| 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 | 36.3 | Very low | 34.7 | Very low | 236 Ų | 236 | 153.5 Ų | 153.5 | 100% | 1.163 | 84% | 0.844 | S | S | * | * | 0 | 118.1 | 0 | -71.2 | 169.5 | 172.2 | 0 | 0 | 105.9 | |||||
| 2 | T | 38.8 | Very low | 34.4 | Very low | 129 Ų | 129 | 147.3 Ų | 147.3 | 79% | 0.791 | 84% | 0.84 | S | S | * | * | cis | -175.1 | 114.7 | 10.7 | 3.8 | 0 | 0 | 0 | 0 | 102.3 | ||||
| 3 | Q | 29.6 | Very low | 34.2 | Very low | 193 Ų | 193 | 146.2 Ų | 146.2 | 90% | 0.902 | 83% | 0.83 | S | S | * | * | 50 | 124.1 | 86.2 | -82 | -82.8 | -16.8 | 0 | 0 | 115.8 | |||||
| 4 | G | 32.6 | Very low | 34 | Very low | 65 Ų | 65 | 147.4 Ų | 147.4 | 67% | 0.67 | 83% | 0.834 | S | S | * | * | trans | 106.4 | 135.3 | 154.1 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 5 | K | 38.2 | Very low | 33.8 | Very low | 210 Ų | 210 | 143.9 Ų | 143.9 | 91% | 0.913 | 82% | 0.823 | S | S | * | * | cis | -159.5 | 140.2 | 23.1 | -83.6 | -170.7 | 170.1 | -178.7 | 0 | 112.5 | ||||
| 6 | L | 37.2 | Very low | 33.8 | Very low | 156 Ų | 156 | 143.2 Ų | 143.2 | 82% | 0.817 | 82% | 0.822 | S | S | * | * | trans | -58.1 | 145.2 | 149.1 | -87.8 | 83.6 | 0 | 0 | 0 | 110.3 | ||||
| 7 | S | 34 | Very low | 33.6 | Very low | 125 Ų | 125 | 141.1 Ų | 141.1 | 87% | 0.874 | 82% | 0.817 | S | S | * | * | trans | -124.4 | 121.6 | 153.8 | -169.5 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 8 | L | 35.2 | Very low | 34.1 | Very low | 144 Ų | 144 | 137.9 Ų | 137.9 | 75% | 0.754 | 82% | 0.821 | S | S | * | * | trans | -85.9 | 142.5 | 177.1 | -89.9 | 155.2 | 0 | 0 | 0 | 110.2 | ||||
| 9 | A | 34.3 | Very low | 34.3 | Very low | 91 Ų | 91 | 140.6 Ų | 140.6 | 75% | 0.752 | 82% | 0.824 | S | S | * | * | trans | 40.5 | 114.7 | 137.2 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 10 | N | 33.5 | Very low | 34.7 | Very low | 167 Ų | 167 | 138.1 Ų | 138.1 | 89% | 0.893 | 82% | 0.82 | S | S | * | * | trans | -109.9 | 121.5 | 143.7 | -163.8 | 11.6 | 0 | 0 | 0 | 109.3 | ||||
| 11 | K | 31.9 | Very low | 35.1 | Very low | 173 Ų | 173 | 140.2 Ų | 140.2 | 75% | 0.752 | 83% | 0.827 | S | S | * | * | trans | -97.8 | 102.9 | -176.5 | -175.2 | -178.9 | -178 | 180 | 0 | 107.4 | ||||
| 12 | G | 30.7 | Very low | 35.9 | Very low | 78 Ų | 78 | 135.3 Ų | 135.3 | 80% | 0.804 | 81% | 0.81 | S | S | * | * | trans | -89.7 | 105.6 | 162.4 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 13 | N | 32.5 | Very low | 36.5 | Very low | 133 Ų | 133 | 133 Ų | 133 | 71% | 0.711 | 80% | 0.803 | S | S | * | * | trans | -72.8 | 124.2 | 165 | -109.1 | 16.4 | 0 | 0 | 0 | 107.7 | ||||
| 14 | D | 31.1 | Very low | 38.3 | Very low | 164 Ų | 164 | 129.4 Ų | 129.4 | 88% | 0.877 | 80% | 0.797 | S | S | * | * | trans | -147.3 | 135.4 | 137.1 | -115.9 | -18.8 | 0 | 0 | 0 | 110.4 | ||||
| 15 | S | 31.8 | Very low | 39.8 | Very low | 95 Ų | 95 | 131.9 Ų | 131.9 | 66% | 0.664 | 80% | 0.801 | S | S | * | * | trans | -97 | 153.7 | -165.6 | 31.1 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 16 | T | 32.6 | Very low | 40.9 | Very low | 132 Ų | 132 | 127.4 Ų | 127.4 | 81% | 0.81 | 79% | 0.794 | S | S | * | * | trans | 73.9 | 115.9 | 160.4 | 6.3 | 0 | 0 | 0 | 0 | 115 | ||||
| 17 | S | 31.3 | Very low | 42.2 | Very low | 107 Ų | 107 | 124.8 Ų | 124.8 | 75% | 0.748 | 79% | 0.786 | S | S | * | * | -170.6 | 150.1 | 66.1 | -56.2 | 0 | 0 | 0 | 0 | 109.6 | E19 | S17-E19 PolarHBondContact O-N 3.19Š| |||
| 18 | G | 43.2 | Very low | 43.7 | Very low | 85 Ų | 85 | 122.5 Ų | 122.5 | 88% | 0.876 | 77% | 0.766 | S | S | * | * | trans | -68.7 | 124.6 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 19 | E | 36.8 | Very low | 44.8 | Very low | 189 Ų | 189 | 123 Ų | 123 | 88% | 0.883 | 76% | 0.76 | S | S | * | * | trans | -123.1 | 129.2 | 162.6 | -87 | 179 | 115.8 | 0 | 0 | 109.3 | S17 L21 | S17-E19 PolarHBondContact O-N 3.19Å; E19-L21 PolarHBondContact O-N 3.32Å | ||
| 20 | A | 42.6 | Very low | 45.9 | Very low | 90 Ų | 90 | 124 Ų | 124 | 74% | 0.744 | 75% | 0.749 | S | S | * | * | trans | -62 | 131.9 | 179.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | V22 | A20-V22 PolarHBondContact O-N 3.24Š| ||
| 21 | L | 43.6 | Very low | 47.1 | Very low | 183 Ų | 183 | 122.2 Ų | 122.2 | 96% | 0.958 | 74% | 0.735 | S | S | * | * | trans | -61.3 | 98.5 | 168.3 | -91 | 130.3 | 0 | 0 | 0 | 109.6 | E19 | E19-L21 PolarHBondContact O-N 3.32Š| ||
| 22 | V | 52.8 | Low | 48.3 | Very low | 133 Ų | 133 | 117 Ų | 117 | 81% | 0.806 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -81.8 | 120 | 166.6 | -179.5 | 0 | 0 | 0 | 0 | 107.5 | A20 | A20-V22 PolarHBondContact O-N 3.24Š|
| 23 | A | 52.1 | Low | 49.5 | Very low | 80 Ų | 80 | 118.1 Ų | 118.1 | 66% | 0.661 | 71% | 0.711 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 144.8 | 173.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||
| 24 | P | 66.3 | Low | 50.4 | Low | 118 Ų | 118 | 116 Ų | 116 | 77% | 0.766 | 71% | 0.711 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 145.9 | 178.3 | 25.2 | -32.9 | 0 | 0 | 0 | 110.8 | ||
| 25 | P | 65.3 | Low | 51.1 | Low | 117 Ų | 117 | 111.2 Ų | 111.2 | 76% | 0.76 | 70% | 0.701 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 144.3 | 178.9 | 25.3 | -32.8 | 0 | 0 | 0 | 110.6 | ||
| 26 | P | 60.4 | Low | 51.8 | Low | 116 Ų | 116 | 111.1 Ų | 111.1 | 75% | 0.753 | 70% | 0.696 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 146.1 | 177.6 | 25.7 | -32.6 | 0 | 0 | 0 | 110.4 | ||
| 27 | P | 64.6 | Low | 52.7 | Low | 101 Ų | 101 | 109.6 Ų | 109.6 | 66% | 0.656 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 145.2 | -178.2 | 23 | -32.7 | 0 | 0 | 0 | 111.5 | ||
| 28 | T | 64.8 | Low | 53.9 | Low | 76 Ų | 76 | 109 Ų | 109 | 47% | 0.466 | 69% | 0.693 | S | S | . | * | P | Polyproline II helix | trans | -65.7 | 144.9 | 179 | -28.5 | 0 | 0 | 0 | 0 | 109.7 | E30 E31 A32 | T28-E30 PolarHBondContact O-N 2.95Å; T28-E31 PolarHBondContact N-OE2 2.89Å; T28-E31 PolarHBondContact O-N 2.97Å; T28-E31 PolarHBondContact OG1-OE2 3.39Å; T28-E31 VanDerWaalsContact OG1-OE2 3.07Å; T28-A32 PolarHBondContact O-N 3.18Å |
| 29 | Y | 59.2 | Low | 54.3 | Low | 156 Ų | 156 | 109.2 Ų | 109.2 | 61% | 0.612 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -54.9 | -31.2 | -175.8 | 73.3 | -88.7 | 0 | 0 | 0 | 113.2 | I33 | Y29-I33 HydrophobicContact CD2-CD1 4.3Å; Y29-I33 WeakPolarHBondContact O-CD1 3.49Å; Y29-I33 VanDerWaalsContact O-CG1 3.26Å; Y29-I33 WeakPolarHBondContact O-CG1 3.4Å |
| 30 | E | 57 | Low | 55.1 | Low | 111 Ų | 111 | 104.5 Ų | 104.5 | 52% | 0.519 | 67% | 0.665 | S | S | . | * | H | α-helix | trans | -70.2 | -36.3 | 175.7 | -93.9 | 144.1 | 179.5 | 0 | 0 | 113.7 | T28 A32 I33 A34 | T28-E30 PolarHBondContact O-N 2.95Å; E30-A32 VanDerWaalsContact C-N 3.35Å; E30-I33 WeakPolarHBondContact O-CG1 3.08Å; E30-I33 PolarHBondContact O-N 2.83Å; E30-A34 WeakPolarHBondContact O-CB 3.43Å; E30-A34 PolarHBondContact O-N 2.82Å |
| 31 | E | 59.7 | Low | 55.7 | Low | 130 Ų | 130 | 108.7 Ų | 108.7 | 61% | 0.607 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -73.8 | -28.8 | 176.7 | -72.2 | 173 | 136.3 | 0 | 0 | 111.9 | T28 I33 | T28-E31 PolarHBondContact N-OE2 2.89Å; T28-E31 PolarHBondContact O-N 2.97Å; T28-E31 PolarHBondContact OG1-OE2 3.39Å; T28-E31 VanDerWaalsContact OG1-OE2 3.07Å; E31-I33 VanDerWaalsContact C-N 3.32Å; E31-I33 PolarHBondContact O-N 3.22Å |
| 32 | A | 57 | Low | 56.5 | Low | 63 Ų | 63 | 105.4 Ų | 105.4 | 52% | 0.521 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -70.5 | -26.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | T28 E30 | T28-A32 PolarHBondContact O-N 3.18Å; E30-A32 VanDerWaalsContact C-N 3.35Å |
| 33 | I | 54.5 | Low | 57.1 | Low | 102 Ų | 102 | 103.1 Ų | 103.1 | 52% | 0.523 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -102.9 | -16.6 | -179.9 | 56.9 | -165.8 | 0 | 0 | 0 | 113.7 | Y29 E30 E31 G35 V36 | Y29-I33 HydrophobicContact CD2-CD1 4.3Å; Y29-I33 WeakPolarHBondContact O-CD1 3.49Å; Y29-I33 VanDerWaalsContact O-CG1 3.26Å; Y29-I33 WeakPolarHBondContact O-CG1 3.4Å; E30-I33 WeakPolarHBondContact O-CG1 3.08Å; E30-I33 PolarHBondContact O-N 2.83Å; E31-I33 VanDerWaalsContact C-N 3.32Å; E31-I33 PolarHBondContact O-N 3.22Å; I33-G35 PolarHBondContact O-N 2.79Å; I33-V36 WeakPolarHBondContact O-CB 3.44Å; I33-V36 PolarHBondContact O-N 2.99Å |
| 34 | A | 51.3 | Low | 58 | Low | 87 Ų | 87 | 103.2 Ų | 103.2 | 72% | 0.719 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.4 | -19.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114 | E30 | E30-A34 WeakPolarHBondContact O-CB 3.43Å; E30-A34 PolarHBondContact O-N 2.82Å |
| 35 | G | 46.1 | Very low | 58.2 | Low | 65 Ų | 65 | 102.2 Ų | 102.2 | 67% | 0.67 | 61% | 0.607 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.7 | -3.1 | 172.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | I33 S37 | I33-G35 PolarHBondContact O-N 2.79Å; G35-S37 PolarHBondContact O-N 3.12Å |
| 36 | V | 47.1 | Very low | 58.6 | Low | 93 Ų | 93 | 101.1 Ų | 101.1 | 56% | 0.564 | 59% | 0.593 | S | S | * | * | trans | -87.2 | 67.9 | 179.5 | -171.6 | 0 | 0 | 0 | 0 | 108.6 | I33 A38 | I33-V36 WeakPolarHBondContact O-CB 3.44Å; I33-V36 PolarHBondContact O-N 2.99Å; V36-A38 PolarHBondContact O-N 3.32Å; V36-A38 VanDerWaalsContact O-N 3.09Å | ||
| 37 | S | 51.8 | Low | 59.2 | Low | 99 Ų | 99 | 100.9 Ų | 100.9 | 69% | 0.692 | 59% | 0.585 | S | S | * | * | trans | -60 | 111.2 | 156.7 | 53.1 | 0 | 0 | 0 | 0 | 107.1 | G35 P39 | G35-S37 PolarHBondContact O-N 3.12Å; S37-P39 WeakPolarHBondContact O-CD 3.17Å; S37-P39 VanDerWaalsContact O-CG 3.3Å; S37-P39 WeakPolarHBondContact O-CG 3.33Å; S37-P39 VanDerWaalsContact O-N 3.17Å | ||
| 38 | A | 56.9 | Low | 59.5 | Low | 96 Ų | 96 | 99.1 Ų | 99.1 | 79% | 0.793 | 57% | 0.572 | S | S | * | * | trans | -29.9 | 108 | -175.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | V36 | V36-A38 PolarHBondContact O-N 3.32Å; V36-A38 VanDerWaalsContact O-N 3.09Å | ||
| 39 | P | 51.3 | Low | 59.6 | Low | 88 Ų | 88 | 101.6 Ų | 101.6 | 57% | 0.571 | 58% | 0.579 | S | S | * | * | trans | -129.8 | 85.1 | 169.4 | 33.7 | -12.5 | 0 | 0 | 0 | 109.2 | S37 | S37-P39 WeakPolarHBondContact O-CD 3.17Å; S37-P39 VanDerWaalsContact O-CG 3.3Å; S37-P39 WeakPolarHBondContact O-CG 3.33Å; S37-P39 VanDerWaalsContact O-N 3.17Å | ||
| 40 | C | 53.7 | Low | 60 | Low | 90 Ų | 90 | 100.8 Ų | 100.8 | 61% | 0.608 | 58% | 0.578 | S | S | * | * | S | Bend | trans | -163.7 | -19.2 | 164.6 | -153.8 | 0 | 0 | 0 | 0 | 112.6 | V44 | C40-V44 WeakPolarHBondContact O-CG2 3.35Å; C40-V44 PolarHBondContact O-N 3.06Å |
| 41 | Y | 55.3 | Low | 60.7 | Low | 178 Ų | 178 | 99.7 Ų | 99.7 | 70% | 0.698 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -77.5 | -47 | 177.5 | -141 | -92.6 | 0 | 0 | 0 | 111.8 | D43 V44 E45 | Y41-D43 PolarHBondContact O-N 3.44Å; Y41-V44 PolarHBondContact O-N 2.96Å; Y41-E45 HydrophobicContact CD1-CG 4.15Å; Y41-E45 HydrophobicContact CE1-CG 4.21Å; Y41-E45 VanDerWaalsContact CE1-OE1 3.23Å; Y41-E45 WeakPolarHBondContact CE1-OE1 3.19Å; Y41-E45 PolarHBondContact O-N 3.34Å |
| 42 | N | 58.8 | Low | 60.8 | Low | 115 Ų | 115 | 101.1 Ų | 101.1 | 62% | 0.615 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -65.8 | -35.1 | 179.9 | -68.8 | -13.7 | 0 | 0 | 0 | 113 | M46 | N42-M46 WeakPolarHBondContact O-CB 3.45Å; N42-M46 PolarHBondContact O-N 3.44Å |
| 43 | D | 66.7 | Low | 61.5 | Low | 85 Ų | 85 | 102 Ų | 102 | 46% | 0.455 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -71.6 | -38.5 | 178.3 | -67.3 | -43.3 | 0 | 0 | 0 | 111.7 | Y41 L47 | Y41-D43 PolarHBondContact O-N 3.44Å; D43-L47 WeakPolarHBondContact O-CB 3.39Å; D43-L47 WeakPolarHBondContact O-CD1 3.17Å; D43-L47 WeakPolarHBondContact O-CG 3.15Å; D43-L47 PolarHBondContact O-N 2.92Å |
| 44 | V | 71.3 | Confident | 62.5 | Low | 81 Ų | 81 | 101.2 Ų | 101.2 | 49% | 0.491 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -69.9 | -44.1 | 176.4 | 175.2 | 0 | 0 | 0 | 0 | 110.7 | C40 Y41 L47 T48 | C40-V44 WeakPolarHBondContact O-CG2 3.35Å; C40-V44 PolarHBondContact O-N 3.06Å; Y41-V44 PolarHBondContact O-N 2.96Å; V44-L47 PolarHBondContact O-N 3.34Å; V44-T48 HydrophobicContact CG1-CG2 4.41Å; V44-T48 WeakPolarHBondContact O-CB 3.43Å; V44-T48 VanDerWaalsContact O-CG2 3.27Å; V44-T48 WeakPolarHBondContact O-CG2 3.12Å; V44-T48 PolarHBondContact O-N 3.43Å; V44-T48 PolarHBondContact O-OG1 3.01Å |
| 45 | E | 70.1 | Confident | 63.9 | Low | 98 Ų | 98 | 98.6 Ų | 98.6 | 46% | 0.458 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -60.9 | -48 | 174.7 | -76.2 | -173.5 | 155 | 0 | 0 | 111.2 | Y41 L47 T48 E49 | Y41-E45 HydrophobicContact CD1-CG 4.15Å; Y41-E45 HydrophobicContact CE1-CG 4.21Å; Y41-E45 VanDerWaalsContact CE1-OE1 3.23Å; Y41-E45 WeakPolarHBondContact CE1-OE1 3.19Å; Y41-E45 PolarHBondContact O-N 3.34Å; E45-L47 PolarHBondContact O-N 3.49Å; E45-T48 WeakPolarHBondContact CA-OG1 3.32Å; E45-T48 PolarHBondContact O-N 3.39Å; E45-T48 PolarHBondContact O-OG1 3.26Å; E45-E49 WeakPolarHBondContact O-CB 3.4Å; E45-E49 PolarHBondContact O-N 3.11Å |
| 46 | M | 72.2 | Confident | 65.6 | Low | 94 Ų | 94 | 99.3 Ų | 99.3 | 46% | 0.463 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -59.7 | -47.6 | 176.6 | -176 | -162.6 | -64 | 0 | 0 | 111.9 | N42 T48 E49 F50 | N42-M46 WeakPolarHBondContact O-CB 3.45Å; N42-M46 PolarHBondContact O-N 3.44Å; M46-T48 VanDerWaalsContact C-N 3.33Å; M46-T48 PolarHBondContact O-N 3.39Å; M46-E49 PolarHBondContact O-N 3.36Å; M46-F50 HydrophobicContact CG-CD2 3.61Å; M46-F50 HydrophobicContact CG-CE2 3.38Å; M46-F50 WeakPolarHBondContact O-CB 3.46Å; M46-F50 WeakPolarHBondContact O-CD2 3.39Å; M46-F50 PolarHBondContact O-N 3.4Å; M46-F50 HydrophobicContact SD-CD2 4.41Å; M46-F50 HydrophobicContact SD-CE2 3.82Å |
| 47 | L | 73.4 | Confident | 67.3 | Low | 111 Ų | 111 | 99.1 Ų | 99.1 | 58% | 0.581 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -62.9 | -40.3 | 177.4 | -75.1 | 172.7 | 0 | 0 | 0 | 111.7 | D43 V44 E45 T51 | D43-L47 WeakPolarHBondContact O-CB 3.39Å; D43-L47 WeakPolarHBondContact O-CD1 3.17Å; D43-L47 WeakPolarHBondContact O-CG 3.15Å; D43-L47 PolarHBondContact O-N 2.92Å; V44-L47 PolarHBondContact O-N 3.34Å; E45-L47 PolarHBondContact O-N 3.49Å; L47-T51 VanDerWaalsContact O-CB 3.31Å; L47-T51 WeakPolarHBondContact O-CB 3.11Å; L47-T51 PolarHBondContact O-N 2.96Å; L47-T51 PolarHBondContact O-OG1 2.99Å |
| 48 | T | 71.8 | Confident | 68.7 | Low | 63 Ų | 63 | 97 Ų | 97 | 39% | 0.387 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -66.2 | -45 | 175.5 | 55.9 | 0 | 0 | 0 | 0 | 111.3 | V44 E45 M46 T51 W52 | V44-T48 HydrophobicContact CG1-CG2 4.41Å; V44-T48 WeakPolarHBondContact O-CB 3.43Å; V44-T48 VanDerWaalsContact O-CG2 3.27Å; V44-T48 WeakPolarHBondContact O-CG2 3.12Å; V44-T48 PolarHBondContact O-N 3.43Å; V44-T48 PolarHBondContact O-OG1 3.01Å; E45-T48 WeakPolarHBondContact CA-OG1 3.32Å; E45-T48 PolarHBondContact O-N 3.39Å; E45-T48 PolarHBondContact O-OG1 3.26Å; M46-T48 VanDerWaalsContact C-N 3.33Å; M46-T48 PolarHBondContact O-N 3.39Å; T48-T51 CarbonylContact O-C 3.54Å; T48-T51 WeakPolarHBondContact O-CA 3.48Å; T48-T51 WeakPolarHBondContact O-CB 3.39Å; T48-T51 PolarHBondContact O-N 2.9Å; T48-T51 VanDerWaalsContact O-N 3.08Å; T48-W52 PolarHBondContact O-N 3.38Å |
| 49 | E | 66.6 | Low | 70 | Confident | 129 Ų | 129 | 99.8 Ų | 99.8 | 60% | 0.603 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -59.4 | -48.9 | 178.1 | -166.8 | 173.2 | -165.7 | 0 | 0 | 111.2 | E45 M46 T51 W52 D53 | E45-E49 WeakPolarHBondContact O-CB 3.4Å; E45-E49 PolarHBondContact O-N 3.11Å; M46-E49 PolarHBondContact O-N 3.36Å; E49-T51 VanDerWaalsContact C-N 3.28Å; E49-T51 PolarHBondContact O-N 2.91Å; E49-W52 PolarHBondContact O-N 3.32Å; E49-D53 WeakPolarHBondContact O-CB 3.49Å; E49-D53 PolarHBondContact O-N 3.28Å |
| 50 | F | 66.7 | Low | 71.6 | Confident | 139 Ų | 139 | 99.9 Ų | 99.9 | 61% | 0.61 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -57.8 | -38.6 | 172.4 | -81.7 | -63.3 | 0 | 0 | 0 | 112.8 | M46 D54 | M46-F50 HydrophobicContact CG-CD2 3.61Å; M46-F50 HydrophobicContact CG-CE2 3.38Å; M46-F50 WeakPolarHBondContact O-CB 3.46Å; M46-F50 WeakPolarHBondContact O-CD2 3.39Å; M46-F50 PolarHBondContact O-N 3.4Å; M46-F50 HydrophobicContact SD-CD2 4.41Å; M46-F50 HydrophobicContact SD-CE2 3.82Å; F50-D54 WeakPolarHBondContact O-CB 3.29Å; F50-D54 PolarHBondContact O-N 3.3Å |
| 51 | T | 72 | Confident | 73.2 | Confident | 87 Ų | 87 | 96.2 Ų | 96.2 | 53% | 0.534 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -69.1 | -41.6 | 178.8 | -58.5 | 0 | 0 | 0 | 0 | 111.8 | L47 T48 E49 V55 | L47-T51 VanDerWaalsContact O-CB 3.31Å; L47-T51 WeakPolarHBondContact O-CB 3.11Å; L47-T51 PolarHBondContact O-N 2.96Å; L47-T51 PolarHBondContact O-OG1 2.99Å; T48-T51 CarbonylContact O-C 3.54Å; T48-T51 WeakPolarHBondContact O-CA 3.48Å; T48-T51 WeakPolarHBondContact O-CB 3.39Å; T48-T51 PolarHBondContact O-N 2.9Å; T48-T51 VanDerWaalsContact O-N 3.08Å; E49-T51 VanDerWaalsContact C-N 3.28Å; E49-T51 PolarHBondContact O-N 2.91Å; T51-V55 VanDerWaalsContact O-CG2 3.26Å; T51-V55 WeakPolarHBondContact O-CG2 3.49Å; T51-V55 PolarHBondContact O-N 3.5Å; T51-V55 VanDerWaalsContact O-N 3.14Å |
| 52 | W | 63.3 | Low | 74.7 | Confident | 161 Ų | 161 | 89.4 Ų | 89.4 | 61% | 0.61 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -67.8 | -42.1 | 177.8 | -71 | 114.4 | 0 | 0 | 0 | 111.5 | T48 E49 V55 N56 | T48-W52 PolarHBondContact O-N 3.38Å; E49-W52 PolarHBondContact O-N 3.32Å; W52-V55 PolarHBondContact O-N 3.38Å; W52-N56 WeakPolarHBondContact O-CB 3.41Å; W52-N56 PolarHBondContact O-N 3.48Å; W52-N56 PolarHBondContact O-ND2 2.77Å; W52-N56 VanDerWaalsContact O-ND2 3.1Å |
| 53 | D | 71.3 | Confident | 76.1 | Confident | 82 Ų | 82 | 92.2 Ų | 92.2 | 44% | 0.439 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -62.8 | -46.3 | 176.7 | -80 | -18.8 | 0 | 0 | 0 | 111.6 | E49 V55 N56 I57 | E49-D53 WeakPolarHBondContact O-CB 3.49Å; E49-D53 PolarHBondContact O-N 3.28Å; D53-V55 VanDerWaalsContact C-N 3.31Å; D53-V55 PolarHBondContact O-N 3.39Å; D53-N56 PolarHBondContact O-N 3.46Å; D53-I57 HydrophobicContact CB-CD1 4.49Å; D53-I57 VanDerWaalsContact O-CB 3.32Å; D53-I57 WeakPolarHBondContact O-CB 3.41Å; D53-I57 WeakPolarHBondContact O-CD1 3.5Å; D53-I57 WeakPolarHBondContact O-CG1 3.3Å; D53-I57 PolarHBondContact O-N 3.06Å |
| 54 | D | 75.8 | Confident | 77.2 | Confident | 84 Ų | 84 | 92.7 Ų | 92.7 | 45% | 0.449 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -59 | -42.6 | 176.3 | -177.3 | 46.1 | 0 | 0 | 0 | 111.9 | F50 R58 | F50-D54 WeakPolarHBondContact O-CB 3.29Å; F50-D54 PolarHBondContact O-N 3.3Å; D54-R58 VanDerWaalsContact O-CB 3.23Å; D54-R58 WeakPolarHBondContact O-CB 3.29Å; D54-R58 PolarHBondContact O-N 3.14Å; D54-R58 IonicContact OD1-NH1 3.8Å; D54-R58 IonicContact OD2-NH1 2.89Å; D54-R58 PolarHBondContact OD2-NH1 3.43Å |
| 55 | V | 78.8 | Confident | 78.2 | Confident | 33 Ų | 33 | 88.8 Ų | 88.8 | 20% | 0.2 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -66.1 | -41.8 | 176.9 | 169.9 | 0 | 0 | 0 | 0 | 111.9 | T51 W52 D53 R58 R59 | T51-V55 VanDerWaalsContact O-CG2 3.26Å; T51-V55 WeakPolarHBondContact O-CG2 3.49Å; T51-V55 PolarHBondContact O-N 3.5Å; T51-V55 VanDerWaalsContact O-N 3.14Å; W52-V55 PolarHBondContact O-N 3.38Å; D53-V55 VanDerWaalsContact C-N 3.31Å; D53-V55 PolarHBondContact O-N 3.39Å; V55-R58 PolarHBondContact O-N 2.81Å; V55-R59 WeakPolarHBondContact O-CG 3.4Å; V55-R59 PolarHBondContact O-N 2.68Å |
| 56 | N | 82.8 | Confident | 79.2 | Confident | 79 Ų | 79 | 86 Ų | 86 | 42% | 0.422 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -68.8 | -46.3 | -179.8 | -74.2 | -31.9 | 0 | 0 | 0 | 111.5 | W52 D53 R58 R59 V60 | W52-N56 WeakPolarHBondContact O-CB 3.41Å; W52-N56 PolarHBondContact O-N 3.48Å; W52-N56 PolarHBondContact O-ND2 2.77Å; W52-N56 VanDerWaalsContact O-ND2 3.1Å; D53-N56 PolarHBondContact O-N 3.46Å; N56-R58 VanDerWaalsContact C-N 3.28Å; N56-R58 PolarHBondContact O-N 3.06Å; N56-R59 PolarHBondContact O-N 2.72Å; N56-V60 WeakPolarHBondContact O-CG2 3.48Å; N56-V60 PolarHBondContact O-N 2.63Å |
| 57 | I | 82.1 | Confident | 80.3 | Confident | 90 Ų | 90 | 84.5 Ų | 84.5 | 46% | 0.462 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -55.7 | -46.7 | 174.1 | -67.6 | 166.4 | 0 | 0 | 0 | 109.4 | D53 R59 V60 F61 P245 | D53-I57 HydrophobicContact CB-CD1 4.49Å; D53-I57 VanDerWaalsContact O-CB 3.32Å; D53-I57 WeakPolarHBondContact O-CB 3.41Å; D53-I57 WeakPolarHBondContact O-CD1 3.5Å; D53-I57 WeakPolarHBondContact O-CG1 3.3Å; D53-I57 PolarHBondContact O-N 3.06Å; I57-R59 PolarHBondContact O-N 2.87Å; I57-V60 PolarHBondContact O-N 3.15Å; I57-F61 WeakPolarHBondContact O-CB 3.08Å; I57-F61 PolarHBondContact O-N 3.15Å; I57-P245 HydrophobicContact CG2-CG 4.13Å |
| 58 | R | 81.9 | Confident | 81.3 | Confident | 53 Ų | 53 | 80.5 Ų | 80.5 | 20% | 0.2 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -62.9 | -42.6 | 178.9 | -172.3 | 153.4 | 72.9 | -122.2 | 1.1 | 112.8 | D54 V55 N56 V60 F61 I62 M236 | D54-R58 VanDerWaalsContact O-CB 3.23Å; D54-R58 WeakPolarHBondContact O-CB 3.29Å; D54-R58 PolarHBondContact O-N 3.14Å; D54-R58 IonicContact OD1-NH1 3.8Å; D54-R58 IonicContact OD2-NH1 2.89Å; D54-R58 PolarHBondContact OD2-NH1 3.43Å; V55-R58 PolarHBondContact O-N 2.81Å; N56-R58 VanDerWaalsContact C-N 3.28Å; N56-R58 PolarHBondContact O-N 3.06Å; R58-V60 VanDerWaalsContact C-N 3.35Å; R58-V60 PolarHBondContact O-N 3Å; R58-F61 PolarHBondContact O-N 3.05Å; R58-I62 HydrophobicContact CG-CD1 3.84Å; R58-I62 HydrophobicContact CG-CG1 4.39Å; R58-I62 WeakPolarHBondContact O-CB 3.48Å; R58-I62 WeakPolarHBondContact O-CG1 3.43Å; R58-I62 PolarHBondContact O-N 2.96Å; R58-M236 WeakPolarHBondContact CD-O 3.43Å; R58-M236 PolarHBondContact NE-O 3.47Å |
