| 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 | 35.7 | Very low | 39.7 | Very low | 237 Ų | 237 | 141.9 Ų | 141.9 | 100% | 1.167 | 83% | 0.825 | S | S | * | * | 0 | 105.5 | 0 | -63.5 | 173.8 | 176.8 | 0 | 0 | 104.6 | |||||
| 2 | A | 34.5 | Very low | 40.8 | Very low | 92 Ų | 92 | 143.4 Ų | 143.4 | 76% | 0.76 | 83% | 0.826 | S | S | * | * | 63.7 | 121.4 | 79.8 | 0 | 0 | 0 | 0 | 0 | 109 | |||||
| 3 | S | 39.2 | Very low | 41.4 | Very low | 95 Ų | 95 | 140.8 Ų | 140.8 | 66% | 0.664 | 82% | 0.818 | S | S | * | * | cis | -165.7 | 165.8 | 31.9 | -84.5 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 4 | E | 40 | Very low | 42.4 | Very low | 158 Ų | 158 | 141.3 Ų | 141.3 | 74% | 0.738 | 82% | 0.824 | S | S | * | * | cis | -162.7 | 174 | -1.6 | -119.8 | 160.9 | 77.7 | 0 | 0 | 114.5 | ||||
| 5 | L | 44.6 | Very low | 42.5 | Very low | 152 Ų | 152 | 136.1 Ų | 136.1 | 80% | 0.796 | 80% | 0.799 | S | S | * | * | trans | -2.6 | 134.2 | 148.7 | -67.1 | 161 | 0 | 0 | 0 | 121 | ||||
| 6 | A | 37.8 | Very low | 43.2 | Very low | 94 Ų | 94 | 135 Ų | 135 | 78% | 0.777 | 80% | 0.797 | S | S | * | * | 170.6 | 113 | 104.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 7 | M | 35.3 | Very low | 43.5 | Very low | 190 Ų | 190 | 135.1 Ų | 135.1 | 94% | 0.936 | 79% | 0.792 | S | S | * | * | trans | -139.3 | 137.7 | 143.8 | -71.4 | -150.3 | 88.1 | 0 | 0 | 108.7 | ||||
| 8 | S | 38.4 | Very low | 44 | Very low | 109 Ų | 109 | 130.6 Ų | 130.6 | 76% | 0.762 | 77% | 0.773 | S | S | * | * | trans | -80.5 | 131.5 | -163 | 35.6 | 0 | 0 | 0 | 0 | 114.1 | S10 | S8-S10 PolarHBondContact O-N 3.09Š| ||
| 9 | N | 44.4 | Very low | 44.3 | Very low | 172 Ų | 172 | 131.4 Ų | 131.4 | 92% | 0.92 | 77% | 0.77 | S | S | * | * | trans | -75.6 | 94.4 | 160.1 | -87.2 | -24.9 | 0 | 0 | 0 | 109.9 | ||||
| 10 | S | 46.9 | Very low | 44.6 | Very low | 95 Ų | 95 | 132.4 Ų | 132.4 | 66% | 0.664 | 77% | 0.767 | S | S | * | * | trans | -153.7 | 106 | 160.7 | -59.3 | 0 | 0 | 0 | 0 | 108.7 | S8 | S8-S10 PolarHBondContact O-N 3.09Š| ||
| 11 | D | 39.5 | Very low | 44.8 | Very low | 167 Ų | 167 | 136.3 Ų | 136.3 | 89% | 0.893 | 77% | 0.77 | S | S | * | * | trans | 170.7 | 75.7 | 142.6 | -85.6 | -20.5 | 0 | 0 | 0 | 109.7 | ||||
| 12 | L | 53.5 | Low | 45.5 | Very low | 160 Ų | 160 | 130.3 Ų | 130.3 | 84% | 0.838 | 75% | 0.747 | S | S | * | * | trans | -77.2 | 126.8 | 163.2 | -78.8 | 153.9 | 0 | 0 | 0 | 108.2 | T14 | L12-T14 PolarHBondContact O-N 3.07Š| ||
| 13 | P | 48.4 | Very low | 46.2 | Very low | 110 Ų | 110 | 132 Ų | 132 | 71% | 0.714 | 74% | 0.743 | S | S | * | * | trans | -69.2 | 108.2 | 175.4 | 26.5 | -32.6 | 0 | 0 | 0 | 110.8 | S15 | P13-S15 PolarHBondContact O-N 3.29Š| ||
| 14 | T | 55.5 | Low | 46.7 | Very low | 147 Ų | 147 | 134.8 Ų | 134.8 | 90% | 0.902 | 75% | 0.751 | S | S | * | * | trans | -74.4 | 66.1 | 177.3 | -27 | 0 | 0 | 0 | 0 | 111.5 | L12 | L12-T14 PolarHBondContact O-N 3.07Š| ||
| 15 | S | 43.3 | Very low | 46.9 | Very low | 64 Ų | 64 | 135.3 Ų | 135.3 | 45% | 0.448 | 75% | 0.751 | S | S | . | * | trans | -122 | 116 | 179.9 | -174 | 0 | 0 | 0 | 0 | 111.8 | P13 L17 A18 | P13-S15 PolarHBondContact O-N 3.29Å; S15-L17 PolarHBondContact O-N 3.42Å; S15-L17 VanDerWaalsContact O-N 3.13Å; S15-A18 PolarHBondContact O-N 2.96Å; S15-A18 VanDerWaalsContact O-N 3.13Å | ||
| 16 | P | 54 | Low | 47.4 | Very low | 118 Ų | 118 | 132.7 Ų | 132.7 | 77% | 0.766 | 74% | 0.737 | S | S | * | * | G | 310 helix | trans | -60 | -24.5 | -175.7 | -26.8 | 35.5 | 0 | 0 | 0 | 115.5 | A18 | P16-A18 VanDerWaalsContact C-N 3.35Š|
| 17 | L | 48.9 | Very low | 48.3 | Very low | 137 Ų | 137 | 135.1 Ų | 135.1 | 72% | 0.717 | 74% | 0.736 | S | S | * | * | G | 310 helix | trans | -77.9 | -15.4 | 179.5 | -77.1 | 115.5 | 0 | 0 | 0 | 114.1 | S15 M19 | S15-L17 PolarHBondContact O-N 3.42Å; S15-L17 VanDerWaalsContact O-N 3.13Å; L17-M19 VanDerWaalsContact C-N 3.34Å |
| 18 | A | 52.2 | Low | 49.1 | Very low | 54 Ų | 54 | 134.4 Ų | 134.4 | 45% | 0.446 | 73% | 0.733 | S | S | . | * | G | 310 helix | trans | -78 | -17.6 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | S15 P16 V22 | S15-A18 PolarHBondContact O-N 2.96Å; S15-A18 VanDerWaalsContact O-N 3.13Å; P16-A18 VanDerWaalsContact C-N 3.35Å; A18-V22 WeakPolarHBondContact O-CG2 3.43Å |
| 19 | M | 49 | Very low | 50 | Low | 146 Ų | 146 | 137 Ų | 137 | 72% | 0.719 | 73% | 0.731 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.3 | -21.4 | -176 | -151.7 | -167.9 | -62.6 | 0 | 0 | 113.5 | L17 N23 | L17-M19 VanDerWaalsContact C-N 3.34Å; M19-N23 PolarHBondContact O-ND2 3.22Å; M19-N23 VanDerWaalsContact O-ND2 3.13Å |
| 20 | E | 50.8 | Low | 49.8 | Very low | 151 Ų | 151 | 137.2 Ų | 137.2 | 71% | 0.706 | 72% | 0.724 | S | S | * | * | G | 310 helix | trans | -72.8 | -38.9 | -179.8 | -164.6 | 167.2 | -164.1 | 0 | 0 | 111.4 | V22 | E20-V22 VanDerWaalsContact C-N 3.29Å; E20-V22 PolarHBondContact O-N 3.06Å |
| 21 | Y | 49.5 | Very low | 49.6 | Very low | 214 Ų | 214 | 141.8 Ų | 141.8 | 84% | 0.839 | 74% | 0.735 | S | S | * | * | G | 310 helix | trans | -75.5 | -6.8 | -177.4 | -111.7 | -91 | 0 | 0 | 0 | 115.9 | ||
| 22 | V | 50.7 | Low | 49.9 | Very low | 111 Ų | 111 | 139.9 Ų | 139.9 | 67% | 0.673 | 73% | 0.729 | S | S | * | * | G | 310 helix | trans | -95.9 | -14 | -176.9 | -177.1 | 0 | 0 | 0 | 0 | 112.2 | A18 E20 | A18-V22 WeakPolarHBondContact O-CG2 3.43Å; E20-V22 VanDerWaalsContact C-N 3.29Å; E20-V22 PolarHBondContact O-N 3.06Å |
| 23 | N | 48.9 | Very low | 49.4 | Very low | 129 Ų | 129 | 141.5 Ų | 141.5 | 69% | 0.69 | 73% | 0.729 | S | S | * | * | S | Bend | trans | -86.8 | -20.7 | -177.3 | -77.9 | -72.5 | 0 | 0 | 0 | 114.6 | M19 | M19-N23 PolarHBondContact O-ND2 3.22Å; M19-N23 VanDerWaalsContact O-ND2 3.13Å |
| 24 | D | 48.1 | Very low | 49.2 | Very low | 153 Ų | 153 | 145.8 Ų | 145.8 | 82% | 0.818 | 74% | 0.736 | S | S | * | * | trans | -90.1 | 4.4 | -175.3 | -87.7 | 5.6 | 0 | 0 | 0 | 114.6 | D26 | D24-D26 VanDerWaalsContact C-N 3.31Å; D24-D26 PolarHBondContact O-N 3.45Å | ||
| 25 | F | 46 | Very low | 48.3 | Very low | 169 Ų | 169 | 147.6 Ų | 147.6 | 74% | 0.741 | 73% | 0.734 | S | S | * | * | trans | -80.6 | 80 | 172.5 | -140.3 | -86.5 | 0 | 0 | 0 | 110.3 | L27 | F25-L27 VanDerWaalsContact C-N 3.3Å; F25-L27 HydrophobicContact CD1-CG 4.36Å; F25-L27 PolarHBondContact O-N 3.46Å | ||
| 26 | D | 54.5 | Low | 48.1 | Very low | 96 Ų | 96 | 150.3 Ų | 150.3 | 51% | 0.513 | 75% | 0.751 | S | S | . | * | trans | -65 | 82.9 | -178.4 | -175.3 | 16.4 | 0 | 0 | 0 | 112.7 | D24 M28 | D24-D26 VanDerWaalsContact C-N 3.31Å; D24-D26 PolarHBondContact O-N 3.45Å; D26-M28 PolarHBondContact O-N 3.31Å; D26-M28 VanDerWaalsContact O-N 3.15Å; D26-M28 VanDerWaalsContact OD1-CB 3.29Å; D26-M28 WeakPolarHBondContact OD1-CB 3.38Å; D26-M28 PolarHBondContact OD1-N 3.31Å | ||
| 27 | L | 56.9 | Low | 47.5 | Very low | 145 Ų | 145 | 150.7 Ų | 150.7 | 76% | 0.759 | 75% | 0.751 | S | S | * | * | G | 310 helix | trans | -65.3 | -7.2 | 175.9 | -81.5 | 134.6 | 0 | 0 | 0 | 113.5 | F25 K29 | F25-L27 VanDerWaalsContact C-N 3.3Å; F25-L27 HydrophobicContact CD1-CG 4.36Å; F25-L27 PolarHBondContact O-N 3.46Å; L27-K29 VanDerWaalsContact C-N 3.26Å; L27-K29 PolarHBondContact O-N 3.13Å |
| 28 | M | 51.8 | Low | 46.8 | Very low | 175 Ų | 175 | 152.2 Ų | 152.2 | 86% | 0.862 | 75% | 0.754 | S | S | * | * | G | 310 helix | trans | -79.6 | -3.5 | -179.5 | -62.4 | -90.4 | -79.7 | 0 | 0 | 113.4 | D26 | D26-M28 PolarHBondContact O-N 3.31Å; D26-M28 VanDerWaalsContact O-N 3.15Å; D26-M28 VanDerWaalsContact OD1-CB 3.29Å; D26-M28 WeakPolarHBondContact OD1-CB 3.38Å; D26-M28 PolarHBondContact OD1-N 3.31Å |
| 29 | K | 56.3 | Low | 46.3 | Very low | 165 Ų | 165 | 154.6 Ų | 154.6 | 72% | 0.717 | 77% | 0.765 | S | S | * | * | G | 310 helix | trans | -108.3 | 3.5 | -170.5 | -146 | 173.6 | -177.8 | 176.9 | 0 | 116.6 | L27 | L27-K29 VanDerWaalsContact C-N 3.26Å; L27-K29 PolarHBondContact O-N 3.13Å |
| 30 | F | 41.6 | Very low | 45.9 | Very low | 175 Ų | 175 | 155.1 Ų | 155.1 | 77% | 0.768 | 77% | 0.77 | S | S | * | * | trans | -122.8 | 83.8 | 174.5 | -70.6 | -80.1 | 0 | 0 | 0 | 111.6 | V32 | F30-V32 PolarHBondContact O-N 3.5Š| ||
| 31 | E | 43.1 | Very low | 45.1 | Very low | 192 Ų | 192 | 159.6 Ų | 159.6 | 90% | 0.897 | 78% | 0.781 | S | S | * | * | trans | -64.5 | 86.3 | 161.3 | -76.6 | -166 | 138.9 | 0 | 0 | 109.9 | K33 | E31-K33 PolarHBondContact O-N 3.39Š| ||
| 32 | V | 45.1 | Very low | 44.4 | Very low | 127 Ų | 127 | 156.9 Ų | 156.9 | 77% | 0.77 | 78% | 0.781 | S | S | * | * | trans | -73.4 | 84 | 166.9 | -177.5 | 0 | 0 | 0 | 0 | 108 | F30 K34 | F30-V32 PolarHBondContact O-N 3.5Å; V32-K34 PolarHBondContact O-N 3Å | ||
| 33 | K | 42.3 | Very low | 43.6 | Very low | 194 Ų | 194 | 158.7 Ų | 158.7 | 84% | 0.843 | 79% | 0.785 | S | S | * | * | trans | -67.6 | 99.6 | 176.2 | -170.8 | 166.2 | -175.9 | 168 | 0 | 109.9 | E31 E35 | E31-K33 PolarHBondContact O-N 3.39Å; K33-E35 PolarHBondContact O-N 3.44Å | ||
| 34 | K | 45.6 | Very low | 42.9 | Very low | 199 Ų | 199 | 157.7 Ų | 157.7 | 87% | 0.865 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 125.7 | 169.9 | -83.3 | -177.6 | 170.2 | -179.9 | 0 | 110.5 | V32 | V32-K34 PolarHBondContact O-N 3Š|
| 35 | E | 35.6 | Very low | 42.1 | Very low | 185 Ų | 185 | 159.3 Ų | 159.3 | 86% | 0.864 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -96.9 | 148.5 | 153.2 | -103.3 | -165.2 | 144.2 | 0 | 0 | 110 | K33 | K33-E35 PolarHBondContact O-N 3.44Š|
| 36 | P | 39.7 | Very low | 41.5 | Very low | 121 Ų | 121 | 156.8 Ų | 156.8 | 79% | 0.786 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -80.6 | 142.6 | 176.9 | 32.6 | -32.9 | 0 | 0 | 0 | 112.2 | ||
| 37 | V | 41.8 | Very low | 40.5 | Very low | 127 Ų | 127 | 158 Ų | 158 | 77% | 0.77 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 140 | 164.5 | 159.8 | 0 | 0 | 0 | 0 | 110 | ||
| 38 | E | 33.8 | Very low | 39.4 | Very low | 169 Ų | 169 | 161.9 Ų | 161.9 | 79% | 0.79 | 81% | 0.813 | S | S | * | * | trans | -162.8 | 164 | 148.5 | -93.2 | -40.9 | 88.8 | 0 | 0 | 109.3 | ||||
| 39 | P | 41.7 | Very low | 38.7 | Very low | 103 Ų | 103 | 160.2 Ų | 160.2 | 67% | 0.669 | 81% | 0.807 | S | S | * | * | -114 | 176.4 | -129.8 | 41.9 | -39.1 | 0 | 0 | 0 | 118.2 | |||||
| 40 | D | 39.7 | Very low | 37.8 | Very low | 157 Ų | 157 | 159.6 Ų | 159.6 | 84% | 0.84 | 81% | 0.81 | S | S | * | * | trans | -21.2 | 126.6 | 172.7 | -83 | -68.3 | 0 | 0 | 0 | 118.5 | ||||
| 41 | R | 35.4 | Very low | 37.4 | Very low | 246 Ų | 246 | 156 Ų | 156 | 93% | 0.928 | 81% | 0.813 | S | S | * | * | trans | -143.7 | 137 | 138.2 | -71.5 | -158.2 | 174.1 | -174.3 | -1.7 | 113.4 | ||||
| 42 | N | 33.8 | Very low | 36.8 | Very low | 156 Ų | 156 | 151 Ų | 151 | 83% | 0.834 | 81% | 0.813 | S | S | * | * | trans | -84.6 | 173.7 | 173.9 | -161.7 | -37.5 | 0 | 0 | 0 | 110.6 | ||||
| 43 | I | 34.8 | Very low | 36.2 | Very low | 150 Ų | 150 | 148.9 Ų | 148.9 | 77% | 0.769 | 82% | 0.817 | S | S | * | * | trans | 103.2 | 122.8 | 163 | -55.8 | 162.1 | 0 | 0 | 0 | 117.7 | ||||
| 44 | S | 33 | Very low | 35.9 | Very low | 107 Ų | 107 | 145.2 Ų | 145.2 | 75% | 0.748 | 82% | 0.815 | S | S | * | * | trans | -17.4 | 147.2 | 158.6 | -49.3 | 0 | 0 | 0 | 0 | 120 | ||||
| 45 | Q | 32.8 | Very low | 35.6 | Very low | 188 Ų | 188 | 144.4 Ų | 144.4 | 88% | 0.879 | 82% | 0.82 | S | S | * | * | 153.7 | 142.9 | 105.1 | -169.6 | 162.6 | 8.7 | 0 | 0 | 112.2 | |||||
| 46 | C | 32.3 | Very low | 35.6 | Very low | 115 Ų | 115 | 141.1 Ų | 141.1 | 78% | 0.777 | 82% | 0.817 | S | S | * | * | trans | -70.1 | 132.5 | 173 | -58.3 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 47 | S | 33.9 | Very low | 35.5 | Very low | 122 Ų | 122 | 140.8 Ų | 140.8 | 85% | 0.853 | 82% | 0.818 | S | S | * | * | 179.9 | 134 | 121.5 | -81.5 | 0 | 0 | 0 | 0 | 115.5 | |||||
| 48 | R | 33.5 | Very low | 35.7 | Very low | 226 Ų | 226 | 141.1 Ų | 141.1 | 85% | 0.853 | 82% | 0.82 | S | S | * | * | trans | -26.7 | 130.7 | 160.1 | -154.9 | -170.6 | -58.4 | -118.4 | 2.4 | 116.5 | ||||
| 49 | L | 37 | Very low | 36.5 | Very low | 140 Ų | 140 | 139.2 Ų | 139.2 | 73% | 0.733 | 82% | 0.823 | S | S | * | * | 168.1 | 127.3 | 111 | -86.7 | 172 | 0 | 0 | 0 | 115.2 | |||||
| 50 | I | 37.4 | Very low | 36.4 | Very low | 153 Ų | 153 | 142.6 Ų | 142.6 | 79% | 0.785 | 83% | 0.831 | S | S | * | * | trans | 30.2 | 120.1 | 140.5 | -55.1 | 177.2 | 0 | 0 | 0 | 120.4 | ||||
| 51 | A | 32.9 | Very low | 36.6 | Very low | 99 Ų | 99 | 139.9 Ų | 139.9 | 82% | 0.818 | 83% | 0.825 | S | S | * | * | -168.9 | 122.2 | 123.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 52 | G | 31.3 | Very low | 36.9 | Very low | 87 Ų | 87 | 134.7 Ų | 134.7 | 90% | 0.897 | 82% | 0.821 | S | S | * | * | trans | 49.5 | 120.3 | 143.3 | 0 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 53 | G | 31.7 | Very low | 37.4 | Very low | 83 Ų | 83 | 132.6 Ų | 132.6 | 86% | 0.856 | 82% | 0.816 | S | S | * | * | trans | 152.4 | 86.8 | 157.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 54 | S | 36.3 | Very low | 37.7 | Very low | 116 Ų | 116 | 132.3 Ų | 132.3 | 81% | 0.811 | 83% | 0.825 | S | S | * | * | trans | -87.4 | 131.5 | 178.9 | -56.4 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 55 | L | 38.2 | Very low | 38.3 | Very low | 182 Ų | 182 | 132.1 Ų | 132.1 | 95% | 0.953 | 82% | 0.824 | S | S | * | * | trans | -137.5 | 125.2 | 143.1 | -71.5 | 178.5 | 0 | 0 | 0 | 108.4 | ||||
| 56 | S | 36.8 | Very low | 38.6 | Very low | 117 Ų | 117 | 128.9 Ų | 128.9 | 82% | 0.818 | 82% | 0.822 | S | S | * | * | trans | -113.4 | 120.9 | -171.6 | 174.2 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 57 | S | 37.1 | Very low | 39.4 | Very low | 114 Ų | 114 | 129.7 Ų | 129.7 | 80% | 0.797 | 82% | 0.823 | S | S | * | * | trans | -164.2 | 70.8 | 169.2 | 43.4 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 58 | T | 46.3 | Very low | 40.1 | Very low | 133 Ų | 133 | 128.7 Ų | 128.7 | 82% | 0.816 | 81% | 0.814 | S | S | * | * | trans | -107.9 | 120.8 | 164 | 32.4 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 59 | P | 50.7 | Low | 40.6 | Very low | 130 Ų | 130 | 124 Ų | 124 | 84% | 0.844 | 81% | 0.812 | S | S | * | * | trans | -77.7 | 168.8 | 176.1 | 31.8 | -34.3 | 0 | 0 | 0 | 112.7 | ||||
| 60 | M | 40.2 | Very low | 40.8 | Very low | 173 Ų | 173 | 122.3 Ų | 122.3 | 85% | 0.852 | 81% | 0.813 | S | S | * | * | trans | -88.2 | 123.2 | -160.9 | -165.3 | 155.1 | 54.7 | 0 | 0 | 113.2 | ||||
| 61 | S | 42.8 | Very low | 41.1 | Very low | 101 Ų | 101 | 120.5 Ų | 120.5 | 71% | 0.706 | 81% | 0.811 | S | S | * | * | trans | 40.9 | 124.4 | 149.7 | 62 | 0 | 0 | 0 | 0 | 122 | ||||
| 62 | T | 41.6 | Very low | 41.6 | Very low | 136 Ų | 136 | 120.8 Ų | 120.8 | 83% | 0.834 | 81% | 0.807 | S | S | * | * | trans | -151 | 135.5 | 143.2 | -44.9 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 63 | P | 45.7 | Very low | 42 | Very low | 113 Ų | 113 | 126.2 Ų | 126.2 | 73% | 0.734 | 81% | 0.806 | S | S | * | * | trans | -83.1 | 133.7 | -174.8 | 31.6 | -34.5 | 0 | 0 | 0 | 113.1 | S65 | P63-S65 PolarHBondContact O-N 2.97Š| ||
| 64 | C | 41 | Very low | 42.4 | Very low | 143 Ų | 143 | 127 Ų | 127 | 97% | 0.966 | 80% | 0.798 | S | S | * | * | trans | -72.8 | 91.1 | 169.2 | -81.9 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 65 | S | 45.5 | Very low | 42.5 | Very low | 104 Ų | 104 | 125.3 Ų | 125.3 | 73% | 0.727 | 79% | 0.792 | S | S | * | * | trans | -131.8 | 71.6 | 168.7 | 179 | 0 | 0 | 0 | 0 | 110.3 | P63 | P63-S65 PolarHBondContact O-N 2.97Š| ||
| 66 | S | 39.3 | Very low | 42.7 | Very low | 120 Ų | 120 | 122.9 Ų | 122.9 | 84% | 0.839 | 79% | 0.787 | S | S | * | * | trans | -125.6 | 69.9 | 175.8 | -56.1 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 67 | V | 47.5 | Very low | 42.8 | Very low | 131 Ų | 131 | 122.4 Ų | 122.4 | 79% | 0.794 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -78.1 | 121.1 | 160 | -178.6 | 0 | 0 | 0 | 0 | 106.2 | ||
