| 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 | 36.2 | Very low | 31.4 | Very low | 243 Ų | 243 | 144.5 Ų | 144.5 | 100% | 1.197 | 87% | 0.872 | S | S | * | * | 0 | 119.9 | 0 | -84.5 | 178.5 | 173.3 | 0 | 0 | 108.5 | |||||
| 2 | S | 34.3 | Very low | 31.1 | Very low | 127 Ų | 127 | 149.1 Ų | 149.1 | 89% | 0.888 | 88% | 0.877 | S | S | * | * | trans | 47.3 | 109.4 | 167.5 | -63.7 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 3 | A | 30.7 | Very low | 30.8 | Very low | 91 Ų | 91 | 145.5 Ų | 145.5 | 75% | 0.752 | 88% | 0.875 | S | S | * | * | trans | -71.8 | 176.2 | 152.3 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 4 | V | 33.2 | Very low | 30.8 | Very low | 152 Ų | 152 | 142.7 Ų | 142.7 | 92% | 0.921 | 88% | 0.875 | S | S | * | * | trans | 137 | 128.7 | 146 | 175.2 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 5 | G | 29.8 | Very low | 30.5 | Very low | 69 Ų | 69 | 145.8 Ų | 145.8 | 71% | 0.711 | 88% | 0.875 | S | S | * | * | cis | 175.3 | 149.6 | 3.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 6 | L | 31.6 | Very low | 30.4 | Very low | 172 Ų | 172 | 148.4 Ų | 148.4 | 90% | 0.901 | 88% | 0.875 | S | S | * | * | trans | -58.5 | 153.3 | 174.9 | -74.4 | 107.9 | 0 | 0 | 0 | 113.4 | ||||
| 7 | R | 29.5 | Very low | 30.5 | Very low | 253 Ų | 253 | 145.9 Ų | 145.9 | 96% | 0.955 | 87% | 0.865 | S | S | * | * | -166.7 | 136.8 | 125.4 | -107.6 | 169.1 | -175 | -170.3 | 1.1 | 112.9 | |||||
| 8 | A | 29.1 | Very low | 30.3 | Very low | 96 Ų | 96 | 147.2 Ų | 147.2 | 79% | 0.793 | 87% | 0.866 | S | S | * | * | trans | -115.9 | 161.4 | 174 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 9 | A | 28.3 | Very low | 30.2 | Very low | 97 Ų | 97 | 150.2 Ų | 150.2 | 80% | 0.802 | 87% | 0.867 | S | S | * | * | trans | 86.4 | 156.7 | 161.3 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 10 | P | 33.6 | Very low | 30.2 | Very low | 122 Ų | 122 | 152.9 Ų | 152.9 | 79% | 0.792 | 87% | 0.868 | S | S | * | * | cis | -135.6 | 174.9 | -3.3 | 27.7 | -3.6 | 0 | 0 | 0 | 116.8 | ||||
| 11 | L | 28.8 | Very low | 30 | Very low | 168 Ų | 168 | 148.7 Ų | 148.7 | 88% | 0.88 | 86% | 0.858 | S | S | * | * | trans | -19.1 | 140 | 160.4 | -67 | 149.5 | 0 | 0 | 0 | 119.3 | ||||
| 12 | Q | 28.1 | Very low | 29.7 | Very low | 199 Ų | 199 | 147.5 Ų | 147.5 | 93% | 0.93 | 85% | 0.846 | S | S | * | * | trans | -134.3 | 122.4 | 145.5 | -86.9 | -177.2 | -11.1 | 0 | 0 | 110.7 | ||||
| 13 | A | 27.6 | Very low | 29.3 | Very low | 103 Ų | 103 | 148.7 Ų | 148.7 | 85% | 0.851 | 84% | 0.842 | S | S | * | * | trans | -76.8 | 139.1 | 167.5 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 14 | A | 29.7 | Very low | 29.3 | Very low | 106 Ų | 106 | 149.7 Ų | 149.7 | 88% | 0.876 | 84% | 0.843 | S | S | * | * | trans | -125.2 | 101.1 | 164.4 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 15 | E | 26.8 | Very low | 28.9 | Very low | 189 Ų | 189 | 146.4 Ų | 146.4 | 88% | 0.883 | 83% | 0.832 | S | S | * | * | trans | -75.8 | 134.6 | 159.2 | -73.5 | -176.6 | 131.7 | 0 | 0 | 108.9 | ||||
| 16 | E | 29.4 | Very low | 28.9 | Very low | 187 Ų | 187 | 149.3 Ų | 149.3 | 87% | 0.874 | 84% | 0.835 | S | S | * | * | trans | -177.9 | 158.5 | 142.8 | -110.2 | -163.5 | -162.4 | 0 | 0 | 111 | ||||
| 17 | P | 31 | Very low | 28.8 | Very low | 107 Ų | 107 | 144.9 Ų | 144.9 | 70% | 0.695 | 82% | 0.824 | S | S | * | * | -118.6 | 162.3 | -82.1 | 26.1 | -6.5 | 0 | 0 | 0 | 114 | K19 | P17-K19 PolarHBondContact O-N 2.85Š| |||
| 18 | L | 27.7 | Very low | 28.7 | Very low | 168 Ų | 168 | 138.5 Ų | 138.5 | 88% | 0.88 | 82% | 0.815 | S | S | * | * | trans | -56.8 | 117.1 | 170 | -87.8 | 95.4 | 0 | 0 | 0 | 112.1 | ||||
| 19 | K | 28.8 | Very low | 28.8 | Very low | 204 Ų | 204 | 145.7 Ų | 145.7 | 89% | 0.887 | 82% | 0.822 | S | S | * | * | trans | -94.3 | 108 | 157 | -83.6 | -179.4 | 178.4 | 175.3 | 0 | 110.1 | P17 G21 | P17-K19 PolarHBondContact O-N 2.85Å; K19-G21 PolarHBondContact O-N 2.74Å; K19-G21 VanDerWaalsContact O-N 3.13Å | ||
| 20 | K | 30.2 | Very low | 29.4 | Very low | 204 Ų | 204 | 150.6 Ų | 150.6 | 89% | 0.887 | 82% | 0.819 | S | S | * | * | trans | -63.9 | 102.1 | 164.9 | -77.4 | 176.1 | 175.7 | 173.1 | 0 | 109.4 | ||||
| 21 | G | 25.3 | Very low | 29.3 | Very low | 65 Ų | 65 | 149.1 Ų | 149.1 | 67% | 0.67 | 82% | 0.817 | S | S | * | * | trans | -103.3 | 105.1 | 164.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | K19 I23 | K19-G21 PolarHBondContact O-N 2.74Å; K19-G21 VanDerWaalsContact O-N 3.13Å; G21-I23 PolarHBondContact O-N 3.34Å | ||
| 22 | K | 29.7 | Very low | 29.6 | Very low | 218 Ų | 218 | 145.1 Ų | 145.1 | 95% | 0.948 | 81% | 0.808 | S | S | * | * | trans | -65.8 | 111 | 162.3 | -81 | 177.9 | 174.1 | 178.1 | 0 | 107.5 | ||||
| 23 | I | 27.2 | Very low | 30 | Very low | 153 Ų | 153 | 137.3 Ų | 137.3 | 79% | 0.785 | 77% | 0.773 | S | S | * | * | trans | -115.2 | 96.5 | 162.4 | -58.7 | 178 | 0 | 0 | 0 | 106.9 | G21 A25 | G21-I23 PolarHBondContact O-N 3.34Å; I23-A25 HydrophobicContact CG2-CB 4.34Å; I23-A25 PolarHBondContact O-N 2.91Å; I23-A25 VanDerWaalsContact O-N 3.1Å | ||
| 24 | S | 29.6 | Very low | 30.6 | Very low | 111 Ų | 111 | 137.1 Ų | 137.1 | 78% | 0.776 | 76% | 0.761 | S | S | * | * | trans | -65.7 | 95.7 | 160.2 | 160.1 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 25 | A | 26 | Very low | 31.1 | Very low | 84 Ų | 84 | 139.2 Ų | 139.2 | 69% | 0.694 | 75% | 0.753 | S | S | * | * | trans | -104.5 | 91.7 | 166.3 | 0 | 0 | 0 | 0 | 0 | 108.3 | I23 A27 | I23-A25 HydrophobicContact CG2-CB 4.34Å; I23-A25 PolarHBondContact O-N 2.91Å; I23-A25 VanDerWaalsContact O-N 3.1Å; A25-A27 PolarHBondContact O-N 2.92Å; A25-A27 VanDerWaalsContact O-N 3.1Å | ||
| 26 | V | 29.2 | Very low | 32 | Very low | 130 Ų | 130 | 131 Ų | 131 | 79% | 0.788 | 71% | 0.714 | S | S | * | * | trans | -61.7 | 107.2 | 163.9 | 174 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 27 | A | 29.1 | Very low | 32.1 | Very low | 79 Ų | 79 | 124 Ų | 124 | 65% | 0.653 | 68% | 0.684 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 140.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | A25 R29 | A25-A27 PolarHBondContact O-N 2.92Å; A25-A27 VanDerWaalsContact O-N 3.1Å; A27-R29 PolarHBondContact O-N 3.17Å |
| 28 | P | 27.9 | Very low | 32.3 | Very low | 119 Ų | 119 | 124.8 Ų | 124.8 | 77% | 0.773 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 128.8 | -178.4 | 27 | -31.4 | 0 | 0 | 0 | 110.6 | R30 | P28-R30 PolarHBondContact O-N 3.46Š|
| 29 | R | 30.8 | Very low | 32.5 | Very low | 247 Ų | 247 | 122.9 Ų | 122.9 | 93% | 0.932 | 67% | 0.674 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 121 | 170.9 | -75.6 | 179.3 | 167.9 | 175.9 | -4 | 109.7 | A27 | A27-R29 PolarHBondContact O-N 3.17Š|
| 30 | R | 40.4 | Very low | 32.7 | Very low | 200 Ų | 200 | 119.7 Ų | 119.7 | 76% | 0.755 | 67% | 0.672 | S | S | * | * | P | Polyproline II helix | trans | -91.2 | 117.1 | 173.9 | -82.3 | -172 | 176.4 | 174.7 | 3.1 | 110.6 | P28 A32 | P28-R30 PolarHBondContact O-N 3.46Å; R30-A32 PolarHBondContact O-N 2.91Å |
| 31 | A | 31.5 | Very low | 32.7 | Very low | 90 Ų | 90 | 113.4 Ų | 113.4 | 74% | 0.744 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.7 | 16.1 | -176.8 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||
| 32 | A | 35.6 | Very low | 32.7 | Very low | 84 Ų | 84 | 115 Ų | 115 | 69% | 0.694 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.2 | -6.4 | -167.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | R30 | R30-A32 PolarHBondContact O-N 2.91Š|
| 33 | L | 37.6 | Very low | 32.6 | Very low | 35 Ų | 35 | 112.7 Ų | 112.7 | 18% | 0.183 | 67% | 0.669 | C | S | . | * | S | Bend | trans | -120.3 | 1.3 | -175.4 | -79.1 | 165.3 | 0 | 0 | 0 | 115 | E35 I36 T37 W159 | L33-E35 PolarHBondContact O-N 3.21Å; L33-I36 HydrophobicContact CD2-CD1 4.31Å; L33-I36 PolarHBondContact O-N 3.3Å; L33-T37 PolarHBondContact O-N 3.14Å; L33-T37 PolarHBondContact O-OG1 3.39Å; L33-W159 HydrophobicContact CD1-CD2 4.27Å; L33-W159 HydrophobicContact CD1-CG 4.07Å |
| 34 | V | 40 | Very low | 32.6 | Very low | 100 Ų | 100 | 110.3 Ų | 110.3 | 61% | 0.606 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.9 | -26.4 | -176.9 | -176.4 | 0 | 0 | 0 | 0 | 112 | I36 | V34-I36 PolarHBondContact O-N 2.93Š|
| 35 | E | 39.6 | Very low | 32.5 | Very low | 150 Ų | 150 | 111.9 Ų | 111.9 | 70% | 0.701 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.5 | -13.3 | 179.9 | -65.7 | -174.8 | 165.9 | 0 | 0 | 115.2 | L33 R192 | L33-E35 PolarHBondContact O-N 3.21Å; E35-R192 PolarHBondContact O-NH1 2.87Å |
| 36 | I | 44.6 | Very low | 32.5 | Very low | 15 Ų | 15 | 114.8 Ų | 114.8 | 8% | 0.077 | 68% | 0.681 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -106 | -27.3 | -179.6 | -61.6 | 176.8 | 0 | 0 | 0 | 111.4 | L33 V34 I155 | L33-I36 HydrophobicContact CD2-CD1 4.31Å; L33-I36 PolarHBondContact O-N 3.3Å; V34-I36 PolarHBondContact O-N 2.93Å; I36-I155 HydrophobicContact CD1-CG2 3.9Å |
| 37 | T | 33.1 | Very low | 32.5 | Very low | 40 Ų | 40 | 117.1 Ų | 117.1 | 25% | 0.245 | 68% | 0.683 | C | S | . | * | trans | -114.7 | 101.2 | -178.1 | 52.5 | 0 | 0 | 0 | 0 | 111 | L33 A227 | L33-T37 PolarHBondContact O-N 3.14Å; L33-T37 PolarHBondContact O-OG1 3.39Å; T37-A227 HydrophobicContact CG2-CB 4.37Å | ||
| 38 | N | 34.3 | Very low | 32.4 | Very low | 124 Ų | 124 | 124.5 Ų | 124.5 | 66% | 0.663 | 69% | 0.694 | S | S | * | * | trans | -87.2 | 112.3 | 160 | -89.9 | 6.3 | 0 | 0 | 0 | 108.4 | ||||
| 39 | N | 32.6 | Very low | 32.3 | Very low | 129 Ų | 129 | 125.9 Ų | 125.9 | 69% | 0.69 | 70% | 0.701 | S | S | * | * | trans | -90.1 | 124.2 | 177.8 | -156.4 | 3.6 | 0 | 0 | 0 | 109.6 | ||||
| 40 | T | 32.5 | Very low | 32 | Very low | 137 Ų | 137 | 117.9 Ų | 117.9 | 84% | 0.84 | 69% | 0.694 | S | S | * | * | trans | -135.5 | 105.9 | 162.3 | 49.8 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 41 | G | 29.3 | Very low | 31.4 | Very low | 72 Ų | 72 | 113.3 Ų | 113.3 | 74% | 0.742 | 70% | 0.7 | S | S | * | * | trans | -83.1 | 150.1 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 42 | A | 26.9 | Very low | 31.1 | Very low | 98 Ų | 98 | 115.8 Ų | 115.8 | 81% | 0.81 | 71% | 0.706 | S | S | * | * | 179.3 | 108.7 | 129.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 43 | L | 26.9 | Very low | 30.9 | Very low | 170 Ų | 170 | 122 Ų | 122 | 89% | 0.89 | 72% | 0.717 | S | S | * | * | trans | 10.5 | 135 | 140.6 | -65.7 | 146.5 | 0 | 0 | 0 | 121.2 | ||||
| 44 | A | 27.6 | Very low | 30.3 | Very low | 103 Ų | 103 | 130.2 Ų | 130.2 | 85% | 0.851 | 75% | 0.752 | S | S | * | * | -168.5 | 136.4 | 120.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 45 | D | 26.1 | Very low | 29.7 | Very low | 143 Ų | 143 | 131 Ų | 131 | 77% | 0.765 | 76% | 0.762 | S | S | * | * | trans | -70.9 | 156.5 | 178.9 | -66.9 | -61.2 | 0 | 0 | 0 | 115.3 | ||||
| 46 | T | 28.1 | Very low | 29 | Very low | 145 Ų | 145 | 128.8 Ų | 128.8 | 89% | 0.89 | 76% | 0.762 | S | S | * | * | -175.6 | 163.2 | 114.3 | 14 | 0 | 0 | 0 | 0 | 114.5 | |||||
| 47 | E | 27.8 | Very low | 28.3 | Very low | 179 Ų | 179 | 137.7 Ų | 137.7 | 84% | 0.836 | 80% | 0.801 | S | S | * | * | trans | -86.6 | 147.6 | -154.4 | -64.2 | 176.8 | 119.4 | 0 | 0 | 118.2 | ||||
| 48 | R | 26.6 | Very low | 28.2 | Very low | 234 Ų | 234 | 142 Ų | 142 | 88% | 0.883 | 83% | 0.829 | S | S | * | * | 29.8 | 131.2 | 129.4 | -121.4 | 176.6 | -176.7 | -176.6 | 0.6 | 121.3 | |||||
| 49 | T | 27.3 | Very low | 27.9 | Very low | 149 Ų | 149 | 141.1 Ų | 141.1 | 91% | 0.914 | 83% | 0.833 | S | S | * | * | -172.6 | 144 | 117.9 | 23.5 | 0 | 0 | 0 | 0 | 110.7 | |||||
| 50 | G | 23.3 | Very low | 27.6 | Very low | 78 Ų | 78 | 140 Ų | 140 | 80% | 0.804 | 83% | 0.834 | S | S | * | * | trans | -104 | 165.5 | -175.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 51 | A | 27.9 | Very low | 27.5 | Very low | 105 Ų | 105 | 138.6 Ų | 138.6 | 87% | 0.868 | 83% | 0.83 | S | S | * | * | trans | -158.5 | 132.6 | 152.7 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 52 | T | 25.7 | Very low | 27.8 | Very low | 142 Ų | 142 | 143.4 Ų | 143.4 | 87% | 0.871 | 83% | 0.833 | S | S | * | * | trans | -75.4 | 141.9 | 175 | 29 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 53 | K | 30.2 | Very low | 28.1 | Very low | 214 Ų | 214 | 148.2 Ų | 148.2 | 93% | 0.93 | 84% | 0.835 | S | S | * | * | trans | -149 | 123.8 | 154.9 | -110.7 | 177.1 | -175.8 | 177.4 | 0 | 111.5 | ||||
| 54 | K | 26.9 | Very low | 28.3 | Very low | 208 Ų | 208 | 146.4 Ų | 146.4 | 90% | 0.904 | 83% | 0.834 | S | S | * | * | trans | -76.5 | 167 | 168.7 | -80.6 | 177.7 | 172.8 | 176.1 | 0 | 111 | ||||
| 55 | S | 25.5 | Very low | 28.5 | Very low | 117 Ų | 117 | 146.8 Ų | 146.8 | 82% | 0.818 | 83% | 0.83 | S | S | * | * | trans | 107.3 | 130.3 | 169.8 | -177.3 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 56 | S | 26.9 | Very low | 28.8 | Very low | 102 Ų | 102 | 151 Ų | 151 | 71% | 0.713 | 84% | 0.835 | S | S | * | * | cis | -162.5 | 149.3 | 11.8 | 33.7 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 57 | K | 29.1 | Very low | 29.1 | Very low | 203 Ų | 203 | 149.9 Ų | 149.9 | 88% | 0.883 | 83% | 0.828 | S | S | * | * | trans | -82.6 | 133.6 | 168.3 | -70.4 | -179.7 | 176 | -179.3 | 0 | 109.2 | ||||
| 58 | P | 31.4 | Very low | 29.4 | Very low | 129 Ų | 129 | 147 Ų | 147 | 84% | 0.838 | 83% | 0.825 | S | S | * | * | trans | -89.7 | 114.7 | 159.6 | 27.7 | -17.6 | 0 | 0 | 0 | 109.5 | ||||
| 59 | S | 27.1 | Very low | 29.8 | Very low | 107 Ų | 107 | 144.8 Ų | 144.8 | 75% | 0.748 | 83% | 0.825 | S | S | * | * | trans | -82.4 | 111.7 | 166.3 | 174.6 | 0 | 0 | 0 | 0 | 108.1 | S61 | S59-S61 PolarHBondContact O-N 3.02Š| ||
| 60 | C | 26.2 | Very low | 30.1 | Very low | 105 Ų | 105 | 142.2 Ų | 142.2 | 71% | 0.709 | 82% | 0.818 | S | S | * | * | trans | -89.6 | 103.2 | 173.3 | -168.5 | 0 | 0 | 0 | 0 | 108.9 | Q62 | C60-Q62 PolarHBondContact O-N 3.32Š| ||
| 61 | S | 30.5 | Very low | 30.8 | Very low | 108 Ų | 108 | 147.6 Ų | 147.6 | 76% | 0.755 | 82% | 0.822 | S | S | * | * | trans | -81.1 | 105.8 | 171.1 | -56.2 | 0 | 0 | 0 | 0 | 109.2 | S59 | S59-S61 PolarHBondContact O-N 3.02Š| ||
| 62 | Q | 36.6 | Very low | 31 | Very low | 173 Ų | 173 | 147.2 Ų | 147.2 | 81% | 0.808 | 82% | 0.819 | S | S | * | * | trans | -109.6 | 118.7 | 165.6 | -69.8 | -171 | -3.6 | 0 | 0 | 109.5 | C60 | C60-Q62 PolarHBondContact O-N 3.32Š| ||
| 63 | K | 32.7 | Very low | 31.8 | Very low | 198 Ų | 198 | 151.9 Ų | 151.9 | 86% | 0.861 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 138.4 | 167.7 | -74.9 | 177.2 | 175.2 | 178.8 | 0 | 108.7 | S65 | K63-S65 PolarHBondContact O-N 3.06Š|
| 64 | P | 31 | Very low | 32.2 | Very low | 132 Ų | 132 | 149.8 Ų | 149.8 | 86% | 0.857 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 122.6 | 175.7 | 26 | -30.5 | 0 | 0 | 0 | 110.4 | ||
| 65 | S | 32.6 | Very low | 32.9 | Very low | 111 Ų | 111 | 145.5 Ų | 145.5 | 78% | 0.776 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -76.1 | 124.1 | 167.9 | 177.8 | 0 | 0 | 0 | 0 | 109 | K63 V67 | K63-S65 PolarHBondContact O-N 3.06Å; S65-V67 PolarHBondContact O-N 2.89Å |
| 66 | R | 31.8 | Very low | 34.2 | Very low | 232 Ų | 232 | 148.5 Ų | 148.5 | 88% | 0.875 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -73.4 | 116.4 | 179 | -160.3 | 175.2 | -174.3 | -175 | 0.1 | 109 | ||
| 67 | V | 34.8 | Very low | 34.8 | Very low | 121 Ų | 121 | 149.7 Ų | 149.7 | 73% | 0.733 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -78.3 | 141.8 | 170.8 | -167.4 | 0 | 0 | 0 | 0 | 107.9 | S65 E69 | S65-V67 PolarHBondContact O-N 2.89Å; V67-E69 PolarHBondContact O-N 3.09Å |
| 68 | P | 34.3 | Very low | 35.7 | Very low | 118 Ų | 118 | 147.8 Ų | 147.8 | 77% | 0.766 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -65 | 132.6 | 176.7 | -15.3 | 28.5 | 0 | 0 | 0 | 111 | A70 | P68-A70 PolarHBondContact O-N 3.05Š|
| 69 | E | 33.7 | Very low | 36.4 | Very low | 189 Ų | 189 | 147.1 Ų | 147.1 | 88% | 0.883 | 81% | 0.813 | S | S | * | * | trans | -60.8 | 112.1 | 166.4 | -107.7 | 163.4 | 156.5 | 0 | 0 | 109.1 | V67 | V67-E69 PolarHBondContact O-N 3.09Š| ||
| 70 | A | 34.9 | Very low | 37.4 | Very low | 94 Ų | 94 | 146.9 Ų | 146.9 | 78% | 0.777 | 82% | 0.818 | S | S | * | * | trans | -92.7 | 113.5 | 163.1 | 0 | 0 | 0 | 0 | 0 | 107.5 | P68 A72 | P68-A70 PolarHBondContact O-N 3.05Å; A70-A72 PolarHBondContact O-N 3.27Å | ||
| 71 | E | 36.2 | Very low | 38.5 | Very low | 191 Ų | 191 | 149.2 Ų | 149.2 | 89% | 0.893 | 82% | 0.822 | S | S | * | * | trans | -59.1 | 108.7 | 171.2 | -73.5 | 179.2 | 156.1 | 0 | 0 | 109.7 | R73 | E71-R73 PolarHBondContact O-N 2.88Š| ||
| 72 | A | 33.7 | Very low | 39.6 | Very low | 97 Ų | 97 | 150 Ų | 150 | 80% | 0.802 | 83% | 0.825 | S | S | * | * | trans | -75.8 | 104 | 169.7 | 0 | 0 | 0 | 0 | 0 | 108.8 | A70 L74 | A70-A72 PolarHBondContact O-N 3.27Å; A72-L74 PolarHBondContact O-N 2.8Å | ||
| 73 | R | 41.8 | Very low | 40.4 | Very low | 241 Ų | 241 | 147.8 Ų | 147.8 | 91% | 0.909 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 127.5 | 164.2 | -80.3 | -178.3 | 175.1 | -169.9 | -2.4 | 109 | E71 | E71-R73 PolarHBondContact O-N 2.88Š|
| 74 | L | 39 | Very low | 41.5 | Very low | 169 Ų | 169 | 142.5 Ų | 142.5 | 89% | 0.885 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 131.9 | 169.6 | -72.5 | 160.6 | 0 | 0 | 0 | 109.5 | A72 | A72-L74 PolarHBondContact O-N 2.8Š|
| 75 | P | 42.2 | Very low | 42.7 | Very low | 119 Ų | 119 | 140.5 Ų | 140.5 | 77% | 0.773 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 139.2 | 170.5 | -13.8 | 27.6 | 0 | 0 | 0 | 110.5 | ||
| 76 | E | 51.8 | Low | 43.9 | Very low | 180 Ų | 180 | 138.3 Ų | 138.3 | 84% | 0.841 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 149 | 170.2 | -73.7 | -177.4 | 160.5 | 0 | 0 | 111.1 | L78 | E76-L78 PolarHBondContact O-N 2.98Š|
| 77 | P | 40 | Very low | 45 | Very low | 126 Ų | 126 | 131.5 Ų | 131.5 | 82% | 0.818 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 128 | -179.2 | -12.5 | 27.1 | 0 | 0 | 0 | 110.9 | ||
| 78 | L | 47.6 | Very low | 46.1 | Very low | 163 Ų | 163 | 130.4 Ų | 130.4 | 85% | 0.853 | 74% | 0.735 | S | S | * | * | P | Polyproline II helix | trans | -64.7 | 144.6 | 169.7 | -74.3 | 162.1 | 0 | 0 | 0 | 110.3 | E76 A80 | E76-L78 PolarHBondContact O-N 2.98Å; L78-A80 PolarHBondContact O-N 3.3Å |
| 79 | P | 45.8 | Very low | 47.5 | Very low | 115 Ų | 115 | 128.5 Ų | 128.5 | 75% | 0.747 | 72% | 0.721 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 135.2 | 178.3 | 22.8 | -28.8 | 0 | 0 | 0 | 110.8 | L81 | P79-L81 PolarHBondContact O-N 3.13Š|
| 80 | A | 48.3 | Very low | 48.6 | Very low | 103 Ų | 103 | 125.4 Ų | 125.4 | 85% | 0.851 | 71% | 0.706 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 122.1 | 178.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | L78 | L78-A80 PolarHBondContact O-N 3.3Š|
| 81 | L | 49 | Very low | 49.7 | Very low | 154 Ų | 154 | 127 Ų | 127 | 81% | 0.806 | 69% | 0.692 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 146.1 | 167.2 | -72 | 165.5 | 0 | 0 | 0 | 108.8 | P79 E83 | P79-L81 PolarHBondContact O-N 3.13Å; L81-E83 PolarHBondContact O-N 2.98Å |
| 82 | P | 54 | Low | 50.6 | Low | 123 Ų | 123 | 124.1 Ų | 124.1 | 80% | 0.799 | 68% | 0.679 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 128.6 | 174.8 | -14.8 | 27.3 | 0 | 0 | 0 | 109.3 | D84 | P82-D84 PolarHBondContact O-N 3.27Š|
| 83 | E | 53.2 | Low | 51.5 | Low | 128 Ų | 128 | 123.9 Ų | 123.9 | 60% | 0.598 | 66% | 0.664 | S | S | * | * | P | Polyproline II helix | trans | -65 | 120.1 | 174.3 | -69.3 | -159.9 | 115.8 | 0 | 0 | 109.1 | L81 P85 R91 | L81-E83 PolarHBondContact O-N 2.98Å; E83-P85 WeakPolarHBondContact O-CD 3.2Å; E83-R91 IonicContact OE1-NH1 2.83Å; E83-R91 IonicContact OE1-NH2 2.94Å; E83-R91 PolarHBondContact OE1-NH2 3.49Å |
| 84 | D | 55.7 | Low | 52.1 | Low | 86 Ų | 86 | 116.5 Ų | 116.5 | 46% | 0.46 | 65% | 0.648 | S | S | . | * | P | Polyproline II helix | trans | -71.6 | 119.2 | 173 | -170.7 | -29.7 | 0 | 0 | 0 | 108 | P82 S86 L87 | P82-D84 PolarHBondContact O-N 3.27Å; D84-S86 PolarHBondContact O-N 3.2Å; D84-S86 WeakPolarHBondContact OD1-CB 3.27Å; D84-S86 PolarHBondContact OD1-N 3.23Å; D84-S86 PolarHBondContact OD1-OG 3.07Å; D84-S86 PolarHBondContact OD2-OG 3.47Å; D84-L87 HydrophobicContact CB-CD1 4.09Å; D84-L87 HydrophobicContact CB-CG 4.27Å; D84-L87 PolarHBondContact O-N 3.42Å |
| 85 | P | 57.1 | Low | 52.6 | Low | 91 Ų | 91 | 116.9 Ų | 116.9 | 59% | 0.591 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -60.6 | -17.1 | -178.4 | 22.4 | -31.8 | 0 | 0 | 0 | 113 | E83 E88 V89 | E83-P85 WeakPolarHBondContact O-CD 3.2Å; P85-E88 PolarHBondContact O-N 3.43Å; P85-V89 WeakPolarHBondContact O-CG2 3.22Å; P85-V89 PolarHBondContact O-N 3.46Å |
| 86 | S | 56.8 | Low | 52.9 | Low | 65 Ų | 65 | 113.6 Ų | 113.6 | 46% | 0.455 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -68 | -33.2 | 173.1 | 64.4 | 0 | 0 | 0 | 0 | 113.4 | D84 E88 E90 | D84-S86 PolarHBondContact O-N 3.2Å; D84-S86 WeakPolarHBondContact OD1-CB 3.27Å; D84-S86 PolarHBondContact OD1-N 3.23Å; D84-S86 PolarHBondContact OD1-OG 3.07Å; D84-S86 PolarHBondContact OD2-OG 3.47Å; S86-E88 VanDerWaalsContact C-N 3.3Å; S86-E88 PolarHBondContact O-N 3.26Å; S86-E90 WeakPolarHBondContact O-CB 3.38Å; S86-E90 PolarHBondContact O-N 3.37Å |
| 87 | L | 56.3 | Low | 52.7 | Low | 88 Ų | 88 | 112.6 Ų | 112.6 | 46% | 0.461 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -75.8 | -20.7 | 178.3 | -67.3 | 171.8 | 0 | 0 | 0 | 112.7 | D84 R91 | D84-L87 HydrophobicContact CB-CD1 4.09Å; D84-L87 HydrophobicContact CB-CG 4.27Å; D84-L87 PolarHBondContact O-N 3.42Å; L87-R91 WeakPolarHBondContact O-CB 3.23Å; L87-R91 WeakPolarHBondContact O-CG 3.27Å; L87-R91 PolarHBondContact O-N 3.32Å; L87-R91 VanDerWaalsContact O-N 3.13Å; L87-R91 PolarHBondContact O-NE 2.65Å; L87-R91 VanDerWaalsContact O-NE 3.13Å |
| 88 | E | 56.5 | Low | 53.3 | Low | 98 Ų | 98 | 110.1 Ų | 110.1 | 46% | 0.458 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -82.6 | -41 | 177.2 | -149.8 | 159.6 | -160.5 | 0 | 0 | 110.5 | P85 S86 R91 E92 | P85-E88 PolarHBondContact O-N 3.43Å; S86-E88 VanDerWaalsContact C-N 3.3Å; S86-E88 PolarHBondContact O-N 3.26Å; E88-R91 PolarHBondContact O-N 3.22Å; E88-E92 WeakPolarHBondContact O-CB 3.25Å; E88-E92 PolarHBondContact O-N 3.21Å |
| 89 | V | 63.4 | Low | 53.1 | Low | 79 Ų | 79 | 110.1 Ų | 110.1 | 48% | 0.479 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -63 | -39.9 | 170 | 175 | 0 | 0 | 0 | 0 | 111.4 | P85 E92 L93 | P85-V89 WeakPolarHBondContact O-CG2 3.22Å; P85-V89 PolarHBondContact O-N 3.46Å; V89-E92 PolarHBondContact O-N 2.95Å; V89-L93 HydrophobicContact CG1-CD1 3.76Å; V89-L93 WeakPolarHBondContact O-CB 3.42Å; V89-L93 VanDerWaalsContact O-CD1 3.26Å; V89-L93 WeakPolarHBondContact O-CD1 3.46Å; V89-L93 PolarHBondContact O-N 3.35Å |
| 90 | E | 58.6 | Low | 53.2 | Low | 124 Ų | 124 | 109.9 Ų | 109.9 | 58% | 0.579 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -68.4 | -38.2 | 175.8 | -162.3 | 173 | -161.1 | 0 | 0 | 111.8 | S86 L93 C94 | S86-E90 WeakPolarHBondContact O-CB 3.38Å; S86-E90 PolarHBondContact O-N 3.37Å; E90-L93 PolarHBondContact O-N 3.32Å; E90-C94 WeakPolarHBondContact O-CB 3.19Å; E90-C94 PolarHBondContact O-N 3.46Å; E90-C94 PolarHBondContact O-SG 3.5Å; E90-C94 VanDerWaalsContact O-SG 3.34Å |
| 91 | R | 57.7 | Low | 53.6 | Low | 127 Ų | 127 | 110.2 Ų | 110.2 | 48% | 0.479 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -66.2 | -38.7 | 171.9 | -85.8 | -177.8 | -81.8 | 176.3 | -3.3 | 112.6 | E83 L87 E88 C94 R95 | E83-R91 IonicContact OE1-NH1 2.83Å; E83-R91 IonicContact OE1-NH2 2.94Å; E83-R91 PolarHBondContact OE1-NH2 3.49Å; L87-R91 WeakPolarHBondContact O-CB 3.23Å; L87-R91 WeakPolarHBondContact O-CG 3.27Å; L87-R91 PolarHBondContact O-N 3.32Å; L87-R91 VanDerWaalsContact O-N 3.13Å; L87-R91 PolarHBondContact O-NE 2.65Å; L87-R91 VanDerWaalsContact O-NE 3.13Å; E88-R91 PolarHBondContact O-N 3.22Å; R91-C94 PolarHBondContact O-N 3.3Å; R91-R95 WeakPolarHBondContact O-CB 3.48Å; R91-R95 PolarHBondContact O-N 3.02Å |
| 92 | E | 54.9 | Low | 53.9 | Low | 130 Ų | 130 | 108.2 Ų | 108.2 | 61% | 0.607 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -68.7 | -39.2 | 174 | -94.8 | -179.2 | 154.7 | 0 | 0 | 111.9 | E88 V89 R95 A96 | E88-E92 WeakPolarHBondContact O-CB 3.25Å; E88-E92 PolarHBondContact O-N 3.21Å; V89-E92 PolarHBondContact O-N 2.95Å; E92-R95 PolarHBondContact O-N 3.04Å; E92-A96 WeakPolarHBondContact O-CB 3.35Å; E92-A96 PolarHBondContact O-N 3.28Å |
| 93 | L | 52.8 | Low | 54.7 | Low | 93 Ų | 93 | 108.4 Ų | 108.4 | 49% | 0.487 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -63 | -47.8 | 170.5 | -101.9 | 94.5 | 0 | 0 | 0 | 110.7 | V89 E90 R95 A96 F97 | V89-L93 HydrophobicContact CG1-CD1 3.76Å; V89-L93 WeakPolarHBondContact O-CB 3.42Å; V89-L93 VanDerWaalsContact O-CD1 3.26Å; V89-L93 WeakPolarHBondContact O-CD1 3.46Å; V89-L93 PolarHBondContact O-N 3.35Å; E90-L93 PolarHBondContact O-N 3.32Å; L93-R95 VanDerWaalsContact C-N 3.29Å; L93-R95 PolarHBondContact O-N 3.4Å; L93-A96 PolarHBondContact O-N 2.92Å; L93-F97 HydrophobicContact CD2-CE2 4.26Å; L93-F97 WeakPolarHBondContact O-CB 3.37Å; L93-F97 VanDerWaalsContact O-CD2 3.24Å; L93-F97 WeakPolarHBondContact O-CD2 3.29Å; L93-F97 PolarHBondContact O-N 3.06Å |
| 94 | C | 53.1 | Low | 56.1 | Low | 85 Ų | 85 | 104.3 Ų | 104.3 | 57% | 0.574 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -59.4 | -39.4 | 175.9 | -77 | 0 | 0 | 0 | 0 | 112.1 | E90 R91 S98 | E90-C94 WeakPolarHBondContact O-CB 3.19Å; E90-C94 PolarHBondContact O-N 3.46Å; E90-C94 PolarHBondContact O-SG 3.5Å; E90-C94 VanDerWaalsContact O-SG 3.34Å; R91-C94 PolarHBondContact O-N 3.3Å; C94-S98 WeakPolarHBondContact O-CB 3.37Å; C94-S98 PolarHBondContact O-N 3.03Å |
| 95 | R | 50.8 | Low | 57.6 | Low | 178 Ų | 178 | 103.6 Ų | 103.6 | 67% | 0.672 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -67.1 | -43.8 | 172.7 | -88.5 | -177.1 | 173 | 164.1 | -1.9 | 112.3 | R91 E92 L93 F97 S98 E99 | R91-R95 WeakPolarHBondContact O-CB 3.48Å; R91-R95 PolarHBondContact O-N 3.02Å; E92-R95 PolarHBondContact O-N 3.04Å; L93-R95 VanDerWaalsContact C-N 3.29Å; L93-R95 PolarHBondContact O-N 3.4Å; R95-F97 VanDerWaalsContact C-N 3.34Å; R95-F97 PolarHBondContact O-N 3.09Å; R95-S98 CarbonylContact O-C 3.45Å; R95-S98 WeakPolarHBondContact O-CA 3.19Å; R95-S98 WeakPolarHBondContact O-CB 3.37Å; R95-S98 PolarHBondContact O-N 3.38Å; R95-E99 WeakPolarHBondContact O-CB 3.44Å; R95-E99 WeakPolarHBondContact O-CG 3.27Å; R95-E99 PolarHBondContact O-N 3.15Å |
| 96 | A | 47.5 | Very low | 59.1 | Low | 50 Ų | 50 | 102.8 Ų | 102.8 | 41% | 0.413 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -63.1 | -40.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | E92 L93 S98 E99 T100 | E92-A96 WeakPolarHBondContact O-CB 3.35Å; E92-A96 PolarHBondContact O-N 3.28Å; L93-A96 PolarHBondContact O-N 2.92Å; A96-S98 VanDerWaalsContact C-N 3.33Å; A96-S98 PolarHBondContact O-N 3.34Å; A96-E99 PolarHBondContact O-N 3.49Å; A96-T100 PolarHBondContact O-N 3.43Å; A96-T100 PolarHBondContact O-OG1 2.94Å |
| 97 | F | 47.3 | Very low | 60.7 | Low | 158 Ų | 158 | 101.3 Ų | 101.3 | 69% | 0.693 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -65.2 | -35.2 | 171.1 | -87.2 | -77.3 | 0 | 0 | 0 | 112.3 | L93 R95 | L93-F97 HydrophobicContact CD2-CE2 4.26Å; L93-F97 WeakPolarHBondContact O-CB 3.37Å; L93-F97 VanDerWaalsContact O-CD2 3.24Å; L93-F97 WeakPolarHBondContact O-CD2 3.29Å; L93-F97 PolarHBondContact O-N 3.06Å; R95-F97 VanDerWaalsContact C-N 3.34Å; R95-F97 PolarHBondContact O-N 3.09Å |
| 98 | S | 53.8 | Low | 62.4 | Low | 75 Ų | 75 | 97.6 Ų | 97.6 | 52% | 0.524 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -72.9 | -30.4 | 174.2 | -126.5 | 0 | 0 | 0 | 0 | 113.4 | C94 R95 A96 L101 | C94-S98 WeakPolarHBondContact O-CB 3.37Å; C94-S98 PolarHBondContact O-N 3.03Å; R95-S98 CarbonylContact O-C 3.45Å; R95-S98 WeakPolarHBondContact O-CA 3.19Å; R95-S98 WeakPolarHBondContact O-CB 3.37Å; R95-S98 PolarHBondContact O-N 3.38Å; A96-S98 VanDerWaalsContact C-N 3.33Å; A96-S98 PolarHBondContact O-N 3.34Å; S98-L101 WeakPolarHBondContact O-CB 3.32Å; S98-L101 WeakPolarHBondContact O-CD1 3.36Å; S98-L101 WeakPolarHBondContact O-CG 3.45Å; S98-L101 PolarHBondContact O-N 3.27Å |
| 99 | E | 42.8 | Very low | 63.9 | Low | 162 Ų | 162 | 100 Ų | 100 | 76% | 0.757 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -84.3 | -14.7 | 176.6 | -73.3 | -178.3 | -176.8 | 0 | 0 | 112.6 | R95 A96 L101 | R95-E99 WeakPolarHBondContact O-CB 3.44Å; R95-E99 WeakPolarHBondContact O-CG 3.27Å; R95-E99 PolarHBondContact O-N 3.15Å; A96-E99 PolarHBondContact O-N 3.49Å; E99-L101 PolarHBondContact O-N 2.97Å |
| 100 | T | 47.3 | Very low | 65.1 | Low | 111 Ų | 111 | 104.7 Ų | 104.7 | 68% | 0.681 | 54% | 0.54 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.2 | 13.3 | 166.4 | -31 | 0 | 0 | 0 | 0 | 112.2 | A96 L102 | A96-T100 PolarHBondContact O-N 3.43Å; A96-T100 PolarHBondContact O-OG1 2.94Å; T100-L102 PolarHBondContact O-N 3.4Å |
| 101 | L | 56.6 | Low | 66.7 | Low | 110 Ų | 110 | 99.6 Ų | 99.6 | 58% | 0.576 | 52% | 0.517 | S | S | * | . | S | Bend | trans | -60.7 | 110.5 | 161.7 | -75.7 | 169.8 | 0 | 0 | 0 | 106.7 | S98 E99 | S98-L101 WeakPolarHBondContact O-CB 3.32Å; S98-L101 WeakPolarHBondContact O-CD1 3.36Å; S98-L101 WeakPolarHBondContact O-CG 3.45Å; S98-L101 PolarHBondContact O-N 3.27Å; E99-L101 PolarHBondContact O-N 2.97Å |
| 102 | L | 55.2 | Low | 68.2 | Low | 111 Ų | 111 | 97 Ų | 97 | 58% | 0.581 | 52% | 0.523 | S | S | * | . | trans | -38.4 | 136.6 | 164 | -68.8 | 166.9 | 0 | 0 | 0 | 108.1 | T100 V104 P314 | T100-L102 PolarHBondContact O-N 3.4Å; L102-V104 WeakPolarHBondContact O-CG2 3.36Å; L102-V104 PolarHBondContact O-N 3.37Å; L102-P314 HydrophobicContact CD1-CB 3.51Å; L102-P314 HydrophobicContact CD1-CG 4.05Å | ||
| 103 | P | 72.4 | Confident | 69.9 | Low | 128 Ų | 128 | 95.5 Ų | 95.5 | 83% | 0.831 | 53% | 0.533 | S | S | * | . | trans | -62.7 | 89.6 | 177 | 24.2 | -31.4 | 0 | 0 | 0 | 108.1 | P105 | P103-P105 WeakPolarHBondContact O-CD 3.31Š| ||
| 104 | V | 81.6 | Confident | 71.7 | Confident | 41 Ų | 41 | 95.9 Ų | 95.9 | 25% | 0.248 | 53% | 0.532 | C | S | . | . | trans | -75.9 | 115.5 | 178.7 | -178.8 | 0 | 0 | 0 | 0 | 105.4 | L102 D106 T315 H318 Y319 | L102-V104 WeakPolarHBondContact O-CG2 3.36Å; L102-V104 PolarHBondContact O-N 3.37Å; V104-D106 PolarHBondContact O-N 3.22Å; V104-T315 HydrophobicContact CG1-CG2 4.05Å; V104-H318 HydrophobicContact CG1-CB 4.06Å; V104-H318 HydrophobicContact CG2-CB 3.96Å; V104-Y319 HydrophobicContact CG1-CD2 4.29Å; V104-Y319 HydrophobicContact CG1-CE2 3.72Å | ||