| 59 | R | 83.9 | Confident | 82.4 | Confident | 155 Ų | 155 | 77.7 Ų | 77.7 | 59% | 0.585 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -62.4 | -41.1 | 175.2 | -72.6 | 179.1 | -153.1 | -133.1 | 8.7 | 112.2 | V55 N56 I57 R63 | V55-R59 WeakPolarHBondContact O-CG 3.4Å; V55-R59 PolarHBondContact O-N 2.68Å; N56-R59 PolarHBondContact O-N 2.72Å; I57-R59 PolarHBondContact O-N 2.87Å; R59-R63 VanDerWaalsContact O-CB 3.3Å; R59-R63 WeakPolarHBondContact O-CB 3.49Å; R59-R63 PolarHBondContact O-N 2.87Å |
| 60 | V | 85.9 | Confident | 83.8 | Confident | 90 Ų | 90 | 77.1 Ų | 77.1 | 55% | 0.545 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -64.8 | -43.7 | 177 | 172.6 | 0 | 0 | 0 | 0 | 110.6 | N56 I57 R58 R63 K64 | N56-V60 WeakPolarHBondContact O-CG2 3.48Å; N56-V60 PolarHBondContact O-N 2.63Å; I57-V60 PolarHBondContact O-N 3.15Å; R58-V60 VanDerWaalsContact C-N 3.35Å; R58-V60 PolarHBondContact O-N 3Å; V60-R63 PolarHBondContact O-N 3.46Å; V60-K64 WeakPolarHBondContact O-CB 3Å; V60-K64 PolarHBondContact O-N 3.29Å |
| 61 | F | 85.8 | Confident | 85.2 | Confident | 14 Ų | 14 | 75.9 Ų | 75.9 | 6% | 0.061 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -59.8 | -50.3 | 174.8 | 169.8 | -103.7 | 0 | 0 | 0 | 112.2 | I57 R58 R63 K64 V65 L235 P245 Y248 | I57-F61 WeakPolarHBondContact O-CB 3.08Å; I57-F61 PolarHBondContact O-N 3.15Å; R58-F61 PolarHBondContact O-N 3.05Å; F61-R63 PolarHBondContact O-N 3.08Å; F61-K64 WeakPolarHBondContact O-CB 3.49Å; F61-K64 PolarHBondContact O-N 3.26Å; F61-K64 VanDerWaalsContact O-N 3.15Å; F61-V65 HydrophobicContact CE2-CG2 4.27Å; F61-V65 HydrophobicContact CZ-CG2 4.25Å; F61-V65 PolarHBondContact O-N 3.25Å; F61-L235 HydrophobicContact CD1-CD1 4.1Å; F61-L235 HydrophobicContact CE1-CD1 3.31Å; F61-L235 HydrophobicContact CE1-CG 4.3Å; F61-L235 HydrophobicContact CZ-CD1 3.79Å; F61-P245 HydrophobicContact CD2-CB 4.08Å; F61-P245 WeakPolarHBondContact CE2-O 3.4Å; F61-Y248 VanDerWaalsContact CE2-CA 3.49Å |
| 62 | I | 87.1 | Confident | 86.4 | Confident | 34 Ų | 34 | 72.1 Ų | 72.1 | 17% | 0.174 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -58.8 | -47.7 | 177 | -68.9 | 166.4 | 0 | 0 | 0 | 110.3 | R58 K64 V65 Y66 L235 | R58-I62 HydrophobicContact CG-CD1 3.84Å; R58-I62 HydrophobicContact CG-CG1 4.39Å; R58-I62 WeakPolarHBondContact O-CB 3.48Å; R58-I62 WeakPolarHBondContact O-CG1 3.43Å; R58-I62 PolarHBondContact O-N 2.96Å; I62-K64 VanDerWaalsContact C-N 3.28Å; I62-K64 PolarHBondContact O-N 3.02Å; I62-V65 PolarHBondContact O-N 3.24Å; I62-Y66 HydrophobicContact CG2-CD2 3.64Å; I62-Y66 HydrophobicContact CG2-CE2 3.82Å; I62-Y66 WeakPolarHBondContact O-CD2 3.4Å; I62-Y66 PolarHBondContact O-N 3.25Å; I62-L235 HydrophobicContact CG1-CG 4.34Å |
| 63 | R | 88.9 | Confident | 88 | Confident | 175 Ų | 175 | 66.4 Ų | 66.4 | 66% | 0.66 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -58.2 | -42.2 | 177.5 | -175.2 | -176.4 | -65.4 | 155.8 | -0.4 | 111.2 | R59 V60 F61 S67 | R59-R63 VanDerWaalsContact O-CB 3.3Å; R59-R63 WeakPolarHBondContact O-CB 3.49Å; R59-R63 PolarHBondContact O-N 2.87Å; V60-R63 PolarHBondContact O-N 3.46Å; F61-R63 PolarHBondContact O-N 3.08Å; R63-S67 VanDerWaalsContact O-CB 3.28Å; R63-S67 WeakPolarHBondContact O-CB 3.49Å; R63-S67 PolarHBondContact O-N 3.23Å; R63-S67 PolarHBondContact O-OG 3.14Å |
| 64 | K | 89.8 | Confident | 89.3 | Confident | 94 Ų | 94 | 68.1 Ų | 68.1 | 41% | 0.409 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -62.3 | -48.3 | 177.5 | -174.5 | 179.6 | -179.6 | -174.5 | 0 | 111.4 | V60 F61 I62 S67 I68 Y248 | V60-K64 WeakPolarHBondContact O-CB 3Å; V60-K64 PolarHBondContact O-N 3.29Å; F61-K64 WeakPolarHBondContact O-CB 3.49Å; F61-K64 PolarHBondContact O-N 3.26Å; F61-K64 VanDerWaalsContact O-N 3.15Å; I62-K64 VanDerWaalsContact C-N 3.28Å; I62-K64 PolarHBondContact O-N 3.02Å; K64-S67 PolarHBondContact O-N 3.35Å; K64-I68 HydrophobicContact CG-CD1 4.18Å; K64-I68 WeakPolarHBondContact O-CG1 3.44Å; K64-I68 PolarHBondContact O-N 3.46Å; K64-I68 VanDerWaalsContact O-N 3.09Å; K64-Y248 HydrophobicContact CD-CD2 4.39Å; K64-Y248 HydrophobicContact CD-CG 4.46Å; K64-Y248 VanDerWaalsContact NZ-CZ 3.27Å; K64-Y248 PolarHBondContact NZ-OH 3.46Å |
| 65 | V | 91.8 | Very high | 90.3 | Very high | 0 Ų | 0 | 66.1 Ų | 66.1 | 0% | 0 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -59.6 | -52.6 | 178.2 | 168.2 | 0 | 0 | 0 | 0 | 111.5 | F61 I62 S67 I68 L69 L235 T252 I255 | F61-V65 HydrophobicContact CE2-CG2 4.27Å; F61-V65 HydrophobicContact CZ-CG2 4.25Å; F61-V65 PolarHBondContact O-N 3.25Å; I62-V65 PolarHBondContact O-N 3.24Å; V65-S67 VanDerWaalsContact C-N 3.29Å; V65-S67 PolarHBondContact O-N 2.99Å; V65-I68 PolarHBondContact O-N 3.07Å; V65-L69 WeakPolarHBondContact O-CB 3.42Å; V65-L69 PolarHBondContact O-N 3.24Å; V65-L235 HydrophobicContact CB-CD1 3.95Å; V65-L235 HydrophobicContact CB-CD2 4.26Å; V65-L235 HydrophobicContact CG1-CD1 3.84Å; V65-L235 HydrophobicContact CG1-CD2 3.79Å; V65-L235 HydrophobicContact CG2-CD1 3.71Å; V65-T252 WeakPolarHBondContact CG1-OG1 3.46Å; V65-I255 HydrophobicContact CG1-CD1 4.49Å |
| 66 | Y | 92.2 | Very high | 91.2 | Very high | 38 Ų | 38 | 65.1 Ų | 65.1 | 15% | 0.149 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -65.2 | -31.9 | 179.8 | -83.2 | -79.5 | 0 | 0 | 0 | 112.8 | I62 L69 M70 T169 F173 T232 L235 | I62-Y66 HydrophobicContact CG2-CD2 3.64Å; I62-Y66 HydrophobicContact CG2-CE2 3.82Å; I62-Y66 WeakPolarHBondContact O-CD2 3.4Å; I62-Y66 PolarHBondContact O-N 3.25Å; Y66-L69 HydrophobicContact CD1-CD2 3.94Å; Y66-L69 HydrophobicContact CE1-CD2 4.13Å; Y66-L69 PolarHBondContact O-N 2.97Å; Y66-M70 WeakPolarHBondContact O-CB 3.45Å; Y66-M70 WeakPolarHBondContact O-CG 3.17Å; Y66-M70 PolarHBondContact O-N 3.43Å; Y66-T169 HydrophobicContact CE1-CG2 4.38Å; Y66-F173 HydrophobicContact CE2-CZ 4.03Å; Y66-T232 VanDerWaalsContact OH-CG2 3.23Å; Y66-T232 WeakPolarHBondContact OH-CG2 3.35Å; Y66-L235 HydrophobicContact CD2-CD2 4.07Å; Y66-L235 HydrophobicContact CE2-CD2 3.53Å |
| 67 | S | 94 | Very high | 91.8 | Very high | 63 Ų | 63 | 67 Ų | 67 | 44% | 0.441 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -64.7 | -44.5 | 175 | -59.5 | 0 | 0 | 0 | 0 | 111.5 | R63 K64 V65 M70 I71 | R63-S67 VanDerWaalsContact O-CB 3.28Å; R63-S67 WeakPolarHBondContact O-CB 3.49Å; R63-S67 PolarHBondContact O-N 3.23Å; R63-S67 PolarHBondContact O-OG 3.14Å; K64-S67 PolarHBondContact O-N 3.35Å; V65-S67 VanDerWaalsContact C-N 3.29Å; V65-S67 PolarHBondContact O-N 2.99Å; S67-M70 PolarHBondContact O-N 3.39Å; S67-I71 WeakPolarHBondContact O-CG1 3.43Å; S67-I71 PolarHBondContact O-N 3.14Å |
| 68 | I | 94.6 | Very high | 92.6 | Very high | 28 Ų | 28 | 64.9 Ų | 64.9 | 14% | 0.144 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -65.9 | -45.4 | 176.7 | -61.1 | 166.1 | 0 | 0 | 0 | 109.9 | K64 V65 M70 I71 Q72 L131 Y248 T252 | K64-I68 HydrophobicContact CG-CD1 4.18Å; K64-I68 WeakPolarHBondContact O-CG1 3.44Å; K64-I68 PolarHBondContact O-N 3.46Å; K64-I68 VanDerWaalsContact O-N 3.09Å; V65-I68 PolarHBondContact O-N 3.07Å; I68-M70 VanDerWaalsContact C-N 3.32Å; I68-M70 PolarHBondContact O-N 2.86Å; I68-I71 WeakPolarHBondContact O-CB 3.17Å; I68-I71 PolarHBondContact O-N 3.38Å; I68-I71 VanDerWaalsContact O-N 3.12Å; I68-Q72 HydrophobicContact CG2-CG 4.45Å; I68-Q72 WeakPolarHBondContact O-CG 3.31Å; I68-Q72 PolarHBondContact O-N 2.87Å; I68-L131 HydrophobicContact CG2-CD2 3.52Å; I68-Y248 HydrophobicContact CD1-CD2 3.73Å; I68-Y248 HydrophobicContact CD1-CE2 3.63Å; I68-T252 HydrophobicContact CB-CG2 4.08Å; I68-T252 HydrophobicContact CG2-CG2 3.79Å |
| 69 | L | 95.7 | Very high | 93.3 | Very high | 3 Ų | 3 | 64 Ų | 64 | 2% | 0.016 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -55.8 | -44.9 | 176.8 | -178.8 | 68.2 | 0 | 0 | 0 | 112.1 | V65 Y66 I71 Q72 L73 T252 I255 Y256 I259 | V65-L69 WeakPolarHBondContact O-CB 3.42Å; V65-L69 PolarHBondContact O-N 3.24Å; Y66-L69 HydrophobicContact CD1-CD2 3.94Å; Y66-L69 HydrophobicContact CE1-CD2 4.13Å; Y66-L69 PolarHBondContact O-N 2.97Å; L69-I71 VanDerWaalsContact C-N 3.3Å; L69-I71 PolarHBondContact O-N 3.34Å; L69-Q72 WeakPolarHBondContact O-CB 3.36Å; L69-Q72 PolarHBondContact O-N 3.12Å; L69-Q72 VanDerWaalsContact O-N 3.14Å; L69-L73 HydrophobicContact CD1-CD1 4.4Å; L69-L73 HydrophobicContact CD1-CG 4.39Å; L69-L73 HydrophobicContact CG-CD1 4.07Å; L69-L73 HydrophobicContact CG-CG 4.43Å; L69-L73 WeakPolarHBondContact O-CG 3.36Å; L69-L73 PolarHBondContact O-N 2.98Å; L69-T252 HydrophobicContact CB-CG2 4.31Å; L69-I255 HydrophobicContact CD1-CB 4.5Å; L69-I255 HydrophobicContact CD1-CG2 4.04Å; L69-I255 HydrophobicContact CD2-CG2 3.51Å; L69-I255 HydrophobicContact CG-CG2 4.43Å; L69-Y256 HydrophobicContact CD1-CD2 4.41Å; L69-I259 HydrophobicContact CD1-CD1 4.3Å; L69-I259 HydrophobicContact CD2-CD1 4.21Å |
| 70 | M | 95.6 | Very high | 93.9 | Very high | 117 Ų | 117 | 56.7 Ų | 56.7 | 58% | 0.576 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -61.9 | -38.8 | 178 | -73.1 | -65.6 | 164.4 | 0 | 0 | 112.1 | Y66 S67 I68 L74 | Y66-M70 WeakPolarHBondContact O-CB 3.45Å; Y66-M70 WeakPolarHBondContact O-CG 3.17Å; Y66-M70 PolarHBondContact O-N 3.43Å; S67-M70 PolarHBondContact O-N 3.39Å; I68-M70 VanDerWaalsContact C-N 3.32Å; I68-M70 PolarHBondContact O-N 2.86Å; M70-L74 VanDerWaalsContact O-CB 3.31Å; M70-L74 WeakPolarHBondContact O-CB 3.32Å; M70-L74 PolarHBondContact O-N 2.9Å |
| 71 | I | 96.9 | Very high | 94.4 | Very high | 114 Ų | 114 | 53.5 Ų | 53.5 | 59% | 0.585 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -64.2 | -44.6 | 173.8 | -65.2 | 166.3 | 0 | 0 | 0 | 110.2 | S67 I68 L69 L74 V75 | S67-I71 WeakPolarHBondContact O-CG1 3.43Å; S67-I71 PolarHBondContact O-N 3.14Å; I68-I71 WeakPolarHBondContact O-CB 3.17Å; I68-I71 PolarHBondContact O-N 3.38Å; I68-I71 VanDerWaalsContact O-N 3.12Å; L69-I71 VanDerWaalsContact C-N 3.3Å; L69-I71 PolarHBondContact O-N 3.34Å; I71-L74 PolarHBondContact O-N 2.83Å; I71-V75 WeakPolarHBondContact O-CG2 3.38Å; I71-V75 PolarHBondContact O-N 3.31Å |
| 72 | Q | 97.2 | Very high | 94.9 | Very high | 7 Ų | 7 | 56.2 Ų | 56.2 | 3% | 0.033 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -59.9 | -49.1 | 178.4 | -66.9 | -177.2 | -43.8 | 0 | 0 | 111.7 | I68 L69 L74 V75 T76 L131 T135 Y256 | I68-Q72 HydrophobicContact CG2-CG 4.45Å; I68-Q72 WeakPolarHBondContact O-CG 3.31Å; I68-Q72 PolarHBondContact O-N 2.87Å; L69-Q72 WeakPolarHBondContact O-CB 3.36Å; L69-Q72 PolarHBondContact O-N 3.12Å; L69-Q72 VanDerWaalsContact O-N 3.14Å; Q72-L74 VanDerWaalsContact C-N 3.31Å; Q72-L74 PolarHBondContact O-N 3.4Å; Q72-V75 WeakPolarHBondContact O-CB 3.4Å; Q72-V75 PolarHBondContact O-N 3.4Å; Q72-T76 PolarHBondContact O-N 3.24Å; Q72-T76 PolarHBondContact O-OG1 3.2Å; Q72-L131 VanDerWaalsContact NE2-CD1 3.25Å; Q72-L131 VanDerWaalsContact NE2-CG 3.27Å; Q72-T135 HydrophobicContact CB-CG2 3.81Å; Q72-T135 VanDerWaalsContact CD-OG1 3.32Å; Q72-T135 HydrophobicContact CG-CG2 3.94Å; Q72-T135 VanDerWaalsContact CG-OG1 3.28Å; Q72-T135 WeakPolarHBondContact CG-OG1 3.38Å; Q72-T135 PolarHBondContact NE2-OG1 3.39Å; Q72-Y256 HydrophobicContact CB-CD2 3.66Å; Q72-Y256 HydrophobicContact CB-CE2 3.75Å; Q72-Y256 HydrophobicContact CB-CG 4.34Å; Q72-Y256 VanDerWaalsContact OE1-CB 3.32Å |
| 73 | L | 96.3 | Very high | 95.2 | Very high | 42 Ų | 42 | 55.6 Ų | 55.6 | 22% | 0.22 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -63.7 | -36 | 178.9 | -66.8 | 174.8 | 0 | 0 | 0 | 112.3 | L69 T76 F77 Y256 I259 | L69-L73 HydrophobicContact CD1-CD1 4.4Å; L69-L73 HydrophobicContact CD1-CG 4.39Å; L69-L73 HydrophobicContact CG-CD1 4.07Å; L69-L73 HydrophobicContact CG-CG 4.43Å; L69-L73 WeakPolarHBondContact O-CG 3.36Å; L69-L73 PolarHBondContact O-N 2.98Å; L73-T76 PolarHBondContact O-N 3.45Å; L73-F77 VanDerWaalsContact O-CB 3.29Å; L73-F77 WeakPolarHBondContact O-CB 3.33Å; L73-F77 PolarHBondContact O-N 3.4Å; L73-Y256 HydrophobicContact CD2-CD2 3.95Å; L73-Y256 HydrophobicContact CD2-CE2 4.19Å; L73-Y256 HydrophobicContact CG-CD2 4.47Å; L73-I259 HydrophobicContact CD1-CD1 3.89Å; L73-I259 HydrophobicContact CD2-CB 4.19Å; L73-I259 HydrophobicContact CD2-CD1 4.31Å; L73-I259 HydrophobicContact CD2-CG2 3.64Å |
| 74 | L | 97.5 | Very high | 95.4 | Very high | 118 Ų | 118 | 47.3 Ų | 47.3 | 62% | 0.618 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -64.9 | -43.2 | 174.6 | -174.1 | 152 | 0 | 0 | 0 | 111.4 | M70 I71 Q72 F77 A78 | M70-L74 VanDerWaalsContact O-CB 3.31Å; M70-L74 WeakPolarHBondContact O-CB 3.32Å; M70-L74 PolarHBondContact O-N 2.9Å; I71-L74 PolarHBondContact O-N 2.83Å; Q72-L74 VanDerWaalsContact C-N 3.31Å; Q72-L74 PolarHBondContact O-N 3.4Å; L74-F77 PolarHBondContact O-N 2.97Å; L74-A78 WeakPolarHBondContact O-CB 3.28Å; L74-A78 PolarHBondContact O-N 2.93Å |
| 75 | V | 97.8 | Very high | 95.6 | Very high | 42 Ų | 42 | 49 Ų | 49 | 26% | 0.255 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -61.3 | -45.4 | 174.8 | 169.8 | 0 | 0 | 0 | 0 | 110.6 | I71 Q72 A78 I79 T135 L136 | I71-V75 WeakPolarHBondContact O-CG2 3.38Å; I71-V75 PolarHBondContact O-N 3.31Å; Q72-V75 WeakPolarHBondContact O-CB 3.4Å; Q72-V75 PolarHBondContact O-N 3.4Å; V75-A78 PolarHBondContact O-N 3.39Å; V75-I79 HydrophobicContact CG1-CD1 3.9Å; V75-I79 WeakPolarHBondContact O-CG1 3.42Å; V75-I79 PolarHBondContact O-N 2.84Å; V75-T135 HydrophobicContact CB-CG2 4.34Å; V75-T135 HydrophobicContact CG1-CG2 4.21Å; V75-L136 HydrophobicContact CG1-CD2 3.88Å |
| 76 | T | 97.5 | Very high | 95.7 | Very high | 12 Ų | 12 | 51.2 Ų | 51.2 | 7% | 0.074 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -60.2 | -48.5 | 176 | -49.9 | 0 | 0 | 0 | 0 | 111.8 | Q72 L73 A78 I79 V80 S139 Y256 V260 | Q72-T76 PolarHBondContact O-N 3.24Å; Q72-T76 PolarHBondContact O-OG1 3.2Å; L73-T76 PolarHBondContact O-N 3.45Å; T76-A78 VanDerWaalsContact C-N 3.31Å; T76-A78 PolarHBondContact O-N 3.19Å; T76-I79 PolarHBondContact O-N 2.89Å; T76-V80 HydrophobicContact CG2-CG2 4.26Å; T76-V80 WeakPolarHBondContact O-CB 3.39Å; T76-V80 VanDerWaalsContact O-CG2 3.28Å; T76-V80 WeakPolarHBondContact O-CG2 3.29Å; T76-V80 PolarHBondContact O-N 2.82Å; T76-S139 VanDerWaalsContact CA-OG 3.28Å; T76-S139 WeakPolarHBondContact CA-OG 3.31Å; T76-S139 WeakPolarHBondContact CB-OG 3.46Å; T76-S139 PolarHBondContact OG1-OG 3.42Å; T76-Y256 VanDerWaalsContact OG1-CE2 3.32Å; T76-Y256 WeakPolarHBondContact OG1-CE2 3.32Å; T76-Y256 PolarHBondContact OG1-OH 3.32Å; T76-V260 HydrophobicContact CG2-CG2 4.48Å |
| 77 | F | 96.4 | Very high | 95.7 | Very high | 119 Ų | 119 | 53.3 Ų | 53.3 | 52% | 0.522 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -58.5 | -44.1 | 177.8 | 174.7 | -97.6 | 0 | 0 | 0 | 111.4 | L73 L74 V80 A81 L158 | L73-F77 VanDerWaalsContact O-CB 3.29Å; L73-F77 WeakPolarHBondContact O-CB 3.33Å; L73-F77 PolarHBondContact O-N 3.4Å; L74-F77 PolarHBondContact O-N 2.97Å; F77-V80 PolarHBondContact O-N 2.84Å; F77-A81 WeakPolarHBondContact O-CB 3.34Å; F77-A81 PolarHBondContact O-N 2.88Å; F77-L158 HydrophobicContact CD2-CD1 4.14Å; F77-L158 HydrophobicContact CE2-CD1 4.11Å |
| 78 | A | 97.4 | Very high | 95.7 | Very high | 45 Ų | 45 | 54.8 Ų | 54.8 | 37% | 0.372 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -61.9 | -45.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | L74 V75 T76 A81 V82 | L74-A78 WeakPolarHBondContact O-CB 3.28Å; L74-A78 PolarHBondContact O-N 2.93Å; V75-A78 PolarHBondContact O-N 3.39Å; T76-A78 VanDerWaalsContact C-N 3.31Å; T76-A78 PolarHBondContact O-N 3.19Å; A78-A81 PolarHBondContact O-N 3.4Å; A78-V82 WeakPolarHBondContact O-CG2 3.24Å; A78-V82 PolarHBondContact O-N 2.97Å |
| 79 | I | 97.3 | Very high | 95.7 | Very high | 34 Ų | 34 | 55.7 Ų | 55.7 | 17% | 0.174 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -64.6 | -47.9 | 178.4 | -69.8 | 167 | 0 | 0 | 0 | 110.9 | V75 T76 A81 V82 F83 L136 S139 | V75-I79 HydrophobicContact CG1-CD1 3.9Å; V75-I79 WeakPolarHBondContact O-CG1 3.42Å; V75-I79 PolarHBondContact O-N 2.84Å; T76-I79 PolarHBondContact O-N 2.89Å; I79-A81 VanDerWaalsContact C-N 3.29Å; I79-A81 PolarHBondContact O-N 2.85Å; I79-V82 PolarHBondContact O-N 3.48Å; I79-F83 HydrophobicContact CG2-CD1 4.4Å; I79-F83 HydrophobicContact CG2-CD2 4.44Å; I79-F83 HydrophobicContact CG2-CE1 4.18Å; I79-F83 HydrophobicContact CG2-CE2 4.23Å; I79-F83 HydrophobicContact CG2-CZ 4.09Å; I79-F83 WeakPolarHBondContact O-CD1 3.13Å; I79-F83 WeakPolarHBondContact O-CG 3.48Å; I79-F83 PolarHBondContact O-N 3.37Å; I79-L136 HydrophobicContact CD1-CD2 4.09Å; I79-S139 VanDerWaalsContact CD1-CB 3.47Å; I79-S139 WeakPolarHBondContact CG2-O 3.47Å |
| 80 | V | 96.6 | Very high | 95.5 | Very high | 2 Ų | 2 | 55.9 Ų | 55.9 | 1% | 0.012 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -58 | -43.6 | 175.7 | 169.3 | 0 | 0 | 0 | 0 | 110.6 | T76 F77 F83 T84 T142 V154 L158 | T76-V80 HydrophobicContact CG2-CG2 4.26Å; T76-V80 WeakPolarHBondContact O-CB 3.39Å; T76-V80 VanDerWaalsContact O-CG2 3.28Å; T76-V80 WeakPolarHBondContact O-CG2 3.29Å; T76-V80 PolarHBondContact O-N 2.82Å; F77-V80 PolarHBondContact O-N 2.84Å; V80-F83 PolarHBondContact O-N 3.26Å; V80-T84 WeakPolarHBondContact O-CB 3.34Å; V80-T84 PolarHBondContact O-N 3.4Å; V80-T84 PolarHBondContact O-OG1 3.35Å; V80-T142 HydrophobicContact CG2-CG2 4.09Å; V80-V154 HydrophobicContact CG1-CG1 4.03Å; V80-L158 HydrophobicContact CG1-CD1 4.32Å |
| 81 | A | 95.3 | Very high | 95.4 | Very high | 22 Ų | 22 | 54.5 Ų | 54.5 | 18% | 0.182 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -62.8 | -48.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | F77 A78 I79 F83 T84 F85 | F77-A81 WeakPolarHBondContact O-CB 3.34Å; F77-A81 PolarHBondContact O-N 2.88Å; A78-A81 PolarHBondContact O-N 3.4Å; I79-A81 VanDerWaalsContact C-N 3.29Å; I79-A81 PolarHBondContact O-N 2.85Å; A81-F83 VanDerWaalsContact C-N 3.31Å; A81-F83 PolarHBondContact O-N 2.97Å; A81-T84 PolarHBondContact O-N 3.37Å; A81-F85 HydrophobicContact CB-CD2 4.06Å; A81-F85 HydrophobicContact CB-CE2 4.31Å; A81-F85 WeakPolarHBondContact O-CB 3.36Å; A81-F85 WeakPolarHBondContact O-CD2 3.31Å; A81-F85 PolarHBondContact O-N 2.83Å |
| 82 | V | 96.4 | Very high | 95.3 | Very high | 72 Ų | 72 | 55.2 Ų | 55.2 | 44% | 0.436 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -58.1 | -46 | 176.8 | 172.9 | 0 | 0 | 0 | 0 | 110.4 | A78 I79 T84 C86 V89 | A78-V82 WeakPolarHBondContact O-CG2 3.24Å; A78-V82 PolarHBondContact O-N 2.97Å; I79-V82 PolarHBondContact O-N 3.48Å; V82-T84 VanDerWaalsContact C-N 3.29Å; V82-T84 PolarHBondContact O-N 2.92Å; V82-C86 HydrophobicContact CG1-CB 4.4Å; V82-C86 WeakPolarHBondContact O-CA 3.47Å; V82-C86 WeakPolarHBondContact O-CB 3.3Å; V82-C86 PolarHBondContact O-N 3.41Å; V82-V89 HydrophobicContact CG1-CB 4.44Å; V82-V89 HydrophobicContact CG1-CG1 4.16Å; V82-V89 HydrophobicContact CG1-CG2 4.26Å |
| 83 | F | 94.7 | Very high | 95.1 | Very high | 21 Ų | 21 | 55.1 Ų | 55.1 | 9% | 0.092 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -72.2 | -25.5 | -177 | -71.6 | 18.8 | 0 | 0 | 0 | 112.3 | I79 V80 A81 V89 K90 I93 Y140 G143 | I79-F83 HydrophobicContact CG2-CD1 4.4Å; I79-F83 HydrophobicContact CG2-CD2 4.44Å; I79-F83 HydrophobicContact CG2-CE1 4.18Å; I79-F83 HydrophobicContact CG2-CE2 4.23Å; I79-F83 HydrophobicContact CG2-CZ 4.09Å; I79-F83 WeakPolarHBondContact O-CD1 3.13Å; I79-F83 WeakPolarHBondContact O-CG 3.48Å; I79-F83 PolarHBondContact O-N 3.37Å; V80-F83 PolarHBondContact O-N 3.26Å; A81-F83 VanDerWaalsContact C-N 3.31Å; A81-F83 PolarHBondContact O-N 2.97Å; F83-V89 HydrophobicContact CD1-CG1 3.66Å; F83-V89 HydrophobicContact CE1-CG1 3.79Å; F83-K90 WeakPolarHBondContact O-CB 3.46Å; F83-K90 WeakPolarHBondContact O-CE 3.42Å; F83-K90 WeakPolarHBondContact O-CG 3.47Å; F83-I93 HydrophobicContact CB-CD1 3.9Å; F83-I93 HydrophobicContact CD1-CD1 4.34Å; F83-I93 HydrophobicContact CD2-CD1 3.14Å; F83-I93 HydrophobicContact CE2-CD1 3.64Å; F83-I93 HydrophobicContact CE2-CG2 4.17Å; F83-I93 HydrophobicContact CG-CD1 3.56Å; F83-I93 HydrophobicContact CZ-CD1 4.41Å; F83-I93 HydrophobicContact CZ-CG2 4.15Å; F83-Y140 AromaticContact CE2-CD2 3.87Å; F83-Y140 HydrophobicContact CE2-CD2 3.87Å; F83-Y140 AromaticContact CE2-CE2 3.82Å; F83-Y140 HydrophobicContact CE2-CE2 3.82Å; F83-Y140 HydrophobicContact CE2-CG 4.41Å; F83-Y140 AromaticContact CZ-CD2 3.68Å; F83-Y140 HydrophobicContact CZ-CD2 3.68Å; F83-Y140 AromaticContact CZ-CE2 3.62Å; F83-Y140 HydrophobicContact CZ-CE2 3.62Å; F83-G143 VanDerWaalsContact CD2-C 3.4Å |
| 84 | T | 92.8 | Very high | 94.9 | Very high | 1 Ų | 1 | 56.2 Ų | 56.2 | 1% | 0.006 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -86.5 | -38.5 | 179.9 | -59.8 | 0 | 0 | 0 | 0 | 112.7 | V80 A81 V82 K90 T151 V154 | V80-T84 WeakPolarHBondContact O-CB 3.34Å; V80-T84 PolarHBondContact O-N 3.4Å; V80-T84 PolarHBondContact O-OG1 3.35Å; A81-T84 PolarHBondContact O-N 3.37Å; V82-T84 VanDerWaalsContact C-N 3.29Å; V82-T84 PolarHBondContact O-N 2.92Å; T84-K90 WeakPolarHBondContact O-CE 3.28Å; T84-K90 PolarHBondContact O-NZ 3.12Å; T84-T151 HydrophobicContact CG2-CG2 3.5Å; T84-T151 VanDerWaalsContact CG2-CG2 3.5Å; T84-V154 HydrophobicContact CG2-CB 4.33Å; T84-V154 HydrophobicContact CG2-CG1 4.33Å |