| 68 | P | 48.9 | Very low | 43.3 | Very low | 102 Ų | 102 | 123.7 Ų | 123.7 | 66% | 0.662 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 145.5 | 176.5 | 26.8 | -33.7 | 0 | 0 | 0 | 109.9 | S70 | P68-S70 PolarHBondContact O-N 3.25Š|
| 69 | P | 44.2 | Very low | 43.4 | Very low | 126 Ų | 126 | 121 Ų | 121 | 82% | 0.818 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 134.3 | 177.7 | 25.1 | -33.4 | 0 | 0 | 0 | 110.1 | ||
| 70 | S | 41.3 | Very low | 42.8 | Very low | 105 Ų | 105 | 120.8 Ų | 120.8 | 73% | 0.734 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 145.8 | 178 | -53.3 | 0 | 0 | 0 | 0 | 110.8 | P68 S72 | P68-S70 PolarHBondContact O-N 3.25Å; S70-S72 PolarHBondContact O-N 3.3Å |
| 71 | P | 44.3 | Very low | 43.2 | Very low | 115 Ų | 115 | 115.3 Ų | 115.3 | 75% | 0.747 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 128.7 | -179.6 | 24.9 | -34 | 0 | 0 | 0 | 110.7 | F73 | P71-F73 PolarHBondContact O-N 2.85Š|
| 72 | S | 42.8 | Very low | 43.5 | Very low | 106 Ų | 106 | 116.1 Ų | 116.1 | 74% | 0.741 | 78% | 0.784 | S | S | * | * | trans | -80.8 | 97.6 | 179.5 | -172.9 | 0 | 0 | 0 | 0 | 110 | S70 S74 | S70-S72 PolarHBondContact O-N 3.3Å; S72-S74 PolarHBondContact O-N 3.46Å | ||
| 73 | F | 40.1 | Very low | 43.3 | Very low | 200 Ų | 200 | 117.5 Ų | 117.5 | 88% | 0.877 | 78% | 0.781 | S | S | * | * | trans | -72.2 | 77.4 | 173.6 | -113.7 | -88.8 | 0 | 0 | 0 | 111.2 | P71 A75 | P71-F73 PolarHBondContact O-N 2.85Å; F73-A75 PolarHBondContact O-N 3.29Å | ||
| 74 | S | 39.7 | Very low | 43.2 | Very low | 99 Ų | 99 | 121.8 Ų | 121.8 | 69% | 0.692 | 79% | 0.791 | S | S | * | * | trans | -81 | 106.7 | 164.7 | -67.9 | 0 | 0 | 0 | 0 | 108.7 | S72 | S72-S74 PolarHBondContact O-N 3.46Š| ||
| 75 | A | 39.4 | Very low | 43.5 | Very low | 82 Ų | 82 | 124.1 Ų | 124.1 | 68% | 0.678 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 137.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | F73 S77 | F73-A75 PolarHBondContact O-N 3.29Å; A75-S77 PolarHBondContact O-N 2.61Å |
| 76 | P | 41.4 | Very low | 43.4 | Very low | 130 Ų | 130 | 123.8 Ų | 123.8 | 84% | 0.844 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 122.3 | 176.4 | 10.5 | -4.4 | 0 | 0 | 0 | 109.8 | ||
| 77 | S | 39.7 | Very low | 43.6 | Very low | 108 Ų | 108 | 124.6 Ų | 124.6 | 76% | 0.755 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -73.1 | 142.5 | 164.5 | -67.3 | 0 | 0 | 0 | 0 | 109.2 | A75 G79 | A75-S77 PolarHBondContact O-N 2.61Å; S77-G79 PolarHBondContact O-N 2.75Å |
| 78 | P | 46.7 | Very low | 43.7 | Very low | 140 Ų | 140 | 125.3 Ų | 125.3 | 91% | 0.909 | 77% | 0.766 | S | S | * | * | S | Bend | trans | -75.4 | 103.4 | -174.1 | 30 | -33.9 | 0 | 0 | 0 | 110.5 | ||
| 79 | G | 48.9 | Very low | 43.9 | Very low | 78 Ų | 78 | 128.1 Ų | 128.1 | 80% | 0.804 | 77% | 0.771 | S | S | * | * | trans | 137.3 | 67.8 | 167.9 | 0 | 0 | 0 | 0 | 0 | 116.5 | S77 | S77-G79 PolarHBondContact O-N 2.75Š| ||
| 80 | S | 37.5 | Very low | 44.2 | Very low | 124 Ų | 124 | 127.6 Ų | 127.6 | 87% | 0.867 | 76% | 0.761 | S | S | * | * | trans | -161.6 | 151.2 | 136.7 | -166.1 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 81 | G | 48.8 | Very low | 44.5 | Very low | 59 Ų | 59 | 127.8 Ų | 127.8 | 61% | 0.608 | 75% | 0.749 | S | S | * | * | trans | -81.6 | 177.7 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 82 | S | 49.5 | Very low | 45 | Very low | 118 Ų | 118 | 132 Ų | 132 | 83% | 0.825 | 75% | 0.751 | S | S | * | * | trans | 61.7 | 109.2 | 176.5 | 67.4 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 83 | E | 38.1 | Very low | 45.6 | Very low | 165 Ų | 165 | 135.3 Ų | 135.3 | 77% | 0.771 | 75% | 0.747 | S | S | * | * | trans | -175.1 | 104.8 | 131.7 | -104.1 | 166.4 | -171.1 | 0 | 0 | 110.7 | K85 | E83-K85 VanDerWaalsContact C-N 3.32Š| ||
| 84 | Q | 43.2 | Very low | 46 | Very low | 203 Ų | 203 | 130 Ų | 130 | 95% | 0.949 | 73% | 0.726 | S | S | * | * | trans | -91.8 | 14.1 | 173.7 | -76 | -176.3 | -32 | 0 | 0 | 112.9 | ||||
| 85 | K | 46.1 | Very low | 46.7 | Very low | 192 Ų | 192 | 129.3 Ų | 129.3 | 84% | 0.835 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -109.7 | 23 | -166.6 | -152.5 | 179.9 | 173 | 179.3 | 0 | 114.6 | E83 | E83-K85 VanDerWaalsContact C-N 3.32Š|
| 86 | T | 44.4 | Very low | 47.1 | Very low | 96 Ų | 96 | 128.6 Ų | 128.6 | 59% | 0.589 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -119 | -10.6 | 179.5 | 42.5 | 0 | 0 | 0 | 0 | 113.9 | ||
| 87 | H | 43.8 | Very low | 47.2 | Very low | 137 Ų | 137 | 131.8 Ų | 131.8 | 63% | 0.634 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86 | -8.7 | -172.2 | -166.1 | -85.9 | 0 | 0 | 0 | 115.2 | F91 | H87-F91 AromaticContact CE1-CE2 3.66Š|
| 88 | I | 48.6 | Very low | 47.4 | Very low | 146 Ų | 146 | 133.7 Ų | 133.7 | 75% | 0.749 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.9 | -31.1 | -174.1 | -154.9 | 94.6 | 0 | 0 | 0 | 113 | ||
| 89 | E | 52.8 | Low | 47.3 | Very low | 162 Ų | 162 | 136.1 Ų | 136.1 | 76% | 0.757 | 72% | 0.715 | S | S | * | * | G | 310 helix | trans | -82.4 | -30 | -172.5 | -61.1 | -173.3 | 172.2 | 0 | 0 | 112.4 | F91 Y92 | E89-F91 PolarHBondContact O-N 2.76Å; E89-F91 VanDerWaalsContact O-N 3.12Å; E89-Y92 PolarHBondContact O-N 3.19Å; E89-Y92 VanDerWaalsContact O-N 3.13Å |
| 90 | D | 50.5 | Low | 47.1 | Very low | 114 Ų | 114 | 141.3 Ų | 141.3 | 61% | 0.61 | 72% | 0.718 | S | S | * | * | G | 310 helix | trans | -65.4 | -12.1 | 178.3 | -79.8 | -25.9 | 0 | 0 | 0 | 114.3 | W93 | D90-W93 PolarHBondContact O-NE1 3.17Š|
| 91 | F | 48.7 | Very low | 47.4 | Very low | 110 Ų | 110 | 141.7 Ų | 141.7 | 48% | 0.482 | 71% | 0.71 | S | S | . | * | G | 310 helix | trans | -88 | -17.3 | 175.2 | -91.2 | -101.5 | 0 | 0 | 0 | 113.8 | H87 E89 W93 M94 | H87-F91 AromaticContact CE1-CE2 3.66Å; E89-F91 PolarHBondContact O-N 2.76Å; E89-F91 VanDerWaalsContact O-N 3.12Å; F91-W93 VanDerWaalsContact C-N 3.29Å; F91-W93 PolarHBondContact O-N 3.12Å; F91-M94 HydrophobicContact CD1-CE 3.45Å; F91-M94 VanDerWaalsContact CD1-CE 3.45Å; F91-M94 HydrophobicContact CE1-CE 3.34Å; F91-M94 HydrophobicContact CG-CE 4.34Å; F91-M94 HydrophobicContact CZ-CE 4.14Å; F91-M94 PolarHBondContact O-N 3.45Å; F91-M94 VanDerWaalsContact O-N 3.11Å |
| 92 | Y | 55 | Low | 46.9 | Very low | 202 Ų | 202 | 143.9 Ų | 143.9 | 79% | 0.792 | 71% | 0.708 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.5 | -28.9 | -169.2 | -156.4 | -95.4 | 0 | 0 | 0 | 113.4 | E89 | E89-Y92 PolarHBondContact O-N 3.19Å; E89-Y92 VanDerWaalsContact O-N 3.13Å |
| 93 | W | 54.5 | Low | 46.8 | Very low | 176 Ų | 176 | 144.1 Ų | 144.1 | 67% | 0.667 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76 | -20.3 | 177.4 | 69.5 | -92.5 | 0 | 0 | 0 | 113.7 | D90 F91 | D90-W93 PolarHBondContact O-NE1 3.17Å; F91-W93 VanDerWaalsContact C-N 3.29Å; F91-W93 PolarHBondContact O-N 3.12Å |
| 94 | M | 49.1 | Very low | 47.1 | Very low | 89 Ų | 89 | 144.6 Ų | 144.6 | 44% | 0.438 | 71% | 0.708 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -76.4 | -32.3 | 176.3 | -66.2 | -153 | -55.5 | 0 | 0 | 112.4 | F91 G96 Y97 | F91-M94 HydrophobicContact CD1-CE 3.45Å; F91-M94 VanDerWaalsContact CD1-CE 3.45Å; F91-M94 HydrophobicContact CE1-CE 3.34Å; F91-M94 HydrophobicContact CG-CE 4.34Å; F91-M94 HydrophobicContact CZ-CE 4.14Å; F91-M94 PolarHBondContact O-N 3.45Å; F91-M94 VanDerWaalsContact O-N 3.11Å; M94-G96 PolarHBondContact O-N 2.96Å; M94-Y97 PolarHBondContact O-N 3.31Å |
| 95 | S | 53.1 | Low | 47.3 | Very low | 85 Ų | 85 | 138.4 Ų | 138.4 | 59% | 0.594 | 69% | 0.692 | S | S | * | * | G | 310 helix | trans | -63.3 | -23 | -178.6 | -59.6 | 0 | 0 | 0 | 0 | 114 | Y97 | S95-Y97 VanDerWaalsContact C-N 3.33Å; S95-Y97 PolarHBondContact O-N 2.97Å |
| 96 | G | 49.4 | Very low | 47.7 | Very low | 66 Ų | 66 | 135.6 Ų | 135.6 | 68% | 0.68 | 69% | 0.686 | S | S | * | * | G | 310 helix | trans | -70.8 | -21.1 | -179.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | M94 | M94-G96 PolarHBondContact O-N 2.96Š|
| 97 | Y | 43.8 | Very low | 47.9 | Very low | 197 Ų | 197 | 135 Ų | 135 | 77% | 0.773 | 70% | 0.698 | S | S | * | * | G | 310 helix | trans | -96.4 | -12.1 | -176.9 | -77.9 | -82 | 0 | 0 | 0 | 114.2 | M94 S95 | M94-Y97 PolarHBondContact O-N 3.31Å; S95-Y97 VanDerWaalsContact C-N 3.33Å; S95-Y97 PolarHBondContact O-N 2.97Å |
| 98 | Q | 42 | Very low | 48.3 | Very low | 149 Ų | 149 | 136 Ų | 136 | 70% | 0.696 | 70% | 0.701 | S | S | * | * | G | 310 helix | trans | -80.3 | -20.1 | -171.7 | -132.3 | -95.3 | -46 | 0 | 0 | 113.2 | Q100 | Q98-Q100 PolarHBondContact O-N 3.35Š|
| 99 | Q | 44.4 | Very low | 49.3 | Very low | 191 Ų | 191 | 131.7 Ų | 131.7 | 89% | 0.893 | 68% | 0.684 | S | S | * | * | G | 310 helix | trans | -87.1 | 1.6 | -171.2 | -150.7 | 170.3 | 90 | 0 | 0 | 114.7 | ||
| 100 | Q | 45.9 | Very low | 49.6 | Very low | 187 Ų | 187 | 128.6 Ų | 128.6 | 87% | 0.874 | 68% | 0.678 | S | S | * | * | G | 310 helix | trans | -121.4 | 26.1 | -178.3 | -147 | 176.9 | 28.5 | 0 | 0 | 113.9 | Q98 | Q98-Q100 PolarHBondContact O-N 3.35Š|
| 101 | L | 42.9 | Very low | 50.5 | Low | 132 Ų | 132 | 129 Ų | 129 | 69% | 0.691 | 68% | 0.676 | S | S | * | * | trans | -101.8 | 116.1 | 167.5 | -68.6 | 175.7 | 0 | 0 | 0 | 109.6 | P103 | L101-P103 WeakPolarHBondContact O-CD 3.44Š| ||
| 102 | N | 39.5 | Very low | 51.4 | Low | 105 Ų | 105 | 127.3 Ų | 127.3 | 56% | 0.561 | 67% | 0.672 | S | S | * | * | trans | -64.7 | 119 | 173.8 | -180 | 11 | 0 | 0 | 0 | 109.3 | E104 A105 | N102-E104 PolarHBondContact O-N 3.4Å; N102-E104 VanDerWaalsContact O-N 3.12Å; N102-E104 PolarHBondContact OD1-N 3.02Å; N102-A105 HydrophobicContact CB-CB 4.33Å; N102-A105 WeakPolarHBondContact O-CB 3.23Å; N102-A105 PolarHBondContact O-N 3.35Å; N102-A105 VanDerWaalsContact O-N 3.08Å | ||
| 103 | P | 47.6 | Very low | 52 | Low | 123 Ų | 123 | 120.8 Ų | 120.8 | 80% | 0.799 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.4 | -17.2 | -174.8 | 24.9 | -34.4 | 0 | 0 | 0 | 114.1 | L101 | L101-P103 WeakPolarHBondContact O-CD 3.44Š|
| 104 | E | 42.8 | Very low | 52.8 | Low | 174 Ų | 174 | 116.2 Ų | 116.2 | 81% | 0.813 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.2 | -2.2 | 176.4 | -60.3 | -164.1 | 128.6 | 0 | 0 | 114.3 | N102 | N102-E104 PolarHBondContact O-N 3.4Å; N102-E104 VanDerWaalsContact O-N 3.12Å; N102-E104 PolarHBondContact OD1-N 3.02Å |
| 105 | A | 47.8 | Very low | 53.7 | Low | 73 Ų | 73 | 118.6 Ų | 118.6 | 60% | 0.603 | 66% | 0.661 | S | S | * | * | S | Bend | trans | -84.4 | -11.2 | -173.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | N102 | N102-A105 HydrophobicContact CB-CB 4.33Å; N102-A105 WeakPolarHBondContact O-CB 3.23Å; N102-A105 PolarHBondContact O-N 3.35Å; N102-A105 VanDerWaalsContact O-N 3.08Å |
| 106 | L | 55.5 | Low | 54.3 | Low | 134 Ų | 134 | 117.2 Ų | 117.2 | 70% | 0.702 | 66% | 0.655 | S | S | * | * | S | Bend | trans | -131 | 91.3 | 178.9 | -66.4 | 174.2 | 0 | 0 | 0 | 108.6 | F108 | L106-F108 PolarHBondContact O-N 2.79Š|
| 107 | G | 48.4 | Very low | 55.4 | Low | 82 Ų | 82 | 119.8 Ų | 119.8 | 85% | 0.845 | 65% | 0.653 | S | S | * | * | trans | -72.7 | 63.1 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 108 | F | 51.9 | Low | 56.4 | Low | 158 Ų | 158 | 115 Ų | 115 | 69% | 0.693 | 64% | 0.639 | S | S | * | * | trans | -122 | 131.5 | 168.1 | -73.8 | -75.4 | 0 | 0 | 0 | 108.3 | L106 D112 | L106-F108 PolarHBondContact O-N 2.79Å; F108-D112 HydrophobicContact CB-CB 4.4Å; F108-D112 HydrophobicContact CD1-CB 4.03Å | ||
| 109 | S | 69.5 | Low | 57 | Low | 57 Ų | 57 | 113.8 Ų | 113.8 | 40% | 0.399 | 64% | 0.637 | S | S | . | * | trans | -69.5 | 151 | 173.3 | -148.9 | 0 | 0 | 0 | 0 | 109.4 | E111 D112 | S109-E111 VanDerWaalsContact CB-OE2 3.26Å; S109-E111 WeakPolarHBondContact CB-OE2 3.36Å; S109-E111 PolarHBondContact O-N 3.26Å; S109-E111 PolarHBondContact OG-OE2 3.06Å; S109-D112 PolarHBondContact N-OD2 3.33Å; S109-D112 WeakPolarHBondContact O-CB 3.29Å; S109-D112 PolarHBondContact O-N 2.91Å | ||
| 110 | P | 60 | Low | 57.4 | Low | 97 Ų | 97 | 108.2 Ų | 108.2 | 63% | 0.63 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -50.6 | -30.5 | 172.8 | -29.1 | 36.8 | 0 | 0 | 0 | 113.4 | V114 | P110-V114 WeakPolarHBondContact O-CG2 3.36Å |
| 111 | E | 68.8 | Low | 57.4 | Low | 121 Ų | 121 | 102.7 Ų | 102.7 | 57% | 0.565 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -66.4 | -40.8 | 176 | -63.2 | 70 | -153.1 | 0 | 0 | 113 | S109 A113 V114 E115 | S109-E111 VanDerWaalsContact CB-OE2 3.26Å; S109-E111 WeakPolarHBondContact CB-OE2 3.36Å; S109-E111 PolarHBondContact O-N 3.26Å; S109-E111 PolarHBondContact OG-OE2 3.06Å; E111-A113 VanDerWaalsContact C-N 3.3Å; E111-A113 PolarHBondContact O-N 3.31Å; E111-V114 WeakPolarHBondContact O-CB 3.37Å; E111-V114 PolarHBondContact O-N 2.78Å; E111-V114 VanDerWaalsContact O-N 3.12Å; E111-E115 PolarHBondContact O-N 2.66Å |
| 112 | D | 68 | Low | 57.7 | Low | 76 Ų | 76 | 103.5 Ų | 103.5 | 41% | 0.406 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -64.3 | -37.1 | -179.4 | -59.9 | -42.1 | 0 | 0 | 0 | 111.6 | F108 S109 V114 E115 A116 | F108-D112 HydrophobicContact CB-CB 4.4Å; F108-D112 HydrophobicContact CD1-CB 4.03Å; S109-D112 PolarHBondContact N-OD2 3.33Å; S109-D112 WeakPolarHBondContact O-CB 3.29Å; S109-D112 PolarHBondContact O-N 2.91Å; D112-V114 VanDerWaalsContact C-N 3.28Å; D112-V114 PolarHBondContact O-N 3.18Å; D112-E115 PolarHBondContact O-N 3.25Å; D112-A116 PolarHBondContact O-N 2.96Å |
| 113 | A | 66.9 | Low | 58 | Low | 64 Ų | 64 | 106.9 Ų | 106.9 | 53% | 0.529 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -67.4 | -29.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | E111 L117 | E111-A113 VanDerWaalsContact C-N 3.3Å; E111-A113 PolarHBondContact O-N 3.31Å; A113-L117 PolarHBondContact O-N 2.82Å |
| 114 | V | 71.7 | Confident | 57.8 | Low | 80 Ų | 80 | 108.2 Ų | 108.2 | 49% | 0.485 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -74.7 | -41.8 | 177 | 173.3 | 0 | 0 | 0 | 0 | 111 | P110 E111 D112 A116 L117 I118 | P110-V114 WeakPolarHBondContact O-CG2 3.36Å; E111-V114 WeakPolarHBondContact O-CB 3.37Å; E111-V114 PolarHBondContact O-N 2.78Å; E111-V114 VanDerWaalsContact O-N 3.12Å; D112-V114 VanDerWaalsContact C-N 3.28Å; D112-V114 PolarHBondContact O-N 3.18Å; V114-A116 VanDerWaalsContact C-N 3.34Å; V114-A116 PolarHBondContact O-N 3.4Å; V114-L117 PolarHBondContact O-N 3.25Å; V114-I118 HydrophobicContact CG1-CD1 3.83Å; V114-I118 HydrophobicContact CG1-CG1 4.48Å; V114-I118 WeakPolarHBondContact O-CG1 3.41Å; V114-I118 PolarHBondContact O-N 2.75Å |
| 115 | E | 67.7 | Low | 57.9 | Low | 139 Ų | 139 | 108.7 Ų | 108.7 | 65% | 0.65 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -61.1 | -40.9 | 175.4 | -70.2 | -157.9 | 153.9 | 0 | 0 | 112.5 | E111 D112 L117 I118 N119 | E111-E115 PolarHBondContact O-N 2.66Å; D112-E115 PolarHBondContact O-N 3.25Å; E115-L117 VanDerWaalsContact C-N 3.3Å; E115-L117 PolarHBondContact O-N 2.91Å; E115-I118 PolarHBondContact O-N 2.79Å; E115-N119 PolarHBondContact O-N 2.78Å |
| 116 | A | 65.9 | Low | 57.5 | Low | 57 Ų | 57 | 110.7 Ų | 110.7 | 47% | 0.471 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -60.8 | -37.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | D112 V114 S120 | D112-A116 PolarHBondContact O-N 2.96Å; V114-A116 VanDerWaalsContact C-N 3.34Å; V114-A116 PolarHBondContact O-N 3.4Å; A116-S120 WeakPolarHBondContact O-CB 3.38Å; A116-S120 PolarHBondContact O-N 3.36Å; A116-S120 PolarHBondContact O-OG 3.05Å |
| 117 | L | 71.6 | Confident | 56.4 | Low | 120 Ų | 120 | 113 Ų | 113 | 63% | 0.628 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -72.5 | -37.7 | 178.4 | -172.3 | 65.3 | 0 | 0 | 0 | 112.4 | A113 V114 E115 S120 S121 | A113-L117 PolarHBondContact O-N 2.82Å; V114-L117 PolarHBondContact O-N 3.25Å; E115-L117 VanDerWaalsContact C-N 3.3Å; E115-L117 PolarHBondContact O-N 2.91Å; L117-S120 PolarHBondContact O-N 3.15Å; L117-S121 PolarHBondContact O-N 2.9Å; L117-S121 PolarHBondContact O-OG 3.45Å; L117-S121 VanDerWaalsContact O-OG 3.1Å |
