 0 | 0 | 112.1 | L144 R145 I150 V151 S152 | L144-T148 PolarHBondContact O-N 3.49Å; L144-T148 VanDerWaalsContact O-N 3.13Å; L144-T148 PolarHBondContact O-OG1 2.98Å; R145-T148 PolarHBondContact O-N 3.19Å; T148-I150 VanDerWaalsContact C-N 3.26Å; T148-I150 PolarHBondContact O-N 3.27Å; T148-V151 PolarHBondContact O-N 3.3Å; T148-S152 PolarHBondContact O-N 3.35Å; T148-S152 PolarHBondContact O-OG 2.9Å |
| 149 | S | 46.8 | Very low | 47.6 | Very low | 75 Ų | 75 | 123.5 Ų | 123.5 | 52% | 0.524 | 67% | 0.669 | S | S | . | * | H | α-helix | trans | -62.1 | -27.6 | 177.8 | 179.6 | 0 | 0 | 0 | 0 | 114.1 | R145 V151 | R145-S149 PolarHBondContact O-N 3.22Å; S149-V151 VanDerWaalsContact C-N 3.35Å |
| 150 | I | 52.7 | Low | 46.9 | Very low | 136 Ų | 136 | 122.6 Ų | 122.6 | 70% | 0.697 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -78.4 | -24.8 | -178.4 | -57.4 | 173.1 | 0 | 0 | 0 | 111 | L147 T148 | L147-I150 PolarHBondContact O-N 3.25Å; T148-I150 VanDerWaalsContact C-N 3.26Å; T148-I150 PolarHBondContact O-N 3.27Å |
| 151 | V | 51.2 | Low | 46.7 | Very low | 122 Ų | 122 | 123.8 Ų | 123.8 | 74% | 0.739 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -82.5 | -25.3 | 179.8 | 170.7 | 0 | 0 | 0 | 0 | 112.2 | T148 S149 | T148-V151 PolarHBondContact O-N 3.3Å; S149-V151 VanDerWaalsContact C-N 3.35Å |
| 152 | S | 44 | Very low | 45.9 | Very low | 88 Ų | 88 | 122.1 Ų | 122.1 | 62% | 0.615 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.7 | -10.1 | -172.3 | -62.1 | 0 | 0 | 0 | 0 | 115.9 | T148 N154 | T148-S152 PolarHBondContact O-N 3.35Å; T148-S152 PolarHBondContact O-OG 2.9Å; S152-N154 PolarHBondContact O-N 2.97Å |
| 153 | S | 44 | Very low | 45.5 | Very low | 105 Ų | 105 | 122.2 Ų | 122.2 | 73% | 0.734 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.2 | 11.1 | -175.7 | -63.5 | 0 | 0 | 0 | 0 | 115.8 | ||
| 154 | N | 41 | Very low | 45 | Very low | 142 Ų | 142 | 127.1 Ų | 127.1 | 76% | 0.759 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -122.3 | 32.8 | -175.8 | -158.9 | 56.3 | 0 | 0 | 0 | 116.4 | S152 | S152-N154 PolarHBondContact O-N 2.97Š|
| 155 | R | 45.7 | Very low | 44.3 | Very low | 232 Ų | 232 | 130.7 Ų | 130.7 | 88% | 0.875 | 71% | 0.711 | S | S | * | * | trans | -145.4 | 86.6 | 161.6 | -66.7 | -166.3 | -174.3 | -81.8 | -0.1 | 111.4 | ||||
| 156 | Q | 39.7 | Very low | 43.3 | Very low | 187 Ų | 187 | 129.9 Ų | 129.9 | 87% | 0.874 | 71% | 0.714 | S | S | * | * | trans | -136.1 | 87.7 | 154.3 | -166.1 | 68.9 | 34.8 | 0 | 0 | 109.2 | ||||
| 157 | S | 38.4 | Very low | 42.3 | Very low | 118 Ų | 118 | 129.5 Ų | 129.5 | 83% | 0.825 | 73% | 0.725 | S | S | * | * | trans | -155.3 | 110.9 | 151 | 58.6 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 158 | G | 36.6 | Very low | 41.6 | Very low | 60 Ų | 60 | 129.8 Ų | 129.8 | 62% | 0.619 | 74% | 0.735 | S | S | * | * | trans | -71.3 | 168.7 | -170.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 159 | I | 36.6 | Very low | 41 | Very low | 166 Ų | 166 | 133.5 Ų | 133.5 | 85% | 0.851 | 75% | 0.749 | S | S | * | * | -178.1 | 122.1 | 129.9 | -83.7 | 148.1 | 0 | 0 | 0 | 107.4 | |||||
| 160 | Q | 38.2 | Very low | 40.6 | Very low | 172 Ų | 172 | 137.2 Ų | 137.2 | 80% | 0.804 | 76% | 0.763 | S | S | * | * | trans | 26.1 | 140 | 151.6 | -50.3 | -64.6 | 4.8 | 0 | 0 | 122.5 | ||||
| 161 | P | 43.7 | Very low | 40.3 | Very low | 123 Ų | 123 | 136.1 Ų | 136.1 | 80% | 0.799 | 77% | 0.765 | S | S | * | * | trans | -97.7 | 129.1 | 167.7 | 35.7 | -25.5 | 0 | 0 | 0 | 112.1 | ||||
| 162 | A | 34 | Very low | 39.5 | Very low | 99 Ų | 99 | 133.4 Ų | 133.4 | 82% | 0.818 | 76% | 0.762 | S | S | * | * | trans | -150.7 | 117 | 160 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 163 | S | 39.9 | Very low | 39.5 | Very low | 82 Ų | 82 | 138.3 Ų | 138.3 | 57% | 0.573 | 78% | 0.777 | S | S | * | * | trans | 16.4 | 126.5 | 152.9 | -66.1 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 164 | Q | 45 | Very low | 39.7 | Very low | 162 Ų | 162 | 137.9 Ų | 137.9 | 76% | 0.757 | 77% | 0.774 | S | S | * | * | 73.1 | 157.4 | 122.9 | -62.8 | 178.2 | 0.6 | 0 | 0 | 120.2 | |||||
| 165 | Y | 37.3 | Very low | 39.6 | Very low | 192 Ų | 192 | 138.3 Ų | 138.3 | 75% | 0.753 | 78% | 0.776 | S | S | * | * | trans | 75.3 | 106.7 | 163.6 | 36 | -94.2 | 0 | 0 | 0 | 120.6 | ||||
| 166 | F | 35.1 | Very low | 39.2 | Very low | 189 Ų | 189 | 132.3 Ų | 132.3 | 83% | 0.829 | 78% | 0.777 | S | S | * | * | 86.3 | 107.3 | 124 | -151.9 | -92.6 | 0 | 0 | 0 | 118.7 | |||||
| 167 | A | 34 | Very low | 39.5 | Very low | 96 Ų | 96 | 129 Ų | 129 | 79% | 0.793 | 78% | 0.775 | S | S | * | * | trans | -155.2 | 97.3 | 144.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 168 | S | 37.1 | Very low | 39.7 | Very low | 94 Ų | 94 | 128.5 Ų | 128.5 | 66% | 0.657 | 77% | 0.771 | S | S | * | * | trans | -57.4 | 143.4 | 166.5 | -75.5 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 169 | I | 40.8 | Very low | 40.2 | Very low | 164 Ų | 164 | 135 Ų | 135 | 84% | 0.841 | 79% | 0.787 | S | S | * | * | trans | -80.2 | 123.4 | 167.5 | -54.9 | 159.3 | 0 | 0 | 0 | 106.2 | ||||
| 170 | D | 38.1 | Very low | 40.8 | Very low | 153 Ų | 153 | 136 Ų | 136 | 82% | 0.818 | 79% | 0.79 | S | S | * | * | trans | -126.4 | 122.6 | 163.4 | -131.9 | -41.6 | 0 | 0 | 0 | 109 | ||||
| 171 | P | 46.9 | Very low | 40.8 | Very low | 113 Ų | 113 | 133.3 Ų | 133.3 | 73% | 0.734 | 79% | 0.791 | S | S | * | * | trans | -101.5 | 120.7 | 177.3 | 33 | -23.3 | 0 | 0 | 0 | 111.3 | ||||
| 172 | G | 34.1 | Very low | 40.5 | Very low | 65 Ų | 65 | 133.6 Ų | 133.6 | 67% | 0.67 | 80% | 0.796 | S | S | * | * | trans | 159 | 107.5 | 162.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 173 | M | 43.8 | Very low | 41.1 | Very low | 191 Ų | 191 | 137 Ų | 137 | 94% | 0.941 | 80% | 0.799 | S | S | * | * | trans | -170.8 | 136.3 | 133.7 | 39 | -170.6 | 60.2 | 0 | 0 | 111.6 | ||||
| 174 | S | 46.8 | Very low | 41 | Very low | 96 Ų | 96 | 140.1 Ų | 140.1 | 67% | 0.671 | 81% | 0.81 | S | S | * | * | trans | -76.4 | 175 | -178.1 | 47.6 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 175 | D | 39.7 | Very low | 40.7 | Very low | 150 Ų | 150 | 138.4 Ų | 138.4 | 80% | 0.802 | 82% | 0.816 | S | S | * | * | trans | 90.3 | 88.5 | 157.8 | -53.3 | -54.7 | 0 | 0 | 0 | 118.4 | ||||
| 176 | A | 38.4 | Very low | 40.8 | Very low | 107 Ų | 107 | 133.3 Ų | 133.3 | 88% | 0.884 | 81% | 0.813 | S | S | * | * | trans | -140.7 | 63.8 | 151.4 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 177 | S | 44.5 | Very low | 41.1 | Very low | 118 Ų | 118 | 136 Ų | 136 | 83% | 0.825 | 82% | 0.818 | S | S | * | * | trans | -102.1 | 97.8 | 156.5 | -78.8 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 178 | S | 42.9 | Very low | 41.5 | Very low | 106 Ų | 106 | 140.6 Ų | 140.6 | 74% | 0.741 | 82% | 0.823 | S | S | * | * | trans | 178 | 88.9 | 157.4 | -85 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 179 | M | 47.3 | Very low | 41.7 | Very low | 196 Ų | 196 | 142 Ų | 142 | 97% | 0.966 | 83% | 0.833 | S | S | * | * | trans | -177.2 | 60.1 | 140.3 | 42.3 | -154.7 | 110.1 | 0 | 0 | 111.2 | ||||
| 180 | M | 49.2 | Very low | 41.7 | Very low | 187 Ų | 187 | 137 Ų | 137 | 92% | 0.921 | 82% | 0.822 | S | S | * | * | trans | -93.9 | 98 | 151.1 | -79.1 | -175.8 | 65.4 | 0 | 0 | 107.9 | ||||
| 181 | S | 38.1 | Very low | 41.8 | Very low | 117 Ų | 117 | 138.7 Ų | 138.7 | 82% | 0.818 | 83% | 0.825 | S | S | * | * | trans | -173.7 | 108.3 | 156.5 | -95.4 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 182 | S | 37.9 | Very low | 41.4 | Very low | 128 Ų | 128 | 141.6 Ų | 141.6 | 90% | 0.895 | 83% | 0.828 | S | S | * | * | trans | 176.5 | 84.4 | 131.7 | -78.5 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 183 | L | 46.3 | Very low | 41.7 | Very low | 171 Ų | 171 | 145.9 Ų | 145.9 | 90% | 0.895 | 83% | 0.831 | S | S | * | * | trans | -97.5 | 87.4 | 161.9 | -153.6 | 128.7 | 0 | 0 | 0 | 106.3 | ||||
| 184 | N | 38.3 | Very low | 41.5 | Very low | 148 Ų | 148 | 145.1 Ų | 145.1 | 79% | 0.791 | 82% | 0.823 | S | S | * | * | trans | 173.8 | 110 | 153.5 | -111.8 | -11.2 | 0 | 0 | 0 | 110 | ||||
| 185 | S | 38.1 | Very low | 41.1 | Very low | 126 Ų | 126 | 147.2 Ų | 147.2 | 88% | 0.881 | 82% | 0.822 | S | S | * | * | trans | -146.3 | 111.7 | 144.6 | -85.4 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 186 | A | 38.7 | Very low | 41.6 | Very low | 85 Ų | 85 | 145.6 Ų | 145.6 | 70% | 0.702 | 81% | 0.813 | S | S | * | * | trans | -62.6 | 144.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 187 | R | 42.2 | Very low | 42.2 | Very low | 244 Ų | 244 | 145.6 Ų | 145.6 | 92% | 0.921 | 80% | 0.802 | S | S | * | * | trans | 37.6 | 95.1 | 136.7 | -66.5 | -175.1 | 154 | -145.6 | -5.5 | 116.3 | ||||
| 188 | Q | 42.1 | Very low | 42.2 | Very low | 193 Ų | 193 | 148.2 Ų | 148.2 | 90% | 0.902 | 80% | 0.799 | S | S | * | * | trans | -132.8 | 116.8 | 139 | -70.3 | -168.4 | 12.3 | 0 | 0 | 110.5 | G190 | Q188-G190 PolarHBondContact O-N 2.78Š| ||
| 189 | S | 42.4 | Very low | 42.5 | Very low | 124 Ų | 124 | 148.2 Ų | 148.2 | 87% | 0.867 | 80% | 0.797 | S | S | * | * | trans | -61.7 | 114.9 | 160.8 | 162.7 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 190 | G | 39.8 | Very low | 42.4 | Very low | 60 Ų | 60 | 141.4 Ų | 141.4 | 62% | 0.619 | 78% | 0.777 | S | S | * | * | trans | -144.7 | 101.8 | 170.4 | 0 | 0 | 0 | 0 | 0 | 108 | Q188 H192 | Q188-G190 PolarHBondContact O-N 2.78Å; G190-H192 PolarHBondContact O-N 3.36Å | ||
| 191 | Q | 39.9 | Very low | 42.5 | Very low | 187 Ų | 187 | 139.2 Ų | 139.2 | 87% | 0.874 | 78% | 0.776 | S | S | * | * | trans | -54.7 | 94.4 | 170.7 | -74.4 | -83.8 | -26.2 | 0 | 0 | 109.5 | Q193 | Q191-Q193 VanDerWaalsContact C-N 3.34Å; Q191-Q193 PolarHBondContact O-N 3.44Å; Q191-Q193 VanDerWaalsContact O-N 3.16Å | ||