| 105 | P | 87.4 | Confident | 73.4 | Confident | 72 Ų | 72 | 96.8 Ų | 96.8 | 47% | 0.468 | 54% | 0.537 | S | S | . | . | trans | -63 | 138 | -179.2 | 26.5 | -34 | 0 | 0 | 0 | 109.6 | P103 V107 T315 Y319 | P103-P105 WeakPolarHBondContact O-CD 3.31Å; P105-V107 PolarHBondContact O-N 3.12Å; P105-V107 VanDerWaalsContact O-N 3.09Å; P105-T315 HydrophobicContact CG-CG2 3.93Å; P105-Y319 PolarHBondContact O-OH 3.47Å | ||
| 106 | D | 88.9 | Confident | 75.2 | Confident | 73 Ų | 73 | 95.6 Ų | 95.6 | 39% | 0.39 | 54% | 0.539 | S | S | . | . | trans | -73.8 | 101.7 | 172.8 | -166.8 | -9.3 | 0 | 0 | 0 | 109.7 | V104 D108 E109 | V104-D106 PolarHBondContact O-N 3.22Å; D106-D108 PolarHBondContact O-N 3Å; D106-D108 VanDerWaalsContact O-N 3.12Å; D106-D108 PolarHBondContact OD1-N 3.34Å; D106-D108 VanDerWaalsContact OD1-N 3.12Å; D106-E109 HydrophobicContact CB-CB 4.32Å; D106-E109 PolarHBondContact O-N 2.85Å | ||
| 107 | V | 90.6 | Very high | 77.2 | Confident | 34 Ų | 34 | 96.3 Ų | 96.3 | 21% | 0.206 | 54% | 0.535 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -67.6 | -9 | -177.6 | -57.4 | 0 | 0 | 0 | 0 | 113.5 | P105 K262 V263 T315 Y319 | P105-V107 PolarHBondContact O-N 3.12Å; P105-V107 VanDerWaalsContact O-N 3.09Å; V107-K262 WeakPolarHBondContact O-CE 3.32Å; V107-V263 HydrophobicContact CG1-CB 4.45Å; V107-V263 HydrophobicContact CG1-CG1 4.39Å; V107-V263 HydrophobicContact CG1-CG2 4.35Å; V107-V263 HydrophobicContact CG2-CG2 4.01Å; V107-T315 HydrophobicContact CG1-CG2 4.49Å; V107-Y319 HydrophobicContact CB-CE2 4.48Å; V107-Y319 HydrophobicContact CG1-CD2 4.38Å; V107-Y319 HydrophobicContact CG1-CE2 3.71Å; V107-Y319 HydrophobicContact CG2-CE1 3.99Å; V107-Y319 HydrophobicContact CG2-CE2 4.04Å; V107-Y319 PolarHBondContact N-OH 2.9Å |
| 108 | D | 90.9 | Very high | 79.2 | Confident | 10 Ų | 10 | 91.5 Ų | 91.5 | 5% | 0.053 | 52% | 0.521 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -111.5 | 3.6 | -177 | -55.2 | -55.7 | 0 | 0 | 0 | 113.1 | D106 Q110 D111 V122 R259 K262 | D106-D108 PolarHBondContact O-N 3Å; D106-D108 VanDerWaalsContact O-N 3.12Å; D106-D108 PolarHBondContact OD1-N 3.34Å; D106-D108 VanDerWaalsContact OD1-N 3.12Å; D108-Q110 PolarHBondContact O-N 3.42Å; D108-Q110 VanDerWaalsContact O-N 3.16Å; D108-D111 WeakPolarHBondContact CA-OD2 3.31Å; D108-D111 WeakPolarHBondContact CB-OD2 3.3Å; D108-D111 WeakPolarHBondContact O-CB 3.22Å; D108-D111 PolarHBondContact O-N 3Å; D108-D111 VanDerWaalsContact O-N 3.13Å; D108-V122 WeakPolarHBondContact OD2-CG1 3.42Å; D108-R259 IonicContact OD1-CZ 2.78Å; D108-R259 IonicContact OD1-NH1 2.73Å; D108-R259 PolarHBondContact OD1-NH1 3.5Å; D108-R259 IonicContact OD1-NH2 3.21Å; D108-R259 IonicContact OD2-CZ 3.7Å; D108-R259 IonicContact OD2-NH1 3.63Å; D108-R259 PolarHBondContact OD2-NH1 3.46Å; D108-R259 IonicContact OD2-NH2 2.79Å; D108-R259 PolarHBondContact OD2-NH2 2.81Å; D108-K262 IonicContact OD1-NZ 2.49Å; D108-K262 PolarHBondContact OD1-NZ 3.43Å |
| 109 | E | 88.9 | Confident | 81 | Confident | 149 Ų | 149 | 89.1 Ų | 89.1 | 70% | 0.696 | 50% | 0.504 | S | S | * | . | G | 310 helix | trans | -55.6 | -36.7 | -175.1 | -175.1 | 177.6 | -156.2 | 0 | 0 | 113 | D106 | D106-E109 HydrophobicContact CB-CB 4.32Å; D106-E109 PolarHBondContact O-N 2.85Å |
| 110 | Q | 88.4 | Confident | 83.3 | Confident | 178 Ų | 178 | 88.9 Ų | 88.9 | 83% | 0.832 | 50% | 0.503 | S | S | * | . | G | 310 helix | trans | -90.8 | -0.4 | -174.8 | -61.4 | -179.7 | 10.7 | 0 | 0 | 114 | D108 | D108-Q110 PolarHBondContact O-N 3.42Å; D108-Q110 VanDerWaalsContact O-N 3.16Å |
| 111 | D | 92.1 | Very high | 85.5 | Confident | 16 Ų | 16 | 90.8 Ų | 90.8 | 9% | 0.086 | 50% | 0.498 | C | S | . | . | G | 310 helix | trans | -84.7 | -10.4 | -172.1 | -67.1 | -9 | 0 | 0 | 0 | 114.4 | D108 A113 E114 L117 K262 | D108-D111 WeakPolarHBondContact CA-OD2 3.31Å; D108-D111 WeakPolarHBondContact CB-OD2 3.3Å; D108-D111 WeakPolarHBondContact O-CB 3.22Å; D108-D111 PolarHBondContact O-N 3Å; D108-D111 VanDerWaalsContact O-N 3.13Å; D111-A113 PolarHBondContact O-N 2.85Å; D111-E114 PolarHBondContact O-N 3.4Å; D111-L117 HydrophobicContact CB-CB 4.09Å; D111-L117 HydrophobicContact CB-CD1 3.8Å; D111-L117 VanDerWaalsContact CG-CD1 3.5Å; D111-L117 WeakPolarHBondContact OD1-CD1 3.42Å; D111-K262 IonicContact OD1-NZ 2.64Å; D111-K262 PolarHBondContact OD1-NZ 3.32Å; D111-K262 IonicContact OD2-NZ 2.95Å; D111-K262 PolarHBondContact OD2-NZ 2.98Å |
| 112 | A | 87.9 | Confident | 87.3 | Confident | 74 Ų | 74 | 86.1 Ų | 86.1 | 61% | 0.612 | 47% | 0.474 | S | S | * | . | G | 310 helix | trans | -56.8 | -24.8 | -170.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 113 | A | 90.8 | Very high | 89 | Confident | 98 Ų | 98 | 87 Ų | 87 | 81% | 0.81 | 47% | 0.474 | S | S | * | . | G | 310 helix | trans | -80.9 | -13.8 | 178 | 0 | 0 | 0 | 0 | 0 | 114.3 | D111 P115 | D111-A113 PolarHBondContact O-N 2.85Å; A113-P115 WeakPolarHBondContact O-CD 3.44Å |
| 114 | E | 90.9 | Very high | 90.2 | Very high | 100 Ų | 100 | 86 Ų | 86 | 47% | 0.467 | 46% | 0.461 | S | S | . | . | trans | -113.6 | 96.3 | -176.4 | -167.6 | 165.9 | -83.2 | 0 | 0 | 111 | D111 Q116 L117 | D111-E114 PolarHBondContact O-N 3.4Å; E114-Q116 HydrophobicContact CG-CB 4.44Å; E114-Q116 VanDerWaalsContact CG-OE1 3.29Å; E114-Q116 PolarHBondContact O-N 3.03Å; E114-L117 HydrophobicContact CB-CD1 3.9Å; E114-L117 HydrophobicContact CB-CG 4.01Å; E114-L117 HydrophobicContact CG-CD1 4.24Å; E114-L117 HydrophobicContact CG-CG 3.97Å; E114-L117 PolarHBondContact O-N 3.39Å; E114-L117 WeakPolarHBondContact OE2-CD1 3.45Å; E114-L117 WeakPolarHBondContact OE2-CD2 3.36Å; E114-L117 VanDerWaalsContact OE2-CG 3.28Å; E114-L117 WeakPolarHBondContact OE2-CG 3.38Å | ||
| 115 | P | 89.9 | Confident | 90.9 | Very high | 104 Ų | 104 | 87.2 Ų | 87.2 | 68% | 0.675 | 47% | 0.466 | S | S | * | . | G | 310 helix | trans | -57.7 | -27 | -175.6 | -26.4 | 34.9 | 0 | 0 | 0 | 114.1 | A113 L117 C118 | A113-P115 WeakPolarHBondContact O-CD 3.44Å; P115-L117 PolarHBondContact O-N 2.88Å; P115-C118 PolarHBondContact O-N 3.23Å; P115-C118 PolarHBondContact O-SG 3.14Å |
| 116 | Q | 88.9 | Confident | 91.3 | Very high | 153 Ų | 153 | 86 Ų | 86 | 72% | 0.715 | 45% | 0.452 | S | S | * | . | G | 310 helix | trans | -66.3 | -23 | 178.7 | -63.2 | 83.9 | -4 | 0 | 0 | 113.2 | E114 C118 | E114-Q116 HydrophobicContact CG-CB 4.44Å; E114-Q116 VanDerWaalsContact CG-OE1 3.29Å; E114-Q116 PolarHBondContact O-N 3.03Å; Q116-C118 VanDerWaalsContact C-N 3.3Å |
| 117 | L | 88.7 | Confident | 91.7 | Very high | 65 Ų | 65 | 85.4 Ų | 85.4 | 34% | 0.34 | 46% | 0.457 | S | S | . | . | G | 310 helix | trans | -80.8 | -14.2 | 178 | -60.4 | -178.4 | 0 | 0 | 0 | 112.6 | D111 E114 P115 S119 | D111-L117 HydrophobicContact CB-CB 4.09Å; D111-L117 HydrophobicContact CB-CD1 3.8Å; D111-L117 VanDerWaalsContact CG-CD1 3.5Å; D111-L117 WeakPolarHBondContact OD1-CD1 3.42Å; E114-L117 HydrophobicContact CB-CD1 3.9Å; E114-L117 HydrophobicContact CB-CG 4.01Å; E114-L117 HydrophobicContact CG-CD1 4.24Å; E114-L117 HydrophobicContact CG-CG 3.97Å; E114-L117 PolarHBondContact O-N 3.39Å; E114-L117 WeakPolarHBondContact OE2-CD1 3.45Å; E114-L117 WeakPolarHBondContact OE2-CD2 3.36Å; E114-L117 VanDerWaalsContact OE2-CG 3.28Å; E114-L117 WeakPolarHBondContact OE2-CG 3.38Å; P115-L117 PolarHBondContact O-N 2.88Å; L117-S119 PolarHBondContact O-N 3.42Å; L117-S119 VanDerWaalsContact O-N 3.14Å |
| 118 | C | 89.8 | Confident | 92 | Very high | 57 Ų | 57 | 90.4 Ų | 90.4 | 39% | 0.385 | 47% | 0.474 | S | S | . | . | trans | 49.6 | 39.5 | 176.1 | -63.9 | 0 | 0 | 0 | 0 | 113.2 | P115 Q116 H120 Y121 V122 I125 | P115-C118 PolarHBondContact O-N 3.23Å; P115-C118 PolarHBondContact O-SG 3.14Å; Q116-C118 VanDerWaalsContact C-N 3.3Å; C118-H120 PolarHBondContact O-N 2.91Å; C118-H120 VanDerWaalsContact O-N 3.13Å; C118-Y121 CarbonylContact O-C 3.49Å; C118-Y121 PolarHBondContact O-N 2.93Å; C118-V122 PolarHBondContact O-N 3.41Å; C118-I125 HydrophobicContact CB-CD1 4.26Å | ||
| 119 | S | 90.8 | Very high | 92.4 | Very high | 25 Ų | 25 | 91 Ų | 91 | 18% | 0.175 | 48% | 0.477 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -55.9 | -34.6 | -170.6 | 58.5 | 0 | 0 | 0 | 0 | 114.1 | L117 Y121 V122 | L117-S119 PolarHBondContact O-N 3.42Å; L117-S119 VanDerWaalsContact O-N 3.14Å; S119-Y121 VanDerWaalsContact C-N 3.28Å; S119-Y121 PolarHBondContact O-N 3Å; S119-V122 WeakPolarHBondContact O-CG1 3.48Å |
| 120 | H | 90.3 | Very high | 92.8 | Very high | 157 Ų | 157 | 86.4 Ų | 86.4 | 73% | 0.727 | 45% | 0.453 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.9 | -30.5 | 174.1 | -69.1 | -69.5 | 0 | 0 | 0 | 114.1 | C118 | C118-H120 PolarHBondContact O-N 2.91Å; C118-H120 VanDerWaalsContact O-N 3.13Å |
| 121 | Y | 93.9 | Very high | 93.2 | Very high | 151 Ų | 151 | 80 Ų | 80 | 59% | 0.592 | 43% | 0.428 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -106.8 | -7.3 | -176 | -63.9 | -77.2 | 0 | 0 | 0 | 113 | C118 S119 K123 D124 I125 | C118-Y121 CarbonylContact O-C 3.49Å; C118-Y121 PolarHBondContact O-N 2.93Å; S119-Y121 VanDerWaalsContact C-N 3.28Å; S119-Y121 PolarHBondContact O-N 3Å; Y121-K123 VanDerWaalsContact C-N 3.27Å; Y121-K123 PolarHBondContact O-N 3.09Å; Y121-D124 PolarHBondContact O-N 3.18Å; Y121-I125 WeakPolarHBondContact O-CB 3.3Å; Y121-I125 VanDerWaalsContact O-CG1 3.26Å; Y121-I125 WeakPolarHBondContact O-CG1 3.4Å; Y121-I125 PolarHBondContact O-N 3.44Å |
| 122 | V | 94.4 | Very high | 93.5 | Very high | 12 Ų | 12 | 79.8 Ų | 79.8 | 7% | 0.073 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -58.5 | -40.1 | -169.7 | 74.9 | 0 | 0 | 0 | 0 | 111.9 | D108 C118 S119 I125 Y126 R259 | D108-V122 WeakPolarHBondContact OD2-CG1 3.42Å; C118-V122 PolarHBondContact O-N 3.41Å; S119-V122 WeakPolarHBondContact O-CG1 3.48Å; V122-I125 PolarHBondContact O-N 3.23Å; V122-Y126 HydrophobicContact CG2-CD2 3.81Å; V122-Y126 HydrophobicContact CG2-CE2 3.76Å; V122-Y126 VanDerWaalsContact O-CD2 3.25Å; V122-Y126 WeakPolarHBondContact O-CD2 3.3Å; V122-Y126 PolarHBondContact O-N 2.7Å; V122-R259 VanDerWaalsContact CG2-NH1 3.33Å |
| 123 | K | 92.1 | Very high | 94 | Very high | 130 Ų | 130 | 76.4 Ų | 76.4 | 57% | 0.565 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -62.5 | -47.3 | 176.9 | -65.1 | 179.3 | -176.6 | 172.3 | 0 | 111.1 | Y121 Y126 A127 | Y121-K123 VanDerWaalsContact C-N 3.27Å; Y121-K123 PolarHBondContact O-N 3.09Å; K123-Y126 PolarHBondContact O-N 3.08Å; K123-A127 WeakPolarHBondContact O-CB 3.4Å; K123-A127 PolarHBondContact O-N 3.27Å |
| 124 | D | 96.1 | Very high | 94.3 | Very high | 107 Ų | 107 | 75.9 Ų | 75.9 | 57% | 0.572 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -65.9 | -41 | 179.1 | -60.2 | -21 | 0 | 0 | 0 | 112 | Y121 A127 Y128 | Y121-D124 PolarHBondContact O-N 3.18Å; D124-A127 PolarHBondContact O-N 2.95Å; D124-Y128 WeakPolarHBondContact O-CB 3.29Å; D124-Y128 PolarHBondContact O-N 3.05Å |
| 125 | I | 96.7 | Very high | 94.6 | Very high | 67 Ų | 67 | 77.7 Ų | 77.7 | 34% | 0.344 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -58.9 | -53.6 | 176.3 | -69.9 | 164.7 | 0 | 0 | 0 | 109.2 | C118 Y121 V122 A127 Y128 L129 | C118-I125 HydrophobicContact CB-CD1 4.26Å; Y121-I125 WeakPolarHBondContact O-CB 3.3Å; Y121-I125 VanDerWaalsContact O-CG1 3.26Å; Y121-I125 WeakPolarHBondContact O-CG1 3.4Å; Y121-I125 PolarHBondContact O-N 3.44Å; V122-I125 PolarHBondContact O-N 3.23Å; I125-A127 VanDerWaalsContact C-N 3.34Å; I125-A127 PolarHBondContact O-N 3.4Å; I125-Y128 WeakPolarHBondContact O-CB 3.5Å; I125-Y128 PolarHBondContact O-N 3Å; I125-Y128 VanDerWaalsContact O-N 3.16Å; I125-L129 HydrophobicContact CG2-CD1 4.19Å; I125-L129 HydrophobicContact CG2-CG 4.26Å; I125-L129 VanDerWaalsContact O-CG 3.31Å; I125-L129 WeakPolarHBondContact O-CG 3.28Å; I125-L129 PolarHBondContact O-N 3.4Å |
| 126 | Y | 96.3 | Very high | 94.9 | Very high | 45 Ų | 45 | 73.3 Ų | 73.3 | 18% | 0.176 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -69 | -31.2 | -177.9 | -80.4 | -78.6 | 0 | 0 | 0 | 112.9 | V122 K123 L129 R130 H255 F256 R259 | V122-Y126 HydrophobicContact CG2-CD2 3.81Å; V122-Y126 HydrophobicContact CG2-CE2 3.76Å; V122-Y126 VanDerWaalsContact O-CD2 3.25Å; V122-Y126 WeakPolarHBondContact O-CD2 3.3Å; V122-Y126 PolarHBondContact O-N 2.7Å; K123-Y126 PolarHBondContact O-N 3.08Å; Y126-L129 HydrophobicContact CD1-CD1 4.27Å; Y126-L129 HydrophobicContact CE1-CD1 4.23Å; Y126-R130 WeakPolarHBondContact O-CG 3.46Å; Y126-R130 PolarHBondContact O-N 2.55Å; Y126-H255 WeakPolarHBondContact CE1-O 3.48Å; Y126-H255 PolarHBondContact OH-O 3.23Å; Y126-F256 AromaticContact CD1-CD1 3.91Å; Y126-F256 HydrophobicContact CD1-CD1 3.91Å; Y126-F256 HydrophobicContact CD1-CE1 4.01Å; Y126-F256 HydrophobicContact CE1-CD1 4.07Å; Y126-F256 HydrophobicContact CE1-CE1 4.5Å; Y126-R259 HydrophobicContact CD1-CB 4.31Å; Y126-R259 HydrophobicContact CD1-CG 4.31Å; Y126-R259 HydrophobicContact CD2-CG 4.28Å; Y126-R259 HydrophobicContact CE1-CB 3.56Å; Y126-R259 HydrophobicContact CE1-CG 4.02Å; Y126-R259 HydrophobicContact CE2-CB 4.02Å; Y126-R259 HydrophobicContact CE2-CG 4.02Å; Y126-R259 HydrophobicContact CG-CG 4.46Å; Y126-R259 VanDerWaalsContact CZ-CB 3.43Å; Y126-R259 WeakPolarHBondContact OH-CB 3.32Å |
| 127 | A | 96.5 | Very high | 95.3 | Very high | 61 Ų | 61 | 68.4 Ų | 68.4 | 50% | 0.504 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -62.3 | -45.1 | 169.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | K123 D124 I125 R130 S131 | K123-A127 WeakPolarHBondContact O-CB 3.4Å; K123-A127 PolarHBondContact O-N 3.27Å; D124-A127 PolarHBondContact O-N 2.95Å; I125-A127 VanDerWaalsContact C-N 3.34Å; I125-A127 PolarHBondContact O-N 3.4Å; A127-R130 PolarHBondContact O-N 3.31Å; A127-S131 PolarHBondContact O-N 3.21Å |
| 128 | Y | 97.9 | Very high | 95.7 | Very high | 139 Ų | 139 | 65.8 Ų | 65.8 | 55% | 0.545 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -63.5 | -46.4 | 176 | 174 | -118.1 | 0 | 0 | 0 | 112.2 | D124 I125 R130 S131 L132 | D124-Y128 WeakPolarHBondContact O-CB 3.29Å; D124-Y128 PolarHBondContact O-N 3.05Å; I125-Y128 WeakPolarHBondContact O-CB 3.5Å; I125-Y128 PolarHBondContact O-N 3Å; I125-Y128 VanDerWaalsContact O-N 3.16Å; Y128-R130 VanDerWaalsContact C-N 3.3Å; Y128-R130 PolarHBondContact O-N 3.44Å; Y128-S131 WeakPolarHBondContact O-CB 3.4Å; Y128-S131 PolarHBondContact O-N 3.19Å; Y128-S131 PolarHBondContact O-OG 2.97Å; Y128-L132 HydrophobicContact CD1-CD1 3.9Å; Y128-L132 HydrophobicContact CD2-CD1 4.42Å; Y128-L132 HydrophobicContact CD2-CG 4.26Å; Y128-L132 HydrophobicContact CE1-CD1 3.29Å; Y128-L132 HydrophobicContact CE1-CG 4.13Å; Y128-L132 HydrophobicContact CE2-CD1 3.87Å; Y128-L132 HydrophobicContact CE2-CD2 4.08Å; Y128-L132 HydrophobicContact CE2-CG 3.77Å; Y128-L132 HydrophobicContact CG-CD1 4.44Å; Y128-L132 PolarHBondContact O-N 3.36Å; Y128-L132 WeakPolarHBondContact OH-CD1 3.49Å |
| 129 | L | 98.2 | Very high | 96.1 | Very high | 24 Ų | 24 | 70.3 Ų | 70.3 | 13% | 0.126 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -59.2 | -41.1 | 176.9 | -62.9 | -174.9 | 0 | 0 | 0 | 111.2 | I125 Y126 S131 L132 E133 P251 H255 F256 | I125-L129 HydrophobicContact CG2-CD1 4.19Å; I125-L129 HydrophobicContact CG2-CG 4.26Å; I125-L129 VanDerWaalsContact O-CG 3.31Å; I125-L129 WeakPolarHBondContact O-CG 3.28Å; I125-L129 PolarHBondContact O-N 3.4Å; Y126-L129 HydrophobicContact CD1-CD1 4.27Å; Y126-L129 HydrophobicContact CE1-CD1 4.23Å; L129-S131 VanDerWaalsContact C-N 3.32Å; L129-S131 PolarHBondContact O-N 3.19Å; L129-L132 PolarHBondContact O-N 3.03Å; L129-E133 PolarHBondContact O-N 3.11Å; L129-P251 HydrophobicContact CB-CB 4.06Å; L129-P251 HydrophobicContact CD2-CB 4.06Å; L129-P251 HydrophobicContact CG-CB 4.44Å; L129-P251 WeakPolarHBondContact O-CG 3.34Å; L129-H255 HydrophobicContact CD1-CB 3.92Å; L129-F256 HydrophobicContact CB-CE1 4.12Å; L129-F256 HydrophobicContact CB-CZ 3.71Å |
| 130 | R | 97.6 | Very high | 96.4 | Very high | 52 Ų | 52 | 71.8 Ų | 71.8 | 20% | 0.196 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -61.6 | -38.2 | 174 | -75.5 | -179.9 | -171.7 | -90.3 | 3.1 | 112.8 | Y126 A127 Y128 L132 E133 F256 Y319 S320 T321 | Y126-R130 WeakPolarHBondContact O-CG 3.46Å; Y126-R130 PolarHBondContact O-N 2.55Å; A127-R130 PolarHBondContact O-N 3.31Å; Y128-R130 VanDerWaalsContact C-N 3.3Å; Y128-R130 PolarHBondContact O-N 3.44Å; R130-L132 VanDerWaalsContact C-N 3.35Å; R130-E133 WeakPolarHBondContact O-CG 3.42Å; R130-F256 HydrophobicContact CG-CE1 4.11Å; R130-Y319 PolarHBondContact NH2-O 3.35Å; R130-S320 PolarHBondContact NH1-O 3.01Å; R130-S320 PolarHBondContact NH2-O 3.49Å; R130-T321 PolarHBondContact NH1-OG1 3.44Å |
| 131 | S | 97.9 | Very high | 96.7 | Very high | 44 Ų | 44 | 69.1 Ų | 69.1 | 31% | 0.308 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -64.9 | -40.4 | 174.4 | 81.2 | 0 | 0 | 0 | 0 | 111.8 | A127 Y128 L129 V134 Q135 | A127-S131 PolarHBondContact O-N 3.21Å; Y128-S131 WeakPolarHBondContact O-CB 3.4Å; Y128-S131 PolarHBondContact O-N 3.19Å; Y128-S131 PolarHBondContact O-OG 2.97Å; L129-S131 VanDerWaalsContact C-N 3.32Å; L129-S131 PolarHBondContact O-N 3.19Å; S131-V134 PolarHBondContact O-N 2.94Å; S131-Q135 WeakPolarHBondContact O-CG 3.44Å; S131-Q135 PolarHBondContact O-N 3.32Å; S131-Q135 VanDerWaalsContact O-N 3.12Å |
| 132 | L | 97.8 | Very high | 96.9 | Very high | 11 Ų | 11 | 62.7 Ų | 62.7 | 6% | 0.058 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -70.9 | -37.5 | -178.5 | -77.5 | 176.1 | 0 | 0 | 0 | 113.6 | Y128 L129 R130 V134 Q135 Q136 G249 P251 | Y128-L132 HydrophobicContact CD1-CD1 3.9Å; Y128-L132 HydrophobicContact CD2-CD1 4.42Å; Y128-L132 HydrophobicContact CD2-CG 4.26Å; Y128-L132 HydrophobicContact CE1-CD1 3.29Å; Y128-L132 HydrophobicContact CE1-CG 4.13Å; Y128-L132 HydrophobicContact CE2-CD1 3.87Å; Y128-L132 HydrophobicContact CE2-CD2 4.08Å; Y128-L132 HydrophobicContact CE2-CG 3.77Å; Y128-L132 HydrophobicContact CG-CD1 4.44Å; Y128-L132 PolarHBondContact O-N 3.36Å; Y128-L132 WeakPolarHBondContact OH-CD1 3.49Å; L129-L132 PolarHBondContact O-N 3.03Å; R130-L132 VanDerWaalsContact C-N 3.35Å; L132-V134 PolarHBondContact O-N 3.39Å; L132-Q135 PolarHBondContact O-N 3.04Å; L132-Q136 PolarHBondContact O-N 3.15Å; L132-G249 WeakPolarHBondContact CD1-O 3.49Å; L132-P251 HydrophobicContact CB-CG 4.33Å |
| 133 | E | 97.8 | Very high | 97.1 | Very high | 2 Ų | 2 | 62.7 Ų | 62.7 | 1% | 0.009 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -63.2 | -29.4 | 177.7 | 56.5 | -179.3 | -172.9 | 0 | 0 | 112.9 | L129 R130 A137 P251 F256 R291 P292 S293 | L129-E133 PolarHBondContact O-N 3.11Å; R130-E133 WeakPolarHBondContact O-CG 3.42Å; E133-A137 PolarHBondContact O-N 3.36Å; E133-P251 HydrophobicContact CB-CG 3.62Å; E133-F256 WeakPolarHBondContact OE2-CE2 3.28Å; E133-R291 HydrophobicContact CG-CB 4.47Å; E133-P292 HydrophobicContact CB-CG 4.3Å; E133-P292 WeakPolarHBondContact OE2-CD 3.47Å; E133-S293 WeakPolarHBondContact OE1-CB 3.18Å; E133-S293 PolarHBondContact OE1-OG 3Å; E133-S293 VanDerWaalsContact OE2-CB 3.29Å; E133-S293 WeakPolarHBondContact OE2-CB 3.3Å; E133-S293 PolarHBondContact OE2-N 3.28Å; E133-S293 PolarHBondContact OE2-OG 3.43Å; E133-S293 VanDerWaalsContact OE2-OG 3.06Å |
| 134 | V | 97.3 | Very high | 97.3 | Very high | 88 Ų | 88 | 65.2 Ų | 65.2 | 53% | 0.533 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -77 | -45.8 | 174.5 | 178.9 | 0 | 0 | 0 | 0 | 110.7 | S131 L132 Q136 A137 | S131-V134 PolarHBondContact O-N 2.94Å; L132-V134 PolarHBondContact O-N 3.39Å; V134-Q136 VanDerWaalsContact C-N 3.26Å; V134-Q136 PolarHBondContact O-N 3.29Å; V134-A137 WeakPolarHBondContact O-CB 3.29Å; V134-A137 PolarHBondContact O-N 3.45Å |
| 135 | Q | 96.9 | Very high | 97.1 | Very high | 137 Ų | 137 | 64.3 Ų | 64.3 | 64% | 0.64 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -61.4 | -35.3 | 178.8 | -71.4 | 172.8 | 23.5 | 0 | 0 | 112.6 | S131 L132 | S131-Q135 WeakPolarHBondContact O-CG 3.44Å; S131-Q135 PolarHBondContact O-N 3.32Å; S131-Q135 VanDerWaalsContact O-N 3.12Å; L132-Q135 PolarHBondContact O-N 3.04Å |
| 136 | Q | 96.8 | Very high | 97.1 | Very high | 13 Ų | 13 | 63.7 Ų | 63.7 | 6% | 0.061 | 35% | 0.352 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -109.4 | 38.4 | -178.1 | -56.8 | -172.4 | 13.2 | 0 | 0 | 111.9 | L132 V134 R250 | L132-Q136 PolarHBondContact O-N 3.15Å; V134-Q136 VanDerWaalsContact C-N 3.26Å; V134-Q136 PolarHBondContact O-N 3.29Å; Q136-R250 HydrophobicContact CB-CB 4.11Å; Q136-R250 HydrophobicContact CB-CG 4.07Å; Q136-R250 WeakPolarHBondContact O-CD 3.41Å; Q136-R250 PolarHBondContact O-NE 3.34Å |
| 137 | A | 97 | Very high | 97 | Very high | 50 Ų | 50 | 67 Ų | 67 | 41% | 0.413 | 37% | 0.37 | S | S | . | . | trans | -65.6 | 153.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113 | E133 V134 Q186 | E133-A137 PolarHBondContact O-N 3.36Å; V134-A137 WeakPolarHBondContact O-CB 3.29Å; V134-A137 PolarHBondContact O-N 3.45Å; A137-Q186 PolarHBondContact O-NE2 3.04Å | ||
| 138 | I | 98.1 | Very high | 97.1 | Very high | 9 Ų | 9 | 64.3 Ų | 64.3 | 5% | 0.046 | 35% | 0.346 | C | S | . | . | trans | -105.7 | 131.2 | 172.6 | -64.2 | 159.8 | 0 | 0 | 0 | 107.3 | Y142 D182 R183 V288 H289 | I138-Y142 HydrophobicContact CG2-CD1 3.66Å; I138-Y142 HydrophobicContact CG2-CE1 3.82Å; I138-D182 HydrophobicContact CD1-CB 3.58Å; I138-D182 HydrophobicContact CG1-CB 4.12Å; I138-D182 HydrophobicContact CG2-CB 4.17Å; I138-R183 HydrophobicContact CD1-CG 4.46Å; I138-R183 HydrophobicContact CG1-CG 3.83Å; I138-V288 WeakPolarHBondContact CB-O 3.4Å; I138-V288 HydrophobicContact CG2-CB 4.18Å; I138-V288 HydrophobicContact CG2-CG2 4.12Å; I138-H289 WeakPolarHBondContact O-CA 3.33Å | ||
| 139 | R | 97.8 | Very high | 97.1 | Very high | 153 Ų | 153 | 60.9 Ų | 60.9 | 58% | 0.577 | 34% | 0.34 | S | S | * | . | trans | -72.8 | 141 | -179.9 | -63.8 | -176.6 | -66.6 | 170.7 | 0.1 | 110.9 | Y142 Q186 | R139-Y142 WeakPolarHBondContact O-CD1 3.43Å; R139-Q186 PolarHBondContact NH2-O 3.29Å | ||
| 140 | A | 97.4 | Very high | 97.1 | Very high | 56 Ų | 56 | 62.4 Ų | 62.4 | 46% | 0.463 | 35% | 0.353 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.8 | 144.4 | 165.4 | 0 | 0 | 0 | 0 | 0 | 109.9 | Y142 H289 | A140-Y142 PolarHBondContact O-N 3.02Å; A140-H289 HydrophobicContact CB-CB 3.88Å |
| 141 | D | 96.9 | Very high | 97 | Very high | 100 Ų | 100 | 62.4 Ų | 62.4 | 54% | 0.535 | 36% | 0.364 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 52.2 | 29.9 | 176.8 | -58.4 | -39 | 0 | 0 | 0 | 115.6 | L143 K144 Y285 | D141-L143 PolarHBondContact O-N 2.99Å; D141-K144 HydrophobicContact CB-CB 4.39Å; D141-K144 WeakPolarHBondContact O-CB 3.32Å; D141-K144 PolarHBondContact O-N 3.26Å; D141-Y285 WeakPolarHBondContact CA-OH 3.31Å |
| 142 | Y | 97.9 | Very high | 97.1 | Very high | 16 Ų | 16 | 61.5 Ų | 61.5 | 6% | 0.063 | 36% | 0.355 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -57.7 | -16.2 | 179.6 | 75.7 | -105.6 | 0 | 0 | 0 | 115.6 | I138 R139 A140 R153 D182 L185 Q186 Y285 V288 | I138-Y142 HydrophobicContact CG2-CD1 3.66Å; I138-Y142 HydrophobicContact CG2-CE1 3.82Å; R139-Y142 WeakPolarHBondContact O-CD1 3.43Å; A140-Y142 PolarHBondContact O-N 3.02Å; Y142-R153 WeakPolarHBondContact OH-CD 3.33Å; Y142-R153 PolarHBondContact OH-NE 2.69Å; Y142-D182 HydrophobicContact CE1-CB 4.13Å; Y142-D182 PolarHBondContact OH-OD1 2.79Å; Y142-L185 HydrophobicContact CD2-CB 4.25Å; Y142-L185 HydrophobicContact CE2-CB 3.51Å; Y142-L185 HydrophobicContact CE2-CD1 4.37Å; Y142-Q186 HydrophobicContact CD1-CB 4.47Å; Y142-Q186 HydrophobicContact CD2-CB 3.83Å; Y142-Q186 HydrophobicContact CG-CB 3.73Å; Y142-Y285 HydrophobicContact CD1-CE2 4.05Å; Y142-Y285 AromaticContact CE1-CE2 3.66Å; Y142-Y285 HydrophobicContact CE1-CE2 3.66Å; Y142-Y285 AromaticContact CZ-CE2 3.9Å; Y142-Y285 PolarHBondContact N-OH 3.14Å; Y142-V288 HydrophobicContact CD1-CG2 4.09Å; Y142-V288 HydrophobicContact CE1-CB 4.34Å; Y142-V288 HydrophobicContact CE1-CG2 3.92Å |
| 143 | L | 97.9 | Very high | 97.1 | Very high | 12 Ų | 12 | 61.1 Ų | 61.1 | 6% | 0.063 | 35% | 0.353 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -90.9 | -4.8 | 177 | -68.3 | 178.3 | 0 | 0 | 0 | 112.4 | D141 G145 S146 V148 R153 L185 Y285 | D141-L143 PolarHBondContact O-N 2.99Å; L143-G145 PolarHBondContact O-N 3.46Å; L143-G145 VanDerWaalsContact O-N 3.17Å; L143-S146 VanDerWaalsContact O-CB 3.27Å; L143-S146 WeakPolarHBondContact O-CB 3.34Å; L143-S146 PolarHBondContact O-N 3.49Å; L143-V148 HydrophobicContact CD1-CG1 4.33Å; L143-V148 HydrophobicContact CD2-CB 4.17Å; L143-V148 HydrophobicContact CD2-CG1 4.02Å; L143-R153 HydrophobicContact CD1-CB 4.23Å; L143-L185 HydrophobicContact CD2-CB 4.48Å; L143-Y285 HydrophobicContact CB-CE2 4.29Å; L143-Y285 WeakPolarHBondContact CB-OH 3.23Å; L143-Y285 HydrophobicContact CD1-CD2 4.06Å; L143-Y285 HydrophobicContact CD1-CE2 3.55Å; L143-Y285 HydrophobicContact CG-CE2 3.8Å; L143-Y285 PolarHBondContact N-OH 2.73Å |
| 144 | K | 95.9 | Very high | 97.1 | Very high | 184 Ų | 184 | 61.3 Ų | 61.3 | 80% | 0.8 | 36% | 0.355 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.7 | 121.8 | 178.7 | -172 | 174.7 | -177.6 | 175.5 | 0 | 109.9 | D141 S146 | D141-K144 HydrophobicContact CB-CB 4.39Å; D141-K144 WeakPolarHBondContact O-CB 3.32Å; D141-K144 PolarHBondContact O-N 3.26Å; K144-S146 VanDerWaalsContact C-N 3.3Å |
| 145 | G | 92.9 | Very high | 97.2 | Very high | 88 Ų | 88 | 58.7 Ų | 58.7 | 91% | 0.907 | 34% | 0.337 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 80.1 | 4.1 | -176.5 | 0 | 0 | 0 | 0 | 0 | 115.1 | L143 | L143-G145 PolarHBondContact O-N 3.46Å; L143-G145 VanDerWaalsContact O-N 3.17Å |
| 146 | S | 95.1 | Very high | 97.3 | Very high | 53 Ų | 53 | 52.2 Ų | 52.2 | 37% | 0.371 | 31% | 0.307 | S | S | . | . | S | Bend | trans | -88 | 156.7 | 172.8 | -61.9 | 0 | 0 | 0 | 0 | 111.6 | L143 K144 V148 | L143-S146 VanDerWaalsContact O-CB 3.27Å; L143-S146 WeakPolarHBondContact O-CB 3.34Å; L143-S146 PolarHBondContact O-N 3.49Å; K144-S146 VanDerWaalsContact C-N 3.3Å; S146-V148 PolarHBondContact O-N 3.13Å |
| 147 | E | 96.1 | Very high | 97.4 | Very high | 116 Ų | 116 | 51.6 Ų | 51.6 | 54% | 0.542 | 30% | 0.304 | S | S | . | . | S | Bend | trans | -65.8 | -31.3 | 171.8 | -168.2 | -168.6 | 143 | 0 | 0 | 111.6 | S191 R192 | E147-S191 VanDerWaalsContact OE2-CA 3.23Å; E147-S191 WeakPolarHBondContact OE2-CA 3.34Å; E147-S191 WeakPolarHBondContact OE2-CB 3.43Å; E147-R192 VanDerWaalsContact OE1-CB 3.27Å; E147-R192 WeakPolarHBondContact OE1-CB 3.44Å; E147-R192 PolarHBondContact OE1-N 3.02Å |
| 148 | V | 97.7 | Very high | 97.4 | Very high | 3 Ų | 3 | 50.1 Ų | 50.1 | 2% | 0.018 | 29% | 0.289 | C | S | . | . | S | Bend | trans | -79.2 | 122.7 | 176.3 | 174 | 0 | 0 | 0 | 0 | 110 | L143 S146 M152 V190 L195 | L143-V148 HydrophobicContact CD1-CG1 4.33Å; L143-V148 HydrophobicContact CD2-CB 4.17Å; L143-V148 HydrophobicContact CD2-CG1 4.02Å; S146-V148 PolarHBondContact O-N 3.13Å; V148-M152 HydrophobicContact CG1-CB 4.39Å; V148-M152 HydrophobicContact CG2-CE 4.48Å; V148-V190 HydrophobicContact CG2-CG1 4.46Å; V148-V190 WeakPolarHBondContact CG2-O 3.48Å; V148-L195 HydrophobicContact CG1-CD1 4.06Å; V148-L195 HydrophobicContact CG1-CD2 3.76Å; V148-L195 HydrophobicContact CG2-CB 4.45Å; V148-L195 HydrophobicContact CG2-CD1 4.21Å; V148-L195 HydrophobicContact CG2-CD2 4.19Å |
| 149 | T | 98 | Very high | 97.4 | Very high | 67 Ų | 67 | 51.1 Ų | 51.1 | 41% | 0.411 | 29% | 0.293 | S | S | . | . | trans | -92.7 | 162.8 | 176.6 | 68.8 | 0 | 0 | 0 | 0 | 112.2 | A151 M152 R153 | T149-A151 PolarHBondContact O-N 3.12Å; T149-M152 HydrophobicContact CG2-SD 4.16Å; T149-M152 WeakPolarHBondContact O-CB 3.17Å; T149-M152 PolarHBondContact O-N 2.96Å; T149-M152 VanDerWaalsContact O-N 3.11Å; T149-M152 VanDerWaalsContact OG1-CG 3.27Å; T149-M152 WeakPolarHBondContact OG1-CG 3.4Å; T149-M152 PolarHBondContact OG1-N 3.08Å; T149-M152 PolarHBondContact OG1-SD 2.99Å; T149-R153 PolarHBondContact O-N 3.19Å | ||
| 150 | S | 97.4 | Very high | 97.5 | Very high | 56 Ų | 56 | 43.9 Ų | 43.9 | 39% | 0.392 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -56.1 | -38.2 | 172.8 | 54.9 | 0 | 0 | 0 | 0 | 112.6 | R153 A154 Y285 | S150-R153 WeakPolarHBondContact O-CB 3.24Å; S150-R153 PolarHBondContact O-N 2.66Å; S150-A154 PolarHBondContact O-N 3.45Å; S150-Y285 VanDerWaalsContact CB-CD1 3.5Å; S150-Y285 VanDerWaalsContact CB-CG 3.5Å |
| 151 | A | 97.3 | Very high | 97.6 | Very high | 52 Ų | 52 | 41.2 Ų | 41.2 | 43% | 0.43 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -64 | -40.9 | 176 | 0 | 0 | 0 | 0 | 0 | 112.1 | T149 A154 I155 | T149-A151 PolarHBondContact O-N 3.12Å; A151-A154 PolarHBondContact O-N 2.87Å; A151-I155 VanDerWaalsContact O-CG1 3.29Å; A151-I155 WeakPolarHBondContact O-CG1 3.46Å; A151-I155 PolarHBondContact O-N 3.36Å |
| 152 | M | 98.3 | Very high | 97.6 | Very high | 25 Ų | 25 | 39.9 Ų | 39.9 | 12% | 0.123 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -67 | -39.4 | 176.9 | -66.6 | 165.5 | 60.4 | 0 | 0 | 111.9 | V148 T149 I155 L156 R192 L195 | V148-M152 HydrophobicContact CG1-CB 4.39Å; V148-M152 HydrophobicContact CG2-CE 4.48Å; T149-M152 HydrophobicContact CG2-SD 4.16Å; T149-M152 WeakPolarHBondContact O-CB 3.17Å; T149-M152 PolarHBondContact O-N 2.96Å; T149-M152 VanDerWaalsContact O-N 3.11Å; T149-M152 VanDerWaalsContact OG1-CG 3.27Å; T149-M152 WeakPolarHBondContact OG1-CG 3.4Å; T149-M152 PolarHBondContact OG1-N 3.08Å; T149-M152 PolarHBondContact OG1-SD 2.99Å; M152-I155 PolarHBondContact O-N 3.09Å; M152-L156 PolarHBondContact O-N 3.31Å; M152-R192 HydrophobicContact CE-CB 3.55Å; M152-R192 HydrophobicContact CE-CG 3.3Å; M152-L195 HydrophobicContact CB-CD2 3.84Å; M152-L195 HydrophobicContact CE-CD2 4.14Å |
| 153 | R | 98.4 | Very high | 97.6 | Very high | 3 Ų | 3 | 39.3 Ų | 39.3 | 1% | 0.011 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -58.9 | -48.2 | 171.5 | -178.7 | -164.1 | 172 | -81.9 | -4.4 | 111 | Y142 L143 T149 S150 I155 L156 V157 D182 L282 | Y142-R153 WeakPolarHBondContact OH-CD 3.33Å; Y142-R153 PolarHBondContact OH-NE 2.69Å; L143-R153 HydrophobicContact CD1-CB 4.23Å; T149-R153 PolarHBondContact O-N 3.19Å; S150-R153 WeakPolarHBondContact O-CB 3.24Å; S150-R153 PolarHBondContact O-N 2.66Å; R153-I155 VanDerWaalsContact C-N 3.33Å; R153-I155 PolarHBondContact O-N 2.79Å; R153-L156 PolarHBondContact O-N 3.42Å; R153-L156 VanDerWaalsContact O-N 3.17Å; R153-V157 HydrophobicContact CG-CG2 4.3Å; R153-V157 WeakPolarHBondContact O-CG2 3.3Å; R153-V157 PolarHBondContact O-N 3.24Å; R153-D182 IonicContact CZ-OD1 3.7Å; R153-D182 IonicContact CZ-OD2 3.85Å; R153-D182 IonicContact NE-OD1 2.73Å; R153-D182 PolarHBondContact NE-OD1 3.41Å; R153-D182 IonicContact NE-OD2 2.64Å; R153-D182 IonicContact NH2-OD1 3.24Å; R153-D182 PolarHBondContact NH2-OD1 3.28Å; R153-D182 IonicContact NH2-OD2 3.24Å; R153-D182 PolarHBondContact NH2-OD2 2.82Å; R153-L282 PolarHBondContact NH1-O 3.31Å; R153-L282 PolarHBondContact NH2-O 3.42Å; R153-L282 VanDerWaalsContact NH2-O 3.12Å |