| 118 | I | 65.3 | Low | 56 | Low | 96 Ų | 96 | 117.2 Ų | 117.2 | 49% | 0.492 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -66.3 | -48.2 | 176.9 | -68.1 | 168.1 | 0 | 0 | 0 | 110.2 | V114 E115 S120 S121 | V114-I118 HydrophobicContact CG1-CD1 3.83Å; V114-I118 HydrophobicContact CG1-CG1 4.48Å; V114-I118 WeakPolarHBondContact O-CG1 3.41Å; V114-I118 PolarHBondContact O-N 2.75Å; E115-I118 PolarHBondContact O-N 2.79Å; I118-S120 VanDerWaalsContact C-N 3.27Å; I118-S120 PolarHBondContact O-N 3.27Å; I118-S121 WeakPolarHBondContact O-CB 3.42Å; I118-S121 PolarHBondContact O-N 3.44Å; I118-S121 VanDerWaalsContact O-N 3.12Å |
| 119 | N | 54.8 | Low | 55.3 | Low | 123 Ų | 123 | 112.5 Ų | 112.5 | 66% | 0.658 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -60.9 | -34.8 | 176.5 | -87.8 | 6.7 | 0 | 0 | 0 | 113 | E115 S121 H122 | E115-N119 PolarHBondContact O-N 2.78Å; N119-S121 VanDerWaalsContact C-N 3.29Å; N119-S121 PolarHBondContact O-N 2.76Å; N119-H122 PolarHBondContact O-N 2.9Å |
| 120 | S | 52.4 | Low | 54 | Low | 74 Ų | 74 | 120 Ų | 120 | 52% | 0.517 | 65% | 0.651 | S | S | . | * | H | α-helix | trans | -67.3 | -28 | 177.8 | -60.5 | 0 | 0 | 0 | 0 | 113.2 | A116 L117 I118 H122 | A116-S120 WeakPolarHBondContact O-CB 3.38Å; A116-S120 PolarHBondContact O-N 3.36Å; A116-S120 PolarHBondContact O-OG 3.05Å; L117-S120 PolarHBondContact O-N 3.15Å; I118-S120 VanDerWaalsContact C-N 3.27Å; I118-S120 PolarHBondContact O-N 3.27Å; S120-H122 VanDerWaalsContact C-N 3.27Å; S120-H122 PolarHBondContact O-N 3.33Å |
| 121 | S | 46.8 | Very low | 52.8 | Low | 71 Ų | 71 | 120.6 Ų | 120.6 | 50% | 0.497 | 66% | 0.663 | S | S | . | * | H | α-helix | trans | -70.5 | -20 | -177.8 | -63.1 | 0 | 0 | 0 | 0 | 113.7 | L117 I118 N119 | L117-S121 PolarHBondContact O-N 2.9Å; L117-S121 PolarHBondContact O-OG 3.45Å; L117-S121 VanDerWaalsContact O-OG 3.1Å; I118-S121 WeakPolarHBondContact O-CB 3.42Å; I118-S121 PolarHBondContact O-N 3.44Å; I118-S121 VanDerWaalsContact O-N 3.12Å; N119-S121 VanDerWaalsContact C-N 3.29Å; N119-S121 PolarHBondContact O-N 2.76Å |
| 122 | H | 48.1 | Very low | 51.4 | Low | 150 Ų | 150 | 126.7 Ų | 126.7 | 69% | 0.694 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78 | -16.2 | -179.2 | -71.1 | -66.3 | 0 | 0 | 0 | 114.6 | N119 S120 | N119-H122 PolarHBondContact O-N 2.9Å; S120-H122 VanDerWaalsContact C-N 3.27Å; S120-H122 PolarHBondContact O-N 3.33Å |
| 123 | Q | 46.7 | Very low | 49.6 | Very low | 176 Ų | 176 | 126.6 Ų | 126.6 | 82% | 0.822 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.7 | -14.9 | 178.5 | -78.4 | -171.2 | -11.6 | 0 | 0 | 114.6 | ||
| 124 | L | 42.8 | Very low | 48.1 | Very low | 150 Ų | 150 | 133 Ų | 133 | 79% | 0.785 | 72% | 0.717 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.1 | -2.4 | -169.9 | -93.3 | 163 | 0 | 0 | 0 | 115.9 | ||
| 125 | Q | 45 | Very low | 46.3 | Very low | 184 Ų | 184 | 136.9 Ų | 136.9 | 86% | 0.86 | 73% | 0.73 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.3 | 7.1 | -176.7 | -69.7 | -168 | -11 | 0 | 0 | 115.7 | ||
| 126 | S | 40 | Very low | 44.6 | Very low | 115 Ų | 115 | 138.7 Ų | 138.7 | 80% | 0.804 | 74% | 0.736 | S | S | * | * | S | Bend | trans | -118.3 | 12.3 | -173 | -76.6 | 0 | 0 | 0 | 0 | 116.7 | ||
| 127 | F | 32.8 | Very low | 43 | Very low | 184 Ų | 184 | 142.7 Ų | 142.7 | 81% | 0.807 | 76% | 0.755 | S | S | * | * | trans | -121.4 | 47.8 | -174.6 | -156.5 | -99.3 | 0 | 0 | 0 | 115.1 | ||||
| 128 | D | 39.2 | Very low | 41 | Very low | 170 Ų | 170 | 140.4 Ų | 140.4 | 91% | 0.909 | 76% | 0.76 | S | S | * | * | trans | -127.5 | 30.9 | 178.7 | -133.7 | -19 | 0 | 0 | 0 | 113.3 | ||||
| 129 | G | 38.3 | Very low | 39.4 | Very low | 59 Ų | 59 | 141.2 Ų | 141.2 | 61% | 0.608 | 78% | 0.781 | S | S | * | * | S | Bend | trans | -104.3 | -18.8 | -165.2 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||
| 130 | Y | 40.5 | Very low | 38.4 | Very low | 215 Ų | 215 | 140.5 Ų | 140.5 | 84% | 0.843 | 79% | 0.792 | S | S | * | * | S | Bend | trans | -122.6 | 12.9 | -157.6 | -60.9 | -71.1 | 0 | 0 | 0 | 116.8 | ||
| 131 | A | 36.1 | Very low | 37.4 | Very low | 108 Ų | 108 | 140.7 Ų | 140.7 | 89% | 0.893 | 81% | 0.806 | S | S | * | * | S | Bend | trans | -98.4 | 24.2 | -176.7 | 0 | 0 | 0 | 0 | 0 | 115 | ||
| 132 | R | 38.6 | Very low | 36.7 | Very low | 249 Ų | 249 | 144.3 Ų | 144.3 | 94% | 0.94 | 83% | 0.825 | S | S | * | * | trans | -144.2 | 89.5 | -179.6 | -163.7 | 172.6 | -175.8 | 141.2 | 0.4 | 115.2 | ||||
| 133 | G | 31.4 | Very low | 35.9 | Very low | 74 Ų | 74 | 141.1 Ų | 141.1 | 76% | 0.763 | 83% | 0.833 | S | S | * | * | trans | 123.5 | 107.7 | 152.1 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 134 | Q | 33.9 | Very low | 35.1 | Very low | 198 Ų | 198 | 136.3 Ų | 136.3 | 93% | 0.925 | 83% | 0.83 | S | S | * | * | -164.3 | 159 | 91.2 | -101 | -157.9 | 11.8 | 0 | 0 | 112.3 | |||||
| 135 | Q | 34.3 | Very low | 34.5 | Very low | 163 Ų | 163 | 134.8 Ų | 134.8 | 76% | 0.762 | 83% | 0.832 | S | S | * | * | trans | -125.2 | 149 | -178.9 | -153.1 | 176.4 | 6.3 | 0 | 0 | 106.5 | ||||
| 136 | F | 32.6 | Very low | 34.1 | Very low | 176 Ų | 176 | 135 Ų | 135 | 77% | 0.772 | 84% | 0.835 | S | S | * | * | trans | 83.2 | 152.2 | 171.9 | -83.1 | -91 | 0 | 0 | 0 | 121.5 | ||||
| 137 | T | 30.8 | Very low | 33.9 | Very low | 142 Ų | 142 | 134.6 Ų | 134.6 | 87% | 0.871 | 84% | 0.84 | S | S | * | * | trans | 72.3 | 144 | -179.3 | 75.6 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 138 | G | 30.6 | Very low | 33.9 | Very low | 71 Ų | 71 | 129.6 Ų | 129.6 | 73% | 0.732 | 84% | 0.839 | S | S | * | * | cis | 142.8 | 117.2 | -9.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 139 | A | 32.6 | Very low | 34.3 | Very low | 114 Ų | 114 | 131.4 Ų | 131.4 | 94% | 0.942 | 84% | 0.843 | S | S | * | * | trans | 80.5 | 154.9 | 167.6 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 140 | A | 33.4 | Very low | 34.4 | Very low | 107 Ų | 107 | 137.6 Ų | 137.6 | 88% | 0.884 | 86% | 0.856 | S | S | * | * | trans | -76.5 | 163.8 | -170 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 141 | G | 30 | Very low | 34.8 | Very low | 78 Ų | 78 | 136.6 Ų | 136.6 | 80% | 0.804 | 86% | 0.861 | S | S | * | * | trans | 177.5 | 140.4 | 166.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 142 | T | 33.3 | Very low | 35.1 | Very low | 147 Ų | 147 | 133.8 Ų | 133.8 | 90% | 0.902 | 84% | 0.843 | S | S | * | * | trans | -101.5 | 139 | -176.1 | 47.4 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 143 | G | 30.7 | Very low | 35.8 | Very low | 83 Ų | 83 | 126 Ų | 126 | 86% | 0.856 | 83% | 0.827 | S | S | * | * | trans | 96.4 | 140.5 | 137.5 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 144 | G | 30.3 | Very low | 36.7 | Very low | 75 Ų | 75 | 126 Ų | 126 | 77% | 0.773 | 82% | 0.819 | S | S | * | * | trans | 106.8 | 111.9 | 138.5 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 145 | S | 30.8 | Very low | 37.3 | Very low | 119 Ų | 119 | 119.5 Ų | 119.5 | 83% | 0.832 | 80% | 0.799 | S | S | * | * | trans | 71.9 | 108.1 | 141.2 | -59.1 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 146 | M | 36.8 | Very low | 38.2 | Very low | 187 Ų | 187 | 114.7 Ų | 114.7 | 92% | 0.921 | 79% | 0.788 | S | S | * | * | 40.8 | 142.5 | 122.2 | -71.6 | -66.9 | -170.2 | 0 | 0 | 123.1 | |||||
| 147 | A | 34.4 | Very low | 39.3 | Very low | 108 Ų | 108 | 110.7 Ų | 110.7 | 89% | 0.893 | 78% | 0.777 | S | S | * | * | trans | 92.2 | 126.3 | 156.8 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 148 | G | 34.2 | Very low | 40.4 | Very low | 78 Ų | 78 | 107.9 Ų | 107.9 | 80% | 0.804 | 76% | 0.76 | S | S | * | * | trans | 151.8 | 77.6 | -177.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | E150 | G148-E150 PolarHBondContact O-N 2.74Š| ||
| 149 | E | 47.1 | Very low | 41.6 | Very low | 209 Ų | 209 | 108 Ų | 108 | 98% | 0.977 | 75% | 0.749 | S | S | * | * | trans | -73.7 | 113.1 | 173.1 | -65.6 | 176.7 | 124.5 | 0 | 0 | 110 | ||||
| 150 | E | 40 | Very low | 42.6 | Very low | 189 Ų | 189 | 105.5 Ų | 105.5 | 88% | 0.883 | 73% | 0.729 | S | S | * | * | trans | -136.6 | 126.9 | 151.2 | -158.7 | -173.3 | -162.3 | 0 | 0 | 108.4 | G148 G152 | G148-E150 PolarHBondContact O-N 2.74Å; E150-G152 PolarHBondContact O-N 2.66Å | ||
| 151 | M | 48.8 | Very low | 43.7 | Very low | 193 Ų | 193 | 105.3 Ų | 105.3 | 95% | 0.951 | 72% | 0.716 | S | S | * | * | trans | -82 | 70.9 | -170.5 | -160.5 | 146.8 | 85.5 | 0 | 0 | 111 | S153 | M151-S153 PolarHBondContact O-N 3.47Š| ||
| 152 | G | 43.3 | Very low | 44.9 | Very low | 50 Ų | 50 | 106.8 Ų | 106.8 | 52% | 0.515 | 71% | 0.705 | S | S | . | * | trans | -54.4 | 124.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | E150 A154 | E150-G152 PolarHBondContact O-N 2.66Å; G152-A154 PolarHBondContact O-N 2.86Å | ||
| 153 | S | 51.5 | Low | 45.9 | Very low | 85 Ų | 85 | 102.7 Ų | 102.7 | 59% | 0.594 | 69% | 0.686 | S | S | * | * | trans | -47.4 | 134.4 | -176.2 | 178.1 | 0 | 0 | 0 | 0 | 112.3 | M151 A155 A156 | M151-S153 PolarHBondContact O-N 3.47Å; S153-A155 PolarHBondContact O-N 3.34Å; S153-A156 WeakPolarHBondContact O-CB 3.27Å; S153-A156 PolarHBondContact O-N 2.87Å | ||
| 154 | A | 50.3 | Low | 46.9 | Very low | 74 Ų | 74 | 101.4 Ų | 101.4 | 61% | 0.612 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -52 | -28.4 | -176.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | G152 A156 V157 V158 | G152-A154 PolarHBondContact O-N 2.86Å; A154-A156 VanDerWaalsContact C-N 3.33Å; A154-A156 PolarHBondContact O-N 3.29Å; A154-V157 PolarHBondContact O-N 3.13Å; A154-V158 WeakPolarHBondContact O-CG2 3.17Å; A154-V158 PolarHBondContact O-N 2.72Å |
| 155 | A | 47.7 | Very low | 47.9 | Very low | 61 Ų | 61 | 100.8 Ų | 100.8 | 50% | 0.504 | 66% | 0.655 | S | S | . | * | H | α-helix | trans | -58.8 | -37.5 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | S153 S159 | S153-A155 PolarHBondContact O-N 3.34Å; A155-S159 WeakPolarHBondContact O-CB 3.37Å; A155-S159 PolarHBondContact O-N 2.66Å; A155-S159 PolarHBondContact O-OG 2.98Å |
| 156 | A | 52.5 | Low | 48.9 | Very low | 63 Ų | 63 | 98.5 Ų | 98.5 | 52% | 0.521 | 64% | 0.643 | S | S | . | * | H | α-helix | trans | -67.4 | -42.3 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | S153 A154 S159 A160 | S153-A156 WeakPolarHBondContact O-CB 3.27Å; S153-A156 PolarHBondContact O-N 2.87Å; A154-A156 VanDerWaalsContact C-N 3.33Å; A154-A156 PolarHBondContact O-N 3.29Å; A156-S159 PolarHBondContact O-N 3.45Å; A156-A160 PolarHBondContact O-N 3.05Å |
| 157 | V | 56.1 | Low | 49.4 | Very low | 91 Ų | 91 | 93.7 Ų | 93.7 | 55% | 0.552 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -66.1 | -42.5 | 179 | -151.1 | 0 | 0 | 0 | 0 | 110.9 | A154 A160 V161 | A154-V157 PolarHBondContact O-N 3.13Å; V157-A160 PolarHBondContact O-N 2.87Å; V157-V161 WeakPolarHBondContact O-CG2 3.31Å; V157-V161 PolarHBondContact O-N 3.08Å |
| 158 | V | 54.8 | Low | 50.1 | Low | 84 Ų | 84 | 96.6 Ų | 96.6 | 51% | 0.509 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -62.5 | -41.8 | 174 | 170.4 | 0 | 0 | 0 | 0 | 111.3 | A154 A160 V161 I162 | A154-V158 WeakPolarHBondContact O-CG2 3.17Å; A154-V158 PolarHBondContact O-N 2.72Å; V158-A160 PolarHBondContact O-N 3.49Å; V158-V161 PolarHBondContact O-N 3.29Å; V158-I162 HydrophobicContact CG1-CD1 3.76Å; V158-I162 WeakPolarHBondContact O-CG1 3.35Å; V158-I162 PolarHBondContact O-N 3.41Å |
| 159 | S | 54.6 | Low | 50.6 | Low | 72 Ų | 72 | 99.8 Ų | 99.8 | 50% | 0.503 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -65.5 | -40.4 | -179.6 | -59.3 | 0 | 0 | 0 | 0 | 112.3 | A155 A156 V161 I162 A163 | A155-S159 WeakPolarHBondContact O-CB 3.37Å; A155-S159 PolarHBondContact O-N 2.66Å; A155-S159 PolarHBondContact O-OG 2.98Å; A156-S159 PolarHBondContact O-N 3.45Å; S159-V161 PolarHBondContact O-N 3.2Å; S159-I162 PolarHBondContact O-N 3.29Å; S159-A163 PolarHBondContact O-N 3.16Å |
| 160 | A | 54.3 | Low | 50.5 | Low | 62 Ų | 62 | 93.5 Ų | 93.5 | 51% | 0.512 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -63 | -39.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | A156 V157 V158 A163 A164 | A156-A160 PolarHBondContact O-N 3.05Å; V157-A160 PolarHBondContact O-N 2.87Å; V158-A160 PolarHBondContact O-N 3.49Å; A160-A163 PolarHBondContact O-N 3.06Å; A160-A164 WeakPolarHBondContact O-CB 3.19Å; A160-A164 PolarHBondContact O-N 3.36Å |
| 161 | V | 55.4 | Low | 50.4 | Low | 103 Ų | 103 | 88.6 Ų | 88.6 | 62% | 0.624 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -67.1 | -39.7 | 176.9 | 171.7 | 0 | 0 | 0 | 0 | 111.8 | V157 V158 S159 A164 A165 | V157-V161 WeakPolarHBondContact O-CG2 3.31Å; V157-V161 PolarHBondContact O-N 3.08Å; V158-V161 PolarHBondContact O-N 3.29Å; S159-V161 PolarHBondContact O-N 3.2Å; V161-A164 PolarHBondContact O-N 3.49Å; V161-A165 PolarHBondContact O-N 3.32Å; V161-A165 VanDerWaalsContact O-N 3.16Å |
| 162 | I | 56.3 | Low | 49.9 | Very low | 109 Ų | 109 | 88 Ų | 88 | 56% | 0.559 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -65.9 | -43.4 | 176.8 | -67.4 | 167 | 0 | 0 | 0 | 111 | V158 S159 A164 A165 A166 | V158-I162 HydrophobicContact CG1-CD1 3.76Å; V158-I162 WeakPolarHBondContact O-CG1 3.35Å; V158-I162 PolarHBondContact O-N 3.41Å; S159-I162 PolarHBondContact O-N 3.29Å; I162-A164 PolarHBondContact O-N 3.48Å; I162-A165 PolarHBondContact O-N 2.96Å; I162-A166 PolarHBondContact O-N 2.94Å |
| 163 | A | 53.2 | Low | 49.5 | Very low | 62 Ų | 62 | 93.7 Ų | 93.7 | 51% | 0.512 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -62.5 | -42 | 177 | 0 | 0 | 0 | 0 | 0 | 112.5 | S159 A160 A165 A166 A167 | S159-A163 PolarHBondContact O-N 3.16Å; A160-A163 PolarHBondContact O-N 3.06Å; A163-A165 VanDerWaalsContact C-N 3.31Å; A163-A165 PolarHBondContact O-N 3.39Å; A163-A166 PolarHBondContact O-N 3.11Å; A163-A167 PolarHBondContact O-N 3.41Å |
| 164 | A | 52.1 | Low | 49.1 | Very low | 56 Ų | 56 | 97.6 Ų | 97.6 | 46% | 0.463 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -65 | -32.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | A160 V161 I162 | A160-A164 WeakPolarHBondContact O-CB 3.19Å; A160-A164 PolarHBondContact O-N 3.36Å; V161-A164 PolarHBondContact O-N 3.49Å; I162-A164 PolarHBondContact O-N 3.48Å |
| 165 | A | 52 | Low | 48.4 | Very low | 62 Ų | 62 | 102 Ų | 102 | 51% | 0.512 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -72.4 | -33.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113 | V161 I162 A163 | V161-A165 PolarHBondContact O-N 3.32Å; V161-A165 VanDerWaalsContact O-N 3.16Å; I162-A165 PolarHBondContact O-N 2.96Å; A163-A165 VanDerWaalsContact C-N 3.31Å; A163-A165 PolarHBondContact O-N 3.39Å |
| 166 | A | 51 | Low | 47.9 | Very low | 71 Ų | 71 | 108.4 Ų | 108.4 | 59% | 0.587 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -69 | -37.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | I162 A163 Q168 N169 | I162-A166 PolarHBondContact O-N 2.94Å; A163-A166 PolarHBondContact O-N 3.11Å; A166-Q168 PolarHBondContact O-N 3.43Å; A166-Q168 VanDerWaalsContact O-N 3.15Å; A166-N169 PolarHBondContact O-N 3.36Å |
| 167 | A | 48.8 | Very low | 47.1 | Very low | 86 Ų | 86 | 114.3 Ų | 114.3 | 71% | 0.711 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.2 | -19.1 | -176.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | A163 | A163-A167 PolarHBondContact O-N 3.41Š|
| 168 | Q | 47.3 | Very low | 46.1 | Very low | 168 Ų | 168 | 118.1 Ų | 118.1 | 79% | 0.785 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.8 | -2.8 | -176.8 | -60.4 | -172.1 | 20.5 | 0 | 0 | 114.6 | A166 | A166-Q168 PolarHBondContact O-N 3.43Å; A166-Q168 VanDerWaalsContact O-N 3.15Å |
| 169 | N | 46 | Very low | 45.1 | Very low | 146 Ų | 146 | 121.7 Ų | 121.7 | 78% | 0.781 | 69% | 0.692 | S | S | * | * | trans | -113.9 | 24.8 | -175.7 | -86.1 | -84.9 | 0 | 0 | 0 | 114.9 | A166 A171 | A166-N169 PolarHBondContact O-N 3.36Å; N169-A171 PolarHBondContact O-N 3.42Å | ||