| 192 | H | 39.3 | Very low | 43.1 | Very low | 175 Ų | 175 | 143.5 Ų | 143.5 | 81% | 0.81 | 78% | 0.776 | S | S | * | * | trans | -80.4 | 92.7 | 163 | -106.4 | -92.8 | 0 | 0 | 0 | 107.7 | G190 F194 | G190-H192 PolarHBondContact O-N 3.36Å; H192-F194 PolarHBondContact O-N 3.47Å | ||
| 193 | Q | 40.8 | Very low | 44.1 | Very low | 154 Ų | 154 | 141 Ų | 141 | 72% | 0.72 | 76% | 0.763 | S | S | * | * | trans | -57.5 | 96.4 | 169.6 | -160.7 | -178.8 | 15.3 | 0 | 0 | 108.5 | Q191 Q195 | Q191-Q193 VanDerWaalsContact C-N 3.34Å; Q191-Q193 PolarHBondContact O-N 3.44Å; Q191-Q193 VanDerWaalsContact O-N 3.16Å; Q193-Q195 VanDerWaalsContact C-N 3.27Å; Q193-Q195 HydrophobicContact CG-CG 4.43Å; Q193-Q195 PolarHBondContact O-N 3.13Å | ||
| 194 | F | 38.9 | Very low | 44.6 | Very low | 176 Ų | 176 | 137.8 Ų | 137.8 | 77% | 0.772 | 75% | 0.75 | S | S | * | * | trans | -67.1 | 93.1 | 163 | -95.1 | -96.6 | 0 | 0 | 0 | 106.9 | H192 D196 | H192-F194 PolarHBondContact O-N 3.47Å; F194-D196 PolarHBondContact O-N 3.34Å; F194-D196 VanDerWaalsContact O-N 3.09Å | ||
| 195 | Q | 39.2 | Very low | 45.5 | Very low | 139 Ų | 139 | 138.1 Ų | 138.1 | 65% | 0.65 | 75% | 0.751 | S | S | * | * | trans | -72.6 | 91.9 | 157.6 | -73.2 | -163.5 | 23.5 | 0 | 0 | 106.9 | Q193 T197 | Q193-Q195 VanDerWaalsContact C-N 3.27Å; Q193-Q195 HydrophobicContact CG-CG 4.43Å; Q193-Q195 PolarHBondContact O-N 3.13Å; Q195-T197 PolarHBondContact O-N 3.21Å | ||
| 196 | D | 48.6 | Very low | 46.3 | Very low | 116 Ų | 116 | 136.7 Ų | 136.7 | 62% | 0.62 | 74% | 0.737 | S | S | * | * | trans | -66.4 | 72.6 | 157.4 | -75.5 | -54.2 | 0 | 0 | 0 | 108.4 | F194 F198 | F194-D196 PolarHBondContact O-N 3.34Å; F194-D196 VanDerWaalsContact O-N 3.09Å; D196-F198 HydrophobicContact CB-CD2 3.9Å; D196-F198 HydrophobicContact CB-CE2 3.73Å; D196-F198 PolarHBondContact O-N 3.49Å | ||
| 197 | T | 51.8 | Low | 47.3 | Very low | 107 Ų | 107 | 142 Ų | 142 | 66% | 0.656 | 75% | 0.745 | S | S | * | * | trans | -71.4 | 82.2 | 160 | -58.2 | 0 | 0 | 0 | 0 | 106 | Q195 P199 | Q195-T197 PolarHBondContact O-N 3.21Å; T197-P199 WeakPolarHBondContact O-CD 3.38Å | ||
| 198 | F | 44.5 | Very low | 47.9 | Very low | 174 Ų | 174 | 137.5 Ų | 137.5 | 76% | 0.763 | 74% | 0.739 | S | S | * | * | trans | -58.3 | 111.2 | 165.3 | -79.5 | -89.3 | 0 | 0 | 0 | 108.2 | D196 G200 | D196-F198 HydrophobicContact CB-CD2 3.9Å; D196-F198 HydrophobicContact CB-CE2 3.73Å; D196-F198 PolarHBondContact O-N 3.49Å; F198-G200 PolarHBondContact O-N 2.9Å | ||
| 199 | P | 49.7 | Very low | 48.6 | Very low | 106 Ų | 106 | 134 Ų | 134 | 69% | 0.688 | 73% | 0.73 | S | S | * | * | trans | -71.3 | 125.8 | 161.8 | -7.6 | 28.4 | 0 | 0 | 0 | 105.6 | T197 | T197-P199 WeakPolarHBondContact O-CD 3.38Š| ||
| 200 | G | 44.2 | Very low | 49.1 | Very low | 53 Ų | 53 | 134.3 Ų | 134.3 | 55% | 0.546 | 72% | 0.72 | S | S | . | * | trans | -53.3 | 179.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | F198 Y202 | F198-G200 PolarHBondContact O-N 2.9Å; G200-Y202 PolarHBondContact O-N 2.67Å | ||
| 201 | P | 51.7 | Low | 49.7 | Very low | 140 Ų | 140 | 136.1 Ų | 136.1 | 91% | 0.909 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -72.6 | 25.2 | -156.5 | 31.8 | -37.4 | 0 | 0 | 0 | 115.9 | ||
| 202 | Y | 50.3 | Low | 50.5 | Low | 208 Ų | 208 | 134.6 Ų | 134.6 | 82% | 0.816 | 71% | 0.714 | S | S | * | * | trans | -134 | 44.5 | -179.3 | -118.2 | -92.9 | 0 | 0 | 0 | 111.7 | G200 V204 | G200-Y202 PolarHBondContact O-N 2.67Å; Y202-V204 HydrophobicContact CD1-CG2 3.97Å; Y202-V204 HydrophobicContact CE1-CG2 4.42Å; Y202-V204 PolarHBondContact O-N 3.41Å | ||
| 203 | A | 60 | Low | 51.2 | Low | 75 Ų | 75 | 131.7 Ų | 131.7 | 62% | 0.62 | 71% | 0.709 | S | S | * | * | trans | -72.1 | 88.3 | 161.7 | 0 | 0 | 0 | 0 | 0 | 108.4 | L205 | A203-L205 PolarHBondContact O-N 3.24Š| ||
| 204 | V | 55.9 | Low | 51.9 | Low | 104 Ų | 104 | 131.8 Ų | 131.8 | 63% | 0.63 | 70% | 0.703 | S | S | * | * | trans | -58.4 | 107.5 | 168.8 | 176.4 | 0 | 0 | 0 | 0 | 107.1 | Y202 T206 | Y202-V204 HydrophobicContact CD1-CG2 3.97Å; Y202-V204 HydrophobicContact CE1-CG2 4.42Å; Y202-V204 PolarHBondContact O-N 3.41Å; V204-T206 VanDerWaalsContact C-N 3.26Å; V204-T206 PolarHBondContact O-N 3.43Å | ||
| 205 | L | 56.3 | Low | 52.9 | Low | 154 Ų | 154 | 132.6 Ų | 132.6 | 81% | 0.806 | 71% | 0.707 | S | S | * | * | trans | -64.2 | 86.2 | 171 | -85 | 116 | 0 | 0 | 0 | 109.4 | A203 K207 | A203-L205 PolarHBondContact O-N 3.24Å; L205-K207 PolarHBondContact O-N 3.02Å | ||
| 206 | T | 56.6 | Low | 53.9 | Low | 96 Ų | 96 | 136.4 Ų | 136.4 | 59% | 0.589 | 72% | 0.715 | S | S | * | * | trans | -67.3 | 117.7 | 157.7 | 33.3 | 0 | 0 | 0 | 0 | 107.8 | V204 D208 | V204-T206 VanDerWaalsContact C-N 3.26Å; V204-T206 PolarHBondContact O-N 3.43Å; T206-D208 PolarHBondContact O-N 2.96Å | ||
| 207 | K | 58.5 | Low | 54.6 | Low | 197 Ų | 197 | 140.6 Ų | 140.6 | 86% | 0.857 | 73% | 0.728 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.9 | -5 | -171.8 | -132.7 | 165.8 | 179.3 | 179.2 | 0 | 114.4 | L205 | L205-K207 PolarHBondContact O-N 3.02Š|
| 208 | D | 55.8 | Low | 55.4 | Low | 150 Ų | 150 | 146.8 Ų | 146.8 | 80% | 0.802 | 74% | 0.739 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.3 | 6.9 | -163.6 | -54.9 | -46.5 | 0 | 0 | 0 | 114.6 | T206 | T206-D208 PolarHBondContact O-N 2.96Š|
| 209 | T | 55.4 | Low | 56.8 | Low | 118 Ų | 118 | 143.8 Ų | 143.8 | 72% | 0.724 | 74% | 0.74 | S | S | * | * | trans | -131.2 | 32 | 176.7 | -35.8 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 210 | M | 54.7 | Low | 58.3 | Low | 131 Ų | 131 | 149.9 Ų | 149.9 | 65% | 0.645 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -97.4 | 117.2 | 166.1 | -84.3 | -71.9 | -177.2 | 0 | 0 | 108.8 | Q212 | M210-Q212 PolarHBondContact O-N 3.26Å; M210-Q212 VanDerWaalsContact O-N 3.14Å |
| 211 | P | 52.5 | Low | 60.3 | Low | 99 Ų | 99 | 152.1 Ų | 152.1 | 64% | 0.643 | 76% | 0.756 | S | S | * | * | trans | -56.4 | 125.6 | 171.5 | 21.7 | -29.3 | 0 | 0 | 0 | 108.5 | T213 | P211-T213 PolarHBondContact O-N 3.49Š| ||
| 212 | Q | 54.8 | Low | 62.1 | Low | 154 Ų | 154 | 156.2 Ų | 156.2 | 72% | 0.72 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -67.5 | 63.3 | -176.1 | -163.9 | 76.1 | -24 | 0 | 0 | 111.1 | M210 Y214 | M210-Q212 PolarHBondContact O-N 3.26Å; M210-Q212 VanDerWaalsContact O-N 3.14Å; Q212-Y214 PolarHBondContact OE1-OH 2.93Å |
| 213 | T | 55.7 | Low | 64 | Low | 115 Ų | 115 | 150.7 Ų | 150.7 | 71% | 0.706 | 75% | 0.751 | S | S | * | * | trans | -126.8 | 12.7 | 178 | 61.2 | 0 | 0 | 0 | 0 | 112.6 | P211 K215 | P211-T213 PolarHBondContact O-N 3.49Å; T213-K215 PolarHBondContact O-N 3.47Å | ||
| 214 | Y | 54.9 | Low | 65.7 | Low | 155 Ų | 155 | 153 Ų | 153 | 61% | 0.608 | 76% | 0.757 | S | S | * | * | trans | -75.3 | 77.1 | 163.6 | 60.2 | -86.3 | 0 | 0 | 0 | 109 | Q212 R216 | Q212-Y214 PolarHBondContact OE1-OH 2.93Å; Y214-R216 VanDerWaalsContact C-N 3.3Å; Y214-R216 PolarHBondContact O-N 3.16Å | ||
| 215 | K | 58.8 | Low | 67.7 | Low | 194 Ų | 194 | 150.6 Ų | 150.6 | 84% | 0.843 | 74% | 0.738 | S | S | * | * | trans | -47.4 | 105.4 | 151.8 | -69.1 | -97.6 | -175.9 | 175.9 | 0 | 105.3 | T213 K217 | T213-K215 PolarHBondContact O-N 3.47Å; K215-K217 PolarHBondContact O-N 2.89Å | ||
| 216 | R | 60.8 | Low | 69.7 | Low | 219 Ų | 219 | 145.9 Ų | 145.9 | 83% | 0.826 | 72% | 0.718 | S | S | * | * | trans | -44 | 112 | 175.8 | -85.2 | -179.8 | -78.9 | 112.6 | -3.3 | 106.8 | Y214 R218 | Y214-R216 VanDerWaalsContact C-N 3.3Å; Y214-R216 PolarHBondContact O-N 3.16Å; R216-R218 PolarHBondContact O-N 3.39Å | ||
| 217 | K | 62.9 | Low | 71.6 | Confident | 204 Ų | 204 | 146.5 Ų | 146.5 | 89% | 0.887 | 72% | 0.718 | S | S | * | * | trans | -44.7 | 115.1 | 177.2 | -76.7 | 178 | 172.8 | -175.5 | 0 | 106.7 | K215 S219 | K215-K217 PolarHBondContact O-N 2.89Å; K217-S219 PolarHBondContact O-N 3.12Å | ||
| 218 | R | 68.6 | Low | 73.5 | Confident | 236 Ų | 236 | 143.5 Ų | 143.5 | 89% | 0.891 | 71% | 0.711 | S | S | * | * | trans | -47.3 | 117.5 | -179 | -164.8 | 175 | -147.5 | 154.4 | 4.1 | 107.1 | R216 W220 | R216-R218 PolarHBondContact O-N 3.39Å; R218-W220 PolarHBondContact O-N 2.91Å | ||
| 219 | S | 74.6 | Confident | 75.6 | Confident | 111 Ų | 111 | 138.2 Ų | 138.2 | 78% | 0.776 | 68% | 0.681 | S | S | * | * | trans | -57.2 | 115.9 | 176.4 | 49 | 0 | 0 | 0 | 0 | 107.1 | K217 S221 | K217-S219 PolarHBondContact O-N 3.12Å; S219-S221 PolarHBondContact O-N 2.89Å | ||
| 220 | W | 80.4 | Confident | 77.6 | Confident | 234 Ų | 234 | 137.5 Ų | 137.5 | 89% | 0.886 | 67% | 0.665 | S | S | * | * | trans | -70.3 | 101.1 | 178.1 | -172.7 | -85.9 | 0 | 0 | 0 | 107.2 | R218 R222 | R218-W220 PolarHBondContact O-N 2.91Å; W220-R222 PolarHBondContact O-N 3.03Å | ||
| 221 | S | 86 | Confident | 79.7 | Confident | 100 Ų | 100 | 138.8 Ų | 138.8 | 70% | 0.699 | 67% | 0.667 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 135.5 | 173.3 | -173.1 | 0 | 0 | 0 | 0 | 108.7 | S219 A223 | S219-S221 PolarHBondContact O-N 2.89Å; S221-A223 PolarHBondContact O-N 3.48Å |
| 222 | R | 89.7 | Confident | 81.9 | Confident | 227 Ų | 227 | 135.1 Ų | 135.1 | 86% | 0.857 | 65% | 0.647 | S | S | * | * | P | Polyproline II helix | trans | -64.7 | 126 | 177.2 | -69.1 | -177.5 | -177.6 | -179.5 | 1.4 | 108.4 | W220 | W220-R222 PolarHBondContact O-N 3.03Š|
| 223 | A | 90.5 | Very high | 84 | Confident | 91 Ų | 91 | 127.8 Ų | 127.8 | 75% | 0.752 | 61% | 0.613 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 140.8 | 172.8 | 0 | 0 | 0 | 0 | 0 | 110.3 | S221 | S221-A223 PolarHBondContact O-N 3.48Š|