| 154 | A | 98.2 | Very high | 97.7 | Very high | 6 Ų | 6 | 39.1 Ų | 39.1 | 5% | 0.05 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -62.5 | -38.7 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | S150 A151 V157 D158 F348 | S150-A154 PolarHBondContact O-N 3.45Å; A151-A154 PolarHBondContact O-N 2.87Å; A154-V157 PolarHBondContact O-N 3.07Å; A154-D158 WeakPolarHBondContact O-CB 3.35Å; A154-D158 PolarHBondContact O-N 2.72Å; A154-F348 HydrophobicContact CB-CD2 4Å; A154-F348 HydrophobicContact CB-CE1 4.2Å; A154-F348 HydrophobicContact CB-CE2 3.41Å; A154-F348 VanDerWaalsContact CB-CE2 3.41Å; A154-F348 HydrophobicContact CB-CZ 3.52Å |
| 155 | I | 98.6 | Very high | 97.7 | Very high | 33 Ų | 33 | 32.2 Ų | 32.2 | 17% | 0.169 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -59.2 | -48.3 | 171.9 | -68 | 162.9 | 0 | 0 | 0 | 110.8 | I36 A151 M152 R153 W159 F348 | I36-I155 HydrophobicContact CD1-CG2 3.9Å; A151-I155 VanDerWaalsContact O-CG1 3.29Å; A151-I155 WeakPolarHBondContact O-CG1 3.46Å; A151-I155 PolarHBondContact O-N 3.36Å; M152-I155 PolarHBondContact O-N 3.09Å; R153-I155 VanDerWaalsContact C-N 3.33Å; R153-I155 PolarHBondContact O-N 2.79Å; I155-W159 PolarHBondContact O-N 3.21Å; I155-W159 VanDerWaalsContact O-N 3.15Å; I155-F348 HydrophobicContact CB-CE1 4.25Å; I155-F348 HydrophobicContact CG1-CE1 3.58Å; I155-F348 HydrophobicContact CG1-CZ 3.9Å |
| 156 | L | 98.7 | Very high | 97.9 | Very high | 2 Ų | 2 | 35.5 Ų | 35.5 | 1% | 0.01 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -62 | -48 | 179.1 | 176.1 | 65.3 | 0 | 0 | 0 | 111.4 | M152 R153 W159 L160 L181 L195 Q196 | M152-L156 PolarHBondContact O-N 3.31Å; R153-L156 PolarHBondContact O-N 3.42Å; R153-L156 VanDerWaalsContact O-N 3.17Å; L156-W159 HydrophobicContact CD1-CE3 3.93Å; L156-W159 HydrophobicContact CD1-CZ3 4.25Å; L156-W159 PolarHBondContact O-N 3.41Å; L156-L160 HydrophobicContact CD1-CD1 4.23Å; L156-L160 HydrophobicContact CD1-CG 4.18Å; L156-L160 HydrophobicContact CD2-CD1 4.34Å; L156-L160 HydrophobicContact CG-CD1 3.89Å; L156-L160 HydrophobicContact CG-CG 4.28Å; L156-L160 WeakPolarHBondContact O-CG 3.39Å; L156-L160 PolarHBondContact O-N 3.06Å; L156-L181 HydrophobicContact CD2-CD1 4.01Å; L156-L181 HydrophobicContact CD2-CD2 3.8Å; L156-L195 HydrophobicContact CD2-CD1 3.75Å; L156-L195 HydrophobicContact CD2-CG 3.81Å; L156-L195 WeakPolarHBondContact CD2-O 3.42Å; L156-Q196 HydrophobicContact CD1-CG 4.43Å |
| 157 | V | 98.8 | Very high | 98 | Very high | 0 Ų | 0 | 35.3 Ų | 35.3 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -65.9 | -41.6 | -177.3 | 175.4 | 0 | 0 | 0 | 0 | 111.4 | R153 A154 W159 L160 I161 V178 L181 L282 L283 | R153-V157 HydrophobicContact CG-CG2 4.3Å; R153-V157 WeakPolarHBondContact O-CG2 3.3Å; R153-V157 PolarHBondContact O-N 3.24Å; A154-V157 PolarHBondContact O-N 3.07Å; V157-W159 VanDerWaalsContact C-N 3.28Å; V157-W159 PolarHBondContact O-N 3.46Å; V157-L160 PolarHBondContact O-N 2.84Å; V157-I161 HydrophobicContact CG1-CD1 4.02Å; V157-I161 WeakPolarHBondContact O-CD1 3.5Å; V157-I161 VanDerWaalsContact O-CG1 3.3Å; V157-I161 WeakPolarHBondContact O-CG1 3.49Å; V157-I161 PolarHBondContact O-N 2.73Å; V157-V178 HydrophobicContact CG1-CG2 4.05Å; V157-V178 HydrophobicContact CG2-CG2 4.45Å; V157-L181 HydrophobicContact CG2-CD2 4.05Å; V157-L282 HydrophobicContact CG1-CB 4Å; V157-L283 HydrophobicContact CG1-CG 4.35Å |
| 158 | D | 98.6 | Very high | 98 | Very high | 18 Ų | 18 | 36.7 Ų | 36.7 | 10% | 0.096 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -58 | -41.4 | 173.6 | -176.1 | 91.7 | 0 | 0 | 0 | 111.6 | A154 I161 Q162 L283 F348 Q349 A350 | A154-D158 WeakPolarHBondContact O-CB 3.35Å; A154-D158 PolarHBondContact O-N 2.72Å; D158-I161 PolarHBondContact O-N 2.97Å; D158-Q162 PolarHBondContact O-N 3.42Å; D158-Q162 PolarHBondContact OD2-NE2 3Å; D158-L283 HydrophobicContact CB-CD2 3.86Å; D158-F348 HydrophobicContact CB-CB 4.27Å; D158-F348 HydrophobicContact CB-CD1 3.87Å; D158-F348 HydrophobicContact CB-CG 4.42Å; D158-F348 WeakPolarHBondContact OD1-CA 3.25Å; D158-Q349 PolarHBondContact OD1-N 3.12Å; D158-Q349 VanDerWaalsContact OD1-N 3.08Å; D158-A350 WeakPolarHBondContact O-CB 3.42Å; D158-A350 WeakPolarHBondContact OD1-CB 3.41Å; D158-A350 PolarHBondContact OD1-N 3.48Å |
| 159 | W | 98.4 | Very high | 98.1 | Very high | 31 Ų | 31 | 37.3 Ų | 37.3 | 12% | 0.117 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -67.4 | -43.3 | 174.2 | 175.1 | 77 | 0 | 0 | 0 | 112.6 | L33 I155 L156 V157 I161 Q162 V163 Q196 V200 I223 T224 | L33-W159 HydrophobicContact CD1-CD2 4.27Å; L33-W159 HydrophobicContact CD1-CG 4.07Å; I155-W159 PolarHBondContact O-N 3.21Å; I155-W159 VanDerWaalsContact O-N 3.15Å; L156-W159 HydrophobicContact CD1-CE3 3.93Å; L156-W159 HydrophobicContact CD1-CZ3 4.25Å; L156-W159 PolarHBondContact O-N 3.41Å; V157-W159 VanDerWaalsContact C-N 3.28Å; V157-W159 PolarHBondContact O-N 3.46Å; W159-I161 PolarHBondContact O-N 3.33Å; W159-Q162 WeakPolarHBondContact O-CA 3.34Å; W159-Q162 VanDerWaalsContact O-CB 3.32Å; W159-Q162 WeakPolarHBondContact O-CB 3.32Å; W159-Q162 PolarHBondContact O-N 2.95Å; W159-V163 HydrophobicContact CD2-CG2 3.86Å; W159-V163 HydrophobicContact CE3-CG2 4.14Å; W159-V163 HydrophobicContact CH2-CG2 3.85Å; W159-V163 HydrophobicContact CZ2-CG2 3.54Å; W159-V163 HydrophobicContact CZ3-CG2 4.14Å; W159-V163 PolarHBondContact O-N 3.32Å; W159-Q196 HydrophobicContact CH2-CG 4.08Å; W159-Q196 HydrophobicContact CZ3-CG 3.91Å; W159-V200 HydrophobicContact CH2-CG1 3.49Å; W159-V200 VanDerWaalsContact CH2-CG1 3.49Å; W159-V200 HydrophobicContact CZ3-CG1 3.72Å; W159-I223 HydrophobicContact CH2-CG2 4.42Å; W159-I223 HydrophobicContact CZ2-CG1 4.41Å; W159-I223 HydrophobicContact CZ2-CG2 4.43Å; W159-T224 HydrophobicContact CH2-CG2 3.98Å; W159-T224 HydrophobicContact CZ2-CG2 4.49Å |
| 160 | L | 98.8 | Very high | 98.1 | Very high | 0 Ų | 0 | 37.8 Ų | 37.8 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -60.7 | -33 | 176.7 | -72.3 | 171.6 | 0 | 0 | 0 | 112.1 | L156 V157 Q162 V163 H164 T177 L181 M203 | L156-L160 HydrophobicContact CD1-CD1 4.23Å; L156-L160 HydrophobicContact CD1-CG 4.18Å; L156-L160 HydrophobicContact CD2-CD1 4.34Å; L156-L160 HydrophobicContact CG-CD1 3.89Å; L156-L160 HydrophobicContact CG-CG 4.28Å; L156-L160 WeakPolarHBondContact O-CG 3.39Å; L156-L160 PolarHBondContact O-N 3.06Å; V157-L160 PolarHBondContact O-N 2.84Å; L160-Q162 VanDerWaalsContact C-N 3.29Å; L160-Q162 PolarHBondContact O-N 3.48Å; L160-V163 PolarHBondContact O-N 2.87Å; L160-H164 VanDerWaalsContact O-CB 3.28Å; L160-H164 WeakPolarHBondContact O-CB 3.48Å; L160-H164 PolarHBondContact O-N 3.12Å; L160-T177 HydrophobicContact CD1-CG2 4.1Å; L160-L181 HydrophobicContact CD1-CD2 4.33Å; L160-M203 HydrophobicContact CB-CE 3.98Å; L160-M203 HydrophobicContact CD2-CE 3.9Å; L160-M203 HydrophobicContact CG-CE 4.49Å; L160-M203 WeakPolarHBondContact O-CE 3.37Å |
| 161 | I | 98.6 | Very high | 98.1 | Very high | 0 Ų | 0 | 36.2 Ų | 36.2 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -64.2 | -35.5 | 172.6 | -68.1 | 156.7 | 0 | 0 | 0 | 111.3 | V157 D158 W159 S165 L174 L283 A350 V351 K354 | V157-I161 HydrophobicContact CG1-CD1 4.02Å; V157-I161 WeakPolarHBondContact O-CD1 3.5Å; V157-I161 VanDerWaalsContact O-CG1 3.3Å; V157-I161 WeakPolarHBondContact O-CG1 3.49Å; V157-I161 PolarHBondContact O-N 2.73Å; D158-I161 PolarHBondContact O-N 2.97Å; W159-I161 PolarHBondContact O-N 3.33Å; I161-S165 PolarHBondContact O-N 2.87Å; I161-S165 VanDerWaalsContact O-N 3.07Å; I161-S165 PolarHBondContact O-OG 2.92Å; I161-L174 HydrophobicContact CG1-CD1 4Å; I161-L174 HydrophobicContact CG1-CD2 3.98Å; I161-L283 HydrophobicContact CD1-CD1 3.75Å; I161-L283 HydrophobicContact CD1-CG 4.26Å; I161-A350 HydrophobicContact CB-CB 4.03Å; I161-A350 HydrophobicContact CG2-CB 3.79Å; I161-V351 HydrophobicContact CD1-CG2 3.61Å; I161-V351 HydrophobicContact CG2-CG2 4.43Å; I161-K354 HydrophobicContact CG2-CD 4.42Å |
| 162 | Q | 98.3 | Very high | 98.2 | Very high | 72 Ų | 72 | 35 Ų | 35 | 34% | 0.336 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -70.8 | -40.4 | 174.1 | -61.3 | 174.2 | 57.3 | 0 | 0 | 111.5 | D158 W159 L160 S165 R166 A350 | D158-Q162 PolarHBondContact O-N 3.42Å; D158-Q162 PolarHBondContact OD2-NE2 3Å; W159-Q162 WeakPolarHBondContact O-CA 3.34Å; W159-Q162 VanDerWaalsContact O-CB 3.32Å; W159-Q162 WeakPolarHBondContact O-CB 3.32Å; W159-Q162 PolarHBondContact O-N 2.95Å; L160-Q162 VanDerWaalsContact C-N 3.29Å; L160-Q162 PolarHBondContact O-N 3.48Å; Q162-S165 PolarHBondContact O-N 3.22Å; Q162-R166 WeakPolarHBondContact O-CB 3.33Å; Q162-R166 PolarHBondContact O-N 3.14Å; Q162-A350 HydrophobicContact CG-CB 3.85Å |
| 163 | V | 98.3 | Very high | 98.2 | Very high | 4 Ų | 4 | 33.8 Ų | 33.8 | 2% | 0.024 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -62.5 | -47.4 | 174.5 | 177.4 | 0 | 0 | 0 | 0 | 110.8 | W159 L160 S165 R166 F167 M203 I223 | W159-V163 HydrophobicContact CD2-CG2 3.86Å; W159-V163 HydrophobicContact CE3-CG2 4.14Å; W159-V163 HydrophobicContact CH2-CG2 3.85Å; W159-V163 HydrophobicContact CZ2-CG2 3.54Å; W159-V163 HydrophobicContact CZ3-CG2 4.14Å; W159-V163 PolarHBondContact O-N 3.32Å; L160-V163 PolarHBondContact O-N 2.87Å; V163-S165 VanDerWaalsContact C-N 3.29Å; V163-S165 PolarHBondContact O-N 3.42Å; V163-R166 PolarHBondContact O-N 3.05Å; V163-F167 HydrophobicContact CG1-CD2 3.72Å; V163-F167 HydrophobicContact CG1-CE2 3.61Å; V163-F167 HydrophobicContact CG1-CZ 4.36Å; V163-F167 PolarHBondContact O-N 3.34Å; V163-M203 HydrophobicContact CB-CE 4.42Å; V163-M203 HydrophobicContact CB-SD 4.28Å; V163-M203 HydrophobicContact CG1-CE 4.43Å; V163-M203 HydrophobicContact CG1-SD 3.66Å; V163-I223 HydrophobicContact CG1-CG1 4.12Å; V163-I223 HydrophobicContact CG1-CG2 4.37Å; V163-I223 HydrophobicContact CG2-CG1 3.86Å |
| 164 | H | 98.4 | Very high | 98.2 | Very high | 8 Ų | 8 | 33.6 Ų | 33.6 | 4% | 0.037 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -49.7 | -50.1 | 172.7 | 167.6 | -93 | 0 | 0 | 0 | 111.6 | L160 R166 F167 Q168 L169 L170 L174 M203 K354 | L160-H164 VanDerWaalsContact O-CB 3.28Å; L160-H164 WeakPolarHBondContact O-CB 3.48Å; L160-H164 PolarHBondContact O-N 3.12Å; H164-R166 VanDerWaalsContact C-N 3.33Å; H164-R166 PolarHBondContact O-N 3.29Å; H164-F167 PolarHBondContact O-N 3.45Å; H164-Q168 PolarHBondContact O-N 3.12Å; H164-L169 PolarHBondContact CE1-O 3.41Å; H164-L169 PolarHBondContact NE2-O 3.37Å; H164-L169 PolarHBondContact O-N 3.11Å; H164-L170 PolarHBondContact CD2-O 3.39Å; H164-L170 PolarHBondContact NE2-O 3.11Å; H164-L174 HydrophobicContact CB-CD1 4.23Å; H164-M203 HydrophobicContact CB-CE 4.18Å; H164-K354 PolarHBondContact CE1-NZ 2.84Å; H164-K354 PolarHBondContact ND1-NZ 2.84Å |
| 165 | S | 96.8 | Very high | 98.2 | Very high | 40 Ų | 40 | 33.7 Ų | 33.7 | 28% | 0.28 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -65.4 | -36 | 178.3 | -57.4 | 0 | 0 | 0 | 0 | 112.2 | I161 Q162 V163 Q168 | I161-S165 PolarHBondContact O-N 2.87Å; I161-S165 VanDerWaalsContact O-N 3.07Å; I161-S165 PolarHBondContact O-OG 2.92Å; Q162-S165 PolarHBondContact O-N 3.22Å; V163-S165 VanDerWaalsContact C-N 3.29Å; V163-S165 PolarHBondContact O-N 3.42Å; S165-Q168 PolarHBondContact O-N 2.8Å; S165-Q168 PolarHBondContact O-NE2 2.98Å |
| 166 | R | 97 | Very high | 98.3 | Very high | 157 Ų | 157 | 32.3 Ų | 32.3 | 59% | 0.592 | 15% | 0.15 | S | C | * | . | H | α-helix | trans | -71.4 | -37.4 | -179.7 | -172.2 | 173 | 177.9 | 167.5 | -2.1 | 112.6 | Q162 V163 H164 Q168 | Q162-R166 WeakPolarHBondContact O-CB 3.33Å; Q162-R166 PolarHBondContact O-N 3.14Å; V163-R166 PolarHBondContact O-N 3.05Å; H164-R166 VanDerWaalsContact C-N 3.33Å; H164-R166 PolarHBondContact O-N 3.29Å; R166-Q168 VanDerWaalsContact C-N 3.29Å |
| 167 | F | 97.4 | Very high | 98.3 | Very high | 49 Ų | 49 | 32.2 Ų | 32.2 | 22% | 0.215 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -82.6 | -4.6 | 175 | -68.3 | -24.5 | 0 | 0 | 0 | 113.6 | V163 H164 L169 P215 D219 F220 I223 | V163-F167 HydrophobicContact CG1-CD2 3.72Å; V163-F167 HydrophobicContact CG1-CE2 3.61Å; V163-F167 HydrophobicContact CG1-CZ 4.36Å; V163-F167 PolarHBondContact O-N 3.34Å; H164-F167 PolarHBondContact O-N 3.45Å; F167-L169 HydrophobicContact CB-CD1 4.08Å; F167-L169 HydrophobicContact CB-CD2 3.9Å; F167-L169 HydrophobicContact CB-CG 3.65Å; F167-L169 HydrophobicContact CD2-CD1 4.37Å; F167-L169 PolarHBondContact O-N 2.72Å; F167-P215 HydrophobicContact CB-CG 4.44Å; F167-P215 HydrophobicContact CD2-CG 4.18Å; F167-P215 HydrophobicContact CG-CG 4.29Å; F167-D219 HydrophobicContact CE1-CB 4.14Å; F167-D219 HydrophobicContact CZ-CB 3.92Å; F167-F220 HydrophobicContact CD2-CE1 4.45Å; F167-F220 HydrophobicContact CD2-CZ 4.5Å; F167-F220 HydrophobicContact CE2-CD1 4.13Å; F167-F220 AromaticContact CE2-CE1 3.89Å; F167-F220 HydrophobicContact CE2-CE1 3.89Å; F167-F220 HydrophobicContact CE2-CZ 4.16Å; F167-I223 HydrophobicContact CE2-CG2 4.48Å; F167-I223 HydrophobicContact CZ-CB 4.08Å; F167-I223 HydrophobicContact CZ-CG1 4.41Å; F167-I223 HydrophobicContact CZ-CG2 4.19Å |
| 168 | Q | 96.9 | Very high | 98.3 | Very high | 145 Ų | 145 | 32.4 Ų | 32.4 | 68% | 0.678 | 15% | 0.151 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 56.1 | 37.4 | -179.9 | -61.4 | -71.1 | -58.3 | 0 | 0 | 113 | H164 S165 R166 | H164-Q168 PolarHBondContact O-N 3.12Å; S165-Q168 PolarHBondContact O-N 2.8Å; S165-Q168 PolarHBondContact O-NE2 2.98Å; R166-Q168 VanDerWaalsContact C-N 3.29Å |
| 169 | L | 98.4 | Very high | 98.3 | Very high | 15 Ų | 15 | 31.7 Ų | 31.7 | 8% | 0.079 | 15% | 0.147 | C | C | . | . | trans | -72.3 | 160.6 | -177 | -58 | 174.9 | 0 | 0 | 0 | 112 | H164 F167 T173 M203 C207 E211 P215 | H164-L169 PolarHBondContact CE1-O 3.41Å; H164-L169 PolarHBondContact NE2-O 3.37Å; H164-L169 PolarHBondContact O-N 3.11Å; F167-L169 HydrophobicContact CB-CD1 4.08Å; F167-L169 HydrophobicContact CB-CD2 3.9Å; F167-L169 HydrophobicContact CB-CG 3.65Å; F167-L169 HydrophobicContact CD2-CD1 4.37Å; F167-L169 PolarHBondContact O-N 2.72Å; L169-T173 HydrophobicContact CB-CG2 4.32Å; L169-T173 HydrophobicContact CD1-CG2 4.03Å; L169-M203 HydrophobicContact CD1-CG 4.22Å; L169-M203 HydrophobicContact CD1-SD 3.92Å; L169-C207 VanDerWaalsContact CD1-SG 3.52Å; L169-E211 WeakPolarHBondContact CA-OE1 3.42Å; L169-E211 WeakPolarHBondContact CB-OE1 3.36Å; L169-E211 HydrophobicContact CD2-CG 4.01Å; L169-P215 HydrophobicContact CD2-CG 4.03Å | ||
| 170 | L | 98.3 | Very high | 98.3 | Very high | 77 Ų | 77 | 30.2 Ų | 30.2 | 40% | 0.403 | 14% | 0.142 | S | C | . | . | trans | -59.4 | 153.8 | 170.9 | -64.2 | 173.4 | 0 | 0 | 0 | 111.2 | H164 E172 T173 E211 | H164-L170 PolarHBondContact CD2-O 3.39Å; H164-L170 PolarHBondContact NE2-O 3.11Å; L170-E172 VanDerWaalsContact C-N 3.28Å; L170-E172 PolarHBondContact O-N 2.73Å; L170-T173 WeakPolarHBondContact O-CB 3.49Å; L170-T173 PolarHBondContact O-N 3.32Å; L170-E211 WeakPolarHBondContact CB-OE1 3.31Å; L170-E211 PolarHBondContact N-OE1 2.87Å | ||
| 171 | Q | 98.1 | Very high | 98.3 | Very high | 24 Ų | 24 | 30.2 Ų | 30.2 | 11% | 0.112 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -68.7 | -35.1 | 179 | -170.6 | 65.9 | 51.9 | 0 | 0 | 110.7 | T173 L174 Y175 L254 E279 | Q171-T173 VanDerWaalsContact C-N 3.29Å; Q171-T173 PolarHBondContact O-N 3.33Å; Q171-L174 WeakPolarHBondContact O-CB 3.47Å; Q171-L174 PolarHBondContact O-N 3.14Å; Q171-L174 VanDerWaalsContact O-N 3.16Å; Q171-Y175 HydrophobicContact CG-CD2 4Å; Q171-Y175 HydrophobicContact CG-CE2 3.79Å; Q171-Y175 WeakPolarHBondContact O-CD2 3.37Å; Q171-Y175 PolarHBondContact O-N 2.87Å; Q171-L254 HydrophobicContact CB-CD1 3.92Å; Q171-L254 HydrophobicContact CG-CD1 3.79Å; Q171-L254 HydrophobicContact CG-CD2 3.99Å; Q171-L254 HydrophobicContact CG-CG 4.42Å; Q171-E279 VanDerWaalsContact CD-OE2 3.27Å; Q171-E279 VanDerWaalsContact NE2-CD 3.31Å; Q171-E279 PolarHBondContact NE2-OE2 2.99Å; Q171-E279 PolarHBondContact OE1-OE2 3.18Å |
| 172 | E | 98.6 | Very high | 98.3 | Very high | 25 Ų | 25 | 30.5 Ų | 30.5 | 12% | 0.117 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -51.2 | -48.9 | 172 | -73.1 | 79.3 | 177.3 | 0 | 0 | 111 | L170 L174 Y175 L176 E210 L252 L254 R258 | L170-E172 VanDerWaalsContact C-N 3.28Å; L170-E172 PolarHBondContact O-N 2.73Å; E172-L174 VanDerWaalsContact C-N 3.29Å; E172-L174 PolarHBondContact O-N 3.18Å; E172-Y175 PolarHBondContact O-N 2.9Å; E172-Y175 VanDerWaalsContact O-N 3.13Å; E172-L176 WeakPolarHBondContact O-CB 3.39Å; E172-L176 PolarHBondContact O-N 2.84Å; E172-E210 HydrophobicContact CB-CG 4.21Å; E172-L252 HydrophobicContact CB-CD1 3.77Å; E172-L252 HydrophobicContact CG-CD1 4.05Å; E172-L252 WeakPolarHBondContact O-CD1 3.44Å; E172-L254 HydrophobicContact CB-CD1 4.43Å; E172-L254 HydrophobicContact CG-CD1 3.87Å; E172-R258 IonicContact OE1-CZ 3.93Å; E172-R258 VanDerWaalsContact OE1-CZ 3.24Å; E172-R258 IonicContact OE1-NH1 3.06Å; E172-R258 PolarHBondContact OE1-NH1 3.26Å; E172-R258 IonicContact OE1-NH2 3.92Å; E172-R258 PolarHBondContact OE1-NH2 3.39Å |
| 173 | T | 98.8 | Very high | 98.3 | Very high | 0 Ų | 0 | 27.9 Ų | 27.9 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -56.3 | -40.3 | 178.5 | -50.4 | 0 | 0 | 0 | 0 | 112.4 | L169 L170 Q171 T177 A206 C207 E210 E211 | L169-T173 HydrophobicContact CB-CG2 4.32Å; L169-T173 HydrophobicContact CD1-CG2 4.03Å; L170-T173 WeakPolarHBondContact O-CB 3.49Å; L170-T173 PolarHBondContact O-N 3.32Å; Q171-T173 VanDerWaalsContact C-N 3.29Å; Q171-T173 PolarHBondContact O-N 3.33Å; T173-T177 VanDerWaalsContact O-CB 3.31Å; T173-T177 WeakPolarHBondContact O-CB 3.47Å; T173-T177 PolarHBondContact O-N 2.99Å; T173-T177 PolarHBondContact O-OG1 3.03Å; T173-A206 HydrophobicContact CG2-CB 3.94Å; T173-A206 WeakPolarHBondContact O-CB 3.36Å; T173-C207 HydrophobicContact CG2-CB 4.4Å; T173-E210 WeakPolarHBondContact OG1-CB 3.12Å; T173-E211 WeakPolarHBondContact CB-OE1 3.33Å; T173-E211 HydrophobicContact CG2-CG 4.35Å; T173-E211 PolarHBondContact OG1-OE1 3.46Å |
| 174 | L | 98.8 | Very high | 98.3 | Very high | 0 Ų | 0 | 27.7 Ų | 27.7 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -67 | -47.1 | 176.3 | 177.4 | 58.5 | 0 | 0 | 0 | 112.3 | I161 H164 Q171 E172 L176 T177 V178 E279 L282 | I161-L174 HydrophobicContact CG1-CD1 4Å; I161-L174 HydrophobicContact CG1-CD2 3.98Å; H164-L174 HydrophobicContact CB-CD1 4.23Å; Q171-L174 WeakPolarHBondContact O-CB 3.47Å; Q171-L174 PolarHBondContact O-N 3.14Å; Q171-L174 VanDerWaalsContact O-N 3.16Å; E172-L174 VanDerWaalsContact C-N 3.29Å; E172-L174 PolarHBondContact O-N 3.18Å; L174-L176 VanDerWaalsContact C-N 3.33Å; L174-L176 PolarHBondContact O-N 3.17Å; L174-T177 WeakPolarHBondContact O-CB 3.44Å; L174-T177 PolarHBondContact O-N 2.94Å; L174-V178 HydrophobicContact CD1-CG2 4.48Å; L174-V178 PolarHBondContact O-N 3.13Å; L174-V178 VanDerWaalsContact O-N 3.13Å; L174-E279 HydrophobicContact CD2-CG 4.43Å; L174-E279 WeakPolarHBondContact CD2-OE1 3.42Å; L174-L282 HydrophobicContact CD2-CD1 4.05Å; L174-L282 HydrophobicContact CG-CD1 3.94Å |
| 175 | Y | 98.8 | Very high | 98.3 | Very high | 8 Ų | 8 | 27.8 Ų | 27.8 | 3% | 0.031 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -63.9 | -40.4 | 178.4 | -81.2 | -81.4 | 0 | 0 | 0 | 111.4 | Q171 E172 V178 A179 P253 L254 M278 E279 L282 | Q171-Y175 HydrophobicContact CG-CD2 4Å; Q171-Y175 HydrophobicContact CG-CE2 3.79Å; Q171-Y175 WeakPolarHBondContact O-CD2 3.37Å; Q171-Y175 PolarHBondContact O-N 2.87Å; E172-Y175 PolarHBondContact O-N 2.9Å; E172-Y175 VanDerWaalsContact O-N 3.13Å; Y175-V178 PolarHBondContact O-N 3.23Å; Y175-A179 WeakPolarHBondContact O-CB 3.26Å; Y175-A179 PolarHBondContact O-N 2.96Å; Y175-P253 HydrophobicContact CD1-CB 4.43Å; Y175-P253 HydrophobicContact CD1-CG 3.77Å; Y175-P253 HydrophobicContact CE1-CB 4.22Å; Y175-P253 HydrophobicContact CE1-CG 3.89Å; Y175-L254 HydrophobicContact CD2-CD1 3.74Å; Y175-L254 HydrophobicContact CD2-CG 3.89Å; Y175-L254 HydrophobicContact CE2-CD1 4.17Å; Y175-L254 HydrophobicContact CE2-CD2 4.13Å; Y175-L254 HydrophobicContact CE2-CG 3.95Å; Y175-M278 HydrophobicContact CE1-CE 4.48Å; Y175-M278 HydrophobicContact CE1-CG 4.18Å; Y175-M278 HydrophobicContact CE2-CE 4.15Å; Y175-M278 VanDerWaalsContact OH-C 3.28Å; Y175-M278 WeakPolarHBondContact OH-CE 3.33Å; Y175-M278 WeakPolarHBondContact OH-CG 3.42Å; Y175-E279 VanDerWaalsContact OH-CA 3.3Å; Y175-E279 WeakPolarHBondContact OH-CA 3.32Å; Y175-E279 PolarHBondContact OH-N 3.42Å; Y175-E279 VanDerWaalsContact OH-N 3.15Å; Y175-L282 HydrophobicContact CD1-CD1 4.46Å; Y175-L282 HydrophobicContact CD1-CD2 3.67Å; Y175-L282 HydrophobicContact CD1-CG 4.46Å; Y175-L282 HydrophobicContact CE1-CD1 4.27Å; Y175-L282 HydrophobicContact CE1-CD2 3.69Å; Y175-L282 HydrophobicContact CE1-CG 4.12Å |
| 176 | L | 98.8 | Very high | 98.4 | Very high | 4 Ų | 4 | 27.3 Ų | 27.3 | 2% | 0.021 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -65.6 | -40.8 | 175.8 | -177.3 | 58.5 | 0 | 0 | 0 | 111.4 | E172 L174 V178 A179 V180 A206 Y209 E210 L252 | E172-L176 WeakPolarHBondContact O-CB 3.39Å; E172-L176 PolarHBondContact O-N 2.84Å; L174-L176 VanDerWaalsContact C-N 3.33Å; L174-L176 PolarHBondContact O-N 3.17Å; L176-V178 VanDerWaalsContact C-N 3.35Å; L176-V178 PolarHBondContact O-N 3.15Å; L176-A179 PolarHBondContact O-N 3.42Å; L176-V180 HydrophobicContact CD1-CG2 4.01Å; L176-V180 HydrophobicContact CG-CG2 4.28Å; L176-V180 WeakPolarHBondContact O-CB 3.36Å; L176-V180 VanDerWaalsContact O-CG2 3.3Å; L176-V180 WeakPolarHBondContact O-CG2 3.41Å; L176-V180 PolarHBondContact O-N 2.99Å; L176-A206 HydrophobicContact CB-CB 4Å; L176-A206 HydrophobicContact CD2-CB 3.98Å; L176-A206 HydrophobicContact CG-CB 3.87Å; L176-Y209 HydrophobicContact CD2-CD1 3.55Å; L176-Y209 HydrophobicContact CD2-CE1 4.39Å; L176-Y209 HydrophobicContact CD2-CG 3.97Å; L176-E210 HydrophobicContact CD2-CG 3.78Å; L176-L252 HydrophobicContact CB-CD1 4.41Å; L176-L252 HydrophobicContact CB-CD2 4.1Å; L176-L252 HydrophobicContact CD1-CD2 4.47Å |
| 177 | T | 98.9 | Very high | 98.4 | Very high | 0 Ų | 0 | 22.7 Ų | 22.7 | 0% | 0 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -54 | -51.2 | 174.7 | -63.4 | 0 | 0 | 0 | 0 | 111.1 | L160 T173 L174 V180 L181 A202 M203 A206 | L160-T177 HydrophobicContact CD1-CG2 4.1Å; T173-T177 VanDerWaalsContact O-CB 3.31Å; T173-T177 WeakPolarHBondContact O-CB 3.47Å; T173-T177 PolarHBondContact O-N 2.99Å; T173-T177 PolarHBondContact O-OG1 3.03Å; L174-T177 WeakPolarHBondContact O-CB 3.44Å; L174-T177 PolarHBondContact O-N 2.94Å; T177-V180 PolarHBondContact O-N 3.5Å; T177-L181 WeakPolarHBondContact O-CB 3.36Å; T177-L181 PolarHBondContact O-N 3.06Å; T177-A202 HydrophobicContact CG2-CB 4.42Å; T177-M203 HydrophobicContact CG2-CB 3.72Å; T177-M203 HydrophobicContact CG2-CE 4.16Å; T177-M203 HydrophobicContact CG2-CG 4.35Å; T177-M203 WeakPolarHBondContact OG1-CA 3.38Å; T177-A206 WeakPolarHBondContact OG1-CB 3.39Å |
| 178 | V | 98.8 | Very high | 98.5 | Very high | 4 Ų | 4 | 22.5 Ų | 22.5 | 2% | 0.024 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -68.2 | -38.9 | -178.9 | 179.2 | 0 | 0 | 0 | 0 | 111 | V157 L174 Y175 L176 V180 L181 D182 L282 | V157-V178 HydrophobicContact CG1-CG2 4.05Å; V157-V178 HydrophobicContact CG2-CG2 4.45Å; L174-V178 HydrophobicContact CD1-CG2 4.48Å; L174-V178 PolarHBondContact O-N 3.13Å; L174-V178 VanDerWaalsContact O-N 3.13Å; Y175-V178 PolarHBondContact O-N 3.23Å; L176-V178 VanDerWaalsContact C-N 3.35Å; L176-V178 PolarHBondContact O-N 3.15Å; V178-V180 PolarHBondContact O-N 3.14Å; V178-L181 WeakPolarHBondContact O-CB 3.38Å; V178-L181 PolarHBondContact O-N 3.36Å; V178-D182 WeakPolarHBondContact CG1-OD2 3.43Å; V178-D182 WeakPolarHBondContact O-CB 3.26Å; V178-D182 PolarHBondContact O-N 3.24Å; V178-L282 HydrophobicContact CB-CD2 4.13Å; V178-L282 HydrophobicContact CG1-CD2 4.09Å; V178-L282 HydrophobicContact CG2-CB 4.5Å; V178-L282 HydrophobicContact CG2-CD1 4.35Å; V178-L282 HydrophobicContact CG2-CD2 4.22Å |
| 179 | A | 98.6 | Very high | 98.4 | Very high | 3 Ų | 3 | 20.7 Ų | 20.7 | 3% | 0.025 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -61.8 | -42.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | Y175 L176 R183 | Y175-A179 WeakPolarHBondContact O-CB 3.26Å; Y175-A179 PolarHBondContact O-N 2.96Å; L176-A179 PolarHBondContact O-N 3.42Å; A179-R183 VanDerWaalsContact O-CB 3.3Å; A179-R183 WeakPolarHBondContact O-CB 3.35Å; A179-R183 VanDerWaalsContact O-CG 3.31Å; A179-R183 WeakPolarHBondContact O-CG 3.24Å; A179-R183 PolarHBondContact O-N 3.37Å; A179-R183 VanDerWaalsContact O-N 3.07Å |
| 180 | V | 98.9 | Very high | 98.4 | Very high | 0 Ų | 0 | 20.9 Ų | 20.9 | 0% | 0 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -65.8 | -45.5 | 175.4 | 168.8 | 0 | 0 | 0 | 0 | 110.4 | L176 T177 V178 F184 A202 V240 L244 L248 | L176-V180 HydrophobicContact CD1-CG2 4.01Å; L176-V180 HydrophobicContact CG-CG2 4.28Å; L176-V180 WeakPolarHBondContact O-CB 3.36Å; L176-V180 VanDerWaalsContact O-CG2 3.3Å; L176-V180 WeakPolarHBondContact O-CG2 3.41Å; L176-V180 PolarHBondContact O-N 2.99Å; T177-V180 PolarHBondContact O-N 3.5Å; V178-V180 PolarHBondContact O-N 3.14Å; V180-F184 WeakPolarHBondContact O-CB 3.48Å; V180-F184 PolarHBondContact O-N 2.8Å; V180-A202 HydrophobicContact CB-CB 4.23Å; V180-A202 HydrophobicContact CG1-CB 3.74Å; V180-V240 HydrophobicContact CG1-CG1 3.51Å; V180-L244 HydrophobicContact CB-CD1 4.45Å; V180-L244 HydrophobicContact CG1-CD1 3.88Å; V180-L248 HydrophobicContact CG2-CD2 3.98Å |
| 181 | L | 98.8 | Very high | 98.4 | Very high | 0 Ų | 0 | 19 Ų | 19 | 0% | 0 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -56.2 | -53.9 | 177 | 175.6 | 65 | 0 | 0 | 0 | 111.4 | L156 V157 L160 T177 V178 F184 L185 V198 A202 | L156-L181 HydrophobicContact CD2-CD1 4.01Å; L156-L181 HydrophobicContact CD2-CD2 3.8Å; V157-L181 HydrophobicContact CG2-CD2 4.05Å; L160-L181 HydrophobicContact CD1-CD2 4.33Å; T177-L181 WeakPolarHBondContact O-CB 3.36Å; T177-L181 PolarHBondContact O-N 3.06Å; V178-L181 WeakPolarHBondContact O-CB 3.38Å; V178-L181 PolarHBondContact O-N 3.36Å; L181-F184 PolarHBondContact O-N 3.34Å; L181-L185 HydrophobicContact CD1-CD1 3.76Å; L181-L185 HydrophobicContact CD1-CG 4.07Å; L181-L185 HydrophobicContact CG-CD1 3.98Å; L181-L185 VanDerWaalsContact O-CG 3.3Å; L181-L185 WeakPolarHBondContact O-CG 3.38Å; L181-L185 PolarHBondContact O-N 3.19Å; L181-V198 HydrophobicContact CD1-CG1 3.7Å; L181-A202 HydrophobicContact CB-CB 4.31Å |
| 182 | D | 98.8 | Very high | 98.3 | Very high | 5 Ų | 5 | 23 Ų | 23 | 3% | 0.027 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -65.8 | -43.2 | -176.9 | -72.6 | -31.9 | 0 | 0 | 0 | 112.3 | I138 Y142 R153 V178 F184 L185 Q186 | I138-D182 HydrophobicContact CD1-CB 3.58Å; I138-D182 HydrophobicContact CG1-CB 4.12Å; I138-D182 HydrophobicContact CG2-CB 4.17Å; Y142-D182 HydrophobicContact CE1-CB 4.13Å; Y142-D182 PolarHBondContact OH-OD1 2.79Å; R153-D182 IonicContact CZ-OD1 3.7Å; R153-D182 IonicContact CZ-OD2 3.85Å; R153-D182 IonicContact NE-OD1 2.73Å; R153-D182 PolarHBondContact NE-OD1 3.41Å; R153-D182 IonicContact NE-OD2 2.64Å; R153-D182 IonicContact NH2-OD1 3.24Å; R153-D182 PolarHBondContact NH2-OD1 3.28Å; R153-D182 IonicContact NH2-OD2 3.24Å; R153-D182 PolarHBondContact NH2-OD2 2.82Å; V178-D182 WeakPolarHBondContact CG1-OD2 3.43Å; V178-D182 WeakPolarHBondContact O-CB 3.26Å; V178-D182 PolarHBondContact O-N 3.24Å; D182-F184 VanDerWaalsContact C-N 3.26Å; D182-F184 PolarHBondContact O-N 2.83Å; D182-L185 PolarHBondContact O-N 3.13Å; D182-Q186 PolarHBondContact O-N 3.37Å; D182-Q186 VanDerWaalsContact O-N 3.09Å |
| 183 | R | 98.6 | Very high | 98.1 | Very high | 18 Ų | 18 | 29.7 Ų | 29.7 | 7% | 0.068 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -65 | -30.6 | 176.4 | -76.1 | -179.8 | 59.8 | -138.2 | 0.7 | 112.9 | I138 A179 Q186 L244 Q247 | I138-R183 HydrophobicContact CD1-CG 4.46Å; I138-R183 HydrophobicContact CG1-CG 3.83Å; A179-R183 VanDerWaalsContact O-CB 3.3Å; A179-R183 WeakPolarHBondContact O-CB 3.35Å; A179-R183 VanDerWaalsContact O-CG 3.31Å; A179-R183 WeakPolarHBondContact O-CG 3.24Å; A179-R183 PolarHBondContact O-N 3.37Å; A179-R183 VanDerWaalsContact O-N 3.07Å; R183-Q186 WeakPolarHBondContact O-CG 3.46Å; R183-L244 HydrophobicContact CB-CD2 3.75Å; R183-Q247 PolarHBondContact NH1-O 3.47Å; R183-Q247 PolarHBondContact NH2-O 3.43Å |
| 184 | F | 98.8 | Very high | 98.1 | Very high | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -74.9 | -48.8 | 175.7 | 178.1 | -101.2 | 0 | 0 | 0 | 111.4 | V180 L181 D182 Q186 V187 Q188 V190 V198 M236 L239 V240 R243 L244 | V180-F184 WeakPolarHBondContact O-CB 3.48Å; V180-F184 PolarHBondContact O-N 2.8Å; L181-F184 PolarHBondContact O-N 3.34Å; D182-F184 VanDerWaalsContact C-N 3.26Å; D182-F184 PolarHBondContact O-N 2.83Å; F184-Q186 VanDerWaalsContact C-N 3.25Å; F184-Q186 PolarHBondContact O-N 2.83Å; F184-V187 WeakPolarHBondContact O-CG2 3.5Å; F184-V187 PolarHBondContact O-N 3.05Å; F184-Q188 HydrophobicContact CD1-CB 4.28Å; F184-Q188 HydrophobicContact CD2-CB 4.16Å; F184-Q188 HydrophobicContact CE1-CB 3.96Å; F184-Q188 HydrophobicContact CE1-CG 3.84Å; F184-Q188 HydrophobicContact CE2-CB 3.82Å; F184-Q188 HydrophobicContact CE2-CG 3.86Å; F184-Q188 HydrophobicContact CG-CB 4.41Å; F184-Q188 HydrophobicContact CZ-CB 3.75Å; F184-Q188 HydrophobicContact CZ-CG 3.42Å; F184-Q188 VanDerWaalsContact CZ-CG 3.42Å; F184-Q188 WeakPolarHBondContact O-CB 3.49Å; F184-Q188 PolarHBondContact O-N 3.44Å; F184-V190 HydrophobicContact CD1-CG2 4.4Å; F184-V190 HydrophobicContact CE1-CG2 3.73Å; F184-V198 HydrophobicContact CD1-CG1 3.46Å; F184-V198 VanDerWaalsContact CD1-CG1 3.46Å; F184-V198 HydrophobicContact CD1-CG2 4.38Å; F184-V198 HydrophobicContact CE1-CB 4.39Å; F184-V198 HydrophobicContact CE1-CG1 3.65Å; F184-V198 HydrophobicContact CE1-CG2 3.73Å; F184-V198 HydrophobicContact CG-CG1 4.47Å; F184-M236 HydrophobicContact CE1-SD 4.48Å; F184-M236 HydrophobicContact CZ-SD 4.18Å; F184-L239 HydrophobicContact CE2-CG 4.11Å; F184-L239 HydrophobicContact CZ-CD2 4.13Å; F184-L239 HydrophobicContact CZ-CG 4.1Å; F184-V240 HydrophobicContact CD1-CG2 4.34Å; F184-V240 HydrophobicContact CD2-CB 4.17Å; F184-V240 HydrophobicContact CD2-CG1 4.39Å; F184-V240 HydrophobicContact CD2-CG2 3.84Å; F184-V240 HydrophobicContact CE1-CG2 4.31Å; F184-V240 HydrophobicContact CE2-CB 4.27Å; F184-V240 HydrophobicContact CE2-CG2 3.8Å; F184-V240 HydrophobicContact CG-CG2 4.08Å; F184-V240 HydrophobicContact CZ-CG2 4.01Å; F184-R243 HydrophobicContact CD2-CB 3.89Å; F184-R243 HydrophobicContact CD2-CG 4.32Å; F184-R243 HydrophobicContact CE2-CB 3.87Å; F184-R243 HydrophobicContact CE2-CG 3.79Å; F184-L244 HydrophobicContact CB-CD2 4.49Å |