| 170 | G | 45.5 | Very low | 44.3 | Very low | 76 Ų | 76 | 126.6 Ų | 126.6 | 78% | 0.784 | 71% | 0.706 | S | S | * | * | trans | -88.6 | 95.9 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 171 | A | 37.1 | Very low | 43.5 | Very low | 87 Ų | 87 | 131.5 Ų | 131.5 | 72% | 0.719 | 72% | 0.718 | S | S | * | * | trans | -151.4 | 86.7 | 166.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | N169 | N169-A171 PolarHBondContact O-N 3.42Š| ||
| 172 | Q | 37.3 | Very low | 42.6 | Very low | 181 Ų | 181 | 134 Ų | 134 | 85% | 0.846 | 73% | 0.728 | S | S | * | * | trans | -81.3 | 122.5 | 175.6 | -70.3 | -179 | -27.5 | 0 | 0 | 111.4 | ||||
| 173 | H | 36.7 | Very low | 41.9 | Very low | 169 Ų | 169 | 132.5 Ų | 132.5 | 78% | 0.782 | 74% | 0.739 | S | S | * | * | trans | -111.2 | 116.7 | 167 | -81.8 | -73.9 | 0 | 0 | 0 | 110.2 | ||||
| 174 | H | 42.7 | Very low | 41.3 | Very low | 167 Ų | 167 | 134.4 Ų | 134.4 | 77% | 0.773 | 75% | 0.749 | S | S | * | * | trans | -79.1 | 129.4 | 173.1 | -76.9 | 43.4 | 0 | 0 | 0 | 110.9 | ||||
| 175 | H | 36 | Very low | 41.1 | Very low | 166 Ų | 166 | 140 Ų | 140 | 77% | 0.769 | 77% | 0.766 | S | S | * | * | trans | -136.4 | 119.9 | 170.3 | -80.3 | -13.9 | 0 | 0 | 0 | 111.7 | ||||
| 176 | H | 37 | Very low | 40.6 | Very low | 195 Ų | 195 | 146.1 Ų | 146.1 | 90% | 0.903 | 78% | 0.783 | S | S | * | * | trans | -68.9 | 138.2 | 166 | -76.4 | -8.9 | 0 | 0 | 0 | 110.8 | ||||
| 177 | H | 34.7 | Very low | 40 | Very low | 187 Ų | 187 | 151.8 Ų | 151.8 | 87% | 0.866 | 80% | 0.797 | S | S | * | * | trans | -103.8 | 104.7 | 170.1 | -99.2 | -62.3 | 0 | 0 | 0 | 110.9 | ||||
| 178 | H | 35.9 | Very low | 39.4 | Very low | 172 Ų | 172 | 151.9 Ų | 151.9 | 80% | 0.796 | 80% | 0.798 | S | S | * | * | trans | -75 | 126 | 159.4 | -99.6 | -72.3 | 0 | 0 | 0 | 109.4 | ||||
| 179 | H | 33.9 | Very low | 39.9 | Very low | 159 Ų | 159 | 150 Ų | 150 | 74% | 0.736 | 80% | 0.801 | S | S | * | * | trans | -105.2 | 112.7 | 174.4 | -138.7 | -14.9 | 0 | 0 | 0 | 108.8 | H181 | H179-H181 AromaticContact CE1-CD2 3.73Å; H179-H181 AromaticContact CE1-NE2 3.79Å; H179-H181 AromaticContact ND1-CD2 3.94Å | ||
| 180 | H | 37.1 | Very low | 39.4 | Very low | 174 Ų | 174 | 146.4 Ų | 146.4 | 81% | 0.806 | 80% | 0.797 | S | S | * | * | trans | -111.6 | 108.4 | 165.1 | -93.9 | -69.4 | 0 | 0 | 0 | 108.9 | ||||
| 181 | H | 37.2 | Very low | 39.3 | Very low | 165 Ų | 165 | 148.9 Ų | 148.9 | 76% | 0.764 | 80% | 0.797 | S | S | * | * | trans | -98.6 | 125.5 | 156.1 | -93.4 | -84.4 | 0 | 0 | 0 | 107.7 | H179 | H179-H181 AromaticContact CE1-CD2 3.73Å; H179-H181 AromaticContact CE1-NE2 3.79Å; H179-H181 AromaticContact ND1-CD2 3.94Å | ||
| 182 | N | 37.5 | Very low | 39.5 | Very low | 155 Ų | 155 | 153 Ų | 153 | 83% | 0.829 | 80% | 0.801 | S | S | * | * | trans | -120.7 | 91.8 | 167.2 | -156 | 65.9 | 0 | 0 | 0 | 107.9 | ||||
| 183 | G | 40 | Very low | 40 | Very low | 78 Ų | 78 | 149.4 Ų | 149.4 | 80% | 0.804 | 80% | 0.797 | S | S | * | * | trans | -91.4 | 126.6 | 171.1 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 184 | S | 41.1 | Very low | 40.2 | Very low | 103 Ų | 103 | 149 Ų | 149 | 72% | 0.72 | 80% | 0.8 | S | S | * | * | trans | -135.7 | 128.9 | 172.3 | -164.6 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 185 | H | 48.9 | Very low | 40.5 | Very low | 174 Ų | 174 | 144.5 Ų | 144.5 | 81% | 0.806 | 80% | 0.799 | S | S | * | * | trans | -64.2 | 158.6 | 169.2 | -82.1 | -68.4 | 0 | 0 | 0 | 110.9 | ||||
| 186 | H | 40.3 | Very low | 40.7 | Very low | 189 Ų | 189 | 143 Ų | 143 | 88% | 0.875 | 80% | 0.801 | S | S | * | * | -164.9 | 175.4 | 121.4 | -99.7 | -59.6 | 0 | 0 | 0 | 111.9 | |||||
| 187 | Q | 40.1 | Very low | 41.4 | Very low | 191 Ų | 191 | 140.1 Ų | 140.1 | 89% | 0.893 | 80% | 0.803 | S | S | * | * | trans | -108.2 | 167.1 | -157.8 | -161.8 | 164.4 | 23 | 0 | 0 | 111.9 | ||||
| 188 | A | 35.4 | Very low | 41.7 | Very low | 87 Ų | 87 | 134 Ų | 134 | 72% | 0.719 | 79% | 0.79 | S | S | * | * | trans | -74.9 | -173.3 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 189 | P | 57.2 | Low | 42.2 | Very low | 130 Ų | 130 | 131.2 Ų | 131.2 | 84% | 0.844 | 79% | 0.786 | S | S | * | * | cis | -134.9 | 178.3 | -9.4 | 40.5 | -23.5 | 0 | 0 | 0 | 115.2 | ||||
| 190 | G | 36.5 | Very low | 42.6 | Very low | 69 Ų | 69 | 131.5 Ų | 131.5 | 71% | 0.711 | 79% | 0.793 | S | S | * | * | trans | 123.1 | 128 | 142.9 | 0 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 191 | V | 43.4 | Very low | 43.2 | Very low | 129 Ų | 129 | 130.3 Ų | 130.3 | 78% | 0.782 | 79% | 0.787 | S | S | * | * | trans | 73.9 | 115.5 | 133.2 | -179.2 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 192 | Q | 40.8 | Very low | 43.6 | Very low | 173 Ų | 173 | 127.8 Ų | 127.8 | 81% | 0.808 | 79% | 0.785 | S | S | * | * | trans | 67.6 | 127.9 | 144.7 | -71.5 | 169.2 | 29.5 | 0 | 0 | 124 | ||||
| 193 | S | 48.5 | Very low | 44 | Very low | 106 Ų | 106 | 125.8 Ų | 125.8 | 74% | 0.741 | 77% | 0.771 | S | S | * | * | trans | 0.4 | 131.1 | 148 | 55.7 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 194 | N | 40.6 | Very low | 44.5 | Very low | 161 Ų | 161 | 128.4 Ų | 128.4 | 86% | 0.861 | 76% | 0.764 | S | S | * | * | -145.1 | 140.6 | 122.2 | -143.2 | 8.3 | 0 | 0 | 0 | 111.5 | |||||
| 195 | G | 47.7 | Very low | 45.4 | Very low | 72 Ų | 72 | 131.1 Ų | 131.1 | 74% | 0.742 | 76% | 0.758 | S | S | * | * | trans | -82.4 | 125.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 196 | T | 41.7 | Very low | 46.1 | Very low | 134 Ų | 134 | 123.3 Ų | 123.3 | 82% | 0.822 | 72% | 0.722 | S | S | * | * | trans | -127.7 | 110.9 | 163.4 | 28.5 | 0 | 0 | 0 | 0 | 109 | G198 | T196-G198 PolarHBondContact O-N 2.94Š| ||
| 197 | S | 51.2 | Low | 47.1 | Very low | 134 Ų | 134 | 115.5 Ų | 115.5 | 94% | 0.937 | 69% | 0.686 | S | S | * | * | trans | -70.9 | 70.9 | 174 | -58.6 | 0 | 0 | 0 | 0 | 110.4 | T199 | S197-T199 PolarHBondContact O-N 3.25Š| ||
| 198 | G | 41.4 | Very low | 48.6 | Very low | 58 Ų | 58 | 112.7 Ų | 112.7 | 60% | 0.598 | 68% | 0.678 | S | S | * | * | trans | -69.7 | 104.9 | 171 | 0 | 0 | 0 | 0 | 0 | 109.8 | T196 N200 | T196-G198 PolarHBondContact O-N 2.94Å; G198-N200 PolarHBondContact O-N 2.75Å; G198-N200 VanDerWaalsContact O-N 3.12Å | ||
| 199 | T | 46.6 | Very low | 50.7 | Low | 114 Ų | 114 | 114.9 Ų | 114.9 | 70% | 0.699 | 67% | 0.667 | S | S | * | * | trans | -4.9 | 99.5 | 159.2 | 40 | 0 | 0 | 0 | 0 | 115.2 | S197 H201 | S197-T199 PolarHBondContact O-N 3.25Å; T199-H201 PolarHBondContact O-N 3.33Å | ||
| 200 | N | 41.6 | Very low | 52.1 | Low | 166 Ų | 166 | 109.4 Ų | 109.4 | 89% | 0.888 | 63% | 0.63 | S | S | * | * | trans | -65.9 | 76.8 | 162.1 | -83.3 | -43.5 | 0 | 0 | 0 | 109.3 | G198 P202 | G198-N200 PolarHBondContact O-N 2.75Å; G198-N200 VanDerWaalsContact O-N 3.12Å; N200-P202 WeakPolarHBondContact O-CD 3.35Å | ||
| 201 | H | 48.6 | Very low | 54.9 | Low | 149 Ų | 149 | 109.1 Ų | 109.1 | 69% | 0.69 | 62% | 0.617 | S | S | * | * | trans | -60.1 | 127.4 | 155.8 | -74.7 | -71.8 | 0 | 0 | 0 | 106.8 | T199 H203 | T199-H201 PolarHBondContact O-N 3.33Å; H201-H203 PolarHBondContact O-N 2.94Å | ||
| 202 | P | 46.7 | Very low | 57.4 | Low | 111 Ų | 111 | 106.1 Ų | 106.1 | 72% | 0.721 | 60% | 0.597 | S | S | * | * | trans | -68.4 | 89 | 167.1 | 29.5 | -31.7 | 0 | 0 | 0 | 106.5 | N200 M204 | N200-P202 WeakPolarHBondContact O-CD 3.35Å; P202-M204 PolarHBondContact O-N 3.17Å | ||
| 203 | H | 46 | Very low | 60 | Low | 113 Ų | 113 | 104.9 Ų | 104.9 | 52% | 0.523 | 59% | 0.591 | S | S | . | * | trans | -64.4 | 88 | 166.6 | -168.2 | -104 | 0 | 0 | 0 | 105.9 | H201 R205 E234 | H201-H203 PolarHBondContact O-N 2.94Å; H203-R205 PolarHBondContact O-N 3.45Å; H203-E234 IonicContact CE1-OE1 3.75Å; H203-E234 PolarHBondContact CE1-OE1 3.35Å; H203-E234 IonicContact NE2-OE1 3.3Å; H203-E234 PolarHBondContact NE2-OE1 2.92Å | ||
| 204 | M | 49.4 | Very low | 62.3 | Low | 134 Ų | 134 | 105 Ų | 105 | 66% | 0.66 | 58% | 0.58 | S | S | * | * | trans | -52.7 | 96.5 | 157.8 | -78.5 | -72 | 111 | 0 | 0 | 105 | P202 L206 | P202-M204 PolarHBondContact O-N 3.17Å; M204-L206 PolarHBondContact O-N 3.18Å | ||
| 205 | R | 60.9 | Low | 64.9 | Low | 159 Ų | 159 | 97.3 Ų | 97.3 | 60% | 0.6 | 54% | 0.539 | S | S | * | . | trans | -53.5 | 131 | -163.8 | -155.7 | -170.3 | -168.5 | 167.4 | 5.9 | 107.1 | H203 E207 D208 | H203-R205 PolarHBondContact O-N 3.45Å; R205-E207 PolarHBondContact O-N 3.31Å; R205-D208 WeakPolarHBondContact O-CB 3.11Å; R205-D208 PolarHBondContact O-N 2.86Å | ||
| 206 | L | 62.7 | Low | 67.3 | Low | 11 Ų | 11 | 96.1 Ų | 96.1 | 6% | 0.058 | 52% | 0.517 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -56.9 | -19.2 | -169.1 | -153.6 | 98.8 | 0 | 0 | 0 | 113.8 | M204 R209 L227 V230 E234 L238 | M204-L206 PolarHBondContact O-N 3.18Å; L206-R209 WeakPolarHBondContact O-CB 3.43Å; L206-R209 PolarHBondContact O-N 3.04Å; L206-L227 HydrophobicContact CD2-CD2 4.17Å; L206-V230 HydrophobicContact CD1-CG1 4.13Å; L206-V230 HydrophobicContact CD1-CG2 4.23Å; L206-V230 HydrophobicContact CD2-CG1 3.65Å; L206-V230 HydrophobicContact CD2-CG2 4.4Å; L206-E234 HydrophobicContact CD2-CB 4.25Å; L206-L238 HydrophobicContact CD2-CD2 4.31Å |
| 207 | E | 63 | Low | 69.9 | Low | 25 Ų | 25 | 94.6 Ų | 94.6 | 12% | 0.117 | 51% | 0.508 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64 | -29.3 | 168.4 | -78.3 | 72.8 | -165.4 | 0 | 0 | 116.1 | R205 R209 R237 L238 K241 | R205-E207 PolarHBondContact O-N 3.31Å; E207-R209 VanDerWaalsContact C-N 3.29Å; E207-R237 VanDerWaalsContact CD-CZ 3.46Å; E207-R237 IonicContact OE1-CZ 2.69Å; E207-R237 IonicContact OE1-NE 3.71Å; E207-R237 IonicContact OE1-NH1 3.45Å; E207-R237 PolarHBondContact OE1-NH1 3.37Å; E207-R237 IonicContact OE1-NH2 3.71Å; E207-R237 PolarHBondContact OE1-NH2 3.24Å; E207-R237 IonicContact OE2-CZ 2.75Å; E207-R237 IonicContact OE2-NH1 2.7Å; E207-R237 PolarHBondContact OE2-NH1 3.48Å; E207-R237 IonicContact OE2-NH2 3.19Å; E207-R237 PolarHBondContact OE2-NH2 3.25Å; E207-L238 HydrophobicContact CG-CD1 4.49Å; E207-K241 HydrophobicContact CB-CD 4.4Å; E207-K241 HydrophobicContact CG-CD 3.47Å; E207-K241 VanDerWaalsContact CG-CD 3.47Å |
| 208 | D | 71.4 | Confident | 72.1 | Confident | 132 Ų | 132 | 89 Ų | 89 | 71% | 0.706 | 47% | 0.467 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77 | -18.5 | 176 | -98.1 | 9.6 | 0 | 0 | 0 | 111.8 | R205 F210 | R205-D208 WeakPolarHBondContact O-CB 3.11Å; R205-D208 PolarHBondContact O-N 2.86Å; D208-F210 PolarHBondContact O-N 3.29Å |
| 209 | R | 78.9 | Confident | 74.8 | Confident | 133 Ų | 133 | 89.2 Ų | 89.2 | 50% | 0.502 | 46% | 0.459 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.3 | -18.8 | 174.4 | -64 | -175.2 | 61.5 | -162 | -5.6 | 113.1 | L206 E207 | L206-R209 WeakPolarHBondContact O-CB 3.43Å; L206-R209 PolarHBondContact O-N 3.04Å; E207-R209 VanDerWaalsContact C-N 3.29Å |
| 210 | F | 86.9 | Confident | 77.2 | Confident | 14 Ų | 14 | 88.4 Ų | 88.4 | 6% | 0.061 | 45% | 0.454 | C | S | . | . | S | Bend | trans | -138.3 | 117.8 | -178.4 | -51.2 | -60.8 | 0 | 0 | 0 | 110.4 | D208 L215 M218 Q226 L238 | D208-F210 PolarHBondContact O-N 3.29Å; F210-L215 HydrophobicContact CB-CB 4.27Å; F210-M218 HydrophobicContact CD1-SD 4.44Å; F210-Q226 HydrophobicContact CE1-CB 4.42Å; F210-Q226 HydrophobicContact CZ-CB 4.11Å; F210-L238 HydrophobicContact CD2-CD1 4.18Å; F210-L238 HydrophobicContact CD2-CD2 3.69Å; F210-L238 HydrophobicContact CE2-CD2 3.71Å |
| 211 | S | 94.3 | Very high | 79.9 | Confident | 63 Ų | 63 | 91 Ų | 91 | 44% | 0.441 | 45% | 0.451 | S | S | . | . | trans | -53.9 | 145.2 | 166.3 | 174 | 0 | 0 | 0 | 0 | 110.2 | E213 Q214 L215 | S211-E213 PolarHBondContact O-N 3.06Å; S211-E213 VanDerWaalsContact O-N 3.13Å; S211-Q214 PolarHBondContact O-N 2.96Å; S211-L215 WeakPolarHBondContact O-CB 3.44Å; S211-L215 PolarHBondContact O-N 3.03Å | ||
| 212 | D | 95.7 | Very high | 82.2 | Confident | 67 Ų | 67 | 86.8 Ų | 86.8 | 36% | 0.358 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -51.9 | -36.7 | 177.3 | -80.2 | 15.1 | 0 | 0 | 0 | 111.9 | V216 K241 L245 | D212-V216 WeakPolarHBondContact O-CG2 3.31Å; D212-V216 PolarHBondContact O-N 2.93Å; D212-V216 VanDerWaalsContact O-N 3.08Å; D212-K241 WeakPolarHBondContact OD1-CE 3.49Å; D212-K241 IonicContact OD1-NZ 3.09Å; D212-K241 PolarHBondContact OD1-NZ 3.37Å; D212-L245 HydrophobicContact CB-CD1 3.71Å; D212-L245 HydrophobicContact CB-CD2 4.18Å; D212-L245 VanDerWaalsContact OD2-CD2 3.31Å; D212-L245 WeakPolarHBondContact OD2-CD2 3.48Å |
| 213 | E | 95.9 | Very high | 84.5 | Confident | 147 Ų | 147 | 81.8 Ų | 81.8 | 69% | 0.687 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -67.8 | -47.9 | 176.9 | -175.3 | 170.5 | -159.1 | 0 | 0 | 112.2 | S211 L215 V216 T217 | S211-E213 PolarHBondContact O-N 3.06Å; S211-E213 VanDerWaalsContact O-N 3.13Å; E213-L215 VanDerWaalsContact C-N 3.34Å; E213-L215 PolarHBondContact O-N 3.5Å; E213-V216 PolarHBondContact O-N 3.31Å; E213-T217 WeakPolarHBondContact O-CB 3.36Å; E213-T217 VanDerWaalsContact O-CG2 3.31Å; E213-T217 WeakPolarHBondContact O-CG2 3.4Å; E213-T217 PolarHBondContact O-N 3.5Å; E213-T217 PolarHBondContact O-OG1 3.42Å |
| 214 | Q | 96.7 | Very high | 86.9 | Confident | 108 Ų | 108 | 80 Ų | 80 | 51% | 0.505 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -60 | -44.8 | 174.8 | -70.7 | 178.3 | -50.4 | 0 | 0 | 111 | S211 V216 T217 M218 | S211-Q214 PolarHBondContact O-N 2.96Å; Q214-V216 VanDerWaalsContact C-N 3.29Å; Q214-V216 PolarHBondContact O-N 2.93Å; Q214-T217 WeakPolarHBondContact CA-OG1 3.49Å; Q214-T217 PolarHBondContact O-N 3.34Å; Q214-T217 PolarHBondContact O-OG1 3.21Å; Q214-M218 WeakPolarHBondContact O-CB 3.46Å; Q214-M218 WeakPolarHBondContact O-CG 3.33Å; Q214-M218 PolarHBondContact O-N 3.28Å |
| 215 | L | 96.2 | Very high | 89.1 | Confident | 0 Ų | 0 | 80.6 Ų | 80.6 | 0% | 0 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -62.4 | -35.3 | -180 | -178.5 | 59.5 | 0 | 0 | 0 | 112.5 | F210 S211 E213 L223 L238 K241 R242 L245 | F210-L215 HydrophobicContact CB-CB 4.27Å; S211-L215 WeakPolarHBondContact O-CB 3.44Å; S211-L215 PolarHBondContact O-N 3.03Å; E213-L215 VanDerWaalsContact C-N 3.34Å; E213-L215 PolarHBondContact O-N 3.5Å; L215-L223 HydrophobicContact CD1-CD1 3.89Å; L215-L223 HydrophobicContact CD1-CD2 4.23Å; L215-L238 HydrophobicContact CD1-CD1 4.29Å; L215-L238 HydrophobicContact CD1-CD2 3.91Å; L215-L238 HydrophobicContact CD1-CG 3.85Å; L215-L238 HydrophobicContact CD2-CD1 3.85Å; L215-L238 HydrophobicContact CD2-CG 4.1Å; L215-K241 HydrophobicContact CD2-CB 4.26Å; L215-K241 HydrophobicContact CD2-CD 3.83Å; L215-K241 HydrophobicContact CD2-CG 3.91Å; L215-R242 HydrophobicContact CD1-CB 4.11Å; L215-R242 HydrophobicContact CD1-CG 4.43Å; L215-R242 HydrophobicContact CD2-CB 4.23Å; L215-R242 HydrophobicContact CG-CB 3.91Å; L215-R242 HydrophobicContact CG-CG 4.21Å; L215-R242 WeakPolarHBondContact O-CD 3.44Å; L215-R242 WeakPolarHBondContact O-CG 3.4Å; L215-R242 VanDerWaalsContact O-CZ 3.3Å; L215-R242 PolarHBondContact O-NE 3.18Å; L215-L245 HydrophobicContact CD2-CD1 4.25Å |
| 216 | V | 97.3 | Very high | 90.5 | Very high | 47 Ų | 47 | 75.8 Ų | 75.8 | 29% | 0.285 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -71.9 | -45.6 | 174.6 | 166.4 | 0 | 0 | 0 | 0 | 111.8 | D212 E213 Q214 R242 L245 K246 | D212-V216 WeakPolarHBondContact O-CG2 3.31Å; D212-V216 PolarHBondContact O-N 2.93Å; D212-V216 VanDerWaalsContact O-N 3.08Å; E213-V216 PolarHBondContact O-N 3.31Å; Q214-V216 VanDerWaalsContact C-N 3.29Å; Q214-V216 PolarHBondContact O-N 2.93Å; V216-R242 PolarHBondContact O-NH2 3Å; V216-L245 HydrophobicContact CG2-CB 3.39Å; V216-L245 HydrophobicContact CG2-CD1 4.17Å; V216-L245 HydrophobicContact CG2-CG 4.4Å; V216-K246 HydrophobicContact CG1-CG 4.21Å; V216-K246 HydrophobicContact CG2-CG 4.42Å |
| 217 | T | 97.3 | Very high | 92 | Very high | 102 Ų | 102 | 75.9 Ų | 75.9 | 63% | 0.626 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -79.2 | -39.8 | -169.7 | 50.2 | 0 | 0 | 0 | 0 | 114.3 | E213 Q214 | E213-T217 WeakPolarHBondContact O-CB 3.36Å; E213-T217 VanDerWaalsContact O-CG2 3.31Å; E213-T217 WeakPolarHBondContact O-CG2 3.4Å; E213-T217 PolarHBondContact O-N 3.5Å; E213-T217 PolarHBondContact O-OG1 3.42Å; Q214-T217 WeakPolarHBondContact CA-OG1 3.49Å; Q214-T217 PolarHBondContact O-N 3.34Å; Q214-T217 PolarHBondContact O-OG1 3.21Å |