| 224 | V | 95.8 | Very high | 86 | Confident | 125 Ų | 125 | 124.3 Ų | 124.3 | 76% | 0.758 | 59% | 0.589 | S | S | * | * | trans | -115.7 | 136.1 | 177.9 | -177.3 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 225 | F | 98 | Very high | 88.1 | Confident | 52 Ų | 52 | 124 Ų | 124 | 23% | 0.228 | 59% | 0.591 | C | S | . | * | trans | -68.1 | 139.9 | 176.2 | -60.3 | -43.1 | 0 | 0 | 0 | 111.5 | Q229 R230 L233 L257 Q261 W265 | F225-Q229 HydrophobicContact CB-CB 4.13Å; F225-R230 PolarHBondContact O-NH2 3.15Å; F225-L233 HydrophobicContact CD2-CD1 4.38Å; F225-L257 HydrophobicContact CD1-CD1 4.43Å; F225-L257 HydrophobicContact CD1-CD2 3.79Å; F225-L257 HydrophobicContact CE1-CD1 4.36Å; F225-L257 HydrophobicContact CE1-CD2 3.71Å; F225-Q261 HydrophobicContact CE1-CB 4.3Å; F225-Q261 HydrophobicContact CE1-CG 4.32Å; F225-Q261 HydrophobicContact CZ-CB 4.03Å; F225-Q261 HydrophobicContact CZ-CG 4.27Å; F225-W265 AromaticContact CD2-CD1 3.73Å; F225-W265 HydrophobicContact CE2-CB 4.24Å; F225-W265 AromaticContact CE2-CD1 3.6Å; F225-W265 HydrophobicContact CE2-CG 4.24Å | ||
| 226 | S | 98.3 | Very high | 90 | Very high | 56 Ų | 56 | 117.5 Ų | 117.5 | 39% | 0.392 | 56% | 0.561 | S | S | . | * | trans | -62 | 163.4 | 175.5 | 79.8 | 0 | 0 | 0 | 0 | 111.4 | L228 Q229 R230 | S226-L228 VanDerWaalsContact C-N 3.3Å; S226-L228 PolarHBondContact O-N 3.06Å; S226-Q229 PolarHBondContact O-N 3.17Å; S226-Q229 VanDerWaalsContact OG-CG 3.32Å; S226-Q229 WeakPolarHBondContact OG-CG 3.45Å; S226-Q229 PolarHBondContact OG-N 3.47Å; S226-R230 PolarHBondContact O-N 3.33Å | ||
| 227 | N | 97.9 | Very high | 91.8 | Very high | 108 Ų | 108 | 107.2 Ų | 107.2 | 58% | 0.578 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -61.5 | -40 | 177.4 | -73.2 | -33.4 | 0 | 0 | 0 | 111.9 | R230 K231 | N227-R230 PolarHBondContact O-N 3.36Å; N227-R230 PolarHBondContact OD1-NH1 2.91Å; N227-R230 PolarHBondContact OD1-NH2 3.38Å; N227-K231 WeakPolarHBondContact O-CB 3.49Å; N227-K231 WeakPolarHBondContact O-CG 3.34Å; N227-K231 PolarHBondContact O-N 2.9Å |
| 228 | L | 98.2 | Very high | 93.4 | Very high | 135 Ų | 135 | 103.5 Ų | 103.5 | 71% | 0.707 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -61.4 | -46.7 | 176.5 | -178.8 | 65.2 | 0 | 0 | 0 | 111.5 | S226 R230 K231 G232 | S226-L228 VanDerWaalsContact C-N 3.3Å; S226-L228 PolarHBondContact O-N 3.06Å; L228-R230 PolarHBondContact O-N 3.08Å; L228-K231 PolarHBondContact O-N 3.08Å; L228-G232 PolarHBondContact O-N 3.11Å |
| 229 | Q | 98.6 | Very high | 94.8 | Very high | 38 Ų | 38 | 98.6 Ų | 98.6 | 18% | 0.178 | 50% | 0.498 | C | S | . | . | H | α-helix | trans | -59.6 | -46 | 177.9 | -73.7 | 170.9 | -22.3 | 0 | 0 | 111.5 | F225 S226 G232 L233 L255 L257 | F225-Q229 HydrophobicContact CB-CB 4.13Å; S226-Q229 PolarHBondContact O-N 3.17Å; S226-Q229 VanDerWaalsContact OG-CG 3.32Å; S226-Q229 WeakPolarHBondContact OG-CG 3.45Å; S226-Q229 PolarHBondContact OG-N 3.47Å; Q229-G232 PolarHBondContact O-N 2.65Å; Q229-L233 WeakPolarHBondContact O-CB 3.49Å; Q229-L233 WeakPolarHBondContact O-CD1 3.44Å; Q229-L233 VanDerWaalsContact O-CG 3.23Å; Q229-L233 WeakPolarHBondContact O-CG 3.37Å; Q229-L233 PolarHBondContact O-N 2.92Å; Q229-L255 HydrophobicContact CG-CB 4.42Å; Q229-L255 PolarHBondContact NE2-O 3.32Å; Q229-L255 VanDerWaalsContact NE2-O 3.09Å; Q229-L257 HydrophobicContact CB-CD1 4.47Å; Q229-L257 HydrophobicContact CG-CD1 4.47Å; Q229-L257 HydrophobicContact CG-CD2 4.46Å; Q229-L257 HydrophobicContact CG-CG 4.45Å |
| 230 | R | 98.5 | Very high | 95.9 | Very high | 104 Ų | 104 | 95.6 Ų | 95.6 | 39% | 0.392 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -63.8 | -43.4 | 179.9 | -155.9 | -176.5 | -47.4 | 108.2 | 11.4 | 112 | F225 S226 N227 L228 L233 E234 | F225-R230 PolarHBondContact O-NH2 3.15Å; S226-R230 PolarHBondContact O-N 3.33Å; N227-R230 PolarHBondContact O-N 3.36Å; N227-R230 PolarHBondContact OD1-NH1 2.91Å; N227-R230 PolarHBondContact OD1-NH2 3.38Å; L228-R230 PolarHBondContact O-N 3.08Å; R230-L233 PolarHBondContact O-N 3.49Å; R230-E234 WeakPolarHBondContact O-CB 3.37Å; R230-E234 PolarHBondContact O-N 3.28Å |
| 231 | K | 98.4 | Very high | 96.7 | Very high | 158 Ų | 158 | 87.3 Ų | 87.3 | 69% | 0.687 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -61.7 | -44.9 | 176.1 | -75 | -177.4 | 177.3 | -172.1 | 0 | 111.7 | N227 L228 E234 K235 | N227-K231 WeakPolarHBondContact O-CB 3.49Å; N227-K231 WeakPolarHBondContact O-CG 3.34Å; N227-K231 PolarHBondContact O-N 2.9Å; L228-K231 PolarHBondContact O-N 3.08Å; K231-E234 PolarHBondContact O-N 2.89Å; K231-K235 WeakPolarHBondContact O-CB 3.15Å; K231-K235 PolarHBondContact O-N 3.11Å |
| 232 | G | 98.3 | Very high | 97.3 | Very high | 22 Ų | 22 | 89.2 Ų | 89.2 | 23% | 0.227 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -63.4 | -41.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | L228 Q229 R236 | L228-G232 PolarHBondContact O-N 3.11Å; Q229-G232 PolarHBondContact O-N 2.65Å; G232-R236 PolarHBondContact O-N 3.47Å |
| 233 | L | 98.7 | Very high | 97.7 | Very high | 0 Ų | 0 | 79.5 Ų | 79.5 | 0% | 0 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -63.5 | -43.5 | 174.8 | -70.6 | 165.4 | 0 | 0 | 0 | 111.8 | F225 Q229 R230 R236 F237 L251 L255 L257 V262 W265 F266 | F225-L233 HydrophobicContact CD2-CD1 4.38Å; Q229-L233 WeakPolarHBondContact O-CB 3.49Å; Q229-L233 WeakPolarHBondContact O-CD1 3.44Å; Q229-L233 VanDerWaalsContact O-CG 3.23Å; Q229-L233 WeakPolarHBondContact O-CG 3.37Å; Q229-L233 PolarHBondContact O-N 2.92Å; R230-L233 PolarHBondContact O-N 3.49Å; L233-R236 PolarHBondContact O-N 3.18Å; L233-F237 WeakPolarHBondContact O-CB 3.34Å; L233-F237 PolarHBondContact O-N 3.4Å; L233-L251 HydrophobicContact CD2-CD2 3.92Å; L233-L251 HydrophobicContact CD2-CG 4.47Å; L233-L255 HydrophobicContact CD2-CD1 3.93Å; L233-L255 HydrophobicContact CG-CD1 3.73Å; L233-L257 HydrophobicContact CD1-CD1 4.01Å; L233-V262 HydrophobicContact CD2-CG1 4.02Å; L233-V262 HydrophobicContact CD2-CG2 4.33Å; L233-W265 HydrophobicContact CB-CD2 3.86Å; L233-W265 HydrophobicContact CB-CE3 3.79Å; L233-W265 HydrophobicContact CB-CH2 3.63Å; L233-W265 HydrophobicContact CB-CZ2 3.67Å; L233-W265 HydrophobicContact CB-CZ3 3.69Å; L233-W265 HydrophobicContact CD1-CB 4.4Å; L233-W265 HydrophobicContact CD1-CD2 3.75Å; L233-W265 HydrophobicContact CD1-CE3 4.37Å; L233-W265 HydrophobicContact CD1-CG 3.74Å; L233-W265 HydrophobicContact CD2-CD2 4.32Å; L233-W265 HydrophobicContact CD2-CE3 4.17Å; L233-W265 HydrophobicContact CG-CD2 4.18Å; L233-W265 HydrophobicContact CG-CE3 4.33Å; L233-F266 HydrophobicContact CD2-CE2 4.02Å |
| 234 | E | 98.6 | Very high | 98.1 | Very high | 42 Ų | 42 | 78.3 Ų | 78.3 | 20% | 0.196 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -64.8 | -47.2 | 178.8 | -162.9 | 64.3 | -130.2 | 0 | 0 | 111.9 | R230 K231 R236 F237 E238 R269 | R230-E234 WeakPolarHBondContact O-CB 3.37Å; R230-E234 PolarHBondContact O-N 3.28Å; K231-E234 PolarHBondContact O-N 2.89Å; E234-R236 VanDerWaalsContact C-N 3.27Å; E234-R236 PolarHBondContact O-N 3.39Å; E234-F237 CarbonylContact O-C 3.58Å; E234-F237 WeakPolarHBondContact O-CA 3.24Å; E234-F237 WeakPolarHBondContact O-CB 3.36Å; E234-F237 PolarHBondContact O-N 3.24Å; E234-E238 WeakPolarHBondContact O-CG 3.36Å; E234-E238 PolarHBondContact O-N 3.46Å; E234-R269 VanDerWaalsContact CD-NE 3.3Å; E234-R269 VanDerWaalsContact CD-NH2 3.3Å; E234-R269 IonicContact OE1-CZ 3.31Å; E234-R269 IonicContact OE1-NE 2.9Å; E234-R269 PolarHBondContact OE1-NE 3.35Å; E234-R269 IonicContact OE1-NH2 2.68Å; E234-R269 PolarHBondContact OE1-NH2 3.3Å; E234-R269 IonicContact OE2-CZ 3.94Å; E234-R269 IonicContact OE2-NE 3.2Å; E234-R269 PolarHBondContact OE2-NE 2.99Å; E234-R269 IonicContact OE2-NH2 3.37Å; E234-R269 PolarHBondContact OE2-NH2 3.06Å |
| 235 | K | 98.4 | Very high | 98.2 | Very high | 148 Ų | 148 | 78.9 Ų | 78.9 | 64% | 0.643 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -54.8 | -43.5 | 176.5 | -176.5 | 175.6 | -177.7 | 175.5 | 0 | 111.7 | K231 | K231-K235 WeakPolarHBondContact O-CB 3.15Å; K231-K235 PolarHBondContact O-N 3.11Å |
| 236 | R | 98.2 | Very high | 98.2 | Very high | 57 Ų | 57 | 80.7 Ų | 80.7 | 22% | 0.215 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -69.7 | -36.1 | 176.2 | -172.5 | 60.9 | 179.3 | -114.9 | 6 | 112 | G232 L233 E234 I239 Q240 V243 D247 L251 F266 | G232-R236 PolarHBondContact O-N 3.47Å; L233-R236 PolarHBondContact O-N 3.18Å; E234-R236 VanDerWaalsContact C-N 3.27Å; E234-R236 PolarHBondContact O-N 3.39Å; R236-I239 PolarHBondContact O-N 2.93Å; R236-Q240 VanDerWaalsContact NH2-OE1 3.09Å; R236-Q240 PolarHBondContact O-N 2.92Å; R236-V243 HydrophobicContact CG-CG2 4.21Å; R236-D247 IonicContact CZ-OD1 2.9Å; R236-D247 IonicContact NH2-OD1 2.86Å; R236-D247 PolarHBondContact NH2-OD1 3.02Å; R236-D247 IonicContact NH2-OD2 3.38Å; R236-D247 PolarHBondContact NH2-OD2 3.19Å; R236-L251 HydrophobicContact CB-CD1 4.31Å; R236-L251 HydrophobicContact CB-CD2 4.02Å; R236-L251 HydrophobicContact CG-CD2 3.98Å; R236-F266 HydrophobicContact CB-CZ 4.3Å; R236-F266 HydrophobicContact CG-CZ 4.23Å |