| 85 | F | 92.8 | Very high | 94.8 | Very high | 130 Ų | 130 | 55.8 Ų | 55.8 | 57% | 0.57 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -101 | -20.8 | -173 | -66 | -70.8 | 0 | 0 | 0 | 114.1 | A81 T151 V155 | A81-F85 HydrophobicContact CB-CD2 4.06Å; A81-F85 HydrophobicContact CB-CE2 4.31Å; A81-F85 WeakPolarHBondContact O-CB 3.36Å; A81-F85 WeakPolarHBondContact O-CD2 3.31Å; A81-F85 PolarHBondContact O-N 2.83Å; F85-T151 HydrophobicContact CD1-CG2 3.83Å; F85-T151 HydrophobicContact CE1-CG2 3.31Å; F85-T151 HydrophobicContact CZ-CG2 3.86Å; F85-V155 HydrophobicContact CZ-CG2 3.91Å |
| 86 | C | 95.1 | Very high | 94.6 | Very high | 46 Ų | 46 | 56.7 Ų | 56.7 | 31% | 0.311 | 31% | 0.305 | S | S | . | . | trans | -99.7 | 97.2 | 178.9 | -165 | 0 | 0 | 0 | 0 | 110.5 | V82 V89 K90 | V82-C86 HydrophobicContact CG1-CB 4.4Å; V82-C86 WeakPolarHBondContact O-CA 3.47Å; V82-C86 WeakPolarHBondContact O-CB 3.3Å; V82-C86 PolarHBondContact O-N 3.41Å; C86-V89 HydrophobicContact CB-CB 4.17Å; C86-V89 HydrophobicContact CB-CG2 4.11Å; C86-V89 PolarHBondContact O-N 2.88Å; C86-K90 WeakPolarHBondContact O-CB 3.11Å; C86-K90 PolarHBondContact O-N 3.44Å | ||
| 87 | D | 92.6 | Very high | 94.2 | Very high | 81 Ų | 81 | 59.7 Ų | 59.7 | 43% | 0.433 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -54.8 | -42.9 | -179.5 | -63.4 | -36.9 | 0 | 0 | 0 | 114.9 | V89 K90 D91 | D87-V89 VanDerWaalsContact C-N 3.31Å; D87-V89 PolarHBondContact O-N 3.22Å; D87-K90 WeakPolarHBondContact O-CB 3.28Å; D87-K90 PolarHBondContact O-N 3.12Å; D87-K90 IonicContact OD1-NZ 2.82Å; D87-K90 PolarHBondContact OD1-NZ 3.49Å; D87-D91 VanDerWaalsContact O-CG 3.29Å; D87-D91 PolarHBondContact O-N 3.26Å |
| 88 | P | 94.2 | Very high | 94.1 | Very high | 95 Ų | 95 | 56.5 Ų | 56.5 | 62% | 0.617 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -65.6 | -32.9 | 178.7 | 24.8 | -34.6 | 0 | 0 | 0 | 113.3 | Y92 | P88-Y92 WeakPolarHBondContact O-CB 3.45Å; P88-Y92 PolarHBondContact O-N 3.4Å |
| 89 | V | 93.7 | Very high | 93.8 | Very high | 47 Ų | 47 | 60.9 Ų | 60.9 | 29% | 0.285 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -70.2 | -44.3 | 174.7 | 176.6 | 0 | 0 | 0 | 0 | 109.7 | V82 F83 C86 D87 D91 Y92 I93 | V82-V89 HydrophobicContact CG1-CB 4.44Å; V82-V89 HydrophobicContact CG1-CG1 4.16Å; V82-V89 HydrophobicContact CG1-CG2 4.26Å; F83-V89 HydrophobicContact CD1-CG1 3.66Å; F83-V89 HydrophobicContact CE1-CG1 3.79Å; C86-V89 HydrophobicContact CB-CB 4.17Å; C86-V89 HydrophobicContact CB-CG2 4.11Å; C86-V89 PolarHBondContact O-N 2.88Å; D87-V89 VanDerWaalsContact C-N 3.31Å; D87-V89 PolarHBondContact O-N 3.22Å; V89-D91 PolarHBondContact O-N 2.96Å; V89-Y92 PolarHBondContact O-N 3.05Å; V89-I93 HydrophobicContact CG1-CG2 4.46Å; V89-I93 WeakPolarHBondContact O-CG1 3.35Å; V89-I93 WeakPolarHBondContact O-CG2 3.32Å; V89-I93 PolarHBondContact O-N 3.43Å |
| 90 | K | 91.7 | Very high | 93.7 | Very high | 7 Ų | 7 | 62.7 Ų | 62.7 | 3% | 0.03 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -56 | -49.1 | 177.2 | -170.2 | -173.3 | -67.3 | 152.9 | 0 | 112.3 | F83 T84 C86 D87 Y92 I93 Q94 | F83-K90 WeakPolarHBondContact O-CB 3.46Å; F83-K90 WeakPolarHBondContact O-CE 3.42Å; F83-K90 WeakPolarHBondContact O-CG 3.47Å; T84-K90 WeakPolarHBondContact O-CE 3.28Å; T84-K90 PolarHBondContact O-NZ 3.12Å; C86-K90 WeakPolarHBondContact O-CB 3.11Å; C86-K90 PolarHBondContact O-N 3.44Å; D87-K90 WeakPolarHBondContact O-CB 3.28Å; D87-K90 PolarHBondContact O-N 3.12Å; D87-K90 IonicContact OD1-NZ 2.82Å; D87-K90 PolarHBondContact OD1-NZ 3.49Å; K90-Y92 VanDerWaalsContact C-N 3.34Å; K90-Y92 PolarHBondContact O-N 3.24Å; K90-I93 WeakPolarHBondContact O-CG1 3.4Å; K90-I93 PolarHBondContact O-N 2.92Å; K90-Q94 WeakPolarHBondContact O-CB 3.43Å; K90-Q94 VanDerWaalsContact O-CG 3.3Å; K90-Q94 WeakPolarHBondContact O-CG 3.28Å; K90-Q94 PolarHBondContact O-N 3.42Å; K90-Q94 VanDerWaalsContact O-N 3.14Å |
| 91 | D | 93.1 | Very high | 93.5 | Very high | 87 Ų | 87 | 70.4 Ų | 70.4 | 47% | 0.465 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -66.4 | -38.9 | -179.3 | -65.7 | -15.3 | 0 | 0 | 0 | 111.2 | D87 V89 T95 | D87-D91 VanDerWaalsContact O-CG 3.29Å; D87-D91 PolarHBondContact O-N 3.26Å; V89-D91 PolarHBondContact O-N 2.96Å; D91-T95 WeakPolarHBondContact O-CB 3.15Å; D91-T95 PolarHBondContact O-N 2.81Å; D91-T95 PolarHBondContact O-OG1 2.88Å |
| 92 | Y | 94.3 | Very high | 93.5 | Very high | 129 Ų | 129 | 71.6 Ų | 71.6 | 51% | 0.506 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -62.2 | -48.3 | 177.9 | 178 | -96.1 | 0 | 0 | 0 | 112.4 | P88 V89 K90 T95 N96 | P88-Y92 WeakPolarHBondContact O-CB 3.45Å; P88-Y92 PolarHBondContact O-N 3.4Å; V89-Y92 PolarHBondContact O-N 3.05Å; K90-Y92 VanDerWaalsContact C-N 3.34Å; K90-Y92 PolarHBondContact O-N 3.24Å; Y92-T95 PolarHBondContact O-N 3.38Å; Y92-N96 PolarHBondContact O-N 3.3Å; Y92-N96 PolarHBondContact O-ND2 2.89Å |
| 93 | I | 93.9 | Very high | 93.5 | Very high | 6 Ų | 6 | 68.7 Ų | 68.7 | 3% | 0.031 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -69.2 | -34.2 | -178.1 | 62.8 | 175.9 | 0 | 0 | 0 | 112 | F83 V89 K90 N96 M144 | F83-I93 HydrophobicContact CB-CD1 3.9Å; F83-I93 HydrophobicContact CD1-CD1 4.34Å; F83-I93 HydrophobicContact CD2-CD1 3.14Å; F83-I93 HydrophobicContact CE2-CD1 3.64Å; F83-I93 HydrophobicContact CE2-CG2 4.17Å; F83-I93 HydrophobicContact CG-CD1 3.56Å; F83-I93 HydrophobicContact CZ-CD1 4.41Å; F83-I93 HydrophobicContact CZ-CG2 4.15Å; V89-I93 HydrophobicContact CG1-CG2 4.46Å; V89-I93 WeakPolarHBondContact O-CG1 3.35Å; V89-I93 WeakPolarHBondContact O-CG2 3.32Å; V89-I93 PolarHBondContact O-N 3.43Å; K90-I93 WeakPolarHBondContact O-CG1 3.4Å; K90-I93 PolarHBondContact O-N 2.92Å; I93-N96 CarbonylContact O-C 3.6Å; I93-N96 PolarHBondContact O-N 2.88Å; I93-M144 HydrophobicContact CB-CE 4.48Å; I93-M144 HydrophobicContact CB-SD 3.58Å; I93-M144 VanDerWaalsContact CB-SD 3.58Å; I93-M144 HydrophobicContact CD1-CE 4.17Å; I93-M144 HydrophobicContact CD1-SD 3.69Å; I93-M144 HydrophobicContact CG1-CE 3.95Å; I93-M144 HydrophobicContact CG1-SD 3.57Å; I93-M144 VanDerWaalsContact CG1-SD 3.57Å |
| 94 | Q | 92.6 | Very high | 93.5 | Very high | 64 Ų | 64 | 72.5 Ų | 72.5 | 30% | 0.299 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -68.8 | -36.3 | 176.6 | -73.1 | -179.2 | 1.9 | 0 | 0 | 112.1 | K90 N96 M144 S147 F148 | K90-Q94 WeakPolarHBondContact O-CB 3.43Å; K90-Q94 VanDerWaalsContact O-CG 3.3Å; K90-Q94 WeakPolarHBondContact O-CG 3.28Å; K90-Q94 PolarHBondContact O-N 3.42Å; K90-Q94 VanDerWaalsContact O-N 3.14Å; Q94-N96 VanDerWaalsContact C-N 3.31Å; Q94-M144 HydrophobicContact CB-CE 4.23Å; Q94-M144 HydrophobicContact CG-CE 3.44Å; Q94-M144 VanDerWaalsContact CG-CE 3.44Å; Q94-S147 PolarHBondContact NE2-O 2.89Å; Q94-S147 PolarHBondContact NE2-OG 2.93Å; Q94-S147 VanDerWaalsContact NE2-OG 3.15Å; Q94-F148 HydrophobicContact CB-CE1 4.47Å; Q94-F148 HydrophobicContact CG-CD1 4.41Å; Q94-F148 HydrophobicContact CG-CE1 3.85Å; Q94-F148 HydrophobicContact CG-CZ 4.05Å |
| 95 | T | 94.3 | Very high | 93.7 | Very high | 109 Ų | 109 | 76.7 Ų | 76.7 | 67% | 0.669 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -74.6 | -22.3 | 178.3 | -52.9 | 0 | 0 | 0 | 0 | 112.5 | D91 Y92 P97 | D91-T95 WeakPolarHBondContact O-CB 3.15Å; D91-T95 PolarHBondContact O-N 2.81Å; D91-T95 PolarHBondContact O-OG1 2.88Å; Y92-T95 PolarHBondContact O-N 3.38Å; T95-P97 WeakPolarHBondContact O-CD 3.38Å |
| 96 | N | 93.3 | Very high | 93.9 | Very high | 61 Ų | 61 | 73.4 Ų | 73.4 | 33% | 0.326 | 39% | 0.39 | S | S | . | . | trans | -118 | 69.3 | -175.4 | -65.6 | -83.4 | 0 | 0 | 0 | 112.2 | Y92 I93 Q94 G98 W99 | Y92-N96 PolarHBondContact O-N 3.3Å; Y92-N96 PolarHBondContact O-ND2 2.89Å; I93-N96 CarbonylContact O-C 3.6Å; I93-N96 PolarHBondContact O-N 2.88Å; Q94-N96 VanDerWaalsContact C-N 3.31Å; N96-G98 PolarHBondContact O-N 3.02Å; N96-W99 PolarHBondContact O-N 3.06Å | ||
| 97 | P | 89.7 | Confident | 94 | Very high | 76 Ų | 76 | 71.7 Ų | 71.7 | 49% | 0.494 | 38% | 0.377 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.6 | -13.3 | -178 | 27.8 | -36.1 | 0 | 0 | 0 | 113.7 | T95 W99 Y100 W101 | T95-P97 WeakPolarHBondContact O-CD 3.38Å; P97-W99 PolarHBondContact O-N 3.09Å; P97-Y100 WeakPolarHBondContact O-CB 3.38Å; P97-Y100 PolarHBondContact O-N 3.46Å; P97-W101 PolarHBondContact O-N 3.25Å |
| 98 | G | 93.8 | Very high | 94.1 | Very high | 51 Ų | 51 | 72.7 Ų | 72.7 | 53% | 0.526 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -56.3 | -35.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113 | N96 Y100 W101 A102 | N96-G98 PolarHBondContact O-N 3.02Å; G98-Y100 VanDerWaalsContact C-N 3.33Å; G98-Y100 PolarHBondContact O-N 2.94Å; G98-W101 PolarHBondContact O-N 3.37Å; G98-A102 WeakPolarHBondContact O-CB 3.38Å; G98-A102 PolarHBondContact O-N 2.81Å |
| 99 | W | 92.6 | Very high | 94.1 | Very high | 138 Ų | 138 | 72 Ų | 72 | 52% | 0.523 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -67.3 | -33.4 | 176.5 | -70.9 | 113.8 | 0 | 0 | 0 | 112.9 | N96 P97 A102 S103 Y140 | N96-W99 PolarHBondContact O-N 3.06Å; P97-W99 PolarHBondContact O-N 3.09Å; W99-A102 PolarHBondContact O-N 3.22Å; W99-S103 WeakPolarHBondContact O-CB 3.46Å; W99-S103 PolarHBondContact O-N 2.65Å; W99-S103 PolarHBondContact O-OG 3.38Å; W99-Y140 HydrophobicContact CB-CE1 4.07Å; W99-Y140 WeakPolarHBondContact CB-OH 3.2Å |
| 100 | Y | 93.4 | Very high | 94.2 | Very high | 72 Ų | 72 | 70.2 Ų | 70.2 | 28% | 0.282 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -63.3 | -49.8 | 174.3 | 176 | -101.1 | 0 | 0 | 0 | 110.9 | P97 G98 A102 S103 Y104 M141 M144 | P97-Y100 WeakPolarHBondContact O-CB 3.38Å; P97-Y100 PolarHBondContact O-N 3.46Å; G98-Y100 VanDerWaalsContact C-N 3.33Å; G98-Y100 PolarHBondContact O-N 2.94Å; Y100-A102 PolarHBondContact O-N 3.14Å; Y100-S103 PolarHBondContact O-N 2.81Å; Y100-S103 PolarHBondContact O-OG 3.3Å; Y100-Y104 PolarHBondContact O-N 2.85Å; Y100-M141 HydrophobicContact CD2-CG 4.46Å; Y100-M141 HydrophobicContact CE2-CB 4.18Å; Y100-M141 HydrophobicContact CE2-CG 4.22Å; Y100-M144 HydrophobicContact CD2-CB 4.11Å; Y100-M144 HydrophobicContact CD2-CG 3.88Å; Y100-M144 HydrophobicContact CG-CG 4.41Å |
| 101 | W | 94.1 | Very high | 94.3 | Very high | 163 Ų | 163 | 73.4 Ų | 73.4 | 62% | 0.617 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -63.2 | -39.9 | 177.1 | -71.4 | 108.2 | 0 | 0 | 0 | 112.9 | P97 G98 Y104 V105 | P97-W101 PolarHBondContact O-N 3.25Å; G98-W101 PolarHBondContact O-N 3.37Å; W101-Y104 WeakPolarHBondContact O-CB 3.35Å; W101-Y104 PolarHBondContact O-N 3.36Å; W101-V105 WeakPolarHBondContact O-CG2 3.3Å; W101-V105 PolarHBondContact O-N 2.98Å |
| 102 | A | 95.4 | Very high | 94.3 | Very high | 47 Ų | 47 | 72.6 Ų | 72.6 | 39% | 0.388 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -60.4 | -46.1 | 174 | 0 | 0 | 0 | 0 | 0 | 111.5 | G98 W99 Y100 Y104 V105 V106 | G98-A102 WeakPolarHBondContact O-CB 3.38Å; G98-A102 PolarHBondContact O-N 2.81Å; W99-A102 PolarHBondContact O-N 3.22Å; Y100-A102 PolarHBondContact O-N 3.14Å; A102-Y104 VanDerWaalsContact C-N 3.29Å; A102-Y104 PolarHBondContact O-N 2.9Å; A102-V105 PolarHBondContact O-N 2.69Å; A102-V106 WeakPolarHBondContact O-CG2 3.23Å; A102-V106 PolarHBondContact O-N 3.03Å |
| 103 | S | 95.8 | Very high | 94.2 | Very high | 12 Ų | 12 | 68.4 Ų | 68.4 | 8% | 0.084 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -61.9 | -36.8 | 176.6 | 71.8 | 0 | 0 | 0 | 0 | 112.5 | W99 Y100 V106 F107 Y140 M141 | W99-S103 WeakPolarHBondContact O-CB 3.46Å; W99-S103 PolarHBondContact O-N 2.65Å; W99-S103 PolarHBondContact O-OG 3.38Å; Y100-S103 PolarHBondContact O-N 2.81Å; Y100-S103 PolarHBondContact O-OG 3.3Å; S103-V106 PolarHBondContact O-N 3.45Å; S103-F107 VanDerWaalsContact O-CB 3.31Å; S103-F107 WeakPolarHBondContact O-CB 3.27Å; S103-F107 PolarHBondContact O-N 3.36Å; S103-Y140 WeakPolarHBondContact OG-CD1 3.4Å; S103-M141 WeakPolarHBondContact OG-CG 3.09Å |
| 104 | Y | 94.5 | Very high | 94 | Very high | 101 Ų | 101 | 68.1 Ų | 68.1 | 40% | 0.396 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -63.1 | -44.5 | 175.9 | -168.3 | -85.3 | 0 | 0 | 0 | 112.3 | Y100 W101 A102 F107 F108 M141 | Y100-Y104 PolarHBondContact O-N 2.85Å; W101-Y104 WeakPolarHBondContact O-CB 3.35Å; W101-Y104 PolarHBondContact O-N 3.36Å; A102-Y104 VanDerWaalsContact C-N 3.29Å; A102-Y104 PolarHBondContact O-N 2.9Å; Y104-F107 PolarHBondContact O-N 3Å; Y104-F108 WeakPolarHBondContact O-CB 3.46Å; Y104-F108 PolarHBondContact O-N 3.06Å; Y104-M141 HydrophobicContact CD2-CE 3.38Å; Y104-M141 HydrophobicContact CD2-SD 4.08Å; Y104-M141 HydrophobicContact CE2-CE 3.91Å; Y104-M141 HydrophobicContact CG-CE 4.37Å |
| 105 | V | 96.8 | Very high | 93.7 | Very high | 88 Ų | 88 | 66.4 Ų | 66.4 | 53% | 0.533 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -62.6 | -45.6 | 176.1 | 173.6 | 0 | 0 | 0 | 0 | 110.7 | W101 A102 F108 V109 | W101-V105 WeakPolarHBondContact O-CG2 3.3Å; W101-V105 PolarHBondContact O-N 2.98Å; A102-V105 PolarHBondContact O-N 2.69Å; V105-F108 PolarHBondContact O-N 3.37Å; V105-V109 HydrophobicContact CG1-CG2 4.35Å; V105-V109 WeakPolarHBondContact O-CB 3.48Å; V105-V109 VanDerWaalsContact O-CG2 3.31Å; V105-V109 WeakPolarHBondContact O-CG2 3.47Å; V105-V109 PolarHBondContact O-N 3.45Å |
| 106 | V | 97.4 | Very high | 93.5 | Very high | 61 Ų | 61 | 65.8 Ų | 65.8 | 37% | 0.37 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -61.6 | -45.7 | 177.8 | 173.7 | 0 | 0 | 0 | 0 | 111.1 | A102 S103 F108 T110 I133 | A102-V106 WeakPolarHBondContact O-CG2 3.23Å; A102-V106 PolarHBondContact O-N 3.03Å; S103-V106 PolarHBondContact O-N 3.45Å; V106-F108 PolarHBondContact O-N 2.9Å; V106-T110 HydrophobicContact CG1-CG2 4.4Å; V106-T110 WeakPolarHBondContact O-CB 3.06Å; V106-T110 WeakPolarHBondContact O-CG2 3.11Å; V106-T110 PolarHBondContact O-N 3.33Å; V106-T110 PolarHBondContact O-OG1 3.06Å; V106-I133 HydrophobicContact CG1-CG2 3.51Å |
| 107 | F | 96.4 | Very high | 93.2 | Very high | 11 Ų | 11 | 65.4 Ų | 65.4 | 5% | 0.048 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -55.9 | -51.3 | 175.4 | 167.2 | -101.2 | 0 | 0 | 0 | 111.3 | S103 Y104 T110 Y111 F134 S137 L138 M141 L257 | S103-F107 VanDerWaalsContact O-CB 3.31Å; S103-F107 WeakPolarHBondContact O-CB 3.27Å; S103-F107 PolarHBondContact O-N 3.36Å; Y104-F107 PolarHBondContact O-N 3Å; F107-T110 PolarHBondContact O-N 2.66Å; F107-T110 PolarHBondContact O-OG1 3.46Å; F107-T110 VanDerWaalsContact O-OG1 3.05Å; F107-Y111 WeakPolarHBondContact O-CB 3.39Å; F107-Y111 PolarHBondContact O-N 3.27Å; F107-F134 AromaticContact CD2-CD2 3.89Å; F107-F134 HydrophobicContact CD2-CD2 3.89Å; F107-F134 AromaticContact CD2-CE2 3.69Å; F107-F134 HydrophobicContact CD2-CE2 3.69Å; F107-F134 AromaticContact CE2-CD2 3.97Å; F107-F134 HydrophobicContact CE2-CD2 3.97Å; F107-F134 AromaticContact CE2-CE2 3.28Å; F107-F134 HydrophobicContact CE2-CE2 3.28Å; F107-F134 AromaticContact CE2-CZ 3.98Å; F107-F134 HydrophobicContact CE2-CZ 3.98Å; F107-F134 HydrophobicContact CZ-CE2 4.21Å; F107-S137 WeakPolarHBondContact CA-OG 3.37Å; F107-L138 HydrophobicContact CD2-CB 3.86Å; F107-L138 HydrophobicContact CD2-CD1 4.05Å; F107-L138 HydrophobicContact CD2-CG 4.4Å; F107-L138 HydrophobicContact CE2-CB 4.04Å; F107-L138 HydrophobicContact CE2-CD1 3.74Å; F107-L138 HydrophobicContact CE2-CD2 4.05Å; F107-L138 HydrophobicContact CE2-CG 4.15Å; F107-L138 HydrophobicContact CZ-CD1 4.22Å; F107-M141 HydrophobicContact CB-SD 3.81Å; F107-M141 HydrophobicContact CD1-SD 4.26Å; F107-M141 HydrophobicContact CG-SD 4.02Å; F107-L257 HydrophobicContact CE2-CD2 3.73Å; F107-L257 HydrophobicContact CZ-CD2 3.81Å |
| 108 | F | 94.6 | Very high | 92.9 | Very high | 102 Ų | 102 | 64.6 Ų | 64.6 | 45% | 0.447 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -64.6 | -45.7 | -176.7 | -171.6 | -105.1 | 0 | 0 | 0 | 112.3 | Y104 V105 V106 Y111 L112 | Y104-F108 WeakPolarHBondContact O-CB 3.46Å; Y104-F108 PolarHBondContact O-N 3.06Å; V105-F108 PolarHBondContact O-N 3.37Å; V106-F108 PolarHBondContact O-N 2.9Å; F108-Y111 PolarHBondContact O-N 3.24Å; F108-L112 HydrophobicContact CD1-CD1 3.84Å; F108-L112 HydrophobicContact CD1-CG 4.37Å; F108-L112 HydrophobicContact CE1-CD1 3.33Å; F108-L112 HydrophobicContact CE1-CG 4.09Å; F108-L112 HydrophobicContact CZ-CD1 3.73Å; F108-L112 HydrophobicContact CZ-CD2 4.38Å; F108-L112 HydrophobicContact CZ-CG 4.17Å; F108-L112 WeakPolarHBondContact O-CB 3.41Å; F108-L112 WeakPolarHBondContact O-CG 3.46Å; F108-L112 PolarHBondContact O-N 3.03Å |
| 109 | V | 95.9 | Very high | 92.4 | Very high | 80 Ų | 80 | 65 Ų | 65 | 49% | 0.485 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -63.5 | -44.4 | 178.5 | 172.1 | 0 | 0 | 0 | 0 | 111.3 | V105 L112 T113 | V105-V109 HydrophobicContact CG1-CG2 4.35Å; V105-V109 WeakPolarHBondContact O-CB 3.48Å; V105-V109 VanDerWaalsContact O-CG2 3.31Å; V105-V109 WeakPolarHBondContact O-CG2 3.47Å; V105-V109 PolarHBondContact O-N 3.45Å; V109-L112 PolarHBondContact O-N 3.28Å; V109-T113 WeakPolarHBondContact O-CB 3.43Å; V109-T113 PolarHBondContact O-N 2.9Å; V109-T113 PolarHBondContact O-OG1 2.88Å |
| 110 | T | 94.9 | Very high | 91.9 | Very high | 10 Ų | 10 | 60.3 Ų | 60.3 | 6% | 0.061 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -68.5 | -39.9 | 178.8 | 52 | 0 | 0 | 0 | 0 | 112.2 | V106 F107 T113 L114 I133 | V106-T110 HydrophobicContact CG1-CG2 4.4Å; V106-T110 WeakPolarHBondContact O-CB 3.06Å; V106-T110 WeakPolarHBondContact O-CG2 3.11Å; V106-T110 PolarHBondContact O-N 3.33Å; V106-T110 PolarHBondContact O-OG1 3.06Å; F107-T110 PolarHBondContact O-N 2.66Å; F107-T110 PolarHBondContact O-OG1 3.46Å; F107-T110 VanDerWaalsContact O-OG1 3.05Å; T110-T113 PolarHBondContact O-N 2.9Å; T110-L114 WeakPolarHBondContact O-CB 3.2Å; T110-L114 WeakPolarHBondContact O-CG 3.14Å; T110-L114 PolarHBondContact O-N 3.49Å; T110-I133 HydrophobicContact CG2-CB 4.22Å; T110-I133 HydrophobicContact CG2-CG2 3.66Å |
| 111 | Y | 93.6 | Very high | 91.5 | Very high | 74 Ų | 74 | 57.5 Ų | 57.5 | 29% | 0.29 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -59.3 | -48.4 | 172.9 | 174.6 | -102.4 | 0 | 0 | 0 | 111.9 | F107 F108 T113 L114 S115 F134 L253 L257 | F107-Y111 WeakPolarHBondContact O-CB 3.39Å; F107-Y111 PolarHBondContact O-N 3.27Å; F108-Y111 PolarHBondContact O-N 3.24Å; Y111-T113 VanDerWaalsContact C-N 3.33Å; Y111-T113 PolarHBondContact O-N 3.47Å; Y111-L114 PolarHBondContact O-N 3.06Å; Y111-S115 WeakPolarHBondContact CE2-OG 3.15Å; Y111-S115 VanDerWaalsContact O-CB 3.22Å; Y111-S115 WeakPolarHBondContact O-CB 3.19Å; Y111-S115 PolarHBondContact O-N 3.4Å; Y111-S115 PolarHBondContact O-OG 3.19Å; Y111-S115 VanDerWaalsContact O-OG 3.07Å; Y111-F134 HydrophobicContact CD2-CE2 4.14Å; Y111-L253 HydrophobicContact CD2-CD1 4.41Å; Y111-L253 HydrophobicContact CD2-CD2 3.85Å; Y111-L253 HydrophobicContact CE2-CD2 3.7Å; Y111-L257 HydrophobicContact CD2-CD1 3.87Å; Y111-L257 HydrophobicContact CE2-CD1 3.51Å |
| 112 | L | 92.8 | Very high | 91 | Very high | 70 Ų | 70 | 55.1 Ų | 55.1 | 37% | 0.366 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -62.3 | -41.3 | 177 | -73.4 | -176.6 | 0 | 0 | 0 | 111.8 | F108 V109 S115 C116 | F108-L112 HydrophobicContact CD1-CD1 3.84Å; F108-L112 HydrophobicContact CD1-CG 4.37Å; F108-L112 HydrophobicContact CE1-CD1 3.33Å; F108-L112 HydrophobicContact CE1-CG 4.09Å; F108-L112 HydrophobicContact CZ-CD1 3.73Å; F108-L112 HydrophobicContact CZ-CD2 4.38Å; F108-L112 HydrophobicContact CZ-CG 4.17Å; F108-L112 WeakPolarHBondContact O-CB 3.41Å; F108-L112 WeakPolarHBondContact O-CG 3.46Å; F108-L112 PolarHBondContact O-N 3.03Å; V109-L112 PolarHBondContact O-N 3.28Å; L112-S115 PolarHBondContact O-N 2.93Å; L112-C116 VanDerWaalsContact O-CB 3.23Å; L112-C116 WeakPolarHBondContact O-CB 3.15Å; L112-C116 PolarHBondContact O-N 3.34Å |
| 113 | T | 92.2 | Very high | 90.5 | Very high | 40 Ų | 40 | 58.2 Ų | 58.2 | 25% | 0.245 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -61.4 | -46.9 | 176.8 | -56.1 | 0 | 0 | 0 | 0 | 110.7 | V109 T110 Y111 C117 P120 L130 | V109-T113 WeakPolarHBondContact O-CB 3.43Å; V109-T113 PolarHBondContact O-N 2.9Å; V109-T113 PolarHBondContact O-OG1 2.88Å; T110-T113 PolarHBondContact O-N 2.9Å; Y111-T113 VanDerWaalsContact C-N 3.33Å; Y111-T113 PolarHBondContact O-N 3.47Å; T113-C117 WeakPolarHBondContact O-CA 3.09Å; T113-C117 WeakPolarHBondContact O-CB 3.41Å; T113-C117 PolarHBondContact O-N 2.95Å; T113-P120 HydrophobicContact CG2-CB 4.48Å; T113-P120 HydrophobicContact CG2-CG 4.39Å; T113-L130 HydrophobicContact CG2-CD1 3.99Å; T113-L130 HydrophobicContact CG2-CD2 4.49Å |
| 114 | L | 89.7 | Confident | 89.9 | Confident | 1 Ų | 1 | 65 Ų | 65 | 1% | 0.005 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -71.8 | -27.7 | -180 | -73 | 172.9 | 0 | 0 | 0 | 113.2 | T110 Y111 R121 L130 F134 V249 L253 | T110-L114 WeakPolarHBondContact O-CB 3.2Å; T110-L114 WeakPolarHBondContact O-CG 3.14Å; T110-L114 PolarHBondContact O-N 3.49Å; Y111-L114 PolarHBondContact O-N 3.06Å; L114-R121 HydrophobicContact CD2-CB 4.41Å; L114-R121 WeakPolarHBondContact O-CD 3.32Å; L114-R121 PolarHBondContact O-NE 2.86Å; L114-R121 PolarHBondContact O-NH1 2.88Å; L114-R121 VanDerWaalsContact O-NH1 3.17Å; L114-R121 PolarHBondContact O-NH2 3.18Å; L114-L130 HydrophobicContact CD1-CB 4.15Å; L114-L130 HydrophobicContact CD2-CB 3.74Å; L114-L130 HydrophobicContact CD2-CD1 4.05Å; L114-L130 HydrophobicContact CG-CB 4.05Å; L114-F134 HydrophobicContact CD1-CB 4.2Å; L114-F134 HydrophobicContact CD1-CG 4.49Å; L114-V249 HydrophobicContact CD2-CG1 4.05Å; L114-L253 HydrophobicContact CB-CD1 3.57Å; L114-L253 HydrophobicContact CD1-CD1 3.56Å; L114-L253 HydrophobicContact CG-CD1 4.2Å |