| 218 | M | 97.2 | Very high | 93.5 | Very high | 17 Ų | 17 | 84.4 Ų | 84.4 | 8% | 0.084 | 40% | 0.404 | C | S | . | . | S | Bend | trans | -50.3 | 140.9 | -178.6 | -80.8 | 170 | 55.8 | 0 | 0 | 113.3 | F210 Q214 E222 L223 Q226 R242 | F210-M218 HydrophobicContact CD1-SD 4.44Å; Q214-M218 WeakPolarHBondContact O-CB 3.46Å; Q214-M218 WeakPolarHBondContact O-CG 3.33Å; Q214-M218 PolarHBondContact O-N 3.28Å; M218-E222 HydrophobicContact CE-CB 4.32Å; M218-E222 HydrophobicContact CE-CG 4.02Å; M218-L223 VanDerWaalsContact CE-CA 3.46Å; M218-L223 HydrophobicContact CE-CB 3.92Å; M218-L223 HydrophobicContact CE-CD1 3.96Å; M218-Q226 HydrophobicContact CE-CG 4.34Å; M218-R242 PolarHBondContact O-NH1 3.24Å; M218-R242 PolarHBondContact O-NH2 3.38Å |
| 219 | S | 97.5 | Very high | 94.4 | Very high | 61 Ų | 61 | 82.4 Ų | 82.4 | 43% | 0.427 | 42% | 0.415 | S | S | . | . | trans | -64 | 159.2 | 176.9 | 76.2 | 0 | 0 | 0 | 0 | 112.4 | R221 E222 L223 | S219-R221 VanDerWaalsContact C-N 3.27Å; S219-R221 PolarHBondContact O-N 3.37Å; S219-E222 PolarHBondContact N-OE2 3.48Å; S219-E222 PolarHBondContact O-N 2.86Å; S219-E222 VanDerWaalsContact OG-CB 3.23Å; S219-E222 WeakPolarHBondContact OG-CB 2.84Å; S219-E222 PolarHBondContact OG-N 3.22Å; S219-E222 VanDerWaalsContact OG-N 3.13Å; S219-L223 PolarHBondContact O-N 3.29Å | ||
| 220 | V | 97.3 | Very high | 95.1 | Very high | 97 Ų | 97 | 77.3 Ų | 77.3 | 59% | 0.588 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -60.9 | -38.6 | 175.8 | 177.7 | 0 | 0 | 0 | 0 | 111.2 | E222 N224 | V220-E222 VanDerWaalsContact C-N 3.34Å; V220-N224 WeakPolarHBondContact O-CB 3.19Å; V220-N224 VanDerWaalsContact O-CG 3.24Å; V220-N224 PolarHBondContact O-N 3.42Å; V220-N224 PolarHBondContact O-ND2 2.97Å |
| 221 | R | 97.6 | Very high | 95.4 | Very high | 220 Ų | 220 | 78.9 Ų | 78.9 | 83% | 0.83 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -63.3 | -41 | 177.2 | -66.6 | -178.3 | 178.8 | 177.9 | -0.4 | 111.7 | S219 R225 | S219-R221 VanDerWaalsContact C-N 3.27Å; S219-R221 PolarHBondContact O-N 3.37Å; R221-R225 PolarHBondContact O-N 2.86Å; R221-R225 VanDerWaalsContact O-N 3.09Å |
| 222 | E | 96.7 | Very high | 95.5 | Very high | 62 Ų | 62 | 83 Ų | 83 | 29% | 0.29 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -69.9 | -46.1 | 179.9 | -165.7 | -176.4 | -173.8 | 0 | 0 | 112.3 | M218 S219 V220 N224 R225 Q226 | M218-E222 HydrophobicContact CE-CB 4.32Å; M218-E222 HydrophobicContact CE-CG 4.02Å; S219-E222 PolarHBondContact N-OE2 3.48Å; S219-E222 PolarHBondContact O-N 2.86Å; S219-E222 VanDerWaalsContact OG-CB 3.23Å; S219-E222 WeakPolarHBondContact OG-CB 2.84Å; S219-E222 PolarHBondContact OG-N 3.22Å; S219-E222 VanDerWaalsContact OG-N 3.13Å; V220-E222 VanDerWaalsContact C-N 3.34Å; E222-N224 VanDerWaalsContact C-N 3.35Å; E222-N224 PolarHBondContact O-N 3.2Å; E222-R225 WeakPolarHBondContact O-CB 3.43Å; E222-R225 PolarHBondContact O-N 2.94Å; E222-Q226 PolarHBondContact O-N 3.41Å |
| 223 | L | 95.4 | Very high | 95.4 | Very high | 6 Ų | 6 | 85.8 Ų | 85.8 | 3% | 0.031 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -59.3 | -45.8 | 174.8 | -176.7 | 61.1 | 0 | 0 | 0 | 111.3 | L215 M218 S219 R225 Q226 L227 L238 | L215-L223 HydrophobicContact CD1-CD1 3.89Å; L215-L223 HydrophobicContact CD1-CD2 4.23Å; M218-L223 VanDerWaalsContact CE-CA 3.46Å; M218-L223 HydrophobicContact CE-CB 3.92Å; M218-L223 HydrophobicContact CE-CD1 3.96Å; S219-L223 PolarHBondContact O-N 3.29Å; L223-R225 PolarHBondContact O-N 3.34Å; L223-Q226 PolarHBondContact O-N 2.7Å; L223-L227 HydrophobicContact CD1-CD1 4.07Å; L223-L227 HydrophobicContact CD1-CG 4.19Å; L223-L227 HydrophobicContact CG-CD1 3.85Å; L223-L227 HydrophobicContact CG-CG 4.38Å; L223-L227 WeakPolarHBondContact O-CB 3.46Å; L223-L227 VanDerWaalsContact O-CG 3.29Å; L223-L227 WeakPolarHBondContact O-CG 3.35Å; L223-L227 PolarHBondContact O-N 3.06Å; L223-L238 HydrophobicContact CD1-CD2 3.99Å |
| 224 | N | 95.8 | Very high | 95.3 | Very high | 76 Ų | 76 | 80.2 Ų | 80.2 | 41% | 0.406 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -64.2 | -26.4 | 176.3 | -72.5 | -21.4 | 0 | 0 | 0 | 113.1 | V220 E222 | V220-N224 WeakPolarHBondContact O-CB 3.19Å; V220-N224 VanDerWaalsContact O-CG 3.24Å; V220-N224 PolarHBondContact O-N 3.42Å; V220-N224 PolarHBondContact O-ND2 2.97Å; E222-N224 VanDerWaalsContact C-N 3.35Å; E222-N224 PolarHBondContact O-N 3.2Å |
| 225 | R | 95.5 | Very high | 95.1 | Very high | 145 Ų | 145 | 76.4 Ų | 76.4 | 55% | 0.547 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -71.1 | -44.8 | 173.2 | -175.7 | 176.1 | 71.4 | -109.9 | 4.4 | 111.4 | R221 E222 L223 L227 R228 | R221-R225 PolarHBondContact O-N 2.86Å; R221-R225 VanDerWaalsContact O-N 3.09Å; E222-R225 WeakPolarHBondContact O-CB 3.43Å; E222-R225 PolarHBondContact O-N 2.94Å; L223-R225 PolarHBondContact O-N 3.34Å; R225-L227 VanDerWaalsContact C-N 3.31Å; R225-R228 WeakPolarHBondContact O-CG 3.42Å; R225-R228 PolarHBondContact O-N 3.35Å |
| 226 | Q | 92.3 | Very high | 95.1 | Very high | 59 Ų | 59 | 80.8 Ų | 80.8 | 28% | 0.276 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -75.6 | -19 | -178.6 | -63.2 | 176.5 | 9 | 0 | 0 | 113.4 | F210 M218 E222 L223 | F210-Q226 HydrophobicContact CE1-CB 4.42Å; F210-Q226 HydrophobicContact CZ-CB 4.11Å; M218-Q226 HydrophobicContact CE-CG 4.34Å; E222-Q226 PolarHBondContact O-N 3.41Å; L223-Q226 PolarHBondContact O-N 2.7Å |
| 227 | L | 93.3 | Very high | 94.9 | Very high | 13 Ų | 13 | 82.2 Ų | 82.2 | 7% | 0.068 | 41% | 0.413 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -85.5 | 2.8 | 173.7 | -73.7 | 177.8 | 0 | 0 | 0 | 114.7 | L206 L223 R225 G229 V230 V235 L238 | L206-L227 HydrophobicContact CD2-CD2 4.17Å; L223-L227 HydrophobicContact CD1-CD1 4.07Å; L223-L227 HydrophobicContact CD1-CG 4.19Å; L223-L227 HydrophobicContact CG-CD1 3.85Å; L223-L227 HydrophobicContact CG-CG 4.38Å; L223-L227 WeakPolarHBondContact O-CB 3.46Å; L223-L227 VanDerWaalsContact O-CG 3.29Å; L223-L227 WeakPolarHBondContact O-CG 3.35Å; L223-L227 PolarHBondContact O-N 3.06Å; R225-L227 VanDerWaalsContact C-N 3.31Å; L227-G229 PolarHBondContact O-N 3.5Å; L227-V230 HydrophobicContact CD2-CB 4.29Å; L227-V230 HydrophobicContact CD2-CG1 4.21Å; L227-V230 HydrophobicContact CD2-CG2 4.15Å; L227-V230 WeakPolarHBondContact O-CB 3.31Å; L227-V230 PolarHBondContact O-N 2.93Å; L227-V235 HydrophobicContact CB-CG2 4.26Å; L227-V235 HydrophobicContact CD1-CG1 4.35Å; L227-V235 HydrophobicContact CD1-CG2 4.34Å; L227-V235 HydrophobicContact CD2-CG2 4.11Å; L227-V235 HydrophobicContact CG-CG2 4.48Å; L227-L238 HydrophobicContact CD2-CD2 3.75Å; L227-L238 HydrophobicContact CG-CD2 4.46Å |
| 228 | R | 94.3 | Very high | 94.8 | Very high | 203 Ų | 203 | 77.4 Ų | 77.4 | 77% | 0.766 | 38% | 0.383 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.8 | 132.4 | 173.9 | -69.7 | 179.5 | 176.7 | -88.3 | 2.8 | 110 | R225 V230 | R225-R228 WeakPolarHBondContact O-CG 3.42Å; R225-R228 PolarHBondContact O-N 3.35Å; R228-V230 VanDerWaalsContact C-N 3.27Å; R228-V230 PolarHBondContact O-N 2.87Å |
| 229 | G | 91.1 | Very high | 94.7 | Very high | 91 Ų | 91 | 81.6 Ų | 81.6 | 94% | 0.938 | 40% | 0.401 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 77.9 | 3.2 | -177.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | L227 | L227-G229 PolarHBondContact O-N 3.5Š|
| 230 | V | 92.4 | Very high | 94.7 | Very high | 26 Ų | 26 | 84.8 Ų | 84.8 | 16% | 0.158 | 41% | 0.409 | C | S | . | . | trans | -85.2 | 147.2 | 173.5 | 178.4 | 0 | 0 | 0 | 0 | 109.8 | L206 L227 R228 E234 V235 | L206-V230 HydrophobicContact CD1-CG1 4.13Å; L206-V230 HydrophobicContact CD1-CG2 4.23Å; L206-V230 HydrophobicContact CD2-CG1 3.65Å; L206-V230 HydrophobicContact CD2-CG2 4.4Å; L227-V230 HydrophobicContact CD2-CB 4.29Å; L227-V230 HydrophobicContact CD2-CG1 4.21Å; L227-V230 HydrophobicContact CD2-CG2 4.15Å; L227-V230 WeakPolarHBondContact O-CB 3.31Å; L227-V230 PolarHBondContact O-N 2.93Å; R228-V230 VanDerWaalsContact C-N 3.27Å; R228-V230 PolarHBondContact O-N 2.87Å; V230-E234 HydrophobicContact CG1-CB 3.59Å; V230-V235 HydrophobicContact CB-CG2 4.09Å; V230-V235 HydrophobicContact CG1-CG2 3.97Å | ||
| 231 | S | 94.8 | Very high | 94.6 | Very high | 47 Ų | 47 | 82.5 Ų | 82.5 | 33% | 0.329 | 39% | 0.391 | S | S | . | . | trans | -64 | 154.5 | 178.4 | 69.7 | 0 | 0 | 0 | 0 | 112.4 | E233 E234 V235 | S231-E233 VanDerWaalsContact C-N 3.27Å; S231-E233 PolarHBondContact O-N 2.92Å; S231-E234 WeakPolarHBondContact CB-OE2 3.49Å; S231-E234 PolarHBondContact N-OE2 3.42Å; S231-E234 PolarHBondContact O-N 3.23Å; S231-E234 WeakPolarHBondContact OG-CB 3.34Å; S231-E234 VanDerWaalsContact OG-CD 3.24Å; S231-E234 WeakPolarHBondContact OG-CG 3.42Å; S231-E234 PolarHBondContact OG-N 3.1Å; S231-E234 PolarHBondContact OG-OE2 2.8Å; S231-V235 WeakPolarHBondContact O-CG2 3.37Å; S231-V235 PolarHBondContact O-N 3.12Å | ||
| 232 | K | 94.9 | Very high | 94.6 | Very high | 150 Ų | 150 | 73.5 Ų | 73.5 | 65% | 0.652 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -61.5 | -39.7 | -177.4 | -179.8 | -174.8 | 176 | -171.6 | 0 | 111.3 | V235 I236 | K232-V235 PolarHBondContact O-N 3.13Å; K232-I236 HydrophobicContact CG-CD1 4.09Å; K232-I236 VanDerWaalsContact O-CG1 3.31Å; K232-I236 WeakPolarHBondContact O-CG1 3.43Å; K232-I236 PolarHBondContact O-N 2.88Å |
| 233 | E | 94.8 | Very high | 94.7 | Very high | 125 Ų | 125 | 77.6 Ų | 77.6 | 58% | 0.584 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -65.5 | -44.1 | -178 | -67.5 | 57.5 | -126.3 | 0 | 0 | 110.4 | S231 I236 R237 | S231-E233 VanDerWaalsContact C-N 3.27Å; S231-E233 PolarHBondContact O-N 2.92Å; E233-I236 PolarHBondContact O-N 3.44Å; E233-R237 WeakPolarHBondContact O-CB 3.34Å; E233-R237 PolarHBondContact O-N 2.89Å |
| 234 | E | 92.4 | Very high | 94.8 | Very high | 29 Ų | 29 | 81.3 Ų | 81.3 | 14% | 0.136 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -67.3 | -39.5 | 173.4 | -70.7 | 171.9 | 120 | 0 | 0 | 112.7 | H203 L206 V230 S231 I236 R237 L238 | H203-E234 IonicContact CE1-OE1 3.75Å; H203-E234 PolarHBondContact CE1-OE1 3.35Å; H203-E234 IonicContact NE2-OE1 3.3Å; H203-E234 PolarHBondContact NE2-OE1 2.92Å; L206-E234 HydrophobicContact CD2-CB 4.25Å; V230-E234 HydrophobicContact CG1-CB 3.59Å; S231-E234 WeakPolarHBondContact CB-OE2 3.49Å; S231-E234 PolarHBondContact N-OE2 3.42Å; S231-E234 PolarHBondContact O-N 3.23Å; S231-E234 WeakPolarHBondContact OG-CB 3.34Å; S231-E234 VanDerWaalsContact OG-CD 3.24Å; S231-E234 WeakPolarHBondContact OG-CG 3.42Å; S231-E234 PolarHBondContact OG-N 3.1Å; S231-E234 PolarHBondContact OG-OE2 2.8Å; E234-I236 VanDerWaalsContact C-N 3.33Å; E234-I236 PolarHBondContact O-N 3.16Å; E234-R237 PolarHBondContact O-N 3.1Å; E234-L238 WeakPolarHBondContact O-CB 3.4Å; E234-L238 PolarHBondContact O-N 3.33Å |
| 235 | V | 93.8 | Very high | 94.9 | Very high | 28 Ų | 28 | 78.8 Ų | 78.8 | 17% | 0.17 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -60.3 | -42.8 | 175 | 166.3 | 0 | 0 | 0 | 0 | 111.2 | L227 V230 S231 K232 K239 | L227-V235 HydrophobicContact CB-CG2 4.26Å; L227-V235 HydrophobicContact CD1-CG1 4.35Å; L227-V235 HydrophobicContact CD1-CG2 4.34Å; L227-V235 HydrophobicContact CD2-CG2 4.11Å; L227-V235 HydrophobicContact CG-CG2 4.48Å; V230-V235 HydrophobicContact CB-CG2 4.09Å; V230-V235 HydrophobicContact CG1-CG2 3.97Å; S231-V235 WeakPolarHBondContact O-CG2 3.37Å; S231-V235 PolarHBondContact O-N 3.12Å; K232-V235 PolarHBondContact O-N 3.13Å; V235-K239 HydrophobicContact CG1-CD 4.02Å; V235-K239 WeakPolarHBondContact O-CB 3.35Å; V235-K239 VanDerWaalsContact O-CG 3.27Å; V235-K239 WeakPolarHBondContact O-CG 3.44Å; V235-K239 PolarHBondContact O-N 3.02Å |
| 236 | I | 94.9 | Very high | 95.1 | Very high | 93 Ų | 93 | 75.4 Ų | 75.4 | 48% | 0.477 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -62.3 | -49.9 | 175.7 | -70 | 163.5 | 0 | 0 | 0 | 109.8 | K232 E233 E234 L238 K239 Q240 | K232-I236 HydrophobicContact CG-CD1 4.09Å; K232-I236 VanDerWaalsContact O-CG1 3.31Å; K232-I236 WeakPolarHBondContact O-CG1 3.43Å; K232-I236 PolarHBondContact O-N 2.88Å; E233-I236 PolarHBondContact O-N 3.44Å; E234-I236 VanDerWaalsContact C-N 3.33Å; E234-I236 PolarHBondContact O-N 3.16Å; I236-L238 PolarHBondContact O-N 2.98Å; I236-K239 PolarHBondContact O-N 3.46Å; I236-Q240 WeakPolarHBondContact O-CB 3.26Å; I236-Q240 PolarHBondContact O-N 3.33Å |
| 237 | R | 94.1 | Very high | 95.3 | Very high | 77 Ų | 77 | 75.7 Ų | 75.7 | 29% | 0.291 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -61.2 | -43.2 | -178.2 | -166.4 | 166.8 | 63.6 | 88.9 | 14 | 112.6 | E207 E233 E234 Q240 K241 | E207-R237 VanDerWaalsContact CD-CZ 3.46Å; E207-R237 IonicContact OE1-CZ 2.69Å; E207-R237 IonicContact OE1-NE 3.71Å; E207-R237 IonicContact OE1-NH1 3.45Å; E207-R237 PolarHBondContact OE1-NH1 3.37Å; E207-R237 IonicContact OE1-NH2 3.71Å; E207-R237 PolarHBondContact OE1-NH2 3.24Å; E207-R237 IonicContact OE2-CZ 2.75Å; E207-R237 IonicContact OE2-NH1 2.7Å; E207-R237 PolarHBondContact OE2-NH1 3.48Å; E207-R237 IonicContact OE2-NH2 3.19Å; E207-R237 PolarHBondContact OE2-NH2 3.25Å; E233-R237 WeakPolarHBondContact O-CB 3.34Å; E233-R237 PolarHBondContact O-N 2.89Å; E234-R237 PolarHBondContact O-N 3.1Å; R237-Q240 PolarHBondContact O-N 3.5Å; R237-K241 PolarHBondContact O-N 2.85Å |
| 238 | L | 94.9 | Very high | 95.6 | Very high | 1 Ų | 1 | 82.7 Ų | 82.7 | 1% | 0.005 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -70.1 | -37.6 | 177.7 | -162.2 | 79 | 0 | 0 | 0 | 112.1 | L206 E207 F210 L215 L223 L227 E234 I236 K241 R242 | L206-L238 HydrophobicContact CD2-CD2 4.31Å; E207-L238 HydrophobicContact CG-CD1 4.49Å; F210-L238 HydrophobicContact CD2-CD1 4.18Å; F210-L238 HydrophobicContact CD2-CD2 3.69Å; F210-L238 HydrophobicContact CE2-CD2 3.71Å; L215-L238 HydrophobicContact CD1-CD1 4.29Å; L215-L238 HydrophobicContact CD1-CD2 3.91Å; L215-L238 HydrophobicContact CD1-CG 3.85Å; L215-L238 HydrophobicContact CD2-CD1 3.85Å; L215-L238 HydrophobicContact CD2-CG 4.1Å; L223-L238 HydrophobicContact CD1-CD2 3.99Å; L227-L238 HydrophobicContact CD2-CD2 3.75Å; L227-L238 HydrophobicContact CG-CD2 4.46Å; E234-L238 WeakPolarHBondContact O-CB 3.4Å; E234-L238 PolarHBondContact O-N 3.33Å; I236-L238 PolarHBondContact O-N 2.98Å; L238-K241 PolarHBondContact O-N 3.36Å; L238-R242 WeakPolarHBondContact O-CB 3.29Å; L238-R242 PolarHBondContact O-N 3.38Å |
| 239 | K | 95.3 | Very high | 95.8 | Very high | 104 Ų | 104 | 74.2 Ų | 74.2 | 45% | 0.452 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -63.9 | -40 | 172.2 | -77.1 | 175.7 | 178.1 | 178.2 | 0 | 111.8 | V235 I236 R242 R243 | V235-K239 HydrophobicContact CG1-CD 4.02Å; V235-K239 WeakPolarHBondContact O-CB 3.35Å; V235-K239 VanDerWaalsContact O-CG 3.27Å; V235-K239 WeakPolarHBondContact O-CG 3.44Å; V235-K239 PolarHBondContact O-N 3.02Å; I236-K239 PolarHBondContact O-N 3.46Å; K239-R242 PolarHBondContact O-N 3.3Å; K239-R243 PolarHBondContact O-N 3.35Å |
| 240 | Q | 96.9 | Very high | 96.1 | Very high | 129 Ų | 129 | 75.7 Ų | 75.7 | 60% | 0.603 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -64.5 | -48.4 | 174.4 | -171.8 | 178.9 | 5.9 | 0 | 0 | 111.2 | I236 R237 R242 R243 T244 | I236-Q240 WeakPolarHBondContact O-CB 3.26Å; I236-Q240 PolarHBondContact O-N 3.33Å; R237-Q240 PolarHBondContact O-N 3.5Å; Q240-R242 VanDerWaalsContact C-N 3.31Å; Q240-R242 PolarHBondContact O-N 3Å; Q240-R243 PolarHBondContact O-N 2.99Å; Q240-R243 VanDerWaalsContact O-N 3.11Å; Q240-T244 PolarHBondContact O-N 3.44Å; Q240-T244 PolarHBondContact O-OG1 3.38Å |