| 237 | F | 98.5 | Very high | 98.2 | Very high | 4 Ų | 4 | 79.8 Ų | 79.8 | 2% | 0.018 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -66.6 | -35.5 | 178.6 | -175.3 | -100.9 | 0 | 0 | 0 | 112.9 | L233 E234 I239 Q240 K241 W265 F266 R269 R270 W273 | L233-F237 WeakPolarHBondContact O-CB 3.34Å; L233-F237 PolarHBondContact O-N 3.4Å; E234-F237 CarbonylContact O-C 3.58Å; E234-F237 WeakPolarHBondContact O-CA 3.24Å; E234-F237 WeakPolarHBondContact O-CB 3.36Å; E234-F237 PolarHBondContact O-N 3.24Å; F237-I239 VanDerWaalsContact C-N 3.33Å; F237-I239 PolarHBondContact O-N 3.1Å; F237-Q240 CarbonylContact O-C 3.44Å; F237-Q240 PolarHBondContact O-N 3.32Å; F237-K241 HydrophobicContact CD1-CD 4.01Å; F237-K241 HydrophobicContact CD2-CD 4.35Å; F237-K241 HydrophobicContact CE1-CD 3.49Å; F237-K241 VanDerWaalsContact CE1-CD 3.49Å; F237-K241 HydrophobicContact CE2-CB 4.25Å; F237-K241 HydrophobicContact CE2-CD 3.87Å; F237-K241 HydrophobicContact CG-CD 4.41Å; F237-K241 HydrophobicContact CZ-CB 4.48Å; F237-K241 HydrophobicContact CZ-CD 3.41Å; F237-K241 VanDerWaalsContact CZ-CD 3.41Å; F237-K241 WeakPolarHBondContact O-CD 3.5Å; F237-K241 PolarHBondContact O-NZ 3.44Å; F237-W265 HydrophobicContact CB-CH2 4.25Å; F237-W265 HydrophobicContact CB-CZ3 4.03Å; F237-W265 HydrophobicContact CD2-CZ3 4.49Å; F237-W265 HydrophobicContact CG-CZ3 4.39Å; F237-F266 HydrophobicContact CB-CE1 4Å; F237-F266 HydrophobicContact CB-CZ 4.2Å; F237-F266 AromaticContact CD2-CD1 3.77Å; F237-F266 HydrophobicContact CD2-CD1 3.77Å; F237-F266 AromaticContact CD2-CE1 3.62Å; F237-F266 HydrophobicContact CD2-CE1 3.62Å; F237-F266 HydrophobicContact CE2-CD1 4.43Å; F237-F266 HydrophobicContact CG-CE1 4.32Å; F237-R269 HydrophobicContact CD1-CG 3.61Å; F237-R269 HydrophobicContact CD2-CB 4.26Å; F237-R269 HydrophobicContact CD2-CG 3.74Å; F237-R269 HydrophobicContact CE1-CG 3.57Å; F237-R269 HydrophobicContact CE2-CB 4.1Å; F237-R269 HydrophobicContact CE2-CG 3.7Å; F237-R269 HydrophobicContact CG-CG 3.7Å; F237-R269 HydrophobicContact CZ-CB 4.34Å; F237-R269 HydrophobicContact CZ-CG 3.62Å; F237-R270 HydrophobicContact CE2-CG 3.75Å; F237-R270 HydrophobicContact CZ-CG 4.2Å; F237-W273 HydrophobicContact CE1-CB 4.37Å; F237-W273 HydrophobicContact CE1-CG 4.48Å; F237-W273 HydrophobicContact CZ-CB 4.11Å; F237-W273 HydrophobicContact CZ-CG 4.33Å |
| 238 | E | 98.1 | Very high | 98.2 | Very high | 126 Ų | 126 | 76.6 Ų | 76.6 | 59% | 0.589 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -57.2 | -47.4 | 174 | -75.2 | 167.9 | -174.6 | 0 | 0 | 111.1 | E234 K241 | E234-E238 WeakPolarHBondContact O-CG 3.36Å; E234-E238 PolarHBondContact O-N 3.46Å; E238-K241 PolarHBondContact O-NZ 3.39Å |
| 239 | I | 97.8 | Very high | 98.3 | Very high | 132 Ų | 132 | 76.1 Ų | 76.1 | 68% | 0.677 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -69.6 | -46.4 | 177.9 | -57.3 | 165.1 | 0 | 0 | 0 | 111.1 | R236 F237 | R236-I239 PolarHBondContact O-N 2.93Å; F237-I239 VanDerWaalsContact C-N 3.33Å; F237-I239 PolarHBondContact O-N 3.1Å |
| 240 | Q | 97.6 | Very high | 98.3 | Very high | 48 Ų | 48 | 79.6 Ų | 79.6 | 22% | 0.224 | 37% | 0.372 | C | S | . | . | trans | -140.1 | 106.8 | -168.9 | -175.4 | 179.7 | -8.3 | 0 | 0 | 110.9 | R236 F237 Y242 | R236-Q240 VanDerWaalsContact NH2-OE1 3.09Å; R236-Q240 PolarHBondContact O-N 2.92Å; F237-Q240 CarbonylContact O-C 3.44Å; F237-Q240 PolarHBondContact O-N 3.32Å; Q240-Y242 WeakPolarHBondContact CG-O 3.37Å; Q240-Y242 PolarHBondContact NE2-O 3.24Å; Q240-Y242 PolarHBondContact O-N 2.97Å | ||
| 241 | K | 97.7 | Very high | 98.2 | Very high | 61 Ų | 61 | 75.2 Ų | 75.2 | 27% | 0.265 | 36% | 0.357 | S | S | . | . | S | Bend | trans | -67.6 | -22.1 | -178.6 | -56.5 | -68.2 | 175.4 | -87.1 | 0 | 113 | F237 E238 R270 | F237-K241 HydrophobicContact CD1-CD 4.01Å; F237-K241 HydrophobicContact CD2-CD 4.35Å; F237-K241 HydrophobicContact CE1-CD 3.49Å; F237-K241 VanDerWaalsContact CE1-CD 3.49Å; F237-K241 HydrophobicContact CE2-CB 4.25Å; F237-K241 HydrophobicContact CE2-CD 3.87Å; F237-K241 HydrophobicContact CG-CD 4.41Å; F237-K241 HydrophobicContact CZ-CB 4.48Å; F237-K241 HydrophobicContact CZ-CD 3.41Å; F237-K241 VanDerWaalsContact CZ-CD 3.41Å; F237-K241 WeakPolarHBondContact O-CD 3.5Å; F237-K241 PolarHBondContact O-NZ 3.44Å; E238-K241 PolarHBondContact O-NZ 3.39Å; K241-R270 VanDerWaalsContact O-CD 3.27Å; K241-R270 WeakPolarHBondContact O-CD 3.41Å; K241-R270 WeakPolarHBondContact O-CG 3.48Å |
| 242 | Y | 98.3 | Very high | 98.3 | Very high | 140 Ų | 140 | 68 Ų | 68 | 55% | 0.549 | 33% | 0.326 | S | S | . | . | S | Bend | trans | -130 | 108.6 | -179.4 | -68.9 | -103 | 0 | 0 | 0 | 110.6 | Q240 | Q240-Y242 WeakPolarHBondContact CG-O 3.37Å; Q240-Y242 PolarHBondContact NE2-O 3.24Å; Q240-Y242 PolarHBondContact O-N 2.97Å |
| 243 | V | 97.8 | Very high | 98.3 | Very high | 22 Ų | 22 | 70.8 Ų | 70.8 | 13% | 0.133 | 35% | 0.347 | C | S | . | . | trans | -89 | 132.1 | -176.6 | -179.9 | 0 | 0 | 0 | 0 | 111.3 | R236 D247 R248 F266 | R236-V243 HydrophobicContact CG-CG2 4.21Å; V243-D247 HydrophobicContact CG1-CB 3.44Å; V243-D247 VanDerWaalsContact CG1-CB 3.44Å; V243-R248 HydrophobicContact CG1-CB 3.83Å; V243-R248 HydrophobicContact CG1-CG 4.49Å; V243-F266 HydrophobicContact CB-CD1 4.34Å; V243-F266 HydrophobicContact CB-CE1 4.23Å; V243-F266 HydrophobicContact CB-CZ 4.44Å; V243-F266 HydrophobicContact CG2-CD1 3.68Å; V243-F266 HydrophobicContact CG2-CD2 4.43Å; V243-F266 HydrophobicContact CG2-CE1 3.13Å; V243-F266 HydrophobicContact CG2-CE2 3.98Å; V243-F266 HydrophobicContact CG2-CG 4.31Å; V243-F266 HydrophobicContact CG2-CZ 3.32Å | ||
| 244 | T | 98.4 | Very high | 98.2 | Very high | 66 Ų | 66 | 77.5 Ų | 77.5 | 41% | 0.405 | 38% | 0.38 | S | S | . | . | trans | -71.6 | 165.1 | 178.7 | 72.8 | 0 | 0 | 0 | 0 | 111.4 | P246 D247 R248 | T244-P246 WeakPolarHBondContact OG1-CD 3.48Å; T244-P246 WeakPolarHBondContact OG1-CG 3.2Å; T244-D247 PolarHBondContact O-N 3.04Å; T244-D247 WeakPolarHBondContact OG1-CB 3.46Å; T244-D247 PolarHBondContact OG1-N 3.42Å; T244-D247 PolarHBondContact OG1-OD2 3.08Å; T244-R248 WeakPolarHBondContact O-CB 3.45Å; T244-R248 PolarHBondContact O-N 3.41Å | ||
| 245 | K | 98.1 | Very high | 98.2 | Very high | 138 Ų | 138 | 76.8 Ų | 76.8 | 60% | 0.6 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -56.9 | -48.1 | 178.4 | -171.2 | 177.8 | -178.3 | -177.9 | 0 | 113.7 | K249 | K245-K249 PolarHBondContact O-N 3.08Å |
| 246 | P | 98.2 | Very high | 98.2 | Very high | 90 Ų | 90 | 72.9 Ų | 72.9 | 58% | 0.584 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -66 | -45.4 | 178.3 | 24.5 | -33.6 | 0 | 0 | 0 | 112.3 | T244 R248 K249 Q250 | T244-P246 WeakPolarHBondContact OG1-CD 3.48Å; T244-P246 WeakPolarHBondContact OG1-CG 3.2Å; P246-R248 VanDerWaalsContact C-N 3.25Å; P246-R248 PolarHBondContact O-N 3.32Å; P246-K249 WeakPolarHBondContact O-CB 3.32Å; P246-K249 PolarHBondContact O-N 3.33Å; P246-Q250 PolarHBondContact O-N 3.13Å |
| 247 | D | 98.1 | Very high | 98.2 | Very high | 36 Ų | 36 | 71.1 Ų | 71.1 | 19% | 0.193 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -58.3 | -40.1 | 177.7 | -70.2 | -43.4 | 0 | 0 | 0 | 112.3 | R236 V243 T244 Q250 L251 | R236-D247 IonicContact CZ-OD1 2.9Å; R236-D247 IonicContact NH2-OD1 2.86Å; R236-D247 PolarHBondContact NH2-OD1 3.02Å; R236-D247 IonicContact NH2-OD2 3.38Å; R236-D247 PolarHBondContact NH2-OD2 3.19Å; V243-D247 HydrophobicContact CG1-CB 3.44Å; V243-D247 VanDerWaalsContact CG1-CB 3.44Å; T244-D247 PolarHBondContact O-N 3.04Å; T244-D247 WeakPolarHBondContact OG1-CB 3.46Å; T244-D247 PolarHBondContact OG1-N 3.42Å; T244-D247 PolarHBondContact OG1-OD2 3.08Å; D247-Q250 PolarHBondContact O-N 3.38Å; D247-L251 WeakPolarHBondContact O-CB 3.43Å; D247-L251 PolarHBondContact O-N 3.33Å |
| 248 | R | 98.6 | Very high | 98.2 | Very high | 41 Ų | 41 | 74.6 Ų | 74.6 | 16% | 0.155 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -65.6 | -41.4 | -179.3 | -164.7 | 174 | 59.8 | -120 | -5.7 | 111.3 | V243 T244 P246 L251 A252 D259 V262 | V243-R248 HydrophobicContact CG1-CB 3.83Å; V243-R248 HydrophobicContact CG1-CG 4.49Å; T244-R248 WeakPolarHBondContact O-CB 3.45Å; T244-R248 PolarHBondContact O-N 3.41Å; P246-R248 VanDerWaalsContact C-N 3.25Å; P246-R248 PolarHBondContact O-N 3.32Å; R248-L251 PolarHBondContact O-N 2.81Å; R248-A252 VanDerWaalsContact O-CB 3.24Å; R248-A252 WeakPolarHBondContact O-CB 3.37Å; R248-A252 PolarHBondContact O-N 3.28Å; R248-D259 WeakPolarHBondContact CB-OD1 3.27Å; R248-D259 WeakPolarHBondContact CD-OD1 3.45Å; R248-D259 WeakPolarHBondContact CG-OD1 3.23Å; R248-D259 IonicContact CZ-OD1 3.5Å; R248-D259 IonicContact CZ-OD2 3.62Å; R248-D259 VanDerWaalsContact NE-CG 3.33Å; R248-D259 IonicContact NE-OD1 2.67Å; R248-D259 PolarHBondContact NE-OD1 3.07Å; R248-D259 IonicContact NE-OD2 3.41Å; R248-D259 PolarHBondContact NE-OD2 3.41Å; R248-D259 IonicContact NH2-OD1 3.5Å; R248-D259 IonicContact NH2-OD2 2.9Å; R248-D259 PolarHBondContact NH2-OD2 3.38Å; R248-V262 HydrophobicContact CG-CB 3.81Å; R248-V262 HydrophobicContact CG-CG1 3.57Å |
| 249 | K | 98.6 | Very high | 98.2 | Very high | 125 Ų | 125 | 71 Ų | 71 | 54% | 0.543 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -62 | -43.1 | 174.1 | -73.8 | -175.5 | 172 | -168.4 | 0 | 111.6 | K245 P246 A252 A253 | K245-K249 PolarHBondContact O-N 3.08Å; P246-K249 WeakPolarHBondContact O-CB 3.32Å; P246-K249 PolarHBondContact O-N 3.33Å; K249-A252 PolarHBondContact O-N 2.98Å; K249-A253 PolarHBondContact O-N 2.98Å |
| 250 | Q | 98.5 | Very high | 98.2 | Very high | 112 Ų | 112 | 67.7 Ų | 67.7 | 52% | 0.523 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -63.7 | -46.7 | 177.5 | -175 | -179.2 | 0.2 | 0 | 0 | 111.6 | P246 D247 A252 A253 M254 | P246-Q250 PolarHBondContact O-N 3.13Å; D247-Q250 PolarHBondContact O-N 3.38Å; Q250-A252 VanDerWaalsContact C-N 3.31Å; Q250-A252 PolarHBondContact O-N 2.86Å; Q250-A253 PolarHBondContact O-N 2.81Å; Q250-M254 HydrophobicContact CG-SD 4.29Å; Q250-M254 WeakPolarHBondContact O-CG 3.36Å; Q250-M254 PolarHBondContact O-N 3.02Å |
| 251 | L | 98.4 | Very high | 98.3 | Very high | 12 Ų | 12 | 68.8 Ų | 68.8 | 6% | 0.063 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -62.8 | -39.2 | 178.2 | -173.4 | 63.8 | 0 | 0 | 0 | 112.1 | L233 R236 D247 R248 M254 L255 V262 F266 | L233-L251 HydrophobicContact CD2-CD2 3.92Å; L233-L251 HydrophobicContact CD2-CG 4.47Å; R236-L251 HydrophobicContact CB-CD1 4.31Å; R236-L251 HydrophobicContact CB-CD2 4.02Å; R236-L251 HydrophobicContact CG-CD2 3.98Å; D247-L251 WeakPolarHBondContact O-CB 3.43Å; D247-L251 PolarHBondContact O-N 3.33Å; R248-L251 PolarHBondContact O-N 2.81Å; L251-M254 PolarHBondContact O-N 2.88Å; L251-L255 HydrophobicContact CD1-CD1 3.79Å; L251-L255 HydrophobicContact CD1-CG 4.2Å; L251-L255 HydrophobicContact CG-CD1 3.99Å; L251-L255 WeakPolarHBondContact O-CB 3.42Å; L251-L255 WeakPolarHBondContact O-CG 3.49Å; L251-L255 PolarHBondContact O-N 3.09Å; L251-L255 VanDerWaalsContact O-N 3.08Å; L251-V262 HydrophobicContact CD2-CG1 3.89Å; L251-F266 HydrophobicContact CD2-CE2 3.78Å; L251-F266 HydrophobicContact CD2-CZ 4.21Å |