| 185 | L | 98.6 | Very high | 98.1 | Very high | 9 Ų | 9 | 35.3 Ų | 35.3 | 5% | 0.047 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -62.4 | -31.1 | -178.5 | -69.1 | 176 | 0 | 0 | 0 | 112.6 | Y142 L143 L181 D182 V187 V190 L195 | Y142-L185 HydrophobicContact CD2-CB 4.25Å; Y142-L185 HydrophobicContact CE2-CB 3.51Å; Y142-L185 HydrophobicContact CE2-CD1 4.37Å; L143-L185 HydrophobicContact CD2-CB 4.48Å; L181-L185 HydrophobicContact CD1-CD1 3.76Å; L181-L185 HydrophobicContact CD1-CG 4.07Å; L181-L185 HydrophobicContact CG-CD1 3.98Å; L181-L185 VanDerWaalsContact O-CG 3.3Å; L181-L185 WeakPolarHBondContact O-CG 3.38Å; L181-L185 PolarHBondContact O-N 3.19Å; D182-L185 PolarHBondContact O-N 3.13Å; L185-V187 PolarHBondContact O-N 3.06Å; L185-V190 HydrophobicContact CD2-CB 3.91Å; L185-V190 HydrophobicContact CD2-CG1 4.36Å; L185-V190 HydrophobicContact CD2-CG2 3.78Å; L185-L195 HydrophobicContact CD1-CD1 4.19Å; L185-L195 HydrophobicContact CD2-CD1 4.22Å |
| 186 | Q | 97.8 | Very high | 98.1 | Very high | 30 Ų | 30 | 35.1 Ų | 35.1 | 14% | 0.14 | 17% | 0.17 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -70.9 | -15.5 | 176.7 | 70.5 | 174.6 | 10 | 0 | 0 | 114.5 | A137 R139 Y142 D182 R183 F184 | A137-Q186 PolarHBondContact O-NE2 3.04Å; R139-Q186 PolarHBondContact NH2-O 3.29Å; Y142-Q186 HydrophobicContact CD1-CB 4.47Å; Y142-Q186 HydrophobicContact CD2-CB 3.83Å; Y142-Q186 HydrophobicContact CG-CB 3.73Å; D182-Q186 PolarHBondContact O-N 3.37Å; D182-Q186 VanDerWaalsContact O-N 3.09Å; R183-Q186 WeakPolarHBondContact O-CG 3.46Å; F184-Q186 VanDerWaalsContact C-N 3.25Å; F184-Q186 PolarHBondContact O-N 2.83Å |
| 187 | V | 97.8 | Very high | 98.1 | Very high | 61 Ų | 61 | 35.6 Ų | 35.6 | 37% | 0.37 | 17% | 0.172 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -119.3 | -12.8 | -179.7 | -58 | 0 | 0 | 0 | 0 | 113.8 | F184 L185 R243 | F184-V187 WeakPolarHBondContact O-CG2 3.5Å; F184-V187 PolarHBondContact O-N 3.05Å; L185-V187 PolarHBondContact O-N 3.06Å; V187-R243 HydrophobicContact CG2-CB 4.23Å; V187-R243 PolarHBondContact O-NH2 2.98Å |
| 188 | Q | 98 | Very high | 98.1 | Very high | 44 Ų | 44 | 35.6 Ų | 35.6 | 21% | 0.206 | 17% | 0.172 | C | C | . | . | S | Bend | trans | -127.1 | 115.9 | -176.2 | -179 | 57.2 | 53 | 0 | 0 | 109.9 | F184 V190 R243 | F184-Q188 HydrophobicContact CD1-CB 4.28Å; F184-Q188 HydrophobicContact CD2-CB 4.16Å; F184-Q188 HydrophobicContact CE1-CB 3.96Å; F184-Q188 HydrophobicContact CE1-CG 3.84Å; F184-Q188 HydrophobicContact CE2-CB 3.82Å; F184-Q188 HydrophobicContact CE2-CG 3.86Å; F184-Q188 HydrophobicContact CG-CB 4.41Å; F184-Q188 HydrophobicContact CZ-CB 3.75Å; F184-Q188 HydrophobicContact CZ-CG 3.42Å; F184-Q188 VanDerWaalsContact CZ-CG 3.42Å; F184-Q188 WeakPolarHBondContact O-CB 3.49Å; F184-Q188 PolarHBondContact O-N 3.44Å; Q188-V190 HydrophobicContact CG-CG2 4.3Å; Q188-V190 PolarHBondContact O-N 2.83Å; Q188-R243 HydrophobicContact CB-CG 4.46Å; Q188-R243 VanDerWaalsContact OE1-NE 3.15Å |
| 189 | P | 96.4 | Very high | 98.1 | Very high | 107 Ų | 107 | 35.4 Ų | 35.4 | 70% | 0.695 | 17% | 0.171 | S | C | * | . | trans | -59.6 | 129.7 | 168.9 | -23.5 | 33.9 | 0 | 0 | 0 | 110.5 | ||||
| 190 | V | 97.8 | Very high | 98.1 | Very high | 19 Ų | 19 | 35.2 Ų | 35.2 | 12% | 0.115 | 17% | 0.17 | C | C | . | . | trans | -130.8 | 133 | -178.6 | 172.1 | 0 | 0 | 0 | 0 | 108.1 | V148 F184 L185 Q188 K194 V198 | V148-V190 HydrophobicContact CG2-CG1 4.46Å; V148-V190 WeakPolarHBondContact CG2-O 3.48Å; F184-V190 HydrophobicContact CD1-CG2 4.4Å; F184-V190 HydrophobicContact CE1-CG2 3.73Å; L185-V190 HydrophobicContact CD2-CB 3.91Å; L185-V190 HydrophobicContact CD2-CG1 4.36Å; L185-V190 HydrophobicContact CD2-CG2 3.78Å; Q188-V190 HydrophobicContact CG-CG2 4.3Å; Q188-V190 PolarHBondContact O-N 2.83Å; V190-K194 HydrophobicContact CG1-CB 4.07Å; V190-V198 HydrophobicContact CG1-CG2 3.98Å; V190-V198 HydrophobicContact CG2-CG2 3.98Å | ||
| 191 | S | 97.3 | Very high | 98.1 | Very high | 39 Ų | 39 | 35.2 Ų | 35.2 | 27% | 0.273 | 17% | 0.17 | S | C | . | . | trans | -80.2 | 157.6 | 173 | 64 | 0 | 0 | 0 | 0 | 111.3 | E147 R193 K194 L195 | E147-S191 VanDerWaalsContact OE2-CA 3.23Å; E147-S191 WeakPolarHBondContact OE2-CA 3.34Å; E147-S191 WeakPolarHBondContact OE2-CB 3.43Å; S191-R193 PolarHBondContact O-N 3.35Å; S191-R193 VanDerWaalsContact O-N 3.13Å; S191-K194 PolarHBondContact O-N 3.16Å; S191-L195 PolarHBondContact O-N 3.36Å | ||
| 192 | R | 96.2 | Very high | 98.1 | Very high | 107 Ų | 107 | 35.2 Ų | 35.2 | 40% | 0.404 | 17% | 0.17 | S | C | . | . | G | 310 helix | trans | -49.3 | -44.6 | 178.8 | 173.5 | 162.9 | 72.2 | 145.8 | 9.8 | 112.7 | E35 E147 M152 K194 L195 | E35-R192 PolarHBondContact O-NH1 2.87Å; E147-R192 VanDerWaalsContact OE1-CB 3.27Å; E147-R192 WeakPolarHBondContact OE1-CB 3.44Å; E147-R192 PolarHBondContact OE1-N 3.02Å; M152-R192 HydrophobicContact CE-CB 3.55Å; M152-R192 HydrophobicContact CE-CG 3.3Å; R192-K194 PolarHBondContact O-N 3.06Å; R192-L195 WeakPolarHBondContact O-CB 3.37Å; R192-L195 PolarHBondContact O-N 2.93Å |
| 193 | R | 95.8 | Very high | 98.1 | Very high | 166 Ų | 166 | 35 Ų | 35 | 63% | 0.626 | 17% | 0.169 | S | C | * | . | G | 310 helix | trans | -65.3 | -25 | -176.2 | -61.5 | -176.7 | -175.6 | 175.9 | 1.9 | 113.2 | S191 | S191-R193 PolarHBondContact O-N 3.35Å; S191-R193 VanDerWaalsContact O-N 3.13Å |
| 194 | K | 97.9 | Very high | 98.1 | Very high | 116 Ų | 116 | 34.2 Ų | 34.2 | 50% | 0.504 | 17% | 0.166 | S | C | . | . | G | 310 helix | trans | -96.5 | -6.5 | -179.5 | -68.3 | -175.1 | 177.6 | -175.9 | 0 | 112.9 | V190 S191 R192 Q196 L197 V198 | V190-K194 HydrophobicContact CG1-CB 4.07Å; S191-K194 PolarHBondContact O-N 3.16Å; R192-K194 PolarHBondContact O-N 3.06Å; K194-Q196 PolarHBondContact O-N 3.19Å; K194-L197 WeakPolarHBondContact O-CB 3.47Å; K194-L197 PolarHBondContact O-N 2.61Å; K194-V198 WeakPolarHBondContact O-CG2 3.48Å; K194-V198 PolarHBondContact O-N 2.84Å |
| 195 | L | 98.6 | Very high | 98.1 | Very high | 1 Ų | 1 | 34.5 Ų | 34.5 | 1% | 0.005 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -60.3 | -44.2 | -175.5 | -179.3 | 58 | 0 | 0 | 0 | 112.2 | V148 M152 L156 L185 S191 R192 L197 V198 G199 | V148-L195 HydrophobicContact CG1-CD1 4.06Å; V148-L195 HydrophobicContact CG1-CD2 3.76Å; V148-L195 HydrophobicContact CG2-CB 4.45Å; V148-L195 HydrophobicContact CG2-CD1 4.21Å; V148-L195 HydrophobicContact CG2-CD2 4.19Å; M152-L195 HydrophobicContact CB-CD2 3.84Å; M152-L195 HydrophobicContact CE-CD2 4.14Å; L156-L195 HydrophobicContact CD2-CD1 3.75Å; L156-L195 HydrophobicContact CD2-CG 3.81Å; L156-L195 WeakPolarHBondContact CD2-O 3.42Å; L185-L195 HydrophobicContact CD1-CD1 4.19Å; L185-L195 HydrophobicContact CD2-CD1 4.22Å; S191-L195 PolarHBondContact O-N 3.36Å; R192-L195 WeakPolarHBondContact O-CB 3.37Å; R192-L195 PolarHBondContact O-N 2.93Å; L195-L197 PolarHBondContact O-N 3.22Å; L195-V198 PolarHBondContact O-N 3.01Å; L195-G199 PolarHBondContact O-N 3.11Å |
| 196 | Q | 98.6 | Very high | 98.1 | Very high | 5 Ų | 5 | 34 Ų | 34 | 2% | 0.023 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -64.9 | -40 | 177.2 | -169.6 | -175.5 | 28.1 | 0 | 0 | 112.2 | L156 W159 K194 V198 G199 V200 T224 F228 | L156-Q196 HydrophobicContact CD1-CG 4.43Å; W159-Q196 HydrophobicContact CH2-CG 4.08Å; W159-Q196 HydrophobicContact CZ3-CG 3.91Å; K194-Q196 PolarHBondContact O-N 3.19Å; Q196-V198 VanDerWaalsContact C-N 3.32Å; Q196-V198 PolarHBondContact O-N 3.06Å; Q196-G199 PolarHBondContact O-N 3.16Å; Q196-G199 VanDerWaalsContact O-N 3.11Å; Q196-V200 PolarHBondContact O-N 3.09Å; Q196-T224 HydrophobicContact CG-CG2 4.48Å; Q196-F228 HydrophobicContact CB-CE2 4Å; Q196-F228 HydrophobicContact CB-CZ 4.33Å; Q196-F228 HydrophobicContact CG-CE2 4.19Å |
| 197 | L | 98.8 | Very high | 98.2 | Very high | 13 Ų | 13 | 32.6 Ų | 32.6 | 7% | 0.068 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -59.2 | -42.7 | 175.3 | 179.1 | 58.2 | 0 | 0 | 0 | 111.7 | K194 L195 G199 V200 A201 F228 Q232 I233 M236 | K194-L197 WeakPolarHBondContact O-CB 3.47Å; K194-L197 PolarHBondContact O-N 2.61Å; L195-L197 PolarHBondContact O-N 3.22Å; L197-G199 VanDerWaalsContact C-N 3.35Å; L197-V200 HydrophobicContact CD1-CG2 4.35Å; L197-V200 VanDerWaalsContact O-CG2 3.28Å; L197-V200 WeakPolarHBondContact O-CG2 3.42Å; L197-A201 VanDerWaalsContact O-CB 3.29Å; L197-A201 WeakPolarHBondContact O-CB 3.22Å; L197-A201 PolarHBondContact O-N 2.69Å; L197-F228 HydrophobicContact CB-CD1 3.98Å; L197-F228 HydrophobicContact CB-CD2 4.17Å; L197-F228 HydrophobicContact CB-CE1 3.79Å; L197-F228 HydrophobicContact CB-CE2 3.99Å; L197-F228 HydrophobicContact CB-CG 4.17Å; L197-F228 HydrophobicContact CB-CZ 3.8Å; L197-F228 HydrophobicContact CD1-CB 3.95Å; L197-F228 HydrophobicContact CD1-CD1 4.11Å; L197-F228 HydrophobicContact CD1-CD2 4.23Å; L197-F228 HydrophobicContact CD1-CG 3.81Å; L197-F228 HydrophobicContact CD2-CD1 4.07Å; L197-F228 HydrophobicContact CD2-CE1 4.36Å; L197-F228 HydrophobicContact CG-CD1 4.27Å; L197-F228 HydrophobicContact CG-CG 4.41Å; L197-Q232 HydrophobicContact CD1-CB 4.49Å; L197-Q232 HydrophobicContact CD2-CB 4.33Å; L197-I233 HydrophobicContact CD1-CB 4.41Å; L197-I233 HydrophobicContact CD1-CG1 3.77Å; L197-M236 HydrophobicContact CD1-CB 4.22Å; L197-M236 HydrophobicContact CD2-CB 4.21Å; L197-M236 HydrophobicContact CD2-CE 3.78Å; L197-M236 HydrophobicContact CG-CB 3.88Å; L197-M236 HydrophobicContact CG-CE 3.98Å; L197-M236 HydrophobicContact CG-CG 4.02Å |
| 198 | V | 98.8 | Very high | 98.2 | Very high | 0 Ų | 0 | 34.8 Ų | 34.8 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -62.3 | -43.3 | 173.7 | 176 | 0 | 0 | 0 | 0 | 110.9 | L181 F184 V190 K194 L195 Q196 A201 A202 M236 | L181-V198 HydrophobicContact CD1-CG1 3.7Å; F184-V198 HydrophobicContact CD1-CG1 3.46Å; F184-V198 VanDerWaalsContact CD1-CG1 3.46Å; F184-V198 HydrophobicContact CD1-CG2 4.38Å; F184-V198 HydrophobicContact CE1-CB 4.39Å; F184-V198 HydrophobicContact CE1-CG1 3.65Å; F184-V198 HydrophobicContact CE1-CG2 3.73Å; F184-V198 HydrophobicContact CG-CG1 4.47Å; V190-V198 HydrophobicContact CG1-CG2 3.98Å; V190-V198 HydrophobicContact CG2-CG2 3.98Å; K194-V198 WeakPolarHBondContact O-CG2 3.48Å; K194-V198 PolarHBondContact O-N 2.84Å; L195-V198 PolarHBondContact O-N 3.01Å; Q196-V198 VanDerWaalsContact C-N 3.32Å; Q196-V198 PolarHBondContact O-N 3.06Å; V198-A201 PolarHBondContact O-N 2.93Å; V198-A202 VanDerWaalsContact O-CB 3.31Å; V198-A202 WeakPolarHBondContact O-CB 3.36Å; V198-A202 PolarHBondContact O-N 3.42Å; V198-M236 HydrophobicContact CG2-CE 3.77Å; V198-M236 HydrophobicContact CG2-CG 4.28Å; V198-M236 HydrophobicContact CG2-SD 3.66Å |
| 199 | G | 98.8 | Very high | 98.2 | Very high | 0 Ų | 0 | 38.6 Ų | 38.6 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -59.4 | -47.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | L195 Q196 L197 A202 M203 | L195-G199 PolarHBondContact O-N 3.11Å; Q196-G199 PolarHBondContact O-N 3.16Å; Q196-G199 VanDerWaalsContact O-N 3.11Å; L197-G199 VanDerWaalsContact C-N 3.35Å; G199-A202 PolarHBondContact O-N 3.5Å; G199-M203 PolarHBondContact O-N 3.33Å |
| 200 | V | 98.7 | Very high | 98.3 | Very high | 0 Ų | 0 | 36.3 Ų | 36.3 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -70.6 | -35.2 | 177.7 | -63.7 | 0 | 0 | 0 | 0 | 112.7 | W159 Q196 L197 M203 L204 F220 T224 I233 | W159-V200 HydrophobicContact CH2-CG1 3.49Å; W159-V200 VanDerWaalsContact CH2-CG1 3.49Å; W159-V200 HydrophobicContact CZ3-CG1 3.72Å; Q196-V200 PolarHBondContact O-N 3.09Å; L197-V200 HydrophobicContact CD1-CG2 4.35Å; L197-V200 VanDerWaalsContact O-CG2 3.28Å; L197-V200 WeakPolarHBondContact O-CG2 3.42Å; V200-M203 PolarHBondContact O-N 3.2Å; V200-L204 WeakPolarHBondContact O-CB 3.09Å; V200-L204 PolarHBondContact O-N 2.83Å; V200-F220 HydrophobicContact CB-CD1 4.11Å; V200-T224 HydrophobicContact CG1-CG2 3.6Å; V200-T224 HydrophobicContact CG2-CG2 4.31Å; V200-I233 HydrophobicContact CG2-CG1 4.39Å |
| 201 | A | 98.9 | Very high | 98.3 | Very high | 0 Ų | 0 | 37.1 Ų | 37.1 | 0% | 0 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -65.9 | -40.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | L197 V198 M203 L204 V205 M236 | L197-A201 VanDerWaalsContact O-CB 3.29Å; L197-A201 WeakPolarHBondContact O-CB 3.22Å; L197-A201 PolarHBondContact O-N 2.69Å; V198-A201 PolarHBondContact O-N 2.93Å; A201-M203 VanDerWaalsContact C-N 3.32Å; A201-M203 PolarHBondContact O-N 3.48Å; A201-L204 PolarHBondContact O-N 3.41Å; A201-V205 WeakPolarHBondContact O-CG2 3.29Å; A201-V205 PolarHBondContact O-N 3.24Å; A201-M236 HydrophobicContact CB-CB 3.85Å; A201-M236 HydrophobicContact CB-CG 3.53Å |
| 202 | A | 98.9 | Very high | 98.3 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -62 | -40.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | T177 V180 L181 V198 G199 V205 A206 | T177-A202 HydrophobicContact CG2-CB 4.42Å; V180-A202 HydrophobicContact CB-CB 4.23Å; V180-A202 HydrophobicContact CG1-CB 3.74Å; L181-A202 HydrophobicContact CB-CB 4.31Å; V198-A202 VanDerWaalsContact O-CB 3.31Å; V198-A202 WeakPolarHBondContact O-CB 3.36Å; V198-A202 PolarHBondContact O-N 3.42Å; G199-A202 PolarHBondContact O-N 3.5Å; A202-V205 PolarHBondContact O-N 2.98Å; A202-A206 PolarHBondContact O-N 2.81Å |
| 203 | M | 98.9 | Very high | 98.3 | Very high | 1 Ų | 1 | 45.6 Ų | 45.6 | 1% | 0.005 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -68.1 | -40.8 | 175.3 | -172.9 | 173.4 | -78.5 | 0 | 0 | 112.1 | L160 V163 H164 L169 T177 G199 V200 A201 V205 A206 C207 F220 | L160-M203 HydrophobicContact CB-CE 3.98Å; L160-M203 HydrophobicContact CD2-CE 3.9Å; L160-M203 HydrophobicContact CG-CE 4.49Å; L160-M203 WeakPolarHBondContact O-CE 3.37Å; V163-M203 HydrophobicContact CB-CE 4.42Å; V163-M203 HydrophobicContact CB-SD 4.28Å; V163-M203 HydrophobicContact CG1-CE 4.43Å; V163-M203 HydrophobicContact CG1-SD 3.66Å; H164-M203 HydrophobicContact CB-CE 4.18Å; L169-M203 HydrophobicContact CD1-CG 4.22Å; L169-M203 HydrophobicContact CD1-SD 3.92Å; T177-M203 HydrophobicContact CG2-CB 3.72Å; T177-M203 HydrophobicContact CG2-CE 4.16Å; T177-M203 HydrophobicContact CG2-CG 4.35Å; T177-M203 WeakPolarHBondContact OG1-CA 3.38Å; G199-M203 PolarHBondContact O-N 3.33Å; V200-M203 PolarHBondContact O-N 3.2Å; A201-M203 VanDerWaalsContact C-N 3.32Å; A201-M203 PolarHBondContact O-N 3.48Å; M203-V205 VanDerWaalsContact C-N 3.33Å; M203-V205 PolarHBondContact O-N 2.83Å; M203-A206 PolarHBondContact O-N 3.45Å; M203-C207 PolarHBondContact O-N 3.33Å; M203-C207 PolarHBondContact O-SG 3.45Å; M203-F220 HydrophobicContact CB-CE1 3.94Å; M203-F220 HydrophobicContact CG-CE1 3.78Å; M203-F220 HydrophobicContact CG-CZ 4.17Å; M203-F220 HydrophobicContact SD-CE1 4Å |
| 204 | L | 98.8 | Very high | 98.4 | Very high | 1 Ų | 1 | 39.9 Ų | 39.9 | 1% | 0.005 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -59.2 | -44.5 | 174.4 | 178.7 | 66 | 0 | 0 | 0 | 111.4 | V200 A201 A206 C207 K208 V217 F220 I233 | V200-L204 WeakPolarHBondContact O-CB 3.09Å; V200-L204 PolarHBondContact O-N 2.83Å; A201-L204 PolarHBondContact O-N 3.41Å; L204-A206 VanDerWaalsContact C-N 3.35Å; L204-C207 PolarHBondContact O-N 3.37Å; L204-K208 HydrophobicContact CG-CD 4.49Å; L204-K208 WeakPolarHBondContact O-CG 3.42Å; L204-K208 PolarHBondContact O-N 3.2Å; L204-V217 HydrophobicContact CD2-CG2 4.3Å; L204-F220 HydrophobicContact CB-CD2 4.35Å; L204-F220 HydrophobicContact CB-CE2 4.11Å; L204-F220 HydrophobicContact CB-CZ 4.2Å; L204-F220 HydrophobicContact CD1-CD2 3.74Å; L204-F220 HydrophobicContact CD1-CE2 3.49Å; L204-F220 VanDerWaalsContact CD1-CE2 3.49Å; L204-F220 HydrophobicContact CD1-CZ 4.32Å; L204-F220 HydrophobicContact CG-CE2 4.4Å; L204-I233 HydrophobicContact CD2-CG2 3.83Å |
| 205 | V | 98.9 | Very high | 98.4 | Very high | 5 Ų | 5 | 35.3 Ų | 35.3 | 3% | 0.03 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -59.5 | -46.1 | 174.7 | 168.5 | 0 | 0 | 0 | 0 | 110.8 | A201 A202 M203 K208 Y209 E237 L241 L248 | A201-V205 WeakPolarHBondContact O-CG2 3.29Å; A201-V205 PolarHBondContact O-N 3.24Å; A202-V205 PolarHBondContact O-N 2.98Å; M203-V205 VanDerWaalsContact C-N 3.33Å; M203-V205 PolarHBondContact O-N 2.83Å; V205-K208 PolarHBondContact O-N 3.18Å; V205-Y209 WeakPolarHBondContact O-CB 3.43Å; V205-Y209 PolarHBondContact O-N 3.43Å; V205-E237 HydrophobicContact CG2-CG 3.86Å; V205-L241 HydrophobicContact CG1-CD2 4.01Å; V205-L241 HydrophobicContact CG2-CD2 4.24Å; V205-L241 HydrophobicContact CG2-CG 4.24Å; V205-L248 HydrophobicContact CG1-CD1 3.62Å; V205-L248 HydrophobicContact CG1-CD2 3.87Å; V205-L248 HydrophobicContact CG1-CG 4.42Å |
| 206 | A | 98.8 | Very high | 98.3 | Very high | 0 Ų | 0 | 41.9 Ų | 41.9 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -63.6 | -42 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | T173 L176 T177 A202 M203 L204 K208 Y209 E210 | T173-A206 HydrophobicContact CG2-CB 3.94Å; T173-A206 WeakPolarHBondContact O-CB 3.36Å; L176-A206 HydrophobicContact CB-CB 4Å; L176-A206 HydrophobicContact CD2-CB 3.98Å; L176-A206 HydrophobicContact CG-CB 3.87Å; T177-A206 WeakPolarHBondContact OG1-CB 3.39Å; A202-A206 PolarHBondContact O-N 2.81Å; M203-A206 PolarHBondContact O-N 3.45Å; L204-A206 VanDerWaalsContact C-N 3.35Å; A206-K208 PolarHBondContact O-N 2.92Å; A206-Y209 PolarHBondContact O-N 3.07Å; A206-Y209 VanDerWaalsContact O-N 3.11Å; A206-E210 PolarHBondContact O-N 3.13Å |
| 207 | C | 98.8 | Very high | 98.3 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -62.3 | -44.2 | 177.4 | -68.9 | 0 | 0 | 0 | 0 | 111.8 | L169 T173 M203 L204 Y209 E211 C214 | L169-C207 VanDerWaalsContact CD1-SG 3.52Å; T173-C207 HydrophobicContact CG2-CB 4.4Å; M203-C207 PolarHBondContact O-N 3.33Å; M203-C207 PolarHBondContact O-SG 3.45Å; L204-C207 PolarHBondContact O-N 3.37Å; C207-Y209 PolarHBondContact O-N 3.43Å; C207-E211 HydrophobicContact CB-CG 4.07Å; C207-E211 WeakPolarHBondContact O-CB 3.36Å; C207-E211 PolarHBondContact O-N 2.66Å; C207-C214 HydrophobicContact CB-CB 4.22Å; C207-C214 WeakPolarHBondContact CB-SG 3.27Å |
| 208 | K | 98.6 | Very high | 98.3 | Very high | 106 Ų | 106 | 43.1 Ų | 43.1 | 46% | 0.461 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -64.2 | -21.5 | 176.3 | -72.1 | 178.4 | -179.1 | 174.7 | 0 | 113.2 | L204 V205 A206 C214 E237 | L204-K208 HydrophobicContact CG-CD 4.49Å; L204-K208 WeakPolarHBondContact O-CG 3.42Å; L204-K208 PolarHBondContact O-N 3.2Å; V205-K208 PolarHBondContact O-N 3.18Å; A206-K208 PolarHBondContact O-N 2.92Å; K208-C214 HydrophobicContact CG-CB 4.43Å; K208-E237 WeakPolarHBondContact CD-OE1 3.46Å; K208-E237 WeakPolarHBondContact CE-OE1 3.41Å; K208-E237 IonicContact NZ-OE1 2.72Å; K208-E237 PolarHBondContact NZ-OE1 3.37Å; K208-E237 IonicContact NZ-OE2 3.87Å; K208-E237 PolarHBondContact NZ-OE2 3.26Å |
| 209 | Y | 98.3 | Very high | 98.3 | Very high | 124 Ų | 124 | 46.3 Ų | 46.3 | 49% | 0.486 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -90.1 | -42.3 | -179 | -167 | -92.1 | 0 | 0 | 0 | 112.6 | L176 V205 A206 C207 L248 | L176-Y209 HydrophobicContact CD2-CD1 3.55Å; L176-Y209 HydrophobicContact CD2-CE1 4.39Å; L176-Y209 HydrophobicContact CD2-CG 3.97Å; V205-Y209 WeakPolarHBondContact O-CB 3.43Å; V205-Y209 PolarHBondContact O-N 3.43Å; A206-Y209 PolarHBondContact O-N 3.07Å; A206-Y209 VanDerWaalsContact O-N 3.11Å; C207-Y209 PolarHBondContact O-N 3.43Å; Y209-L248 HydrophobicContact CD2-CB 4.13Å; Y209-L248 HydrophobicContact CD2-CD1 3.92Å; Y209-L248 HydrophobicContact CE2-CB 4.01Å; Y209-L248 HydrophobicContact CE2-CD1 4.48Å |
| 210 | E | 98.1 | Very high | 98.2 | Very high | 59 Ų | 59 | 46.3 Ų | 46.3 | 28% | 0.276 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -105 | -30.7 | -171.9 | -66.9 | -66.1 | 164.9 | 0 | 0 | 114.3 | E172 T173 L176 A206 | E172-E210 HydrophobicContact CB-CG 4.21Å; T173-E210 WeakPolarHBondContact OG1-CB 3.12Å; L176-E210 HydrophobicContact CD2-CG 3.78Å; A206-E210 PolarHBondContact O-N 3.13Å |
| 211 | E | 98.3 | Very high | 98.2 | Very high | 37 Ų | 37 | 46.5 Ų | 46.5 | 17% | 0.173 | 23% | 0.226 | C | C | . | . | trans | -86 | 135.7 | -171.7 | -58.9 | -68.8 | 159.1 | 0 | 0 | 111.7 | L169 L170 T173 C207 F213 | L169-E211 WeakPolarHBondContact CA-OE1 3.42Å; L169-E211 WeakPolarHBondContact CB-OE1 3.36Å; L169-E211 HydrophobicContact CD2-CG 4.01Å; L170-E211 WeakPolarHBondContact CB-OE1 3.31Å; L170-E211 PolarHBondContact N-OE1 2.87Å; T173-E211 WeakPolarHBondContact CB-OE1 3.33Å; T173-E211 HydrophobicContact CG2-CG 4.35Å; T173-E211 PolarHBondContact OG1-OE1 3.46Å; C207-E211 HydrophobicContact CB-CG 4.07Å; C207-E211 WeakPolarHBondContact O-CB 3.36Å; C207-E211 PolarHBondContact O-N 2.66Å; E211-F213 PolarHBondContact O-N 3.29Å | ||
| 212 | M | 97.5 | Very high | 98.2 | Very high | 162 Ų | 162 | 53.3 Ų | 53.3 | 80% | 0.798 | 25% | 0.253 | S | S | * | . | S | Bend | trans | -62.3 | -37.3 | 168.6 | -174.4 | 178.8 | -176.8 | 0 | 0 | 111.3 | ||
| 213 | F | 96.3 | Very high | 98.1 | Very high | 162 Ų | 162 | 54.4 Ų | 54.4 | 71% | 0.711 | 26% | 0.259 | S | S | * | . | S | Bend | trans | -128.2 | 90.5 | 178.6 | -57.7 | -70.3 | 0 | 0 | 0 | 109.7 | E211 | E211-F213 PolarHBondContact O-N 3.29Š|
| 214 | C | 96.9 | Very high | 98 | Very high | 45 Ų | 45 | 54.6 Ų | 54.6 | 30% | 0.304 | 26% | 0.26 | S | S | . | . | P | Polyproline II helix | trans | -67.1 | 135.5 | 176.6 | 178.3 | 0 | 0 | 0 | 0 | 110.9 | C207 K208 | C207-C214 HydrophobicContact CB-CB 4.22Å; C207-C214 WeakPolarHBondContact CB-SG 3.27Å; K208-C214 HydrophobicContact CG-CB 4.43Å |
| 215 | P | 97.7 | Very high | 97.8 | Very high | 21 Ų | 21 | 61 Ų | 61 | 14% | 0.136 | 29% | 0.294 | C | S | . | . | P | Polyproline II helix | trans | -55.9 | 151.9 | 168.7 | -22.1 | 32.1 | 0 | 0 | 0 | 111.9 | F167 L169 D219 F220 | F167-P215 HydrophobicContact CB-CG 4.44Å; F167-P215 HydrophobicContact CD2-CG 4.18Å; F167-P215 HydrophobicContact CG-CG 4.29Å; L169-P215 HydrophobicContact CD2-CG 4.03Å; P215-D219 HydrophobicContact CB-CB 4.19Å; P215-F220 HydrophobicContact CB-CE2 3.9Å; P215-F220 HydrophobicContact CG-CE2 4.38Å |
| 216 | E | 97.8 | Very high | 97.6 | Very high | 139 Ų | 139 | 66.1 Ų | 66.1 | 65% | 0.65 | 32% | 0.322 | S | S | * | . | P | Polyproline II helix | trans | -73.7 | 156.5 | 179.6 | -65.4 | -169.4 | 179.2 | 0 | 0 | 111.1 | G218 D219 F220 | E216-G218 PolarHBondContact O-N 3.34Å; E216-G218 VanDerWaalsContact O-N 3.07Å; E216-D219 PolarHBondContact N-OD2 3.47Å; E216-D219 WeakPolarHBondContact O-CB 3.42Å; E216-D219 PolarHBondContact O-N 3.48Å; E216-F220 WeakPolarHBondContact O-CD2 3.5Å; E216-F220 PolarHBondContact O-N 2.91Å |
| 217 | V | 98.3 | Very high | 97.5 | Very high | 29 Ų | 29 | 67.7 Ų | 67.7 | 18% | 0.176 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -56.4 | -29.9 | 174.8 | -172 | 0 | 0 | 0 | 0 | 111.6 | L204 D219 F220 A221 K230 I233 L234 | L204-V217 HydrophobicContact CD2-CG2 4.3Å; V217-D219 VanDerWaalsContact C-N 3.34Å; V217-F220 PolarHBondContact O-N 3.07Å; V217-A221 PolarHBondContact O-N 3.22Å; V217-K230 HydrophobicContact CG1-CB 3.9Å; V217-K230 HydrophobicContact CG1-CG 4.18Å; V217-I233 HydrophobicContact CG1-CB 4.18Å; V217-I233 HydrophobicContact CG1-CG2 4.05Å; V217-L234 HydrophobicContact CG1-CG 4.24Å; V217-L234 HydrophobicContact CG2-CD2 4.03Å |
| 218 | G | 98.2 | Very high | 97.5 | Very high | 15 Ų | 15 | 68.7 Ų | 68.7 | 16% | 0.155 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -65 | -33.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 114 | E216 F220 A221 Y222 K230 | E216-G218 PolarHBondContact O-N 3.34Å; E216-G218 VanDerWaalsContact O-N 3.07Å; G218-F220 VanDerWaalsContact C-N 3.3Å; G218-F220 PolarHBondContact O-N 3.07Å; G218-A221 PolarHBondContact O-N 2.85Å; G218-Y222 WeakPolarHBondContact O-CB 3.4Å; G218-Y222 PolarHBondContact O-N 2.89Å; G218-K230 VanDerWaalsContact CA-CE 3.49Å |
| 219 | D | 98.2 | Very high | 97.5 | Very high | 67 Ų | 67 | 66.4 Ų | 66.4 | 36% | 0.358 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -66.8 | -36.5 | 176.6 | -59.2 | -44.2 | 0 | 0 | 0 | 110.9 | F167 P215 E216 V217 Y222 I223 | F167-D219 HydrophobicContact CE1-CB 4.14Å; F167-D219 HydrophobicContact CZ-CB 3.92Å; P215-D219 HydrophobicContact CB-CB 4.19Å; E216-D219 PolarHBondContact N-OD2 3.47Å; E216-D219 WeakPolarHBondContact O-CB 3.42Å; E216-D219 PolarHBondContact O-N 3.48Å; V217-D219 VanDerWaalsContact C-N 3.34Å; D219-Y222 PolarHBondContact O-N 3.04Å; D219-I223 WeakPolarHBondContact O-CB 3.39Å; D219-I223 PolarHBondContact O-N 2.91Å |
| 220 | F | 98.3 | Very high | 97.5 | Very high | 0 Ų | 0 | 66 Ų | 66 | 0% | 0 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -71 | -34.8 | 174.4 | -72.2 | -81.1 | 0 | 0 | 0 | 113.2 | F167 V200 M203 L204 P215 E216 V217 G218 I223 T224 I233 | F167-F220 HydrophobicContact CD2-CE1 4.45Å; F167-F220 HydrophobicContact CD2-CZ 4.5Å; F167-F220 HydrophobicContact CE2-CD1 4.13Å; F167-F220 AromaticContact CE2-CE1 3.89Å; F167-F220 HydrophobicContact CE2-CE1 3.89Å; F167-F220 HydrophobicContact CE2-CZ 4.16Å; V200-F220 HydrophobicContact CB-CD1 4.11Å; M203-F220 HydrophobicContact CB-CE1 3.94Å; M203-F220 HydrophobicContact CG-CE1 3.78Å; M203-F220 HydrophobicContact CG-CZ 4.17Å; M203-F220 HydrophobicContact SD-CE1 4Å; L204-F220 HydrophobicContact CB-CD2 4.35Å; L204-F220 HydrophobicContact CB-CE2 4.11Å; L204-F220 HydrophobicContact CB-CZ 4.2Å; L204-F220 HydrophobicContact CD1-CD2 3.74Å; L204-F220 HydrophobicContact CD1-CE2 3.49Å; L204-F220 VanDerWaalsContact CD1-CE2 3.49Å; L204-F220 HydrophobicContact CD1-CZ 4.32Å; L204-F220 HydrophobicContact CG-CE2 4.4Å; P215-F220 HydrophobicContact CB-CE2 3.9Å; P215-F220 HydrophobicContact CG-CE2 4.38Å; E216-F220 WeakPolarHBondContact O-CD2 3.5Å; E216-F220 PolarHBondContact O-N 2.91Å; V217-F220 PolarHBondContact O-N 3.07Å; G218-F220 VanDerWaalsContact C-N 3.3Å; G218-F220 PolarHBondContact O-N 3.07Å; F220-I223 WeakPolarHBondContact O-CG2 3.31Å; F220-T224 WeakPolarHBondContact O-CG2 3.46Å; F220-T224 PolarHBondContact O-OG1 3.4Å; F220-I233 HydrophobicContact CB-CD1 4.09Å |
| 221 | A | 98.1 | Very high | 97.5 | Very high | 4 Ų | 4 | 65.8 Ų | 65.8 | 3% | 0.033 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -64.8 | -48.6 | 170.7 | 0 | 0 | 0 | 0 | 0 | 110.5 | V217 G218 I223 T224 D226 K230 I233 | V217-A221 PolarHBondContact O-N 3.22Å; G218-A221 PolarHBondContact O-N 2.85Å; A221-I223 PolarHBondContact O-N 2.94Å; A221-T224 PolarHBondContact O-N 3.14Å; A221-T224 VanDerWaalsContact O-N 3.11Å; A221-T224 PolarHBondContact O-OG1 3.47Å; A221-D226 PolarHBondContact O-N 3.28Å; A221-D226 VanDerWaalsContact O-N 3.14Å; A221-K230 HydrophobicContact CB-CG 4.37Å; A221-I233 HydrophobicContact CB-CD1 4.02Å |
| 222 | Y | 97.9 | Very high | 97.5 | Very high | 142 Ų | 142 | 68 Ų | 68 | 56% | 0.557 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -59.4 | -44 | 179.5 | 174.6 | -102.3 | 0 | 0 | 0 | 112.8 | G218 D219 T224 D225 | G218-Y222 WeakPolarHBondContact O-CB 3.4Å; G218-Y222 PolarHBondContact O-N 2.89Å; D219-Y222 PolarHBondContact O-N 3.04Å; Y222-T224 PolarHBondContact O-N 3.15Å; Y222-D225 PolarHBondContact O-N 3.23Å |
| 223 | I | 97.4 | Very high | 97.6 | Very high | 23 Ų | 23 | 60.2 Ų | 60.2 | 12% | 0.118 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -67.6 | -19.5 | -178.9 | -159.6 | 62.4 | 0 | 0 | 0 | 112.9 | W159 V163 F167 D219 F220 A221 D225 | W159-I223 HydrophobicContact CH2-CG2 4.42Å; W159-I223 HydrophobicContact CZ2-CG1 4.41Å; W159-I223 HydrophobicContact CZ2-CG2 4.43Å; V163-I223 HydrophobicContact CG1-CG1 4.12Å; V163-I223 HydrophobicContact CG1-CG2 4.37Å; V163-I223 HydrophobicContact CG2-CG1 3.86Å; F167-I223 HydrophobicContact CE2-CG2 4.48Å; F167-I223 HydrophobicContact CZ-CB 4.08Å; F167-I223 HydrophobicContact CZ-CG1 4.41Å; F167-I223 HydrophobicContact CZ-CG2 4.19Å; D219-I223 WeakPolarHBondContact O-CB 3.39Å; D219-I223 PolarHBondContact O-N 2.91Å; F220-I223 WeakPolarHBondContact O-CG2 3.31Å; A221-I223 PolarHBondContact O-N 2.94Å; I223-D225 VanDerWaalsContact C-N 3.27Å |
| 224 | T | 96.4 | Very high | 97.7 | Very high | 6 Ų | 6 | 55.6 Ų | 55.6 | 4% | 0.037 | 30% | 0.299 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -87.6 | 11.7 | 172.2 | 63.5 | 0 | 0 | 0 | 0 | 113.6 | W159 Q196 V200 F220 A221 Y222 D226 A227 F228 | W159-T224 HydrophobicContact CH2-CG2 3.98Å; W159-T224 HydrophobicContact CZ2-CG2 4.49Å; Q196-T224 HydrophobicContact CG-CG2 4.48Å; V200-T224 HydrophobicContact CG1-CG2 3.6Å; V200-T224 HydrophobicContact CG2-CG2 4.31Å; F220-T224 WeakPolarHBondContact O-CG2 3.46Å; F220-T224 PolarHBondContact O-OG1 3.4Å; A221-T224 PolarHBondContact O-N 3.14Å; A221-T224 VanDerWaalsContact O-N 3.11Å; A221-T224 PolarHBondContact O-OG1 3.47Å; Y222-T224 PolarHBondContact O-N 3.15Å; T224-D226 PolarHBondContact O-N 3.22Å; T224-A227 WeakPolarHBondContact O-CB 3.38Å; T224-A227 PolarHBondContact O-N 2.61Å; T224-A227 VanDerWaalsContact O-N 3.13Å; T224-F228 HydrophobicContact CG2-CD2 4.12Å |
| 225 | D | 95.9 | Very high | 97.8 | Very high | 134 Ų | 134 | 59.4 Ų | 59.4 | 72% | 0.717 | 31% | 0.313 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.5 | 39.8 | -174.6 | -158.6 | 32.6 | 0 | 0 | 0 | 111.6 | Y222 I223 A227 | Y222-D225 PolarHBondContact O-N 3.23Å; I223-D225 VanDerWaalsContact C-N 3.27Å; D225-A227 PolarHBondContact O-N 3.16Å |
| 226 | D | 94.5 | Very high | 97.8 | Very high | 114 Ų | 114 | 59.1 Ų | 59.1 | 61% | 0.61 | 31% | 0.31 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.9 | 24.2 | -176.8 | -62.8 | -57.9 | 0 | 0 | 0 | 114.3 | A221 T224 F228 | A221-D226 PolarHBondContact O-N 3.28Å; A221-D226 VanDerWaalsContact O-N 3.14Å; T224-D226 PolarHBondContact O-N 3.22Å; D226-F228 PolarHBondContact O-N 3.18Å |
| 227 | A | 96.8 | Very high | 97.9 | Very high | 32 Ų | 32 | 53.4 Ų | 53.4 | 26% | 0.264 | 28% | 0.283 | S | S | . | . | S | Bend | trans | -61.6 | -22.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | T37 T224 D225 | T37-A227 HydrophobicContact CG2-CB 4.37Å; T224-A227 WeakPolarHBondContact O-CB 3.38Å; T224-A227 PolarHBondContact O-N 2.61Å; T224-A227 VanDerWaalsContact O-N 3.13Å; D225-A227 PolarHBondContact O-N 3.16Å |
| 228 | F | 97.8 | Very high | 97.9 | Very high | 21 Ų | 21 | 57.1 Ų | 57.1 | 9% | 0.092 | 30% | 0.299 | C | S | . | . | S | Bend | trans | -132.8 | 138.8 | 177.2 | -51.2 | -70.9 | 0 | 0 | 0 | 111.5 | Q196 L197 T224 D226 Q232 I233 | Q196-F228 HydrophobicContact CB-CE2 4Å; Q196-F228 HydrophobicContact CB-CZ 4.33Å; Q196-F228 HydrophobicContact CG-CE2 4.19Å; L197-F228 HydrophobicContact CB-CD1 3.98Å; L197-F228 HydrophobicContact CB-CD2 4.17Å; L197-F228 HydrophobicContact CB-CE1 3.79Å; L197-F228 HydrophobicContact CB-CE2 3.99Å; L197-F228 HydrophobicContact CB-CG 4.17Å; L197-F228 HydrophobicContact CB-CZ 3.8Å; L197-F228 HydrophobicContact CD1-CB 3.95Å; L197-F228 HydrophobicContact CD1-CD1 4.11Å; L197-F228 HydrophobicContact CD1-CD2 4.23Å; L197-F228 HydrophobicContact CD1-CG 3.81Å; L197-F228 HydrophobicContact CD2-CD1 4.07Å; L197-F228 HydrophobicContact CD2-CE1 4.36Å; L197-F228 HydrophobicContact CG-CD1 4.27Å; L197-F228 HydrophobicContact CG-CG 4.41Å; T224-F228 HydrophobicContact CG2-CD2 4.12Å; D226-F228 PolarHBondContact O-N 3.18Å; F228-Q232 HydrophobicContact CB-CB 4.5Å; F228-I233 HydrophobicContact CB-CG1 4.24Å |