| 241 | K | 95.9 | Very high | 96.4 | Very high | 48 Ų | 48 | 76.6 Ų | 76.6 | 21% | 0.209 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -52.4 | -49.6 | 172.7 | -177.6 | -180 | 176.6 | -165.9 | 0 | 110.8 | E207 D212 L215 R237 L238 R243 T244 L245 | E207-K241 HydrophobicContact CB-CD 4.4Å; E207-K241 HydrophobicContact CG-CD 3.47Å; E207-K241 VanDerWaalsContact CG-CD 3.47Å; D212-K241 WeakPolarHBondContact OD1-CE 3.49Å; D212-K241 IonicContact OD1-NZ 3.09Å; D212-K241 PolarHBondContact OD1-NZ 3.37Å; L215-K241 HydrophobicContact CD2-CB 4.26Å; L215-K241 HydrophobicContact CD2-CD 3.83Å; L215-K241 HydrophobicContact CD2-CG 3.91Å; R237-K241 PolarHBondContact O-N 2.85Å; L238-K241 PolarHBondContact O-N 3.36Å; K241-R243 PolarHBondContact O-N 3.22Å; K241-T244 PolarHBondContact O-N 3.1Å; K241-L245 HydrophobicContact CG-CD1 4Å; K241-L245 HydrophobicContact CG-CG 4.48Å; K241-L245 WeakPolarHBondContact O-CG 3.43Å; K241-L245 PolarHBondContact O-N 3.12Å |
| 242 | R | 97.4 | Very high | 96.6 | Very high | 31 Ų | 31 | 80.4 Ų | 80.4 | 12% | 0.117 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -58.3 | -43.8 | 176.9 | -174 | 174 | -178.9 | 168.9 | 8.5 | 112.8 | L215 V216 M218 L238 K239 Q240 L245 K246 | L215-R242 HydrophobicContact CD1-CB 4.11Å; L215-R242 HydrophobicContact CD1-CG 4.43Å; L215-R242 HydrophobicContact CD2-CB 4.23Å; L215-R242 HydrophobicContact CG-CB 3.91Å; L215-R242 HydrophobicContact CG-CG 4.21Å; L215-R242 WeakPolarHBondContact O-CD 3.44Å; L215-R242 WeakPolarHBondContact O-CG 3.4Å; L215-R242 VanDerWaalsContact O-CZ 3.3Å; L215-R242 PolarHBondContact O-NE 3.18Å; V216-R242 PolarHBondContact O-NH2 3Å; M218-R242 PolarHBondContact O-NH1 3.24Å; M218-R242 PolarHBondContact O-NH2 3.38Å; L238-R242 WeakPolarHBondContact O-CB 3.29Å; L238-R242 PolarHBondContact O-N 3.38Å; K239-R242 PolarHBondContact O-N 3.3Å; Q240-R242 VanDerWaalsContact C-N 3.31Å; Q240-R242 PolarHBondContact O-N 3Å; R242-L245 PolarHBondContact O-N 3.11Å; R242-K246 WeakPolarHBondContact O-CG 3.48Å; R242-K246 PolarHBondContact O-N 3.24Å |
| 243 | R | 98.1 | Very high | 96.8 | Very high | 148 Ų | 148 | 76.3 Ų | 76.3 | 56% | 0.558 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -63 | -44.8 | 177.2 | 177.8 | 54 | 163.5 | 164.9 | -12.4 | 111.4 | K239 Q240 K241 K246 N247 | K239-R243 PolarHBondContact O-N 3.35Å; Q240-R243 PolarHBondContact O-N 2.99Å; Q240-R243 VanDerWaalsContact O-N 3.11Å; K241-R243 PolarHBondContact O-N 3.22Å; R243-K246 PolarHBondContact O-N 3.05Å; R243-N247 PolarHBondContact NH1-OD1 3.29Å; R243-N247 WeakPolarHBondContact O-CB 3.41Å; R243-N247 VanDerWaalsContact O-CG 3.23Å; R243-N247 PolarHBondContact O-N 2.98Å; R243-N247 PolarHBondContact O-OD1 3.01Å |
| 244 | T | 98.2 | Very high | 97 | Very high | 84 Ų | 84 | 73.5 Ų | 73.5 | 52% | 0.515 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -60.6 | -44.8 | 176.7 | -59.7 | 0 | 0 | 0 | 0 | 111.7 | Q240 K241 N247 R248 | Q240-T244 PolarHBondContact O-N 3.44Å; Q240-T244 PolarHBondContact O-OG1 3.38Å; K241-T244 PolarHBondContact O-N 3.1Å; T244-N247 PolarHBondContact O-N 2.85Å; T244-R248 PolarHBondContact O-N 3.43Å |
| 245 | L | 98.1 | Very high | 97.3 | Very high | 23 Ų | 23 | 80.9 Ų | 80.9 | 12% | 0.12 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -65.2 | -43.2 | 177.4 | -67.5 | 171 | 0 | 0 | 0 | 112.6 | D212 L215 V216 K241 R242 N247 R248 G249 | D212-L245 HydrophobicContact CB-CD1 3.71Å; D212-L245 HydrophobicContact CB-CD2 4.18Å; D212-L245 VanDerWaalsContact OD2-CD2 3.31Å; D212-L245 WeakPolarHBondContact OD2-CD2 3.48Å; L215-L245 HydrophobicContact CD2-CD1 4.25Å; V216-L245 HydrophobicContact CG2-CB 3.39Å; V216-L245 HydrophobicContact CG2-CD1 4.17Å; V216-L245 HydrophobicContact CG2-CG 4.4Å; K241-L245 HydrophobicContact CG-CD1 4Å; K241-L245 HydrophobicContact CG-CG 4.48Å; K241-L245 WeakPolarHBondContact O-CG 3.43Å; K241-L245 PolarHBondContact O-N 3.12Å; R242-L245 PolarHBondContact O-N 3.11Å; L245-N247 VanDerWaalsContact C-N 3.32Å; L245-N247 PolarHBondContact O-N 3.28Å; L245-R248 WeakPolarHBondContact O-CB 3.35Å; L245-R248 PolarHBondContact O-N 3.2Å; L245-G249 PolarHBondContact O-N 3.41Å |
| 246 | K | 98.3 | Very high | 97.5 | Very high | 74 Ų | 74 | 86.2 Ų | 86.2 | 32% | 0.322 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -61.2 | -40 | 173.2 | -72.8 | -164.5 | 70.2 | 173.6 | 0 | 112.1 | V216 R242 R243 R248 G249 Y250 | V216-K246 HydrophobicContact CG1-CG 4.21Å; V216-K246 HydrophobicContact CG2-CG 4.42Å; R242-K246 WeakPolarHBondContact O-CG 3.48Å; R242-K246 PolarHBondContact O-N 3.24Å; R243-K246 PolarHBondContact O-N 3.05Å; K246-R248 VanDerWaalsContact C-N 3.34Å; K246-R248 PolarHBondContact O-N 3.39Å; K246-G249 PolarHBondContact O-N 2.75Å; K246-Y250 HydrophobicContact CB-CE2 4.28Å; K246-Y250 WeakPolarHBondContact CE-OH 3.46Å; K246-Y250 PolarHBondContact NZ-OH 3.07Å; K246-Y250 WeakPolarHBondContact O-CD2 3.37Å; K246-Y250 VanDerWaalsContact O-CG 3.27Å; K246-Y250 PolarHBondContact O-N 3.03Å |
| 247 | N | 98.4 | Very high | 97.7 | Very high | 66 Ų | 66 | 89 Ų | 89 | 35% | 0.353 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -66 | -34.1 | 176.8 | -71.7 | 1.9 | 0 | 0 | 0 | 112.6 | R243 T244 L245 Y250 A251 | R243-N247 PolarHBondContact NH1-OD1 3.29Å; R243-N247 WeakPolarHBondContact O-CB 3.41Å; R243-N247 VanDerWaalsContact O-CG 3.23Å; R243-N247 PolarHBondContact O-N 2.98Å; R243-N247 PolarHBondContact O-OD1 3.01Å; T244-N247 PolarHBondContact O-N 2.85Å; L245-N247 VanDerWaalsContact C-N 3.32Å; L245-N247 PolarHBondContact O-N 3.28Å; N247-Y250 PolarHBondContact O-N 3.31Å; N247-A251 WeakPolarHBondContact O-CB 3.33Å; N247-A251 PolarHBondContact O-N 3.37Å |
| 248 | R | 98.3 | Very high | 97.9 | Very high | 159 Ų | 159 | 93.9 Ų | 93.9 | 60% | 0.6 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -59.8 | -45 | 170.7 | 176.5 | 179.8 | -79.3 | 163.4 | -7.2 | 111.2 | T244 L245 K246 A251 Q252 | T244-R248 PolarHBondContact O-N 3.43Å; L245-R248 WeakPolarHBondContact O-CB 3.35Å; L245-R248 PolarHBondContact O-N 3.2Å; K246-R248 VanDerWaalsContact C-N 3.34Å; K246-R248 PolarHBondContact O-N 3.39Å; R248-A251 PolarHBondContact O-N 3.4Å; R248-Q252 PolarHBondContact O-N 3.42Å; R248-Q252 VanDerWaalsContact O-N 3.16Å |
| 249 | G | 98.1 | Very high | 98.1 | Very high | 26 Ų | 26 | 96.8 Ų | 96.8 | 27% | 0.268 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -61 | -46.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | L245 K246 A251 Q252 S253 | L245-G249 PolarHBondContact O-N 3.41Å; K246-G249 PolarHBondContact O-N 2.75Å; G249-A251 VanDerWaalsContact C-N 3.3Å; G249-A251 PolarHBondContact O-N 3.21Å; G249-Q252 WeakPolarHBondContact O-CB 3.4Å; G249-Q252 PolarHBondContact O-N 3.19Å; G249-Q252 VanDerWaalsContact O-N 3.1Å; G249-S253 PolarHBondContact O-N 2.95Å; G249-S253 PolarHBondContact O-OG 3.08Å |
| 250 | Y | 98.6 | Very high | 98.3 | Very high | 122 Ų | 122 | 96.3 Ų | 96.3 | 48% | 0.478 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -61 | -35.9 | 176.7 | -59.6 | -30.4 | 0 | 0 | 0 | 113.1 | K246 N247 S253 C254 | K246-Y250 HydrophobicContact CB-CE2 4.28Å; K246-Y250 WeakPolarHBondContact CE-OH 3.46Å; K246-Y250 PolarHBondContact NZ-OH 3.07Å; K246-Y250 WeakPolarHBondContact O-CD2 3.37Å; K246-Y250 VanDerWaalsContact O-CG 3.27Å; K246-Y250 PolarHBondContact O-N 3.03Å; N247-Y250 PolarHBondContact O-N 3.31Å; Y250-S253 PolarHBondContact O-N 2.89Å; Y250-C254 VanDerWaalsContact O-CB 3.26Å; Y250-C254 WeakPolarHBondContact O-CB 3.43Å; Y250-C254 PolarHBondContact O-N 3.4Å |
| 251 | A | 98.6 | Very high | 98.4 | Very high | 45 Ų | 45 | 96.3 Ų | 96.3 | 37% | 0.372 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -65.4 | -38.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | N247 R248 G249 R255 | N247-A251 WeakPolarHBondContact O-CB 3.33Å; N247-A251 PolarHBondContact O-N 3.37Å; R248-A251 PolarHBondContact O-N 3.4Å; G249-A251 VanDerWaalsContact C-N 3.3Å; G249-A251 PolarHBondContact O-N 3.21Å; A251-R255 VanDerWaalsContact O-CG 3.29Å; A251-R255 WeakPolarHBondContact O-CG 3.48Å; A251-R255 PolarHBondContact O-N 3.35Å; A251-R255 VanDerWaalsContact O-N 3.1Å |
| 252 | Q | 98.5 | Very high | 98.5 | Very high | 127 Ų | 127 | 100 Ų | 100 | 59% | 0.593 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -64.1 | -49.1 | 172.3 | -71.2 | 174.5 | -37.3 | 0 | 0 | 111.2 | R248 G249 C254 R255 F256 | R248-Q252 PolarHBondContact O-N 3.42Å; R248-Q252 VanDerWaalsContact O-N 3.16Å; G249-Q252 WeakPolarHBondContact O-CB 3.4Å; G249-Q252 PolarHBondContact O-N 3.19Å; G249-Q252 VanDerWaalsContact O-N 3.1Å; Q252-C254 VanDerWaalsContact C-N 3.3Å; Q252-C254 PolarHBondContact O-N 2.9Å; Q252-R255 PolarHBondContact O-N 3.23Å; Q252-F256 WeakPolarHBondContact O-CB 3.35Å; Q252-F256 PolarHBondContact O-N 3.23Å |
| 253 | S | 98.7 | Very high | 98.6 | Very high | 63 Ų | 63 | 102.5 Ų | 102.5 | 44% | 0.441 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -61.2 | -36.7 | 177.9 | -53.2 | 0 | 0 | 0 | 0 | 112.9 | G249 Y250 F256 K257 | G249-S253 PolarHBondContact O-N 2.95Å; G249-S253 PolarHBondContact O-OG 3.08Å; Y250-S253 PolarHBondContact O-N 2.89Å; S253-F256 PolarHBondContact O-N 3.06Å; S253-K257 WeakPolarHBondContact O-CB 3.33Å; S253-K257 WeakPolarHBondContact O-CG 3.29Å; S253-K257 PolarHBondContact O-N 3.45Å |
| 254 | C | 98.8 | Very high | 98.6 | Very high | 67 Ų | 67 | 98.8 Ų | 98.8 | 45% | 0.453 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -64 | -47.5 | 175.3 | 179.8 | 0 | 0 | 0 | 0 | 111.7 | Y250 Q252 K257 R258 | Y250-C254 VanDerWaalsContact O-CB 3.26Å; Y250-C254 WeakPolarHBondContact O-CB 3.43Å; Y250-C254 PolarHBondContact O-N 3.4Å; Q252-C254 VanDerWaalsContact C-N 3.3Å; Q252-C254 PolarHBondContact O-N 2.9Å; C254-K257 PolarHBondContact O-N 3.41Å; C254-R258 WeakPolarHBondContact O-CB 3.31Å; C254-R258 PolarHBondContact O-N 3.32Å |
| 255 | R | 98.8 | Very high | 98.6 | Very high | 183 Ų | 183 | 99.3 Ų | 99.3 | 69% | 0.691 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -59.9 | -46.6 | 174.9 | -70.3 | 168.5 | -177.4 | -175.4 | -0.3 | 111.4 | A251 Q252 R258 V259 | A251-R255 VanDerWaalsContact O-CG 3.29Å; A251-R255 WeakPolarHBondContact O-CG 3.48Å; A251-R255 PolarHBondContact O-N 3.35Å; A251-R255 VanDerWaalsContact O-N 3.1Å; Q252-R255 PolarHBondContact O-N 3.23Å; R255-R258 PolarHBondContact O-N 3.12Å; R255-V259 WeakPolarHBondContact O-CG2 3.49Å; R255-V259 PolarHBondContact O-N 3.3Å |
| 256 | F | 98.8 | Very high | 98.7 | Very high | 140 Ų | 140 | 102.4 Ų | 102.4 | 61% | 0.614 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -58.5 | -52.4 | 177.6 | 179.1 | -95.5 | 0 | 0 | 0 | 111.9 | Q252 S253 R258 V259 Q260 | Q252-F256 WeakPolarHBondContact O-CB 3.35Å; Q252-F256 PolarHBondContact O-N 3.23Å; S253-F256 PolarHBondContact O-N 3.06Å; F256-R258 VanDerWaalsContact C-N 3.33Å; F256-R258 PolarHBondContact O-N 2.91Å; F256-V259 PolarHBondContact O-N 3.24Å; F256-Q260 WeakPolarHBondContact O-CB 3.4Å; F256-Q260 PolarHBondContact O-N 3.43Å |
| 257 | K | 98.8 | Very high | 98.7 | Very high | 152 Ų | 152 | 100.3 Ų | 100.3 | 66% | 0.661 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -58.8 | -42.1 | 178.5 | -75.2 | -175.1 | 177.4 | -167.5 | 0 | 112.5 | S253 C254 Q260 Q261 | S253-K257 WeakPolarHBondContact O-CB 3.33Å; S253-K257 WeakPolarHBondContact O-CG 3.29Å; S253-K257 PolarHBondContact O-N 3.45Å; C254-K257 PolarHBondContact O-N 3.41Å; K257-Q260 PolarHBondContact O-N 3.38Å; K257-Q261 WeakPolarHBondContact O-CB 3.47Å; K257-Q261 PolarHBondContact O-N 3.17Å |
| 258 | R | 98.8 | Very high | 98.7 | Very high | 179 Ų | 179 | 101.6 Ų | 101.6 | 68% | 0.675 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -63.7 | -44.5 | 177.5 | -173.5 | -176.8 | -63 | -173.9 | -2.5 | 112.2 | C254 R255 F256 R262 | C254-R258 WeakPolarHBondContact O-CB 3.31Å; C254-R258 PolarHBondContact O-N 3.32Å; R255-R258 PolarHBondContact O-N 3.12Å; F256-R258 VanDerWaalsContact C-N 3.33Å; F256-R258 PolarHBondContact O-N 2.91Å; R258-R262 PolarHBondContact O-N 3.12Å |
| 259 | V | 98.8 | Very high | 98.7 | Very high | 62 Ų | 62 | 100.3 Ų | 100.3 | 38% | 0.376 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -66.3 | -42.6 | 177.6 | 169.7 | 0 | 0 | 0 | 0 | 110.8 | R255 F256 R262 H263 | R255-V259 WeakPolarHBondContact O-CG2 3.49Å; R255-V259 PolarHBondContact O-N 3.3Å; F256-V259 PolarHBondContact O-N 3.24Å; V259-R262 WeakPolarHBondContact O-CB 3.38Å; V259-R262 PolarHBondContact O-N 3.13Å; V259-H263 WeakPolarHBondContact CG1-CE1 3.45Å; V259-H263 VanDerWaalsContact O-CG 3.29Å; V259-H263 PolarHBondContact O-N 3.05Å |
| 260 | Q | 98.8 | Very high | 98.7 | Very high | 94 Ų | 94 | 102.1 Ų | 102.1 | 44% | 0.439 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.6 | -45.3 | 176.4 | -170.1 | 64.4 | 20.6 | 0 | 0 | 111.9 | F256 K257 R262 H263 V264 | F256-Q260 WeakPolarHBondContact O-CB 3.4Å; F256-Q260 PolarHBondContact O-N 3.43Å; K257-Q260 PolarHBondContact O-N 3.38Å; Q260-R262 VanDerWaalsContact C-N 3.31Å; Q260-R262 PolarHBondContact O-N 3.44Å; Q260-H263 PolarHBondContact O-N 3.46Å; Q260-V264 WeakPolarHBondContact O-CG2 3.26Å; Q260-V264 PolarHBondContact O-N 3.4Å |
| 261 | Q | 98.8 | Very high | 98.8 | Very high | 129 Ų | 129 | 101.8 Ų | 101.8 | 60% | 0.603 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -60.8 | -41 | 175.9 | -174.8 | 178.2 | 12.5 | 0 | 0 | 111.5 | K257 V264 L265 | K257-Q261 WeakPolarHBondContact O-CB 3.47Å; K257-Q261 PolarHBondContact O-N 3.17Å; Q261-V264 PolarHBondContact O-N 3.1Å; Q261-L265 HydrophobicContact CG-CD1 4.23Å; Q261-L265 WeakPolarHBondContact O-CG 3.22Å; Q261-L265 PolarHBondContact O-N 2.74Å |
| 262 | R | 98.8 | Very high | 98.8 | Very high | 125 Ų | 125 | 104.6 Ų | 104.6 | 47% | 0.472 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -59.7 | -47.9 | 173.8 | -170.2 | -165.2 | 64.5 | -161.3 | -7.3 | 111.4 | R258 V259 Q260 V264 L265 E266 | R258-R262 PolarHBondContact O-N 3.12Å; V259-R262 WeakPolarHBondContact O-CB 3.38Å; V259-R262 PolarHBondContact O-N 3.13Å; Q260-R262 VanDerWaalsContact C-N 3.31Å; Q260-R262 PolarHBondContact O-N 3.44Å; R262-V264 VanDerWaalsContact C-N 3.3Å; R262-V264 PolarHBondContact O-N 3.42Å; R262-L265 PolarHBondContact O-N 3.49Å; R262-E266 WeakPolarHBondContact CD-OE1 3.48Å; R262-E266 HydrophobicContact CG-CG 4.28Å; R262-E266 WeakPolarHBondContact CG-OE1 3.42Å; R262-E266 IonicContact NE-OE1 2.83Å; R262-E266 PolarHBondContact NE-OE1 2.97Å; R262-E266 IonicContact NE-OE2 3.37Å; R262-E266 WeakPolarHBondContact O-CB 3.41Å; R262-E266 VanDerWaalsContact O-CG 3.29Å; R262-E266 WeakPolarHBondContact O-CG 3.46Å; R262-E266 PolarHBondContact O-N 3.26Å |
| 263 | H | 98.9 | Very high | 98.8 | Very high | 85 Ų | 85 | 103.4 Ų | 103.4 | 39% | 0.394 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.2 | -35.8 | 178.8 | -62.4 | 162.9 | 0 | 0 | 0 | 112.9 | V259 Q260 E266 G267 | V259-H263 WeakPolarHBondContact CG1-CE1 3.45Å; V259-H263 VanDerWaalsContact O-CG 3.29Å; V259-H263 PolarHBondContact O-N 3.05Å; Q260-H263 PolarHBondContact O-N 3.46Å; H263-E266 IonicContact CD2-OE2 2.9Å; H263-E266 PolarHBondContact CD2-OE2 3.36Å; H263-G267 PolarHBondContact O-N 2.94Å |
| 264 | V | 98.8 | Very high | 98.8 | Very high | 69 Ų | 69 | 106.5 Ų | 106.5 | 42% | 0.418 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.7 | -51.7 | 173.5 | 170.9 | 0 | 0 | 0 | 0 | 110.5 | Q260 Q261 R262 E266 G267 E268 | Q260-V264 WeakPolarHBondContact O-CG2 3.26Å; Q260-V264 PolarHBondContact O-N 3.4Å; Q261-V264 PolarHBondContact O-N 3.1Å; R262-V264 VanDerWaalsContact C-N 3.3Å; R262-V264 PolarHBondContact O-N 3.42Å; V264-E266 VanDerWaalsContact C-N 3.33Å; V264-E266 PolarHBondContact O-N 3.45Å; V264-G267 WeakPolarHBondContact O-CA 3.49Å; V264-G267 PolarHBondContact O-N 3.44Å; V264-G267 VanDerWaalsContact O-N 3.08Å; V264-E268 WeakPolarHBondContact CG1-OE1 3.38Å; V264-E268 WeakPolarHBondContact O-CG 3.35Å; V264-E268 PolarHBondContact O-N 2.8Å |
| 265 | L | 98.8 | Very high | 98.8 | Very high | 95 Ų | 95 | 108.4 Ų | 108.4 | 50% | 0.497 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.4 | -35.3 | 178.7 | -65.9 | 170.2 | 0 | 0 | 0 | 112.9 | Q261 R262 K269 | Q261-L265 HydrophobicContact CG-CD1 4.23Å; Q261-L265 WeakPolarHBondContact O-CG 3.22Å; Q261-L265 PolarHBondContact O-N 2.74Å; R262-L265 PolarHBondContact O-N 3.49Å; L265-K269 VanDerWaalsContact O-CB 3.26Å; L265-K269 WeakPolarHBondContact O-CB 3.47Å; L265-K269 PolarHBondContact O-N 3.04Å |