| 115 | S | 87.6 | Confident | 89.7 | Confident | 27 Ų | 27 | 63.1 Ų | 63.1 | 19% | 0.189 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -87.7 | -43.2 | -179.2 | -68.6 | 0 | 0 | 0 | 0 | 112.8 | Y111 L112 R121 | Y111-S115 WeakPolarHBondContact CE2-OG 3.15Å; Y111-S115 VanDerWaalsContact O-CB 3.22Å; Y111-S115 WeakPolarHBondContact O-CB 3.19Å; Y111-S115 PolarHBondContact O-N 3.4Å; Y111-S115 PolarHBondContact O-OG 3.19Å; Y111-S115 VanDerWaalsContact O-OG 3.07Å; L112-S115 PolarHBondContact O-N 2.93Å; S115-R121 VanDerWaalsContact C-NH2 3.32Å; S115-R121 PolarHBondContact O-NH2 3.37Å |
| 116 | C | 88.3 | Confident | 89.3 | Confident | 96 Ų | 96 | 65.9 Ų | 65.9 | 65% | 0.649 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -93.7 | -24.7 | -174 | -57.9 | 0 | 0 | 0 | 0 | 113.5 | L112 | L112-C116 VanDerWaalsContact O-CB 3.23Å; L112-C116 WeakPolarHBondContact O-CB 3.15Å; L112-C116 PolarHBondContact O-N 3.34Å |
| 117 | C | 87.8 | Confident | 89 | Confident | 54 Ų | 54 | 63.1 Ų | 63.1 | 37% | 0.365 | 33% | 0.331 | S | S | . | . | trans | -107.2 | 113.8 | -177.2 | -51.4 | 0 | 0 | 0 | 0 | 110.9 | T113 P120 R121 | T113-C117 WeakPolarHBondContact O-CA 3.09Å; T113-C117 WeakPolarHBondContact O-CB 3.41Å; T113-C117 PolarHBondContact O-N 2.95Å; C117-P120 HydrophobicContact CB-CG 4.04Å; C117-R121 PolarHBondContact O-NH2 3.37Å | ||
| 118 | S | 82.6 | Confident | 88.7 | Confident | 59 Ų | 59 | 66 Ų | 66 | 41% | 0.413 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -77.2 | -30.7 | 178.1 | -55 | 0 | 0 | 0 | 0 | 112.7 | R121 R122 | S118-R121 PolarHBondContact O-N 3.46Å; S118-R122 WeakPolarHBondContact O-CB 3.22Å; S118-R122 WeakPolarHBondContact O-CG 3.49Å; S118-R122 PolarHBondContact O-N 3.45Å |
| 119 | A | 84.8 | Confident | 88.6 | Confident | 60 Ų | 60 | 64.7 Ų | 64.7 | 50% | 0.496 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -64.1 | -52.7 | -176.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | R121 R122 Q123 | A119-R121 VanDerWaalsContact C-N 3.28Å; A119-R121 PolarHBondContact O-N 3.09Å; A119-R122 PolarHBondContact O-N 2.96Å; A119-Q123 WeakPolarHBondContact O-CB 3.43Å; A119-Q123 VanDerWaalsContact O-CG 3.3Å; A119-Q123 WeakPolarHBondContact O-CG 3.49Å; A119-Q123 PolarHBondContact O-N 2.82Å |
| 120 | P | 81.7 | Confident | 88.5 | Confident | 38 Ų | 38 | 62 Ų | 62 | 25% | 0.247 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -66.4 | -29.8 | 178 | -20.1 | 33.8 | 0 | 0 | 0 | 113.2 | T113 C117 N127 L130 | T113-P120 HydrophobicContact CG2-CB 4.48Å; T113-P120 HydrophobicContact CG2-CG 4.39Å; C117-P120 HydrophobicContact CB-CG 4.04Å; P120-N127 WeakPolarHBondContact O-CA 3.31Å; P120-N127 PolarHBondContact O-N 3.29Å; P120-L130 HydrophobicContact CB-CD1 3.64Å |
| 121 | R | 83.9 | Confident | 88.5 | Confident | 14 Ų | 14 | 61.8 Ų | 61.8 | 5% | 0.053 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -71.4 | -31.3 | 178.9 | 171 | 174 | 27.6 | -173.8 | -15 | 113.2 | L114 S115 C117 S118 A119 N127 V249 | L114-R121 HydrophobicContact CD2-CB 4.41Å; L114-R121 WeakPolarHBondContact O-CD 3.32Å; L114-R121 PolarHBondContact O-NE 2.86Å; L114-R121 PolarHBondContact O-NH1 2.88Å; L114-R121 VanDerWaalsContact O-NH1 3.17Å; L114-R121 PolarHBondContact O-NH2 3.18Å; S115-R121 VanDerWaalsContact C-NH2 3.32Å; S115-R121 PolarHBondContact O-NH2 3.37Å; C117-R121 PolarHBondContact O-NH2 3.37Å; S118-R121 PolarHBondContact O-N 3.46Å; A119-R121 VanDerWaalsContact C-N 3.28Å; A119-R121 PolarHBondContact O-N 3.09Å; R121-N127 WeakPolarHBondContact O-CB 3.47Å; R121-N127 PolarHBondContact O-ND2 2.68Å; R121-V249 HydrophobicContact CG-CB 4.14Å; R121-V249 HydrophobicContact CG-CG1 4.29Å |
| 122 | R | 84.3 | Confident | 88.6 | Confident | 113 Ų | 113 | 60.6 Ų | 60.6 | 43% | 0.426 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -95 | -15.6 | -178.3 | -66.7 | -176.9 | -177.6 | -166.9 | 7.4 | 113.6 | S118 A119 E246 E247 | S118-R122 WeakPolarHBondContact O-CB 3.22Å; S118-R122 WeakPolarHBondContact O-CG 3.49Å; S118-R122 PolarHBondContact O-N 3.45Å; A119-R122 PolarHBondContact O-N 2.96Å; R122-E246 IonicContact CZ-OE2 2.93Å; R122-E246 IonicContact NE-OE2 3.8Å; R122-E246 IonicContact NH1-OE2 3.85Å; R122-E246 PolarHBondContact NH1-OE2 3Å; R122-E247 IonicContact CZ-OE1 3.58Å; R122-E247 IonicContact NH2-OE1 2.77Å; R122-E247 PolarHBondContact NH2-OE1 2.86Å |
| 123 | Q | 84.4 | Confident | 88.8 | Confident | 111 Ų | 111 | 60.6 Ų | 60.6 | 52% | 0.519 | 33% | 0.33 | S | S | . | . | S | Bend | trans | -92.6 | 126.9 | -179.1 | -70.5 | 177.7 | 8.4 | 0 | 0 | 112.5 | A119 W126 N127 | A119-Q123 WeakPolarHBondContact O-CB 3.43Å; A119-Q123 VanDerWaalsContact O-CG 3.3Å; A119-Q123 WeakPolarHBondContact O-CG 3.49Å; A119-Q123 PolarHBondContact O-N 2.82Å; Q123-W126 PolarHBondContact O-N 3.48Å; Q123-N127 PolarHBondContact O-N 3.06Å |
| 124 | F | 84.3 | Confident | 89 | Confident | 156 Ų | 156 | 58.7 Ų | 58.7 | 68% | 0.684 | 32% | 0.318 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.8 | 140.4 | 166.3 | -177.3 | -91.5 | 0 | 0 | 0 | 109.9 | L128 | F124-L128 HydrophobicContact CD2-CD1 4.26Å; F124-L128 HydrophobicContact CE2-CD1 3.79Å |
| 125 | P | 89.4 | Confident | 89.4 | Confident | 60 Ų | 60 | 58.9 Ų | 58.9 | 39% | 0.39 | 32% | 0.319 | S | S | . | . | T | Hydrogen-bonded Turn | cis | -91.8 | -0.4 | 1.2 | 36.4 | -35.7 | 0 | 0 | 0 | 114.5 | N127 L128 I129 | P125-N127 PolarHBondContact O-N 3.22Å; P125-L128 PolarHBondContact O-N 3.45Å; P125-I129 HydrophobicContact CB-CD1 4.29Å; P125-I129 HydrophobicContact CG-CD1 4.24Å; P125-I129 PolarHBondContact O-N 3.04Å |
| 126 | W | 88.6 | Confident | 89.9 | Confident | 147 Ų | 147 | 62.2 Ų | 62.2 | 56% | 0.557 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -54.8 | -38.9 | -173.4 | -75.3 | 115.4 | 0 | 0 | 0 | 113.5 | Q123 L128 I129 L130 | Q123-W126 PolarHBondContact O-N 3.48Å; W126-L128 PolarHBondContact O-N 2.91Å; W126-I129 PolarHBondContact O-N 3.38Å; W126-L130 WeakPolarHBondContact O-CB 3.49Å; W126-L130 WeakPolarHBondContact O-CG 3.34Å; W126-L130 PolarHBondContact O-N 3.49Å |
| 127 | N | 90.4 | Very high | 90.3 | Very high | 3 Ų | 3 | 58 Ų | 58 | 2% | 0.016 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -61.6 | -40.2 | -178.7 | 68.7 | -11.3 | 0 | 0 | 0 | 113.7 | P120 R121 Q123 P125 L131 Y248 V249 | P120-N127 WeakPolarHBondContact O-CA 3.31Å; P120-N127 PolarHBondContact O-N 3.29Å; R121-N127 WeakPolarHBondContact O-CB 3.47Å; R121-N127 PolarHBondContact O-ND2 2.68Å; Q123-N127 PolarHBondContact O-N 3.06Å; P125-N127 PolarHBondContact O-N 3.22Å; N127-L131 WeakPolarHBondContact O-CB 3.37Å; N127-L131 PolarHBondContact O-N 2.89Å; N127-L131 VanDerWaalsContact O-N 3.12Å; N127-Y248 PolarHBondContact ND2-OH 3.48Å; N127-V249 HydrophobicContact CB-CG2 4.08Å |
| 128 | L | 90.3 | Very high | 90.8 | Very high | 70 Ų | 70 | 55.6 Ų | 55.6 | 37% | 0.366 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -75 | -36.9 | 176.7 | -64.7 | -174.9 | 0 | 0 | 0 | 111.9 | F124 P125 W126 L131 A132 | F124-L128 HydrophobicContact CD2-CD1 4.26Å; F124-L128 HydrophobicContact CE2-CD1 3.79Å; P125-L128 PolarHBondContact O-N 3.45Å; W126-L128 PolarHBondContact O-N 2.91Å; L128-L131 PolarHBondContact O-N 3.13Å; L128-A132 WeakPolarHBondContact O-CB 3.24Å; L128-A132 PolarHBondContact O-N 3.35Å |
| 129 | I | 93.8 | Very high | 91.5 | Very high | 76 Ų | 76 | 52.8 Ų | 52.8 | 39% | 0.39 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -63.8 | -50.3 | 177.7 | -65.7 | 169.4 | 0 | 0 | 0 | 110 | P125 W126 L131 A132 I133 | P125-I129 HydrophobicContact CB-CD1 4.29Å; P125-I129 HydrophobicContact CG-CD1 4.24Å; P125-I129 PolarHBondContact O-N 3.04Å; W126-I129 PolarHBondContact O-N 3.38Å; I129-L131 VanDerWaalsContact C-N 3.29Å; I129-L131 PolarHBondContact O-N 3.11Å; I129-A132 PolarHBondContact O-N 3.48Å; I129-I133 HydrophobicContact CG2-CD1 3.93Å; I129-I133 WeakPolarHBondContact O-CG1 3.37Å; I129-I133 PolarHBondContact O-N 3.4Å |
| 130 | L | 93.6 | Very high | 92.1 | Very high | 23 Ų | 23 | 52.1 Ų | 52.1 | 12% | 0.12 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -60.9 | -40.8 | 177.4 | -71.8 | 172.3 | 0 | 0 | 0 | 111.3 | T113 L114 P120 W126 I133 F134 | T113-L130 HydrophobicContact CG2-CD1 3.99Å; T113-L130 HydrophobicContact CG2-CD2 4.49Å; L114-L130 HydrophobicContact CD1-CB 4.15Å; L114-L130 HydrophobicContact CD2-CB 3.74Å; L114-L130 HydrophobicContact CD2-CD1 4.05Å; L114-L130 HydrophobicContact CG-CB 4.05Å; P120-L130 HydrophobicContact CB-CD1 3.64Å; W126-L130 WeakPolarHBondContact O-CB 3.49Å; W126-L130 WeakPolarHBondContact O-CG 3.34Å; W126-L130 PolarHBondContact O-N 3.49Å; L130-I133 PolarHBondContact O-N 2.82Å; L130-F134 VanDerWaalsContact O-CB 3.24Å; L130-F134 WeakPolarHBondContact O-CB 3.37Å; L130-F134 PolarHBondContact O-N 2.86Å |
| 131 | L | 94 | Very high | 92.8 | Very high | 5 Ų | 5 | 51 Ų | 51 | 3% | 0.026 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -63.7 | -40.5 | 176.7 | -169.1 | 67.7 | 0 | 0 | 0 | 111.9 | I68 Q72 N127 L128 I129 F134 T135 V249 T252 L253 | I68-L131 HydrophobicContact CG2-CD2 3.52Å; Q72-L131 VanDerWaalsContact NE2-CD1 3.25Å; Q72-L131 VanDerWaalsContact NE2-CG 3.27Å; N127-L131 WeakPolarHBondContact O-CB 3.37Å; N127-L131 PolarHBondContact O-N 2.89Å; N127-L131 VanDerWaalsContact O-N 3.12Å; L128-L131 PolarHBondContact O-N 3.13Å; I129-L131 VanDerWaalsContact C-N 3.29Å; I129-L131 PolarHBondContact O-N 3.11Å; L131-F134 HydrophobicContact CD1-CD1 4.33Å; L131-F134 PolarHBondContact O-N 3.18Å; L131-T135 WeakPolarHBondContact O-CB 3.44Å; L131-T135 PolarHBondContact O-N 3.24Å; L131-T135 PolarHBondContact O-OG1 3.06Å; L131-V249 HydrophobicContact CD1-CG1 4.18Å; L131-T252 HydrophobicContact CD2-CG2 4.45Å; L131-L253 HydrophobicContact CD1-CB 4.36Å |
| 132 | A | 95.8 | Very high | 93.4 | Very high | 50 Ų | 50 | 50.5 Ų | 50.5 | 41% | 0.413 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -66.3 | -44.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | L128 I129 F134 T135 L136 | L128-A132 WeakPolarHBondContact O-CB 3.24Å; L128-A132 PolarHBondContact O-N 3.35Å; I129-A132 PolarHBondContact O-N 3.48Å; A132-F134 VanDerWaalsContact C-N 3.31Å; A132-F134 PolarHBondContact O-N 2.82Å; A132-T135 PolarHBondContact O-N 2.81Å; A132-L136 WeakPolarHBondContact O-CB 3.41Å; A132-L136 WeakPolarHBondContact O-CG 3.39Å; A132-L136 PolarHBondContact O-N 3.38Å |
| 133 | I | 97.2 | Very high | 94 | Very high | 69 Ų | 69 | 45.1 Ų | 45.1 | 35% | 0.354 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -60.5 | -45.5 | 175.8 | -64.3 | 166.4 | 0 | 0 | 0 | 109.9 | V106 T110 I129 L130 L136 S137 | V106-I133 HydrophobicContact CG1-CG2 3.51Å; T110-I133 HydrophobicContact CG2-CB 4.22Å; T110-I133 HydrophobicContact CG2-CG2 3.66Å; I129-I133 HydrophobicContact CG2-CD1 3.93Å; I129-I133 WeakPolarHBondContact O-CG1 3.37Å; I129-I133 PolarHBondContact O-N 3.4Å; L130-I133 PolarHBondContact O-N 2.82Å; I133-L136 PolarHBondContact O-N 2.97Å; I133-S137 WeakPolarHBondContact O-CB 3.38Å; I133-S137 PolarHBondContact O-N 3.31Å; I133-S137 PolarHBondContact O-OG 3.45Å; I133-S137 VanDerWaalsContact O-OG 3.12Å |
| 134 | F | 96.9 | Very high | 94.5 | Very high | 0 Ų | 0 | 40.1 Ų | 40.1 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -57.9 | -49.3 | 175.5 | 167.8 | -98.5 | 0 | 0 | 0 | 111.8 | F107 Y111 L114 L130 L131 A132 L136 S137 L138 L253 Y256 L257 | F107-F134 AromaticContact CD2-CD2 3.89Å; F107-F134 HydrophobicContact CD2-CD2 3.89Å; F107-F134 AromaticContact CD2-CE2 3.69Å; F107-F134 HydrophobicContact CD2-CE2 3.69Å; F107-F134 AromaticContact CE2-CD2 3.97Å; F107-F134 HydrophobicContact CE2-CD2 3.97Å; F107-F134 AromaticContact CE2-CE2 3.28Å; F107-F134 HydrophobicContact CE2-CE2 3.28Å; F107-F134 AromaticContact CE2-CZ 3.98Å; F107-F134 HydrophobicContact CE2-CZ 3.98Å; F107-F134 HydrophobicContact CZ-CE2 4.21Å; Y111-F134 HydrophobicContact CD2-CE2 4.14Å; L114-F134 HydrophobicContact CD1-CB 4.2Å; L114-F134 HydrophobicContact CD1-CG 4.49Å; L130-F134 VanDerWaalsContact O-CB 3.24Å; L130-F134 WeakPolarHBondContact O-CB 3.37Å; L130-F134 PolarHBondContact O-N 2.86Å; L131-F134 HydrophobicContact CD1-CD1 4.33Å; L131-F134 PolarHBondContact O-N 3.18Å; A132-F134 VanDerWaalsContact C-N 3.31Å; A132-F134 PolarHBondContact O-N 2.82Å; F134-L136 PolarHBondContact O-N 3.41Å; F134-S137 PolarHBondContact O-N 2.67Å; F134-S137 PolarHBondContact O-OG 3.17Å; F134-L138 PolarHBondContact O-N 3.41Å; F134-L253 HydrophobicContact CD1-CD1 4.47Å; F134-L253 HydrophobicContact CD1-CG 4.46Å; F134-L253 HydrophobicContact CE1-CB 4.48Å; F134-L253 HydrophobicContact CE1-CD1 4.23Å; F134-L253 HydrophobicContact CE1-CG 3.79Å; F134-L253 HydrophobicContact CE2-CD1 4.33Å; F134-L253 HydrophobicContact CE2-CG 4.34Å; F134-L253 HydrophobicContact CZ-CD1 4.16Å; F134-L253 HydrophobicContact CZ-CD2 4.34Å; F134-L253 HydrophobicContact CZ-CG 3.72Å; F134-Y256 HydrophobicContact CD1-CD1 4.37Å; F134-Y256 HydrophobicContact CD1-CE1 4.39Å; F134-Y256 AromaticContact CE1-CD1 3.54Å; F134-Y256 HydrophobicContact CE1-CD1 3.54Å; F134-Y256 AromaticContact CE1-CE1 3.87Å; F134-Y256 HydrophobicContact CE1-CE1 3.87Å; F134-Y256 HydrophobicContact CZ-CD1 4.23Å; F134-L257 HydrophobicContact CE2-CD2 4.03Å; F134-L257 HydrophobicContact CZ-CD1 4.17Å; F134-L257 HydrophobicContact CZ-CD2 3.47Å; F134-L257 VanDerWaalsContact CZ-CD2 3.47Å; F134-L257 HydrophobicContact CZ-CG 3.72Å |
| 135 | T | 97.5 | Very high | 94.9 | Very high | 6 Ų | 6 | 35.6 Ų | 35.6 | 4% | 0.037 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -59.7 | -46.3 | 177.1 | -63 | 0 | 0 | 0 | 0 | 112.3 | Q72 V75 L131 A132 S139 Y256 | Q72-T135 HydrophobicContact CB-CG2 3.81Å; Q72-T135 VanDerWaalsContact CD-OG1 3.32Å; Q72-T135 HydrophobicContact CG-CG2 3.94Å; Q72-T135 VanDerWaalsContact CG-OG1 3.28Å; Q72-T135 WeakPolarHBondContact CG-OG1 3.38Å; Q72-T135 PolarHBondContact NE2-OG1 3.39Å; V75-T135 HydrophobicContact CB-CG2 4.34Å; V75-T135 HydrophobicContact CG1-CG2 4.21Å; L131-T135 WeakPolarHBondContact O-CB 3.44Å; L131-T135 PolarHBondContact O-N 3.24Å; L131-T135 PolarHBondContact O-OG1 3.06Å; A132-T135 PolarHBondContact O-N 2.81Å; T135-S139 WeakPolarHBondContact O-CB 3.32Å; T135-S139 PolarHBondContact O-N 2.64Å; T135-S139 PolarHBondContact O-OG 3.38Å; T135-Y256 HydrophobicContact CG2-CE2 4.46Å; T135-Y256 PolarHBondContact O-OH 3.39Å |
| 136 | L | 97.9 | Very high | 95.2 | Very high | 96 Ų | 96 | 32.7 Ų | 32.7 | 50% | 0.503 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -64.5 | -43.9 | -179.9 | -72.4 | 172.3 | 0 | 0 | 0 | 111.5 | V75 I79 A132 I133 F134 S139 Y140 | V75-L136 HydrophobicContact CG1-CD2 3.88Å; I79-L136 HydrophobicContact CD1-CD2 4.09Å; A132-L136 WeakPolarHBondContact O-CB 3.41Å; A132-L136 WeakPolarHBondContact O-CG 3.39Å; A132-L136 PolarHBondContact O-N 3.38Å; I133-L136 PolarHBondContact O-N 2.97Å; F134-L136 PolarHBondContact O-N 3.41Å; L136-S139 PolarHBondContact O-N 2.87Å; L136-Y140 WeakPolarHBondContact O-CB 3.43Å; L136-Y140 PolarHBondContact O-N 2.97Å |
| 137 | S | 97.8 | Very high | 95.4 | Very high | 8 Ų | 8 | 25.8 Ų | 25.8 | 6% | 0.056 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -62.9 | -47.7 | 178.8 | 65.4 | 0 | 0 | 0 | 0 | 112.1 | F107 I133 F134 Y140 M141 | F107-S137 WeakPolarHBondContact CA-OG 3.37Å; I133-S137 WeakPolarHBondContact O-CB 3.38Å; I133-S137 PolarHBondContact O-N 3.31Å; I133-S137 PolarHBondContact O-OG 3.45Å; I133-S137 VanDerWaalsContact O-OG 3.12Å; F134-S137 PolarHBondContact O-N 2.67Å; F134-S137 PolarHBondContact O-OG 3.17Å; S137-Y140 PolarHBondContact O-N 2.96Å; S137-M141 WeakPolarHBondContact O-CG 3.33Å; S137-M141 PolarHBondContact O-N 2.95Å |
| 138 | L | 97.4 | Very high | 95.5 | Very high | 4 Ų | 4 | 30.6 Ų | 30.6 | 2% | 0.021 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -67 | -41.4 | 177.1 | -173.8 | 60.6 | 0 | 0 | 0 | 111.9 | F107 F134 Y140 M141 T142 Y256 L257 V260 | F107-L138 HydrophobicContact CD2-CB 3.86Å; F107-L138 HydrophobicContact CD2-CD1 4.05Å; F107-L138 HydrophobicContact CD2-CG 4.4Å; F107-L138 HydrophobicContact CE2-CB 4.04Å; F107-L138 HydrophobicContact CE2-CD1 3.74Å; F107-L138 HydrophobicContact CE2-CD2 4.05Å; F107-L138 HydrophobicContact CE2-CG 4.15Å; F107-L138 HydrophobicContact CZ-CD1 4.22Å; F134-L138 PolarHBondContact O-N 3.41Å; L138-Y140 VanDerWaalsContact C-N 3.27Å; L138-Y140 PolarHBondContact O-N 3.38Å; L138-M141 WeakPolarHBondContact O-CB 3.21Å; L138-M141 PolarHBondContact O-N 2.95Å; L138-T142 WeakPolarHBondContact O-CB 3.47Å; L138-T142 PolarHBondContact O-N 3.44Å; L138-T142 PolarHBondContact O-OG1 3.17Å; L138-T142 VanDerWaalsContact O-OG1 3.06Å; L138-Y256 HydrophobicContact CB-CE1 4.16Å; L138-Y256 HydrophobicContact CD2-CD1 3.98Å; L138-Y256 HydrophobicContact CD2-CE1 3.39Å; L138-Y256 HydrophobicContact CG-CE1 4.24Å; L138-L257 HydrophobicContact CD2-CD2 3.6Å; L138-V260 HydrophobicContact CD1-CG1 4.17Å; L138-V260 HydrophobicContact CD2-CB 3.94Å; L138-V260 HydrophobicContact CD2-CG1 3.82Å; L138-V260 HydrophobicContact CD2-CG2 4.06Å; L138-V260 HydrophobicContact CG-CG1 3.89Å |
| 139 | S | 97.8 | Very high | 95.7 | Very high | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -61.2 | -38.2 | 177 | -62.6 | 0 | 0 | 0 | 0 | 112.1 | T76 I79 T135 L136 G143 Y256 | T76-S139 VanDerWaalsContact CA-OG 3.28Å; T76-S139 WeakPolarHBondContact CA-OG 3.31Å; T76-S139 WeakPolarHBondContact CB-OG 3.46Å; T76-S139 PolarHBondContact OG1-OG 3.42Å; I79-S139 VanDerWaalsContact CD1-CB 3.47Å; I79-S139 WeakPolarHBondContact CG2-O 3.47Å; T135-S139 WeakPolarHBondContact O-CB 3.32Å; T135-S139 PolarHBondContact O-N 2.64Å; T135-S139 PolarHBondContact O-OG 3.38Å; L136-S139 PolarHBondContact O-N 2.87Å; S139-G143 PolarHBondContact O-N 3.26Å; S139-Y256 PolarHBondContact OG-OH 3.27Å |
| 140 | Y | 97.3 | Very high | 95.7 | Very high | 45 Ų | 45 | 27.9 Ų | 27.9 | 18% | 0.176 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -63.2 | -48.2 | 173.6 | -176.5 | -82 | 0 | 0 | 0 | 111.3 | F83 W99 S103 L136 S137 L138 T142 G143 M144 | F83-Y140 AromaticContact CE2-CD2 3.87Å; F83-Y140 HydrophobicContact CE2-CD2 3.87Å; F83-Y140 AromaticContact CE2-CE2 3.82Å; F83-Y140 HydrophobicContact CE2-CE2 3.82Å; F83-Y140 HydrophobicContact CE2-CG 4.41Å; F83-Y140 AromaticContact CZ-CD2 3.68Å; F83-Y140 HydrophobicContact CZ-CD2 3.68Å; F83-Y140 AromaticContact CZ-CE2 3.62Å; F83-Y140 HydrophobicContact CZ-CE2 3.62Å; W99-Y140 HydrophobicContact CB-CE1 4.07Å; W99-Y140 WeakPolarHBondContact CB-OH 3.2Å; S103-Y140 WeakPolarHBondContact OG-CD1 3.4Å; L136-Y140 WeakPolarHBondContact O-CB 3.43Å; L136-Y140 PolarHBondContact O-N 2.97Å; S137-Y140 PolarHBondContact O-N 2.96Å; L138-Y140 VanDerWaalsContact C-N 3.27Å; L138-Y140 PolarHBondContact O-N 3.38Å; Y140-T142 VanDerWaalsContact C-N 3.35Å; Y140-T142 PolarHBondContact O-N 3.05Å; Y140-G143 PolarHBondContact O-N 3.47Å; Y140-M144 WeakPolarHBondContact O-CB 3.33Å; Y140-M144 PolarHBondContact O-N 3.18Å |
| 141 | M | 96.3 | Very high | 95.7 | Very high | 16 Ų | 16 | 28.6 Ų | 28.6 | 8% | 0.079 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -57.8 | -47.8 | 177.2 | -70.5 | 173 | 52.7 | 0 | 0 | 111.6 | Y100 S103 Y104 F107 S137 L138 M144 L145 | Y100-M141 HydrophobicContact CD2-CG 4.46Å; Y100-M141 HydrophobicContact CE2-CB 4.18Å; Y100-M141 HydrophobicContact CE2-CG 4.22Å; S103-M141 WeakPolarHBondContact OG-CG 3.09Å; Y104-M141 HydrophobicContact CD2-CE 3.38Å; Y104-M141 HydrophobicContact CD2-SD 4.08Å; Y104-M141 HydrophobicContact CE2-CE 3.91Å; Y104-M141 HydrophobicContact CG-CE 4.37Å; F107-M141 HydrophobicContact CB-SD 3.81Å; F107-M141 HydrophobicContact CD1-SD 4.26Å; F107-M141 HydrophobicContact CG-SD 4.02Å; S137-M141 WeakPolarHBondContact O-CG 3.33Å; S137-M141 PolarHBondContact O-N 2.95Å; L138-M141 WeakPolarHBondContact O-CB 3.21Å; L138-M141 PolarHBondContact O-N 2.95Å; M141-M144 PolarHBondContact O-N 2.87Å; M141-L145 WeakPolarHBondContact O-CB 3.44Å; M141-L145 PolarHBondContact O-N 3.4Å |
| 142 | T | 96.7 | Very high | 95.6 | Very high | 3 Ų | 3 | 37.2 Ų | 37.2 | 2% | 0.018 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -66.2 | -40.9 | 178.8 | -59 | 0 | 0 | 0 | 0 | 112 | V80 L138 Y140 L145 S146 V260 F263 | V80-T142 HydrophobicContact CG2-CG2 4.09Å; L138-T142 WeakPolarHBondContact O-CB 3.47Å; L138-T142 PolarHBondContact O-N 3.44Å; L138-T142 PolarHBondContact O-OG1 3.17Å; L138-T142 VanDerWaalsContact O-OG1 3.06Å; Y140-T142 VanDerWaalsContact C-N 3.35Å; Y140-T142 PolarHBondContact O-N 3.05Å; T142-L145 PolarHBondContact O-N 3.48Å; T142-S146 WeakPolarHBondContact O-CB 3.25Å; T142-S146 PolarHBondContact O-N 3.42Å; T142-S146 PolarHBondContact O-OG 2.97Å; T142-V260 HydrophobicContact CG2-CG1 4.16Å; T142-V260 WeakPolarHBondContact OG1-CG1 3.3Å; T142-F263 HydrophobicContact CG2-CD1 3.49Å; T142-F263 VanDerWaalsContact CG2-CD1 3.49Å; T142-F263 HydrophobicContact CG2-CE1 3.41Å; T142-F263 VanDerWaalsContact CG2-CE1 3.41Å |
| 143 | G | 96.1 | Very high | 95.6 | Very high | 0 Ų | 0 | 35.4 Ų | 35.4 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -59.5 | -47.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | F83 S139 Y140 L145 S146 S147 | F83-G143 VanDerWaalsContact CD2-C 3.4Å; S139-G143 PolarHBondContact O-N 3.26Å; Y140-G143 PolarHBondContact O-N 3.47Å; G143-L145 PolarHBondContact O-N 3.12Å; G143-S146 WeakPolarHBondContact CA-OG 3.35Å; G143-S146 PolarHBondContact O-N 3.21Å; G143-S146 PolarHBondContact O-OG 3.29Å; G143-S147 PolarHBondContact O-N 3.43Å |