| 252 | A | 98.6 | Very high | 98.3 | Very high | 5 Ų | 5 | 65.9 Ų | 65.9 | 4% | 0.041 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -60 | -47.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | R248 K249 Q250 L255 G256 L257 V262 | R248-A252 VanDerWaalsContact O-CB 3.24Å; R248-A252 WeakPolarHBondContact O-CB 3.37Å; R248-A252 PolarHBondContact O-N 3.28Å; K249-A252 PolarHBondContact O-N 2.98Å; Q250-A252 VanDerWaalsContact C-N 3.31Å; Q250-A252 PolarHBondContact O-N 2.86Å; A252-L255 PolarHBondContact O-N 3.31Å; A252-G256 PolarHBondContact O-N 3.25Å; A252-L257 CarbonylContact C-O 3.45Å; A252-L257 WeakPolarHBondContact CB-O 3.38Å; A252-L257 PolarHBondContact O-N 3.31Å; A252-V262 HydrophobicContact CB-CG2 3.85Å |
| 253 | A | 98.4 | Very high | 98.3 | Very high | 81 Ų | 81 | 64.2 Ų | 64.2 | 67% | 0.669 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -61.1 | -45.9 | 176 | 0 | 0 | 0 | 0 | 0 | 112.2 | K249 Q250 L255 G256 | K249-A253 PolarHBondContact O-N 2.98Å; Q250-A253 PolarHBondContact O-N 2.81Å; A253-L255 VanDerWaalsContact C-N 3.3Å; A253-L255 PolarHBondContact O-N 3.14Å; A253-G256 PolarHBondContact O-N 2.75Å |
| 254 | M | 98.1 | Very high | 98.3 | Very high | 141 Ų | 141 | 66.6 Ų | 66.6 | 70% | 0.695 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -63 | -32.5 | -179.8 | -70.9 | 178.7 | 72.6 | 0 | 0 | 113.6 | Q250 L251 | Q250-M254 HydrophobicContact CG-SD 4.29Å; Q250-M254 WeakPolarHBondContact O-CG 3.36Å; Q250-M254 PolarHBondContact O-N 3.02Å; L251-M254 PolarHBondContact O-N 2.88Å |
| 255 | L | 97.9 | Very high | 98.4 | Very high | 28 Ų | 28 | 65 Ų | 65 | 15% | 0.147 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -101 | 1 | -175.8 | -61.2 | -179.7 | 0 | 0 | 0 | 113.9 | Q229 L233 L251 A252 A253 L257 | Q229-L255 HydrophobicContact CG-CB 4.42Å; Q229-L255 PolarHBondContact NE2-O 3.32Å; Q229-L255 VanDerWaalsContact NE2-O 3.09Å; L233-L255 HydrophobicContact CD2-CD1 3.93Å; L233-L255 HydrophobicContact CG-CD1 3.73Å; L251-L255 HydrophobicContact CD1-CD1 3.79Å; L251-L255 HydrophobicContact CD1-CG 4.2Å; L251-L255 HydrophobicContact CG-CD1 3.99Å; L251-L255 WeakPolarHBondContact O-CB 3.42Å; L251-L255 WeakPolarHBondContact O-CG 3.49Å; L251-L255 PolarHBondContact O-N 3.09Å; L251-L255 VanDerWaalsContact O-N 3.08Å; A252-L255 PolarHBondContact O-N 3.31Å; A253-L255 VanDerWaalsContact C-N 3.3Å; A253-L255 PolarHBondContact O-N 3.14Å; L255-L257 VanDerWaalsContact C-N 3.31Å; L255-L257 HydrophobicContact CB-CD1 4.15Å; L255-L257 HydrophobicContact CB-CG 4.13Å; L255-L257 PolarHBondContact O-N 2.9Å |
| 256 | G | 98.3 | Very high | 98.4 | Very high | 65 Ų | 65 | 58.8 Ų | 58.8 | 67% | 0.67 | 34% | 0.335 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 62.6 | 37.5 | -174.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | A252 A253 | A252-G256 PolarHBondContact O-N 3.25Å; A253-G256 PolarHBondContact O-N 2.75Å |
| 257 | L | 98.3 | Very high | 98.4 | Very high | 20 Ų | 20 | 58.3 Ų | 58.3 | 11% | 0.105 | 33% | 0.325 | C | S | . | . | trans | -114.5 | 165.9 | 179.1 | -64.7 | 179.6 | 0 | 0 | 0 | 110.7 | F225 Q229 L233 A252 L255 V262 | F225-L257 HydrophobicContact CD1-CD1 4.43Å; F225-L257 HydrophobicContact CD1-CD2 3.79Å; F225-L257 HydrophobicContact CE1-CD1 4.36Å; F225-L257 HydrophobicContact CE1-CD2 3.71Å; Q229-L257 HydrophobicContact CB-CD1 4.47Å; Q229-L257 HydrophobicContact CG-CD1 4.47Å; Q229-L257 HydrophobicContact CG-CD2 4.46Å; Q229-L257 HydrophobicContact CG-CG 4.45Å; L233-L257 HydrophobicContact CD1-CD1 4.01Å; A252-L257 CarbonylContact C-O 3.45Å; A252-L257 WeakPolarHBondContact CB-O 3.38Å; A252-L257 PolarHBondContact O-N 3.31Å; L255-L257 VanDerWaalsContact C-N 3.31Å; L255-L257 HydrophobicContact CB-CD1 4.15Å; L255-L257 HydrophobicContact CB-CG 4.13Å; L255-L257 PolarHBondContact O-N 2.9Å; L257-V262 HydrophobicContact CB-CG2 4.08Å; L257-V262 HydrophobicContact CD1-CG2 4.34Å | ||
| 258 | T | 98.5 | Very high | 98.4 | Very high | 78 Ų | 78 | 61.3 Ų | 61.3 | 48% | 0.479 | 34% | 0.341 | S | S | . | . | trans | -87.2 | 152.7 | 171.5 | 62.3 | 0 | 0 | 0 | 0 | 111.5 | A260 Q261 V262 | T258-A260 PolarHBondContact O-N 3.1Å; T258-A260 VanDerWaalsContact O-N 3.16Å; T258-Q261 WeakPolarHBondContact O-CB 3.32Å; T258-Q261 PolarHBondContact O-N 3.45Å; T258-Q261 WeakPolarHBondContact OG1-CB 3.3Å; T258-Q261 VanDerWaalsContact OG1-CD 3.27Å; T258-Q261 WeakPolarHBondContact OG1-CG 3.46Å; T258-Q261 PolarHBondContact OG1-N 3.32Å; T258-Q261 PolarHBondContact OG1-OE1 3Å; T258-V262 PolarHBondContact O-N 3.32Å; T258-V262 VanDerWaalsContact O-N 3.12Å | ||
| 259 | D | 98.4 | Very high | 98.4 | Very high | 50 Ų | 50 | 62.6 Ų | 62.6 | 27% | 0.267 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -53.2 | -38.2 | 176.2 | -169.1 | 41.1 | 0 | 0 | 0 | 111.9 | R248 K263 | R248-D259 WeakPolarHBondContact CB-OD1 3.27Å; R248-D259 WeakPolarHBondContact CD-OD1 3.45Å; R248-D259 WeakPolarHBondContact CG-OD1 3.23Å; R248-D259 IonicContact CZ-OD1 3.5Å; R248-D259 IonicContact CZ-OD2 3.62Å; R248-D259 VanDerWaalsContact NE-CG 3.33Å; R248-D259 IonicContact NE-OD1 2.67Å; R248-D259 PolarHBondContact NE-OD1 3.07Å; R248-D259 IonicContact NE-OD2 3.41Å; R248-D259 PolarHBondContact NE-OD2 3.41Å; R248-D259 IonicContact NH2-OD1 3.5Å; R248-D259 IonicContact NH2-OD2 2.9Å; R248-D259 PolarHBondContact NH2-OD2 3.38Å; D259-K263 WeakPolarHBondContact O-CB 3.14Å; D259-K263 PolarHBondContact O-N 3.07Å |
| 260 | A | 98.3 | Very high | 98.3 | Very high | 63 Ų | 63 | 59.7 Ų | 59.7 | 52% | 0.521 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -66.9 | -42.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | T258 K263 V264 | T258-A260 PolarHBondContact O-N 3.1Å; T258-A260 VanDerWaalsContact O-N 3.16Å; A260-K263 WeakPolarHBondContact O-CB 3.46Å; A260-K263 PolarHBondContact O-N 3.1Å; A260-V264 WeakPolarHBondContact O-CG2 3.45Å; A260-V264 PolarHBondContact O-N 2.9Å |
| 261 | Q | 98.3 | Very high | 98.3 | Very high | 70 Ų | 70 | 58.3 Ų | 58.3 | 33% | 0.327 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -62 | -44.6 | 176.7 | -78.6 | 166.3 | -39.5 | 0 | 0 | 111.4 | F225 T258 K263 V264 W265 | F225-Q261 HydrophobicContact CE1-CB 4.3Å; F225-Q261 HydrophobicContact CE1-CG 4.32Å; F225-Q261 HydrophobicContact CZ-CB 4.03Å; F225-Q261 HydrophobicContact CZ-CG 4.27Å; T258-Q261 WeakPolarHBondContact O-CB 3.32Å; T258-Q261 PolarHBondContact O-N 3.45Å; T258-Q261 WeakPolarHBondContact OG1-CB 3.3Å; T258-Q261 VanDerWaalsContact OG1-CD 3.27Å; T258-Q261 WeakPolarHBondContact OG1-CG 3.46Å; T258-Q261 PolarHBondContact OG1-N 3.32Å; T258-Q261 PolarHBondContact OG1-OE1 3Å; Q261-K263 VanDerWaalsContact C-N 3.34Å; Q261-K263 PolarHBondContact O-N 3.28Å; Q261-V264 PolarHBondContact O-N 2.86Å; Q261-W265 WeakPolarHBondContact O-CB 3.16Å; Q261-W265 PolarHBondContact O-N 3.42Å |
| 262 | V | 98.6 | Very high | 98.2 | Very high | 0 Ų | 0 | 64.6 Ų | 64.6 | 0% | 0 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -63.2 | -42.7 | 176.1 | -176.8 | 0 | 0 | 0 | 0 | 110.2 | L233 R248 L251 A252 L257 T258 V264 W265 F266 | L233-V262 HydrophobicContact CD2-CG1 4.02Å; L233-V262 HydrophobicContact CD2-CG2 4.33Å; R248-V262 HydrophobicContact CG-CB 3.81Å; R248-V262 HydrophobicContact CG-CG1 3.57Å; L251-V262 HydrophobicContact CD2-CG1 3.89Å; A252-V262 HydrophobicContact CB-CG2 3.85Å; L257-V262 HydrophobicContact CB-CG2 4.08Å; L257-V262 HydrophobicContact CD1-CG2 4.34Å; T258-V262 PolarHBondContact O-N 3.32Å; T258-V262 VanDerWaalsContact O-N 3.12Å; V262-V264 PolarHBondContact O-N 3.07Å; V262-W265 PolarHBondContact O-N 3.42Å; V262-F266 HydrophobicContact CG1-CD2 3.73Å; V262-F266 HydrophobicContact CG1-CE2 3.87Å; V262-F266 WeakPolarHBondContact O-CD2 3.38Å; V262-F266 PolarHBondContact O-N 3.14Å |
| 263 | K | 98.3 | Very high | 98.1 | Very high | 105 Ų | 105 | 69.2 Ų | 69.2 | 46% | 0.457 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -57.3 | -50.1 | 176.2 | -177.2 | -177.1 | 177.6 | -175 | 0 | 111.9 | D259 A260 Q261 F266 Q267 | D259-K263 WeakPolarHBondContact O-CB 3.14Å; D259-K263 PolarHBondContact O-N 3.07Å; A260-K263 WeakPolarHBondContact O-CB 3.46Å; A260-K263 PolarHBondContact O-N 3.1Å; Q261-K263 VanDerWaalsContact C-N 3.34Å; Q261-K263 PolarHBondContact O-N 3.28Å; K263-F266 PolarHBondContact O-N 3.37Å; K263-Q267 WeakPolarHBondContact O-CG 3.39Å; K263-Q267 PolarHBondContact O-N 2.96Å |
| 264 | V | 98.5 | Very high | 97.9 | Very high | 73 Ų | 73 | 69.6 Ų | 69.6 | 44% | 0.442 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -64.6 | -42.3 | 179.8 | 171.6 | 0 | 0 | 0 | 0 | 110.7 | A260 Q261 V262 F266 Q267 N268 | A260-V264 WeakPolarHBondContact O-CG2 3.45Å; A260-V264 PolarHBondContact O-N 2.9Å; Q261-V264 PolarHBondContact O-N 2.86Å; V262-V264 PolarHBondContact O-N 3.07Å; V264-F266 PolarHBondContact O-N 2.94Å; V264-Q267 WeakPolarHBondContact O-CB 3.47Å; V264-Q267 PolarHBondContact O-N 3.43Å; V264-N268 PolarHBondContact O-N 3.33Å |