| 266 | E | 98.8 | Very high | 98.8 | Very high | 88 Ų | 88 | 103.4 Ų | 103.4 | 41% | 0.411 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -66.1 | -36.8 | 173.2 | -74.7 | 165.3 | 167.6 | 0 | 0 | 111.7 | R262 H263 V264 T270 | R262-E266 WeakPolarHBondContact CD-OE1 3.48Å; R262-E266 HydrophobicContact CG-CG 4.28Å; R262-E266 WeakPolarHBondContact CG-OE1 3.42Å; R262-E266 IonicContact NE-OE1 2.83Å; R262-E266 PolarHBondContact NE-OE1 2.97Å; R262-E266 IonicContact NE-OE2 3.37Å; R262-E266 WeakPolarHBondContact O-CB 3.41Å; R262-E266 VanDerWaalsContact O-CG 3.29Å; R262-E266 WeakPolarHBondContact O-CG 3.46Å; R262-E266 PolarHBondContact O-N 3.26Å; H263-E266 IonicContact CD2-OE2 2.9Å; H263-E266 PolarHBondContact CD2-OE2 3.36Å; V264-E266 VanDerWaalsContact C-N 3.33Å; V264-E266 PolarHBondContact O-N 3.45Å; E266-T270 WeakPolarHBondContact O-CB 3.33Å; E266-T270 PolarHBondContact O-N 3.44Å; E266-T270 VanDerWaalsContact O-N 3.12Å; E266-T270 PolarHBondContact O-OG1 2.99Å |
| 267 | G | 98.8 | Very high | 98.8 | Very high | 30 Ų | 30 | 101.1 Ų | 101.1 | 31% | 0.309 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -65.4 | -51.3 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | H263 V264 K269 T270 Q271 | H263-G267 PolarHBondContact O-N 2.94Å; V264-G267 WeakPolarHBondContact O-CA 3.49Å; V264-G267 PolarHBondContact O-N 3.44Å; V264-G267 VanDerWaalsContact O-N 3.08Å; G267-K269 PolarHBondContact O-N 3.07Å; G267-T270 WeakPolarHBondContact O-CB 3.45Å; G267-T270 PolarHBondContact O-N 2.96Å; G267-Q271 WeakPolarHBondContact O-CG 3.47Å; G267-Q271 PolarHBondContact O-N 3.38Å |
| 268 | E | 98.8 | Very high | 98.8 | Very high | 93 Ų | 93 | 99.2 Ų | 99.2 | 44% | 0.435 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -57.7 | -46.5 | 176.8 | -71.5 | 171.3 | -174.7 | 0 | 0 | 111.6 | V264 T270 Q271 L272 | V264-E268 WeakPolarHBondContact CG1-OE1 3.38Å; V264-E268 WeakPolarHBondContact O-CG 3.35Å; V264-E268 PolarHBondContact O-N 2.8Å; E268-T270 VanDerWaalsContact C-N 3.27Å; E268-T270 PolarHBondContact O-N 2.97Å; E268-Q271 PolarHBondContact O-N 3.15Å; E268-L272 WeakPolarHBondContact O-CG 3.4Å; E268-L272 PolarHBondContact O-N 3.27Å |
| 269 | K | 98.7 | Very high | 98.8 | Very high | 133 Ų | 133 | 95.7 Ų | 95.7 | 58% | 0.578 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -54.1 | -45.6 | 173 | -179.4 | -170.9 | 173.4 | -177.9 | 0 | 111.3 | L265 G267 L272 M273 | L265-K269 VanDerWaalsContact O-CB 3.26Å; L265-K269 WeakPolarHBondContact O-CB 3.47Å; L265-K269 PolarHBondContact O-N 3.04Å; G267-K269 PolarHBondContact O-N 3.07Å; K269-L272 PolarHBondContact O-N 2.86Å; K269-M273 HydrophobicContact CD-CE 4.49Å; K269-M273 HydrophobicContact CG-CE 4.13Å; K269-M273 HydrophobicContact CG-SD 4.28Å; K269-M273 VanDerWaalsContact O-CG 3.28Å; K269-M273 WeakPolarHBondContact O-CG 3.28Å; K269-M273 PolarHBondContact O-N 3.13Å |
| 270 | T | 98.8 | Very high | 98.8 | Very high | 64 Ų | 64 | 98.4 Ų | 98.4 | 39% | 0.393 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -64.9 | -42.8 | -179 | -56.7 | 0 | 0 | 0 | 0 | 111.6 | E266 G267 E268 M273 Q274 | E266-T270 WeakPolarHBondContact O-CB 3.33Å; E266-T270 PolarHBondContact O-N 3.44Å; E266-T270 VanDerWaalsContact O-N 3.12Å; E266-T270 PolarHBondContact O-OG1 2.99Å; G267-T270 WeakPolarHBondContact O-CB 3.45Å; G267-T270 PolarHBondContact O-N 2.96Å; E268-T270 VanDerWaalsContact C-N 3.27Å; E268-T270 PolarHBondContact O-N 2.97Å; T270-M273 PolarHBondContact O-N 2.78Å; T270-Q274 WeakPolarHBondContact O-CG 3.26Å; T270-Q274 PolarHBondContact O-N 2.69Å; T270-Q274 VanDerWaalsContact O-N 3.1Å |
| 271 | Q | 98.8 | Very high | 98.8 | Very high | 115 Ų | 115 | 99 Ų | 99 | 54% | 0.537 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.1 | -41.1 | 175.8 | -69.4 | 174.3 | -6.4 | 0 | 0 | 112.6 | G267 E268 Q274 Q275 | G267-Q271 WeakPolarHBondContact O-CG 3.47Å; G267-Q271 PolarHBondContact O-N 3.38Å; E268-Q271 PolarHBondContact O-N 3.15Å; Q271-Q274 PolarHBondContact O-N 3.12Å; Q271-Q275 WeakPolarHBondContact O-CG 3.46Å; Q271-Q275 PolarHBondContact O-N 3.36Å; Q271-Q275 PolarHBondContact O-NE2 3.11Å |
| 272 | L | 98.8 | Very high | 98.8 | Very high | 103 Ų | 103 | 95.7 Ų | 95.7 | 54% | 0.539 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -68 | -40.5 | 177.5 | -71.1 | 170.5 | 0 | 0 | 0 | 111.9 | E268 K269 Q274 Q275 V276 | E268-L272 WeakPolarHBondContact O-CG 3.4Å; E268-L272 PolarHBondContact O-N 3.27Å; K269-L272 PolarHBondContact O-N 2.86Å; L272-Q274 VanDerWaalsContact C-N 3.31Å; L272-Q274 PolarHBondContact O-N 3.39Å; L272-Q275 PolarHBondContact O-N 3.19Å; L272-V276 WeakPolarHBondContact O-CG2 3.45Å; L272-V276 PolarHBondContact O-N 3.49Å |
| 273 | M | 98.7 | Very high | 98.8 | Very high | 103 Ų | 103 | 94.8 Ų | 94.8 | 51% | 0.507 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -60.4 | -40.5 | 173.8 | -71.9 | -174.4 | -52.8 | 0 | 0 | 111.9 | K269 T270 V276 E277 | K269-M273 HydrophobicContact CD-CE 4.49Å; K269-M273 HydrophobicContact CG-CE 4.13Å; K269-M273 HydrophobicContact CG-SD 4.28Å; K269-M273 VanDerWaalsContact O-CG 3.28Å; K269-M273 WeakPolarHBondContact O-CG 3.28Å; K269-M273 PolarHBondContact O-N 3.13Å; T270-M273 PolarHBondContact O-N 2.78Å; M273-V276 PolarHBondContact O-N 2.94Å; M273-E277 WeakPolarHBondContact O-CB 3.29Å; M273-E277 PolarHBondContact O-N 3.13Å |
| 274 | Q | 98.8 | Very high | 98.8 | Very high | 127 Ų | 127 | 94 Ų | 94 | 59% | 0.593 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -64.6 | -41.9 | 175.4 | -72.5 | 171.5 | -3.8 | 0 | 0 | 112.5 | T270 Q271 L272 E277 H278 | T270-Q274 WeakPolarHBondContact O-CG 3.26Å; T270-Q274 PolarHBondContact O-N 2.69Å; T270-Q274 VanDerWaalsContact O-N 3.1Å; Q271-Q274 PolarHBondContact O-N 3.12Å; L272-Q274 VanDerWaalsContact C-N 3.31Å; L272-Q274 PolarHBondContact O-N 3.39Å; Q274-E277 PolarHBondContact O-N 2.87Å; Q274-H278 WeakPolarHBondContact O-CB 3.49Å; Q274-H278 PolarHBondContact O-N 3.03Å |
| 275 | Q | 98.8 | Very high | 98.8 | Very high | 108 Ų | 108 | 94.8 Ų | 94.8 | 51% | 0.505 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -63.1 | -44.3 | 176 | -74.6 | 170.4 | 73.3 | 0 | 0 | 112.2 | Q271 L272 E277 H278 L279 | Q271-Q275 WeakPolarHBondContact O-CG 3.46Å; Q271-Q275 PolarHBondContact O-N 3.36Å; Q271-Q275 PolarHBondContact O-NE2 3.11Å; L272-Q275 PolarHBondContact O-N 3.19Å; Q275-E277 VanDerWaalsContact C-N 3.32Å; Q275-E277 PolarHBondContact O-N 3.49Å; Q275-H278 PolarHBondContact O-N 3.44Å; Q275-L279 WeakPolarHBondContact O-CB 3.49Å; Q275-L279 WeakPolarHBondContact O-CG 3.36Å; Q275-L279 PolarHBondContact O-N 3.32Å |
| 276 | V | 98.9 | Very high | 98.8 | Very high | 77 Ų | 77 | 94.7 Ų | 94.7 | 47% | 0.467 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -60 | -43.2 | 175.9 | 168.6 | 0 | 0 | 0 | 0 | 111.1 | L272 M273 L279 K280 | L272-V276 WeakPolarHBondContact O-CG2 3.45Å; L272-V276 PolarHBondContact O-N 3.49Å; M273-V276 PolarHBondContact O-N 2.94Å; V276-L279 PolarHBondContact O-N 3.23Å; V276-K280 HydrophobicContact CG1-CD 4.26Å; V276-K280 VanDerWaalsContact O-CG 3.3Å; V276-K280 WeakPolarHBondContact O-CG 3.5Å; V276-K280 PolarHBondContact O-N 2.88Å |
| 277 | E | 98.8 | Very high | 98.8 | Very high | 92 Ų | 92 | 93 Ų | 93 | 43% | 0.43 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -67.3 | -42.8 | 179.1 | -175.1 | 50.8 | -144.8 | 0 | 0 | 112.1 | M273 Q274 Q275 L279 K280 Q281 | M273-E277 WeakPolarHBondContact O-CB 3.29Å; M273-E277 PolarHBondContact O-N 3.13Å; Q274-E277 PolarHBondContact O-N 2.87Å; Q275-E277 VanDerWaalsContact C-N 3.32Å; Q275-E277 PolarHBondContact O-N 3.49Å; E277-L279 PolarHBondContact O-N 3.35Å; E277-K280 PolarHBondContact O-N 3.48Å; E277-Q281 WeakPolarHBondContact O-CG 3.35Å; E277-Q281 PolarHBondContact O-N 3Å; E277-Q281 VanDerWaalsContact O-N 3.11Å; E277-Q281 PolarHBondContact OE1-NE2 3.44Å |
| 278 | H | 98.8 | Very high | 98.8 | Very high | 113 Ų | 113 | 99.7 Ų | 99.7 | 52% | 0.523 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -59.4 | -46.6 | 174 | 177.9 | 56.7 | 0 | 0 | 0 | 112.3 | Q274 Q275 K280 Q281 E282 | Q274-H278 WeakPolarHBondContact O-CB 3.49Å; Q274-H278 PolarHBondContact O-N 3.03Å; Q275-H278 PolarHBondContact O-N 3.44Å; H278-K280 PolarHBondContact O-N 3.37Å; H278-Q281 WeakPolarHBondContact O-CB 3.43Å; H278-Q281 PolarHBondContact O-N 2.81Å; H278-E282 PolarHBondContact O-N 3.12Å |
| 279 | L | 98.8 | Very high | 98.7 | Very high | 105 Ų | 105 | 98.9 Ų | 98.9 | 55% | 0.55 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -65.3 | -35.7 | 178.5 | -70.6 | 172.7 | 0 | 0 | 0 | 112.5 | Q275 V276 E277 Q281 E282 I283 | Q275-L279 WeakPolarHBondContact O-CB 3.49Å; Q275-L279 WeakPolarHBondContact O-CG 3.36Å; Q275-L279 PolarHBondContact O-N 3.32Å; V276-L279 PolarHBondContact O-N 3.23Å; E277-L279 PolarHBondContact O-N 3.35Å; L279-Q281 VanDerWaalsContact C-N 3.33Å; L279-Q281 PolarHBondContact O-N 3.08Å; L279-E282 PolarHBondContact O-N 2.85Å; L279-I283 WeakPolarHBondContact O-CB 3.49Å; L279-I283 VanDerWaalsContact O-CG1 3.27Å; L279-I283 WeakPolarHBondContact O-CG1 3.3Å; L279-I283 PolarHBondContact O-N 2.7Å |
| 280 | K | 98.7 | Very high | 98.7 | Very high | 118 Ų | 118 | 99.5 Ų | 99.5 | 51% | 0.513 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -62.2 | -39.6 | 172.5 | -77.5 | 173.5 | 178.6 | -179.4 | 0 | 112.6 | V276 E277 H278 S284 | V276-K280 HydrophobicContact CG1-CD 4.26Å; V276-K280 VanDerWaalsContact O-CG 3.3Å; V276-K280 WeakPolarHBondContact O-CG 3.5Å; V276-K280 PolarHBondContact O-N 2.88Å; E277-K280 PolarHBondContact O-N 3.48Å; H278-K280 PolarHBondContact O-N 3.37Å; K280-S284 WeakPolarHBondContact O-CB 3.39Å; K280-S284 PolarHBondContact O-N 3.09Å; K280-S284 PolarHBondContact O-OG 2.83Å |
| 281 | Q | 98.8 | Very high | 98.7 | Very high | 106 Ų | 106 | 99.5 Ų | 99.5 | 50% | 0.495 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -66.7 | -42.1 | 177.1 | -68.5 | 170.4 | 17.3 | 0 | 0 | 110.9 | E277 H278 L279 S284 R285 | E277-Q281 WeakPolarHBondContact O-CG 3.35Å; E277-Q281 PolarHBondContact O-N 3Å; E277-Q281 VanDerWaalsContact O-N 3.11Å; E277-Q281 PolarHBondContact OE1-NE2 3.44Å; H278-Q281 WeakPolarHBondContact O-CB 3.43Å; H278-Q281 PolarHBondContact O-N 2.81Å; L279-Q281 VanDerWaalsContact C-N 3.33Å; L279-Q281 PolarHBondContact O-N 3.08Å; Q281-S284 CarbonylContact O-C 3.58Å; Q281-S284 PolarHBondContact O-N 2.57Å; Q281-R285 PolarHBondContact O-N 3.32Å |
| 282 | E | 98.7 | Very high | 98.7 | Very high | 61 Ų | 61 | 96 Ų | 96 | 29% | 0.285 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -66 | -42.5 | 175.3 | -76.6 | -65.3 | 92.5 | 0 | 0 | 112.9 | H278 L279 S284 R285 L286 | H278-E282 PolarHBondContact O-N 3.12Å; L279-E282 PolarHBondContact O-N 2.85Å; E282-S284 VanDerWaalsContact C-N 3.29Å; E282-S284 PolarHBondContact O-N 2.9Å; E282-R285 WeakPolarHBondContact O-CB 3.27Å; E282-R285 PolarHBondContact O-N 3.18Å; E282-R285 VanDerWaalsContact O-N 3.12Å; E282-R285 IonicContact OE1-CZ 3.33Å; E282-R285 IonicContact OE1-NE 3.38Å; E282-R285 PolarHBondContact OE1-NE 3.34Å; E282-R285 IonicContact OE1-NH2 2.74Å; E282-R285 IonicContact OE2-CZ 3.1Å; E282-R285 IonicContact OE2-NE 2.66Å; E282-R285 PolarHBondContact OE2-NE 2.92Å; E282-R285 IonicContact OE2-NH2 3.06Å; E282-R285 PolarHBondContact OE2-NH2 2.86Å; E282-L286 WeakPolarHBondContact O-CG 3.08Å; E282-L286 PolarHBondContact O-N 3.07Å |
| 283 | I | 98.7 | Very high | 98.7 | Very high | 106 Ų | 106 | 98.5 Ų | 98.5 | 54% | 0.544 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -57.7 | -44.7 | 171.1 | -70.4 | 164.5 | 0 | 0 | 0 | 110.4 | L279 R285 L286 V287 | L279-I283 WeakPolarHBondContact O-CB 3.49Å; L279-I283 VanDerWaalsContact O-CG1 3.27Å; L279-I283 WeakPolarHBondContact O-CG1 3.3Å; L279-I283 PolarHBondContact O-N 2.7Å; I283-R285 VanDerWaalsContact C-N 3.27Å; I283-R285 PolarHBondContact O-N 3.01Å; I283-L286 PolarHBondContact O-N 3.39Å; I283-V287 HydrophobicContact CG2-CG2 4.31Å; I283-V287 WeakPolarHBondContact O-CB 3.49Å; I283-V287 VanDerWaalsContact O-CG2 3.29Å; I283-V287 WeakPolarHBondContact O-CG2 3.27Å; I283-V287 PolarHBondContact O-N 3.42Å |
| 284 | S | 98.8 | Very high | 98.6 | Very high | 67 Ų | 67 | 99.6 Ų | 99.6 | 47% | 0.469 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -67.6 | -23.8 | 178.3 | -56.9 | 0 | 0 | 0 | 0 | 113.5 | K280 Q281 E282 R288 | K280-S284 WeakPolarHBondContact O-CB 3.39Å; K280-S284 PolarHBondContact O-N 3.09Å; K280-S284 PolarHBondContact O-OG 2.83Å; Q281-S284 CarbonylContact O-C 3.58Å; Q281-S284 PolarHBondContact O-N 2.57Å; E282-S284 VanDerWaalsContact C-N 3.29Å; E282-S284 PolarHBondContact O-N 2.9Å; S284-R288 WeakPolarHBondContact O-CG 3.28Å; S284-R288 PolarHBondContact O-NE 3.37Å |
| 285 | R | 98.8 | Very high | 98.6 | Very high | 87 Ų | 87 | 98.6 Ų | 98.6 | 33% | 0.328 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -75.4 | -52.7 | 170 | -176.9 | 178.9 | 67.8 | 79.6 | -2.8 | 110.6 | Q281 E282 I283 V287 R288 E289 | Q281-R285 PolarHBondContact O-N 3.32Å; E282-R285 WeakPolarHBondContact O-CB 3.27Å; E282-R285 PolarHBondContact O-N 3.18Å; E282-R285 VanDerWaalsContact O-N 3.12Å; E282-R285 IonicContact OE1-CZ 3.33Å; E282-R285 IonicContact OE1-NE 3.38Å; E282-R285 PolarHBondContact OE1-NE 3.34Å; E282-R285 IonicContact OE1-NH2 2.74Å; E282-R285 IonicContact OE2-CZ 3.1Å; E282-R285 IonicContact OE2-NE 2.66Å; E282-R285 PolarHBondContact OE2-NE 2.92Å; E282-R285 IonicContact OE2-NH2 3.06Å; E282-R285 PolarHBondContact OE2-NH2 2.86Å; I283-R285 VanDerWaalsContact C-N 3.27Å; I283-R285 PolarHBondContact O-N 3.01Å; R285-V287 VanDerWaalsContact C-N 3.32Å; R285-V287 PolarHBondContact O-N 3.12Å; R285-R288 PolarHBondContact O-N 3.36Å; R285-R288 VanDerWaalsContact O-N 3.12Å; R285-E289 VanDerWaalsContact CG-OE1 3.28Å; R285-E289 WeakPolarHBondContact CG-OE1 3.29Å; R285-E289 IonicContact CZ-OE1 3.76Å; R285-E289 VanDerWaalsContact NH1-CD 3.25Å; R285-E289 IonicContact NH1-OE1 3.91Å; R285-E289 PolarHBondContact NH1-OE1 2.95Å; R285-E289 IonicContact NH1-OE2 2.66Å; R285-E289 PolarHBondContact NH1-OE2 3.25Å; R285-E289 VanDerWaalsContact NH1-OE2 3.09Å; R285-E289 PolarHBondContact O-N 2.91Å |
| 286 | L | 98.7 | Very high | 98.5 | Very high | 92 Ų | 92 | 99.2 Ų | 99.2 | 48% | 0.482 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -62.1 | -35.4 | -179 | -68.4 | 172.4 | 0 | 0 | 0 | 113 | E282 I283 E289 R290 | E282-L286 WeakPolarHBondContact O-CG 3.08Å; E282-L286 PolarHBondContact O-N 3.07Å; I283-L286 PolarHBondContact O-N 3.39Å; L286-E289 PolarHBondContact O-N 2.97Å; L286-R290 VanDerWaalsContact O-CB 3.27Å; L286-R290 WeakPolarHBondContact O-CB 3.39Å; L286-R290 PolarHBondContact O-N 3.26Å |
| 287 | V | 98.8 | Very high | 98.3 | Very high | 52 Ų | 52 | 102.4 Ų | 102.4 | 32% | 0.315 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -59.9 | -47.4 | 172.5 | 161.8 | 0 | 0 | 0 | 0 | 111.3 | I283 R285 E289 R290 D291 | I283-V287 HydrophobicContact CG2-CG2 4.31Å; I283-V287 WeakPolarHBondContact O-CB 3.49Å; I283-V287 VanDerWaalsContact O-CG2 3.29Å; I283-V287 WeakPolarHBondContact O-CG2 3.27Å; I283-V287 PolarHBondContact O-N 3.42Å; R285-V287 VanDerWaalsContact C-N 3.32Å; R285-V287 PolarHBondContact O-N 3.12Å; V287-E289 PolarHBondContact O-N 2.77Å; V287-R290 PolarHBondContact O-N 3.27Å; V287-D291 WeakPolarHBondContact O-CB 3.36Å; V287-D291 PolarHBondContact O-N 3.31Å |
| 288 | R | 98.7 | Very high | 98.2 | Very high | 171 Ų | 171 | 102.1 Ų | 102.1 | 65% | 0.645 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -65.2 | -38.6 | 177.5 | -71.9 | 179.1 | -70.2 | 144.4 | -3.3 | 112.3 | S284 R285 D291 A292 | S284-R288 WeakPolarHBondContact O-CG 3.28Å; S284-R288 PolarHBondContact O-NE 3.37Å; R285-R288 PolarHBondContact O-N 3.36Å; R285-R288 VanDerWaalsContact O-N 3.12Å; R288-D291 PolarHBondContact O-N 2.84Å; R288-A292 WeakPolarHBondContact O-CB 3.34Å; R288-A292 PolarHBondContact O-N 2.87Å |