| 144 | M | 94.6 | Very high | 95.5 | Very high | 6 Ų | 6 | 32.2 Ų | 32.2 | 3% | 0.03 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -59 | -48.3 | 177 | -176.5 | 65.3 | -116.6 | 0 | 0 | 110.6 | I93 Q94 Y100 Y140 M141 S146 S147 F148 | I93-M144 HydrophobicContact CB-CE 4.48Å; I93-M144 HydrophobicContact CB-SD 3.58Å; I93-M144 VanDerWaalsContact CB-SD 3.58Å; I93-M144 HydrophobicContact CD1-CE 4.17Å; I93-M144 HydrophobicContact CD1-SD 3.69Å; I93-M144 HydrophobicContact CG1-CE 3.95Å; I93-M144 HydrophobicContact CG1-SD 3.57Å; I93-M144 VanDerWaalsContact CG1-SD 3.57Å; Q94-M144 HydrophobicContact CB-CE 4.23Å; Q94-M144 HydrophobicContact CG-CE 3.44Å; Q94-M144 VanDerWaalsContact CG-CE 3.44Å; Y100-M144 HydrophobicContact CD2-CB 4.11Å; Y100-M144 HydrophobicContact CD2-CG 3.88Å; Y100-M144 HydrophobicContact CG-CG 4.41Å; Y140-M144 WeakPolarHBondContact O-CB 3.33Å; Y140-M144 PolarHBondContact O-N 3.18Å; M141-M144 PolarHBondContact O-N 2.87Å; M144-S146 VanDerWaalsContact C-N 3.34Å; M144-S146 PolarHBondContact O-N 3.4Å; M144-S147 WeakPolarHBondContact CE-OG 3.4Å; M144-S147 VanDerWaalsContact O-CB 3.29Å; M144-S147 WeakPolarHBondContact O-CB 3.31Å; M144-S147 PolarHBondContact O-N 3.29Å; M144-S147 VanDerWaalsContact O-N 3.15Å; M144-S147 PolarHBondContact O-OG 3.34Å; M144-F148 HydrophobicContact CE-CD2 3.97Å; M144-F148 HydrophobicContact CE-CE1 4.3Å; M144-F148 HydrophobicContact CE-CE2 3.19Å; M144-F148 HydrophobicContact CE-CZ 3.4Å; M144-F148 VanDerWaalsContact CE-CZ 3.4Å; M144-F148 HydrophobicContact CG-CE2 4.4Å; M144-F148 WeakPolarHBondContact O-CD2 3.39Å |
| 145 | L | 93.3 | Very high | 95.4 | Very high | 60 Ų | 60 | 35.8 Ų | 35.8 | 31% | 0.314 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -57.8 | -46.7 | 176.8 | -177.6 | 62.7 | 0 | 0 | 0 | 111.6 | M141 T142 G143 S147 F148 Y149 | M141-L145 WeakPolarHBondContact O-CB 3.44Å; M141-L145 PolarHBondContact O-N 3.4Å; T142-L145 PolarHBondContact O-N 3.48Å; G143-L145 PolarHBondContact O-N 3.12Å; L145-S147 PolarHBondContact O-N 3.46Å; L145-F148 PolarHBondContact O-N 2.89Å; L145-Y149 HydrophobicContact CD1-CE2 4.18Å; L145-Y149 HydrophobicContact CG-CE2 4.28Å; L145-Y149 VanDerWaalsContact O-CD2 3.29Å; L145-Y149 WeakPolarHBondContact O-CD2 3.17Å |
| 146 | S | 95 | Very high | 95.3 | Very high | 0 Ų | 0 | 40.9 Ų | 40.9 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -62.1 | -28.5 | 179.4 | 73.4 | 0 | 0 | 0 | 0 | 113.4 | T142 G143 M144 F148 Y149 V154 | T142-S146 WeakPolarHBondContact O-CB 3.25Å; T142-S146 PolarHBondContact O-N 3.42Å; T142-S146 PolarHBondContact O-OG 2.97Å; G143-S146 WeakPolarHBondContact CA-OG 3.35Å; G143-S146 PolarHBondContact O-N 3.21Å; G143-S146 PolarHBondContact O-OG 3.29Å; M144-S146 VanDerWaalsContact C-N 3.34Å; M144-S146 PolarHBondContact O-N 3.4Å; S146-F148 PolarHBondContact O-N 3.45Å; S146-Y149 PolarHBondContact O-N 3.12Å; S146-Y149 VanDerWaalsContact O-N 3.08Å; S146-V154 WeakPolarHBondContact O-CG2 3.2Å |
| 147 | S | 94.6 | Very high | 95.2 | Very high | 1 Ų | 1 | 36.3 Ų | 36.3 | 1% | 0.007 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -64.1 | -24.7 | -178.7 | 83.7 | 0 | 0 | 0 | 0 | 113.7 | Q94 G143 M144 L145 Y149 | Q94-S147 PolarHBondContact NE2-O 2.89Å; Q94-S147 PolarHBondContact NE2-OG 2.93Å; Q94-S147 VanDerWaalsContact NE2-OG 3.15Å; G143-S147 PolarHBondContact O-N 3.43Å; M144-S147 WeakPolarHBondContact CE-OG 3.4Å; M144-S147 VanDerWaalsContact O-CB 3.29Å; M144-S147 WeakPolarHBondContact O-CB 3.31Å; M144-S147 PolarHBondContact O-N 3.29Å; M144-S147 VanDerWaalsContact O-N 3.15Å; M144-S147 PolarHBondContact O-OG 3.34Å; L145-S147 PolarHBondContact O-N 3.46Å; S147-Y149 VanDerWaalsContact C-N 3.29Å |
| 148 | F | 92.4 | Very high | 95.1 | Very high | 104 Ų | 104 | 38 Ų | 38 | 46% | 0.456 | 19% | 0.186 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -81.5 | -7.8 | 177.9 | -68.8 | -70.1 | 0 | 0 | 0 | 113.6 | Q94 M144 L145 S146 R274 | Q94-F148 HydrophobicContact CB-CE1 4.47Å; Q94-F148 HydrophobicContact CG-CD1 4.41Å; Q94-F148 HydrophobicContact CG-CE1 3.85Å; Q94-F148 HydrophobicContact CG-CZ 4.05Å; M144-F148 HydrophobicContact CE-CD2 3.97Å; M144-F148 HydrophobicContact CE-CE1 4.3Å; M144-F148 HydrophobicContact CE-CE2 3.19Å; M144-F148 HydrophobicContact CE-CZ 3.4Å; M144-F148 VanDerWaalsContact CE-CZ 3.4Å; M144-F148 HydrophobicContact CG-CE2 4.4Å; M144-F148 WeakPolarHBondContact O-CD2 3.39Å; L145-F148 PolarHBondContact O-N 2.89Å; S146-F148 PolarHBondContact O-N 3.45Å; F148-R274 PolarHBondContact O-N 2.83Å |
| 149 | Y | 93.4 | Very high | 95.1 | Very high | 33 Ų | 33 | 40 Ų | 40 | 13% | 0.129 | 21% | 0.207 | C | C | . | . | B | Isolated β-bridge | trans | -104.9 | 155.7 | 179 | -67 | -81.1 | 0 | 0 | 0 | 111.2 | L145 S146 S147 T151 L267 G271 K273 | L145-Y149 HydrophobicContact CD1-CE2 4.18Å; L145-Y149 HydrophobicContact CG-CE2 4.28Å; L145-Y149 VanDerWaalsContact O-CD2 3.29Å; L145-Y149 WeakPolarHBondContact O-CD2 3.17Å; S146-Y149 PolarHBondContact O-N 3.12Å; S146-Y149 VanDerWaalsContact O-N 3.08Å; S147-Y149 VanDerWaalsContact C-N 3.29Å; Y149-T151 PolarHBondContact O-N 3.39Å; Y149-L267 HydrophobicContact CD2-CB 4.41Å; Y149-L267 HydrophobicContact CD2-CD1 4.3Å; Y149-L267 HydrophobicContact CD2-CD2 4.41Å; Y149-L267 WeakPolarHBondContact CE1-O 3.41Å; Y149-L267 HydrophobicContact CE2-CB 4.21Å; Y149-L267 HydrophobicContact CG-CD2 4.47Å; Y149-G271 VanDerWaalsContact CD1-CA 3.44Å; Y149-K273 HydrophobicContact CE1-CG 4.41Å |
| 150 | N | 93.4 | Very high | 95 | Very high | 57 Ų | 57 | 42.5 Ų | 42.5 | 31% | 0.305 | 22% | 0.22 | S | C | . | . | trans | -61.9 | 134.7 | 173.3 | -90.4 | -60.8 | 0 | 0 | 0 | 111.5 | K152 S153 V154 T272 K273 | N150-K152 PolarHBondContact O-N 2.94Å; N150-K152 VanDerWaalsContact O-N 3.12Å; N150-S153 WeakPolarHBondContact O-CA 3.47Å; N150-S153 WeakPolarHBondContact O-CB 3.32Å; N150-S153 PolarHBondContact O-N 3.22Å; N150-V154 PolarHBondContact O-N 3.41Å; N150-T272 PolarHBondContact N-O 2.85Å; N150-T272 PolarHBondContact ND2-O 3.36Å; N150-K273 PolarHBondContact ND2-O 3.43Å | ||
| 151 | T | 93.8 | Very high | 95 | Very high | 37 Ų | 37 | 40.7 Ų | 40.7 | 23% | 0.227 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -51.9 | -39.2 | -179 | -53.6 | 0 | 0 | 0 | 0 | 112.9 | T84 F85 Y149 V154 V155 | T84-T151 HydrophobicContact CG2-CG2 3.5Å; T84-T151 VanDerWaalsContact CG2-CG2 3.5Å; F85-T151 HydrophobicContact CD1-CG2 3.83Å; F85-T151 HydrophobicContact CE1-CG2 3.31Å; F85-T151 HydrophobicContact CZ-CG2 3.86Å; Y149-T151 PolarHBondContact O-N 3.39Å; T151-V154 PolarHBondContact O-N 3.26Å; T151-V155 WeakPolarHBondContact O-CG2 3.09Å; T151-V155 PolarHBondContact O-N 3.39Å |
| 152 | K | 93.3 | Very high | 95 | Very high | 186 Ų | 186 | 43 Ų | 43 | 81% | 0.809 | 24% | 0.235 | S | C | * | . | H | α-helix | trans | -61.6 | -44.2 | 176.8 | -63 | -176.6 | -175.8 | 179.8 | 0 | 111.9 | N150 M156 | N150-K152 PolarHBondContact O-N 2.94Å; N150-K152 VanDerWaalsContact O-N 3.12Å; K152-M156 WeakPolarHBondContact O-CB 3.27Å; K152-M156 PolarHBondContact O-N 3.26Å |
| 153 | S | 94.1 | Very high | 95 | Very high | 13 Ų | 13 | 45.4 Ų | 45.4 | 9% | 0.091 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -67.4 | -39.7 | 177 | -54 | 0 | 0 | 0 | 0 | 111.5 | N150 M156 C157 T272 | N150-S153 WeakPolarHBondContact O-CA 3.47Å; N150-S153 WeakPolarHBondContact O-CB 3.32Å; N150-S153 PolarHBondContact O-N 3.22Å; S153-M156 PolarHBondContact O-N 3.47Å; S153-C157 WeakPolarHBondContact O-CB 3.43Å; S153-C157 PolarHBondContact O-N 2.9Å; S153-C157 PolarHBondContact O-SG 3Å; S153-T272 PolarHBondContact OG-N 3.05Å; S153-T272 PolarHBondContact OG-OG1 3.28Å |
| 154 | V | 95.9 | Very high | 95 | Very high | 1 Ų | 1 | 47.1 Ų | 47.1 | 1% | 0.006 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -60.3 | -49.3 | 177.3 | 176.6 | 0 | 0 | 0 | 0 | 111.1 | V80 T84 S146 N150 T151 M156 C157 L158 F263 L267 | V80-V154 HydrophobicContact CG1-CG1 4.03Å; T84-V154 HydrophobicContact CG2-CB 4.33Å; T84-V154 HydrophobicContact CG2-CG1 4.33Å; S146-V154 WeakPolarHBondContact O-CG2 3.2Å; N150-V154 PolarHBondContact O-N 3.41Å; T151-V154 PolarHBondContact O-N 3.26Å; V154-M156 VanDerWaalsContact C-N 3.34Å; V154-M156 PolarHBondContact O-N 3.06Å; V154-C157 PolarHBondContact O-N 3.43Å; V154-L158 HydrophobicContact CG1-CD1 4.33Å; V154-L158 WeakPolarHBondContact O-CG 3.43Å; V154-L158 PolarHBondContact O-N 2.95Å; V154-F263 HydrophobicContact CG1-CZ 4.23Å; V154-L267 HydrophobicContact CB-CD2 4.32Å; V154-L267 HydrophobicContact CG2-CD2 3.93Å |
| 155 | V | 95 | Very high | 95.1 | Very high | 75 Ų | 75 | 47.4 Ų | 47.4 | 46% | 0.455 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -63.4 | -40.5 | 178.7 | 174.5 | 0 | 0 | 0 | 0 | 111.4 | F85 T151 L158 G159 | F85-V155 HydrophobicContact CZ-CG2 3.91Å; T151-V155 WeakPolarHBondContact O-CG2 3.09Å; T151-V155 PolarHBondContact O-N 3.39Å; V155-L158 PolarHBondContact O-N 3.1Å; V155-G159 PolarHBondContact O-N 2.99Å; V155-G159 VanDerWaalsContact O-N 3.11Å |
| 156 | M | 95.8 | Very high | 95.2 | Very high | 113 Ų | 113 | 49.8 Ų | 49.8 | 56% | 0.557 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -59.5 | -48.1 | 173.9 | 179.5 | -171.4 | -80.7 | 0 | 0 | 111.4 | K152 S153 V154 L158 G159 I160 | K152-M156 WeakPolarHBondContact O-CB 3.27Å; K152-M156 PolarHBondContact O-N 3.26Å; S153-M156 PolarHBondContact O-N 3.47Å; V154-M156 VanDerWaalsContact C-N 3.34Å; V154-M156 PolarHBondContact O-N 3.06Å; M156-L158 PolarHBondContact O-N 3.34Å; M156-G159 PolarHBondContact O-N 2.92Å; M156-G159 VanDerWaalsContact O-N 3.14Å; M156-I160 HydrophobicContact CG-CD1 3.94Å; M156-I160 WeakPolarHBondContact O-CG1 3.36Å; M156-I160 PolarHBondContact O-N 3.24Å; M156-I160 HydrophobicContact SD-CD1 4.49Å |
| 157 | C | 96.3 | Very high | 95.2 | Very high | 0 Ų | 0 | 54.3 Ų | 54.3 | 0% | 0 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -62.9 | -41 | -179.9 | -66.4 | 0 | 0 | 0 | 0 | 112 | S153 V154 G159 I160 T161 F263 F266 L267 | S153-C157 WeakPolarHBondContact O-CB 3.43Å; S153-C157 PolarHBondContact O-N 2.9Å; S153-C157 PolarHBondContact O-SG 3Å; V154-C157 PolarHBondContact O-N 3.43Å; C157-G159 VanDerWaalsContact C-N 3.29Å; C157-G159 PolarHBondContact O-N 3.44Å; C157-I160 PolarHBondContact O-N 2.86Å; C157-T161 PolarHBondContact O-N 3.22Å; C157-T161 PolarHBondContact O-OG1 3.48Å; C157-T161 VanDerWaalsContact O-OG1 3.07Å; C157-F263 HydrophobicContact CB-CD2 4.15Å; C157-F263 HydrophobicContact CB-CE2 3.9Å; C157-F266 HydrophobicContact CB-CB 4.21Å; C157-F266 VanDerWaalsContact SG-C 3.59Å; C157-F266 PolarHBondContact SG-O 3.39Å; C157-F266 VanDerWaalsContact SG-O 3.38Å; C157-L267 HydrophobicContact CB-CD2 3.9Å; C157-L267 HydrophobicContact CB-CG 4.27Å |
| 158 | L | 95.6 | Very high | 95.2 | Very high | 45 Ų | 45 | 55.1 Ų | 55.1 | 24% | 0.236 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -57 | -43.5 | 173.3 | -73.7 | 171.5 | 0 | 0 | 0 | 111.6 | F77 V80 V154 V155 M156 A162 F263 | F77-L158 HydrophobicContact CD2-CD1 4.14Å; F77-L158 HydrophobicContact CE2-CD1 4.11Å; V80-L158 HydrophobicContact CG1-CD1 4.32Å; V154-L158 HydrophobicContact CG1-CD1 4.33Å; V154-L158 WeakPolarHBondContact O-CG 3.43Å; V154-L158 PolarHBondContact O-N 2.95Å; V155-L158 PolarHBondContact O-N 3.1Å; M156-L158 PolarHBondContact O-N 3.34Å; L158-A162 WeakPolarHBondContact O-CB 3.45Å; L158-A162 PolarHBondContact O-N 3.15Å; L158-F263 HydrophobicContact CB-CE2 4.46Å; L158-F263 HydrophobicContact CD2-CD2 3.77Å; L158-F263 HydrophobicContact CD2-CE2 3.48Å; L158-F263 VanDerWaalsContact CD2-CE2 3.48Å; L158-F263 HydrophobicContact CD2-CG 4.45Å; L158-F263 HydrophobicContact CD2-CZ 3.92Å; L158-F263 HydrophobicContact CG-CD2 4.21Å; L158-F263 HydrophobicContact CG-CE2 3.59Å; L158-F263 HydrophobicContact CG-CZ 4.18Å |
| 159 | G | 96.1 | Very high | 95.2 | Very high | 44 Ų | 44 | 51.4 Ų | 51.4 | 45% | 0.454 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -63.3 | -44.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | V155 M156 C157 A162 A163 | V155-G159 PolarHBondContact O-N 2.99Å; V155-G159 VanDerWaalsContact O-N 3.11Å; M156-G159 PolarHBondContact O-N 2.92Å; M156-G159 VanDerWaalsContact O-N 3.14Å; C157-G159 VanDerWaalsContact C-N 3.29Å; C157-G159 PolarHBondContact O-N 3.44Å; G159-A162 PolarHBondContact O-N 3.41Å; G159-A163 WeakPolarHBondContact O-CB 3.37Å; G159-A163 PolarHBondContact O-N 3.25Å |
| 160 | I | 96.5 | Very high | 95.1 | Very high | 54 Ų | 54 | 52.7 Ų | 52.7 | 28% | 0.277 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -64.4 | -46.7 | 177.7 | -62.5 | 168.4 | 0 | 0 | 0 | 110.4 | M156 C157 A162 A163 V164 F266 F270 | M156-I160 HydrophobicContact CG-CD1 3.94Å; M156-I160 WeakPolarHBondContact O-CG1 3.36Å; M156-I160 PolarHBondContact O-N 3.24Å; M156-I160 HydrophobicContact SD-CD1 4.49Å; C157-I160 PolarHBondContact O-N 2.86Å; I160-A162 PolarHBondContact O-N 2.89Å; I160-A163 PolarHBondContact O-N 2.91Å; I160-V164 HydrophobicContact CG2-CG2 4.26Å; I160-V164 WeakPolarHBondContact O-CG2 3.25Å; I160-V164 PolarHBondContact O-N 2.64Å; I160-F266 HydrophobicContact CB-CD2 4.23Å; I160-F266 HydrophobicContact CB-CE2 4.41Å; I160-F266 HydrophobicContact CG2-CD2 3.74Å; I160-F266 HydrophobicContact CG2-CE1 4.42Å; I160-F266 HydrophobicContact CG2-CE2 3.53Å; I160-F266 HydrophobicContact CG2-CG 4.32Å; I160-F266 HydrophobicContact CG2-CZ 3.91Å; I160-F270 HydrophobicContact CD1-CD2 4.01Å; I160-F270 HydrophobicContact CD1-CE2 4.05Å |
| 161 | T | 96.9 | Very high | 95 | Very high | 7 Ų | 7 | 54.9 Ų | 54.9 | 4% | 0.043 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -57 | -49.1 | 176.1 | -59.3 | 0 | 0 | 0 | 0 | 110.9 | C157 A163 V164 C165 I259 I262 F263 F266 | C157-T161 PolarHBondContact O-N 3.22Å; C157-T161 PolarHBondContact O-OG1 3.48Å; C157-T161 VanDerWaalsContact O-OG1 3.07Å; T161-A163 VanDerWaalsContact C-N 3.31Å; T161-A163 PolarHBondContact O-N 3.47Å; T161-V164 PolarHBondContact O-N 2.94Å; T161-C165 WeakPolarHBondContact O-CB 3.46Å; T161-C165 PolarHBondContact O-N 3.48Å; T161-C165 PolarHBondContact O-SG 3.33Å; T161-I259 HydrophobicContact CG2-CG2 4.02Å; T161-I262 HydrophobicContact CG2-CB 4.41Å; T161-I262 HydrophobicContact CG2-CG2 4.03Å; T161-F263 HydrophobicContact CG2-CB 4.06Å; T161-F263 VanDerWaalsContact OG1-CA 3.24Å; T161-F263 WeakPolarHBondContact OG1-CA 3Å; T161-F266 WeakPolarHBondContact OG1-CD2 3.43Å |
| 162 | A | 96 | Very high | 94.8 | Very high | 63 Ų | 63 | 53.3 Ų | 53.3 | 52% | 0.521 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -58.6 | -43.1 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | L158 G159 I160 L166 | L158-A162 WeakPolarHBondContact O-CB 3.45Å; L158-A162 PolarHBondContact O-N 3.15Å; G159-A162 PolarHBondContact O-N 3.41Å; I160-A162 PolarHBondContact O-N 2.89Å; A162-L166 WeakPolarHBondContact O-CB 3.43Å; A162-L166 PolarHBondContact O-N 3.01Å |
| 163 | A | 97.1 | Very high | 94.4 | Very high | 54 Ų | 54 | 49 Ų | 49 | 45% | 0.446 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -64.1 | -47.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | G159 I160 T161 L166 V167 | G159-A163 WeakPolarHBondContact O-CB 3.37Å; G159-A163 PolarHBondContact O-N 3.25Å; I160-A163 PolarHBondContact O-N 2.91Å; T161-A163 VanDerWaalsContact C-N 3.31Å; T161-A163 PolarHBondContact O-N 3.47Å; A163-L166 PolarHBondContact O-N 3.44Å; A163-V167 WeakPolarHBondContact O-CB 3.47Å; A163-V167 VanDerWaalsContact O-CG2 3.3Å; A163-V167 WeakPolarHBondContact O-CG2 3.44Å; A163-V167 PolarHBondContact O-N 3.07Å |
| 164 | V | 96.9 | Very high | 94.1 | Very high | 36 Ų | 36 | 55.5 Ų | 55.5 | 22% | 0.218 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -62 | -47.3 | 178.1 | 169.9 | 0 | 0 | 0 | 0 | 110.7 | I160 T161 L166 V167 V168 T225 F266 | I160-V164 HydrophobicContact CG2-CG2 4.26Å; I160-V164 WeakPolarHBondContact O-CG2 3.25Å; I160-V164 PolarHBondContact O-N 2.64Å; T161-V164 PolarHBondContact O-N 2.94Å; V164-L166 VanDerWaalsContact C-N 3.33Å; V164-L166 PolarHBondContact O-N 3.49Å; V164-V167 PolarHBondContact O-N 3.26Å; V164-V168 HydrophobicContact CG1-CG2 4.13Å; V164-V168 WeakPolarHBondContact O-CB 3.3Å; V164-V168 WeakPolarHBondContact O-CG2 3.44Å; V164-V168 PolarHBondContact O-N 3Å; V164-T225 HydrophobicContact CG1-CG2 3.9Å; V164-F266 HydrophobicContact CB-CE2 4.35Å; V164-F266 HydrophobicContact CG2-CE2 3.98Å; V164-F266 HydrophobicContact CG2-CZ 3.96Å |
| 165 | C | 95.7 | Very high | 93.5 | Very high | 13 Ų | 13 | 56.5 Ų | 56.5 | 9% | 0.088 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -60.7 | -41.9 | 178.2 | -65.4 | 0 | 0 | 0 | 0 | 112 | T161 T169 L228 | T161-C165 WeakPolarHBondContact O-CB 3.46Å; T161-C165 PolarHBondContact O-N 3.48Å; T161-C165 PolarHBondContact O-SG 3.33Å; C165-T169 WeakPolarHBondContact O-CB 3.49Å; C165-T169 PolarHBondContact O-N 2.89Å; C165-T169 PolarHBondContact O-OG1 3.25Å; C165-L228 HydrophobicContact CB-CD2 4.01Å |
| 166 | L | 94.9 | Very high | 92.6 | Very high | 109 Ų | 109 | 62.6 Ų | 62.6 | 57% | 0.571 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -62.2 | -52.9 | 175.2 | -172.7 | 167.1 | 0 | 0 | 0 | 110.8 | A162 A163 V164 V168 T169 V170 | A162-L166 WeakPolarHBondContact O-CB 3.43Å; A162-L166 PolarHBondContact O-N 3.01Å; A163-L166 PolarHBondContact O-N 3.44Å; V164-L166 VanDerWaalsContact C-N 3.33Å; V164-L166 PolarHBondContact O-N 3.49Å; L166-V168 VanDerWaalsContact C-N 3.32Å; L166-V168 PolarHBondContact O-N 3.15Å; L166-T169 PolarHBondContact O-N 3.44Å; L166-V170 HydrophobicContact CD2-CG2 3.8Å; L166-V170 WeakPolarHBondContact O-CB 3.42Å; L166-V170 WeakPolarHBondContact O-CG2 3.38Å; L166-V170 PolarHBondContact O-N 2.91Å |
| 167 | V | 95.9 | Very high | 91.7 | Very high | 96 Ų | 96 | 63 Ų | 63 | 58% | 0.582 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -58.1 | -45.9 | -178.6 | 169.2 | 0 | 0 | 0 | 0 | 111 | A163 V164 V170 F171 | A163-V167 WeakPolarHBondContact O-CB 3.47Å; A163-V167 VanDerWaalsContact O-CG2 3.3Å; A163-V167 WeakPolarHBondContact O-CG2 3.44Å; A163-V167 PolarHBondContact O-N 3.07Å; V164-V167 PolarHBondContact O-N 3.26Å; V167-V170 PolarHBondContact O-N 2.65Å; V167-F171 WeakPolarHBondContact O-CB 3.5Å; V167-F171 PolarHBondContact O-N 3.46Å |
| 168 | V | 94.6 | Very high | 90.8 | Very high | 17 Ų | 17 | 64.9 Ų | 64.9 | 10% | 0.103 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -66.2 | -42.3 | 179.4 | 172.4 | 0 | 0 | 0 | 0 | 111.3 | V164 L166 F171 S172 T225 L228 A229 | V164-V168 HydrophobicContact CG1-CG2 4.13Å; V164-V168 WeakPolarHBondContact O-CB 3.3Å; V164-V168 WeakPolarHBondContact O-CG2 3.44Å; V164-V168 PolarHBondContact O-N 3Å; L166-V168 VanDerWaalsContact C-N 3.32Å; L166-V168 PolarHBondContact O-N 3.15Å; V168-F171 PolarHBondContact O-N 2.77Å; V168-S172 VanDerWaalsContact O-CB 3.32Å; V168-S172 WeakPolarHBondContact O-CB 3.43Å; V168-S172 PolarHBondContact O-N 3.24Å; V168-S172 PolarHBondContact O-OG 3.48Å; V168-T225 HydrophobicContact CG2-CG2 3.5Å; V168-L228 HydrophobicContact CB-CD2 4.18Å; V168-L228 HydrophobicContact CG1-CB 4.28Å; V168-L228 HydrophobicContact CG1-CD2 4.02Å; V168-L228 HydrophobicContact CG1-CG 3.98Å; V168-A229 HydrophobicContact CG1-CB 3.76Å |
| 169 | T | 92.1 | Very high | 89.9 | Confident | 26 Ų | 26 | 64.1 Ų | 64.1 | 16% | 0.16 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -61.1 | -49 | 177.1 | -64.4 | 0 | 0 | 0 | 0 | 110.7 | Y66 C165 L166 S172 F173 T232 | Y66-T169 HydrophobicContact CE1-CG2 4.38Å; C165-T169 WeakPolarHBondContact O-CB 3.49Å; C165-T169 PolarHBondContact O-N 2.89Å; C165-T169 PolarHBondContact O-OG1 3.25Å; L166-T169 PolarHBondContact O-N 3.44Å; T169-S172 PolarHBondContact O-N 3.15Å; T169-F173 HydrophobicContact CG2-CD2 3.84Å; T169-F173 HydrophobicContact CG2-CE2 3.29Å; T169-F173 HydrophobicContact CG2-CZ 4.17Å; T169-F173 WeakPolarHBondContact O-CD2 3.44Å; T169-F173 PolarHBondContact O-N 3.03Å; T169-T232 HydrophobicContact CG2-CG2 4.38Å |
| 170 | V | 91.9 | Very high | 89.1 | Confident | 60 Ų | 60 | 62.2 Ų | 62.2 | 36% | 0.364 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -62.9 | -43.7 | 177.3 | 172.5 | 0 | 0 | 0 | 0 | 111.3 | L166 V167 S172 F173 Q174 | L166-V170 HydrophobicContact CD2-CG2 3.8Å; L166-V170 WeakPolarHBondContact O-CB 3.42Å; L166-V170 WeakPolarHBondContact O-CG2 3.38Å; L166-V170 PolarHBondContact O-N 2.91Å; V167-V170 PolarHBondContact O-N 2.65Å; V170-S172 VanDerWaalsContact C-N 3.35Å; V170-S172 PolarHBondContact O-N 2.99Å; V170-F173 PolarHBondContact O-N 2.85Å; V170-Q174 WeakPolarHBondContact O-CG 3.45Å; V170-Q174 PolarHBondContact O-N 3.31Å; V170-Q174 VanDerWaalsContact O-N 3.11Å |
| 171 | F | 91.4 | Very high | 88.3 | Confident | 103 Ų | 103 | 63.9 Ų | 63.9 | 45% | 0.452 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -59 | -46.2 | 175.3 | 174.2 | -99.7 | 0 | 0 | 0 | 111.3 | V167 V168 F173 Q174 T175 | V167-F171 WeakPolarHBondContact O-CB 3.5Å; V167-F171 PolarHBondContact O-N 3.46Å; V168-F171 PolarHBondContact O-N 2.77Å; F171-F173 VanDerWaalsContact C-N 3.28Å; F171-F173 PolarHBondContact O-N 3.36Å; F171-Q174 PolarHBondContact O-N 3.27Å; F171-T175 HydrophobicContact CD1-CG2 4.16Å; F171-T175 HydrophobicContact CE1-CG2 3.88Å; F171-T175 HydrophobicContact CZ-CG2 4.15Å; F171-T175 WeakPolarHBondContact O-CB 3.39Å; F171-T175 WeakPolarHBondContact O-CG2 3.35Å; F171-T175 PolarHBondContact O-N 2.99Å |
| 172 | S | 89.3 | Confident | 87.5 | Confident | 4 Ų | 4 | 66.2 Ų | 66.2 | 3% | 0.028 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -63 | -32.5 | 178.2 | -75.5 | 0 | 0 | 0 | 0 | 113.1 | V168 T169 V170 A229 | V168-S172 VanDerWaalsContact O-CB 3.32Å; V168-S172 WeakPolarHBondContact O-CB 3.43Å; V168-S172 PolarHBondContact O-N 3.24Å; V168-S172 PolarHBondContact O-OG 3.48Å; T169-S172 PolarHBondContact O-N 3.15Å; V170-S172 VanDerWaalsContact C-N 3.35Å; V170-S172 PolarHBondContact O-N 2.99Å; S172-A229 WeakPolarHBondContact OG-CA 3.35Å; S172-A229 PolarHBondContact OG-O 3.04Å |