| 229 | S | 98.4 | Very high | 97.9 | Very high | 58 Ų | 58 | 58.7 Ų | 58.7 | 41% | 0.406 | 30% | 0.303 | S | S | . | . | trans | -75.5 | 158.1 | 174.5 | 77.8 | 0 | 0 | 0 | 0 | 111.6 | A231 Q232 I233 | S229-A231 PolarHBondContact O-N 3.3Å; S229-Q232 PolarHBondContact O-N 2.8Å; S229-Q232 VanDerWaalsContact O-N 3.08Å; S229-Q232 WeakPolarHBondContact OG-CG 3.26Å; S229-Q232 PolarHBondContact OG-N 3.27Å; S229-I233 PolarHBondContact O-N 3.45Å; S229-I233 VanDerWaalsContact O-N 3.09Å | ||
| 230 | K | 98.6 | Very high | 98 | Very high | 116 Ų | 116 | 55.5 Ų | 55.5 | 50% | 0.504 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -53.8 | -37.6 | 173.8 | -60.5 | -174.1 | -171.1 | -170.3 | 0 | 112.1 | V217 G218 A221 I233 L234 | V217-K230 HydrophobicContact CG1-CB 3.9Å; V217-K230 HydrophobicContact CG1-CG 4.18Å; G218-K230 VanDerWaalsContact CA-CE 3.49Å; A221-K230 HydrophobicContact CB-CG 4.37Å; K230-I233 PolarHBondContact O-N 2.89Å; K230-L234 VanDerWaalsContact O-CG 3.32Å; K230-L234 WeakPolarHBondContact O-CG 3.45Å; K230-L234 PolarHBondContact O-N 3.48Å |
| 231 | A | 98.6 | Very high | 98 | Very high | 54 Ų | 54 | 57 Ų | 57 | 45% | 0.446 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -63.9 | -45.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | S229 I233 L234 E235 | S229-A231 PolarHBondContact O-N 3.3Å; A231-I233 VanDerWaalsContact C-N 3.31Å; A231-I233 PolarHBondContact O-N 3.25Å; A231-L234 PolarHBondContact O-N 2.89Å; A231-E235 WeakPolarHBondContact O-CG 3.36Å; A231-E235 PolarHBondContact O-N 3.29Å |
| 232 | Q | 98.6 | Very high | 98 | Very high | 83 Ų | 83 | 64.2 Ų | 64.2 | 39% | 0.388 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -62.4 | -38.5 | 177.3 | -71 | 172.2 | -42 | 0 | 0 | 112.2 | L197 F228 S229 M236 | L197-Q232 HydrophobicContact CD1-CB 4.49Å; L197-Q232 HydrophobicContact CD2-CB 4.33Å; F228-Q232 HydrophobicContact CB-CB 4.5Å; S229-Q232 PolarHBondContact O-N 2.8Å; S229-Q232 VanDerWaalsContact O-N 3.08Å; S229-Q232 WeakPolarHBondContact OG-CG 3.26Å; S229-Q232 PolarHBondContact OG-N 3.27Å; Q232-M236 WeakPolarHBondContact O-CB 3.36Å; Q232-M236 PolarHBondContact O-N 3.32Å |
| 233 | I | 98.8 | Very high | 98.1 | Very high | 0 Ų | 0 | 63.3 Ų | 63.3 | 0% | 0 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -64.2 | -45.6 | 176 | -64.5 | 170.4 | 0 | 0 | 0 | 110.5 | L197 V200 L204 V217 F220 A221 F228 S229 K230 A231 M236 E237 | L197-I233 HydrophobicContact CD1-CB 4.41Å; L197-I233 HydrophobicContact CD1-CG1 3.77Å; V200-I233 HydrophobicContact CG2-CG1 4.39Å; L204-I233 HydrophobicContact CD2-CG2 3.83Å; V217-I233 HydrophobicContact CG1-CB 4.18Å; V217-I233 HydrophobicContact CG1-CG2 4.05Å; F220-I233 HydrophobicContact CB-CD1 4.09Å; A221-I233 HydrophobicContact CB-CD1 4.02Å; F228-I233 HydrophobicContact CB-CG1 4.24Å; S229-I233 PolarHBondContact O-N 3.45Å; S229-I233 VanDerWaalsContact O-N 3.09Å; K230-I233 PolarHBondContact O-N 2.89Å; A231-I233 VanDerWaalsContact C-N 3.31Å; A231-I233 PolarHBondContact O-N 3.25Å; I233-M236 PolarHBondContact O-N 2.86Å; I233-E237 WeakPolarHBondContact O-CB 3.41Å; I233-E237 PolarHBondContact O-N 3.41Å |
| 234 | L | 98.8 | Very high | 98.1 | Very high | 64 Ų | 64 | 62.7 Ų | 62.7 | 34% | 0.335 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -65.6 | -39.4 | 177.9 | -71.2 | 171.2 | 0 | 0 | 0 | 112.6 | V217 K230 A231 M236 E237 Q238 | V217-L234 HydrophobicContact CG1-CG 4.24Å; V217-L234 HydrophobicContact CG2-CD2 4.03Å; K230-L234 VanDerWaalsContact O-CG 3.32Å; K230-L234 WeakPolarHBondContact O-CG 3.45Å; K230-L234 PolarHBondContact O-N 3.48Å; A231-L234 PolarHBondContact O-N 2.89Å; L234-M236 VanDerWaalsContact C-N 3.35Å; L234-E237 PolarHBondContact O-N 2.86Å; L234-Q238 VanDerWaalsContact O-CG 3.31Å; L234-Q238 WeakPolarHBondContact O-CG 3.45Å; L234-Q238 PolarHBondContact O-N 2.98Å |
| 235 | E | 98.8 | Very high | 98.2 | Very high | 125 Ų | 125 | 64.5 Ų | 64.5 | 58% | 0.584 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -62.8 | -42.7 | 174 | -75.4 | 174.5 | -169.1 | 0 | 0 | 111.7 | A231 Q238 L239 | A231-E235 WeakPolarHBondContact O-CG 3.36Å; A231-E235 PolarHBondContact O-N 3.29Å; E235-Q238 PolarHBondContact O-N 3.15Å; E235-L239 PolarHBondContact O-N 3.04Å |
| 236 | M | 98.8 | Very high | 98.3 | Very high | 16 Ų | 16 | 64.8 Ų | 64.8 | 8% | 0.079 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -66.6 | -41.9 | 176.3 | -173.5 | 60.3 | 72.6 | 0 | 0 | 111.7 | F184 L197 V198 A201 Q232 I233 L234 Q238 L239 V240 | F184-M236 HydrophobicContact CE1-SD 4.48Å; F184-M236 HydrophobicContact CZ-SD 4.18Å; L197-M236 HydrophobicContact CD1-CB 4.22Å; L197-M236 HydrophobicContact CD2-CB 4.21Å; L197-M236 HydrophobicContact CD2-CE 3.78Å; L197-M236 HydrophobicContact CG-CB 3.88Å; L197-M236 HydrophobicContact CG-CE 3.98Å; L197-M236 HydrophobicContact CG-CG 4.02Å; V198-M236 HydrophobicContact CG2-CE 3.77Å; V198-M236 HydrophobicContact CG2-CG 4.28Å; V198-M236 HydrophobicContact CG2-SD 3.66Å; A201-M236 HydrophobicContact CB-CB 3.85Å; A201-M236 HydrophobicContact CB-CG 3.53Å; Q232-M236 WeakPolarHBondContact O-CB 3.36Å; Q232-M236 PolarHBondContact O-N 3.32Å; I233-M236 PolarHBondContact O-N 2.86Å; L234-M236 VanDerWaalsContact C-N 3.35Å; M236-Q238 VanDerWaalsContact C-N 3.34Å; M236-Q238 PolarHBondContact O-N 3.46Å; M236-L239 WeakPolarHBondContact O-CB 3.48Å; M236-L239 PolarHBondContact O-N 3.4Å; M236-L239 VanDerWaalsContact O-N 3.12Å; M236-L239 HydrophobicContact SD-CB 4.49Å; M236-L239 HydrophobicContact SD-CD2 4.09Å; M236-V240 HydrophobicContact CG-CG2 4.41Å; M236-V240 WeakPolarHBondContact O-CG2 3.43Å; M236-V240 PolarHBondContact O-N 3.47Å |
| 237 | E | 98.8 | Very high | 98.4 | Very high | 18 Ų | 18 | 64.4 Ų | 64.4 | 8% | 0.084 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -54.2 | -50.1 | 173.1 | 167 | 177.1 | -108.7 | 0 | 0 | 111.1 | V205 K208 I233 L234 L239 V240 L241 | V205-E237 HydrophobicContact CG2-CG 3.86Å; K208-E237 WeakPolarHBondContact CD-OE1 3.46Å; K208-E237 WeakPolarHBondContact CE-OE1 3.41Å; K208-E237 IonicContact NZ-OE1 2.72Å; K208-E237 PolarHBondContact NZ-OE1 3.37Å; K208-E237 IonicContact NZ-OE2 3.87Å; K208-E237 PolarHBondContact NZ-OE2 3.26Å; I233-E237 WeakPolarHBondContact O-CB 3.41Å; I233-E237 PolarHBondContact O-N 3.41Å; L234-E237 PolarHBondContact O-N 2.86Å; E237-L239 VanDerWaalsContact C-N 3.27Å; E237-L239 PolarHBondContact O-N 3.3Å; E237-V240 PolarHBondContact O-N 2.95Å; E237-L241 HydrophobicContact CG-CD1 4Å; E237-L241 WeakPolarHBondContact O-CG 3.41Å; E237-L241 PolarHBondContact O-N 3.3Å |
| 238 | Q | 98.8 | Very high | 98.4 | Very high | 108 Ų | 108 | 63.8 Ų | 63.8 | 51% | 0.505 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -61.8 | -35.6 | 177.7 | -71 | 173.8 | 1.8 | 0 | 0 | 112.4 | L234 E235 M236 R242 | L234-Q238 VanDerWaalsContact O-CG 3.31Å; L234-Q238 WeakPolarHBondContact O-CG 3.45Å; L234-Q238 PolarHBondContact O-N 2.98Å; E235-Q238 PolarHBondContact O-N 3.15Å; M236-Q238 VanDerWaalsContact C-N 3.34Å; M236-Q238 PolarHBondContact O-N 3.46Å; Q238-R242 WeakPolarHBondContact O-CB 3.43Å; Q238-R242 VanDerWaalsContact O-CG 3.25Å; Q238-R242 WeakPolarHBondContact O-CG 3.39Å; Q238-R242 PolarHBondContact O-N 3.38Å; Q238-R242 VanDerWaalsContact O-N 3.15Å; Q238-R242 PolarHBondContact O-NE 2.96Å |
| 239 | L | 98.8 | Very high | 98.3 | Very high | 48 Ų | 48 | 64.3 Ų | 64.3 | 25% | 0.251 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -67.7 | -46 | 175.6 | -178.3 | 61.1 | 0 | 0 | 0 | 111.1 | F184 E235 M236 E237 L241 R242 R243 | F184-L239 HydrophobicContact CE2-CG 4.11Å; F184-L239 HydrophobicContact CZ-CD2 4.13Å; F184-L239 HydrophobicContact CZ-CG 4.1Å; E235-L239 PolarHBondContact O-N 3.04Å; M236-L239 WeakPolarHBondContact O-CB 3.48Å; M236-L239 PolarHBondContact O-N 3.4Å; M236-L239 VanDerWaalsContact O-N 3.12Å; M236-L239 HydrophobicContact SD-CB 4.49Å; M236-L239 HydrophobicContact SD-CD2 4.09Å; E237-L239 VanDerWaalsContact C-N 3.27Å; E237-L239 PolarHBondContact O-N 3.3Å; L239-L241 PolarHBondContact O-N 3.36Å; L239-R242 PolarHBondContact O-N 3.18Å; L239-R243 HydrophobicContact CD1-CG 3.9Å; L239-R243 HydrophobicContact CG-CG 4.29Å; L239-R243 WeakPolarHBondContact O-CB 3.35Å; L239-R243 VanDerWaalsContact O-CG 3.29Å; L239-R243 WeakPolarHBondContact O-CG 3.37Å; L239-R243 PolarHBondContact O-N 3.45Å |
| 240 | V | 98.9 | Very high | 98.2 | Very high | 0 Ų | 0 | 62.8 Ų | 62.8 | 0% | 0 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -56.1 | -52.4 | 176.8 | 169.9 | 0 | 0 | 0 | 0 | 110.6 | V180 F184 M236 E237 R242 R243 L244 | V180-V240 HydrophobicContact CG1-CG1 3.51Å; F184-V240 HydrophobicContact CD1-CG2 4.34Å; F184-V240 HydrophobicContact CD2-CB 4.17Å; F184-V240 HydrophobicContact CD2-CG1 4.39Å; F184-V240 HydrophobicContact CD2-CG2 3.84Å; F184-V240 HydrophobicContact CE1-CG2 4.31Å; F184-V240 HydrophobicContact CE2-CB 4.27Å; F184-V240 HydrophobicContact CE2-CG2 3.8Å; F184-V240 HydrophobicContact CG-CG2 4.08Å; F184-V240 HydrophobicContact CZ-CG2 4.01Å; M236-V240 HydrophobicContact CG-CG2 4.41Å; M236-V240 WeakPolarHBondContact O-CG2 3.43Å; M236-V240 PolarHBondContact O-N 3.47Å; E237-V240 PolarHBondContact O-N 2.95Å; V240-R242 PolarHBondContact O-N 2.95Å; V240-R243 PolarHBondContact O-N 2.88Å; V240-L244 HydrophobicContact CG1-CD1 4.05Å; V240-L244 WeakPolarHBondContact O-CG 3.4Å; V240-L244 PolarHBondContact O-N 3.3Å |
| 241 | L | 98.8 | Very high | 98.1 | Very high | 30 Ų | 30 | 57.4 Ų | 57.4 | 16% | 0.157 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -59.4 | -44.1 | -179.7 | -69.9 | 170.6 | 0 | 0 | 0 | 112.4 | V205 E237 L239 L244 G245 F246 L248 | V205-L241 HydrophobicContact CG1-CD2 4.01Å; V205-L241 HydrophobicContact CG2-CD2 4.24Å; V205-L241 HydrophobicContact CG2-CG 4.24Å; E237-L241 HydrophobicContact CG-CD1 4Å; E237-L241 WeakPolarHBondContact O-CG 3.41Å; E237-L241 PolarHBondContact O-N 3.3Å; L239-L241 PolarHBondContact O-N 3.36Å; L241-L244 PolarHBondContact O-N 3.11Å; L241-G245 PolarHBondContact O-N 2.94Å; L241-G245 VanDerWaalsContact O-N 3.09Å; L241-F246 HydrophobicContact CB-CD1 4.11Å; L241-F246 HydrophobicContact CB-CE1 3.78Å; L241-F246 HydrophobicContact CB-CE2 4.4Å; L241-F246 HydrophobicContact CB-CZ 3.94Å; L241-F246 HydrophobicContact CD1-CE1 3.98Å; L241-F246 HydrophobicContact CD2-CD1 4.15Å; L241-F246 HydrophobicContact CD2-CE1 4.37Å; L241-F246 HydrophobicContact CG-CE1 4.27Å; L241-F246 PolarHBondContact O-N 3.4Å; L241-L248 HydrophobicContact CD2-CD1 3.97Å; L241-L248 HydrophobicContact CD2-CD2 4.4Å |
| 242 | R | 98.6 | Very high | 98.1 | Very high | 157 Ų | 157 | 55 Ų | 55 | 59% | 0.592 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -65.2 | -44.9 | 178.3 | -76.5 | -178.6 | -68.3 | 152.9 | -6.7 | 112.4 | Q238 L239 V240 L244 G245 | Q238-R242 WeakPolarHBondContact O-CB 3.43Å; Q238-R242 VanDerWaalsContact O-CG 3.25Å; Q238-R242 WeakPolarHBondContact O-CG 3.39Å; Q238-R242 PolarHBondContact O-N 3.38Å; Q238-R242 VanDerWaalsContact O-N 3.15Å; Q238-R242 PolarHBondContact O-NE 2.96Å; L239-R242 PolarHBondContact O-N 3.18Å; V240-R242 PolarHBondContact O-N 2.95Å; R242-L244 VanDerWaalsContact C-N 3.25Å; R242-L244 PolarHBondContact O-N 2.95Å; R242-G245 PolarHBondContact O-N 3.19Å; R242-G245 VanDerWaalsContact O-N 3.14Å |
| 243 | R | 98.6 | Very high | 98 | Very high | 122 Ų | 122 | 51.6 Ų | 51.6 | 46% | 0.46 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -67.7 | -27.2 | -179.7 | -66.5 | -58.5 | -68.9 | -168.7 | -5.4 | 112.6 | F184 V187 Q188 L239 V240 | F184-R243 HydrophobicContact CD2-CB 3.89Å; F184-R243 HydrophobicContact CD2-CG 4.32Å; F184-R243 HydrophobicContact CE2-CB 3.87Å; F184-R243 HydrophobicContact CE2-CG 3.79Å; V187-R243 HydrophobicContact CG2-CB 4.23Å; V187-R243 PolarHBondContact O-NH2 2.98Å; Q188-R243 HydrophobicContact CB-CG 4.46Å; Q188-R243 VanDerWaalsContact OE1-NE 3.15Å; L239-R243 HydrophobicContact CD1-CG 3.9Å; L239-R243 HydrophobicContact CG-CG 4.29Å; L239-R243 WeakPolarHBondContact O-CB 3.35Å; L239-R243 VanDerWaalsContact O-CG 3.29Å; L239-R243 WeakPolarHBondContact O-CG 3.37Å; L239-R243 PolarHBondContact O-N 3.45Å; V240-R243 PolarHBondContact O-N 2.88Å |
| 244 | L | 98.3 | Very high | 98 | Very high | 11 Ų | 11 | 51.9 Ų | 51.9 | 6% | 0.058 | 25% | 0.254 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -91.1 | 0.8 | 174.6 | -61 | -174.8 | 0 | 0 | 0 | 113.7 | V180 R183 F184 V240 L241 R242 F246 Q247 L248 | V180-L244 HydrophobicContact CB-CD1 4.45Å; V180-L244 HydrophobicContact CG1-CD1 3.88Å; R183-L244 HydrophobicContact CB-CD2 3.75Å; F184-L244 HydrophobicContact CB-CD2 4.49Å; V240-L244 HydrophobicContact CG1-CD1 4.05Å; V240-L244 WeakPolarHBondContact O-CG 3.4Å; V240-L244 PolarHBondContact O-N 3.3Å; L241-L244 PolarHBondContact O-N 3.11Å; R242-L244 VanDerWaalsContact C-N 3.25Å; R242-L244 PolarHBondContact O-N 2.95Å; L244-F246 PolarHBondContact O-N 3.15Å; L244-Q247 WeakPolarHBondContact O-CB 3.28Å; L244-Q247 PolarHBondContact O-N 3.43Å; L244-Q247 VanDerWaalsContact O-N 3.08Å; L244-L248 HydrophobicContact CD1-CD2 4.39Å |
| 245 | G | 98 | Very high | 97.9 | Very high | 43 Ų | 43 | 51.4 Ų | 51.4 | 44% | 0.443 | 25% | 0.25 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 57.3 | 32.1 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | L241 R242 Q247 | L241-G245 PolarHBondContact O-N 2.94Å; L241-G245 VanDerWaalsContact O-N 3.09Å; R242-G245 PolarHBondContact O-N 3.19Å; R242-G245 VanDerWaalsContact O-N 3.14Å; G245-Q247 PolarHBondContact O-N 3.19Å |
| 246 | F | 98.3 | Very high | 97.9 | Very high | 141 Ų | 141 | 46 Ų | 46 | 62% | 0.618 | 22% | 0.224 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 57.2 | 14.2 | -174.8 | -64.6 | -99.1 | 0 | 0 | 0 | 115.2 | L241 L244 L248 | L241-F246 HydrophobicContact CB-CD1 4.11Å; L241-F246 HydrophobicContact CB-CE1 3.78Å; L241-F246 HydrophobicContact CB-CE2 4.4Å; L241-F246 HydrophobicContact CB-CZ 3.94Å; L241-F246 HydrophobicContact CD1-CE1 3.98Å; L241-F246 HydrophobicContact CD2-CD1 4.15Å; L241-F246 HydrophobicContact CD2-CE1 4.37Å; L241-F246 HydrophobicContact CG-CE1 4.27Å; L241-F246 PolarHBondContact O-N 3.4Å; L244-F246 PolarHBondContact O-N 3.15Å; F246-L248 PolarHBondContact O-N 3.26Å; F246-L248 VanDerWaalsContact O-N 3.09Å |
| 247 | Q | 97.3 | Very high | 97.9 | Very high | 106 Ų | 106 | 45.2 Ų | 45.2 | 50% | 0.495 | 22% | 0.221 | S | C | . | . | trans | -83.1 | 87.7 | 178.3 | -65.9 | 171.1 | 42.1 | 0 | 0 | 109.6 | R183 L244 G245 | R183-Q247 PolarHBondContact NH1-O 3.47Å; R183-Q247 PolarHBondContact NH2-O 3.43Å; L244-Q247 WeakPolarHBondContact O-CB 3.28Å; L244-Q247 PolarHBondContact O-N 3.43Å; L244-Q247 VanDerWaalsContact O-N 3.08Å; G245-Q247 PolarHBondContact O-N 3.19Å | ||
| 248 | L | 97.2 | Very high | 97.8 | Very high | 19 Ų | 19 | 50.1 Ų | 50.1 | 10% | 0.099 | 24% | 0.238 | C | C | . | . | trans | -98.7 | -8.5 | -179.4 | -59.1 | 178.5 | 0 | 0 | 0 | 113.8 | V180 V205 Y209 L241 L244 F246 R250 | V180-L248 HydrophobicContact CG2-CD2 3.98Å; V205-L248 HydrophobicContact CG1-CD1 3.62Å; V205-L248 HydrophobicContact CG1-CD2 3.87Å; V205-L248 HydrophobicContact CG1-CG 4.42Å; Y209-L248 HydrophobicContact CD2-CB 4.13Å; Y209-L248 HydrophobicContact CD2-CD1 3.92Å; Y209-L248 HydrophobicContact CE2-CB 4.01Å; Y209-L248 HydrophobicContact CE2-CD1 4.48Å; L241-L248 HydrophobicContact CD2-CD1 3.97Å; L241-L248 HydrophobicContact CD2-CD2 4.4Å; L244-L248 HydrophobicContact CD1-CD2 4.39Å; F246-L248 PolarHBondContact O-N 3.26Å; F246-L248 VanDerWaalsContact O-N 3.09Å; L248-R250 PolarHBondContact O-N 2.94Å | ||
| 249 | G | 94.2 | Very high | 97.7 | Very high | 32 Ų | 32 | 46.1 Ų | 46.1 | 33% | 0.33 | 22% | 0.219 | S | C | . | . | trans | -75.2 | 27.3 | -173.4 | 0 | 0 | 0 | 0 | 0 | 116.4 | L132 | L132-G249 WeakPolarHBondContact CD1-O 3.49Š| ||
| 250 | R | 95.8 | Very high | 97.6 | Very high | 26 Ų | 26 | 44.5 Ų | 44.5 | 10% | 0.098 | 21% | 0.212 | C | C | . | . | P | Polyproline II helix | trans | -63 | 128.3 | 175.4 | -175.4 | 176 | 178.6 | -109 | 5.4 | 107.7 | Q136 L248 | Q136-R250 HydrophobicContact CB-CB 4.11Å; Q136-R250 HydrophobicContact CB-CG 4.07Å; Q136-R250 WeakPolarHBondContact O-CD 3.41Å; Q136-R250 PolarHBondContact O-NE 3.34Å; L248-R250 PolarHBondContact O-N 2.94Å |
| 251 | P | 97.4 | Very high | 97.4 | Very high | 3 Ų | 3 | 45 Ų | 45 | 2% | 0.019 | 22% | 0.216 | C | C | . | . | P | Polyproline II helix | trans | -62.5 | 142.8 | 177.8 | 30.6 | -40.6 | 0 | 0 | 0 | 110.6 | L129 L132 E133 F256 P292 | L129-P251 HydrophobicContact CB-CB 4.06Å; L129-P251 HydrophobicContact CD2-CB 4.06Å; L129-P251 HydrophobicContact CG-CB 4.44Å; L129-P251 WeakPolarHBondContact O-CG 3.34Å; L132-P251 HydrophobicContact CB-CG 4.33Å; E133-P251 HydrophobicContact CB-CG 3.62Å; P251-F256 HydrophobicContact CB-CE2 3.8Å; P251-F256 HydrophobicContact CB-CZ 4.24Å; P251-F256 HydrophobicContact CG-CE2 4.09Å; P251-F256 HydrophobicContact CG-CZ 4.41Å; P251-P292 VanDerWaalsContact O-CG 3.27Å; P251-P292 WeakPolarHBondContact O-CG 3.49Å |
| 252 | L | 97.9 | Very high | 97.2 | Very high | 2 Ų | 2 | 47.1 Ų | 47.1 | 1% | 0.01 | 22% | 0.224 | C | C | . | . | P | Polyproline II helix | trans | -92.7 | 148.6 | 177.8 | -51.8 | -178.5 | 0 | 0 | 0 | 111 | E172 L176 L254 H255 | E172-L252 HydrophobicContact CB-CD1 3.77Å; E172-L252 HydrophobicContact CG-CD1 4.05Å; E172-L252 WeakPolarHBondContact O-CD1 3.44Å; L176-L252 HydrophobicContact CB-CD1 4.41Å; L176-L252 HydrophobicContact CB-CD2 4.1Å; L176-L252 HydrophobicContact CD1-CD2 4.47Å; L252-L254 PolarHBondContact O-N 3.18Å; L252-H255 PolarHBondContact N-CD2 2.94Å; L252-H255 VanDerWaalsContact N-CD2 3.34Å; L252-H255 PolarHBondContact O-CD2 3.29Å; L252-H255 PolarHBondContact O-N 2.98Å; L252-H255 VanDerWaalsContact O-N 3.07Å |
| 253 | P | 98.3 | Very high | 97 | Very high | 12 Ų | 12 | 40.4 Ų | 40.4 | 8% | 0.078 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -54.2 | -29.6 | 176.5 | -27.5 | 35.2 | 0 | 0 | 0 | 113.4 | Y175 H255 F256 L257 M278 P292 A296 | Y175-P253 HydrophobicContact CD1-CB 4.43Å; Y175-P253 HydrophobicContact CD1-CG 3.77Å; Y175-P253 HydrophobicContact CE1-CB 4.22Å; Y175-P253 HydrophobicContact CE1-CG 3.89Å; P253-H255 VanDerWaalsContact C-N 3.33Å; P253-H255 PolarHBondContact O-N 2.97Å; P253-F256 PolarHBondContact O-N 3.23Å; P253-L257 PolarHBondContact O-N 3.08Å; P253-M278 HydrophobicContact CB-CE 3.99Å; P253-M278 HydrophobicContact CB-CG 3.88Å; P253-M278 HydrophobicContact CB-SD 3.27Å; P253-M278 WeakPolarHBondContact CB-SD 3.4Å; P253-P292 HydrophobicContact CB-CB 4.41Å; P253-P292 HydrophobicContact CG-CB 3.9Å; P253-A296 WeakPolarHBondContact O-CB 3.33Å |
| 254 | L | 97.9 | Very high | 96.7 | Very high | 7 Ų | 7 | 35.7 Ų | 35.7 | 4% | 0.037 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -58.1 | -38.2 | 177.3 | -68 | 167 | 0 | 0 | 0 | 113.8 | Q171 E172 Y175 L252 F256 L257 R258 M278 | Q171-L254 HydrophobicContact CB-CD1 3.92Å; Q171-L254 HydrophobicContact CG-CD1 3.79Å; Q171-L254 HydrophobicContact CG-CD2 3.99Å; Q171-L254 HydrophobicContact CG-CG 4.42Å; E172-L254 HydrophobicContact CB-CD1 4.43Å; E172-L254 HydrophobicContact CG-CD1 3.87Å; Y175-L254 HydrophobicContact CD2-CD1 3.74Å; Y175-L254 HydrophobicContact CD2-CG 3.89Å; Y175-L254 HydrophobicContact CE2-CD1 4.17Å; Y175-L254 HydrophobicContact CE2-CD2 4.13Å; Y175-L254 HydrophobicContact CE2-CG 3.95Å; L252-L254 PolarHBondContact O-N 3.18Å; L254-F256 VanDerWaalsContact C-N 3.33Å; L254-F256 PolarHBondContact O-N 3.16Å; L254-L257 PolarHBondContact O-N 3.43Å; L254-R258 WeakPolarHBondContact O-CG 3.44Å; L254-R258 PolarHBondContact O-N 3.11Å; L254-M278 HydrophobicContact CD2-CE 3.65Å; L254-M278 HydrophobicContact CG-CE 4.08Å |
| 255 | H | 97.1 | Very high | 96.4 | Very high | 54 Ų | 54 | 42.4 Ų | 42.4 | 25% | 0.25 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -65 | -41.9 | 179.7 | -55.9 | -58.1 | 0 | 0 | 0 | 110.9 | Y126 L129 L252 P253 R259 | Y126-H255 WeakPolarHBondContact CE1-O 3.48Å; Y126-H255 PolarHBondContact OH-O 3.23Å; L129-H255 HydrophobicContact CD1-CB 3.92Å; L252-H255 PolarHBondContact N-CD2 2.94Å; L252-H255 VanDerWaalsContact N-CD2 3.34Å; L252-H255 PolarHBondContact O-CD2 3.29Å; L252-H255 PolarHBondContact O-N 2.98Å; L252-H255 VanDerWaalsContact O-N 3.07Å; P253-H255 VanDerWaalsContact C-N 3.33Å; P253-H255 PolarHBondContact O-N 2.97Å; H255-R259 PolarHBondContact O-N 2.75Å |
| 256 | F | 98.5 | Very high | 96.1 | Very high | 11 Ų | 11 | 41.5 Ų | 41.5 | 5% | 0.048 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -71.1 | -37 | 177.2 | -63.7 | -71.5 | 0 | 0 | 0 | 112 | Y126 L129 R130 E133 P251 P253 L254 R259 A260 P292 A296 | Y126-F256 AromaticContact CD1-CD1 3.91Å; Y126-F256 HydrophobicContact CD1-CD1 3.91Å; Y126-F256 HydrophobicContact CD1-CE1 4.01Å; Y126-F256 HydrophobicContact CE1-CD1 4.07Å; Y126-F256 HydrophobicContact CE1-CE1 4.5Å; L129-F256 HydrophobicContact CB-CE1 4.12Å; L129-F256 HydrophobicContact CB-CZ 3.71Å; R130-F256 HydrophobicContact CG-CE1 4.11Å; E133-F256 WeakPolarHBondContact OE2-CE2 3.28Å; P251-F256 HydrophobicContact CB-CE2 3.8Å; P251-F256 HydrophobicContact CB-CZ 4.24Å; P251-F256 HydrophobicContact CG-CE2 4.09Å; P251-F256 HydrophobicContact CG-CZ 4.41Å; P253-F256 PolarHBondContact O-N 3.23Å; L254-F256 VanDerWaalsContact C-N 3.33Å; L254-F256 PolarHBondContact O-N 3.16Å; F256-R259 PolarHBondContact O-N 3.37Å; F256-A260 WeakPolarHBondContact O-CB 3.42Å; F256-A260 PolarHBondContact O-N 3.44Å; F256-P292 HydrophobicContact CD2-CB 3.92Å; F256-P292 HydrophobicContact CE2-CB 3.88Å; F256-A296 HydrophobicContact CB-CB 3.56Å |
| 257 | L | 98.4 | Very high | 95.9 | Very high | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -65 | -41.8 | 176.9 | -178.7 | 60.2 | 0 | 0 | 0 | 111.6 | P253 L254 R259 A260 S261 A274 K275 M278 A296 L300 | P253-L257 PolarHBondContact O-N 3.08Å; L254-L257 PolarHBondContact O-N 3.43Å; L257-R259 VanDerWaalsContact C-N 3.31Å; L257-R259 PolarHBondContact O-N 2.76Å; L257-A260 PolarHBondContact O-N 3.39Å; L257-S261 WeakPolarHBondContact O-CB 3.35Å; L257-S261 PolarHBondContact O-N 2.9Å; L257-S261 PolarHBondContact O-OG 3.29Å; L257-A274 HydrophobicContact CD1-CB 3.71Å; L257-A274 HydrophobicContact CD2-CB 4.2Å; L257-K275 HydrophobicContact CD2-CB 4.44Å; L257-K275 HydrophobicContact CD2-CG 3.55Å; L257-M278 HydrophobicContact CB-CE 4.27Å; L257-M278 HydrophobicContact CB-SD 4.2Å; L257-M278 HydrophobicContact CD2-CE 3.65Å; L257-M278 HydrophobicContact CD2-SD 4.08Å; L257-A296 HydrophobicContact CB-CB 4.07Å; L257-L300 HydrophobicContact CD1-CB 3.99Å; L257-L300 HydrophobicContact CD1-CD1 4.41Å |
| 258 | R | 96.6 | Very high | 95.9 | Very high | 121 Ų | 121 | 38 Ų | 38 | 46% | 0.457 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -56.7 | -45.8 | 174.3 | -74.9 | 174.2 | 179.3 | 133.1 | 6.6 | 111.5 | E172 L254 K262 | E172-R258 IonicContact OE1-CZ 3.93Å; E172-R258 VanDerWaalsContact OE1-CZ 3.24Å; E172-R258 IonicContact OE1-NH1 3.06Å; E172-R258 PolarHBondContact OE1-NH1 3.26Å; E172-R258 IonicContact OE1-NH2 3.92Å; E172-R258 PolarHBondContact OE1-NH2 3.39Å; L254-R258 WeakPolarHBondContact O-CG 3.44Å; L254-R258 PolarHBondContact O-N 3.11Å; R258-K262 PolarHBondContact O-N 2.65Å; R258-K262 VanDerWaalsContact O-N 3.09Å |
| 259 | R | 96 | Very high | 95.8 | Very high | 24 Ų | 24 | 40.6 Ų | 40.6 | 9% | 0.091 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -61.8 | -50.2 | 176 | -175.1 | 59.3 | -178.4 | 179.7 | 4.2 | 112.1 | D108 V122 Y126 H255 F256 L257 S261 K262 V263 Y319 | D108-R259 IonicContact OD1-CZ 2.78Å; D108-R259 IonicContact OD1-NH1 2.73Å; D108-R259 PolarHBondContact OD1-NH1 3.5Å; D108-R259 IonicContact OD1-NH2 3.21Å; D108-R259 IonicContact OD2-CZ 3.7Å; D108-R259 IonicContact OD2-NH1 3.63Å; D108-R259 PolarHBondContact OD2-NH1 3.46Å; D108-R259 IonicContact OD2-NH2 2.79Å; D108-R259 PolarHBondContact OD2-NH2 2.81Å; V122-R259 VanDerWaalsContact CG2-NH1 3.33Å; Y126-R259 HydrophobicContact CD1-CB 4.31Å; Y126-R259 HydrophobicContact CD1-CG 4.31Å; Y126-R259 HydrophobicContact CD2-CG 4.28Å; Y126-R259 HydrophobicContact CE1-CB 3.56Å; Y126-R259 HydrophobicContact CE1-CG 4.02Å; Y126-R259 HydrophobicContact CE2-CB 4.02Å; Y126-R259 HydrophobicContact CE2-CG 4.02Å; Y126-R259 HydrophobicContact CG-CG 4.46Å; Y126-R259 VanDerWaalsContact CZ-CB 3.43Å; Y126-R259 WeakPolarHBondContact OH-CB 3.32Å; H255-R259 PolarHBondContact O-N 2.75Å; F256-R259 PolarHBondContact O-N 3.37Å; L257-R259 VanDerWaalsContact C-N 3.31Å; L257-R259 PolarHBondContact O-N 2.76Å; R259-S261 VanDerWaalsContact C-N 3.31Å; R259-S261 PolarHBondContact O-N 3.33Å; R259-K262 PolarHBondContact O-N 3.04Å; R259-V263 HydrophobicContact CG-CG2 4.41Å; R259-V263 VanDerWaalsContact O-CG2 3.28Å; R259-V263 WeakPolarHBondContact O-CG2 3.41Å; R259-V263 PolarHBondContact O-N 3Å; R259-Y319 VanDerWaalsContact NH2-CD1 3.3Å |
| 260 | A | 96.5 | Very high | 96 | Very high | 14 Ų | 14 | 40.1 Ų | 40.1 | 12% | 0.116 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -62.4 | -41 | -176.9 | 0 | 0 | 0 | 0 | 0 | 111 | F256 L257 V263 A264 L300 | F256-A260 WeakPolarHBondContact O-CB 3.42Å; F256-A260 PolarHBondContact O-N 3.44Å; L257-A260 PolarHBondContact O-N 3.39Å; A260-V263 PolarHBondContact O-N 2.97Å; A260-A264 WeakPolarHBondContact O-CB 3.43Å; A260-A264 PolarHBondContact O-N 3.42Å; A260-L300 HydrophobicContact CB-CD2 3.48Å; A260-L300 VanDerWaalsContact CB-CD2 3.48Å; A260-L300 WeakPolarHBondContact O-CD2 3.42Å |
| 261 | S | 96.5 | Very high | 96.1 | Very high | 10 Ų | 10 | 41.1 Ų | 41.1 | 7% | 0.07 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -64.9 | -38.3 | 176 | -68.9 | 0 | 0 | 0 | 0 | 113 | L257 R259 A264 N265 T266 H271 | L257-S261 WeakPolarHBondContact O-CB 3.35Å; L257-S261 PolarHBondContact O-N 2.9Å; L257-S261 PolarHBondContact O-OG 3.29Å; R259-S261 VanDerWaalsContact C-N 3.31Å; R259-S261 PolarHBondContact O-N 3.33Å; S261-A264 PolarHBondContact O-N 3.43Å; S261-N265 PolarHBondContact O-N 2.89Å; S261-N265 VanDerWaalsContact O-N 3.13Å; S261-T266 WeakPolarHBondContact O-CB 3.38Å; S261-T266 PolarHBondContact O-N 2.85Å; S261-T266 PolarHBondContact O-OG1 3.07Å; S261-H271 WeakPolarHBondContact CB-ND1 3.3Å; S261-H271 PolarHBondContact OG-ND1 3.34Å |
| 262 | K | 94.3 | Very high | 96.1 | Very high | 75 Ų | 75 | 41.6 Ų | 41.6 | 33% | 0.326 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -63.2 | -51.3 | 173.8 | -175.9 | -178 | -178.9 | -171.1 | 0 | 111.4 | V107 D108 D111 R258 R259 A264 N265 | V107-K262 WeakPolarHBondContact O-CE 3.32Å; D108-K262 IonicContact OD1-NZ 2.49Å; D108-K262 PolarHBondContact OD1-NZ 3.43Å; D111-K262 IonicContact OD1-NZ 2.64Å; D111-K262 PolarHBondContact OD1-NZ 3.32Å; D111-K262 IonicContact OD2-NZ 2.95Å; D111-K262 PolarHBondContact OD2-NZ 2.98Å; R258-K262 PolarHBondContact O-N 2.65Å; R258-K262 VanDerWaalsContact O-N 3.09Å; R259-K262 PolarHBondContact O-N 3.04Å; K262-A264 PolarHBondContact O-N 3.02Å; K262-N265 PolarHBondContact O-N 3.32Å |
| 263 | V | 93.8 | Very high | 96.1 | Very high | 15 Ų | 15 | 41.5 Ų | 41.5 | 9% | 0.091 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -55.7 | -39.8 | 178.7 | 170.6 | 0 | 0 | 0 | 0 | 111.4 | V107 R259 A260 N265 T315 Q316 Y319 | V107-V263 HydrophobicContact CG1-CB 4.45Å; V107-V263 HydrophobicContact CG1-CG1 4.39Å; V107-V263 HydrophobicContact CG1-CG2 4.35Å; V107-V263 HydrophobicContact CG2-CG2 4.01Å; R259-V263 HydrophobicContact CG-CG2 4.41Å; R259-V263 VanDerWaalsContact O-CG2 3.28Å; R259-V263 WeakPolarHBondContact O-CG2 3.41Å; R259-V263 PolarHBondContact O-N 3Å; A260-V263 PolarHBondContact O-N 2.97Å; V263-N265 VanDerWaalsContact C-N 3.31Å; V263-N265 PolarHBondContact O-N 2.96Å; V263-T315 HydrophobicContact CG1-CG2 3.98Å; V263-Q316 HydrophobicContact CG1-CG 4.17Å; V263-Y319 HydrophobicContact CB-CD2 4.45Å; V263-Y319 HydrophobicContact CG1-CD2 3.67Å; V263-Y319 HydrophobicContact CG1-CE2 4.49Å; V263-Y319 HydrophobicContact CG1-CG 4.17Å; V263-Y319 HydrophobicContact CG2-CD1 4.29Å; V263-Y319 HydrophobicContact CG2-CD2 3.85Å; V263-Y319 HydrophobicContact CG2-CG 3.69Å |
| 264 | A | 93.1 | Very high | 96.1 | Very high | 24 Ų | 24 | 41 Ų | 41 | 20% | 0.198 | 21% | 0.209 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -85.6 | 1.5 | -178.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | A260 S261 K262 T266 L300 Q316 | A260-A264 WeakPolarHBondContact O-CB 3.43Å; A260-A264 PolarHBondContact O-N 3.42Å; S261-A264 PolarHBondContact O-N 3.43Å; K262-A264 PolarHBondContact O-N 3.02Å; A264-T266 VanDerWaalsContact CB-OG1 3.25Å; A264-T266 WeakPolarHBondContact CB-OG1 3.47Å; A264-T266 PolarHBondContact O-N 3.01Å; A264-L300 HydrophobicContact CB-CD2 4.13Å; A264-Q316 HydrophobicContact CB-CG 4.03Å; A264-Q316 VanDerWaalsContact CB-NE2 3.33Å |
| 265 | N | 92.4 | Very high | 96.2 | Very high | 152 Ų | 152 | 42.9 Ų | 42.9 | 81% | 0.813 | 22% | 0.217 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 44.5 | 48.6 | -171.4 | -166.8 | 29.8 | 0 | 0 | 0 | 112.3 | S261 K262 V263 | S261-N265 PolarHBondContact O-N 2.89Å; S261-N265 VanDerWaalsContact O-N 3.13Å; K262-N265 PolarHBondContact O-N 3.32Å; V263-N265 VanDerWaalsContact C-N 3.31Å; V263-N265 PolarHBondContact O-N 2.96Å |
| 266 | T | 91.4 | Very high | 96.2 | Very high | 23 Ų | 23 | 40.3 Ų | 40.3 | 14% | 0.141 | 21% | 0.205 | C | C | . | . | trans | -78 | 135 | -170.2 | -57.1 | 0 | 0 | 0 | 0 | 111.3 | S261 A264 K270 H271 L300 | S261-T266 WeakPolarHBondContact O-CB 3.38Å; S261-T266 PolarHBondContact O-N 2.85Å; S261-T266 PolarHBondContact O-OG1 3.07Å; A264-T266 VanDerWaalsContact CB-OG1 3.25Å; A264-T266 WeakPolarHBondContact CB-OG1 3.47Å; A264-T266 PolarHBondContact O-N 3.01Å; T266-K270 HydrophobicContact CG2-CB 3.25Å; T266-K270 HydrophobicContact CG2-CD 4.36Å; T266-K270 HydrophobicContact CG2-CG 4.41Å; T266-H271 HydrophobicContact CG2-CB 4.33Å; T266-L300 HydrophobicContact CG2-CD1 3.84Å | ||
| 267 | D | 94.3 | Very high | 96.3 | Very high | 69 Ų | 69 | 39.8 Ų | 39.8 | 37% | 0.369 | 20% | 0.203 | S | C | . | . | trans | -71 | 172.8 | 171.9 | 63.3 | 27.5 | 0 | 0 | 0 | 113.4 | E269 K270 H271 | D267-E269 VanDerWaalsContact C-N 3.29Å; D267-E269 PolarHBondContact O-N 3.48Å; D267-E269 PolarHBondContact OD1-N 2.85Å; D267-K270 WeakPolarHBondContact OD1-CB 3.47Å; D267-K270 WeakPolarHBondContact OD1-CE 3.49Å; D267-K270 PolarHBondContact OD1-N 3.02Å; D267-K270 WeakPolarHBondContact OD2-CE 3.28Å; D267-K270 IonicContact OD2-NZ 3.73Å; D267-K270 PolarHBondContact OD2-NZ 2.72Å; D267-H271 WeakPolarHBondContact O-CB 3.35Å; D267-H271 PolarHBondContact O-N 2.82Å | ||
| 268 | V | 95.9 | Very high | 96.3 | Very high | 104 Ų | 104 | 39.8 Ų | 39.8 | 63% | 0.63 | 20% | 0.203 | S | C | * | . | H | α-helix | trans | -64.4 | -35.7 | -177 | -175.9 | 0 | 0 | 0 | 0 | 111.5 | T272 M361 | V268-T272 VanDerWaalsContact O-CB 3.24Å; V268-T272 WeakPolarHBondContact O-CB 3.32Å; V268-T272 PolarHBondContact O-N 2.91Å; V268-T272 PolarHBondContact O-OG1 3.09Å; V268-M361 HydrophobicContact CG1-CE 3.91Å; V268-M361 HydrophobicContact CG1-SD 4.15Å; V268-M361 WeakPolarHBondContact O-CE 3.3Å |