| 265 | W | 98.5 | Very high | 97.7 | Very high | 31 Ų | 31 | 67.6 Ų | 67.6 | 12% | 0.117 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -61.3 | -45.9 | 177.7 | -170.9 | 94 | 0 | 0 | 0 | 111.7 | F225 L233 F237 Q261 V262 Q267 N268 R269 | F225-W265 AromaticContact CD2-CD1 3.73Å; F225-W265 HydrophobicContact CE2-CB 4.24Å; F225-W265 AromaticContact CE2-CD1 3.6Å; F225-W265 HydrophobicContact CE2-CG 4.24Å; L233-W265 HydrophobicContact CB-CD2 3.86Å; L233-W265 HydrophobicContact CB-CE3 3.79Å; L233-W265 HydrophobicContact CB-CH2 3.63Å; L233-W265 HydrophobicContact CB-CZ2 3.67Å; L233-W265 HydrophobicContact CB-CZ3 3.69Å; L233-W265 HydrophobicContact CD1-CB 4.4Å; L233-W265 HydrophobicContact CD1-CD2 3.75Å; L233-W265 HydrophobicContact CD1-CE3 4.37Å; L233-W265 HydrophobicContact CD1-CG 3.74Å; L233-W265 HydrophobicContact CD2-CD2 4.32Å; L233-W265 HydrophobicContact CD2-CE3 4.17Å; L233-W265 HydrophobicContact CG-CD2 4.18Å; L233-W265 HydrophobicContact CG-CE3 4.33Å; F237-W265 HydrophobicContact CB-CH2 4.25Å; F237-W265 HydrophobicContact CB-CZ3 4.03Å; F237-W265 HydrophobicContact CD2-CZ3 4.49Å; F237-W265 HydrophobicContact CG-CZ3 4.39Å; Q261-W265 WeakPolarHBondContact O-CB 3.16Å; Q261-W265 PolarHBondContact O-N 3.42Å; V262-W265 PolarHBondContact O-N 3.42Å; W265-Q267 VanDerWaalsContact C-N 3.32Å; W265-Q267 PolarHBondContact O-N 3.2Å; W265-N268 PolarHBondContact O-N 3.37Å; W265-R269 HydrophobicContact CE3-CB 4.04Å; W265-R269 HydrophobicContact CH2-CB 4.08Å; W265-R269 HydrophobicContact CH2-CG 3.71Å; W265-R269 HydrophobicContact CZ2-CG 4.38Å; W265-R269 HydrophobicContact CZ3-CB 3.8Å; W265-R269 HydrophobicContact CZ3-CG 3.8Å; W265-R269 VanDerWaalsContact O-CB 3.3Å; W265-R269 WeakPolarHBondContact O-CB 3.43Å; W265-R269 PolarHBondContact O-N 2.96Å |
| 266 | F | 98.7 | Very high | 97.2 | Very high | 8 Ų | 8 | 70.3 Ų | 70.3 | 4% | 0.035 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -65.1 | -32.7 | 176.8 | -92.1 | -96 | 0 | 0 | 0 | 113 | L233 R236 F237 V243 L251 V262 K263 V264 R270 | L233-F266 HydrophobicContact CD2-CE2 4.02Å; R236-F266 HydrophobicContact CB-CZ 4.3Å; R236-F266 HydrophobicContact CG-CZ 4.23Å; F237-F266 HydrophobicContact CB-CE1 4Å; F237-F266 HydrophobicContact CB-CZ 4.2Å; F237-F266 AromaticContact CD2-CD1 3.77Å; F237-F266 HydrophobicContact CD2-CD1 3.77Å; F237-F266 AromaticContact CD2-CE1 3.62Å; F237-F266 HydrophobicContact CD2-CE1 3.62Å; F237-F266 HydrophobicContact CE2-CD1 4.43Å; F237-F266 HydrophobicContact CG-CE1 4.32Å; V243-F266 HydrophobicContact CB-CD1 4.34Å; V243-F266 HydrophobicContact CB-CE1 4.23Å; V243-F266 HydrophobicContact CB-CZ 4.44Å; V243-F266 HydrophobicContact CG2-CD1 3.68Å; V243-F266 HydrophobicContact CG2-CD2 4.43Å; V243-F266 HydrophobicContact CG2-CE1 3.13Å; V243-F266 HydrophobicContact CG2-CE2 3.98Å; V243-F266 HydrophobicContact CG2-CG 4.31Å; V243-F266 HydrophobicContact CG2-CZ 3.32Å; L251-F266 HydrophobicContact CD2-CE2 3.78Å; L251-F266 HydrophobicContact CD2-CZ 4.21Å; V262-F266 HydrophobicContact CG1-CD2 3.73Å; V262-F266 HydrophobicContact CG1-CE2 3.87Å; V262-F266 WeakPolarHBondContact O-CD2 3.38Å; V262-F266 PolarHBondContact O-N 3.14Å; K263-F266 PolarHBondContact O-N 3.37Å; V264-F266 PolarHBondContact O-N 2.94Å; F266-R270 WeakPolarHBondContact O-CB 3.43Å; F266-R270 WeakPolarHBondContact O-CG 3.39Å; F266-R270 PolarHBondContact O-N 2.99Å; F266-R270 VanDerWaalsContact O-N 3.1Å; F266-R270 PolarHBondContact O-NE 3.31Å |
| 267 | Q | 98.5 | Very high | 96.4 | Very high | 80 Ų | 80 | 74.2 Ų | 74.2 | 37% | 0.374 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -64.3 | -54 | 171.6 | -74.2 | 174.4 | 2.2 | 0 | 0 | 110.7 | K263 V264 W265 R269 R270 M271 | K263-Q267 WeakPolarHBondContact O-CG 3.39Å; K263-Q267 PolarHBondContact O-N 2.96Å; V264-Q267 WeakPolarHBondContact O-CB 3.47Å; V264-Q267 PolarHBondContact O-N 3.43Å; W265-Q267 VanDerWaalsContact C-N 3.32Å; W265-Q267 PolarHBondContact O-N 3.2Å; Q267-R269 VanDerWaalsContact C-N 3.28Å; Q267-R269 PolarHBondContact O-N 3.37Å; Q267-R270 PolarHBondContact O-N 3.44Å; Q267-M271 WeakPolarHBondContact O-CG 3.44Å; Q267-M271 PolarHBondContact O-N 3.21Å |
| 268 | N | 98.1 | Very high | 95.4 | Very high | 99 Ų | 99 | 78.3 Ų | 78.3 | 53% | 0.529 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -58.8 | -41.2 | 179.4 | -69.2 | -13.9 | 0 | 0 | 0 | 111.8 | V264 W265 M271 K272 | V264-N268 PolarHBondContact O-N 3.33Å; W265-N268 PolarHBondContact O-N 3.37Å; N268-M271 PolarHBondContact O-N 3.28Å; N268-K272 PolarHBondContact O-N 3.42Å; N268-K272 VanDerWaalsContact O-N 3.13Å |
| 269 | R | 98.1 | Very high | 94.3 | Very high | 68 Ų | 68 | 77.2 Ų | 77.2 | 26% | 0.257 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -63.5 | -43.7 | 178.6 | -169.9 | 67.9 | -176.4 | 127.7 | -5.6 | 111.7 | E234 F237 W265 Q267 K272 W273 | E234-R269 VanDerWaalsContact CD-NE 3.3Å; E234-R269 VanDerWaalsContact CD-NH2 3.3Å; E234-R269 IonicContact OE1-CZ 3.31Å; E234-R269 IonicContact OE1-NE 2.9Å; E234-R269 PolarHBondContact OE1-NE 3.35Å; E234-R269 IonicContact OE1-NH2 2.68Å; E234-R269 PolarHBondContact OE1-NH2 3.3Å; E234-R269 IonicContact OE2-CZ 3.94Å; E234-R269 IonicContact OE2-NE 3.2Å; E234-R269 PolarHBondContact OE2-NE 2.99Å; E234-R269 IonicContact OE2-NH2 3.37Å; E234-R269 PolarHBondContact OE2-NH2 3.06Å; F237-R269 HydrophobicContact CD1-CG 3.61Å; F237-R269 HydrophobicContact CD2-CB 4.26Å; F237-R269 HydrophobicContact CD2-CG 3.74Å; F237-R269 HydrophobicContact CE1-CG 3.57Å; F237-R269 HydrophobicContact CE2-CB 4.1Å; F237-R269 HydrophobicContact CE2-CG 3.7Å; F237-R269 HydrophobicContact CG-CG 3.7Å; F237-R269 HydrophobicContact CZ-CB 4.34Å; F237-R269 HydrophobicContact CZ-CG 3.62Å; W265-R269 HydrophobicContact CE3-CB 4.04Å; W265-R269 HydrophobicContact CH2-CB 4.08Å; W265-R269 HydrophobicContact CH2-CG 3.71Å; W265-R269 HydrophobicContact CZ2-CG 4.38Å; W265-R269 HydrophobicContact CZ3-CB 3.8Å; W265-R269 HydrophobicContact CZ3-CG 3.8Å; W265-R269 VanDerWaalsContact O-CB 3.3Å; W265-R269 WeakPolarHBondContact O-CB 3.43Å; W265-R269 PolarHBondContact O-N 2.96Å; Q267-R269 VanDerWaalsContact C-N 3.28Å; Q267-R269 PolarHBondContact O-N 3.37Å; R269-K272 PolarHBondContact O-N 3.31Å; R269-W273 WeakPolarHBondContact O-CB 3.37Å; R269-W273 PolarHBondContact O-N 2.76Å |
| 270 | R | 98 | Very high | 93 | Very high | 64 Ų | 64 | 80 Ų | 80 | 24% | 0.242 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -63.6 | -39.3 | 175.3 | -77.5 | -172.8 | -70.5 | 140.9 | -4.1 | 112.9 | F237 K241 F266 Q267 W273 R274 | F237-R270 HydrophobicContact CE2-CG 3.75Å; F237-R270 HydrophobicContact CZ-CG 4.2Å; K241-R270 VanDerWaalsContact O-CD 3.27Å; K241-R270 WeakPolarHBondContact O-CD 3.41Å; K241-R270 WeakPolarHBondContact O-CG 3.48Å; F266-R270 WeakPolarHBondContact O-CB 3.43Å; F266-R270 WeakPolarHBondContact O-CG 3.39Å; F266-R270 PolarHBondContact O-N 2.99Å; F266-R270 VanDerWaalsContact O-N 3.1Å; F266-R270 PolarHBondContact O-NE 3.31Å; Q267-R270 PolarHBondContact O-N 3.44Å; R270-W273 PolarHBondContact O-N 3.39Å; R270-R274 PolarHBondContact O-N 3.02Å |
| 271 | M | 97.9 | Very high | 91.7 | Very high | 83 Ų | 83 | 79.9 Ų | 79.9 | 41% | 0.409 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -58.5 | -51.2 | 175.6 | -65.3 | -57.8 | -68.1 | 0 | 0 | 110.7 | Q267 N268 W273 R274 H275 | Q267-M271 WeakPolarHBondContact O-CG 3.44Å; Q267-M271 PolarHBondContact O-N 3.21Å; N268-M271 PolarHBondContact O-N 3.28Å; M271-W273 VanDerWaalsContact C-N 3.31Å; M271-W273 PolarHBondContact O-N 2.78Å; M271-R274 PolarHBondContact O-N 2.76Å; M271-R274 PolarHBondContact SD-NH2 2.9Å; M271-H275 PolarHBondContact O-CD2 2.97Å; M271-H275 PolarHBondContact O-N 3.4Å; M271-H275 VanDerWaalsContact O-N 3.14Å |
| 272 | K | 96.4 | Very high | 90 | Very high | 144 Ų | 144 | 83.7 Ų | 83.7 | 63% | 0.626 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -61.1 | -39.7 | 178.1 | -170.3 | 176.6 | 173.5 | -177.4 | 0 | 112.4 | N268 R269 S276 | N268-K272 PolarHBondContact O-N 3.42Å; N268-K272 VanDerWaalsContact O-N 3.13Å; R269-K272 PolarHBondContact O-N 3.31Å; K272-S276 PolarHBondContact O-N 3.12Å |
| 273 | W | 95.5 | Very high | 88.1 | Confident | 102 Ų | 102 | 90.6 Ų | 90.6 | 39% | 0.386 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -62.1 | -44 | 177.4 | 173.4 | 73.4 | 0 | 0 | 0 | 112.6 | F237 R269 R270 M271 S276 K277 | F237-W273 HydrophobicContact CE1-CB 4.37Å; F237-W273 HydrophobicContact CE1-CG 4.48Å; F237-W273 HydrophobicContact CZ-CB 4.11Å; F237-W273 HydrophobicContact CZ-CG 4.33Å; R269-W273 WeakPolarHBondContact O-CB 3.37Å; R269-W273 PolarHBondContact O-N 2.76Å; R270-W273 PolarHBondContact O-N 3.39Å; M271-W273 VanDerWaalsContact C-N 3.31Å; M271-W273 PolarHBondContact O-N 2.78Å; W273-S276 PolarHBondContact O-N 3.44Å; W273-K277 PolarHBondContact O-N 3.39Å |
| 274 | R | 95.7 | Very high | 86.3 | Confident | 90 Ų | 90 | 90.5 Ų | 90.5 | 34% | 0.34 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -64.4 | -46.2 | 177.1 | -70.3 | -169 | -56.3 | 99 | -1.8 | 112.3 | R270 M271 S276 K277 E278 | R270-R274 PolarHBondContact O-N 3.02Å; M271-R274 PolarHBondContact O-N 2.76Å; M271-R274 PolarHBondContact SD-NH2 2.9Å; R274-S276 VanDerWaalsContact C-N 3.27Å; R274-S276 PolarHBondContact O-N 3.41Å; R274-K277 PolarHBondContact O-N 3.44Å; R274-E278 IonicContact NH1-OE1 3.72Å; R274-E278 PolarHBondContact O-N 3.49Å; R274-E278 VanDerWaalsContact O-N 3.1Å |
| 275 | H | 92.6 | Very high | 84.3 | Confident | 99 Ų | 99 | 95.6 Ų | 95.6 | 46% | 0.458 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -61.5 | -35.8 | 178.7 | -67.5 | -46.7 | 0 | 0 | 0 | 112.8 | M271 K277 E278 A279 | M271-H275 PolarHBondContact O-CD2 2.97Å; M271-H275 PolarHBondContact O-N 3.4Å; M271-H275 VanDerWaalsContact O-N 3.14Å; H275-K277 VanDerWaalsContact C-N 3.31Å; H275-K277 PolarHBondContact O-N 2.88Å; H275-E278 IonicContact ND1-OE2 3.73Å; H275-A279 WeakPolarHBondContact O-CB 3.49Å; H275-A279 PolarHBondContact O-N 2.95Å; H275-A279 VanDerWaalsContact O-N 3.1Å |
| 276 | S | 88.4 | Confident | 82.2 | Confident | 84 Ų | 84 | 102.2 Ų | 102.2 | 59% | 0.587 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -66.2 | -33.1 | 175.7 | -163.2 | 0 | 0 | 0 | 0 | 112.8 | K272 W273 R274 Q280 | K272-S276 PolarHBondContact O-N 3.12Å; W273-S276 PolarHBondContact O-N 3.44Å; R274-S276 VanDerWaalsContact C-N 3.27Å; R274-S276 PolarHBondContact O-N 3.41Å; S276-Q280 PolarHBondContact O-N 3.29Å |