| 173 | F | 84.8 | Confident | 87 | Confident | 95 Ų | 95 | 68 Ų | 68 | 42% | 0.417 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -71.6 | -35.9 | 174.7 | -74.4 | -56.9 | 0 | 0 | 0 | 112.8 | Y66 T169 V170 F171 M236 | Y66-F173 HydrophobicContact CE2-CZ 4.03Å; T169-F173 HydrophobicContact CG2-CD2 3.84Å; T169-F173 HydrophobicContact CG2-CE2 3.29Å; T169-F173 HydrophobicContact CG2-CZ 4.17Å; T169-F173 WeakPolarHBondContact O-CD2 3.44Å; T169-F173 PolarHBondContact O-N 3.03Å; V170-F173 PolarHBondContact O-N 2.85Å; F171-F173 VanDerWaalsContact C-N 3.28Å; F171-F173 PolarHBondContact O-N 3.36Å; F173-M236 HydrophobicContact CB-CE 4.4Å; F173-M236 HydrophobicContact CB-SD 4.44Å; F173-M236 HydrophobicContact CD1-CE 3.24Å; F173-M236 HydrophobicContact CD1-CG 3.87Å; F173-M236 HydrophobicContact CD1-SD 3.11Å; F173-M236 WeakPolarHBondContact CD1-SD 3.45Å; F173-M236 HydrophobicContact CD2-CE 4.39Å; F173-M236 HydrophobicContact CE1-CE 3.35Å; F173-M236 HydrophobicContact CE1-CG 3.58Å; F173-M236 HydrophobicContact CE1-SD 3.46Å; F173-M236 WeakPolarHBondContact CE1-SD 3.29Å; F173-M236 HydrophobicContact CG-CE 3.75Å; F173-M236 HydrophobicContact CG-SD 4.01Å; F173-M236 HydrophobicContact CZ-CE 4.01Å |
| 174 | Q | 88.1 | Confident | 86.5 | Confident | 150 Ų | 150 | 67.6 Ų | 67.6 | 70% | 0.701 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -92.9 | -27.6 | -173.9 | -65.1 | -177.2 | 34.4 | 0 | 0 | 113.5 | V170 F171 K176 | V170-Q174 WeakPolarHBondContact O-CG 3.45Å; V170-Q174 PolarHBondContact O-N 3.31Å; V170-Q174 VanDerWaalsContact O-N 3.11Å; F171-Q174 PolarHBondContact O-N 3.27Å; Q174-K176 PolarHBondContact O-N 2.89Å |
| 175 | T | 83.3 | Confident | 86.2 | Confident | 22 Ų | 22 | 71.3 Ų | 71.3 | 14% | 0.135 | 38% | 0.384 | C | S | . | . | trans | -74.9 | 131 | -168.8 | -165.5 | 0 | 0 | 0 | 0 | 112.3 | F171 L177 | F171-T175 HydrophobicContact CD1-CG2 4.16Å; F171-T175 HydrophobicContact CE1-CG2 3.88Å; F171-T175 HydrophobicContact CZ-CG2 4.15Å; F171-T175 WeakPolarHBondContact O-CB 3.39Å; F171-T175 WeakPolarHBondContact O-CG2 3.35Å; F171-T175 PolarHBondContact O-N 2.99Å; T175-L177 VanDerWaalsContact C-N 3.26Å; T175-L177 WeakPolarHBondContact OG1-CB 3.08Å; T175-L177 PolarHBondContact OG1-N 3.13Å | ||
| 176 | K | 75.6 | Confident | 85.9 | Confident | 203 Ų | 203 | 71 Ų | 71 | 88% | 0.883 | 38% | 0.381 | S | S | * | . | trans | -76.8 | -15.9 | 170 | -61.5 | -177.2 | -178.5 | -179.6 | 0 | 112.1 | Q174 D178 | Q174-K176 PolarHBondContact O-N 2.89Å; K176-D178 PolarHBondContact O-N 2.91Å | ||
| 177 | L | 76.8 | Confident | 85.8 | Confident | 121 Ų | 121 | 72.5 Ų | 72.5 | 63% | 0.634 | 38% | 0.383 | S | S | * | . | S | Bend | trans | -70.7 | 123 | -179.2 | -65.2 | 179 | 0 | 0 | 0 | 111 | T175 V179 Q233 K239 | T175-L177 VanDerWaalsContact C-N 3.26Å; T175-L177 WeakPolarHBondContact OG1-CB 3.08Å; T175-L177 PolarHBondContact OG1-N 3.13Å; L177-V179 PolarHBondContact O-N 2.98Å; L177-V179 VanDerWaalsContact O-N 3.17Å; L177-Q233 PolarHBondContact O-OE1 2.94Å; L177-K239 VanDerWaalsContact C-NZ 3.3Å; L177-K239 PolarHBondContact O-NZ 3.07Å |
| 178 | D | 76.4 | Confident | 85.7 | Confident | 41 Ų | 41 | 73.1 Ų | 73.1 | 22% | 0.219 | 38% | 0.382 | C | S | . | . | trans | -78.6 | 92.2 | 178.8 | -167.8 | 3.3 | 0 | 0 | 0 | 112.8 | K176 T180 S181 K239 | K176-D178 PolarHBondContact O-N 2.91Å; D178-T180 PolarHBondContact O-N 2.93Å; D178-T180 WeakPolarHBondContact OD1-CA 3.05Å; D178-T180 WeakPolarHBondContact OD1-CB 3.48Å; D178-T180 PolarHBondContact OD1-N 3.23Å; D178-T180 PolarHBondContact OD1-OG1 2.88Å; D178-T180 PolarHBondContact OD2-OG1 3.36Å; D178-S181 WeakPolarHBondContact O-CB 3.24Å; D178-S181 PolarHBondContact O-N 3.46Å; D178-S181 PolarHBondContact OD1-N 2.93Å; D178-S181 PolarHBondContact OD2-OG 3.07Å; D178-K239 HydrophobicContact CB-CD 3.6Å; D178-K239 WeakPolarHBondContact OD1-CD 3.23Å | ||
| 179 | V | 78.2 | Confident | 85.7 | Confident | 29 Ų | 29 | 74.6 Ų | 74.6 | 18% | 0.176 | 39% | 0.387 | C | S | . | . | G | 310 helix | trans | -66.8 | -24.5 | 174.5 | 179.6 | 0 | 0 | 0 | 0 | 110.6 | L177 S181 C182 A229 F230 Q233 | L177-V179 PolarHBondContact O-N 2.98Å; L177-V179 VanDerWaalsContact O-N 3.17Å; V179-S181 PolarHBondContact O-N 3.41Å; V179-C182 WeakPolarHBondContact O-CB 3.5Å; V179-C182 PolarHBondContact O-N 3.31Å; V179-A229 HydrophobicContact CG1-CB 4.35Å; V179-F230 HydrophobicContact CG1-CB 4.23Å; V179-Q233 VanDerWaalsContact CG2-NE2 3.26Å |
| 180 | T | 78.5 | Confident | 85.7 | Confident | 3 Ų | 3 | 75.8 Ų | 75.8 | 2% | 0.018 | 40% | 0.396 | C | S | . | . | G | 310 helix | trans | -67.5 | -24.9 | 178.7 | 75.6 | 0 | 0 | 0 | 0 | 113 | D178 C182 Q183 F230 Q233 | D178-T180 PolarHBondContact O-N 2.93Å; D178-T180 WeakPolarHBondContact OD1-CA 3.05Å; D178-T180 WeakPolarHBondContact OD1-CB 3.48Å; D178-T180 PolarHBondContact OD1-N 3.23Å; D178-T180 PolarHBondContact OD1-OG1 2.88Å; D178-T180 PolarHBondContact OD2-OG1 3.36Å; T180-C182 PolarHBondContact O-N 2.89Å; T180-Q183 PolarHBondContact O-N 3.28Å; T180-F230 HydrophobicContact CG2-CD2 4.26Å; T180-F230 HydrophobicContact CG2-CE2 4.27Å; T180-Q233 HydrophobicContact CG2-CB 3.94Å |
| 181 | S | 79.6 | Confident | 85.8 | Confident | 89 Ų | 89 | 75.6 Ų | 75.6 | 62% | 0.622 | 40% | 0.395 | S | S | * | . | G | 310 helix | trans | -65.5 | -19 | 172.9 | -71.1 | 0 | 0 | 0 | 0 | 113.1 | D178 V179 Q183 | D178-S181 WeakPolarHBondContact O-CB 3.24Å; D178-S181 PolarHBondContact O-N 3.46Å; D178-S181 PolarHBondContact OD1-N 2.93Å; D178-S181 PolarHBondContact OD2-OG 3.07Å; V179-S181 PolarHBondContact O-N 3.41Å; S181-Q183 VanDerWaalsContact C-N 3.34Å; S181-Q183 PolarHBondContact O-N 2.85Å |
| 182 | C | 80.8 | Confident | 86 | Confident | 56 Ų | 56 | 74.6 Ų | 74.6 | 38% | 0.378 | 40% | 0.397 | S | S | . | . | G | 310 helix | trans | -90.5 | 14.2 | 179.2 | -63.2 | 0 | 0 | 0 | 0 | 113.9 | V179 T180 G184 I185 L186 | V179-C182 WeakPolarHBondContact O-CB 3.5Å; V179-C182 PolarHBondContact O-N 3.31Å; T180-C182 PolarHBondContact O-N 2.89Å; C182-G184 PolarHBondContact O-N 3.19Å; C182-G184 VanDerWaalsContact O-N 3.14Å; C182-I185 PolarHBondContact O-N 3.5Å; C182-L186 PolarHBondContact O-N 3.28Å; C182-L186 VanDerWaalsContact O-N 3.09Å |
| 183 | Q | 85.4 | Confident | 86.2 | Confident | 100 Ų | 100 | 74.9 Ų | 74.9 | 47% | 0.467 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -50.9 | -40.7 | -177.5 | -171.9 | -179.5 | -14.4 | 0 | 0 | 113.2 | T180 S181 I185 L186 F187 F230 | T180-Q183 PolarHBondContact O-N 3.28Å; S181-Q183 VanDerWaalsContact C-N 3.34Å; S181-Q183 PolarHBondContact O-N 2.85Å; Q183-I185 PolarHBondContact O-N 3.05Å; Q183-L186 PolarHBondContact O-N 2.91Å; Q183-F187 WeakPolarHBondContact O-CB 3.34Å; Q183-F187 PolarHBondContact O-N 3.18Å; Q183-F230 HydrophobicContact CB-CE2 3.84Å; Q183-F230 HydrophobicContact CB-CZ 4.24Å; Q183-F230 HydrophobicContact CG-CE2 4.08Å; Q183-F230 HydrophobicContact CG-CZ 3.98Å |
| 184 | G | 87.5 | Confident | 86.6 | Confident | 46 Ų | 46 | 76.8 Ų | 76.8 | 47% | 0.474 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -64.4 | -36.9 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | C182 F187 I188 | C182-G184 PolarHBondContact O-N 3.19Å; C182-G184 VanDerWaalsContact O-N 3.14Å; G184-F187 PolarHBondContact O-N 3.19Å; G184-I188 VanDerWaalsContact O-CG1 3.31Å; G184-I188 WeakPolarHBondContact O-CG1 3.41Å; G184-I188 PolarHBondContact O-N 3.41Å; G184-I188 VanDerWaalsContact O-N 3.08Å |
| 185 | I | 89.6 | Confident | 86.9 | Confident | 114 Ų | 114 | 74.2 Ų | 74.2 | 59% | 0.585 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -69.3 | -44.1 | 176.7 | -62 | 173 | 0 | 0 | 0 | 109.9 | C182 Q183 F187 I188 F189 | C182-I185 PolarHBondContact O-N 3.5Å; Q183-I185 PolarHBondContact O-N 3.05Å; I185-F187 VanDerWaalsContact C-N 3.3Å; I185-F187 PolarHBondContact O-N 3.22Å; I185-I188 PolarHBondContact O-N 3.48Å; I185-F189 WeakPolarHBondContact O-CB 3.38Å; I185-F189 PolarHBondContact O-N 3.02Å |
| 186 | L | 90.3 | Very high | 87.2 | Confident | 6 Ų | 6 | 75.1 Ų | 75.1 | 3% | 0.031 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -61.1 | -40.2 | 176.4 | -65.7 | 178.4 | 0 | 0 | 0 | 111.7 | C182 Q183 F189 C190 L223 M226 F227 F230 | C182-L186 PolarHBondContact O-N 3.28Å; C182-L186 VanDerWaalsContact O-N 3.09Å; Q183-L186 PolarHBondContact O-N 2.91Å; L186-F189 PolarHBondContact O-N 3.18Å; L186-C190 VanDerWaalsContact O-CB 3.23Å; L186-C190 WeakPolarHBondContact O-CB 3.48Å; L186-C190 PolarHBondContact O-N 2.9Å; L186-L223 HydrophobicContact CD2-CD1 4.39Å; L186-M226 HydrophobicContact CD2-CB 3.65Å; L186-M226 HydrophobicContact CD2-CE 4Å; L186-M226 HydrophobicContact CD2-SD 4.22Å; L186-F227 HydrophobicContact CB-CE1 3.87Å; L186-F227 HydrophobicContact CB-CZ 4.08Å; L186-F227 HydrophobicContact CD1-CD1 4.25Å; L186-F227 HydrophobicContact CD1-CE1 4.31Å; L186-F230 HydrophobicContact CD1-CB 3.78Å; L186-F230 HydrophobicContact CD1-CD2 3.75Å; L186-F230 HydrophobicContact CD1-CG 3.89Å |
| 187 | F | 91.9 | Very high | 87.9 | Confident | 141 Ų | 141 | 66.2 Ų | 66.2 | 62% | 0.618 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -61.4 | -50.2 | 175.2 | 178.7 | -102.7 | 0 | 0 | 0 | 112.1 | Q183 G184 I185 F189 C190 V191 | Q183-F187 WeakPolarHBondContact O-CB 3.34Å; Q183-F187 PolarHBondContact O-N 3.18Å; G184-F187 PolarHBondContact O-N 3.19Å; I185-F187 VanDerWaalsContact C-N 3.3Å; I185-F187 PolarHBondContact O-N 3.22Å; F187-F189 VanDerWaalsContact C-N 3.34Å; F187-F189 PolarHBondContact O-N 3.45Å; F187-C190 WeakPolarHBondContact O-CB 3.44Å; F187-C190 PolarHBondContact O-N 3.39Å; F187-V191 HydrophobicContact CE1-CG2 4.12Å; F187-V191 HydrophobicContact CE2-CG2 4.24Å; F187-V191 HydrophobicContact CZ-CG2 3.97Å; F187-V191 WeakPolarHBondContact O-CG2 3.21Å; F187-V191 PolarHBondContact O-N 2.97Å |
| 188 | I | 94 | Very high | 88.6 | Confident | 110 Ų | 110 | 64.7 Ų | 64.7 | 56% | 0.564 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -60.5 | -46.1 | 178.6 | -67 | 164.9 | 0 | 0 | 0 | 110.5 | G184 I185 C190 V191 V192 | G184-I188 VanDerWaalsContact O-CG1 3.31Å; G184-I188 WeakPolarHBondContact O-CG1 3.41Å; G184-I188 PolarHBondContact O-N 3.41Å; G184-I188 VanDerWaalsContact O-N 3.08Å; I185-I188 PolarHBondContact O-N 3.48Å; I188-C190 VanDerWaalsContact C-N 3.33Å; I188-C190 PolarHBondContact O-N 3.05Å; I188-V191 PolarHBondContact O-N 3.44Å; I188-V192 WeakPolarHBondContact O-CG2 3.39Å; I188-V192 PolarHBondContact O-N 3.05Å |
| 189 | F | 93.8 | Very high | 89.2 | Confident | 48 Ų | 48 | 66.5 Ų | 66.5 | 21% | 0.211 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -65 | -38.6 | -179.4 | -169.6 | -163.8 | 0 | 0 | 0 | 111.7 | I185 L186 F187 V192 M193 L219 L223 M226 | I185-F189 WeakPolarHBondContact O-CB 3.38Å; I185-F189 PolarHBondContact O-N 3.02Å; L186-F189 PolarHBondContact O-N 3.18Å; F187-F189 VanDerWaalsContact C-N 3.34Å; F187-F189 PolarHBondContact O-N 3.45Å; F189-V192 PolarHBondContact O-N 3.28Å; F189-M193 HydrophobicContact CD2-CG 3.89Å; F189-M193 HydrophobicContact CE2-CG 3.67Å; F189-M193 HydrophobicContact CE2-SD 4.06Å; F189-M193 HydrophobicContact CZ-CG 4.4Å; F189-M193 WeakPolarHBondContact O-CB 3.31Å; F189-M193 WeakPolarHBondContact O-CG 3.49Å; F189-M193 PolarHBondContact O-N 2.89Å; F189-L219 HydrophobicContact CE2-CB 4.47Å; F189-L219 HydrophobicContact CZ-CB 4.13Å; F189-L219 HydrophobicContact CZ-CD2 4.15Å; F189-L223 HydrophobicContact CB-CD1 4.1Å; F189-L223 HydrophobicContact CD1-CB 4.16Å; F189-L223 HydrophobicContact CD1-CD1 3.55Å; F189-L223 HydrophobicContact CD1-CG 4.34Å; F189-L223 HydrophobicContact CE1-CB 3.84Å; F189-L223 HydrophobicContact CE1-CD1 4.14Å; F189-L223 HydrophobicContact CG-CD1 3.95Å; F189-L223 HydrophobicContact CZ-CB 4.29Å; F189-M226 HydrophobicContact CD1-CE 3.63Å; F189-M226 HydrophobicContact CE1-CE 3.66Å |
| 190 | C | 93.1 | Very high | 89.6 | Confident | 50 Ų | 50 | 66.1 Ų | 66.1 | 34% | 0.338 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -61.1 | -43.9 | 173 | -173.3 | 0 | 0 | 0 | 0 | 112.5 | L186 F187 I188 M193 F194 L223 F227 | L186-C190 VanDerWaalsContact O-CB 3.23Å; L186-C190 WeakPolarHBondContact O-CB 3.48Å; L186-C190 PolarHBondContact O-N 2.9Å; F187-C190 WeakPolarHBondContact O-CB 3.44Å; F187-C190 PolarHBondContact O-N 3.39Å; I188-C190 VanDerWaalsContact C-N 3.33Å; I188-C190 PolarHBondContact O-N 3.05Å; C190-M193 PolarHBondContact O-N 3.32Å; C190-F194 WeakPolarHBondContact O-CB 3.42Å; C190-F194 PolarHBondContact O-N 2.96Å; C190-L223 HydrophobicContact CB-CD2 4.32Å; C190-F227 HydrophobicContact CB-CE2 4.11Å; C190-F227 HydrophobicContact CB-CZ 3.94Å |
| 191 | V | 94.3 | Very high | 89.9 | Confident | 57 Ų | 57 | 69.1 Ų | 69.1 | 35% | 0.345 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -63 | -43.7 | 177 | 171.8 | 0 | 0 | 0 | 0 | 110.9 | F187 I188 M193 F194 I195 | F187-V191 HydrophobicContact CE1-CG2 4.12Å; F187-V191 HydrophobicContact CE2-CG2 4.24Å; F187-V191 HydrophobicContact CZ-CG2 3.97Å; F187-V191 WeakPolarHBondContact O-CG2 3.21Å; F187-V191 PolarHBondContact O-N 2.97Å; I188-V191 PolarHBondContact O-N 3.44Å; V191-M193 PolarHBondContact O-N 3.43Å; V191-F194 PolarHBondContact O-N 2.97Å; V191-I195 HydrophobicContact CG1-CD1 3.82Å; V191-I195 HydrophobicContact CG1-CG1 4.43Å; V191-I195 WeakPolarHBondContact O-CG1 3.41Å; V191-I195 PolarHBondContact O-N 2.85Å |
| 192 | V | 95.1 | Very high | 90.2 | Very high | 82 Ų | 82 | 70.4 Ų | 70.4 | 50% | 0.497 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -60.2 | -46.7 | 176.3 | 170.8 | 0 | 0 | 0 | 0 | 111 | I188 F189 F194 I195 S196 | I188-V192 WeakPolarHBondContact O-CG2 3.39Å; I188-V192 PolarHBondContact O-N 3.05Å; F189-V192 PolarHBondContact O-N 3.28Å; V192-F194 VanDerWaalsContact C-N 3.33Å; V192-F194 PolarHBondContact O-N 3.49Å; V192-I195 PolarHBondContact O-N 2.73Å; V192-S196 WeakPolarHBondContact O-CB 3.42Å; V192-S196 PolarHBondContact O-N 3.2Å; V192-S196 PolarHBondContact O-OG 2.86Å |
| 193 | M | 93.7 | Very high | 90.3 | Very high | 10 Ų | 10 | 71 Ų | 71 | 5% | 0.049 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -64.2 | -35.4 | 177.5 | -77.1 | -65.9 | -62.6 | 0 | 0 | 113 | F189 C190 V191 S196 G197 Y216 L219 G220 L223 | F189-M193 HydrophobicContact CD2-CG 3.89Å; F189-M193 HydrophobicContact CE2-CG 3.67Å; F189-M193 HydrophobicContact CE2-SD 4.06Å; F189-M193 HydrophobicContact CZ-CG 4.4Å; F189-M193 WeakPolarHBondContact O-CB 3.31Å; F189-M193 WeakPolarHBondContact O-CG 3.49Å; F189-M193 PolarHBondContact O-N 2.89Å; C190-M193 PolarHBondContact O-N 3.32Å; V191-M193 PolarHBondContact O-N 3.43Å; M193-S196 WeakPolarHBondContact CA-OG 3.21Å; M193-S196 PolarHBondContact O-OG 3.05Å; M193-G197 PolarHBondContact O-N 3.35Å; M193-Y216 HydrophobicContact CE-CD1 4.47Å; M193-Y216 HydrophobicContact CE-CD2 3.85Å; M193-Y216 HydrophobicContact CE-CE1 4.19Å; M193-Y216 HydrophobicContact CE-CE2 3.52Å; M193-Y216 HydrophobicContact CE-CG 4.31Å; M193-Y216 WeakPolarHBondContact CE-O 3.41Å; M193-Y216 WeakPolarHBondContact O-CE2 3.39Å; M193-Y216 PolarHBondContact O-OH 2.63Å; M193-Y216 HydrophobicContact SD-CD2 4.26Å; M193-Y216 HydrophobicContact SD-CE2 4.09Å; M193-L219 HydrophobicContact CE-CB 4.25Å; M193-L219 HydrophobicContact SD-CB 3.72Å; M193-G220 VanDerWaalsContact CE-CA 3.47Å; M193-L223 HydrophobicContact CB-CD2 3.96Å; M193-L223 HydrophobicContact CG-CD2 3.75Å |
| 194 | F | 93.2 | Very high | 89.8 | Confident | 134 Ų | 134 | 68.6 Ų | 68.6 | 59% | 0.588 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -68.2 | -49.3 | 176.4 | 178.3 | -105.4 | 0 | 0 | 0 | 111.6 | C190 V191 V192 G197 L198 | C190-F194 WeakPolarHBondContact O-CB 3.42Å; C190-F194 PolarHBondContact O-N 2.96Å; V191-F194 PolarHBondContact O-N 2.97Å; V192-F194 VanDerWaalsContact C-N 3.33Å; V192-F194 PolarHBondContact O-N 3.49Å; F194-G197 PolarHBondContact O-N 3.34Å; F194-L198 HydrophobicContact CD1-CD1 4.23Å; F194-L198 HydrophobicContact CE1-CD1 3.63Å; F194-L198 HydrophobicContact CE1-CG 4.4Å; F194-L198 HydrophobicContact CZ-CD1 3.82Å; F194-L198 HydrophobicContact CZ-CG 4.3Å; F194-L198 PolarHBondContact O-N 2.94Å |
| 195 | I | 93.5 | Very high | 89.4 | Confident | 97 Ų | 97 | 71.3 Ų | 71.3 | 50% | 0.497 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -63.6 | -45 | 178.6 | -65.4 | 172.1 | 0 | 0 | 0 | 110.6 | V191 V192 G197 L198 V199 | V191-I195 HydrophobicContact CG1-CD1 3.82Å; V191-I195 HydrophobicContact CG1-CG1 4.43Å; V191-I195 WeakPolarHBondContact O-CG1 3.41Å; V191-I195 PolarHBondContact O-N 2.85Å; V192-I195 PolarHBondContact O-N 2.73Å; I195-G197 VanDerWaalsContact C-N 3.32Å; I195-G197 PolarHBondContact O-N 2.84Å; I195-L198 PolarHBondContact O-N 3.35Å; I195-V199 WeakPolarHBondContact O-CG2 3.11Å; I195-V199 PolarHBondContact O-N 3.48Å |
| 196 | S | 90.9 | Very high | 88.8 | Confident | 40 Ų | 40 | 74.2 Ų | 74.2 | 28% | 0.28 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -64.6 | -37.2 | 177.9 | 62.9 | 0 | 0 | 0 | 0 | 111.9 | V192 M193 V199 L200 Y216 | V192-S196 WeakPolarHBondContact O-CB 3.42Å; V192-S196 PolarHBondContact O-N 3.2Å; V192-S196 PolarHBondContact O-OG 2.86Å; M193-S196 WeakPolarHBondContact CA-OG 3.21Å; M193-S196 PolarHBondContact O-OG 3.05Å; S196-V199 PolarHBondContact O-N 3.11Å; S196-L200 WeakPolarHBondContact O-CB 3.32Å; S196-L200 VanDerWaalsContact O-CG 3.29Å; S196-L200 WeakPolarHBondContact O-CG 3.49Å; S196-L200 PolarHBondContact O-N 3.43Å; S196-Y216 WeakPolarHBondContact OG-CE2 3.15Å |
| 197 | G | 89.4 | Confident | 88.1 | Confident | 17 Ų | 17 | 80.9 Ų | 80.9 | 18% | 0.175 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -60.8 | -43.1 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | M193 F194 I195 L200 A201 Y216 | M193-G197 PolarHBondContact O-N 3.35Å; F194-G197 PolarHBondContact O-N 3.34Å; I195-G197 VanDerWaalsContact C-N 3.32Å; I195-G197 PolarHBondContact O-N 2.84Å; G197-L200 PolarHBondContact O-N 2.93Å; G197-A201 WeakPolarHBondContact O-CB 3.41Å; G197-A201 PolarHBondContact O-N 2.95Å; G197-Y216 WeakPolarHBondContact CA-OH 3.23Å |
| 198 | L | 90.4 | Very high | 87.4 | Confident | 88 Ų | 88 | 79.8 Ų | 79.8 | 46% | 0.461 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -63 | -43.8 | 175.1 | -73.3 | 179.1 | 0 | 0 | 0 | 112.2 | F194 I195 A201 I202 | F194-L198 HydrophobicContact CD1-CD1 4.23Å; F194-L198 HydrophobicContact CE1-CD1 3.63Å; F194-L198 HydrophobicContact CE1-CG 4.4Å; F194-L198 HydrophobicContact CZ-CD1 3.82Å; F194-L198 HydrophobicContact CZ-CG 4.3Å; F194-L198 PolarHBondContact O-N 2.94Å; I195-L198 PolarHBondContact O-N 3.35Å; L198-A201 PolarHBondContact O-N 2.84Å; L198-I202 WeakPolarHBondContact O-CG1 3.4Å; L198-I202 PolarHBondContact O-N 2.98Å |
| 199 | V | 89.3 | Confident | 86.8 | Confident | 79 Ų | 79 | 76.3 Ų | 76.3 | 48% | 0.479 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -62.4 | -45.8 | 176.6 | 173.3 | 0 | 0 | 0 | 0 | 110.3 | I195 S196 A201 I202 V203 | I195-V199 WeakPolarHBondContact O-CG2 3.11Å; I195-V199 PolarHBondContact O-N 3.48Å; S196-V199 PolarHBondContact O-N 3.11Å; V199-A201 PolarHBondContact O-N 3.08Å; V199-I202 PolarHBondContact O-N 3.14Å; V199-V203 HydrophobicContact CG1-CG2 4.05Å; V199-V203 WeakPolarHBondContact O-CB 3.44Å; V199-V203 VanDerWaalsContact O-CG2 3.25Å; V199-V203 WeakPolarHBondContact O-CG2 3.42Å; V199-V203 PolarHBondContact O-N 3.19Å |
| 200 | L | 86.9 | Confident | 86.1 | Confident | 21 Ų | 21 | 77.9 Ų | 77.9 | 11% | 0.11 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -60.3 | -44.8 | 176.5 | -73 | 173.9 | 0 | 0 | 0 | 111.7 | S196 G197 I202 V203 L204 L212 Y216 | S196-L200 WeakPolarHBondContact O-CB 3.32Å; S196-L200 VanDerWaalsContact O-CG 3.29Å; S196-L200 WeakPolarHBondContact O-CG 3.49Å; S196-L200 PolarHBondContact O-N 3.43Å; G197-L200 PolarHBondContact O-N 2.93Å; L200-I202 PolarHBondContact O-N 2.89Å; L200-V203 PolarHBondContact O-N 3.02Å; L200-L204 HydrophobicContact CB-CD1 4.15Å; L200-L204 HydrophobicContact CB-CG 4.42Å; L200-L204 VanDerWaalsContact O-CB 3.24Å; L200-L204 WeakPolarHBondContact O-CB 3.41Å; L200-L204 WeakPolarHBondContact O-CD1 3.26Å; L200-L204 WeakPolarHBondContact O-CG 3.5Å; L200-L204 PolarHBondContact O-N 3Å; L200-L212 HydrophobicContact CD2-CD2 3.36Å; L200-L212 HydrophobicContact CD2-CG 3.73Å; L200-Y216 HydrophobicContact CD1-CD1 4.34Å; L200-Y216 HydrophobicContact CD1-CD2 3.57Å; L200-Y216 HydrophobicContact CD1-CE2 4.23Å; L200-Y216 HydrophobicContact CD1-CG 3.64Å |
| 201 | A | 85.6 | Confident | 85.7 | Confident | 66 Ų | 66 | 83.4 Ų | 83.4 | 55% | 0.545 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -58 | -34.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | G197 L198 V199 P205 | G197-A201 WeakPolarHBondContact O-CB 3.41Å; G197-A201 PolarHBondContact O-N 2.95Å; L198-A201 PolarHBondContact O-N 2.84Å; V199-A201 PolarHBondContact O-N 3.08Å; A201-P205 VanDerWaalsContact O-CD 3.3Å; A201-P205 WeakPolarHBondContact O-CD 3.16Å |
| 202 | I | 85.7 | Confident | 85.3 | Confident | 117 Ų | 117 | 83.7 Ų | 83.7 | 60% | 0.6 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -80.6 | -37.4 | 177.7 | -64.1 | 167.6 | 0 | 0 | 0 | 111.9 | L198 V199 L200 P205 F206 | L198-I202 WeakPolarHBondContact O-CG1 3.4Å; L198-I202 PolarHBondContact O-N 2.98Å; V199-I202 PolarHBondContact O-N 3.14Å; L200-I202 PolarHBondContact O-N 2.89Å; I202-P205 WeakPolarHBondContact O-CD 3.23Å; I202-F206 WeakPolarHBondContact O-CD2 3.49Å; I202-F206 VanDerWaalsContact O-CE2 3.23Å; I202-F206 WeakPolarHBondContact O-CE2 3.18Å |