| 269 | E | 96.4 | Very high | 96.4 | Very high | 74 Ų | 74 | 34 Ų | 34 | 35% | 0.346 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -63.4 | -55.5 | -179.2 | -174.6 | 171.5 | -154 | 0 | 0 | 111.1 | D267 H271 T272 L273 I363 | D267-E269 VanDerWaalsContact C-N 3.29Å; D267-E269 PolarHBondContact O-N 3.48Å; D267-E269 PolarHBondContact OD1-N 2.85Å; E269-H271 PolarHBondContact O-N 3.5Å; E269-T272 PolarHBondContact O-N 3.2Å; E269-L273 WeakPolarHBondContact O-CB 3.41Å; E269-L273 PolarHBondContact O-N 3.29Å; E269-I363 HydrophobicContact CG-CD1 3.81Å |
| 270 | K | 96.8 | Very high | 96.5 | Very high | 22 Ų | 22 | 33.3 Ų | 33.3 | 10% | 0.096 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -62.9 | -40.4 | 177.4 | -75.8 | 172.9 | -74.6 | -162.4 | 0 | 112 | T266 D267 T272 L273 A274 S303 Q304 V307 D308 | T266-K270 HydrophobicContact CG2-CB 3.25Å; T266-K270 HydrophobicContact CG2-CD 4.36Å; T266-K270 HydrophobicContact CG2-CG 4.41Å; D267-K270 WeakPolarHBondContact OD1-CB 3.47Å; D267-K270 WeakPolarHBondContact OD1-CE 3.49Å; D267-K270 PolarHBondContact OD1-N 3.02Å; D267-K270 WeakPolarHBondContact OD2-CE 3.28Å; D267-K270 IonicContact OD2-NZ 3.73Å; D267-K270 PolarHBondContact OD2-NZ 2.72Å; K270-T272 VanDerWaalsContact C-N 3.29Å; K270-T272 PolarHBondContact O-N 2.97Å; K270-L273 PolarHBondContact O-N 2.94Å; K270-A274 WeakPolarHBondContact O-CB 3.28Å; K270-A274 PolarHBondContact O-N 3.34Å; K270-S303 VanDerWaalsContact CA-OG 3.3Å; K270-S303 WeakPolarHBondContact CA-OG 3.42Å; K270-S303 PolarHBondContact O-OG 3.42Å; K270-Q304 HydrophobicContact CD-CG 4.11Å; K270-V307 HydrophobicContact CD-CB 4.25Å; K270-V307 HydrophobicContact CD-CG1 4.35Å; K270-V307 HydrophobicContact CG-CB 3.81Å; K270-V307 HydrophobicContact CG-CG1 4.01Å; K270-V307 HydrophobicContact CG-CG2 3.89Å; K270-D308 VanDerWaalsContact CD-OD2 3.23Å; K270-D308 WeakPolarHBondContact CD-OD2 3.28Å; K270-D308 WeakPolarHBondContact CE-OD2 3.08Å; K270-D308 IonicContact NZ-OD1 3.49Å; K270-D308 IonicContact NZ-OD2 3.54Å; K270-D308 PolarHBondContact NZ-OD2 3.32Å |
| 271 | H | 97.9 | Very high | 96.6 | Very high | 47 Ų | 47 | 33.3 Ų | 33.3 | 22% | 0.218 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -61.3 | -41.2 | 175.5 | -176.7 | 77.1 | 0 | 0 | 0 | 111.7 | S261 T266 D267 E269 A274 K275 | S261-H271 WeakPolarHBondContact CB-ND1 3.3Å; S261-H271 PolarHBondContact OG-ND1 3.34Å; T266-H271 HydrophobicContact CG2-CB 4.33Å; D267-H271 WeakPolarHBondContact O-CB 3.35Å; D267-H271 PolarHBondContact O-N 2.82Å; E269-H271 PolarHBondContact O-N 3.5Å; H271-A274 PolarHBondContact O-N 3.07Å; H271-K275 WeakPolarHBondContact O-CG 3.46Å; H271-K275 PolarHBondContact O-N 2.6Å |
| 272 | T | 98.3 | Very high | 96.7 | Very high | 13 Ų | 13 | 33.4 Ų | 33.4 | 8% | 0.08 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -73.3 | -35.6 | -179.2 | -58.1 | 0 | 0 | 0 | 0 | 112.1 | V268 E269 K270 K275 Y276 M361 I363 | V268-T272 VanDerWaalsContact O-CB 3.24Å; V268-T272 WeakPolarHBondContact O-CB 3.32Å; V268-T272 PolarHBondContact O-N 2.91Å; V268-T272 PolarHBondContact O-OG1 3.09Å; E269-T272 PolarHBondContact O-N 3.2Å; K270-T272 VanDerWaalsContact C-N 3.29Å; K270-T272 PolarHBondContact O-N 2.97Å; T272-K275 WeakPolarHBondContact O-CB 3.22Å; T272-K275 PolarHBondContact O-N 3.34Å; T272-Y276 PolarHBondContact O-N 3.26Å; T272-M361 HydrophobicContact CG2-CE 3.59Å; T272-M361 WeakPolarHBondContact OG1-CE 3.34Å; T272-I363 HydrophobicContact CG2-CB 4.14Å; T272-I363 HydrophobicContact CG2-CG1 4.35Å; T272-I363 HydrophobicContact CG2-CG2 3.99Å |
| 273 | L | 98.5 | Very high | 96.8 | Very high | 1 Ų | 1 | 30.9 Ų | 30.9 | 1% | 0.005 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -66 | -43.9 | 172.8 | 175.2 | 58.1 | 0 | 0 | 0 | 111 | E269 K270 K275 Y276 L277 S303 L306 V307 I363 L366 L369 | E269-L273 WeakPolarHBondContact O-CB 3.41Å; E269-L273 PolarHBondContact O-N 3.29Å; K270-L273 PolarHBondContact O-N 2.94Å; L273-K275 VanDerWaalsContact C-N 3.3Å; L273-K275 PolarHBondContact O-N 3.02Å; L273-Y276 HydrophobicContact CD1-CD1 4.12Å; L273-Y276 WeakPolarHBondContact O-CB 3.42Å; L273-Y276 PolarHBondContact O-N 3.5Å; L273-Y276 VanDerWaalsContact O-N 3.11Å; L273-L277 HydrophobicContact CD1-CD1 4.4Å; L273-L277 HydrophobicContact CD1-CG 4.28Å; L273-L277 HydrophobicContact CG-CD1 4.26Å; L273-L277 WeakPolarHBondContact O-CG 3.37Å; L273-L277 PolarHBondContact O-N 3.24Å; L273-S303 WeakPolarHBondContact CB-OG 3.29Å; L273-S303 WeakPolarHBondContact CD2-OG 3.19Å; L273-S303 WeakPolarHBondContact CG-OG 3.42Å; L273-L306 HydrophobicContact CD2-CB 4.37Å; L273-L306 HydrophobicContact CD2-CD1 4.36Å; L273-V307 HydrophobicContact CD2-CG2 3.76Å; L273-I363 HydrophobicContact CB-CD1 4.08Å; L273-I363 HydrophobicContact CB-CG1 3.7Å; L273-I363 HydrophobicContact CD1-CG1 4.18Å; L273-L366 HydrophobicContact CD1-CD1 4.4Å; L273-L366 HydrophobicContact CD2-CD1 4.09Å; L273-L369 HydrophobicContact CD1-CD2 3.93Å; L273-L369 HydrophobicContact CD1-CG 4.46Å |
| 274 | A | 98.6 | Very high | 97 | Very high | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -58.4 | -41.5 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | L257 K270 H271 Y276 L277 M278 S299 L300 | L257-A274 HydrophobicContact CD1-CB 3.71Å; L257-A274 HydrophobicContact CD2-CB 4.2Å; K270-A274 WeakPolarHBondContact O-CB 3.28Å; K270-A274 PolarHBondContact O-N 3.34Å; H271-A274 PolarHBondContact O-N 3.07Å; A274-Y276 PolarHBondContact O-N 3.05Å; A274-L277 PolarHBondContact O-N 2.9Å; A274-M278 WeakPolarHBondContact O-CB 3.41Å; A274-M278 PolarHBondContact O-N 2.87Å; A274-S299 WeakPolarHBondContact O-CB 3.42Å; A274-L300 HydrophobicContact CB-CB 4.4Å; A274-L300 HydrophobicContact CB-CD1 4.17Å |
| 275 | K | 98.6 | Very high | 97.3 | Very high | 48 Ų | 48 | 31.2 Ų | 31.2 | 21% | 0.209 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -60.2 | -42.1 | 173.3 | -74.7 | 178 | 65.8 | 176.9 | 0 | 112.8 | L257 H271 T272 L273 E279 Y355 | L257-K275 HydrophobicContact CD2-CB 4.44Å; L257-K275 HydrophobicContact CD2-CG 3.55Å; H271-K275 WeakPolarHBondContact O-CG 3.46Å; H271-K275 PolarHBondContact O-N 2.6Å; T272-K275 WeakPolarHBondContact O-CB 3.22Å; T272-K275 PolarHBondContact O-N 3.34Å; L273-K275 VanDerWaalsContact C-N 3.3Å; L273-K275 PolarHBondContact O-N 3.02Å; K275-E279 WeakPolarHBondContact O-CB 3.31Å; K275-E279 PolarHBondContact O-N 3.07Å; K275-Y355 HydrophobicContact CB-CE1 4.2Å; K275-Y355 PolarHBondContact O-OH 3.42Å |
| 276 | Y | 98.7 | Very high | 97.5 | Very high | 0 Ų | 0 | 29.4 Ų | 29.4 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -60.9 | -51.3 | 176.2 | 167.9 | -115.9 | 0 | 0 | 0 | 111.6 | T272 L273 A274 M278 E279 L280 V351 Y355 I363 L369 | T272-Y276 PolarHBondContact O-N 3.26Å; L273-Y276 HydrophobicContact CD1-CD1 4.12Å; L273-Y276 WeakPolarHBondContact O-CB 3.42Å; L273-Y276 PolarHBondContact O-N 3.5Å; L273-Y276 VanDerWaalsContact O-N 3.11Å; A274-Y276 PolarHBondContact O-N 3.05Å; Y276-M278 VanDerWaalsContact C-N 3.33Å; Y276-M278 PolarHBondContact O-N 3.29Å; Y276-E279 PolarHBondContact O-N 3.46Å; Y276-L280 HydrophobicContact CE1-CD1 3.99Å; Y276-L280 HydrophobicContact CE2-CD1 4.17Å; Y276-L280 HydrophobicContact CE2-CD2 4.06Å; Y276-L280 HydrophobicContact CE2-CG 4.09Å; Y276-L280 PolarHBondContact O-N 2.81Å; Y276-L280 VanDerWaalsContact O-N 3.16Å; Y276-V351 HydrophobicContact CD2-CG1 3.91Å; Y276-V351 HydrophobicContact CE2-CG1 3.97Å; Y276-Y355 HydrophobicContact CD2-CD1 4.23Å; Y276-Y355 AromaticContact CD2-CD2 3.79Å; Y276-Y355 HydrophobicContact CD2-CD2 3.79Å; Y276-Y355 HydrophobicContact CD2-CE2 4.49Å; Y276-Y355 AromaticContact CD2-CG 3.63Å; Y276-Y355 HydrophobicContact CD2-CG 3.63Å; Y276-Y355 HydrophobicContact CG-CD1 4.36Å; Y276-Y355 HydrophobicContact CG-CG 4.2Å; Y276-I363 HydrophobicContact CG-CG2 4.32Å; Y276-L369 HydrophobicContact CD1-CD1 4.3Å; Y276-L369 HydrophobicContact CE1-CD1 3.74Å; Y276-L369 HydrophobicContact CE1-CD2 4.14Å |
| 277 | L | 98.8 | Very high | 97.8 | Very high | 0 Ų | 0 | 28.7 Ų | 28.7 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -58.6 | -45.4 | 178.7 | -66.3 | 171 | 0 | 0 | 0 | 111.4 | L273 A274 E279 L280 L302 L334 V338 L369 | L273-L277 HydrophobicContact CD1-CD1 4.4Å; L273-L277 HydrophobicContact CD1-CG 4.28Å; L273-L277 HydrophobicContact CG-CD1 4.26Å; L273-L277 WeakPolarHBondContact O-CG 3.37Å; L273-L277 PolarHBondContact O-N 3.24Å; A274-L277 PolarHBondContact O-N 2.9Å; L277-E279 VanDerWaalsContact C-N 3.33Å; L277-E279 PolarHBondContact O-N 3.13Å; L277-L280 WeakPolarHBondContact O-CB 3.49Å; L277-L280 PolarHBondContact O-N 2.92Å; L277-L302 HydrophobicContact CD1-CB 4.09Å; L277-L302 HydrophobicContact CD1-CD2 4Å; L277-L302 HydrophobicContact CD1-CG 3.95Å; L277-L302 HydrophobicContact CD2-CD2 4.22Å; L277-L334 HydrophobicContact CB-CD2 4.43Å; L277-L334 WeakPolarHBondContact O-CD2 3.35Å; L277-V338 HydrophobicContact CD2-CG2 3.44Å; L277-V338 VanDerWaalsContact CD2-CG2 3.44Å; L277-L369 HydrophobicContact CD2-CD2 4.35Å |
| 278 | M | 98.6 | Very high | 98 | Very high | 0 Ų | 0 | 25.9 Ų | 25.9 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -61.4 | -39.4 | 177.7 | -168.3 | 167.2 | 74.2 | 0 | 0 | 112 | Y175 P253 L254 L257 A274 Y276 T281 V295 A296 S299 | Y175-M278 HydrophobicContact CE1-CE 4.48Å; Y175-M278 HydrophobicContact CE1-CG 4.18Å; Y175-M278 HydrophobicContact CE2-CE 4.15Å; Y175-M278 VanDerWaalsContact OH-C 3.28Å; Y175-M278 WeakPolarHBondContact OH-CE 3.33Å; Y175-M278 WeakPolarHBondContact OH-CG 3.42Å; P253-M278 HydrophobicContact CB-CE 3.99Å; P253-M278 HydrophobicContact CB-CG 3.88Å; P253-M278 HydrophobicContact CB-SD 3.27Å; P253-M278 WeakPolarHBondContact CB-SD 3.4Å; L254-M278 HydrophobicContact CD2-CE 3.65Å; L254-M278 HydrophobicContact CG-CE 4.08Å; L257-M278 HydrophobicContact CB-CE 4.27Å; L257-M278 HydrophobicContact CB-SD 4.2Å; L257-M278 HydrophobicContact CD2-CE 3.65Å; L257-M278 HydrophobicContact CD2-SD 4.08Å; A274-M278 WeakPolarHBondContact O-CB 3.41Å; A274-M278 PolarHBondContact O-N 2.87Å; Y276-M278 VanDerWaalsContact C-N 3.33Å; Y276-M278 PolarHBondContact O-N 3.29Å; M278-T281 WeakPolarHBondContact O-CB 3.39Å; M278-T281 PolarHBondContact O-N 2.9Å; M278-T281 PolarHBondContact O-OG1 3.46Å; M278-V295 HydrophobicContact CG-CG1 3.86Å; M278-A296 HydrophobicContact SD-CB 4.23Å; M278-S299 WeakPolarHBondContact CA-OG 3.37Å; M278-S299 PolarHBondContact N-OG 3.44Å |
| 279 | E | 98.7 | Very high | 98.1 | Very high | 0 Ų | 0 | 25.1 Ų | 25.1 | 0% | 0 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -73.9 | -26.8 | -178.8 | -164 | 168.8 | 147.9 | 0 | 0 | 113 | Q171 L174 Y175 K275 Y276 L277 T281 L282 V351 K354 Y355 | Q171-E279 VanDerWaalsContact CD-OE2 3.27Å; Q171-E279 VanDerWaalsContact NE2-CD 3.31Å; Q171-E279 PolarHBondContact NE2-OE2 2.99Å; Q171-E279 PolarHBondContact OE1-OE2 3.18Å; L174-E279 HydrophobicContact CD2-CG 4.43Å; L174-E279 WeakPolarHBondContact CD2-OE1 3.42Å; Y175-E279 VanDerWaalsContact OH-CA 3.3Å; Y175-E279 WeakPolarHBondContact OH-CA 3.32Å; Y175-E279 PolarHBondContact OH-N 3.42Å; Y175-E279 VanDerWaalsContact OH-N 3.15Å; K275-E279 WeakPolarHBondContact O-CB 3.31Å; K275-E279 PolarHBondContact O-N 3.07Å; Y276-E279 PolarHBondContact O-N 3.46Å; L277-E279 VanDerWaalsContact C-N 3.33Å; L277-E279 PolarHBondContact O-N 3.13Å; E279-T281 PolarHBondContact O-N 2.88Å; E279-L282 HydrophobicContact CG-CD1 3.83Å; E279-L282 WeakPolarHBondContact O-CB 3.23Å; E279-L282 WeakPolarHBondContact O-CG 3.4Å; E279-L282 PolarHBondContact O-N 2.91Å; E279-V351 HydrophobicContact CB-CG1 3.95Å; E279-V351 HydrophobicContact CG-CG1 4.04Å; E279-V351 HydrophobicContact CG-CG2 4.11Å; E279-K354 VanDerWaalsContact CD-NZ 3.35Å; E279-K354 WeakPolarHBondContact OE1-CD 3.13Å; E279-K354 WeakPolarHBondContact OE1-CE 3.41Å; E279-K354 IonicContact OE1-NZ 3.21Å; E279-K354 PolarHBondContact OE1-NZ 2.67Å; E279-K354 IonicContact OE2-NZ 2.73Å; E279-K354 PolarHBondContact OE2-NZ 3.49Å; E279-K354 VanDerWaalsContact OE2-NZ 3.14Å; E279-Y355 HydrophobicContact CB-CE2 4.14Å; E279-Y355 HydrophobicContact CG-CE2 4.37Å; E279-Y355 WeakPolarHBondContact OE2-CE2 3.42Å; E279-Y355 PolarHBondContact OE2-OH 3.16Å |
| 280 | L | 98.5 | Very high | 98.2 | Very high | 9 Ų | 9 | 22.7 Ų | 22.7 | 5% | 0.047 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -60.3 | -31 | 171.2 | -69.4 | 176.6 | 0 | 0 | 0 | 112.2 | Y276 L277 L282 L283 N337 V338 V341 V351 | Y276-L280 HydrophobicContact CE1-CD1 3.99Å; Y276-L280 HydrophobicContact CE2-CD1 4.17Å; Y276-L280 HydrophobicContact CE2-CD2 4.06Å; Y276-L280 HydrophobicContact CE2-CG 4.09Å; Y276-L280 PolarHBondContact O-N 2.81Å; Y276-L280 VanDerWaalsContact O-N 3.16Å; L277-L280 WeakPolarHBondContact O-CB 3.49Å; L277-L280 PolarHBondContact O-N 2.92Å; L280-L282 PolarHBondContact O-N 3.43Å; L280-L283 PolarHBondContact O-N 3.46Å; L280-N337 HydrophobicContact CB-CB 4.4Å; L280-V338 HydrophobicContact CD1-CG2 3.93Å; L280-V341 HydrophobicContact CD2-CG2 4.12Å; L280-V351 HydrophobicContact CD2-CB 3.89Å; L280-V351 HydrophobicContact CD2-CG1 3.83Å; L280-V351 HydrophobicContact CD2-CG2 4.49Å; L280-V351 HydrophobicContact CG-CG1 4.24Å |
| 281 | T | 98.5 | Very high | 98.2 | Very high | 14 Ų | 14 | 25.5 Ų | 25.5 | 9% | 0.086 | 12% | 0.119 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -64.8 | -22.5 | 179.9 | 72.8 | 0 | 0 | 0 | 0 | 113.5 | M278 E279 L283 D284 M287 V295 L334 | M278-T281 WeakPolarHBondContact O-CB 3.39Å; M278-T281 PolarHBondContact O-N 2.9Å; M278-T281 PolarHBondContact O-OG1 3.46Å; E279-T281 PolarHBondContact O-N 2.88Å; T281-L283 PolarHBondContact O-N 2.92Å; T281-D284 PolarHBondContact O-N 3.49Å; T281-D284 VanDerWaalsContact O-N 3.16Å; T281-M287 HydrophobicContact CG2-CE 3.68Å; T281-M287 HydrophobicContact CG2-SD 3.79Å; T281-V295 HydrophobicContact CG2-CG1 3.81Å; T281-L334 HydrophobicContact CG2-CD2 3.33Å |
| 282 | L | 98.5 | Very high | 98.3 | Very high | 12 Ų | 12 | 23.3 Ų | 23.3 | 6% | 0.063 | 11% | 0.109 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -59.8 | -31.7 | 179.6 | -63.5 | -177.5 | 0 | 0 | 0 | 112 | R153 V157 L174 Y175 V178 E279 L280 | R153-L282 PolarHBondContact NH1-O 3.31Å; R153-L282 PolarHBondContact NH2-O 3.42Å; R153-L282 VanDerWaalsContact NH2-O 3.12Å; V157-L282 HydrophobicContact CG1-CB 4Å; L174-L282 HydrophobicContact CD2-CD1 4.05Å; L174-L282 HydrophobicContact CG-CD1 3.94Å; Y175-L282 HydrophobicContact CD1-CD1 4.46Å; Y175-L282 HydrophobicContact CD1-CD2 3.67Å; Y175-L282 HydrophobicContact CD1-CG 4.46Å; Y175-L282 HydrophobicContact CE1-CD1 4.27Å; Y175-L282 HydrophobicContact CE1-CD2 3.69Å; Y175-L282 HydrophobicContact CE1-CG 4.12Å; V178-L282 HydrophobicContact CB-CD2 4.13Å; V178-L282 HydrophobicContact CG1-CD2 4.09Å; V178-L282 HydrophobicContact CG2-CB 4.5Å; V178-L282 HydrophobicContact CG2-CD1 4.35Å; V178-L282 HydrophobicContact CG2-CD2 4.22Å; E279-L282 HydrophobicContact CG-CD1 3.83Å; E279-L282 WeakPolarHBondContact O-CB 3.23Å; E279-L282 WeakPolarHBondContact O-CG 3.4Å; E279-L282 PolarHBondContact O-N 2.91Å; L280-L282 PolarHBondContact O-N 3.43Å |
| 283 | L | 98.1 | Very high | 98.3 | Very high | 21 Ų | 21 | 22.9 Ų | 22.9 | 11% | 0.11 | 11% | 0.106 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -84.9 | -26.7 | -178.7 | -63.3 | 96 | 0 | 0 | 0 | 112.9 | V157 D158 I161 L280 T281 Y285 F348 V351 | V157-L283 HydrophobicContact CG1-CG 4.35Å; D158-L283 HydrophobicContact CB-CD2 3.86Å; I161-L283 HydrophobicContact CD1-CD1 3.75Å; I161-L283 HydrophobicContact CD1-CG 4.26Å; L280-L283 PolarHBondContact O-N 3.46Å; T281-L283 PolarHBondContact O-N 2.92Å; L283-Y285 PolarHBondContact O-N 2.76Å; L283-F348 HydrophobicContact CD2-CB 3.37Å; L283-F348 HydrophobicContact CD2-CD2 4.48Å; L283-F348 HydrophobicContact CD2-CG 3.96Å; L283-V351 HydrophobicContact CD1-CG2 3.51Å |
| 284 | D | 97.7 | Very high | 98.3 | Very high | 19 Ų | 19 | 23.7 Ų | 23.7 | 10% | 0.102 | 11% | 0.11 | C | C | . | . | trans | -82.2 | 109.3 | -173.3 | -169.9 | -7.8 | 0 | 0 | 0 | 111.3 | T281 Q286 M287 K336 N337 | T281-D284 PolarHBondContact O-N 3.49Å; T281-D284 VanDerWaalsContact O-N 3.16Å; D284-Q286 PolarHBondContact O-N 3.15Å; D284-Q286 WeakPolarHBondContact OD1-CB 3.43Å; D284-Q286 PolarHBondContact OD1-N 3.49Å; D284-M287 HydrophobicContact CB-CB 4.33Å; D284-M287 HydrophobicContact CB-CG 4.11Å; D284-M287 HydrophobicContact CB-SD 4.23Å; D284-M287 PolarHBondContact O-N 3.33Å; D284-M287 VanDerWaalsContact O-N 3.14Å; D284-K336 IonicContact OD1-NZ 3.44Å; D284-K336 WeakPolarHBondContact OD2-CE 3.22Å; D284-K336 IonicContact OD2-NZ 2.87Å; D284-K336 PolarHBondContact OD2-NZ 2.94Å; D284-N337 WeakPolarHBondContact CB-ND2 3.41Å; D284-N337 PolarHBondContact OD2-ND2 2.99Å; D284-N337 PolarHBondContact OD2-OD1 3.19Å | ||
| 285 | Y | 97.9 | Very high | 98.3 | Very high | 28 Ų | 28 | 24 Ų | 24 | 11% | 0.11 | 11% | 0.112 | C | C | . | . | G | 310 helix | trans | -63.2 | -29.2 | 179.1 | -174.1 | -112.7 | 0 | 0 | 0 | 113.1 | D141 Y142 L143 S150 L283 M287 V288 | D141-Y285 WeakPolarHBondContact CA-OH 3.31Å; Y142-Y285 HydrophobicContact CD1-CE2 4.05Å; Y142-Y285 AromaticContact CE1-CE2 3.66Å; Y142-Y285 HydrophobicContact CE1-CE2 3.66Å; Y142-Y285 AromaticContact CZ-CE2 3.9Å; Y142-Y285 PolarHBondContact N-OH 3.14Å; L143-Y285 HydrophobicContact CB-CE2 4.29Å; L143-Y285 WeakPolarHBondContact CB-OH 3.23Å; L143-Y285 HydrophobicContact CD1-CD2 4.06Å; L143-Y285 HydrophobicContact CD1-CE2 3.55Å; L143-Y285 HydrophobicContact CG-CE2 3.8Å; L143-Y285 PolarHBondContact N-OH 2.73Å; S150-Y285 VanDerWaalsContact CB-CD1 3.5Å; S150-Y285 VanDerWaalsContact CB-CG 3.5Å; L283-Y285 PolarHBondContact O-N 2.76Å; Y285-M287 PolarHBondContact O-N 2.67Å; Y285-V288 HydrophobicContact CD2-CG1 3.96Å; Y285-V288 HydrophobicContact CD2-CG2 4.32Å; Y285-V288 HydrophobicContact CE2-CG1 4.45Å; Y285-V288 HydrophobicContact CE2-CG2 4.14Å; Y285-V288 WeakPolarHBondContact O-CG1 3.39Å; Y285-V288 VanDerWaalsContact O-CG2 3.3Å; Y285-V288 WeakPolarHBondContact O-CG2 3.27Å; Y285-V288 PolarHBondContact O-N 3.21Å |
| 286 | Q | 97 | Very high | 98.3 | Very high | 114 Ų | 114 | 21.7 Ų | 21.7 | 53% | 0.533 | 10% | 0.102 | S | C | . | . | G | 310 helix | trans | -68.1 | -19.3 | 179.4 | -65.1 | 177.3 | -24.8 | 0 | 0 | 111.8 | D284 H289 | D284-Q286 PolarHBondContact O-N 3.15Å; D284-Q286 WeakPolarHBondContact OD1-CB 3.43Å; D284-Q286 PolarHBondContact OD1-N 3.49Å; Q286-H289 PolarHBondContact O-CE1 2.93Å; Q286-H289 PolarHBondContact O-ND1 3Å |
| 287 | M | 98.2 | Very high | 98.3 | Very high | 7 Ų | 7 | 21.9 Ų | 21.9 | 3% | 0.034 | 10% | 0.104 | C | C | . | . | G | 310 helix | trans | -100 | -1.5 | -175.9 | -62 | -172.6 | 79 | 0 | 0 | 114 | T281 D284 Y285 H289 L290 I330 Q333 L334 N337 | T281-M287 HydrophobicContact CG2-CE 3.68Å; T281-M287 HydrophobicContact CG2-SD 3.79Å; D284-M287 HydrophobicContact CB-CB 4.33Å; D284-M287 HydrophobicContact CB-CG 4.11Å; D284-M287 HydrophobicContact CB-SD 4.23Å; D284-M287 PolarHBondContact O-N 3.33Å; D284-M287 VanDerWaalsContact O-N 3.14Å; Y285-M287 PolarHBondContact O-N 2.67Å; M287-H289 PolarHBondContact O-N 3.07Å; M287-H289 VanDerWaalsContact O-N 3.14Å; M287-L290 HydrophobicContact CB-CD1 3.95Å; M287-L290 HydrophobicContact CE-CD1 3.53Å; M287-L290 HydrophobicContact CG-CD1 4.14Å; M287-L290 WeakPolarHBondContact O-CB 3.36Å; M287-L290 WeakPolarHBondContact O-CG 3.5Å; M287-L290 PolarHBondContact O-N 3.16Å; M287-L290 VanDerWaalsContact O-N 3.12Å; M287-I330 HydrophobicContact CE-CG2 3.83Å; M287-Q333 HydrophobicContact CE-CB 3.85Å; M287-Q333 HydrophobicContact CG-CB 4.12Å; M287-Q333 HydrophobicContact SD-CB 3.71Å; M287-L334 HydrophobicContact CE-CD2 4.09Å; M287-L334 HydrophobicContact CE-CG 4.17Å; M287-N337 PolarHBondContact SD-ND2 3.34Å |
| 288 | V | 97.6 | Very high | 98.3 | Very high | 11 Ų | 11 | 21.9 Ų | 21.9 | 7% | 0.067 | 10% | 0.104 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -62.4 | -26.1 | -172.8 | -61.4 | 0 | 0 | 0 | 0 | 114.3 | I138 Y142 Y285 | I138-V288 WeakPolarHBondContact CB-O 3.4Å; I138-V288 HydrophobicContact CG2-CB 4.18Å; I138-V288 HydrophobicContact CG2-CG2 4.12Å; Y142-V288 HydrophobicContact CD1-CG2 4.09Å; Y142-V288 HydrophobicContact CE1-CB 4.34Å; Y142-V288 HydrophobicContact CE1-CG2 3.92Å; Y285-V288 HydrophobicContact CD2-CG1 3.96Å; Y285-V288 HydrophobicContact CD2-CG2 4.32Å; Y285-V288 HydrophobicContact CE2-CG1 4.45Å; Y285-V288 HydrophobicContact CE2-CG2 4.14Å; Y285-V288 WeakPolarHBondContact O-CG1 3.39Å; Y285-V288 VanDerWaalsContact O-CG2 3.3Å; Y285-V288 WeakPolarHBondContact O-CG2 3.27Å; Y285-V288 PolarHBondContact O-N 3.21Å |
| 289 | H | 97.9 | Very high | 98.3 | Very high | 88 Ų | 88 | 21.9 Ų | 21.9 | 41% | 0.407 | 10% | 0.104 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -84.4 | -13.1 | -177.5 | 67.5 | -83.3 | 0 | 0 | 0 | 113.3 | I138 A140 Q286 M287 | I138-H289 WeakPolarHBondContact O-CA 3.33Å; A140-H289 HydrophobicContact CB-CB 3.88Å; Q286-H289 PolarHBondContact O-CE1 2.93Å; Q286-H289 PolarHBondContact O-ND1 3Å; M287-H289 PolarHBondContact O-N 3.07Å; M287-H289 VanDerWaalsContact O-N 3.14Å |
| 290 | L | 98.3 | Very high | 98.3 | Very high | 23 Ų | 23 | 21.9 Ų | 21.9 | 12% | 0.12 | 10% | 0.104 | C | C | . | . | S | Bend | trans | -66.4 | 143.2 | 179.4 | -62.2 | 178.4 | 0 | 0 | 0 | 110.4 | M287 V295 I330 | M287-L290 HydrophobicContact CB-CD1 3.95Å; M287-L290 HydrophobicContact CE-CD1 3.53Å; M287-L290 HydrophobicContact CG-CD1 4.14Å; M287-L290 WeakPolarHBondContact O-CB 3.36Å; M287-L290 WeakPolarHBondContact O-CG 3.5Å; M287-L290 PolarHBondContact O-N 3.16Å; M287-L290 VanDerWaalsContact O-N 3.12Å; L290-V295 HydrophobicContact CB-CG2 3.71Å; L290-V295 HydrophobicContact CD1-CG2 4.26Å; L290-I330 HydrophobicContact CD1-CG1 4.15Å; L290-I330 HydrophobicContact CD1-CG2 3.85Å; L290-I330 HydrophobicContact CD2-CD1 4.34Å; L290-I330 HydrophobicContact CD2-CG1 4.2Å |
| 291 | R | 98.3 | Very high | 98.3 | Very high | 80 Ų | 80 | 21.6 Ų | 21.6 | 30% | 0.302 | 10% | 0.102 | S | C | . | . | trans | -70.7 | 142.9 | 176.8 | -67.4 | 173.6 | -74.9 | 179.7 | -3.5 | 110.1 | E133 S293 E294 V295 Y322 | E133-R291 HydrophobicContact CG-CB 4.47Å; R291-S293 PolarHBondContact O-N 3.36Å; R291-S293 VanDerWaalsContact O-N 3.16Å; R291-E294 HydrophobicContact CB-CB 4.42Å; R291-E294 HydrophobicContact CB-CG 4.01Å; R291-E294 VanDerWaalsContact CB-OE2 3.24Å; R291-E294 WeakPolarHBondContact CB-OE2 3.41Å; R291-E294 WeakPolarHBondContact CG-OE2 3.33Å; R291-E294 IonicContact CZ-OE1 2.69Å; R291-E294 IonicContact CZ-OE2 2.7Å; R291-E294 PolarHBondContact N-OE2 2.95Å; R291-E294 IonicContact NE-OE1 3.14Å; R291-E294 PolarHBondContact NE-OE1 2.96Å; R291-E294 IonicContact NE-OE2 3.23Å; R291-E294 PolarHBondContact NE-OE2 3.42Å; R291-E294 IonicContact NH2-OE1 3.76Å; R291-E294 PolarHBondContact NH2-OE1 2.9Å; R291-E294 IonicContact NH2-OE2 3.38Å; R291-E294 WeakPolarHBondContact O-CB 3.16Å; R291-E294 PolarHBondContact O-N 3.5Å; R291-V295 WeakPolarHBondContact O-CG2 3.45Å; R291-V295 PolarHBondContact O-N 3.42Å; R291-V295 VanDerWaalsContact O-N 3.07Å; R291-Y322 PolarHBondContact NH1-OH 2.89Å; R291-Y322 PolarHBondContact NH2-OH 3.4Å | ||
| 292 | P | 98.6 | Very high | 98.2 | Very high | 2 Ų | 2 | 20.9 Ų | 20.9 | 1% | 0.013 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -49.6 | -38.1 | 173.6 | -29.6 | 36.9 | 0 | 0 | 0 | 114.1 | E133 P251 P253 F256 A296 | E133-P292 HydrophobicContact CB-CG 4.3Å; E133-P292 WeakPolarHBondContact OE2-CD 3.47Å; P251-P292 VanDerWaalsContact O-CG 3.27Å; P251-P292 WeakPolarHBondContact O-CG 3.49Å; P253-P292 HydrophobicContact CB-CB 4.41Å; P253-P292 HydrophobicContact CG-CB 3.9Å; F256-P292 HydrophobicContact CD2-CB 3.92Å; F256-P292 HydrophobicContact CE2-CB 3.88Å; P292-A296 WeakPolarHBondContact O-CB 3.46Å; P292-A296 PolarHBondContact O-N 2.87Å; P292-A296 VanDerWaalsContact O-N 3.09Å |
| 293 | S | 98.6 | Very high | 98.2 | Very high | 4 Ų | 4 | 20.3 Ų | 20.3 | 3% | 0.028 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -64.6 | -40.2 | 176.1 | 64.8 | 0 | 0 | 0 | 0 | 113.4 | E133 R291 A297 Y322 | E133-S293 WeakPolarHBondContact OE1-CB 3.18Å; E133-S293 PolarHBondContact OE1-OG 3Å; E133-S293 VanDerWaalsContact OE2-CB 3.29Å; E133-S293 WeakPolarHBondContact OE2-CB 3.3Å; E133-S293 PolarHBondContact OE2-N 3.28Å; E133-S293 PolarHBondContact OE2-OG 3.43Å; E133-S293 VanDerWaalsContact OE2-OG 3.06Å; R291-S293 PolarHBondContact O-N 3.36Å; R291-S293 VanDerWaalsContact O-N 3.16Å; S293-A297 WeakPolarHBondContact O-CB 3.2Å; S293-A297 PolarHBondContact O-N 3.45Å; S293-Y322 PolarHBondContact OG-OH 2.95Å |
| 294 | E | 98.5 | Very high | 98.1 | Very high | 17 Ų | 17 | 19.9 Ų | 19.9 | 8% | 0.079 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -66.6 | -46.2 | 178.1 | -67.1 | 174.9 | 131.4 | 0 | 0 | 111.2 | R291 A296 A297 A298 Y322 H326 I330 | R291-E294 HydrophobicContact CB-CB 4.42Å; R291-E294 HydrophobicContact CB-CG 4.01Å; R291-E294 VanDerWaalsContact CB-OE2 3.24Å; R291-E294 WeakPolarHBondContact CB-OE2 3.41Å; R291-E294 WeakPolarHBondContact CG-OE2 3.33Å; R291-E294 IonicContact CZ-OE1 2.69Å; R291-E294 IonicContact CZ-OE2 2.7Å; R291-E294 PolarHBondContact N-OE2 2.95Å; R291-E294 IonicContact NE-OE1 3.14Å; R291-E294 PolarHBondContact NE-OE1 2.96Å; R291-E294 IonicContact NE-OE2 3.23Å; R291-E294 PolarHBondContact NE-OE2 3.42Å; R291-E294 IonicContact NH2-OE1 3.76Å; R291-E294 PolarHBondContact NH2-OE1 2.9Å; R291-E294 IonicContact NH2-OE2 3.38Å; R291-E294 WeakPolarHBondContact O-CB 3.16Å; R291-E294 PolarHBondContact O-N 3.5Å; E294-A296 VanDerWaalsContact C-N 3.32Å; E294-A296 PolarHBondContact O-N 2.94Å; E294-A297 PolarHBondContact O-N 3.31Å; E294-A298 WeakPolarHBondContact O-CB 3.48Å; E294-A298 PolarHBondContact O-N 3.43Å; E294-Y322 HydrophobicContact CB-CE2 4.46Å; E294-Y322 HydrophobicContact CG-CE1 3.87Å; E294-Y322 HydrophobicContact CG-CE2 3.77Å; E294-Y322 WeakPolarHBondContact CG-OH 3.35Å; E294-H326 IonicContact OE1-CE1 2.68Å; E294-H326 PolarHBondContact OE1-CE1 3.49Å; E294-H326 IonicContact OE1-NE2 2.73Å; E294-H326 PolarHBondContact OE1-NE2 3.26Å; E294-I330 HydrophobicContact CB-CD1 3.77Å; E294-I330 HydrophobicContact CG-CD1 4.46Å |
| 295 | V | 98.6 | Very high | 98.1 | Very high | 7 Ų | 7 | 20.8 Ų | 20.8 | 4% | 0.042 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -61.7 | -43 | 178.6 | -176.6 | 0 | 0 | 0 | 0 | 110.6 | M278 T281 L290 R291 S299 | M278-V295 HydrophobicContact CG-CG1 3.86Å; T281-V295 HydrophobicContact CG2-CG1 3.81Å; L290-V295 HydrophobicContact CB-CG2 3.71Å; L290-V295 HydrophobicContact CD1-CG2 4.26Å; R291-V295 WeakPolarHBondContact O-CG2 3.45Å; R291-V295 PolarHBondContact O-N 3.42Å; R291-V295 VanDerWaalsContact O-N 3.07Å; V295-S299 VanDerWaalsContact O-CB 3.23Å; V295-S299 WeakPolarHBondContact O-CB 3.38Å; V295-S299 PolarHBondContact O-N 3.38Å; V295-S299 PolarHBondContact O-OG 3.12Å |
| 296 | A | 98.7 | Very high | 98 | Very high | 0 Ų | 0 | 20 Ų | 20 | 0% | 0 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -64.1 | -46.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | P253 F256 L257 M278 P292 E294 S299 L300 | P253-A296 WeakPolarHBondContact O-CB 3.33Å; F256-A296 HydrophobicContact CB-CB 3.56Å; L257-A296 HydrophobicContact CB-CB 4.07Å; M278-A296 HydrophobicContact SD-CB 4.23Å; P292-A296 WeakPolarHBondContact O-CB 3.46Å; P292-A296 PolarHBondContact O-N 2.87Å; P292-A296 VanDerWaalsContact O-N 3.09Å; E294-A296 VanDerWaalsContact C-N 3.32Å; E294-A296 PolarHBondContact O-N 2.94Å; A296-S299 PolarHBondContact O-N 3.1Å; A296-L300 PolarHBondContact O-N 2.95Å; A296-L300 VanDerWaalsContact O-N 3.07Å |
| 297 | A | 98.5 | Very high | 97.9 | Very high | 4 Ų | 4 | 16.3 Ų | 16.3 | 3% | 0.033 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -63.5 | -47.7 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | S293 E294 S299 L300 C301 W312 Y322 L327 | S293-A297 WeakPolarHBondContact O-CB 3.2Å; S293-A297 PolarHBondContact O-N 3.45Å; E294-A297 PolarHBondContact O-N 3.31Å; A297-S299 VanDerWaalsContact C-N 3.34Å; A297-S299 PolarHBondContact O-N 3.21Å; A297-L300 PolarHBondContact O-N 3.35Å; A297-C301 VanDerWaalsContact O-CB 3.31Å; A297-C301 WeakPolarHBondContact O-CB 3.42Å; A297-C301 PolarHBondContact O-N 2.85Å; A297-W312 HydrophobicContact CB-CH2 4.34Å; A297-W312 HydrophobicContact CB-CZ2 4.25Å; A297-Y322 HydrophobicContact CB-CD2 4.09Å; A297-L327 HydrophobicContact CB-CD1 4.17Å; A297-L327 HydrophobicContact CB-CD2 3.79Å |
| 298 | A | 98.6 | Very high | 97.7 | Very high | 0 Ų | 0 | 19.2 Ų | 19.2 | 0% | 0 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -64.6 | -37.6 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | E294 C301 L302 L327 I330 M331 L334 | E294-A298 WeakPolarHBondContact O-CB 3.48Å; E294-A298 PolarHBondContact O-N 3.43Å; A298-C301 PolarHBondContact O-N 3.29Å; A298-L302 WeakPolarHBondContact O-CB 3.49Å; A298-L302 PolarHBondContact O-N 2.65Å; A298-L327 HydrophobicContact CB-CB 4.49Å; A298-L327 HydrophobicContact CB-CD2 4.14Å; A298-I330 HydrophobicContact CB-CB 3.75Å; A298-I330 HydrophobicContact CB-CG2 3.42Å; A298-I330 VanDerWaalsContact CB-CG2 3.42Å; A298-M331 HydrophobicContact CB-CG 4.19Å; A298-L334 HydrophobicContact CB-CD1 4.02Å |
| 299 | S | 98.6 | Very high | 97.4 | Very high | 0 Ų | 0 | 21.1 Ų | 21.1 | 0% | 0 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -65.7 | -40.4 | 177 | -60 | 0 | 0 | 0 | 0 | 111.9 | A274 M278 V295 A296 A297 S303 | A274-S299 WeakPolarHBondContact O-CB 3.42Å; M278-S299 WeakPolarHBondContact CA-OG 3.37Å; M278-S299 PolarHBondContact N-OG 3.44Å; V295-S299 VanDerWaalsContact O-CB 3.23Å; V295-S299 WeakPolarHBondContact O-CB 3.38Å; V295-S299 PolarHBondContact O-N 3.38Å; V295-S299 PolarHBondContact O-OG 3.12Å; A296-S299 PolarHBondContact O-N 3.1Å; A297-S299 VanDerWaalsContact C-N 3.34Å; A297-S299 PolarHBondContact O-N 3.21Å; S299-S303 VanDerWaalsContact O-CB 3.31Å; S299-S303 WeakPolarHBondContact O-CB 3.31Å; S299-S303 PolarHBondContact O-N 3.47Å |
| 300 | L | 98.4 | Very high | 97 | Very high | 0 Ų | 0 | 21.4 Ų | 21.4 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -70.2 | -44.4 | 175.8 | -175.2 | 63.8 | 0 | 0 | 0 | 111.8 | L257 A260 A264 T266 A274 A296 A297 L302 S303 Q304 W312 | L257-L300 HydrophobicContact CD1-CB 3.99Å; L257-L300 HydrophobicContact CD1-CD1 4.41Å; A260-L300 HydrophobicContact CB-CD2 3.48Å; A260-L300 VanDerWaalsContact CB-CD2 3.48Å; A260-L300 WeakPolarHBondContact O-CD2 3.42Å; A264-L300 HydrophobicContact CB-CD2 4.13Å; T266-L300 HydrophobicContact CG2-CD1 3.84Å; A274-L300 HydrophobicContact CB-CB 4.4Å; A274-L300 HydrophobicContact CB-CD1 4.17Å; A296-L300 PolarHBondContact O-N 2.95Å; A296-L300 VanDerWaalsContact O-N 3.07Å; A297-L300 PolarHBondContact O-N 3.35Å; L300-L302 VanDerWaalsContact C-N 3.34Å; L300-L302 PolarHBondContact O-N 3.18Å; L300-S303 WeakPolarHBondContact O-CB 3.42Å; L300-S303 PolarHBondContact O-N 2.7Å; L300-S303 VanDerWaalsContact O-N 3.14Å; L300-Q304 HydrophobicContact CD1-CG 4.45Å; L300-Q304 WeakPolarHBondContact O-CG 3.18Å; L300-Q304 PolarHBondContact O-N 3.27Å; L300-W312 HydrophobicContact CB-CZ3 4.39Å; L300-W312 HydrophobicContact CD2-CH2 4.4Å; L300-W312 HydrophobicContact CD2-CZ3 4.37Å; L300-W312 HydrophobicContact CG-CZ3 4.35Å |