| 277 | K | 80.6 | Confident | 80.2 | Confident | 147 Ų | 147 | 110.9 Ų | 110.9 | 64% | 0.639 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -74.5 | -39.6 | 179.3 | -169.3 | 178.7 | 179.5 | -178.5 | 0 | 111.9 | W273 R274 H275 Q280 A281 | W273-K277 PolarHBondContact O-N 3.39Å; R274-K277 PolarHBondContact O-N 3.44Å; H275-K277 VanDerWaalsContact C-N 3.31Å; H275-K277 PolarHBondContact O-N 2.88Å; K277-Q280 PolarHBondContact O-N 2.68Å; K277-A281 PolarHBondContact O-N 3.44Å |
| 278 | E | 77.5 | Confident | 77.6 | Confident | 107 Ų | 107 | 115.5 Ų | 115.5 | 50% | 0.5 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -66.2 | -39.2 | 176.7 | -71.3 | 162.2 | -164.8 | 0 | 0 | 111.7 | R274 H275 Q280 A281 | R274-E278 IonicContact NH1-OE1 3.72Å; R274-E278 PolarHBondContact O-N 3.49Å; R274-E278 VanDerWaalsContact O-N 3.1Å; H275-E278 IonicContact ND1-OE2 3.73Å; E278-Q280 VanDerWaalsContact C-N 3.32Å; E278-Q280 PolarHBondContact O-N 3.26Å; E278-A281 PolarHBondContact O-N 3.33Å |
| 279 | A | 75.6 | Confident | 74.6 | Confident | 54 Ų | 54 | 116.6 Ų | 116.6 | 45% | 0.446 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -66.5 | -31.8 | 177 | 0 | 0 | 0 | 0 | 0 | 113.2 | H275 | H275-A279 WeakPolarHBondContact O-CB 3.49Å; H275-A279 PolarHBondContact O-N 2.95Å; H275-A279 VanDerWaalsContact O-N 3.1Å |
| 280 | Q | 71.3 | Confident | 72.3 | Confident | 108 Ų | 108 | 119.5 Ų | 119.5 | 51% | 0.505 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -72.8 | -39.3 | 178.3 | -166.9 | 65.6 | 24.7 | 0 | 0 | 111.7 | S276 K277 E278 Q282 K283 D284 | S276-Q280 PolarHBondContact O-N 3.29Å; K277-Q280 PolarHBondContact O-N 2.68Å; E278-Q280 VanDerWaalsContact C-N 3.32Å; E278-Q280 PolarHBondContact O-N 3.26Å; Q280-Q282 PolarHBondContact O-N 3.43Å; Q280-Q282 VanDerWaalsContact O-N 3.12Å; Q280-K283 PolarHBondContact O-N 2.92Å; Q280-D284 PolarHBondContact O-N 3.46Å |
| 281 | A | 69.7 | Low | 69.5 | Low | 61 Ų | 61 | 123.7 Ų | 123.7 | 50% | 0.504 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -64.1 | -17.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | K277 E278 | K277-A281 PolarHBondContact O-N 3.44Å; E278-A281 PolarHBondContact O-N 3.33Å |
| 282 | Q | 62.3 | Low | 67 | Low | 150 Ų | 150 | 129.1 Ų | 129.1 | 70% | 0.701 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -85.8 | -27.2 | 175 | -69.8 | -176.4 | -21.2 | 0 | 0 | 112.9 | Q280 | Q280-Q282 PolarHBondContact O-N 3.43Å; Q280-Q282 VanDerWaalsContact O-N 3.12Å |
| 283 | K | 60.8 | Low | 64 | Low | 145 Ų | 145 | 126.7 Ų | 126.7 | 63% | 0.63 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -75.8 | -27.9 | 178.2 | -72.9 | -168.9 | 171.1 | -169.2 | 0 | 113.2 | Q280 K285 | Q280-K283 PolarHBondContact O-N 2.92Å; K283-K285 VanDerWaalsContact C-N 3.26Å; K283-K285 PolarHBondContact O-N 3.07Å |
| 284 | D | 59.1 | Low | 61.4 | Low | 103 Ų | 103 | 129.4 Ų | 129.4 | 55% | 0.551 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.2 | -11.8 | 179.7 | -60.2 | -29.2 | 0 | 0 | 0 | 112.5 | Q280 | Q280-D284 PolarHBondContact O-N 3.46Š|
| 285 | K | 57.2 | Low | 58.4 | Low | 180 Ų | 180 | 130.1 Ų | 130.1 | 78% | 0.783 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.9 | -13.1 | 175.5 | -78.7 | -165.9 | 171.4 | -166.2 | 0 | 115.1 | K283 | K283-K285 VanDerWaalsContact C-N 3.26Å; K283-K285 PolarHBondContact O-N 3.07Å |
| 286 | E | 54.6 | Low | 55.8 | Low | 170 Ų | 170 | 133.8 Ų | 133.8 | 79% | 0.794 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -92.2 | 0.7 | 176.7 | -83 | -177.9 | 160.6 | 0 | 0 | 113.5 | ||
| 287 | K | 55.1 | Low | 53.4 | Low | 190 Ų | 190 | 134.3 Ų | 134.3 | 83% | 0.826 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -105.2 | -2.8 | 178.2 | -85.1 | -166.9 | 174.6 | -166.7 | 0 | 115.7 | ||
| 288 | E | 44.1 | Very low | 51.3 | Low | 177 Ų | 177 | 136 Ų | 136 | 83% | 0.827 | 71% | 0.71 | S | S | * | * | trans | -108.9 | 72 | 172.6 | -76 | -166.4 | 157.5 | 0 | 0 | 111.2 | ||||
| 289 | T | 36.9 | Very low | 49.1 | Very low | 122 Ų | 122 | 135.9 Ų | 135.9 | 75% | 0.748 | 72% | 0.721 | S | S | * | * | trans | -123.5 | 109.9 | 149.6 | 47.6 | 0 | 0 | 0 | 0 | 107.4 | D291 | T289-D291 PolarHBondContact O-N 3.3Š| ||
| 290 | P | 48.3 | Very low | 47.3 | Very low | 129 Ų | 129 | 142.8 Ų | 142.8 | 84% | 0.838 | 74% | 0.741 | S | S | * | * | trans | -82 | 101.7 | 172.4 | 31.9 | -25.1 | 0 | 0 | 0 | 106.6 | ||||
| 291 | D | 40.7 | Very low | 45.6 | Very low | 152 Ų | 152 | 146.2 Ų | 146.2 | 81% | 0.813 | 76% | 0.757 | S | S | * | * | trans | -98.7 | 124.5 | 167.7 | -138.6 | -20.6 | 0 | 0 | 0 | 110.6 | T289 | T289-D291 PolarHBondContact O-N 3.3Š| ||
| 292 | K | 44.6 | Very low | 44.7 | Very low | 198 Ų | 198 | 147.7 Ų | 147.7 | 86% | 0.861 | 76% | 0.761 | S | S | * | * | trans | -127.5 | 94.2 | -171 | -167.1 | -175.7 | -169.4 | -179.2 | 0 | 105.5 | ||||
| 293 | S | 34.3 | Very low | 43.4 | Very low | 92 Ų | 92 | 148.7 Ų | 148.7 | 64% | 0.643 | 77% | 0.766 | S | S | * | * | trans | -163.9 | 103.4 | 156.5 | 55 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 294 | L | 40.1 | Very low | 42.3 | Very low | 159 Ų | 159 | 149.5 Ų | 149.5 | 83% | 0.832 | 77% | 0.772 | S | S | * | * | 68.3 | 124.9 | 92 | -65.5 | 173.8 | 0 | 0 | 0 | 111.2 | |||||
| 295 | T | 33.2 | Very low | 41.2 | Very low | 105 Ų | 105 | 149.1 Ų | 149.1 | 64% | 0.644 | 78% | 0.778 | S | S | * | * | cis | -173.4 | 143.9 | 26.7 | 20.3 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 296 | E | 37 | Very low | 40 | Very low | 176 Ų | 176 | 149.4 Ų | 149.4 | 82% | 0.822 | 78% | 0.782 | S | S | * | * | trans | 52.9 | 119.7 | 136.1 | -70.7 | 169.6 | 117.1 | 0 | 0 | 124.4 | ||||
| 297 | A | 38.3 | Very low | 39 | Very low | 96 Ų | 96 | 146.4 Ų | 146.4 | 79% | 0.793 | 78% | 0.779 | S | S | * | * | -170.6 | 95.7 | 108.2 | 0 | 0 | 0 | 0 | 0 | 108.3 | |||||
| 298 | E | 37 | Very low | 38 | Very low | 183 Ų | 183 | 145.2 Ų | 145.2 | 86% | 0.855 | 78% | 0.776 | S | S | * | * | 54.2 | 109.3 | 104.5 | -148.1 | -170.5 | 109.2 | 0 | 0 | 113 | |||||
| 299 | S | 31.4 | Very low | 37.8 | Very low | 104 Ų | 104 | 141 Ų | 141 | 73% | 0.727 | 77% | 0.766 | S | S | * | * | -179.7 | 136.8 | 76.4 | 33.3 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 300 | K | 36.8 | Very low | 37.7 | Very low | 198 Ų | 198 | 143.9 Ų | 143.9 | 86% | 0.861 | 77% | 0.771 | S | S | * | * | 157.1 | 99.6 | 116.8 | -158.9 | 168.4 | -169.9 | -178 | 0 | 112.3 | |||||
| 301 | E | 37.2 | Very low | 37.2 | Very low | 180 Ų | 180 | 141.8 Ų | 141.8 | 84% | 0.841 | 76% | 0.764 | S | S | * | * | trans | 42.7 | 145.1 | 141.7 | -69.5 | -81 | 113 | 0 | 0 | 123.1 | ||||
| 302 | P | 50.7 | Low | 37.2 | Very low | 92 Ų | 92 | 139.6 Ų | 139.6 | 60% | 0.597 | 76% | 0.761 | S | S | * | * | trans | -99.5 | 168.1 | -173.3 | 41.3 | -32.3 | 0 | 0 | 0 | 113.1 | ||||
| 303 | E | 35 | Very low | 36.7 | Very low | 172 Ų | 172 | 139.1 Ų | 139.1 | 80% | 0.804 | 76% | 0.762 | S | S | * | * | -171.8 | 124.6 | 129.4 | -78.6 | -125.9 | 155.6 | 0 | 0 | 108.1 | |||||
| 304 | E | 36.2 | Very low | 36.8 | Very low | 162 Ų | 162 | 140.7 Ų | 140.7 | 76% | 0.757 | 77% | 0.773 | S | S | * | * | 39.5 | 132.1 | 109.6 | -31.7 | -71.6 | 140.8 | 0 | 0 | 112.7 | |||||
| 305 | S | 37.5 | Very low | 37.1 | Very low | 95 Ų | 95 | 140.2 Ų | 140.2 | 66% | 0.664 | 77% | 0.771 | S | S | * | * | cis | 178.2 | 157.3 | 27.7 | 53.2 | 0 | 0 | 0 | 0 | 108 | ||||
| 306 | E | 32.2 | Very low | 37.3 | Very low | 185 Ų | 185 | 144.8 Ų | 144.8 | 86% | 0.864 | 78% | 0.783 | S | S | * | * | trans | 80 | 125.2 | 149.6 | -68.3 | 174.6 | 174.3 | 0 | 0 | 122.4 | ||||
| 307 | C | 33 | Very low | 37.9 | Very low | 108 Ų | 108 | 145 Ų | 145 | 73% | 0.73 | 78% | 0.784 | S | S | * | * | trans | -27.8 | 143.7 | 145.1 | -163.3 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 308 | E | 34.2 | Very low | 38.1 | Very low | 164 Ų | 164 | 147.9 Ų | 147.9 | 77% | 0.766 | 79% | 0.785 | S | S | * | * | -165.9 | 157.7 | 73.8 | -52.8 | -137.2 | 126.7 | 0 | 0 | 111.2 | |||||
| 309 | S | 40 | Very low | 38.3 | Very low | 88 Ų | 88 | 142.9 Ų | 142.9 | 62% | 0.615 | 78% | 0.784 | S | S | * | * | trans | 28.8 | 139.9 | 147.1 | -45.1 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 310 | E | 35.3 | Very low | 38.8 | Very low | 183 Ų | 183 | 145.9 Ų | 145.9 | 86% | 0.855 | 79% | 0.786 | S | S | * | * | 176.4 | 161.2 | 60.7 | 36.1 | -125.4 | 133.2 | 0 | 0 | 113.5 | |||||
| 311 | A | 37.8 | Very low | 39.1 | Very low | 85 Ų | 85 | 144.5 Ų | 144.5 | 70% | 0.702 | 78% | 0.782 | S | S | * | * | trans | 85.1 | 105.2 | 148.5 | 0 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 312 | S | 39 | Very low | 39.2 | Very low | 107 Ų | 107 | 142.4 Ų | 142.4 | 75% | 0.748 | 78% | 0.777 | S | S | * | * | 64.8 | 137.5 | 124 | -55.6 | 0 | 0 | 0 | 0 | 118.5 | |||||
| 313 | E | 35.9 | Very low | 39.1 | Very low | 187 Ų | 187 | 146.3 Ų | 146.3 | 87% | 0.874 | 79% | 0.785 | S | S | * | * | cis | -168.6 | 124.7 | 34.6 | 34.6 | -150.4 | 86.9 | 0 | 0 | 109 | ||||
| 314 | S | 36 | Very low | 39.1 | Very low | 125 Ų | 125 | 143.9 Ų | 143.9 | 87% | 0.874 | 79% | 0.787 | S | S | * | * | trans | -119.3 | 111.4 | 167.8 | 60.3 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 315 | D | 45.7 | Very low | 39.5 | Very low | 149 Ų | 149 | 143.5 Ų | 143.5 | 80% | 0.797 | 79% | 0.79 | S | S | * | * | trans | -81 | 113.2 | 176.6 | -168.1 | -98.8 | 0 | 0 | 0 | 110 | ||||
| 316 | F | 38.1 | Very low | 39.9 | Very low | 202 Ų | 202 | 147.9 Ų | 147.9 | 89% | 0.886 | 80% | 0.802 | S | S | * | * | trans | -156.1 | 99.9 | 155.8 | -141.8 | -92.3 | 0 | 0 | 0 | 108.8 | D318 | F316-D318 PolarHBondContact O-N 3.37Š| ||
| 317 | E | 49.2 | Very low | 40.5 | Very low | 180 Ų | 180 | 146 Ų | 146 | 84% | 0.841 | 80% | 0.798 | S | S | * | * | trans | -69.4 | 116.6 | 171.8 | -74.7 | -172.9 | 115.2 | 0 | 0 | 110.4 | ||||