| 203 | V | 82.9 | Confident | 84.8 | Confident | 68 Ų | 68 | 81 Ų | 81 | 41% | 0.412 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -83.9 | -36 | -173.5 | 173.3 | 0 | 0 | 0 | 0 | 112.8 | V199 L200 P205 F206 Q207 | V199-V203 HydrophobicContact CG1-CG2 4.05Å; V199-V203 WeakPolarHBondContact O-CB 3.44Å; V199-V203 VanDerWaalsContact O-CG2 3.25Å; V199-V203 WeakPolarHBondContact O-CG2 3.42Å; V199-V203 PolarHBondContact O-N 3.19Å; L200-V203 PolarHBondContact O-N 3.02Å; V203-P205 VanDerWaalsContact C-CD 3.43Å; V203-P205 VanDerWaalsContact C-N 3.34Å; V203-F206 PolarHBondContact O-N 3.36Å; V203-Q207 PolarHBondContact O-N 2.9Å |
| 204 | L | 75.1 | Confident | 84.5 | Confident | 50 Ų | 50 | 82.7 Ų | 82.7 | 26% | 0.262 | 44% | 0.438 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.3 | -36 | -176.1 | -74.1 | 169.6 | 0 | 0 | 0 | 114.5 | L200 F206 Y208 | L200-L204 HydrophobicContact CB-CD1 4.15Å; L200-L204 HydrophobicContact CB-CG 4.42Å; L200-L204 VanDerWaalsContact O-CB 3.24Å; L200-L204 WeakPolarHBondContact O-CB 3.41Å; L200-L204 WeakPolarHBondContact O-CD1 3.26Å; L200-L204 WeakPolarHBondContact O-CG 3.5Å; L200-L204 PolarHBondContact O-N 3Å; L204-F206 PolarHBondContact O-N 3.33Å; L204-Y208 HydrophobicContact CD2-CD2 3.64Å; L204-Y208 HydrophobicContact CD2-CE2 3.99Å |
| 205 | P | 78.1 | Confident | 84.5 | Confident | 102 Ų | 102 | 80.3 Ų | 80.3 | 66% | 0.662 | 43% | 0.431 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.7 | -23.7 | 172.7 | -24.9 | 35 | 0 | 0 | 0 | 114.6 | A201 I202 V203 | A201-P205 VanDerWaalsContact O-CD 3.3Å; A201-P205 WeakPolarHBondContact O-CD 3.16Å; I202-P205 WeakPolarHBondContact O-CD 3.23Å; V203-P205 VanDerWaalsContact C-CD 3.43Å; V203-P205 VanDerWaalsContact C-N 3.34Å |
| 206 | F | 78.4 | Confident | 84.5 | Confident | 175 Ų | 175 | 77.9 Ų | 77.9 | 77% | 0.768 | 42% | 0.416 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.9 | -36.7 | -176.6 | -58.5 | -76.4 | 0 | 0 | 0 | 113.1 | I202 V203 L204 | I202-F206 WeakPolarHBondContact O-CD2 3.49Å; I202-F206 VanDerWaalsContact O-CE2 3.23Å; I202-F206 WeakPolarHBondContact O-CE2 3.18Å; V203-F206 PolarHBondContact O-N 3.36Å; L204-F206 PolarHBondContact O-N 3.33Å |
| 207 | Q | 74.9 | Confident | 84.6 | Confident | 146 Ų | 146 | 76 Ų | 76 | 68% | 0.682 | 40% | 0.402 | S | S | * | . | trans | -146.2 | 111.4 | 172.6 | -98.3 | -159 | -75.3 | 0 | 0 | 111 | V203 | V203-Q207 PolarHBondContact O-N 2.9Š| ||
| 208 | Y | 76.3 | Confident | 84.9 | Confident | 118 Ų | 118 | 77 Ų | 77 | 46% | 0.463 | 41% | 0.41 | S | S | . | . | trans | -80.9 | 121.3 | 174.2 | -171.4 | -111.9 | 0 | 0 | 0 | 111.1 | L204 P210 D213 | L204-Y208 HydrophobicContact CD2-CD2 3.64Å; L204-Y208 HydrophobicContact CD2-CE2 3.99Å; Y208-P210 HydrophobicContact CD1-CG 3.91Å; Y208-P210 HydrophobicContact CE1-CB 4.05Å; Y208-P210 HydrophobicContact CE1-CG 3.66Å; Y208-D213 PolarHBondContact OH-OD2 3.45Å; Y208-D213 VanDerWaalsContact OH-OD2 3.06Å | ||
| 209 | V | 81.6 | Confident | 85.1 | Confident | 37 Ų | 37 | 76.3 Ų | 76.3 | 22% | 0.224 | 41% | 0.406 | C | S | . | . | trans | -121.5 | 98.1 | 178.3 | -175.7 | 0 | 0 | 0 | 0 | 108.9 | W211 L212 D213 | V209-W211 VanDerWaalsContact C-N 3.33Å; V209-W211 HydrophobicContact CG1-CD2 4.04Å; V209-W211 VanDerWaalsContact CG1-CE2 3.43Å; V209-W211 HydrophobicContact CG1-CG 4Å; V209-W211 HydrophobicContact CG1-CZ2 4.01Å; V209-W211 PolarHBondContact O-N 3.45Å; V209-L212 HydrophobicContact CB-CB 4.19Å; V209-L212 HydrophobicContact CG1-CB 4.05Å; V209-L212 WeakPolarHBondContact O-CB 3.32Å; V209-L212 PolarHBondContact O-N 3.26Å; V209-L212 VanDerWaalsContact O-N 3.17Å; V209-D213 PolarHBondContact O-N 3.31Å | ||
| 210 | P | 80 | Confident | 85.5 | Confident | 81 Ų | 81 | 72.6 Ų | 72.6 | 53% | 0.526 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -60.3 | -36.4 | -170 | -22.4 | 28.4 | 0 | 0 | 0 | 114.7 | Y208 L212 D213 A214 | Y208-P210 HydrophobicContact CD1-CG 3.91Å; Y208-P210 HydrophobicContact CE1-CB 4.05Å; Y208-P210 HydrophobicContact CE1-CG 3.66Å; P210-L212 VanDerWaalsContact C-N 3.29Å; P210-L212 PolarHBondContact O-N 3.38Å; P210-D213 WeakPolarHBondContact O-CB 3.16Å; P210-D213 PolarHBondContact O-N 3Å; P210-A214 PolarHBondContact O-N 2.89Å |
| 211 | W | 84.1 | Confident | 85.9 | Confident | 167 Ų | 167 | 71.8 Ų | 71.8 | 63% | 0.633 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -68.8 | -30.2 | -178.4 | 65.4 | -99.6 | 0 | 0 | 0 | 112.5 | V209 A214 I215 | V209-W211 VanDerWaalsContact C-N 3.33Å; V209-W211 HydrophobicContact CG1-CD2 4.04Å; V209-W211 VanDerWaalsContact CG1-CE2 3.43Å; V209-W211 HydrophobicContact CG1-CG 4Å; V209-W211 HydrophobicContact CG1-CZ2 4.01Å; V209-W211 PolarHBondContact O-N 3.45Å; W211-A214 PolarHBondContact O-N 3.47Å; W211-I215 HydrophobicContact CE3-CD1 3.6Å; W211-I215 HydrophobicContact CZ3-CD1 3.81Å; W211-I215 WeakPolarHBondContact O-CG1 3.24Å; W211-I215 PolarHBondContact O-N 3.18Å |
| 212 | L | 86.1 | Confident | 86.4 | Confident | 62 Ų | 62 | 73.1 Ų | 73.1 | 33% | 0.325 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -71.1 | -39.9 | 179.7 | -173.6 | 63.4 | 0 | 0 | 0 | 110.9 | L200 V209 P210 I215 Y216 | L200-L212 HydrophobicContact CD2-CD2 3.36Å; L200-L212 HydrophobicContact CD2-CG 3.73Å; V209-L212 HydrophobicContact CB-CB 4.19Å; V209-L212 HydrophobicContact CG1-CB 4.05Å; V209-L212 WeakPolarHBondContact O-CB 3.32Å; V209-L212 PolarHBondContact O-N 3.26Å; V209-L212 VanDerWaalsContact O-N 3.17Å; P210-L212 VanDerWaalsContact C-N 3.29Å; P210-L212 PolarHBondContact O-N 3.38Å; L212-I215 PolarHBondContact O-N 3.25Å; L212-Y216 WeakPolarHBondContact O-CB 3.38Å; L212-Y216 PolarHBondContact O-N 2.85Å |
| 213 | D | 84.8 | Confident | 86.9 | Confident | 25 Ų | 25 | 67.7 Ų | 67.7 | 13% | 0.134 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -60.5 | -44.4 | 173.7 | -163 | 25 | 0 | 0 | 0 | 111.2 | Y208 V209 P210 Y216 A217 Q268 | Y208-D213 PolarHBondContact OH-OD2 3.45Å; Y208-D213 VanDerWaalsContact OH-OD2 3.06Å; V209-D213 PolarHBondContact O-N 3.31Å; P210-D213 WeakPolarHBondContact O-CB 3.16Å; P210-D213 PolarHBondContact O-N 3Å; D213-Y216 PolarHBondContact O-N 3.37Å; D213-A217 WeakPolarHBondContact O-CB 3.04Å; D213-A217 PolarHBondContact O-N 3.45Å; D213-Q268 PolarHBondContact OD1-NE2 3.49Å |
| 214 | A | 87.9 | Confident | 87.5 | Confident | 46 Ų | 46 | 66.3 Ų | 66.3 | 38% | 0.38 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -64.6 | -41.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | P210 W211 A217 A218 | P210-A214 PolarHBondContact O-N 2.89Å; W211-A214 PolarHBondContact O-N 3.47Å; A214-A217 PolarHBondContact O-N 2.98Å; A214-A218 WeakPolarHBondContact O-CB 3.46Å; A214-A218 PolarHBondContact O-N 3.3Å |
| 215 | I | 92.1 | Very high | 88.5 | Confident | 84 Ų | 84 | 65.4 Ų | 65.4 | 43% | 0.431 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -64.5 | -44.7 | 175.8 | -70.4 | 175.7 | 0 | 0 | 0 | 110.6 | W211 L212 A217 A218 L219 | W211-I215 HydrophobicContact CE3-CD1 3.6Å; W211-I215 HydrophobicContact CZ3-CD1 3.81Å; W211-I215 WeakPolarHBondContact O-CG1 3.24Å; W211-I215 PolarHBondContact O-N 3.18Å; L212-I215 PolarHBondContact O-N 3.25Å; I215-A217 VanDerWaalsContact C-N 3.3Å; I215-A217 PolarHBondContact O-N 3.34Å; I215-A218 PolarHBondContact O-N 3.28Å; I215-L219 HydrophobicContact CG2-CD1 3.94Å; I215-L219 HydrophobicContact CG2-CG 4.35Å; I215-L219 WeakPolarHBondContact O-CG 3.22Å; I215-L219 PolarHBondContact O-N 3.38Å |
| 216 | Y | 93.4 | Very high | 89.2 | Confident | 46 Ų | 46 | 63.7 Ų | 63.7 | 18% | 0.18 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -57.5 | -46.5 | 176.7 | -177 | -97.2 | 0 | 0 | 0 | 110.9 | M193 S196 G197 L200 L212 D213 A218 L219 G220 F265 | M193-Y216 HydrophobicContact CE-CD1 4.47Å; M193-Y216 HydrophobicContact CE-CD2 3.85Å; M193-Y216 HydrophobicContact CE-CE1 4.19Å; M193-Y216 HydrophobicContact CE-CE2 3.52Å; M193-Y216 HydrophobicContact CE-CG 4.31Å; M193-Y216 WeakPolarHBondContact CE-O 3.41Å; M193-Y216 WeakPolarHBondContact O-CE2 3.39Å; M193-Y216 PolarHBondContact O-OH 2.63Å; M193-Y216 HydrophobicContact SD-CD2 4.26Å; M193-Y216 HydrophobicContact SD-CE2 4.09Å; S196-Y216 WeakPolarHBondContact OG-CE2 3.15Å; G197-Y216 WeakPolarHBondContact CA-OH 3.23Å; L200-Y216 HydrophobicContact CD1-CD1 4.34Å; L200-Y216 HydrophobicContact CD1-CD2 3.57Å; L200-Y216 HydrophobicContact CD1-CE2 4.23Å; L200-Y216 HydrophobicContact CD1-CG 3.64Å; L212-Y216 WeakPolarHBondContact O-CB 3.38Å; L212-Y216 PolarHBondContact O-N 2.85Å; D213-Y216 PolarHBondContact O-N 3.37Å; Y216-A218 PolarHBondContact O-N 3.2Å; Y216-L219 PolarHBondContact O-N 3.21Å; Y216-G220 PolarHBondContact O-N 2.86Å; Y216-F265 HydrophobicContact CD1-CE1 4.25Å; Y216-F265 AromaticContact CE1-CE1 3.95Å; Y216-F265 HydrophobicContact CE1-CE1 3.95Å; Y216-F265 HydrophobicContact CE1-CZ 4.49Å |
| 217 | A | 93.7 | Very high | 90 | Very high | 0 Ų | 0 | 57.2 Ų | 57.2 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -63.2 | -42 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | D213 A214 I215 G220 A221 F265 Q268 I269 | D213-A217 WeakPolarHBondContact O-CB 3.04Å; D213-A217 PolarHBondContact O-N 3.45Å; A214-A217 PolarHBondContact O-N 2.98Å; I215-A217 VanDerWaalsContact C-N 3.3Å; I215-A217 PolarHBondContact O-N 3.34Å; A217-G220 PolarHBondContact O-N 3.05Å; A217-A221 WeakPolarHBondContact O-CB 3.37Å; A217-A221 PolarHBondContact O-N 3.47Å; A217-F265 HydrophobicContact CB-CD1 4.13Å; A217-Q268 HydrophobicContact CB-CB 3.82Å; A217-Q268 HydrophobicContact CB-CG 3.74Å; A217-I269 HydrophobicContact CB-CD1 4.17Å; A217-I269 HydrophobicContact CB-CG1 3.55Å |
| 218 | A | 95 | Very high | 91 | Very high | 40 Ų | 40 | 50.3 Ų | 50.3 | 33% | 0.331 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -62.8 | -44.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | A214 I215 Y216 G220 A221 I222 I269 | A214-A218 WeakPolarHBondContact O-CB 3.46Å; A214-A218 PolarHBondContact O-N 3.3Å; I215-A218 PolarHBondContact O-N 3.28Å; Y216-A218 PolarHBondContact O-N 3.2Å; A218-G220 VanDerWaalsContact C-N 3.34Å; A218-A221 PolarHBondContact O-N 2.93Å; A218-I222 VanDerWaalsContact O-CG1 3.31Å; A218-I222 WeakPolarHBondContact O-CG1 3.39Å; A218-I222 PolarHBondContact O-N 3.35Å; A218-I269 HydrophobicContact CB-CD1 4.24Å |
| 219 | L | 96.1 | Very high | 91.8 | Very high | 73 Ų | 73 | 45.1 Ų | 45.1 | 38% | 0.382 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -64.3 | -39.2 | 175.7 | -68.9 | 175.3 | 0 | 0 | 0 | 111.7 | F189 M193 I215 Y216 I222 L223 | F189-L219 HydrophobicContact CE2-CB 4.47Å; F189-L219 HydrophobicContact CZ-CB 4.13Å; F189-L219 HydrophobicContact CZ-CD2 4.15Å; M193-L219 HydrophobicContact CE-CB 4.25Å; M193-L219 HydrophobicContact SD-CB 3.72Å; I215-L219 HydrophobicContact CG2-CD1 3.94Å; I215-L219 HydrophobicContact CG2-CG 4.35Å; I215-L219 WeakPolarHBondContact O-CG 3.22Å; I215-L219 PolarHBondContact O-N 3.38Å; Y216-L219 PolarHBondContact O-N 3.21Å; L219-I222 PolarHBondContact O-N 3.35Å; L219-L223 WeakPolarHBondContact O-CB 3.36Å; L219-L223 PolarHBondContact O-N 3.45Å |
| 220 | G | 96.1 | Very high | 92.3 | Very high | 0 Ų | 0 | 44.2 Ų | 44.2 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -62.3 | -46.9 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | M193 Y216 A217 A218 I222 L223 F224 F265 | M193-G220 VanDerWaalsContact CE-CA 3.47Å; Y216-G220 PolarHBondContact O-N 2.86Å; A217-G220 PolarHBondContact O-N 3.05Å; A218-G220 VanDerWaalsContact C-N 3.34Å; G220-I222 VanDerWaalsContact C-N 3.31Å; G220-I222 PolarHBondContact O-N 2.96Å; G220-L223 PolarHBondContact O-N 3.16Å; G220-F224 WeakPolarHBondContact O-CD2 3.25Å; G220-F224 PolarHBondContact O-N 2.96Å; G220-F265 VanDerWaalsContact C-CD2 3.46Å |
| 221 | A | 96.5 | Very high | 92.8 | Very high | 5 Ų | 5 | 41.3 Ų | 41.3 | 4% | 0.041 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -58.3 | -44.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | A217 A218 T225 F265 F266 I269 | A217-A221 WeakPolarHBondContact O-CB 3.37Å; A217-A221 PolarHBondContact O-N 3.47Å; A218-A221 PolarHBondContact O-N 2.93Å; A221-T225 VanDerWaalsContact O-CB 3.22Å; A221-T225 WeakPolarHBondContact O-CB 3.41Å; A221-T225 PolarHBondContact O-N 3.49Å; A221-T225 PolarHBondContact O-OG1 3.34Å; A221-F265 HydrophobicContact CB-CB 3.91Å; A221-F266 HydrophobicContact CB-CD1 4.3Å; A221-F266 HydrophobicContact CB-CE1 3.92Å; A221-I269 HydrophobicContact CB-CD1 4.45Å |
| 222 | I | 95.5 | Very high | 93.2 | Very high | 94 Ų | 94 | 33.4 Ų | 33.4 | 48% | 0.482 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -62.9 | -47.6 | 176.4 | -67.7 | 165.6 | 0 | 0 | 0 | 110.8 | A218 L219 G220 T225 M226 | A218-I222 VanDerWaalsContact O-CG1 3.31Å; A218-I222 WeakPolarHBondContact O-CG1 3.39Å; A218-I222 PolarHBondContact O-N 3.35Å; L219-I222 PolarHBondContact O-N 3.35Å; G220-I222 VanDerWaalsContact C-N 3.31Å; G220-I222 PolarHBondContact O-N 2.96Å; I222-T225 PolarHBondContact O-N 3.47Å; I222-M226 HydrophobicContact CG2-CE 4.04Å; I222-M226 WeakPolarHBondContact O-CG 3.43Å; I222-M226 PolarHBondContact O-N 3.02Å |
| 223 | L | 95.6 | Very high | 93.3 | Very high | 2 Ų | 2 | 30.6 Ų | 30.6 | 1% | 0.01 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -58.6 | -52.7 | -179.9 | 175.7 | 62.6 | 0 | 0 | 0 | 111.8 | L186 F189 C190 M193 L219 G220 T225 M226 F227 | L186-L223 HydrophobicContact CD2-CD1 4.39Å; F189-L223 HydrophobicContact CB-CD1 4.1Å; F189-L223 HydrophobicContact CD1-CB 4.16Å; F189-L223 HydrophobicContact CD1-CD1 3.55Å; F189-L223 HydrophobicContact CD1-CG 4.34Å; F189-L223 HydrophobicContact CE1-CB 3.84Å; F189-L223 HydrophobicContact CE1-CD1 4.14Å; F189-L223 HydrophobicContact CG-CD1 3.95Å; F189-L223 HydrophobicContact CZ-CB 4.29Å; C190-L223 HydrophobicContact CB-CD2 4.32Å; M193-L223 HydrophobicContact CB-CD2 3.96Å; M193-L223 HydrophobicContact CG-CD2 3.75Å; L219-L223 WeakPolarHBondContact O-CB 3.36Å; L219-L223 PolarHBondContact O-N 3.45Å; G220-L223 PolarHBondContact O-N 3.16Å; L223-T225 VanDerWaalsContact C-N 3.29Å; L223-T225 PolarHBondContact O-N 2.88Å; L223-M226 HydrophobicContact CD1-CE 4.37Å; L223-M226 WeakPolarHBondContact O-CA 3.45Å; L223-M226 WeakPolarHBondContact O-CB 3.41Å; L223-M226 PolarHBondContact O-N 2.9Å; L223-F227 HydrophobicContact CD1-CD2 3.91Å; L223-F227 HydrophobicContact CD1-CE2 3.48Å; L223-F227 VanDerWaalsContact CD1-CE2 3.48Å; L223-F227 HydrophobicContact CD1-CZ 4.23Å; L223-F227 HydrophobicContact CD2-CE2 4.08Å; L223-F227 HydrophobicContact CG-CD2 3.86Å; L223-F227 HydrophobicContact CG-CE2 3.65Å; L223-F227 PolarHBondContact O-N 3.17Å |
| 224 | F | 96.2 | Very high | 93.3 | Very high | 39 Ų | 39 | 30.4 Ų | 30.4 | 17% | 0.171 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -69.6 | -27.2 | -179.6 | -81.6 | -83 | 0 | 0 | 0 | 112.8 | G220 M226 F227 L228 D258 Y261 I262 F265 | G220-F224 WeakPolarHBondContact O-CD2 3.25Å; G220-F224 PolarHBondContact O-N 2.96Å; F224-M226 VanDerWaalsContact C-N 3.32Å; F224-F227 HydrophobicContact CD1-CD2 4.43Å; F224-F227 PolarHBondContact O-N 2.92Å; F224-L228 WeakPolarHBondContact O-CB 3.34Å; F224-L228 PolarHBondContact O-N 3.34Å; F224-D258 HydrophobicContact CD1-CB 4.43Å; F224-D258 WeakPolarHBondContact CD1-OD1 3.41Å; F224-Y261 HydrophobicContact CD1-CD2 4.17Å; F224-Y261 HydrophobicContact CD1-CG 4.3Å; F224-Y261 AromaticContact CE1-CD2 3.42Å; F224-Y261 HydrophobicContact CE1-CD2 3.42Å; F224-Y261 VanDerWaalsContact CE1-CD2 3.42Å; F224-Y261 HydrophobicContact CE1-CE2 4.25Å; F224-Y261 AromaticContact CE1-CG 3.81Å; F224-Y261 HydrophobicContact CE1-CG 3.81Å; F224-Y261 HydrophobicContact CE2-CD2 4.49Å; F224-Y261 HydrophobicContact CE2-CG 4.17Å; F224-Y261 HydrophobicContact CZ-CD1 4.4Å; F224-Y261 AromaticContact CZ-CD2 3.6Å; F224-Y261 HydrophobicContact CZ-CD2 3.6Å; F224-Y261 HydrophobicContact CZ-CE2 4.23Å; F224-Y261 AromaticContact CZ-CG 3.71Å; F224-Y261 HydrophobicContact CZ-CG 3.71Å; F224-I262 HydrophobicContact CB-CD1 4.5Å; F224-I262 HydrophobicContact CB-CG1 3.74Å; F224-F265 HydrophobicContact CD2-CD2 4.04Å; F224-F265 AromaticContact CD2-CE2 3.42Å; F224-F265 HydrophobicContact CD2-CE2 3.42Å; F224-F265 VanDerWaalsContact CD2-CE2 3.42Å; F224-F265 HydrophobicContact CD2-CZ 4.42Å; F224-F265 AromaticContact CE2-CE2 3.56Å; F224-F265 HydrophobicContact CE2-CE2 3.56Å; F224-F265 HydrophobicContact CE2-CZ 4.26Å; F224-F265 HydrophobicContact CG-CE2 4.49Å |
| 225 | T | 95.9 | Very high | 93.2 | Very high | 32 Ų | 32 | 28.4 Ų | 28.4 | 20% | 0.196 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -64.9 | -37.4 | 169.2 | -60 | 0 | 0 | 0 | 0 | 111.5 | V164 V168 A221 I222 L223 A229 | V164-T225 HydrophobicContact CG1-CG2 3.9Å; V168-T225 HydrophobicContact CG2-CG2 3.5Å; A221-T225 VanDerWaalsContact O-CB 3.22Å; A221-T225 WeakPolarHBondContact O-CB 3.41Å; A221-T225 PolarHBondContact O-N 3.49Å; A221-T225 PolarHBondContact O-OG1 3.34Å; I222-T225 PolarHBondContact O-N 3.47Å; L223-T225 VanDerWaalsContact C-N 3.29Å; L223-T225 PolarHBondContact O-N 2.88Å; T225-A229 PolarHBondContact O-N 3.43Å; T225-A229 VanDerWaalsContact O-N 3.13Å |
| 226 | M | 93.7 | Very high | 92.5 | Very high | 66 Ų | 66 | 25.1 Ų | 25.1 | 33% | 0.325 | 13% | 0.132 | S | C | . | . | H | α-helix | trans | -71.3 | -37.2 | 173.3 | -66.8 | -173.9 | -65.4 | 0 | 0 | 112.5 | L186 F189 I222 L223 F224 A229 F230 | L186-M226 HydrophobicContact CD2-CB 3.65Å; L186-M226 HydrophobicContact CD2-CE 4Å; L186-M226 HydrophobicContact CD2-SD 4.22Å; F189-M226 HydrophobicContact CD1-CE 3.63Å; F189-M226 HydrophobicContact CE1-CE 3.66Å; I222-M226 HydrophobicContact CG2-CE 4.04Å; I222-M226 WeakPolarHBondContact O-CG 3.43Å; I222-M226 PolarHBondContact O-N 3.02Å; L223-M226 HydrophobicContact CD1-CE 4.37Å; L223-M226 WeakPolarHBondContact O-CA 3.45Å; L223-M226 WeakPolarHBondContact O-CB 3.41Å; L223-M226 PolarHBondContact O-N 2.9Å; F224-M226 VanDerWaalsContact C-N 3.32Å; M226-A229 WeakPolarHBondContact O-CB 3.18Å; M226-A229 PolarHBondContact O-N 2.76Å; M226-F230 WeakPolarHBondContact O-CB 3.3Å; M226-F230 PolarHBondContact O-N 3.43Å |
| 227 | F | 94.6 | Very high | 91.2 | Very high | 38 Ų | 38 | 23.4 Ų | 23.4 | 17% | 0.167 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -61.7 | -43.5 | 171.2 | -81 | -60 | 0 | 0 | 0 | 111.6 | L186 C190 L223 F224 A229 F230 D231 D258 | L186-F227 HydrophobicContact CB-CE1 3.87Å; L186-F227 HydrophobicContact CB-CZ 4.08Å; L186-F227 HydrophobicContact CD1-CD1 4.25Å; L186-F227 HydrophobicContact CD1-CE1 4.31Å; C190-F227 HydrophobicContact CB-CE2 4.11Å; C190-F227 HydrophobicContact CB-CZ 3.94Å; L223-F227 HydrophobicContact CD1-CD2 3.91Å; L223-F227 HydrophobicContact CD1-CE2 3.48Å; L223-F227 VanDerWaalsContact CD1-CE2 3.48Å; L223-F227 HydrophobicContact CD1-CZ 4.23Å; L223-F227 HydrophobicContact CD2-CE2 4.08Å; L223-F227 HydrophobicContact CG-CD2 3.86Å; L223-F227 HydrophobicContact CG-CE2 3.65Å; L223-F227 PolarHBondContact O-N 3.17Å; F224-F227 HydrophobicContact CD1-CD2 4.43Å; F224-F227 PolarHBondContact O-N 2.92Å; F227-A229 VanDerWaalsContact C-N 3.25Å; F227-A229 PolarHBondContact O-N 3.19Å; F227-F230 CarbonylContact O-C 3.55Å; F227-F230 WeakPolarHBondContact O-CA 3.48Å; F227-F230 WeakPolarHBondContact O-CB 3.44Å; F227-F230 PolarHBondContact O-N 3.34Å; F227-D231 PolarHBondContact O-N 3.04Å; F227-D258 WeakPolarHBondContact CB-OD1 3.31Å |
| 228 | L | 95.3 | Very high | 89.4 | Confident | 1 Ų | 1 | 29 Ų | 29 | 1% | 0.005 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -57.1 | -43 | 174.9 | -179.3 | 63.7 | 0 | 0 | 0 | 111.2 | C165 V168 F224 T232 I255 D258 I259 I262 | C165-L228 HydrophobicContact CB-CD2 4.01Å; V168-L228 HydrophobicContact CB-CD2 4.18Å; V168-L228 HydrophobicContact CG1-CB 4.28Å; V168-L228 HydrophobicContact CG1-CD2 4.02Å; V168-L228 HydrophobicContact CG1-CG 3.98Å; F224-L228 WeakPolarHBondContact O-CB 3.34Å; F224-L228 PolarHBondContact O-N 3.34Å; L228-T232 WeakPolarHBondContact O-CB 3.42Å; L228-T232 PolarHBondContact O-N 2.94Å; L228-T232 PolarHBondContact O-OG1 3.06Å; L228-I255 HydrophobicContact CD1-CG2 3.83Å; L228-D258 VanDerWaalsContact CA-OD2 3.27Å; L228-D258 WeakPolarHBondContact CA-OD2 3.34Å; L228-D258 HydrophobicContact CB-CB 4.04Å; L228-D258 HydrophobicContact CD1-CB 4.33Å; L228-D258 PolarHBondContact N-OD2 3.37Å; L228-I259 HydrophobicContact CD1-CD1 4.44Å; L228-I259 HydrophobicContact CD1-CG1 4.02Å; L228-I259 HydrophobicContact CD2-CG1 4.47Å; L228-I262 HydrophobicContact CB-CD1 4.26Å; L228-I262 HydrophobicContact CD2-CD1 3.98Å |
| 229 | A | 93.4 | Very high | 87.5 | Confident | 9 Ų | 9 | 29.2 Ų | 29.2 | 7% | 0.074 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -63.5 | -44.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112 | V168 S172 V179 T225 M226 F227 Q233 | V168-A229 HydrophobicContact CG1-CB 3.76Å; S172-A229 WeakPolarHBondContact OG-CA 3.35Å; S172-A229 PolarHBondContact OG-O 3.04Å; V179-A229 HydrophobicContact CG1-CB 4.35Å; T225-A229 PolarHBondContact O-N 3.43Å; T225-A229 VanDerWaalsContact O-N 3.13Å; M226-A229 WeakPolarHBondContact O-CB 3.18Å; M226-A229 PolarHBondContact O-N 2.76Å; F227-A229 VanDerWaalsContact C-N 3.25Å; F227-A229 PolarHBondContact O-N 3.19Å; A229-Q233 WeakPolarHBondContact O-CB 3.46Å; A229-Q233 VanDerWaalsContact O-CG 3.25Å; A229-Q233 WeakPolarHBondContact O-CG 3.23Å; A229-Q233 PolarHBondContact O-N 3.17Å |