| 301 | C | 98.3 | Very high | 96.6 | Very high | 2 Ų | 2 | 24.1 Ų | 24.1 | 1% | 0.014 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -56.5 | -48.8 | 176.9 | -172.3 | 0 | 0 | 0 | 0 | 111 | A297 A298 S303 Q304 L305 W312 L327 M331 | A297-C301 VanDerWaalsContact O-CB 3.31Å; A297-C301 WeakPolarHBondContact O-CB 3.42Å; A297-C301 PolarHBondContact O-N 2.85Å; A298-C301 PolarHBondContact O-N 3.29Å; C301-S303 PolarHBondContact O-N 2.68Å; C301-Q304 PolarHBondContact O-N 3.04Å; C301-L305 WeakPolarHBondContact O-CB 3.49Å; C301-L305 PolarHBondContact O-N 2.88Å; C301-W312 HydrophobicContact CB-CD2 4.24Å; C301-W312 HydrophobicContact CB-CE3 3.49Å; C301-W312 VanDerWaalsContact CB-CE3 3.49Å; C301-W312 HydrophobicContact CB-CZ3 3.74Å; C301-L327 HydrophobicContact CB-CD1 4.08Å; C301-M331 HydrophobicContact CB-SD 4.06Å; C301-M331 VanDerWaalsContact SG-SD 3.63Å |
| 302 | L | 98.3 | Very high | 96.5 | Very high | 0 Ų | 0 | 21.1 Ų | 21.1 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -63.8 | -40.8 | 176 | -177.5 | 56.7 | 0 | 0 | 0 | 111.9 | L277 A298 L300 Q304 L305 L306 M331 L334 I374 L377 | L277-L302 HydrophobicContact CD1-CB 4.09Å; L277-L302 HydrophobicContact CD1-CD2 4Å; L277-L302 HydrophobicContact CD1-CG 3.95Å; L277-L302 HydrophobicContact CD2-CD2 4.22Å; A298-L302 WeakPolarHBondContact O-CB 3.49Å; A298-L302 PolarHBondContact O-N 2.65Å; L300-L302 VanDerWaalsContact C-N 3.34Å; L300-L302 PolarHBondContact O-N 3.18Å; L302-Q304 PolarHBondContact O-N 3.34Å; L302-L305 PolarHBondContact O-N 2.96Å; L302-L306 HydrophobicContact CD1-CD1 4.13Å; L302-L306 HydrophobicContact CD1-CD2 4.47Å; L302-L306 HydrophobicContact CD1-CG 4.08Å; L302-L306 HydrophobicContact CG-CD1 4.01Å; L302-L306 HydrophobicContact CG-CG 4.41Å; L302-L306 WeakPolarHBondContact O-CG 3.36Å; L302-L306 PolarHBondContact O-N 3.42Å; L302-M331 HydrophobicContact CB-CE 4.12Å; L302-M331 HydrophobicContact CB-CG 4.2Å; L302-M331 HydrophobicContact CD1-CE 4.09Å; L302-L334 HydrophobicContact CD2-CB 3.67Å; L302-L334 HydrophobicContact CD2-CD1 4.27Å; L302-I374 HydrophobicContact CD1-CD1 4.25Å; L302-I374 HydrophobicContact CD2-CD1 4.34Å; L302-L377 HydrophobicContact CD1-CD1 3.6Å |
| 303 | S | 98.1 | Very high | 96.2 | Very high | 0 Ų | 0 | 22.9 Ų | 22.9 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -60 | -43.8 | 176.5 | -176.6 | 0 | 0 | 0 | 0 | 112.7 | K270 L273 S299 L300 C301 L306 V307 | K270-S303 VanDerWaalsContact CA-OG 3.3Å; K270-S303 WeakPolarHBondContact CA-OG 3.42Å; K270-S303 PolarHBondContact O-OG 3.42Å; L273-S303 WeakPolarHBondContact CB-OG 3.29Å; L273-S303 WeakPolarHBondContact CD2-OG 3.19Å; L273-S303 WeakPolarHBondContact CG-OG 3.42Å; S299-S303 VanDerWaalsContact O-CB 3.31Å; S299-S303 WeakPolarHBondContact O-CB 3.31Å; S299-S303 PolarHBondContact O-N 3.47Å; L300-S303 WeakPolarHBondContact O-CB 3.42Å; L300-S303 PolarHBondContact O-N 2.7Å; L300-S303 VanDerWaalsContact O-N 3.14Å; C301-S303 PolarHBondContact O-N 2.68Å; S303-L306 PolarHBondContact O-N 3.42Å; S303-V307 WeakPolarHBondContact O-CG2 3.14Å; S303-V307 PolarHBondContact O-N 3.3Å; S303-V307 VanDerWaalsContact O-N 3.14Å |
| 304 | Q | 96.1 | Very high | 96 | Very high | 12 Ų | 12 | 26.2 Ų | 26.2 | 6% | 0.056 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -67.4 | -42.2 | 178.6 | -71.7 | 172.7 | -56.3 | 0 | 0 | 111.7 | K270 L300 C301 L302 L306 V307 D308 G309 Q316 | K270-Q304 HydrophobicContact CD-CG 4.11Å; L300-Q304 HydrophobicContact CD1-CG 4.45Å; L300-Q304 WeakPolarHBondContact O-CG 3.18Å; L300-Q304 PolarHBondContact O-N 3.27Å; C301-Q304 PolarHBondContact O-N 3.04Å; L302-Q304 PolarHBondContact O-N 3.34Å; Q304-L306 PolarHBondContact O-N 2.95Å; Q304-V307 PolarHBondContact O-N 3.05Å; Q304-D308 PolarHBondContact O-N 3.34Å; Q304-G309 PolarHBondContact O-N 3.29Å; Q304-Q316 VanDerWaalsContact CD-NE2 3.32Å |
| 305 | L | 96.5 | Very high | 95.8 | Very high | 37 Ų | 37 | 27 Ų | 27 | 19% | 0.194 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -60.2 | -36.8 | 176.4 | -177.6 | 63.3 | 0 | 0 | 0 | 111.9 | C301 L302 G309 M331 I373 L377 | C301-L305 WeakPolarHBondContact O-CB 3.49Å; C301-L305 PolarHBondContact O-N 2.88Å; L302-L305 PolarHBondContact O-N 2.96Å; L305-G309 VanDerWaalsContact O-CA 3.24Å; L305-G309 WeakPolarHBondContact O-CA 3.48Å; L305-G309 PolarHBondContact O-N 3.21Å; L305-M331 HydrophobicContact CD2-CE 3.82Å; L305-I373 HydrophobicContact CD2-CG2 3.86Å; L305-I373 HydrophobicContact CG-CG2 4.14Å; L305-L377 HydrophobicContact CD2-CD1 4.46Å |
| 306 | L | 96.5 | Very high | 95.6 | Very high | 12 Ų | 12 | 27.1 Ų | 27.1 | 6% | 0.063 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -76.4 | -35.9 | -179.8 | -68.4 | 172.2 | 0 | 0 | 0 | 113.9 | L273 L302 S303 Q304 Q368 L369 I373 I374 | L273-L306 HydrophobicContact CD2-CB 4.37Å; L273-L306 HydrophobicContact CD2-CD1 4.36Å; L302-L306 HydrophobicContact CD1-CD1 4.13Å; L302-L306 HydrophobicContact CD1-CD2 4.47Å; L302-L306 HydrophobicContact CD1-CG 4.08Å; L302-L306 HydrophobicContact CG-CD1 4.01Å; L302-L306 HydrophobicContact CG-CG 4.41Å; L302-L306 WeakPolarHBondContact O-CG 3.36Å; L302-L306 PolarHBondContact O-N 3.42Å; S303-L306 PolarHBondContact O-N 3.42Å; Q304-L306 PolarHBondContact O-N 2.95Å; L306-Q368 HydrophobicContact CB-CB 4.4Å; L306-Q368 WeakPolarHBondContact O-CG 3.26Å; L306-L369 HydrophobicContact CD1-CD2 4.34Å; L306-I373 HydrophobicContact CD2-CB 4.13Å; L306-I373 HydrophobicContact CD2-CG2 3.99Å; L306-I374 HydrophobicContact CD1-CD1 3.86Å; L306-I374 HydrophobicContact CD1-CG1 4.33Å; L306-I374 HydrophobicContact CD2-CD1 3.88Å; L306-I374 HydrophobicContact CD2-CG1 3.73Å; L306-I374 HydrophobicContact CG-CD1 4.43Å |
| 307 | V | 95 | Very high | 95.4 | Very high | 37 Ų | 37 | 31.2 Ų | 31.2 | 22% | 0.224 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -88.7 | -47.6 | -175.3 | 179.3 | 0 | 0 | 0 | 0 | 111.1 | K270 L273 S303 Q304 | K270-V307 HydrophobicContact CD-CB 4.25Å; K270-V307 HydrophobicContact CD-CG1 4.35Å; K270-V307 HydrophobicContact CG-CB 3.81Å; K270-V307 HydrophobicContact CG-CG1 4.01Å; K270-V307 HydrophobicContact CG-CG2 3.89Å; L273-V307 HydrophobicContact CD2-CG2 3.76Å; S303-V307 WeakPolarHBondContact O-CG2 3.14Å; S303-V307 PolarHBondContact O-N 3.3Å; S303-V307 VanDerWaalsContact O-N 3.14Å; Q304-V307 PolarHBondContact O-N 3.05Å |
| 308 | D | 93.1 | Very high | 95.2 | Very high | 68 Ų | 68 | 35.5 Ų | 35.5 | 36% | 0.364 | 21% | 0.207 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -107.3 | -14.9 | -172.6 | -54.9 | -31 | 0 | 0 | 0 | 113.3 | K270 Q304 L310 | K270-D308 VanDerWaalsContact CD-OD2 3.23Å; K270-D308 WeakPolarHBondContact CD-OD2 3.28Å; K270-D308 WeakPolarHBondContact CE-OD2 3.08Å; K270-D308 IonicContact NZ-OD1 3.49Å; K270-D308 IonicContact NZ-OD2 3.54Å; K270-D308 PolarHBondContact NZ-OD2 3.32Å; Q304-D308 PolarHBondContact O-N 3.34Å; D308-L310 HydrophobicContact CB-CB 4.18Å; D308-L310 HydrophobicContact CB-CD1 3.69Å; D308-L310 HydrophobicContact CB-CG 3.65Å; D308-L310 PolarHBondContact O-N 2.98Å |
| 309 | G | 92.4 | Very high | 95 | Very high | 50 Ų | 50 | 37.4 Ų | 37.4 | 52% | 0.515 | 22% | 0.215 | S | C | . | . | trans | 68.6 | 17.1 | -170.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | Q304 L305 | Q304-G309 PolarHBondContact O-N 3.29Å; L305-G309 VanDerWaalsContact O-CA 3.24Å; L305-G309 WeakPolarHBondContact O-CA 3.48Å; L305-G309 PolarHBondContact O-N 3.21Å | ||
| 310 | L | 89.6 | Confident | 94.8 | Very high | 95 Ų | 95 | 38 Ų | 38 | 50% | 0.497 | 22% | 0.219 | S | C | . | . | trans | -88.3 | 141.1 | -176.4 | -67.7 | 174.4 | 0 | 0 | 0 | 112 | D308 | D308-L310 HydrophobicContact CB-CB 4.18Å; D308-L310 HydrophobicContact CB-CD1 3.69Å; D308-L310 HydrophobicContact CB-CG 3.65Å; D308-L310 PolarHBondContact O-N 2.98Å | ||
| 311 | P | 90.3 | Very high | 94.6 | Very high | 80 Ų | 80 | 42 Ų | 42 | 52% | 0.519 | 24% | 0.243 | S | C | . | . | trans | -77 | 172.5 | 174.1 | 34.3 | -36 | 0 | 0 | 0 | 111.9 | S313 | P311-S313 PolarHBondContact O-N 3.16Š| ||
| 312 | W | 94.6 | Very high | 94.6 | Very high | 16 Ų | 16 | 42.4 Ų | 42.4 | 6% | 0.061 | 25% | 0.245 | C | C | . | . | trans | -70.5 | 116 | 174.9 | -165.4 | -116.1 | 0 | 0 | 0 | 110.8 | A297 L300 C301 Q316 Y322 E324 L327 | A297-W312 HydrophobicContact CB-CH2 4.34Å; A297-W312 HydrophobicContact CB-CZ2 4.25Å; L300-W312 HydrophobicContact CB-CZ3 4.39Å; L300-W312 HydrophobicContact CD2-CH2 4.4Å; L300-W312 HydrophobicContact CD2-CZ3 4.37Å; L300-W312 HydrophobicContact CG-CZ3 4.35Å; C301-W312 HydrophobicContact CB-CD2 4.24Å; C301-W312 HydrophobicContact CB-CE3 3.49Å; C301-W312 VanDerWaalsContact CB-CE3 3.49Å; C301-W312 HydrophobicContact CB-CZ3 3.74Å; W312-Q316 HydrophobicContact CD2-CB 3.81Å; W312-Q316 VanDerWaalsContact CE2-CB 3.49Å; W312-Q316 HydrophobicContact CE3-CB 4.15Å; W312-Q316 HydrophobicContact CG-CB 4.42Å; W312-Q316 HydrophobicContact CH2-CB 3.97Å; W312-Q316 HydrophobicContact CH2-CG 4.43Å; W312-Q316 HydrophobicContact CZ2-CB 3.59Å; W312-Q316 HydrophobicContact CZ3-CB 4.24Å; W312-Q316 HydrophobicContact CZ3-CG 4.45Å; W312-Y322 PolarHBondContact NE1-O 3.48Å; W312-E324 HydrophobicContact CB-CB 4.2Å; W312-E324 HydrophobicContact CB-CG 4.5Å; W312-L327 HydrophobicContact CD2-CD1 4Å; W312-L327 HydrophobicContact CG-CD1 4.27Å; W312-L327 HydrophobicContact CZ2-CD1 4.18Å | ||
| 313 | S | 94 | Very high | 94.5 | Very high | 40 Ų | 40 | 45.7 Ų | 45.7 | 28% | 0.28 | 26% | 0.262 | S | S | . | . | trans | -74.9 | 156.6 | -174.3 | 68.7 | 0 | 0 | 0 | 0 | 113.3 | P311 T315 Q316 Q317 | P311-S313 PolarHBondContact O-N 3.16Å; S313-T315 VanDerWaalsContact C-N 3.27Å; S313-T315 PolarHBondContact O-N 2.77Å; S313-Q316 WeakPolarHBondContact O-CB 3.4Å; S313-Q316 PolarHBondContact O-N 2.85Å; S313-Q316 VanDerWaalsContact OG-CD 3.32Å; S313-Q316 WeakPolarHBondContact OG-CG 3.25Å; S313-Q316 PolarHBondContact OG-N 3.31Å; S313-Q316 PolarHBondContact OG-OE1 2.64Å; S313-Q317 PolarHBondContact O-N 3.37Å | ||
| 314 | P | 93.8 | Very high | 94.3 | Very high | 74 Ų | 74 | 49.5 Ų | 49.5 | 48% | 0.481 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -57.6 | -36.6 | 176 | -25.8 | 34.6 | 0 | 0 | 0 | 114 | L102 Q317 H318 | L102-P314 HydrophobicContact CD1-CB 3.51Å; L102-P314 HydrophobicContact CD1-CG 4.05Å; P314-Q317 PolarHBondContact O-N 2.94Å; P314-H318 PolarHBondContact O-N 3.41Å |
| 315 | T | 93.4 | Very high | 94.3 | Very high | 33 Ų | 33 | 52 Ų | 52 | 20% | 0.202 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -62.4 | -43.7 | 174.9 | -54.6 | 0 | 0 | 0 | 0 | 111 | V104 P105 V107 V263 S313 H318 Y319 | V104-T315 HydrophobicContact CG1-CG2 4.05Å; P105-T315 HydrophobicContact CG-CG2 3.93Å; V107-T315 HydrophobicContact CG1-CG2 4.49Å; V263-T315 HydrophobicContact CG1-CG2 3.98Å; S313-T315 VanDerWaalsContact C-N 3.27Å; S313-T315 PolarHBondContact O-N 2.77Å; T315-H318 PolarHBondContact O-N 3.26Å; T315-Y319 HydrophobicContact CG2-CD2 4.12Å; T315-Y319 HydrophobicContact CG2-CE2 4.13Å; T315-Y319 WeakPolarHBondContact O-CD2 3.36Å; T315-Y319 PolarHBondContact O-N 3Å |
| 316 | Q | 94.9 | Very high | 94.3 | Very high | 9 Ų | 9 | 53.5 Ų | 53.5 | 4% | 0.042 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -65.6 | -41.8 | 177 | -68.8 | 168.6 | -76.3 | 0 | 0 | 111.5 | V263 A264 Q304 W312 S313 H318 Y319 S320 | V263-Q316 HydrophobicContact CG1-CG 4.17Å; A264-Q316 HydrophobicContact CB-CG 4.03Å; A264-Q316 VanDerWaalsContact CB-NE2 3.33Å; Q304-Q316 VanDerWaalsContact CD-NE2 3.32Å; W312-Q316 HydrophobicContact CD2-CB 3.81Å; W312-Q316 VanDerWaalsContact CE2-CB 3.49Å; W312-Q316 HydrophobicContact CE3-CB 4.15Å; W312-Q316 HydrophobicContact CG-CB 4.42Å; W312-Q316 HydrophobicContact CH2-CB 3.97Å; W312-Q316 HydrophobicContact CH2-CG 4.43Å; W312-Q316 HydrophobicContact CZ2-CB 3.59Å; W312-Q316 HydrophobicContact CZ3-CB 4.24Å; W312-Q316 HydrophobicContact CZ3-CG 4.45Å; S313-Q316 WeakPolarHBondContact O-CB 3.4Å; S313-Q316 PolarHBondContact O-N 2.85Å; S313-Q316 VanDerWaalsContact OG-CD 3.32Å; S313-Q316 WeakPolarHBondContact OG-CG 3.25Å; S313-Q316 PolarHBondContact OG-N 3.31Å; S313-Q316 PolarHBondContact OG-OE1 2.64Å; Q316-H318 VanDerWaalsContact C-N 3.34Å; Q316-H318 PolarHBondContact O-N 3.32Å; Q316-Y319 PolarHBondContact O-N 3.39Å; Q316-S320 WeakPolarHBondContact O-CB 3.37Å; Q316-S320 PolarHBondContact O-N 3.45Å; Q316-S320 PolarHBondContact O-OG 3.14Å |
| 317 | Q | 95.5 | Very high | 94.4 | Very high | 86 Ų | 86 | 53 Ų | 53 | 40% | 0.402 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -59.8 | -42.1 | 173.6 | 174.3 | 174.3 | -20.4 | 0 | 0 | 112.2 | S313 P314 T321 Y322 D323 | S313-Q317 PolarHBondContact O-N 3.37Å; P314-Q317 PolarHBondContact O-N 2.94Å; Q317-T321 VanDerWaalsContact O-CA 3.23Å; Q317-T321 WeakPolarHBondContact O-CA 3.28Å; Q317-T321 PolarHBondContact O-N 3Å; Q317-Y322 WeakPolarHBondContact CA-O 3.45Å; Q317-D323 HydrophobicContact CG-CB 4.3Å |
| 318 | H | 93.3 | Very high | 94.5 | Very high | 94 Ų | 94 | 55.7 Ų | 55.7 | 44% | 0.435 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -58.9 | -53 | 177.7 | 176.9 | 88 | 0 | 0 | 0 | 111.9 | V104 P314 T315 Q316 | V104-H318 HydrophobicContact CG1-CB 4.06Å; V104-H318 HydrophobicContact CG2-CB 3.96Å; P314-H318 PolarHBondContact O-N 3.41Å; T315-H318 PolarHBondContact O-N 3.26Å; Q316-H318 VanDerWaalsContact C-N 3.34Å; Q316-H318 PolarHBondContact O-N 3.32Å |
| 319 | Y | 93.4 | Very high | 94.7 | Very high | 40 Ų | 40 | 55.6 Ų | 55.6 | 16% | 0.157 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -76.3 | -29.9 | -177.4 | -76.2 | -78 | 0 | 0 | 0 | 113.6 | V104 P105 V107 R130 R259 V263 T315 Q316 | V104-Y319 HydrophobicContact CG1-CD2 4.29Å; V104-Y319 HydrophobicContact CG1-CE2 3.72Å; P105-Y319 PolarHBondContact O-OH 3.47Å; V107-Y319 HydrophobicContact CB-CE2 4.48Å; V107-Y319 HydrophobicContact CG1-CD2 4.38Å; V107-Y319 HydrophobicContact CG1-CE2 3.71Å; V107-Y319 HydrophobicContact CG2-CE1 3.99Å; V107-Y319 HydrophobicContact CG2-CE2 4.04Å; V107-Y319 PolarHBondContact N-OH 2.9Å; R130-Y319 PolarHBondContact NH2-O 3.35Å; R259-Y319 VanDerWaalsContact NH2-CD1 3.3Å; V263-Y319 HydrophobicContact CB-CD2 4.45Å; V263-Y319 HydrophobicContact CG1-CD2 3.67Å; V263-Y319 HydrophobicContact CG1-CE2 4.49Å; V263-Y319 HydrophobicContact CG1-CG 4.17Å; V263-Y319 HydrophobicContact CG2-CD1 4.29Å; V263-Y319 HydrophobicContact CG2-CD2 3.85Å; V263-Y319 HydrophobicContact CG2-CG 3.69Å; T315-Y319 HydrophobicContact CG2-CD2 4.12Å; T315-Y319 HydrophobicContact CG2-CE2 4.13Å; T315-Y319 WeakPolarHBondContact O-CD2 3.36Å; T315-Y319 PolarHBondContact O-N 3Å; Q316-Y319 PolarHBondContact O-N 3.39Å |
| 320 | S | 94.8 | Very high | 95 | Very high | 13 Ų | 13 | 53.6 Ų | 53.6 | 9% | 0.091 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -83.6 | -18.8 | 177.6 | 80 | 0 | 0 | 0 | 0 | 113.3 | R130 Q316 Y322 | R130-S320 PolarHBondContact NH1-O 3.01Å; R130-S320 PolarHBondContact NH2-O 3.49Å; Q316-S320 WeakPolarHBondContact O-CB 3.37Å; Q316-S320 PolarHBondContact O-N 3.45Å; Q316-S320 PolarHBondContact O-OG 3.14Å; S320-Y322 WeakPolarHBondContact O-CD2 3.35Å; S320-Y322 WeakPolarHBondContact O-CE2 3.38Å; S320-Y322 PolarHBondContact O-N 3.4Å; S320-Y322 PolarHBondContact OG-N 3.46Å; S320-Y322 VanDerWaalsContact OG-N 3.09Å; S320-Y322 PolarHBondContact OG-O 2.87Å |
| 321 | T | 95.2 | Very high | 95.4 | Very high | 84 Ų | 84 | 49.3 Ų | 49.3 | 52% | 0.515 | 27% | 0.274 | S | S | . | . | trans | 59.2 | 16.9 | -170.9 | 79.4 | 0 | 0 | 0 | 0 | 114.3 | R130 Q317 | R130-T321 PolarHBondContact NH1-OG1 3.44Å; Q317-T321 VanDerWaalsContact O-CA 3.23Å; Q317-T321 WeakPolarHBondContact O-CA 3.28Å; Q317-T321 PolarHBondContact O-N 3Å | ||
| 322 | Y | 97.2 | Very high | 95.8 | Very high | 11 Ų | 11 | 47.4 Ų | 47.4 | 4% | 0.043 | 26% | 0.259 | C | S | . | . | trans | -125.6 | 130.3 | -179.6 | -58.3 | -57.8 | 0 | 0 | 0 | 110 | R291 S293 E294 A297 W312 Q317 S320 H326 L327 | R291-Y322 PolarHBondContact NH1-OH 2.89Å; R291-Y322 PolarHBondContact NH2-OH 3.4Å; S293-Y322 PolarHBondContact OG-OH 2.95Å; E294-Y322 HydrophobicContact CB-CE2 4.46Å; E294-Y322 HydrophobicContact CG-CE1 3.87Å; E294-Y322 HydrophobicContact CG-CE2 3.77Å; E294-Y322 WeakPolarHBondContact CG-OH 3.35Å; A297-Y322 HydrophobicContact CB-CD2 4.09Å; W312-Y322 PolarHBondContact NE1-O 3.48Å; Q317-Y322 WeakPolarHBondContact CA-O 3.45Å; S320-Y322 WeakPolarHBondContact O-CD2 3.35Å; S320-Y322 WeakPolarHBondContact O-CE2 3.38Å; S320-Y322 PolarHBondContact O-N 3.4Å; S320-Y322 PolarHBondContact OG-N 3.46Å; S320-Y322 VanDerWaalsContact OG-N 3.09Å; S320-Y322 PolarHBondContact OG-O 2.87Å; Y322-H326 AromaticContact CD1-CD2 3.22Å; Y322-H326 WeakPolarHBondContact CD1-CD2 3.45Å; Y322-H326 AromaticContact CD1-CG 3.96Å; Y322-H326 AromaticContact CD1-NE2 3.48Å; Y322-H326 WeakPolarHBondContact CD1-NE2 3.2Å; Y322-H326 AromaticContact CE1-CD2 3.87Å; Y322-H326 AromaticContact CE1-NE2 3.61Å; Y322-H326 AromaticContact CG-CD2 3.74Å; Y322-L327 HydrophobicContact CD2-CD2 4.35Å; Y322-L327 HydrophobicContact CG-CD2 4.22Å | ||
| 323 | D | 95.9 | Very high | 96 | Very high | 68 Ų | 68 | 48.6 Ų | 48.6 | 36% | 0.364 | 27% | 0.265 | S | S | . | . | trans | -84.6 | 169.4 | 170.9 | 65.7 | 6.1 | 0 | 0 | 0 | 111.3 | Q317 A325 H326 L327 | Q317-D323 HydrophobicContact CG-CB 4.3Å; D323-A325 VanDerWaalsContact C-N 3.26Å; D323-A325 PolarHBondContact O-N 3.38Å; D323-H326 PolarHBondContact O-N 3.02Å; D323-H326 WeakPolarHBondContact OD1-CB 3.45Å; D323-H326 PolarHBondContact OD1-N 3.47Å; D323-L327 WeakPolarHBondContact O-CG 3.46Å; D323-L327 PolarHBondContact O-N 3Å | ||
| 324 | E | 94.1 | Very high | 96.2 | Very high | 80 Ų | 80 | 46.7 Ų | 46.7 | 37% | 0.374 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -62.9 | -35 | -179.1 | -170.3 | 170.8 | -178.4 | 0 | 0 | 112.2 | W312 H326 L327 Q328 | W312-E324 HydrophobicContact CB-CB 4.2Å; W312-E324 HydrophobicContact CB-CG 4.5Å; E324-H326 PolarHBondContact O-N 3.34Å; E324-L327 PolarHBondContact O-N 3.46Å; E324-Q328 WeakPolarHBondContact O-CB 3.36Å; E324-Q328 PolarHBondContact O-N 3.11Å |
| 325 | A | 96.5 | Very high | 96.4 | Very high | 66 Ų | 66 | 43.2 Ų | 43.2 | 55% | 0.545 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -62.5 | -40.8 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | D323 P329 | D323-A325 VanDerWaalsContact C-N 3.26Å; D323-A325 PolarHBondContact O-N 3.38Å; A325-P329 VanDerWaalsContact O-CD 3.26Å; A325-P329 WeakPolarHBondContact O-CD 3.4Å |
| 326 | H | 97.4 | Very high | 96.7 | Very high | 68 Ų | 68 | 42.3 Ų | 42.3 | 32% | 0.315 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -66.5 | -38.6 | 173.8 | -177.3 | 81 | 0 | 0 | 0 | 112.4 | E294 Y322 D323 E324 P329 | E294-H326 IonicContact OE1-CE1 2.68Å; E294-H326 PolarHBondContact OE1-CE1 3.49Å; E294-H326 IonicContact OE1-NE2 2.73Å; E294-H326 PolarHBondContact OE1-NE2 3.26Å; Y322-H326 AromaticContact CD1-CD2 3.22Å; Y322-H326 WeakPolarHBondContact CD1-CD2 3.45Å; Y322-H326 AromaticContact CD1-CG 3.96Å; Y322-H326 AromaticContact CD1-NE2 3.48Å; Y322-H326 WeakPolarHBondContact CD1-NE2 3.2Å; Y322-H326 AromaticContact CE1-CD2 3.87Å; Y322-H326 AromaticContact CE1-NE2 3.61Å; Y322-H326 AromaticContact CG-CD2 3.74Å; D323-H326 PolarHBondContact O-N 3.02Å; D323-H326 WeakPolarHBondContact OD1-CB 3.45Å; D323-H326 PolarHBondContact OD1-N 3.47Å; E324-H326 PolarHBondContact O-N 3.34Å; H326-P329 WeakPolarHBondContact O-CD 3.42Å; H326-P329 WeakPolarHBondContact O-CG 3.39Å |
| 327 | L | 97.9 | Very high | 96.8 | Very high | 0 Ų | 0 | 42.7 Ų | 42.7 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -76.6 | -28.7 | -178.5 | -62.6 | -180 | 0 | 0 | 0 | 112.9 | A297 A298 C301 W312 Y322 D323 E324 I330 M331 | A297-L327 HydrophobicContact CB-CD1 4.17Å; A297-L327 HydrophobicContact CB-CD2 3.79Å; A298-L327 HydrophobicContact CB-CB 4.49Å; A298-L327 HydrophobicContact CB-CD2 4.14Å; C301-L327 HydrophobicContact CB-CD1 4.08Å; W312-L327 HydrophobicContact CD2-CD1 4Å; W312-L327 HydrophobicContact CG-CD1 4.27Å; W312-L327 HydrophobicContact CZ2-CD1 4.18Å; Y322-L327 HydrophobicContact CD2-CD2 4.35Å; Y322-L327 HydrophobicContact CG-CD2 4.22Å; D323-L327 WeakPolarHBondContact O-CG 3.46Å; D323-L327 PolarHBondContact O-N 3Å; E324-L327 PolarHBondContact O-N 3.46Å; L327-I330 WeakPolarHBondContact O-CB 3.4Å; L327-I330 PolarHBondContact O-N 2.7Å; L327-M331 HydrophobicContact CB-SD 4.25Å; L327-M331 WeakPolarHBondContact O-CG 3.31Å; L327-M331 PolarHBondContact O-N 3.37Å |
| 328 | Q | 97.3 | Very high | 96.9 | Very high | 95 Ų | 95 | 38.6 Ų | 38.6 | 44% | 0.444 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -50.5 | -52.2 | -177.1 | -175 | 175.7 | -9.7 | 0 | 0 | 114.4 | E324 I330 M331 Q332 | E324-Q328 WeakPolarHBondContact O-CB 3.36Å; E324-Q328 PolarHBondContact O-N 3.11Å; Q328-I330 PolarHBondContact O-N 3.05Å; Q328-M331 WeakPolarHBondContact O-CB 3.42Å; Q328-M331 PolarHBondContact O-N 3.44Å; Q328-M331 VanDerWaalsContact O-N 3.14Å; Q328-Q332 WeakPolarHBondContact O-CG 3.32Å; Q328-Q332 PolarHBondContact O-N 2.94Å |
| 329 | P | 98 | Very high | 97.1 | Very high | 65 Ų | 65 | 34.2 Ų | 34.2 | 42% | 0.422 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -61.2 | -33 | 178.6 | 23.3 | -34.5 | 0 | 0 | 0 | 112.9 | A325 H326 Q332 Q333 | A325-P329 VanDerWaalsContact O-CD 3.26Å; A325-P329 WeakPolarHBondContact O-CD 3.4Å; H326-P329 WeakPolarHBondContact O-CD 3.42Å; H326-P329 WeakPolarHBondContact O-CG 3.39Å; P329-Q332 WeakPolarHBondContact O-CB 3.37Å; P329-Q332 PolarHBondContact O-N 3.47Å; P329-Q333 WeakPolarHBondContact O-CG 3.39Å; P329-Q333 PolarHBondContact O-N 3.41Å |
| 330 | I | 98.4 | Very high | 97.3 | Very high | 9 Ų | 9 | 34.2 Ų | 34.2 | 5% | 0.046 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -72.2 | -40.2 | 176.9 | -56.3 | 166.3 | 0 | 0 | 0 | 110 | M287 L290 E294 A298 L327 Q328 Q332 Q333 L334 | M287-I330 HydrophobicContact CE-CG2 3.83Å; L290-I330 HydrophobicContact CD1-CG1 4.15Å; L290-I330 HydrophobicContact CD1-CG2 3.85Å; L290-I330 HydrophobicContact CD2-CD1 4.34Å; L290-I330 HydrophobicContact CD2-CG1 4.2Å; E294-I330 HydrophobicContact CB-CD1 3.77Å; E294-I330 HydrophobicContact CG-CD1 4.46Å; A298-I330 HydrophobicContact CB-CB 3.75Å; A298-I330 HydrophobicContact CB-CG2 3.42Å; A298-I330 VanDerWaalsContact CB-CG2 3.42Å; L327-I330 WeakPolarHBondContact O-CB 3.4Å; L327-I330 PolarHBondContact O-N 2.7Å; Q328-I330 PolarHBondContact O-N 3.05Å; I330-Q332 VanDerWaalsContact C-N 3.28Å; I330-Q332 PolarHBondContact O-N 3.02Å; I330-Q333 WeakPolarHBondContact O-CB 3.47Å; I330-Q333 PolarHBondContact O-N 3.18Å; I330-Q333 VanDerWaalsContact O-N 3.15Å; I330-L334 WeakPolarHBondContact O-CG 3.24Å; I330-L334 PolarHBondContact O-N 2.93Å |
| 331 | M | 98.4 | Very high | 97.4 | Very high | 4 Ų | 4 | 34.1 Ų | 34.1 | 2% | 0.02 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -61.9 | -35 | 173.8 | -66.3 | 169.1 | 61.5 | 0 | 0 | 112.2 | A298 C301 L302 L305 L327 Q328 L334 A335 L377 | A298-M331 HydrophobicContact CB-CG 4.19Å; C301-M331 HydrophobicContact CB-SD 4.06Å; C301-M331 VanDerWaalsContact SG-SD 3.63Å; L302-M331 HydrophobicContact CB-CE 4.12Å; L302-M331 HydrophobicContact CB-CG 4.2Å; L302-M331 HydrophobicContact CD1-CE 4.09Å; L305-M331 HydrophobicContact CD2-CE 3.82Å; L327-M331 HydrophobicContact CB-SD 4.25Å; L327-M331 WeakPolarHBondContact O-CG 3.31Å; L327-M331 PolarHBondContact O-N 3.37Å; Q328-M331 WeakPolarHBondContact O-CB 3.42Å; Q328-M331 PolarHBondContact O-N 3.44Å; Q328-M331 VanDerWaalsContact O-N 3.14Å; M331-L334 PolarHBondContact O-N 3.39Å; M331-A335 VanDerWaalsContact O-CB 3.32Å; M331-A335 WeakPolarHBondContact O-CB 3.2Å; M331-A335 PolarHBondContact O-N 3.49Å; M331-L377 HydrophobicContact CE-CD1 4.4Å |
| 332 | Q | 98.4 | Very high | 97.4 | Very high | 41 Ų | 41 | 31.8 Ų | 31.8 | 19% | 0.192 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -62.7 | -43.9 | 172.6 | -66.6 | 175.1 | -19.3 | 0 | 0 | 111.3 | Q328 P329 I330 A335 K336 L377 L381 | Q328-Q332 WeakPolarHBondContact O-CG 3.32Å; Q328-Q332 PolarHBondContact O-N 2.94Å; P329-Q332 WeakPolarHBondContact O-CB 3.37Å; P329-Q332 PolarHBondContact O-N 3.47Å; I330-Q332 VanDerWaalsContact C-N 3.28Å; I330-Q332 PolarHBondContact O-N 3.02Å; Q332-A335 PolarHBondContact O-N 2.72Å; Q332-K336 WeakPolarHBondContact O-CB 3.35Å; Q332-K336 PolarHBondContact O-N 3.41Å; Q332-L377 WeakPolarHBondContact CB-O 3.35Å; Q332-L377 HydrophobicContact CG-CD2 4.28Å; Q332-L377 VanDerWaalsContact CG-O 3.28Å; Q332-L377 WeakPolarHBondContact CG-O 3.38Å; Q332-L381 VanDerWaalsContact C-CD1 3.49Å; Q332-L381 HydrophobicContact CB-CD1 3.81Å; Q332-L381 HydrophobicContact CB-CG 4.47Å |
| 333 | Q | 98.3 | Very high | 97.2 | Very high | 40 Ų | 40 | 35.8 Ų | 35.8 | 19% | 0.187 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -64.2 | -41.4 | 175.9 | -64.7 | -66.4 | -10.5 | 0 | 0 | 112.2 | M287 P329 I330 K336 N337 L381 | M287-Q333 HydrophobicContact CE-CB 3.85Å; M287-Q333 HydrophobicContact CG-CB 4.12Å; M287-Q333 HydrophobicContact SD-CB 3.71Å; P329-Q333 WeakPolarHBondContact O-CG 3.39Å; P329-Q333 PolarHBondContact O-N 3.41Å; I330-Q333 WeakPolarHBondContact O-CB 3.47Å; I330-Q333 PolarHBondContact O-N 3.18Å; I330-Q333 VanDerWaalsContact O-N 3.15Å; Q333-K336 WeakPolarHBondContact O-CB 3.13Å; Q333-K336 PolarHBondContact O-N 3.49Å; Q333-N337 PolarHBondContact O-N 3.34Å; Q333-N337 PolarHBondContact O-ND2 3.3Å; Q333-L381 HydrophobicContact CB-CD1 4.46Å; Q333-L381 HydrophobicContact CG-CD1 3.99Å |
| 334 | L | 98.5 | Very high | 97 | Very high | 1 Ų | 1 | 35.2 Ų | 35.2 | 1% | 0.005 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -59.6 | -48.5 | 172.9 | -70 | 172 | 0 | 0 | 0 | 111.3 | L277 T281 M287 A298 L302 I330 M331 K336 N337 V338 | L277-L334 HydrophobicContact CB-CD2 4.43Å; L277-L334 WeakPolarHBondContact O-CD2 3.35Å; T281-L334 HydrophobicContact CG2-CD2 3.33Å; M287-L334 HydrophobicContact CE-CD2 4.09Å; M287-L334 HydrophobicContact CE-CG 4.17Å; A298-L334 HydrophobicContact CB-CD1 4.02Å; L302-L334 HydrophobicContact CD2-CB 3.67Å; L302-L334 HydrophobicContact CD2-CD1 4.27Å; I330-L334 WeakPolarHBondContact O-CG 3.24Å; I330-L334 PolarHBondContact O-N 2.93Å; M331-L334 PolarHBondContact O-N 3.39Å; L334-K336 PolarHBondContact O-N 3.31Å; L334-N337 PolarHBondContact O-N 3.1Å; L334-N337 VanDerWaalsContact O-N 3.15Å; L334-V338 WeakPolarHBondContact O-CG2 3.45Å; L334-V338 PolarHBondContact O-N 3.23Å |
| 335 | A | 98.4 | Very high | 97 | Very high | 0 Ų | 0 | 37.2 Ų | 37.2 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -61.5 | -42.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112 | M331 Q332 N337 V338 V339 I374 L377 A378 | M331-A335 VanDerWaalsContact O-CB 3.32Å; M331-A335 WeakPolarHBondContact O-CB 3.2Å; M331-A335 PolarHBondContact O-N 3.49Å; Q332-A335 PolarHBondContact O-N 2.72Å; A335-N337 VanDerWaalsContact C-N 3.32Å; A335-N337 PolarHBondContact O-N 3.18Å; A335-V338 WeakPolarHBondContact O-CB 3.43Å; A335-V338 PolarHBondContact O-N 3.08Å; A335-V339 WeakPolarHBondContact O-CG2 3.4Å; A335-V339 PolarHBondContact O-N 3.08Å; A335-I374 HydrophobicContact CB-CD1 4.11Å; A335-I374 HydrophobicContact CB-CG2 4.41Å; A335-L377 HydrophobicContact CB-CB 3.53Å; A335-L377 HydrophobicContact CB-CD1 4.49Å; A335-A378 HydrophobicContact CB-CB 4.11Å |
| 336 | K | 98.1 | Very high | 96.8 | Very high | 15 Ų | 15 | 35.5 Ų | 35.5 | 7% | 0.065 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -53.1 | -49.6 | 171.5 | 179 | -154.3 | 73.8 | -169.6 | 0 | 110.7 | D284 Q332 Q333 L334 V338 V339 L340 L381 L382 | D284-K336 IonicContact OD1-NZ 3.44Å; D284-K336 WeakPolarHBondContact OD2-CE 3.22Å; D284-K336 IonicContact OD2-NZ 2.87Å; D284-K336 PolarHBondContact OD2-NZ 2.94Å; Q332-K336 WeakPolarHBondContact O-CB 3.35Å; Q332-K336 PolarHBondContact O-N 3.41Å; Q333-K336 WeakPolarHBondContact O-CB 3.13Å; Q333-K336 PolarHBondContact O-N 3.49Å; L334-K336 PolarHBondContact O-N 3.31Å; K336-V338 VanDerWaalsContact C-N 3.35Å; K336-V338 PolarHBondContact O-N 3.26Å; K336-V339 PolarHBondContact O-N 3.1Å; K336-L340 HydrophobicContact CD-CD1 4.49Å; K336-L340 HydrophobicContact CG-CD1 4.15Å; K336-L340 HydrophobicContact CG-CG 4.47Å; K336-L340 VanDerWaalsContact O-CG 3.28Å; K336-L340 WeakPolarHBondContact O-CG 3.37Å; K336-L340 PolarHBondContact O-N 2.98Å; K336-L381 HydrophobicContact CB-CB 4.37Å; K336-L381 HydrophobicContact CB-CD1 4.14Å; K336-L381 HydrophobicContact CD-CB 4.13Å; K336-L381 HydrophobicContact CD-CD1 4.34Å; K336-L381 HydrophobicContact CG-CB 4.28Å; K336-L382 HydrophobicContact CG-CD2 3.9Å |
| 337 | N | 98.1 | Very high | 96.6 | Very high | 17 Ų | 17 | 39.5 Ų | 39.5 | 9% | 0.091 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -63 | -39.4 | 179.6 | -70.4 | -29.9 | 0 | 0 | 0 | 112.6 | L280 D284 M287 Q333 L334 A335 V341 | L280-N337 HydrophobicContact CB-CB 4.4Å; D284-N337 WeakPolarHBondContact CB-ND2 3.41Å; D284-N337 PolarHBondContact OD2-ND2 2.99Å; D284-N337 PolarHBondContact OD2-OD1 3.19Å; M287-N337 PolarHBondContact SD-ND2 3.34Å; Q333-N337 PolarHBondContact O-N 3.34Å; Q333-N337 PolarHBondContact O-ND2 3.3Å; L334-N337 PolarHBondContact O-N 3.1Å; L334-N337 VanDerWaalsContact O-N 3.15Å; A335-N337 VanDerWaalsContact C-N 3.32Å; A335-N337 PolarHBondContact O-N 3.18Å; N337-V341 WeakPolarHBondContact O-CB 3.34Å; N337-V341 VanDerWaalsContact O-CG2 3.28Å; N337-V341 WeakPolarHBondContact O-CG2 3.49Å; N337-V341 PolarHBondContact O-N 2.66Å; N337-V341 VanDerWaalsContact O-N 3.15Å |
| 338 | V | 98.2 | Very high | 96.4 | Very high | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -59.6 | -49.8 | 173.6 | 172.6 | 0 | 0 | 0 | 0 | 111 | L277 L280 L334 A335 K336 L340 V341 N342 L369 I374 | L277-V338 HydrophobicContact CD2-CG2 3.44Å; L277-V338 VanDerWaalsContact CD2-CG2 3.44Å; L280-V338 HydrophobicContact CD1-CG2 3.93Å; L334-V338 WeakPolarHBondContact O-CG2 3.45Å; L334-V338 PolarHBondContact O-N 3.23Å; A335-V338 WeakPolarHBondContact O-CB 3.43Å; A335-V338 PolarHBondContact O-N 3.08Å; K336-V338 VanDerWaalsContact C-N 3.35Å; K336-V338 PolarHBondContact O-N 3.26Å; V338-L340 PolarHBondContact O-N 2.93Å; V338-V341 PolarHBondContact O-N 2.92Å; V338-N342 WeakPolarHBondContact O-CB 3.49Å; V338-N342 PolarHBondContact O-N 3.13Å; V338-L369 HydrophobicContact CG1-CB 4Å; V338-L369 HydrophobicContact CG1-CD2 3.85Å; V338-L369 WeakPolarHBondContact CG1-O 3.33Å; V338-L369 HydrophobicContact CG2-CD2 4.21Å; V338-I374 HydrophobicContact CB-CG2 4.33Å; V338-I374 HydrophobicContact CG1-CD1 4.42Å; V338-I374 HydrophobicContact CG1-CG1 4.48Å; V338-I374 HydrophobicContact CG1-CG2 4.02Å |
| 339 | V | 97.6 | Very high | 96.4 | Very high | 2 Ų | 2 | 38.1 Ų | 38.1 | 1% | 0.012 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -59.9 | -49.1 | 179.6 | 174 | 0 | 0 | 0 | 0 | 111 | A335 K336 V341 N342 E343 I374 A378 L382 | A335-V339 WeakPolarHBondContact O-CG2 3.4Å; A335-V339 PolarHBondContact O-N 3.08Å; K336-V339 PolarHBondContact O-N 3.1Å; V339-V341 PolarHBondContact O-N 3.14Å; V339-N342 PolarHBondContact O-N 3.46Å; V339-E343 HydrophobicContact CG1-CG 4.09Å; V339-E343 WeakPolarHBondContact CG1-OE1 3.49Å; V339-E343 WeakPolarHBondContact CG1-OE2 3.2Å; V339-E343 WeakPolarHBondContact O-CB 3.34Å; V339-E343 PolarHBondContact O-N 3.22Å; V339-I374 HydrophobicContact CG2-CG2 3.46Å; V339-I374 VanDerWaalsContact CG2-CG2 3.46Å; V339-A378 HydrophobicContact CB-CB 4.41Å; V339-A378 HydrophobicContact CG2-CB 3.7Å; V339-L382 HydrophobicContact CB-CD1 4.1Å; V339-L382 HydrophobicContact CG1-CD1 3.63Å; V339-L382 HydrophobicContact CG2-CD1 4.37Å |