| 289 | E | 98.6 | Very high | 98 | Very high | 77 Ų | 77 | 101.6 Ų | 101.6 | 36% | 0.36 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -65.2 | -48.2 | 175.9 | -72.7 | 171.2 | -165.3 | 0 | 0 | 111.4 | R285 L286 V287 D291 A292 Y293 | R285-E289 VanDerWaalsContact CG-OE1 3.28Å; R285-E289 WeakPolarHBondContact CG-OE1 3.29Å; R285-E289 IonicContact CZ-OE1 3.76Å; R285-E289 VanDerWaalsContact NH1-CD 3.25Å; R285-E289 IonicContact NH1-OE1 3.91Å; R285-E289 PolarHBondContact NH1-OE1 2.95Å; R285-E289 IonicContact NH1-OE2 2.66Å; R285-E289 PolarHBondContact NH1-OE2 3.25Å; R285-E289 VanDerWaalsContact NH1-OE2 3.09Å; R285-E289 PolarHBondContact O-N 2.91Å; L286-E289 PolarHBondContact O-N 2.97Å; V287-E289 PolarHBondContact O-N 2.77Å; E289-D291 VanDerWaalsContact C-N 3.33Å; E289-D291 PolarHBondContact O-N 2.99Å; E289-A292 PolarHBondContact O-N 3.39Å; E289-Y293 WeakPolarHBondContact O-CD2 3.43Å; E289-Y293 PolarHBondContact O-N 3.48Å |
| 290 | R | 98.6 | Very high | 97.7 | Very high | 145 Ų | 145 | 102.9 Ų | 102.9 | 55% | 0.547 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -53.2 | -49.2 | 173.3 | 178.7 | -158.8 | 69.9 | -164 | -2.8 | 111.3 | L286 V287 Y293 K294 | L286-R290 VanDerWaalsContact O-CB 3.27Å; L286-R290 WeakPolarHBondContact O-CB 3.39Å; L286-R290 PolarHBondContact O-N 3.26Å; V287-R290 PolarHBondContact O-N 3.27Å; R290-Y293 PolarHBondContact O-N 3.38Å; R290-K294 WeakPolarHBondContact O-CB 3.39Å; R290-K294 PolarHBondContact O-N 2.99Å |
| 291 | D | 98.4 | Very high | 97.5 | Very high | 65 Ų | 65 | 100.8 Ų | 100.8 | 35% | 0.348 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -69.1 | -36.7 | -175.9 | -65.9 | -17.1 | 0 | 0 | 0 | 111.6 | V287 R288 E289 K294 E295 | V287-D291 WeakPolarHBondContact O-CB 3.36Å; V287-D291 PolarHBondContact O-N 3.31Å; R288-D291 PolarHBondContact O-N 2.84Å; E289-D291 VanDerWaalsContact C-N 3.33Å; E289-D291 PolarHBondContact O-N 2.99Å; D291-K294 PolarHBondContact O-N 3.5Å; D291-E295 WeakPolarHBondContact O-CB 3.32Å; D291-E295 PolarHBondContact O-N 3.07Å |
| 292 | A | 98.4 | Very high | 97 | Very high | 42 Ų | 42 | 98.9 Ų | 98.9 | 35% | 0.347 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -66.3 | -35.6 | 172.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | R288 E289 K296 | R288-A292 WeakPolarHBondContact O-CB 3.34Å; R288-A292 PolarHBondContact O-N 2.87Å; E289-A292 PolarHBondContact O-N 3.39Å; A292-K296 VanDerWaalsContact O-CG 3.32Å; A292-K296 WeakPolarHBondContact O-CG 3.25Å; A292-K296 PolarHBondContact O-N 3.4Å |
| 293 | Y | 98.4 | Very high | 96.1 | Very high | 154 Ų | 154 | 101.1 Ų | 101.1 | 60% | 0.604 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -71.8 | -39.1 | 172.7 | -75.5 | -61.9 | 0 | 0 | 0 | 112.3 | E289 R290 K296 Y297 | E289-Y293 WeakPolarHBondContact O-CD2 3.43Å; E289-Y293 PolarHBondContact O-N 3.48Å; R290-Y293 PolarHBondContact O-N 3.38Å; Y293-K296 HydrophobicContact CD1-CD 4.3Å; Y293-K296 PolarHBondContact O-N 3.01Å; Y293-Y297 PolarHBondContact O-N 2.85Å |
| 294 | K | 97.8 | Very high | 94.5 | Very high | 126 Ų | 126 | 98.2 Ų | 98.2 | 55% | 0.548 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -58.6 | -48.6 | 173 | -172.5 | -178.5 | 179.3 | -175.8 | 0 | 110.8 | R290 D291 K296 Y297 E298 | R290-K294 WeakPolarHBondContact O-CB 3.39Å; R290-K294 PolarHBondContact O-N 2.99Å; D291-K294 PolarHBondContact O-N 3.5Å; K294-K296 VanDerWaalsContact C-N 3.3Å; K294-K296 PolarHBondContact O-N 2.91Å; K294-Y297 WeakPolarHBondContact O-CB 3.43Å; K294-Y297 PolarHBondContact O-N 2.95Å; K294-Y297 VanDerWaalsContact O-N 3.07Å; K294-E298 HydrophobicContact CG-CG 4.31Å; K294-E298 WeakPolarHBondContact O-CG 3.46Å; K294-E298 PolarHBondContact O-N 3.41Å |
| 295 | E | 97.4 | Very high | 92.6 | Very high | 107 Ų | 107 | 103.4 Ų | 103.4 | 50% | 0.5 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -58.7 | -40.1 | 178.4 | -162.9 | -159 | 166.7 | 0 | 0 | 112.6 | D291 K299 | D291-E295 WeakPolarHBondContact O-CB 3.32Å; D291-E295 PolarHBondContact O-N 3.07Å; E295-K299 VanDerWaalsContact CD-NZ 3.29Å; E295-K299 VanDerWaalsContact O-CG 3.3Å; E295-K299 WeakPolarHBondContact O-CG 3.5Å; E295-K299 PolarHBondContact O-N 3.49Å; E295-K299 VanDerWaalsContact O-N 3.13Å; E295-K299 WeakPolarHBondContact OE1-CE 3.21Å; E295-K299 IonicContact OE1-NZ 3.54Å; E295-K299 PolarHBondContact OE1-NZ 3.25Å; E295-K299 IonicContact OE2-NZ 2.61Å |
| 296 | K | 96.4 | Very high | 90.5 | Very high | 120 Ų | 120 | 109.3 Ų | 109.3 | 52% | 0.522 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.4 | -41.4 | 174.1 | -70.9 | 168.2 | -174.8 | 174.8 | 0 | 112.2 | A292 Y293 K294 K299 L300 | A292-K296 VanDerWaalsContact O-CG 3.32Å; A292-K296 WeakPolarHBondContact O-CG 3.25Å; A292-K296 PolarHBondContact O-N 3.4Å; Y293-K296 HydrophobicContact CD1-CD 4.3Å; Y293-K296 PolarHBondContact O-N 3.01Å; K294-K296 VanDerWaalsContact C-N 3.3Å; K294-K296 PolarHBondContact O-N 2.91Å; K296-K299 PolarHBondContact O-N 2.91Å; K296-L300 WeakPolarHBondContact O-CG 3.3Å; K296-L300 PolarHBondContact O-N 3.36Å |
| 297 | Y | 96.3 | Very high | 88.3 | Confident | 145 Ų | 145 | 113.2 Ų | 113.2 | 57% | 0.569 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -66 | -47.4 | 178.2 | 178.4 | -102.3 | 0 | 0 | 0 | 112.1 | Y293 K294 K299 L300 I301 | Y293-Y297 PolarHBondContact O-N 2.85Å; K294-Y297 WeakPolarHBondContact O-CB 3.43Å; K294-Y297 PolarHBondContact O-N 2.95Å; K294-Y297 VanDerWaalsContact O-N 3.07Å; Y297-K299 VanDerWaalsContact C-N 3.28Å; Y297-K299 PolarHBondContact O-N 3.32Å; Y297-L300 PolarHBondContact O-N 3.47Å; Y297-I301 HydrophobicContact CD1-CD1 4Å; Y297-I301 HydrophobicContact CE1-CD1 3.33Å; Y297-I301 HydrophobicContact CE1-CG1 4.32Å; Y297-I301 HydrophobicContact CE2-CD1 4.23Å; Y297-I301 VanDerWaalsContact CZ-CD1 3.48Å; Y297-I301 PolarHBondContact O-N 2.93Å |
| 298 | E | 95.4 | Very high | 85.9 | Confident | 86 Ų | 86 | 118 Ų | 118 | 40% | 0.402 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -60.4 | -36.3 | 176.8 | -62.9 | -59.1 | 162 | 0 | 0 | 112.1 | K294 S302 | K294-E298 HydrophobicContact CG-CG 4.31Å; K294-E298 WeakPolarHBondContact O-CG 3.46Å; K294-E298 PolarHBondContact O-N 3.41Å; E298-S302 WeakPolarHBondContact O-CB 3.46Å; E298-S302 PolarHBondContact O-N 3.32Å; E298-S302 PolarHBondContact O-OG 3.19Å |
| 299 | K | 94.2 | Very high | 83.5 | Confident | 102 Ų | 102 | 113.2 Ų | 113.2 | 44% | 0.443 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -63.7 | -41 | 173.1 | -75.3 | 170.1 | -175.8 | 170.6 | 0 | 112.5 | E295 K296 Y297 N303 | E295-K299 VanDerWaalsContact CD-NZ 3.29Å; E295-K299 VanDerWaalsContact O-CG 3.3Å; E295-K299 WeakPolarHBondContact O-CG 3.5Å; E295-K299 PolarHBondContact O-N 3.49Å; E295-K299 VanDerWaalsContact O-N 3.13Å; E295-K299 WeakPolarHBondContact OE1-CE 3.21Å; E295-K299 IonicContact OE1-NZ 3.54Å; E295-K299 PolarHBondContact OE1-NZ 3.25Å; E295-K299 IonicContact OE2-NZ 2.61Å; K296-K299 PolarHBondContact O-N 2.91Å; Y297-K299 VanDerWaalsContact C-N 3.28Å; Y297-K299 PolarHBondContact O-N 3.32Å; K299-N303 VanDerWaalsContact O-CB 3.3Å; K299-N303 WeakPolarHBondContact O-CB 3.3Å; K299-N303 VanDerWaalsContact O-CG 3.22Å; K299-N303 PolarHBondContact O-N 3.3Å; K299-N303 PolarHBondContact O-OD1 3.23Å |
| 300 | L | 94.1 | Very high | 81.3 | Confident | 131 Ų | 131 | 114.8 Ų | 114.8 | 69% | 0.686 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -66.5 | -43.5 | 177.2 | -70.7 | 170.8 | 0 | 0 | 0 | 111.7 | K296 Y297 N303 G304 | K296-L300 WeakPolarHBondContact O-CG 3.3Å; K296-L300 PolarHBondContact O-N 3.36Å; Y297-L300 PolarHBondContact O-N 3.47Å; L300-N303 PolarHBondContact O-N 3.3Å; L300-G304 PolarHBondContact O-N 3.02Å |
| 301 | I | 93.4 | Very high | 78.8 | Confident | 74 Ų | 74 | 113.3 Ų | 113.3 | 38% | 0.379 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -62 | -49.2 | 174.1 | -70.8 | -175.4 | 0 | 0 | 0 | 111.1 | Y297 N303 G304 F305 | Y297-I301 HydrophobicContact CD1-CD1 4Å; Y297-I301 HydrophobicContact CE1-CD1 3.33Å; Y297-I301 HydrophobicContact CE1-CG1 4.32Å; Y297-I301 HydrophobicContact CE2-CD1 4.23Å; Y297-I301 VanDerWaalsContact CZ-CD1 3.48Å; Y297-I301 PolarHBondContact O-N 2.93Å; I301-N303 VanDerWaalsContact C-N 3.27Å; I301-N303 PolarHBondContact O-N 2.87Å; I301-G304 PolarHBondContact O-N 3.5Å; I301-F305 PolarHBondContact O-N 3.38Å |
| 302 | S | 88.4 | Confident | 76.5 | Confident | 67 Ų | 67 | 115.2 Ų | 115.2 | 47% | 0.469 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -62.8 | -33.6 | -177.6 | -60.9 | 0 | 0 | 0 | 0 | 112.5 | E298 R306 | E298-S302 WeakPolarHBondContact O-CB 3.46Å; E298-S302 PolarHBondContact O-N 3.32Å; E298-S302 PolarHBondContact O-OG 3.19Å; S302-R306 WeakPolarHBondContact O-CG 3.18Å |
| 303 | N | 80.6 | Confident | 74.3 | Confident | 107 Ų | 107 | 119.5 Ų | 119.5 | 57% | 0.572 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -80.3 | -40 | 177 | -71.7 | 9.1 | 0 | 0 | 0 | 112.1 | K299 L300 I301 F305 R306 | K299-N303 VanDerWaalsContact O-CB 3.3Å; K299-N303 WeakPolarHBondContact O-CB 3.3Å; K299-N303 VanDerWaalsContact O-CG 3.22Å; K299-N303 PolarHBondContact O-N 3.3Å; K299-N303 PolarHBondContact O-OD1 3.23Å; L300-N303 PolarHBondContact O-N 3.3Å; I301-N303 VanDerWaalsContact C-N 3.27Å; I301-N303 PolarHBondContact O-N 2.87Å; N303-F305 PolarHBondContact O-N 2.98Å; N303-R306 PolarHBondContact O-N 3.32Å |
| 304 | G | 64.6 | Low | 71.9 | Confident | 46 Ų | 46 | 119.9 Ų | 119.9 | 47% | 0.474 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -59.9 | -30.4 | 179 | 0 | 0 | 0 | 0 | 0 | 113.7 | L300 I301 R306 | L300-G304 PolarHBondContact O-N 3.02Å; I301-G304 PolarHBondContact O-N 3.5Å; G304-R306 VanDerWaalsContact C-N 3.32Å; G304-R306 PolarHBondContact O-N 3.07Å |
| 305 | F | 57.9 | Low | 70.1 | Confident | 176 Ų | 176 | 120.8 Ų | 120.8 | 77% | 0.772 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -73.9 | -15.7 | 174.3 | -111 | -86.3 | 0 | 0 | 0 | 114.8 | I301 N303 | I301-F305 PolarHBondContact O-N 3.38Å; N303-F305 PolarHBondContact O-N 2.98Å |
| 306 | R | 55.9 | Low | 67.8 | Low | 210 Ų | 210 | 120.9 Ų | 120.9 | 79% | 0.792 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -95.5 | -27.8 | -174.1 | -63.8 | -175.2 | 80.7 | -165.4 | 4.2 | 114 | S302 N303 G304 | S302-R306 WeakPolarHBondContact O-CG 3.18Å; N303-R306 PolarHBondContact O-N 3.32Å; G304-R306 VanDerWaalsContact C-N 3.32Å; G304-R306 PolarHBondContact O-N 3.07Å |
| 307 | E | 52.7 | Low | 65.9 | Low | 175 Ų | 175 | 120.4 Ų | 120.4 | 82% | 0.818 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -88.2 | -27.7 | 175.6 | -65.5 | -157.5 | 135.7 | 0 | 0 | 113.3 | G309 | E307-G309 PolarHBondContact O-N 3.13Å |
| 308 | N | 47.5 | Very low | 63.5 | Low | 151 Ų | 151 | 118 Ų | 118 | 81% | 0.807 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.6 | 1.4 | 176.5 | -107.7 | 57.2 | 0 | 0 | 0 | 114.6 | S310 | N308-S310 VanDerWaalsContact C-N 3.32Š|
| 309 | G | 48.7 | Very low | 61.6 | Low | 71 Ų | 71 | 119.4 Ų | 119.4 | 73% | 0.732 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.8 | -0.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | E307 | E307-G309 PolarHBondContact O-N 3.13Š|
| 310 | S | 51.6 | Low | 59.6 | Low | 110 Ų | 110 | 121 Ų | 121 | 77% | 0.769 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -139.5 | 62.5 | -178.3 | -147.4 | 0 | 0 | 0 | 0 | 113.3 | N308 | N308-S310 VanDerWaalsContact C-N 3.32Š|
| 311 | S | 46.3 | Very low | 57.4 | Low | 114 Ų | 114 | 123.9 Ų | 123.9 | 80% | 0.797 | 71% | 0.706 | S | S | * | * | trans | -154 | 93.1 | 153.4 | -80.1 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 312 | S | 50.9 | Low | 55.4 | Low | 105 Ų | 105 | 129.3 Ų | 129.3 | 73% | 0.734 | 73% | 0.727 | S | S | * | * | trans | -61.4 | 146.2 | 153.2 | -167.2 | 0 | 0 | 0 | 0 | 108 | ||||
| 313 | D | 51 | Low | 53.7 | Low | 133 Ų | 133 | 132.9 Ų | 132.9 | 71% | 0.711 | 74% | 0.738 | S | S | * | * | trans | 60.9 | 86.2 | 169.1 | -54 | -65.7 | 0 | 0 | 0 | 116.1 | ||||
| 314 | N | 48.4 | Very low | 52.2 | Low | 161 Ų | 161 | 132.9 Ų | 132.9 | 86% | 0.861 | 75% | 0.747 | S | S | * | * | -162.1 | 113.8 | 116.9 | -101.4 | -62.6 | 0 | 0 | 0 | 111.7 | P316 | N314-P316 VanDerWaalsContact O-CD 3.25Å; N314-P316 WeakPolarHBondContact O-CD 3.45Å | |||
| 315 | N | 59.8 | Low | 51.6 | Low | 146 Ų | 146 | 136.3 Ų | 136.3 | 78% | 0.781 | 76% | 0.763 | S | S | * | * | trans | -92.8 | 114.4 | 168.6 | 163.8 | 37.6 | 0 | 0 | 0 | 109.8 | S317 | N315-S317 PolarHBondContact OD1-N 2.73Š| ||
| 316 | P | 49.6 | Very low | 51.4 | Low | 109 Ų | 109 | 138.6 Ų | 138.6 | 71% | 0.708 | 77% | 0.767 | S | S | * | * | trans | -108.3 | 116.3 | 152 | 33.6 | -26.2 | 0 | 0 | 0 | 110.2 | N314 S318 | N314-P316 VanDerWaalsContact O-CD 3.25Å; N314-P316 WeakPolarHBondContact O-CD 3.45Å; P316-S318 PolarHBondContact O-N 3.2Å | ||
| 317 | S | 56.2 | Low | 51.2 | Low | 109 Ų | 109 | 137.3 Ų | 137.3 | 76% | 0.762 | 77% | 0.767 | S | S | * | * | trans | -56.3 | 128.4 | 170.8 | -174.4 | 0 | 0 | 0 | 0 | 111.2 | N315 | N315-S317 PolarHBondContact OD1-N 2.73Š| ||
| 318 | S | 47.3 | Very low | 51.2 | Low | 95 Ų | 95 | 138.9 Ų | 138.9 | 66% | 0.664 | 77% | 0.771 | S | S | * | * | trans | -153.8 | 106.8 | 167 | -163.9 | 0 | 0 | 0 | 0 | 112.1 | P316 E320 | P316-S318 PolarHBondContact O-N 3.2Å; S318-E320 VanDerWaalsContact C-N 3.33Å; S318-E320 PolarHBondContact O-N 2.61Å | ||
| 319 | P | 54.4 | Low | 51.3 | Low | 115 Ų | 115 | 139.6 Ų | 139.6 | 75% | 0.747 | 77% | 0.774 | S | S | * | * | trans | -88.9 | 25 | -174.8 | 35.7 | -36 | 0 | 0 | 0 | 114.8 | ||||
| 320 | E | 51.4 | Low | 51.4 | Low | 136 Ų | 136 | 144.8 Ų | 144.8 | 64% | 0.636 | 78% | 0.779 | S | S | * | * | trans | -88.4 | -17.4 | -171.1 | -85.4 | -76.4 | 113.6 | 0 | 0 | 115.5 | S318 F322 | S318-E320 VanDerWaalsContact C-N 3.33Å; S318-E320 PolarHBondContact O-N 2.61Å; E320-F322 VanDerWaalsContact C-N 3.3Å; E320-F322 PolarHBondContact O-N 3.2Å | ||
| 321 | F | 48.9 | Very low | 50.9 | Low | 191 Ų | 191 | 151.2 Ų | 151.2 | 84% | 0.838 | 80% | 0.804 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.1 | -14.4 | -169.3 | -154.3 | -99.5 | 0 | 0 | 0 | 115.1 | ||
| 322 | F | 50.6 | Low | 51.2 | Low | 188 Ų | 188 | 153.1 Ų | 153.1 | 83% | 0.825 | 80% | 0.804 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.2 | -3.1 | -173.8 | -94.9 | -79.1 | 0 | 0 | 0 | 115.9 | E320 | E320-F322 VanDerWaalsContact C-N 3.3Å; E320-F322 PolarHBondContact O-N 3.2Å |
| 323 | M | 53.5 | Low | 51.2 | Low | 143 Ų | 143 | 155.6 Ų | 155.6 | 70% | 0.704 | 81% | 0.808 | S | S | * | * | S | Bend | trans | -93 | -15.3 | -175.4 | -69.9 | -167.2 | 69.5 | 0 | 0 | 115.5 | ||
| 324 | S | 49.8 | Very low | 51.2 | Low | 107 Ų | 107 | 156.9 Ų | 156.9 | 75% | 0.748 | 81% | 0.813 | S | S | * | * | G | 310 helix | trans | -80.6 | -21.2 | -175.4 | -65.7 | 0 | 0 | 0 | 0 | 115.1 | R326 | S324-R326 PolarHBondContact O-N 2.96Š|
| 325 | S | 50.3 | Low | 51.4 | Low | 117 Ų | 117 | 156.6 Ų | 156.6 | 82% | 0.818 | 81% | 0.81 | S | S | * | * | G | 310 helix | trans | -90.2 | 14.4 | -175.2 | -55 | 0 | 0 | 0 | 0 | 115 | ||
| 326 | R | 53.6 | Low | 50.8 | Low | 225 Ų | 225 | 157.3 Ų | 157.3 | 85% | 0.849 | 81% | 0.812 | S | S | * | * | G | 310 helix | trans | -124 | 26.6 | -175.3 | -120.5 | -168.7 | -84.7 | -149.6 | -0.9 | 115.4 | S324 | S324-R326 PolarHBondContact O-N 2.96Š|
| 327 | K | 53.8 | Low | 50.9 | Low | 183 Ų | 183 | 160.5 Ų | 160.5 | 80% | 0.796 | 82% | 0.819 | S | S | * | * | S | Bend | trans | -122.8 | 15.2 | -179.7 | -72.2 | -169.8 | 178 | 178.6 | 0 | 116.4 | ||
| 328 | F | 51.6 | Low | 50.5 | Low | 208 Ų | 208 | 164.2 Ų | 164.2 | 91% | 0.912 | 82% | 0.823 | S | S | * | * | S | Bend | trans | -131 | 35.8 | 177 | -102.8 | -78.2 | 0 | 0 | 0 | 114.1 | ||
| 329 | L | 50.3 | Low | 50.8 | Low | 166 Ų | 166 | 169.5 Ų | 169.5 | 87% | 0.869 | 84% | 0.835 | S | S | * | * | S | Bend | trans | -139.3 | 52.9 | 170.3 | -96.7 | 169.5 | 0 | 0 | 0 | 110.7 | ||
| 330 | H | 50 | Low | 50.5 | Low | 180 Ų | 180 | 174.1 Ų | 174.1 | 83% | 0.833 | 84% | 0.843 | S | S | * | * | trans | -170.7 | 89.2 | 154.2 | -122.1 | -87.6 | 0 | 0 | 0 | 110.6 | ||||
| 331 | L | 42.2 | Very low | 50.4 | Low | 245 Ų | 245 | 177.5 Ų | 177.5 | 100% | 1.283 | 86% | 0.861 | S | S | * | * | -169.1 | 0 | 128.1 | -124.2 | 71.9 | 0 | 0 | 0 | 109.3 |
Retrieved 331 of 331 residues in 124.8 ms
(Link to these results)