| 318 | D | 42.1 | Very low | 40.8 | Very low | 156 Ų | 156 | 148.9 Ų | 148.9 | 83% | 0.834 | 81% | 0.805 | S | S | * | * | trans | -88.3 | 122.8 | 155.5 | -175.4 | 65.2 | 0 | 0 | 0 | 107.4 | F316 | F316-D318 PolarHBondContact O-N 3.37Š| ||
| 319 | G | 40.3 | Very low | 41.2 | Very low | 79 Ų | 79 | 145.3 Ų | 145.3 | 81% | 0.814 | 80% | 0.797 | S | S | * | * | trans | -124.5 | 92.5 | -179.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 320 | Q | 43.3 | Very low | 41.3 | Very low | 167 Ų | 167 | 148.2 Ų | 148.2 | 78% | 0.78 | 80% | 0.801 | S | S | * | * | trans | -112.6 | 119.6 | 153.2 | -165.9 | 165.6 | -4.7 | 0 | 0 | 103.4 | ||||
| 321 | E | 42.6 | Very low | 41.6 | Very low | 168 Ų | 168 | 146.1 Ų | 146.1 | 79% | 0.785 | 79% | 0.791 | S | S | * | * | 178.8 | 140.4 | 79.3 | 46.6 | -161.7 | 131.5 | 0 | 0 | 109.5 | |||||
| 322 | D | 38.4 | Very low | 41.4 | Very low | 137 Ų | 137 | 149 Ų | 149 | 73% | 0.733 | 80% | 0.795 | S | S | * | * | -161.1 | 155.7 | 124.9 | -123.3 | -23.4 | 0 | 0 | 0 | 114.2 | |||||
| 323 | K | 48.7 | Very low | 41.7 | Very low | 173 Ų | 173 | 153.3 Ų | 153.3 | 75% | 0.752 | 80% | 0.8 | S | S | * | * | trans | -63 | 147.4 | -164 | -58.2 | 166.9 | -166.1 | 77 | 0 | 115.2 | ||||
| 324 | S | 35.9 | Very low | 41.9 | Very low | 121 Ų | 121 | 151.1 Ų | 151.1 | 85% | 0.846 | 80% | 0.8 | S | S | * | * | -155.6 | 134.4 | 125.6 | 40.8 | 0 | 0 | 0 | 0 | 111.7 | |||||
| 325 | D | 45 | Very low | 42.1 | Very low | 154 Ų | 154 | 150.4 Ų | 150.4 | 82% | 0.824 | 80% | 0.795 | S | S | * | * | trans | -45.9 | 142.1 | 171.6 | -74.9 | -78.8 | 0 | 0 | 0 | 114.9 | ||||
| 326 | M | 44.7 | Very low | 41.7 | Very low | 187 Ų | 187 | 150.1 Ų | 150.1 | 92% | 0.921 | 80% | 0.798 | S | S | * | * | trans | -161.3 | 121.6 | 132.1 | -152 | 87.7 | 93.6 | 0 | 0 | 110.5 | ||||
| 327 | D | 44.4 | Very low | 42.1 | Very low | 147 Ų | 147 | 147.8 Ų | 147.8 | 79% | 0.786 | 79% | 0.793 | S | S | * | * | trans | -44.9 | 141.1 | 171.1 | -100.8 | -62.6 | 0 | 0 | 0 | 115.3 | ||||
| 328 | I | 39.5 | Very low | 41.6 | Very low | 168 Ų | 168 | 147.5 Ų | 147.5 | 86% | 0.862 | 79% | 0.794 | S | S | * | * | -165.4 | 115.3 | 129.8 | -108.2 | 161.7 | 0 | 0 | 0 | 111.1 | |||||
| 329 | S | 44.1 | Very low | 41.4 | Very low | 88 Ų | 88 | 146.3 Ų | 146.3 | 62% | 0.615 | 79% | 0.793 | S | S | * | * | trans | -57.3 | 145.8 | 162.6 | 54.6 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 330 | E | 41.4 | Very low | 41 | Very low | 149 Ų | 149 | 146.5 Ų | 146.5 | 70% | 0.696 | 80% | 0.795 | S | S | * | * | 179.1 | 122.6 | 73.6 | -96.9 | -159.3 | 140.2 | 0 | 0 | 109.7 | |||||
| 331 | H | 42 | Very low | 40.7 | Very low | 139 Ų | 139 | 142.9 Ų | 142.9 | 64% | 0.644 | 79% | 0.793 | S | S | * | * | trans | 13.7 | 133.4 | 146.7 | 46.1 | 54.7 | 0 | 0 | 0 | 122.4 | ||||
| 332 | N | 32.7 | Very low | 40.6 | Very low | 145 Ų | 145 | 141.8 Ų | 141.8 | 78% | 0.775 | 79% | 0.791 | S | S | * | * | -177.4 | 117 | 126.3 | 45.2 | 12.4 | 0 | 0 | 0 | 113.1 | |||||
| 333 | K | 46.4 | Very low | 41.3 | Very low | 198 Ų | 198 | 141 Ų | 141 | 86% | 0.861 | 79% | 0.794 | S | S | * | * | trans | 172.3 | 114.3 | 133.9 | -93.4 | 157.6 | -170.4 | 179.9 | 0 | 111.8 | ||||
| 334 | T | 39.9 | Very low | 40.7 | Very low | 142 Ų | 142 | 138.3 Ų | 138.3 | 87% | 0.871 | 79% | 0.792 | S | S | * | * | trans | 177.7 | 109.9 | 140 | 25.8 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 335 | S | 40.6 | Very low | 40.7 | Very low | 110 Ų | 110 | 137.6 Ų | 137.6 | 77% | 0.769 | 79% | 0.787 | S | S | * | * | 48.2 | 116.2 | 99.3 | -165.7 | 0 | 0 | 0 | 0 | 115.2 | |||||
| 336 | V | 36.2 | Very low | 40.4 | Very low | 143 Ų | 143 | 136 Ų | 136 | 87% | 0.867 | 78% | 0.782 | S | S | * | * | trans | -176 | 141.8 | 133.2 | 151.2 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 337 | I | 47 | Very low | 40.3 | Very low | 153 Ų | 153 | 136.1 Ų | 136.1 | 79% | 0.785 | 78% | 0.781 | S | S | * | * | trans | -82.4 | 140.4 | -179.1 | -63.7 | 171.9 | 0 | 0 | 0 | 110.8 | ||||
| 338 | M | 38.1 | Very low | 40 | Very low | 174 Ų | 174 | 138.1 Ų | 138.1 | 86% | 0.857 | 79% | 0.785 | S | S | * | * | trans | -171.4 | 123.1 | 139.2 | -110.2 | -174.9 | -170.8 | 0 | 0 | 114 | ||||
| 339 | T | 37.3 | Very low | 40.2 | Very low | 131 Ų | 131 | 134.7 Ų | 134.7 | 80% | 0.804 | 78% | 0.782 | S | S | * | * | trans | 8.1 | 140.6 | 138.3 | 49.9 | 0 | 0 | 0 | 0 | 121 | ||||
| 340 | G | 33.1 | Very low | 39.9 | Very low | 83 Ų | 83 | 137.3 Ų | 137.3 | 86% | 0.856 | 79% | 0.789 | S | S | * | * | trans | 150.1 | 122.9 | 146.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 341 | A | 35.8 | Very low | 39.6 | Very low | 91 Ų | 91 | 134.7 Ų | 134.7 | 75% | 0.752 | 79% | 0.787 | S | S | * | * | trans | -79.8 | 146.2 | -171.7 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 342 | I | 41.3 | Very low | 39.8 | Very low | 145 Ų | 145 | 134 Ų | 134 | 74% | 0.744 | 79% | 0.792 | S | S | * | * | 37.2 | 128.3 | 124.8 | -56 | 177.6 | 0 | 0 | 0 | 117.9 | V344 | I342-V344 HydrophobicContact CG2-CG2 4.05Š| |||
| 343 | P | 52.7 | Low | 40.1 | Very low | 120 Ų | 120 | 132 Ų | 132 | 78% | 0.779 | 79% | 0.79 | S | S | * | * | -138.1 | 132.2 | 79.5 | 22.5 | 1 | 0 | 0 | 0 | 115.9 | |||||
| 344 | V | 36.7 | Very low | 39.8 | Very low | 117 Ų | 117 | 126.8 Ų | 126.8 | 71% | 0.709 | 78% | 0.784 | S | S | * | * | 69.7 | 111.5 | 94.6 | 174.8 | 0 | 0 | 0 | 0 | 115.6 | I342 | I342-V344 HydrophobicContact CG2-CG2 4.05Š| |||
| 345 | S | 36.3 | Very low | 39.8 | Very low | 106 Ų | 106 | 127.2 Ų | 127.2 | 74% | 0.741 | 78% | 0.78 | S | S | * | * | trans | -171.5 | 104.5 | 134.2 | -69.1 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 346 | T | 38.5 | Very low | 39.9 | Very low | 120 Ų | 120 | 127.2 Ų | 127.2 | 74% | 0.736 | 78% | 0.775 | S | S | * | * | 48.4 | 121.5 | 97 | 56 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 347 | E | 42.8 | Very low | 40 | Very low | 189 Ų | 189 | 129.1 Ų | 129.1 | 88% | 0.883 | 78% | 0.775 | S | S | * | * | cis | -158.2 | 174.5 | 44.4 | -73.9 | -169.3 | 150 | 0 | 0 | 113.9 | ||||
| 348 | E | 37.8 | Very low | 39.7 | Very low | 190 Ų | 190 | 126.4 Ų | 126.4 | 89% | 0.888 | 78% | 0.775 | S | S | * | * | trans | -58.8 | 153.7 | -170.9 | -57.1 | -168.9 | 116.2 | 0 | 0 | 119.8 | ||||
| 349 | A | 43.1 | Very low | 40.5 | Very low | 95 Ų | 95 | 124.7 Ų | 124.7 | 79% | 0.785 | 77% | 0.774 | S | S | * | * | 175.6 | 105 | 114 | 0 | 0 | 0 | 0 | 0 | 108.6 | |||||
| 350 | N | 37.8 | Very low | 41.6 | Very low | 144 Ų | 144 | 123.7 Ų | 123.7 | 77% | 0.77 | 77% | 0.77 | S | S | * | * | 91 | 110.2 | 88 | -160.6 | 26.4 | 0 | 0 | 0 | 113.6 | |||||
| 351 | S | 36.6 | Very low | 42 | Very low | 94 Ų | 94 | 125.2 Ų | 125.2 | 66% | 0.657 | 77% | 0.768 | S | S | * | * | trans | 58.2 | 139.4 | 141.8 | -64.2 | 0 | 0 | 0 | 0 | 119 | ||||
| 352 | V | 44.4 | Very low | 42.6 | Very low | 123 Ų | 123 | 126.1 Ų | 126.1 | 75% | 0.745 | 77% | 0.769 | S | S | * | * | cis | -173.2 | 154.4 | 21.9 | -113.4 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 353 | S | 40.1 | Very low | 42.9 | Very low | 103 Ų | 103 | 127.6 Ų | 127.6 | 72% | 0.72 | 77% | 0.772 | S | S | * | * | trans | 51.2 | 110.2 | 141.4 | -47.2 | 0 | 0 | 0 | 0 | 120 | ||||
| 354 | A | 39.9 | Very low | 42.8 | Very low | 89 Ų | 89 | 130 Ų | 130 | 74% | 0.736 | 78% | 0.775 | S | S | * | * | 67.8 | 126 | 82.1 | 0 | 0 | 0 | 0 | 0 | 115.6 | |||||
| 355 | L | 39.6 | Very low | 43.1 | Very low | 152 Ų | 152 | 132 Ų | 132 | 80% | 0.796 | 78% | 0.781 | S | S | * | * | trans | 86.4 | 120.4 | 150.8 | -67 | 158.2 | 0 | 0 | 0 | 119.9 | ||||
| 356 | T | 42.8 | Very low | 43.7 | Very low | 110 Ų | 110 | 138 Ų | 138 | 68% | 0.675 | 80% | 0.803 | S | S | * | * | 74.8 | 125.5 | 129.2 | 58.1 | 0 | 0 | 0 | 0 | 121.6 | |||||
| 357 | E | 38.5 | Very low | 44 | Very low | 182 Ų | 182 | 139 Ų | 139 | 85% | 0.85 | 81% | 0.806 | S | S | * | * | trans | 73.3 | 132.3 | 134.8 | -80.6 | -169.2 | 124.4 | 0 | 0 | 122.2 | ||||
| 358 | A | 41.2 | Very low | 44 | Very low | 96 Ų | 96 | 136.3 Ų | 136.3 | 79% | 0.793 | 80% | 0.802 | S | S | * | * | trans | 70.5 | 101.2 | 138.1 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 359 | V | 53.6 | Low | 44.4 | Very low | 138 Ų | 138 | 133.3 Ų | 133.3 | 84% | 0.836 | 80% | 0.797 | S | S | * | * | trans | -71.2 | 153.3 | 143.3 | 168.6 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 360 | P | 60.6 | Low | 44.5 | Very low | 111 Ų | 111 | 135.6 Ų | 135.6 | 72% | 0.721 | 80% | 0.798 | S | S | * | * | cis | -139.4 | 157.1 | 26.7 | 17.5 | 10 | 0 | 0 | 0 | 119 | ||||
| 361 | S | 42.1 | Very low | 44.9 | Very low | 115 Ų | 115 | 135.1 Ų | 135.1 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | 37.2 | 108.8 | 119.2 | -136.4 | 0 | 0 | 0 | 0 | 120.1 | |||||
| 362 | S | 48 | Very low | 45.4 | Very low | 110 Ų | 110 | 137.8 Ų | 137.8 | 77% | 0.769 | 81% | 0.809 | S | S | * | * | trans | -160.4 | 106.5 | 144.3 | -81.5 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 363 | Q | 48.2 | Very low | 45.5 | Very low | 176 Ų | 176 | 138.9 Ų | 138.9 | 82% | 0.822 | 81% | 0.813 | S | S | * | * | 67.5 | 117.6 | 107.1 | -79.4 | -159.6 | 63.5 | 0 | 0 | 116.4 | |||||
| 364 | M | 49.6 | Very low | 45.9 | Very low | 171 Ų | 171 | 141.6 Ų | 141.6 | 84% | 0.842 | 82% | 0.821 | S | S | * | * | trans | 42 | 120.1 | 140.3 | -81.7 | -159 | 161.7 | 0 | 0 | 119.6 | ||||
| 365 | L | 43.4 | Very low | 46.4 | Very low | 159 Ų | 159 | 146 Ų | 146 | 83% | 0.832 | 83% | 0.828 | S | S | * | * | -172.1 | 127.2 | 115.7 | -105 | 150.2 | 0 | 0 | 0 | 111.9 | |||||
| 366 | I | 49.2 | Very low | 47 | Very low | 232 Ų | 232 | 145.5 Ų | 145.5 | 100% | 1.19 | 83% | 0.831 | S | S | * | * | trans | 73.5 | 0 | 158.6 | -40 | -179.5 | 0 | 0 | 0 | 117.9 |
Retrieved 366 of 366 residues in 669.5 ms
(Link to these results)