| 340 | L | 96.4 | Very high | 96.3 | Very high | 39 Ų | 39 | 35.4 Ų | 35.4 | 20% | 0.204 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -56.5 | -40.9 | -179.1 | -70.7 | 176.4 | 0 | 0 | 0 | 112 | K336 V338 R345 T346 L382 | K336-L340 HydrophobicContact CD-CD1 4.49Å; K336-L340 HydrophobicContact CG-CD1 4.15Å; K336-L340 HydrophobicContact CG-CG 4.47Å; K336-L340 VanDerWaalsContact O-CG 3.28Å; K336-L340 WeakPolarHBondContact O-CG 3.37Å; K336-L340 PolarHBondContact O-N 2.98Å; V338-L340 PolarHBondContact O-N 2.93Å; L340-R345 HydrophobicContact CD2-CB 3.8Å; L340-R345 PolarHBondContact O-N 3.16Å; L340-T346 HydrophobicContact CB-CG2 4.26Å; L340-T346 PolarHBondContact O-N 3.12Å; L340-T346 VanDerWaalsContact O-N 3.16Å; L340-L382 HydrophobicContact CD2-CD2 4.12Å; L340-L382 HydrophobicContact CG-CD2 4.45Å |
| 341 | V | 96.3 | Very high | 96.3 | Very high | 11 Ų | 11 | 35.1 Ų | 35.1 | 7% | 0.067 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -74 | -45.5 | -179.3 | 172 | 0 | 0 | 0 | 0 | 112 | L280 N337 V338 V339 G344 T346 Q349 R352 | L280-V341 HydrophobicContact CD2-CG2 4.12Å; N337-V341 WeakPolarHBondContact O-CB 3.34Å; N337-V341 VanDerWaalsContact O-CG2 3.28Å; N337-V341 WeakPolarHBondContact O-CG2 3.49Å; N337-V341 PolarHBondContact O-N 2.66Å; N337-V341 VanDerWaalsContact O-N 3.15Å; V338-V341 PolarHBondContact O-N 2.92Å; V339-V341 PolarHBondContact O-N 3.14Å; V341-G344 PolarHBondContact O-N 3.34Å; V341-T346 HydrophobicContact CB-CG2 4.26Å; V341-T346 HydrophobicContact CG2-CG2 3.58Å; V341-Q349 PolarHBondContact O-NE2 3.47Å; V341-Q349 VanDerWaalsContact O-NE2 3.12Å; V341-R352 HydrophobicContact CG1-CB 3.64Å; V341-R352 HydrophobicContact CG1-CG 4.13Å |
| 342 | N | 95.2 | Very high | 96.2 | Very high | 35 Ų | 35 | 38.6 Ų | 38.6 | 19% | 0.187 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -72.4 | -35.8 | -175.6 | -79.5 | 1.6 | 0 | 0 | 0 | 113 | V338 V339 G344 N370 | V338-N342 WeakPolarHBondContact O-CB 3.49Å; V338-N342 PolarHBondContact O-N 3.13Å; V339-N342 PolarHBondContact O-N 3.46Å; N342-G344 PolarHBondContact O-N 3.28Å; N342-N370 PolarHBondContact ND2-OD1 3.21Å |
| 343 | E | 94.4 | Very high | 96.1 | Very high | 96 Ų | 96 | 43 Ų | 43 | 45% | 0.449 | 21% | 0.21 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -83.3 | 1.7 | 177.4 | -64.3 | 179.9 | 177.8 | 0 | 0 | 112.8 | V339 R345 Q375 | V339-E343 HydrophobicContact CG1-CG 4.09Å; V339-E343 WeakPolarHBondContact CG1-OE1 3.49Å; V339-E343 WeakPolarHBondContact CG1-OE2 3.2Å; V339-E343 WeakPolarHBondContact O-CB 3.34Å; V339-E343 PolarHBondContact O-N 3.22Å; E343-R345 HydrophobicContact CB-CG 4Å; E343-R345 PolarHBondContact O-N 3.09Å; E343-R345 VanDerWaalsContact OE2-CD 3.28Å; E343-R345 WeakPolarHBondContact OE2-CD 3.5Å; E343-R345 IonicContact OE2-NH1 3.36Å; E343-Q375 PolarHBondContact OE1-NE2 2.49Å |
| 344 | G | 91.9 | Very high | 96.1 | Very high | 56 Ų | 56 | 42.8 Ų | 42.8 | 58% | 0.577 | 21% | 0.208 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 68.5 | 19.3 | -179.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | V341 N342 T346 | V341-G344 PolarHBondContact O-N 3.34Å; N342-G344 PolarHBondContact O-N 3.28Å; G344-T346 PolarHBondContact O-N 2.83Å |
| 345 | R | 92.4 | Very high | 96.1 | Very high | 122 Ų | 122 | 42.8 Ų | 42.8 | 46% | 0.46 | 21% | 0.208 | S | C | . | . | trans | -76.2 | -11.1 | 177.6 | -62.7 | 173.3 | 62.2 | 178 | -0.8 | 113 | L340 E343 | L340-R345 HydrophobicContact CD2-CB 3.8Å; L340-R345 PolarHBondContact O-N 3.16Å; E343-R345 HydrophobicContact CB-CG 4Å; E343-R345 PolarHBondContact O-N 3.09Å; E343-R345 VanDerWaalsContact OE2-CD 3.28Å; E343-R345 WeakPolarHBondContact OE2-CD 3.5Å; E343-R345 IonicContact OE2-NH1 3.36Å | ||
| 346 | T | 92.4 | Very high | 96 | Very high | 30 Ų | 30 | 44.9 Ų | 44.9 | 18% | 0.184 | 22% | 0.223 | C | C | . | . | trans | -120.6 | 142.1 | 171.2 | -176.9 | 0 | 0 | 0 | 0 | 112.5 | L340 V341 G344 F348 Q349 | L340-T346 HydrophobicContact CB-CG2 4.26Å; L340-T346 PolarHBondContact O-N 3.12Å; L340-T346 VanDerWaalsContact O-N 3.16Å; V341-T346 HydrophobicContact CB-CG2 4.26Å; V341-T346 HydrophobicContact CG2-CG2 3.58Å; G344-T346 PolarHBondContact O-N 2.83Å; T346-F348 VanDerWaalsContact C-N 3.28Å; T346-F348 VanDerWaalsContact OG1-CD2 3.26Å; T346-F348 WeakPolarHBondContact OG1-CD2 3.34Å; T346-F348 PolarHBondContact OG1-N 2.78Å; T346-Q349 PolarHBondContact O-NE2 2.73Å; T346-Q349 VanDerWaalsContact O-NE2 3.11Å | ||
| 347 | K | 94.1 | Very high | 95.9 | Very high | 152 Ų | 152 | 46.6 Ų | 46.6 | 66% | 0.661 | 24% | 0.236 | S | C | * | . | S | Bend | trans | -75.4 | -16.1 | 172.3 | 64.7 | -178.8 | 178.7 | -179.3 | 0 | 113.3 | Q349 | K347-Q349 PolarHBondContact O-N 3Š|
| 348 | F | 94.7 | Very high | 95.7 | Very high | 37 Ų | 37 | 50.4 Ų | 50.4 | 16% | 0.162 | 26% | 0.264 | C | S | . | . | trans | -83.8 | 105.8 | -177.9 | -49.3 | -55.4 | 0 | 0 | 0 | 110.5 | A154 I155 D158 L283 T346 | A154-F348 HydrophobicContact CB-CD2 4Å; A154-F348 HydrophobicContact CB-CE1 4.2Å; A154-F348 HydrophobicContact CB-CE2 3.41Å; A154-F348 VanDerWaalsContact CB-CE2 3.41Å; A154-F348 HydrophobicContact CB-CZ 3.52Å; I155-F348 HydrophobicContact CB-CE1 4.25Å; I155-F348 HydrophobicContact CG1-CE1 3.58Å; I155-F348 HydrophobicContact CG1-CZ 3.9Å; D158-F348 HydrophobicContact CB-CB 4.27Å; D158-F348 HydrophobicContact CB-CD1 3.87Å; D158-F348 HydrophobicContact CB-CG 4.42Å; D158-F348 WeakPolarHBondContact OD1-CA 3.25Å; L283-F348 HydrophobicContact CD2-CB 3.37Å; L283-F348 HydrophobicContact CD2-CD2 4.48Å; L283-F348 HydrophobicContact CD2-CG 3.96Å; T346-F348 VanDerWaalsContact C-N 3.28Å; T346-F348 VanDerWaalsContact OG1-CD2 3.26Å; T346-F348 WeakPolarHBondContact OG1-CD2 3.34Å; T346-F348 PolarHBondContact OG1-N 2.78Å | ||
| 349 | Q | 95.4 | Very high | 95.5 | Very high | 29 Ų | 29 | 58.3 Ų | 58.3 | 14% | 0.136 | 30% | 0.299 | C | S | . | . | trans | -127.6 | 3.1 | -168.2 | -67.7 | -73.2 | -32 | 0 | 0 | 112.3 | D158 V341 T346 K347 V351 R352 K353 | D158-Q349 PolarHBondContact OD1-N 3.12Å; D158-Q349 VanDerWaalsContact OD1-N 3.08Å; V341-Q349 PolarHBondContact O-NE2 3.47Å; V341-Q349 VanDerWaalsContact O-NE2 3.12Å; T346-Q349 PolarHBondContact O-NE2 2.73Å; T346-Q349 VanDerWaalsContact O-NE2 3.11Å; K347-Q349 PolarHBondContact O-N 3Å; Q349-V351 PolarHBondContact O-N 3.13Å; Q349-R352 PolarHBondContact O-N 2.97Å; Q349-K353 HydrophobicContact CB-CD 4.37Å; Q349-K353 WeakPolarHBondContact O-CB 3.44Å; Q349-K353 VanDerWaalsContact O-CG 3.29Å; Q349-K353 WeakPolarHBondContact O-CG 3.35Å; Q349-K353 PolarHBondContact O-N 2.71Å | ||
| 350 | A | 96.7 | Very high | 95.3 | Very high | 8 Ų | 8 | 60 Ų | 60 | 7% | 0.066 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -59.8 | -44.9 | -175.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | D158 I161 Q162 K353 K354 | D158-A350 WeakPolarHBondContact O-CB 3.42Å; D158-A350 WeakPolarHBondContact OD1-CB 3.41Å; D158-A350 PolarHBondContact OD1-N 3.48Å; I161-A350 HydrophobicContact CB-CB 4.03Å; I161-A350 HydrophobicContact CG2-CB 3.79Å; Q162-A350 HydrophobicContact CG-CB 3.85Å; A350-K353 PolarHBondContact O-N 3.5Å; A350-K354 WeakPolarHBondContact O-CB 3.3Å; A350-K354 PolarHBondContact O-N 3.01Å |
| 351 | V | 97.8 | Very high | 95.3 | Very high | 2 Ų | 2 | 62.1 Ų | 62.1 | 1% | 0.012 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -62.9 | -51.8 | 178.8 | -176.7 | 0 | 0 | 0 | 0 | 111 | I161 Y276 E279 L280 L283 Q349 K353 K354 Y355 | I161-V351 HydrophobicContact CD1-CG2 3.61Å; I161-V351 HydrophobicContact CG2-CG2 4.43Å; Y276-V351 HydrophobicContact CD2-CG1 3.91Å; Y276-V351 HydrophobicContact CE2-CG1 3.97Å; E279-V351 HydrophobicContact CB-CG1 3.95Å; E279-V351 HydrophobicContact CG-CG1 4.04Å; E279-V351 HydrophobicContact CG-CG2 4.11Å; L280-V351 HydrophobicContact CD2-CB 3.89Å; L280-V351 HydrophobicContact CD2-CG1 3.83Å; L280-V351 HydrophobicContact CD2-CG2 4.49Å; L280-V351 HydrophobicContact CG-CG1 4.24Å; L283-V351 HydrophobicContact CD1-CG2 3.51Å; Q349-V351 PolarHBondContact O-N 3.13Å; V351-K353 VanDerWaalsContact C-N 3.3Å; V351-K353 PolarHBondContact O-N 3.24Å; V351-K354 WeakPolarHBondContact O-CB 3.23Å; V351-K354 PolarHBondContact O-N 3.48Å; V351-K354 VanDerWaalsContact O-N 3.1Å; V351-Y355 HydrophobicContact CG1-CD2 3.79Å; V351-Y355 HydrophobicContact CG1-CE2 3.95Å; V351-Y355 WeakPolarHBondContact O-CD2 3.24Å; V351-Y355 PolarHBondContact O-N 3.35Å |
| 352 | R | 97.3 | Very high | 95.4 | Very high | 77 Ų | 77 | 67.2 Ų | 67.2 | 29% | 0.291 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -58.3 | -42.4 | 178.4 | 175.6 | 164.1 | 177.5 | -88.7 | -0.3 | 112.1 | V341 Q349 Y355 S356 S364 | V341-R352 HydrophobicContact CG1-CB 3.64Å; V341-R352 HydrophobicContact CG1-CG 4.13Å; Q349-R352 PolarHBondContact O-N 2.97Å; R352-Y355 PolarHBondContact O-N 3.3Å; R352-S356 WeakPolarHBondContact O-CB 3.33Å; R352-S356 PolarHBondContact O-N 3.41Å; R352-S364 PolarHBondContact O-OG 3.18Å |
| 353 | K | 97.1 | Very high | 95.5 | Very high | 135 Ų | 135 | 65.6 Ų | 65.6 | 59% | 0.587 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -62.5 | -44 | 175.6 | -71.8 | 173.2 | -177.3 | 174.3 | 0 | 111.5 | Q349 A350 V351 Y355 S356 | Q349-K353 HydrophobicContact CB-CD 4.37Å; Q349-K353 WeakPolarHBondContact O-CB 3.44Å; Q349-K353 VanDerWaalsContact O-CG 3.29Å; Q349-K353 WeakPolarHBondContact O-CG 3.35Å; Q349-K353 PolarHBondContact O-N 2.71Å; A350-K353 PolarHBondContact O-N 3.5Å; V351-K353 VanDerWaalsContact C-N 3.3Å; V351-K353 PolarHBondContact O-N 3.24Å; K353-Y355 PolarHBondContact O-N 2.85Å; K353-S356 PolarHBondContact O-N 3.09Å; K353-S356 PolarHBondContact O-OG 2.9Å |
| 354 | K | 97.3 | Very high | 95.7 | Very high | 34 Ų | 34 | 61.1 Ų | 61.1 | 15% | 0.148 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -56.5 | -51.1 | 175.6 | 175.1 | 179.3 | 171.3 | -176.7 | 0 | 111.3 | I161 H164 E279 A350 V351 S356 S357 L360 | I161-K354 HydrophobicContact CG2-CD 4.42Å; H164-K354 PolarHBondContact CE1-NZ 2.84Å; H164-K354 PolarHBondContact ND1-NZ 2.84Å; E279-K354 VanDerWaalsContact CD-NZ 3.35Å; E279-K354 WeakPolarHBondContact OE1-CD 3.13Å; E279-K354 WeakPolarHBondContact OE1-CE 3.41Å; E279-K354 IonicContact OE1-NZ 3.21Å; E279-K354 PolarHBondContact OE1-NZ 2.67Å; E279-K354 IonicContact OE2-NZ 2.73Å; E279-K354 PolarHBondContact OE2-NZ 3.49Å; E279-K354 VanDerWaalsContact OE2-NZ 3.14Å; A350-K354 WeakPolarHBondContact O-CB 3.3Å; A350-K354 PolarHBondContact O-N 3.01Å; V351-K354 WeakPolarHBondContact O-CB 3.23Å; V351-K354 PolarHBondContact O-N 3.48Å; V351-K354 VanDerWaalsContact O-N 3.1Å; K354-S356 VanDerWaalsContact C-N 3.3Å; K354-S356 PolarHBondContact O-N 3.29Å; K354-S357 WeakPolarHBondContact O-CB 3.44Å; K354-S357 PolarHBondContact O-N 3.2Å; K354-L360 HydrophobicContact CG-CD1 4.05Å |
| 355 | Y | 98.2 | Very high | 95.9 | Very high | 1 Ų | 1 | 62.5 Ų | 62.5 | 0% | 0.004 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -79.2 | -5.7 | -177.6 | -76.7 | -95.3 | 0 | 0 | 0 | 114.8 | K275 Y276 E279 V351 R352 K353 S357 L360 K362 I363 S364 | K275-Y355 HydrophobicContact CB-CE1 4.2Å; K275-Y355 PolarHBondContact O-OH 3.42Å; Y276-Y355 HydrophobicContact CD2-CD1 4.23Å; Y276-Y355 AromaticContact CD2-CD2 3.79Å; Y276-Y355 HydrophobicContact CD2-CD2 3.79Å; Y276-Y355 HydrophobicContact CD2-CE2 4.49Å; Y276-Y355 AromaticContact CD2-CG 3.63Å; Y276-Y355 HydrophobicContact CD2-CG 3.63Å; Y276-Y355 HydrophobicContact CG-CD1 4.36Å; Y276-Y355 HydrophobicContact CG-CG 4.2Å; E279-Y355 HydrophobicContact CB-CE2 4.14Å; E279-Y355 HydrophobicContact CG-CE2 4.37Å; E279-Y355 WeakPolarHBondContact OE2-CE2 3.42Å; E279-Y355 PolarHBondContact OE2-OH 3.16Å; V351-Y355 HydrophobicContact CG1-CD2 3.79Å; V351-Y355 HydrophobicContact CG1-CE2 3.95Å; V351-Y355 WeakPolarHBondContact O-CD2 3.24Å; V351-Y355 PolarHBondContact O-N 3.35Å; R352-Y355 PolarHBondContact O-N 3.3Å; K353-Y355 PolarHBondContact O-N 2.85Å; Y355-S357 PolarHBondContact O-N 3.33Å; Y355-L360 HydrophobicContact CD1-CB 4.11Å; Y355-L360 HydrophobicContact CD1-CD1 3.78Å; Y355-L360 HydrophobicContact CD1-CG 4.39Å; Y355-L360 HydrophobicContact CD2-CD1 4.33Å; Y355-L360 HydrophobicContact CE1-CD1 4.05Å; Y355-L360 HydrophobicContact CE1-CD2 4.47Å; Y355-L360 HydrophobicContact CG-CD1 3.95Å; Y355-K362 CarbonylContact O-C 3.55Å; Y355-K362 WeakPolarHBondContact O-CA 3.07Å; Y355-I363 HydrophobicContact CD1-CG2 3.6Å; Y355-I363 HydrophobicContact CG-CG2 4.22Å; Y355-I363 PolarHBondContact O-N 2.85Å; Y355-I363 VanDerWaalsContact O-N 3.17Å; Y355-S364 VanDerWaalsContact C-OG 3.24Å; Y355-S364 PolarHBondContact O-OG 3.37Å |
| 356 | S | 97.2 | Very high | 96.1 | Very high | 45 Ų | 45 | 57.9 Ų | 57.9 | 32% | 0.315 | 29% | 0.287 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.1 | -7.9 | 169.2 | 72.9 | 0 | 0 | 0 | 0 | 113.7 | R352 K353 K354 K362 S364 | R352-S356 WeakPolarHBondContact O-CB 3.33Å; R352-S356 PolarHBondContact O-N 3.41Å; K353-S356 PolarHBondContact O-N 3.09Å; K353-S356 PolarHBondContact O-OG 2.9Å; K354-S356 VanDerWaalsContact C-N 3.3Å; K354-S356 PolarHBondContact O-N 3.29Å; S356-K362 WeakPolarHBondContact O-CG 3.37Å; S356-S364 WeakPolarHBondContact CA-OG 3.34Å; S356-S364 PolarHBondContact N-OG 3.17Å; S356-S364 VanDerWaalsContact N-OG 3.1Å |
| 357 | S | 96 | Very high | 96.3 | Very high | 50 Ų | 50 | 61 Ų | 61 | 35% | 0.35 | 31% | 0.308 | S | S | . | . | S | Bend | trans | -67 | 146.4 | 175.9 | 176.2 | 0 | 0 | 0 | 0 | 111.8 | K354 Y355 K359 L360 K362 | K354-S357 WeakPolarHBondContact O-CB 3.44Å; K354-S357 PolarHBondContact O-N 3.2Å; Y355-S357 PolarHBondContact O-N 3.33Å; S357-K359 PolarHBondContact O-N 2.86Å; S357-K359 PolarHBondContact OG-N 3.39Å; S357-L360 CarbonylContact O-C 3.33Å; S357-L360 PolarHBondContact O-N 2.86Å; S357-K362 PolarHBondContact O-N 3.45Å |
| 358 | S | 94.3 | Very high | 96.4 | Very high | 97 Ų | 97 | 57 Ų | 57 | 68% | 0.678 | 29% | 0.291 | S | S | * | . | G | 310 helix | trans | -60.1 | -29.1 | 172 | 52.8 | 0 | 0 | 0 | 0 | 112.8 | L360 M361 | S358-L360 PolarHBondContact O-N 3.38Å; S358-M361 PolarHBondContact O-N 2.92Å; S358-M361 VanDerWaalsContact O-N 3.1Å |
| 359 | K | 92.8 | Very high | 96.5 | Very high | 167 Ų | 167 | 55.3 Ų | 55.3 | 73% | 0.726 | 28% | 0.284 | S | S | * | . | G | 310 helix | trans | -59.7 | -25.2 | 174.5 | -173.8 | 177.2 | 179 | -179.4 | 0 | 112.5 | S357 | S357-K359 PolarHBondContact O-N 2.86Å; S357-K359 PolarHBondContact OG-N 3.39Å |
| 360 | L | 94.5 | Very high | 96.5 | Very high | 36 Ų | 36 | 58.6 Ų | 58.6 | 19% | 0.188 | 30% | 0.303 | C | S | . | . | G | 310 helix | trans | -115.2 | 31.6 | 179.8 | -63.4 | 173 | 0 | 0 | 0 | 111 | K354 Y355 S357 S358 K362 I363 | K354-L360 HydrophobicContact CG-CD1 4.05Å; Y355-L360 HydrophobicContact CD1-CB 4.11Å; Y355-L360 HydrophobicContact CD1-CD1 3.78Å; Y355-L360 HydrophobicContact CD1-CG 4.39Å; Y355-L360 HydrophobicContact CD2-CD1 4.33Å; Y355-L360 HydrophobicContact CE1-CD1 4.05Å; Y355-L360 HydrophobicContact CE1-CD2 4.47Å; Y355-L360 HydrophobicContact CG-CD1 3.95Å; S357-L360 CarbonylContact O-C 3.33Å; S357-L360 PolarHBondContact O-N 2.86Å; S358-L360 PolarHBondContact O-N 3.38Å; L360-K362 PolarHBondContact O-N 3.17Å; L360-I363 WeakPolarHBondContact O-CB 3.38Å; L360-I363 PolarHBondContact O-N 2.72Å |
| 361 | M | 95.9 | Very high | 96.5 | Very high | 84 Ų | 84 | 59.7 Ų | 59.7 | 41% | 0.414 | 31% | 0.31 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 57.3 | 16 | 178 | -60.5 | -177.7 | -68.6 | 0 | 0 | 115 | V268 T272 S358 I363 | V268-M361 HydrophobicContact CG1-CE 3.91Å; V268-M361 HydrophobicContact CG1-SD 4.15Å; V268-M361 WeakPolarHBondContact O-CE 3.3Å; T272-M361 HydrophobicContact CG2-CE 3.59Å; T272-M361 WeakPolarHBondContact OG1-CE 3.34Å; S358-M361 PolarHBondContact O-N 2.92Å; S358-M361 VanDerWaalsContact O-N 3.1Å; M361-I363 HydrophobicContact CE-CD1 4.45Å; M361-I363 PolarHBondContact O-N 3.14Å |
| 362 | K | 97.4 | Very high | 96.4 | Very high | 119 Ų | 119 | 63.3 Ų | 63.3 | 52% | 0.517 | 34% | 0.335 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 52.4 | 32 | -170.3 | -48.2 | -178.1 | 177.3 | 172.2 | 0 | 111.9 | Y355 S356 S357 L360 S364 L365 | Y355-K362 CarbonylContact O-C 3.55Å; Y355-K362 WeakPolarHBondContact O-CA 3.07Å; S356-K362 WeakPolarHBondContact O-CG 3.37Å; S357-K362 PolarHBondContact O-N 3.45Å; L360-K362 PolarHBondContact O-N 3.17Å; K362-S364 PolarHBondContact O-N 3.03Å; K362-S364 VanDerWaalsContact O-N 3.08Å; K362-L365 HydrophobicContact CB-CD1 4.23Å; K362-L365 HydrophobicContact CB-CG 4.49Å; K362-L365 WeakPolarHBondContact O-CB 3.48Å; K362-L365 PolarHBondContact O-N 2.98Å |
| 363 | I | 97.9 | Very high | 96.4 | Very high | 1 Ų | 1 | 62.3 Ų | 62.3 | 1% | 0.005 | 34% | 0.335 | C | S | . | . | G | 310 helix | trans | -59.4 | -28.8 | -167.4 | -157.3 | 73.7 | 0 | 0 | 0 | 113 | E269 T272 L273 Y276 Y355 L360 M361 L365 L366 L369 | E269-I363 HydrophobicContact CG-CD1 3.81Å; T272-I363 HydrophobicContact CG2-CB 4.14Å; T272-I363 HydrophobicContact CG2-CG1 4.35Å; T272-I363 HydrophobicContact CG2-CG2 3.99Å; L273-I363 HydrophobicContact CB-CD1 4.08Å; L273-I363 HydrophobicContact CB-CG1 3.7Å; L273-I363 HydrophobicContact CD1-CG1 4.18Å; Y276-I363 HydrophobicContact CG-CG2 4.32Å; Y355-I363 HydrophobicContact CD1-CG2 3.6Å; Y355-I363 HydrophobicContact CG-CG2 4.22Å; Y355-I363 PolarHBondContact O-N 2.85Å; Y355-I363 VanDerWaalsContact O-N 3.17Å; L360-I363 WeakPolarHBondContact O-CB 3.38Å; L360-I363 PolarHBondContact O-N 2.72Å; M361-I363 HydrophobicContact CE-CD1 4.45Å; M361-I363 PolarHBondContact O-N 3.14Å; I363-L365 PolarHBondContact O-N 2.99Å; I363-L366 HydrophobicContact CD1-CD1 3.37Å; I363-L366 HydrophobicContact CD1-CG 3.97Å; I363-L366 HydrophobicContact CG1-CD1 3.84Å; I363-L366 HydrophobicContact CG1-CG 4.37Å; I363-L366 WeakPolarHBondContact O-CB 3.36Å; I363-L366 WeakPolarHBondContact O-CG 3.4Å; I363-L366 PolarHBondContact O-N 3.03Å; I363-L369 WeakPolarHBondContact O-CD1 3.42Å |
| 364 | S | 97.7 | Very high | 96.4 | Very high | 1 Ų | 1 | 55.9 Ų | 55.9 | 1% | 0.007 | 31% | 0.307 | C | S | . | . | G | 310 helix | trans | -71.9 | -6.7 | 177.1 | 69.1 | 0 | 0 | 0 | 0 | 113.7 | R352 Y355 S356 K362 | R352-S364 PolarHBondContact O-OG 3.18Å; Y355-S364 VanDerWaalsContact C-OG 3.24Å; Y355-S364 PolarHBondContact O-OG 3.37Å; S356-S364 WeakPolarHBondContact CA-OG 3.34Å; S356-S364 PolarHBondContact N-OG 3.17Å; S356-S364 VanDerWaalsContact N-OG 3.1Å; K362-S364 PolarHBondContact O-N 3.03Å; K362-S364 VanDerWaalsContact O-N 3.08Å |
| 365 | L | 97.3 | Very high | 96.3 | Very high | 86 Ų | 86 | 57.6 Ų | 57.6 | 45% | 0.45 | 32% | 0.316 | S | S | . | . | G | 310 helix | trans | -103.5 | 5.5 | 176.7 | -53 | -176.1 | 0 | 0 | 0 | 112.1 | K362 I363 | K362-L365 HydrophobicContact CB-CD1 4.23Å; K362-L365 HydrophobicContact CB-CG 4.49Å; K362-L365 WeakPolarHBondContact O-CB 3.48Å; K362-L365 PolarHBondContact O-N 2.98Å; I363-L365 PolarHBondContact O-N 2.99Å |
| 366 | L | 96.6 | Very high | 96.3 | Very high | 24 Ų | 24 | 65 Ų | 65 | 13% | 0.126 | 35% | 0.348 | C | S | . | . | trans | -56.6 | 128.9 | 178 | -83.8 | -177.8 | 0 | 0 | 0 | 111.3 | L273 I363 Q368 L369 | L273-L366 HydrophobicContact CD1-CD1 4.4Å; L273-L366 HydrophobicContact CD2-CD1 4.09Å; I363-L366 HydrophobicContact CD1-CD1 3.37Å; I363-L366 HydrophobicContact CD1-CG 3.97Å; I363-L366 HydrophobicContact CG1-CD1 3.84Å; I363-L366 HydrophobicContact CG1-CG 4.37Å; I363-L366 WeakPolarHBondContact O-CB 3.36Å; I363-L366 WeakPolarHBondContact O-CG 3.4Å; I363-L366 PolarHBondContact O-N 3.03Å; L366-Q368 PolarHBondContact O-N 3.17Å; L366-L369 HydrophobicContact CB-CD1 4.18Å; L366-L369 HydrophobicContact CB-CG 4.25Å; L366-L369 WeakPolarHBondContact O-CB 3.35Å; L366-L369 PolarHBondContact O-N 3.47Å; L366-L369 VanDerWaalsContact O-N 3.08Å | ||
| 367 | P | 96.2 | Very high | 96.2 | Very high | 96 Ų | 96 | 64.1 Ų | 64.1 | 62% | 0.623 | 34% | 0.339 | S | S | * | . | G | 310 helix | trans | -56.7 | -31.3 | 176.7 | -26.5 | 34.7 | 0 | 0 | 0 | 113.7 | L369 N370 | P367-L369 PolarHBondContact O-N 3.24Å; P367-N370 PolarHBondContact O-N 3.18Å |
| 368 | Q | 96.1 | Very high | 96.3 | Very high | 67 Ų | 67 | 61.7 Ų | 61.7 | 31% | 0.313 | 32% | 0.323 | S | S | . | . | G | 310 helix | trans | -60 | -25.7 | 178.9 | -63.6 | 83.4 | -14.4 | 0 | 0 | 112.3 | L306 L366 N370 S371 | L306-Q368 HydrophobicContact CB-CB 4.4Å; L306-Q368 WeakPolarHBondContact O-CG 3.26Å; L366-Q368 PolarHBondContact O-N 3.17Å; Q368-N370 PolarHBondContact O-N 3.27Å; Q368-S371 WeakPolarHBondContact O-CB 3.39Å; Q368-S371 PolarHBondContact O-N 3.49Å; Q368-S371 VanDerWaalsContact O-N 3.08Å; Q368-S371 PolarHBondContact O-OG 3.19Å |
| 369 | L | 97 | Very high | 96.3 | Very high | 3 Ų | 3 | 58.8 Ų | 58.8 | 2% | 0.016 | 30% | 0.304 | C | S | . | . | G | 310 helix | trans | -68.5 | -14.2 | 174.3 | -67.8 | 168.6 | 0 | 0 | 0 | 113.3 | L273 Y276 L277 L306 V338 I363 L366 P367 | L273-L369 HydrophobicContact CD1-CD2 3.93Å; L273-L369 HydrophobicContact CD1-CG 4.46Å; Y276-L369 HydrophobicContact CD1-CD1 4.3Å; Y276-L369 HydrophobicContact CE1-CD1 3.74Å; Y276-L369 HydrophobicContact CE1-CD2 4.14Å; L277-L369 HydrophobicContact CD2-CD2 4.35Å; L306-L369 HydrophobicContact CD1-CD2 4.34Å; V338-L369 HydrophobicContact CG1-CB 4Å; V338-L369 HydrophobicContact CG1-CD2 3.85Å; V338-L369 WeakPolarHBondContact CG1-O 3.33Å; V338-L369 HydrophobicContact CG2-CD2 4.21Å; I363-L369 WeakPolarHBondContact O-CD1 3.42Å; L366-L369 HydrophobicContact CB-CD1 4.18Å; L366-L369 HydrophobicContact CB-CG 4.25Å; L366-L369 WeakPolarHBondContact O-CB 3.35Å; L366-L369 PolarHBondContact O-N 3.47Å; L366-L369 VanDerWaalsContact O-N 3.08Å; P367-L369 PolarHBondContact O-N 3.24Å |
| 370 | N | 95.7 | Very high | 96.4 | Very high | 98 Ų | 98 | 53.5 Ų | 53.5 | 52% | 0.524 | 29% | 0.287 | S | S | . | . | G | 310 helix | trans | -107.5 | 12.5 | 173.5 | -57.6 | -46.8 | 0 | 0 | 0 | 112.1 | N342 P367 Q368 | N342-N370 PolarHBondContact ND2-OD1 3.21Å; P367-N370 PolarHBondContact O-N 3.18Å; Q368-N370 PolarHBondContact O-N 3.27Å |
| 371 | S | 96.5 | Very high | 96.3 | Very high | 31 Ų | 31 | 53.3 Ų | 53.3 | 22% | 0.217 | 29% | 0.286 | C | S | . | . | S | Bend | trans | -69.3 | 164.3 | -178.2 | 67.8 | 0 | 0 | 0 | 0 | 112.6 | Q368 I373 I374 Q375 | Q368-S371 WeakPolarHBondContact O-CB 3.39Å; Q368-S371 PolarHBondContact O-N 3.49Å; Q368-S371 VanDerWaalsContact O-N 3.08Å; Q368-S371 PolarHBondContact O-OG 3.19Å; S371-I373 PolarHBondContact O-N 2.86Å; S371-I373 PolarHBondContact OG-N 3.08Å; S371-I374 PolarHBondContact O-N 2.89Å; S371-Q375 PolarHBondContact O-N 3.13Å |
| 372 | S | 95.9 | Very high | 95.9 | Very high | 77 Ų | 77 | 50.6 Ų | 50.6 | 54% | 0.538 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -62.1 | -23.7 | 173.5 | 65.3 | 0 | 0 | 0 | 0 | 113 | Q375 K376 | S372-Q375 PolarHBondContact O-N 3.16Å; S372-K376 VanDerWaalsContact O-CB 3.31Å; S372-K376 WeakPolarHBondContact O-CB 3.37Å; S372-K376 WeakPolarHBondContact O-CG 3.4Å; S372-K376 PolarHBondContact O-N 2.95Å |
| 373 | I | 96.3 | Very high | 94.6 | Very high | 56 Ų | 56 | 53.5 Ų | 53.5 | 29% | 0.287 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -63.3 | -51.4 | 176 | -63.1 | 171.2 | 0 | 0 | 0 | 109.8 | L305 L306 S371 Q375 K376 L377 | L305-I373 HydrophobicContact CD2-CG2 3.86Å; L305-I373 HydrophobicContact CG-CG2 4.14Å; L306-I373 HydrophobicContact CD2-CB 4.13Å; L306-I373 HydrophobicContact CD2-CG2 3.99Å; S371-I373 PolarHBondContact O-N 2.86Å; S371-I373 PolarHBondContact OG-N 3.08Å; I373-Q375 VanDerWaalsContact C-N 3.35Å; I373-Q375 PolarHBondContact O-N 3.1Å; I373-K376 PolarHBondContact O-N 2.97Å; I373-L377 HydrophobicContact CG2-CD1 4.05Å; I373-L377 WeakPolarHBondContact O-CB 3.47Å; I373-L377 WeakPolarHBondContact O-CG 3.28Å; I373-L377 PolarHBondContact O-N 3.05Å |
| 374 | I | 97.3 | Very high | 92.4 | Very high | 0 Ų | 0 | 61.5 Ų | 61.5 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -58.9 | -47.5 | 176.6 | -72 | -61.2 | 0 | 0 | 0 | 110.8 | L302 L306 A335 V338 V339 S371 K376 L377 A378 | L302-I374 HydrophobicContact CD1-CD1 4.25Å; L302-I374 HydrophobicContact CD2-CD1 4.34Å; L306-I374 HydrophobicContact CD1-CD1 3.86Å; L306-I374 HydrophobicContact CD1-CG1 4.33Å; L306-I374 HydrophobicContact CD2-CD1 3.88Å; L306-I374 HydrophobicContact CD2-CG1 3.73Å; L306-I374 HydrophobicContact CG-CD1 4.43Å; A335-I374 HydrophobicContact CB-CD1 4.11Å; A335-I374 HydrophobicContact CB-CG2 4.41Å; V338-I374 HydrophobicContact CB-CG2 4.33Å; V338-I374 HydrophobicContact CG1-CD1 4.42Å; V338-I374 HydrophobicContact CG1-CG1 4.48Å; V338-I374 HydrophobicContact CG1-CG2 4.02Å; V339-I374 HydrophobicContact CG2-CG2 3.46Å; V339-I374 VanDerWaalsContact CG2-CG2 3.46Å; S371-I374 PolarHBondContact O-N 2.89Å; I374-K376 PolarHBondContact O-N 3.33Å; I374-L377 PolarHBondContact O-N 3.38Å; I374-A378 VanDerWaalsContact O-CB 3.3Å; I374-A378 WeakPolarHBondContact O-CB 3.49Å; I374-A378 PolarHBondContact O-N 3.02Å |
| 375 | Q | 96.4 | Very high | 89.9 | Confident | 71 Ų | 71 | 67.6 Ų | 67.6 | 33% | 0.332 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -62.9 | -41.7 | -178.3 | -67.4 | -67.5 | -5 | 0 | 0 | 111.9 | E343 S371 S372 I373 A378 A379 | E343-Q375 PolarHBondContact OE1-NE2 2.49Å; S371-Q375 PolarHBondContact O-N 3.13Å; S372-Q375 PolarHBondContact O-N 3.16Å; I373-Q375 VanDerWaalsContact C-N 3.35Å; I373-Q375 PolarHBondContact O-N 3.1Å; Q375-A378 PolarHBondContact O-N 2.64Å; Q375-A379 WeakPolarHBondContact O-CB 3.05Å; Q375-A379 PolarHBondContact O-N 3.3Å |
| 376 | K | 96.7 | Very high | 89.5 | Confident | 155 Ų | 155 | 66.7 Ų | 66.7 | 67% | 0.674 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -65.3 | -42.4 | 176.1 | -75 | 173.3 | -176.4 | 179.9 | 0 | 112.5 | S372 I373 I374 | S372-K376 VanDerWaalsContact O-CB 3.31Å; S372-K376 WeakPolarHBondContact O-CB 3.37Å; S372-K376 WeakPolarHBondContact O-CG 3.4Å; S372-K376 PolarHBondContact O-N 2.95Å; I373-K376 PolarHBondContact O-N 2.97Å; I374-K376 PolarHBondContact O-N 3.33Å |
| 377 | L | 96.6 | Very high | 89.1 | Confident | 27 Ų | 27 | 68.9 Ų | 68.9 | 14% | 0.141 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -67.3 | -37.1 | 177.4 | -74.7 | 173.5 | 0 | 0 | 0 | 112.1 | L302 L305 M331 Q332 A335 I373 I374 P380 | L302-L377 HydrophobicContact CD1-CD1 3.6Å; L305-L377 HydrophobicContact CD2-CD1 4.46Å; M331-L377 HydrophobicContact CE-CD1 4.4Å; Q332-L377 WeakPolarHBondContact CB-O 3.35Å; Q332-L377 HydrophobicContact CG-CD2 4.28Å; Q332-L377 VanDerWaalsContact CG-O 3.28Å; Q332-L377 WeakPolarHBondContact CG-O 3.38Å; A335-L377 HydrophobicContact CB-CB 3.53Å; A335-L377 HydrophobicContact CB-CD1 4.49Å; I373-L377 HydrophobicContact CG2-CD1 4.05Å; I373-L377 WeakPolarHBondContact O-CB 3.47Å; I373-L377 WeakPolarHBondContact O-CG 3.28Å; I373-L377 PolarHBondContact O-N 3.05Å; I374-L377 PolarHBondContact O-N 3.38Å; L377-P380 WeakPolarHBondContact O-CD 3.05Å |
| 378 | A | 96.6 | Very high | 88.8 | Confident | 0 Ų | 0 | 67.4 Ų | 67.4 | 0% | 0 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -78.2 | -27.3 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | A335 V339 I374 Q375 L381 L382 | A335-A378 HydrophobicContact CB-CB 4.11Å; V339-A378 HydrophobicContact CB-CB 4.41Å; V339-A378 HydrophobicContact CG2-CB 3.7Å; I374-A378 VanDerWaalsContact O-CB 3.3Å; I374-A378 WeakPolarHBondContact O-CB 3.49Å; I374-A378 PolarHBondContact O-N 3.02Å; Q375-A378 PolarHBondContact O-N 2.64Å; A378-L381 PolarHBondContact O-N 3.23Å; A378-L382 HydrophobicContact CB-CD1 3.72Å; A378-L382 HydrophobicContact CB-CG 4.2Å; A378-L382 WeakPolarHBondContact O-CG 3.45Å; A378-L382 PolarHBondContact O-N 3.49Å; A378-L382 VanDerWaalsContact O-N 3.11Å |
| 379 | A | 95.2 | Very high | 88.3 | Confident | 35 Ų | 35 | 67.5 Ų | 67.5 | 29% | 0.289 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -52 | -39.7 | -172 | 0 | 0 | 0 | 0 | 0 | 115.8 | Q375 L381 K383 | Q375-A379 WeakPolarHBondContact O-CB 3.05Å; Q375-A379 PolarHBondContact O-N 3.3Å; A379-L381 VanDerWaalsContact C-N 3.26Å; A379-L381 PolarHBondContact O-N 3.13Å; A379-K383 WeakPolarHBondContact O-CG 3.39Å; A379-K383 PolarHBondContact O-N 3.1Å |
| 380 | P | 94 | Very high | 87.8 | Confident | 56 Ų | 56 | 71.5 Ų | 71.5 | 36% | 0.364 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -59.8 | -37.2 | 176.9 | -24.2 | 35.5 | 0 | 0 | 0 | 112.7 | L377 | L377-P380 WeakPolarHBondContact O-CD 3.05Å |
| 381 | L | 93 | Very high | 87.2 | Confident | 32 Ų | 32 | 69.7 Ų | 69.7 | 17% | 0.168 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -90.6 | -22.5 | -172.9 | -59.1 | 174.8 | 0 | 0 | 0 | 113.5 | Q332 Q333 K336 A378 A379 | Q332-L381 VanDerWaalsContact C-CD1 3.49Å; Q332-L381 HydrophobicContact CB-CD1 3.81Å; Q332-L381 HydrophobicContact CB-CG 4.47Å; Q333-L381 HydrophobicContact CB-CD1 4.46Å; Q333-L381 HydrophobicContact CG-CD1 3.99Å; K336-L381 HydrophobicContact CB-CB 4.37Å; K336-L381 HydrophobicContact CB-CD1 4.14Å; K336-L381 HydrophobicContact CD-CB 4.13Å; K336-L381 HydrophobicContact CD-CD1 4.34Å; K336-L381 HydrophobicContact CG-CB 4.28Å; A378-L381 PolarHBondContact O-N 3.23Å; A379-L381 VanDerWaalsContact C-N 3.26Å; A379-L381 PolarHBondContact O-N 3.13Å |
| 382 | L | 87.6 | Confident | 86.6 | Confident | 28 Ų | 28 | 72.5 Ų | 72.5 | 15% | 0.147 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -83.8 | -15.8 | 178.8 | -65.8 | 176.3 | 0 | 0 | 0 | 113.5 | K336 V339 L340 A378 S385 | K336-L382 HydrophobicContact CG-CD2 3.9Å; V339-L382 HydrophobicContact CB-CD1 4.1Å; V339-L382 HydrophobicContact CG1-CD1 3.63Å; V339-L382 HydrophobicContact CG2-CD1 4.37Å; L340-L382 HydrophobicContact CD2-CD2 4.12Å; L340-L382 HydrophobicContact CG-CD2 4.45Å; A378-L382 HydrophobicContact CB-CD1 3.72Å; A378-L382 HydrophobicContact CB-CG 4.2Å; A378-L382 WeakPolarHBondContact O-CG 3.45Å; A378-L382 PolarHBondContact O-N 3.49Å; A378-L382 VanDerWaalsContact O-N 3.11Å; L382-S385 PolarHBondContact O-OG 3.25Å |
| 383 | K | 69.1 | Low | 85.9 | Confident | 180 Ų | 180 | 72.2 Ų | 72.2 | 78% | 0.783 | 38% | 0.375 | S | S | * | . | S | Bend | trans | -82.7 | -19.4 | 175.5 | -71.2 | 176.6 | -176.9 | -177.7 | 0 | 112.8 | A379 | A379-K383 WeakPolarHBondContact O-CG 3.39Å; A379-K383 PolarHBondContact O-N 3.1Å |
| 384 | E | 52.5 | Low | 85 | Confident | 168 Ų | 168 | 73.5 Ų | 73.5 | 79% | 0.785 | 38% | 0.383 | S | S | * | . | trans | -94.7 | -4.6 | -179.1 | -65 | -178.4 | 168 | 0 | 0 | 113.1 | ||||
| 385 | S | 45.1 | Very low | 83.9 | Confident | 130 Ų | 130 | 80.2 Ų | 80.2 | 91% | 0.909 | 42% | 0.417 | S | S | * | . | trans | -101.8 | 0 | -172.8 | 66.9 | 0 | 0 | 0 | 0 | 114.7 | L382 | L382-S385 PolarHBondContact O-OG 3.25Š|
Retrieved 385 of 385 residues in 196.4 ms
(Link to these results)