| 230 | F | 91.7 | Very high | 85 | Confident | 18 Ų | 18 | 36.1 Ų | 36.1 | 8% | 0.079 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -60.6 | -54.3 | 177.7 | 176.8 | -88 | 0 | 0 | 0 | 111.8 | V179 T180 Q183 L186 M226 F227 T232 Q233 L234 | V179-F230 HydrophobicContact CG1-CB 4.23Å; T180-F230 HydrophobicContact CG2-CD2 4.26Å; T180-F230 HydrophobicContact CG2-CE2 4.27Å; Q183-F230 HydrophobicContact CB-CE2 3.84Å; Q183-F230 HydrophobicContact CB-CZ 4.24Å; Q183-F230 HydrophobicContact CG-CE2 4.08Å; Q183-F230 HydrophobicContact CG-CZ 3.98Å; L186-F230 HydrophobicContact CD1-CB 3.78Å; L186-F230 HydrophobicContact CD1-CD2 3.75Å; L186-F230 HydrophobicContact CD1-CG 3.89Å; M226-F230 WeakPolarHBondContact O-CB 3.3Å; M226-F230 PolarHBondContact O-N 3.43Å; F227-F230 CarbonylContact O-C 3.55Å; F227-F230 WeakPolarHBondContact O-CA 3.48Å; F227-F230 WeakPolarHBondContact O-CB 3.44Å; F227-F230 PolarHBondContact O-N 3.34Å; F230-T232 PolarHBondContact O-N 3.42Å; F230-Q233 PolarHBondContact O-N 3.05Å; F230-Q233 VanDerWaalsContact O-N 3.15Å; F230-L234 HydrophobicContact CE1-CD2 3.83Å; F230-L234 HydrophobicContact CZ-CD2 4.4Å; F230-L234 WeakPolarHBondContact O-CB 3.48Å; F230-L234 PolarHBondContact O-N 3.45Å |
| 231 | D | 92.1 | Very high | 82.7 | Confident | 21 Ų | 21 | 42 Ų | 42 | 11% | 0.112 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -67.5 | -36.7 | -177.1 | -77 | -28.8 | 0 | 0 | 0 | 111.9 | F227 Q233 L234 L235 N254 I255 | F227-D231 PolarHBondContact O-N 3.04Å; D231-Q233 VanDerWaalsContact C-N 3.34Å; D231-Q233 PolarHBondContact O-N 3.3Å; D231-L234 PolarHBondContact O-N 2.81Å; D231-L235 VanDerWaalsContact O-CB 3.32Å; D231-L235 WeakPolarHBondContact O-CB 3.36Å; D231-L235 PolarHBondContact O-N 3.37Å; D231-N254 WeakPolarHBondContact OD2-CB 3.33Å; D231-I255 HydrophobicContact CB-CG1 3.81Å |
| 232 | T | 90.9 | Very high | 80.6 | Confident | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -64.2 | -39.6 | 173.4 | -58.7 | 0 | 0 | 0 | 0 | 111 | Y66 T169 L228 F230 M236 | Y66-T232 VanDerWaalsContact OH-CG2 3.23Å; Y66-T232 WeakPolarHBondContact OH-CG2 3.35Å; T169-T232 HydrophobicContact CG2-CG2 4.38Å; L228-T232 WeakPolarHBondContact O-CB 3.42Å; L228-T232 PolarHBondContact O-N 2.94Å; L228-T232 PolarHBondContact O-OG1 3.06Å; F230-T232 PolarHBondContact O-N 3.42Å; T232-M236 HydrophobicContact CG2-CE 3.21Å; T232-M236 WeakPolarHBondContact O-CE 3.22Å; T232-M236 WeakPolarHBondContact O-CG 3.35Å; T232-M236 PolarHBondContact O-N 2.94Å |
| 233 | Q | 88.9 | Confident | 78.9 | Confident | 4 Ų | 4 | 44.4 Ų | 44.4 | 2% | 0.019 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -71.7 | -36.8 | 175.9 | -73.6 | -178 | 26.5 | 0 | 0 | 113.1 | L177 V179 T180 A229 F230 D231 L235 M236 G237 | L177-Q233 PolarHBondContact O-OE1 2.94Å; V179-Q233 VanDerWaalsContact CG2-NE2 3.26Å; T180-Q233 HydrophobicContact CG2-CB 3.94Å; A229-Q233 WeakPolarHBondContact O-CB 3.46Å; A229-Q233 VanDerWaalsContact O-CG 3.25Å; A229-Q233 WeakPolarHBondContact O-CG 3.23Å; A229-Q233 PolarHBondContact O-N 3.17Å; F230-Q233 PolarHBondContact O-N 3.05Å; F230-Q233 VanDerWaalsContact O-N 3.15Å; D231-Q233 VanDerWaalsContact C-N 3.34Å; D231-Q233 PolarHBondContact O-N 3.3Å; Q233-L235 VanDerWaalsContact C-N 3.32Å; Q233-M236 PolarHBondContact O-N 2.92Å; Q233-G237 PolarHBondContact O-N 3.23Å |
| 234 | L | 85.4 | Confident | 77.3 | Confident | 21 Ų | 21 | 46.6 Ų | 46.6 | 11% | 0.11 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -63.7 | -40.1 | 175.2 | -174.2 | 58.5 | 0 | 0 | 0 | 111.2 | F230 D231 M236 G237 Y241 M243 | F230-L234 HydrophobicContact CE1-CD2 3.83Å; F230-L234 HydrophobicContact CZ-CD2 4.4Å; F230-L234 WeakPolarHBondContact O-CB 3.48Å; F230-L234 PolarHBondContact O-N 3.45Å; D231-L234 PolarHBondContact O-N 2.81Å; L234-M236 VanDerWaalsContact C-N 3.32Å; L234-M236 PolarHBondContact O-N 3.3Å; L234-G237 PolarHBondContact O-N 2.87Å; L234-Y241 VanDerWaalsContact CD1-CB 3.49Å; L234-Y241 HydrophobicContact CD1-CG 4.47Å; L234-M243 HydrophobicContact CD1-CE 4.07Å; L234-M243 HydrophobicContact CD1-CG 4.2Å; L234-M243 HydrophobicContact CD2-CE 3.38Å; L234-M243 HydrophobicContact CD2-CG 4.49Å; L234-M243 HydrophobicContact CG-CE 3.77Å; L234-M243 HydrophobicContact CG-CG 3.88Å |
| 235 | L | 85.3 | Confident | 75.5 | Confident | 4 Ų | 4 | 48 Ų | 48 | 2% | 0.021 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -61.5 | -38.2 | 173.8 | -179.7 | 73.6 | 0 | 0 | 0 | 112.5 | F61 I62 V65 Y66 D231 Q233 G237 A251 I255 | F61-L235 HydrophobicContact CD1-CD1 4.1Å; F61-L235 HydrophobicContact CE1-CD1 3.31Å; F61-L235 HydrophobicContact CE1-CG 4.3Å; F61-L235 HydrophobicContact CZ-CD1 3.79Å; I62-L235 HydrophobicContact CG1-CG 4.34Å; V65-L235 HydrophobicContact CB-CD1 3.95Å; V65-L235 HydrophobicContact CB-CD2 4.26Å; V65-L235 HydrophobicContact CG1-CD1 3.84Å; V65-L235 HydrophobicContact CG1-CD2 3.79Å; V65-L235 HydrophobicContact CG2-CD1 3.71Å; Y66-L235 HydrophobicContact CD2-CD2 4.07Å; Y66-L235 HydrophobicContact CE2-CD2 3.53Å; D231-L235 VanDerWaalsContact O-CB 3.32Å; D231-L235 WeakPolarHBondContact O-CB 3.36Å; D231-L235 PolarHBondContact O-N 3.37Å; Q233-L235 VanDerWaalsContact C-N 3.32Å; L235-G237 PolarHBondContact O-N 3.47Å; L235-A251 HydrophobicContact CD1-CB 3.82Å; L235-I255 HydrophobicContact CB-CD1 4.44Å; L235-I255 HydrophobicContact CD2-CD1 3.9Å |
| 236 | M | 76.9 | Confident | 73.9 | Confident | 14 Ų | 14 | 51.5 Ų | 51.5 | 7% | 0.069 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -72.4 | -15.1 | -178.6 | -72.2 | 176.2 | -133.5 | 0 | 0 | 114.3 | R58 F173 T232 Q233 L234 N238 | R58-M236 WeakPolarHBondContact CD-O 3.43Å; R58-M236 PolarHBondContact NE-O 3.47Å; F173-M236 HydrophobicContact CB-CE 4.4Å; F173-M236 HydrophobicContact CB-SD 4.44Å; F173-M236 HydrophobicContact CD1-CE 3.24Å; F173-M236 HydrophobicContact CD1-CG 3.87Å; F173-M236 HydrophobicContact CD1-SD 3.11Å; F173-M236 WeakPolarHBondContact CD1-SD 3.45Å; F173-M236 HydrophobicContact CD2-CE 4.39Å; F173-M236 HydrophobicContact CE1-CE 3.35Å; F173-M236 HydrophobicContact CE1-CG 3.58Å; F173-M236 HydrophobicContact CE1-SD 3.46Å; F173-M236 WeakPolarHBondContact CE1-SD 3.29Å; F173-M236 HydrophobicContact CG-CE 3.75Å; F173-M236 HydrophobicContact CG-SD 4.01Å; F173-M236 HydrophobicContact CZ-CE 4.01Å; T232-M236 HydrophobicContact CG2-CE 3.21Å; T232-M236 WeakPolarHBondContact O-CE 3.22Å; T232-M236 WeakPolarHBondContact O-CG 3.35Å; T232-M236 PolarHBondContact O-N 2.94Å; Q233-M236 PolarHBondContact O-N 2.92Å; L234-M236 VanDerWaalsContact C-N 3.32Å; L234-M236 PolarHBondContact O-N 3.3Å; M236-N238 HydrophobicContact CB-CB 4.4Å; M236-N238 PolarHBondContact O-N 2.83Å |
| 237 | G | 66.1 | Low | 73.1 | Confident | 10 Ų | 10 | 50.3 Ų | 50.3 | 10% | 0.103 | 25% | 0.248 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 57.8 | 18.5 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | Q233 L234 L235 K239 | Q233-G237 PolarHBondContact O-N 3.23Å; L234-G237 PolarHBondContact O-N 2.87Å; L235-G237 PolarHBondContact O-N 3.47Å; G237-K239 PolarHBondContact O-N 2.79Å |
| 238 | N | 56.1 | Low | 72.5 | Confident | 117 Ų | 117 | 49.5 Ų | 49.5 | 63% | 0.626 | 24% | 0.244 | S | C | * | . | trans | -81.6 | 2.6 | -171.6 | -141.9 | 19.2 | 0 | 0 | 0 | 112.7 | M236 | M236-N238 HydrophobicContact CB-CB 4.4Å; M236-N238 PolarHBondContact O-N 2.83Å | ||
| 239 | K | 56.1 | Low | 72.1 | Confident | 45 Ų | 45 | 49.5 Ų | 49.5 | 20% | 0.196 | 24% | 0.244 | C | C | . | . | S | Bend | trans | -144.7 | -169.3 | -167.9 | -56.3 | -170.2 | -175.3 | 154.9 | 0 | 110.8 | L177 D178 G237 Y241 | L177-K239 VanDerWaalsContact C-NZ 3.3Å; L177-K239 PolarHBondContact O-NZ 3.07Å; D178-K239 HydrophobicContact CB-CD 3.6Å; D178-K239 WeakPolarHBondContact OD1-CD 3.23Å; G237-K239 PolarHBondContact O-N 2.79Å; K239-Y241 PolarHBondContact O-N 3.42Å |
| 240 | R | 42.7 | Very low | 71.8 | Confident | 218 Ų | 218 | 51.4 Ų | 51.4 | 82% | 0.823 | 25% | 0.251 | S | S | * | . | S | Bend | trans | -56.7 | -13.7 | -167 | -69 | -77.4 | -173.1 | 170.3 | 0.1 | 116.3 | ||
| 241 | Y | 47.5 | Very low | 71.8 | Confident | 125 Ų | 125 | 51.1 Ų | 51.1 | 49% | 0.49 | 25% | 0.252 | S | S | . | . | trans | -123.9 | 120.4 | -178.9 | -60.3 | -77.3 | 0 | 0 | 0 | 110.6 | L234 K239 | L234-Y241 VanDerWaalsContact CD1-CB 3.49Å; L234-Y241 HydrophobicContact CD1-CG 4.47Å; K239-Y241 PolarHBondContact O-N 3.42Å | ||
| 242 | T | 53.5 | Low | 71.8 | Confident | 101 Ų | 101 | 50.1 Ų | 50.1 | 62% | 0.62 | 25% | 0.246 | S | C | * | . | trans | -111.4 | 117.8 | 176.5 | -17.3 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 243 | M | 58.8 | Low | 72 | Confident | 48 Ų | 48 | 50.1 Ų | 50.1 | 24% | 0.236 | 25% | 0.246 | C | C | . | . | trans | -73.5 | 134.6 | 174.5 | -77.8 | -70 | 177.2 | 0 | 0 | 110 | L234 | L234-M243 HydrophobicContact CD1-CE 4.07Å; L234-M243 HydrophobicContact CD1-CG 4.2Å; L234-M243 HydrophobicContact CD2-CE 3.38Å; L234-M243 HydrophobicContact CD2-CG 4.49Å; L234-M243 HydrophobicContact CG-CE 3.77Å; L234-M243 HydrophobicContact CG-CG 3.88Å | ||
| 244 | S | 62.3 | Low | 72.2 | Confident | 48 Ų | 48 | 51 Ų | 51 | 34% | 0.336 | 25% | 0.251 | S | S | . | . | trans | -60.8 | 138.3 | 172.1 | 174.9 | 0 | 0 | 0 | 0 | 109.2 | E246 E247 | S244-E246 PolarHBondContact O-N 2.95Å; S244-E246 PolarHBondContact OG-N 2.78Å; S244-E247 PolarHBondContact O-N 3.24Å | ||
| 245 | P | 58.8 | Low | 72.7 | Confident | 69 Ų | 69 | 50.1 Ų | 50.1 | 45% | 0.448 | 25% | 0.247 | S | C | . | . | G | 310 helix | trans | -53.7 | -19.9 | 175 | -27.6 | 35.3 | 0 | 0 | 0 | 114.3 | I57 F61 E247 Y248 | I57-P245 HydrophobicContact CG2-CG 4.13Å; F61-P245 HydrophobicContact CD2-CB 4.08Å; F61-P245 WeakPolarHBondContact CE2-O 3.4Å; P245-E247 PolarHBondContact O-N 3.36Å; P245-Y248 WeakPolarHBondContact O-CD1 3.27Å |
| 246 | E | 61.3 | Low | 73.3 | Confident | 105 Ų | 105 | 49.9 Ų | 49.9 | 49% | 0.491 | 25% | 0.246 | S | C | . | . | G | 310 helix | trans | -69.8 | -15.7 | 174.8 | -61.6 | -178.4 | -179.2 | 0 | 0 | 113.9 | R122 S244 | R122-E246 IonicContact CZ-OE2 2.93Å; R122-E246 IonicContact NE-OE2 3.8Å; R122-E246 IonicContact NH1-OE2 3.85Å; R122-E246 PolarHBondContact NH1-OE2 3Å; S244-E246 PolarHBondContact O-N 2.95Å; S244-E246 PolarHBondContact OG-N 2.78Å |
| 247 | E | 77.8 | Confident | 74.2 | Confident | 41 Ų | 41 | 49.9 Ų | 49.9 | 19% | 0.192 | 25% | 0.246 | C | C | . | . | G | 310 helix | trans | -101.9 | 15.9 | -173.8 | -57.2 | -166.3 | 159.3 | 0 | 0 | 113.3 | R122 S244 P245 V249 F250 A251 | R122-E247 IonicContact CZ-OE1 3.58Å; R122-E247 IonicContact NH2-OE1 2.77Å; R122-E247 PolarHBondContact NH2-OE1 2.86Å; S244-E247 PolarHBondContact O-N 3.24Å; P245-E247 PolarHBondContact O-N 3.36Å; E247-V249 PolarHBondContact O-N 3.44Å; E247-F250 PolarHBondContact O-N 2.85Å; E247-A251 PolarHBondContact O-N 3Å; E247-A251 VanDerWaalsContact O-N 3.11Å |
| 248 | Y | 81.8 | Confident | 75.7 | Confident | 21 Ų | 21 | 49.7 Ų | 49.7 | 8% | 0.082 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -53 | -33.7 | 179.6 | 72.3 | -91.8 | 0 | 0 | 0 | 112.7 | F61 K64 I68 N127 P245 T252 | F61-Y248 VanDerWaalsContact CE2-CA 3.49Å; K64-Y248 HydrophobicContact CD-CD2 4.39Å; K64-Y248 HydrophobicContact CD-CG 4.46Å; K64-Y248 VanDerWaalsContact NZ-CZ 3.27Å; K64-Y248 PolarHBondContact NZ-OH 3.46Å; I68-Y248 HydrophobicContact CD1-CD2 3.73Å; I68-Y248 HydrophobicContact CD1-CE2 3.63Å; N127-Y248 PolarHBondContact ND2-OH 3.48Å; P245-Y248 WeakPolarHBondContact O-CD1 3.27Å; Y248-T252 VanDerWaalsContact O-CB 3.3Å; Y248-T252 WeakPolarHBondContact O-CB 3.43Å; Y248-T252 PolarHBondContact O-N 2.66Å; Y248-T252 PolarHBondContact O-OG1 3.47Å |
| 249 | V | 86.1 | Confident | 77.7 | Confident | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -67.3 | -40.5 | 179.1 | 177.4 | 0 | 0 | 0 | 0 | 111.4 | L114 R121 N127 L131 E247 L253 | L114-V249 HydrophobicContact CD2-CG1 4.05Å; R121-V249 HydrophobicContact CG-CB 4.14Å; R121-V249 HydrophobicContact CG-CG1 4.29Å; N127-V249 HydrophobicContact CB-CG2 4.08Å; L131-V249 HydrophobicContact CD1-CG1 4.18Å; E247-V249 PolarHBondContact O-N 3.44Å; V249-L253 WeakPolarHBondContact O-CB 3.31Å; V249-L253 PolarHBondContact O-N 3.3Å |
| 250 | F | 88.6 | Confident | 79.6 | Confident | 49 Ų | 49 | 43.2 Ų | 43.2 | 22% | 0.215 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -69.9 | -43.4 | 178.1 | -175.5 | -109.9 | 0 | 0 | 0 | 111.3 | E247 T252 L253 N254 | E247-F250 PolarHBondContact O-N 2.85Å; F250-T252 PolarHBondContact O-N 2.9Å; F250-L253 WeakPolarHBondContact O-CB 3.5Å; F250-L253 PolarHBondContact O-N 3.42Å; F250-N254 WeakPolarHBondContact CE1-ND2 3.46Å; F250-N254 WeakPolarHBondContact CZ-ND2 3.5Å; F250-N254 PolarHBondContact O-N 2.89Å; F250-N254 PolarHBondContact O-ND2 2.81Å |
| 251 | A | 90.7 | Very high | 82.2 | Confident | 12 Ų | 12 | 36.3 Ų | 36.3 | 10% | 0.099 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -61.1 | -44.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | L235 E247 L253 N254 I255 | L235-A251 HydrophobicContact CD1-CB 3.82Å; E247-A251 PolarHBondContact O-N 3Å; E247-A251 VanDerWaalsContact O-N 3.11Å; A251-L253 VanDerWaalsContact C-N 3.33Å; A251-L253 PolarHBondContact O-N 2.54Å; A251-N254 PolarHBondContact O-N 2.92Å; A251-I255 VanDerWaalsContact O-CG1 3.31Å; A251-I255 WeakPolarHBondContact O-CG1 3.23Å; A251-I255 PolarHBondContact O-N 3.33Å; A251-I255 VanDerWaalsContact O-N 3.15Å |
| 252 | T | 93.1 | Very high | 84.6 | Confident | 0 Ų | 0 | 30.4 Ų | 30.4 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -60.7 | -44.3 | 175.7 | -53.6 | 0 | 0 | 0 | 0 | 111 | V65 I68 L69 L131 Y248 F250 Y256 | V65-T252 WeakPolarHBondContact CG1-OG1 3.46Å; I68-T252 HydrophobicContact CB-CG2 4.08Å; I68-T252 HydrophobicContact CG2-CG2 3.79Å; L69-T252 HydrophobicContact CB-CG2 4.31Å; L131-T252 HydrophobicContact CD2-CG2 4.45Å; Y248-T252 VanDerWaalsContact O-CB 3.3Å; Y248-T252 WeakPolarHBondContact O-CB 3.43Å; Y248-T252 PolarHBondContact O-N 2.66Å; Y248-T252 PolarHBondContact O-OG1 3.47Å; F250-T252 PolarHBondContact O-N 2.9Å; T252-Y256 VanDerWaalsContact O-CB 3.25Å; T252-Y256 WeakPolarHBondContact O-CB 3.21Å; T252-Y256 PolarHBondContact O-N 3.26Å |
| 253 | L | 93.7 | Very high | 86.7 | Confident | 0 Ų | 0 | 26 Ų | 26 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -59.1 | -49.2 | -180 | 176.5 | 154.5 | 0 | 0 | 0 | 112 | Y111 L114 L131 F134 V249 F250 A251 Y256 L257 | Y111-L253 HydrophobicContact CD2-CD1 4.41Å; Y111-L253 HydrophobicContact CD2-CD2 3.85Å; Y111-L253 HydrophobicContact CE2-CD2 3.7Å; L114-L253 HydrophobicContact CB-CD1 3.57Å; L114-L253 HydrophobicContact CD1-CD1 3.56Å; L114-L253 HydrophobicContact CG-CD1 4.2Å; L131-L253 HydrophobicContact CD1-CB 4.36Å; F134-L253 HydrophobicContact CD1-CD1 4.47Å; F134-L253 HydrophobicContact CD1-CG 4.46Å; F134-L253 HydrophobicContact CE1-CB 4.48Å; F134-L253 HydrophobicContact CE1-CD1 4.23Å; F134-L253 HydrophobicContact CE1-CG 3.79Å; F134-L253 HydrophobicContact CE2-CD1 4.33Å; F134-L253 HydrophobicContact CE2-CG 4.34Å; F134-L253 HydrophobicContact CZ-CD1 4.16Å; F134-L253 HydrophobicContact CZ-CD2 4.34Å; F134-L253 HydrophobicContact CZ-CG 3.72Å; V249-L253 WeakPolarHBondContact O-CB 3.31Å; V249-L253 PolarHBondContact O-N 3.3Å; F250-L253 WeakPolarHBondContact O-CB 3.5Å; F250-L253 PolarHBondContact O-N 3.42Å; A251-L253 VanDerWaalsContact C-N 3.33Å; A251-L253 PolarHBondContact O-N 2.54Å; L253-Y256 PolarHBondContact O-N 2.88Å; L253-L257 HydrophobicContact CD2-CD1 3.77Å; L253-L257 HydrophobicContact CD2-CG 4.45Å; L253-L257 WeakPolarHBondContact O-CG 3.34Å; L253-L257 PolarHBondContact O-N 3.31Å |
| 254 | N | 94.3 | Very high | 88.5 | Confident | 23 Ų | 23 | 24.7 Ų | 24.7 | 12% | 0.123 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -69.1 | -45.3 | -177.7 | -64.4 | -32.9 | 0 | 0 | 0 | 112.1 | D231 F250 A251 Y256 L257 D258 | D231-N254 WeakPolarHBondContact OD2-CB 3.33Å; F250-N254 WeakPolarHBondContact CE1-ND2 3.46Å; F250-N254 WeakPolarHBondContact CZ-ND2 3.5Å; F250-N254 PolarHBondContact O-N 2.89Å; F250-N254 PolarHBondContact O-ND2 2.81Å; A251-N254 PolarHBondContact O-N 2.92Å; N254-Y256 PolarHBondContact O-N 3.49Å; N254-L257 WeakPolarHBondContact O-CB 3.46Å; N254-L257 PolarHBondContact O-N 3.48Å; N254-D258 PolarHBondContact O-N 3.43Å |
| 255 | I | 95.7 | Very high | 90.1 | Very high | 2 Ų | 2 | 23.3 Ų | 23.3 | 1% | 0.01 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -58.8 | -40.1 | 177 | -65.1 | 171.4 | 0 | 0 | 0 | 110.7 | V65 L69 L228 D231 L235 A251 D258 I259 | V65-I255 HydrophobicContact CG1-CD1 4.49Å; L69-I255 HydrophobicContact CD1-CB 4.5Å; L69-I255 HydrophobicContact CD1-CG2 4.04Å; L69-I255 HydrophobicContact CD2-CG2 3.51Å; L69-I255 HydrophobicContact CG-CG2 4.43Å; L228-I255 HydrophobicContact CD1-CG2 3.83Å; D231-I255 HydrophobicContact CB-CG1 3.81Å; L235-I255 HydrophobicContact CB-CD1 4.44Å; L235-I255 HydrophobicContact CD2-CD1 3.9Å; A251-I255 VanDerWaalsContact O-CG1 3.31Å; A251-I255 WeakPolarHBondContact O-CG1 3.23Å; A251-I255 PolarHBondContact O-N 3.33Å; A251-I255 VanDerWaalsContact O-N 3.15Å; I255-D258 PolarHBondContact O-N 3.14Å; I255-I259 HydrophobicContact CG2-CD1 4.07Å; I255-I259 VanDerWaalsContact O-CG1 3.27Å; I255-I259 WeakPolarHBondContact O-CG1 3.39Å; I255-I259 PolarHBondContact O-N 3.47Å |
| 256 | Y | 97.3 | Very high | 91.9 | Very high | 0 Ų | 0 | 21 Ų | 21 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -64.9 | -43.6 | 175.7 | 173.5 | -105 | 0 | 0 | 0 | 112.6 | L69 Q72 L73 T76 F134 T135 L138 S139 T252 L253 N254 D258 I259 V260 | L69-Y256 HydrophobicContact CD1-CD2 4.41Å; Q72-Y256 HydrophobicContact CB-CD2 3.66Å; Q72-Y256 HydrophobicContact CB-CE2 3.75Å; Q72-Y256 HydrophobicContact CB-CG 4.34Å; Q72-Y256 VanDerWaalsContact OE1-CB 3.32Å; L73-Y256 HydrophobicContact CD2-CD2 3.95Å; L73-Y256 HydrophobicContact CD2-CE2 4.19Å; L73-Y256 HydrophobicContact CG-CD2 4.47Å; T76-Y256 VanDerWaalsContact OG1-CE2 3.32Å; T76-Y256 WeakPolarHBondContact OG1-CE2 3.32Å; T76-Y256 PolarHBondContact OG1-OH 3.32Å; F134-Y256 HydrophobicContact CD1-CD1 4.37Å; F134-Y256 HydrophobicContact CD1-CE1 4.39Å; F134-Y256 AromaticContact CE1-CD1 3.54Å; F134-Y256 HydrophobicContact CE1-CD1 3.54Å; F134-Y256 AromaticContact CE1-CE1 3.87Å; F134-Y256 HydrophobicContact CE1-CE1 3.87Å; F134-Y256 HydrophobicContact CZ-CD1 4.23Å; T135-Y256 HydrophobicContact CG2-CE2 4.46Å; T135-Y256 PolarHBondContact O-OH 3.39Å; L138-Y256 HydrophobicContact CB-CE1 4.16Å; L138-Y256 HydrophobicContact CD2-CD1 3.98Å; L138-Y256 HydrophobicContact CD2-CE1 3.39Å; L138-Y256 HydrophobicContact CG-CE1 4.24Å; S139-Y256 PolarHBondContact OG-OH 3.27Å; T252-Y256 VanDerWaalsContact O-CB 3.25Å; T252-Y256 WeakPolarHBondContact O-CB 3.21Å; T252-Y256 PolarHBondContact O-N 3.26Å; L253-Y256 PolarHBondContact O-N 2.88Å; N254-Y256 PolarHBondContact O-N 3.49Å; Y256-D258 VanDerWaalsContact C-N 3.33Å; Y256-D258 PolarHBondContact O-N 3.23Å; Y256-I259 PolarHBondContact O-N 3.29Å; Y256-V260 HydrophobicContact CD2-CG2 4.2Å; Y256-V260 HydrophobicContact CE1-CG2 4.3Å; Y256-V260 HydrophobicContact CE2-CG2 3.76Å; Y256-V260 WeakPolarHBondContact O-CG2 3.4Å; Y256-V260 PolarHBondContact O-N 2.93Å; Y256-V260 VanDerWaalsContact O-N 3.09Å |
| 257 | L | 96.6 | Very high | 93.4 | Very high | 13 Ų | 13 | 16 Ų | 16 | 7% | 0.068 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -56.8 | -47.8 | 174 | -74.4 | 177.7 | 0 | 0 | 0 | 111.4 | F107 Y111 F134 L138 L253 N254 I259 V260 Y261 | F107-L257 HydrophobicContact CE2-CD2 3.73Å; F107-L257 HydrophobicContact CZ-CD2 3.81Å; Y111-L257 HydrophobicContact CD2-CD1 3.87Å; Y111-L257 HydrophobicContact CE2-CD1 3.51Å; F134-L257 HydrophobicContact CE2-CD2 4.03Å; F134-L257 HydrophobicContact CZ-CD1 4.17Å; F134-L257 HydrophobicContact CZ-CD2 3.47Å; F134-L257 VanDerWaalsContact CZ-CD2 3.47Å; F134-L257 HydrophobicContact CZ-CG 3.72Å; L138-L257 HydrophobicContact CD2-CD2 3.6Å; L253-L257 HydrophobicContact CD2-CD1 3.77Å; L253-L257 HydrophobicContact CD2-CG 4.45Å; L253-L257 WeakPolarHBondContact O-CG 3.34Å; L253-L257 PolarHBondContact O-N 3.31Å; N254-L257 WeakPolarHBondContact O-CB 3.46Å; N254-L257 PolarHBondContact O-N 3.48Å; L257-I259 VanDerWaalsContact C-N 3.33Å; L257-I259 PolarHBondContact O-N 2.88Å; L257-V260 PolarHBondContact O-N 3.08Å; L257-Y261 HydrophobicContact CB-CD2 4.18Å; L257-Y261 HydrophobicContact CB-CE2 4.27Å; L257-Y261 HydrophobicContact CD2-CE2 3.94Å; L257-Y261 WeakPolarHBondContact O-CB 3.37Å; L257-Y261 WeakPolarHBondContact O-CD2 3.04Å; L257-Y261 PolarHBondContact O-N 2.95Å |
| 258 | D | 97 | Very high | 94.1 | Very high | 7 Ų | 7 | 17 Ų | 17 | 4% | 0.037 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -57.5 | -47.5 | -178.4 | -67.5 | -21 | 0 | 0 | 0 | 111.6 | F224 F227 L228 N254 I255 Y256 V260 Y261 I262 | F224-D258 HydrophobicContact CD1-CB 4.43Å; F224-D258 WeakPolarHBondContact CD1-OD1 3.41Å; F227-D258 WeakPolarHBondContact CB-OD1 3.31Å; L228-D258 VanDerWaalsContact CA-OD2 3.27Å; L228-D258 WeakPolarHBondContact CA-OD2 3.34Å; L228-D258 HydrophobicContact CB-CB 4.04Å; L228-D258 HydrophobicContact CD1-CB 4.33Å; L228-D258 PolarHBondContact N-OD2 3.37Å; N254-D258 PolarHBondContact O-N 3.43Å; I255-D258 PolarHBondContact O-N 3.14Å; Y256-D258 VanDerWaalsContact C-N 3.33Å; Y256-D258 PolarHBondContact O-N 3.23Å; D258-V260 PolarHBondContact O-N 3.44Å; D258-Y261 PolarHBondContact O-N 3.24Å; D258-I262 WeakPolarHBondContact O-CB 3.5Å; D258-I262 WeakPolarHBondContact O-CD1 3.2Å; D258-I262 WeakPolarHBondContact O-CG1 3.1Å; D258-I262 PolarHBondContact O-N 2.91Å |
| 259 | I | 97.3 | Very high | 94.6 | Very high | 21 Ų | 21 | 18.8 Ų | 18.8 | 11% | 0.108 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -62.2 | -44.5 | 179.9 | -63.2 | 172.1 | 0 | 0 | 0 | 111.1 | L69 L73 T161 L228 I255 Y256 L257 I262 F263 | L69-I259 HydrophobicContact CD1-CD1 4.3Å; L69-I259 HydrophobicContact CD2-CD1 4.21Å; L73-I259 HydrophobicContact CD1-CD1 3.89Å; L73-I259 HydrophobicContact CD2-CB 4.19Å; L73-I259 HydrophobicContact CD2-CD1 4.31Å; L73-I259 HydrophobicContact CD2-CG2 3.64Å; T161-I259 HydrophobicContact CG2-CG2 4.02Å; L228-I259 HydrophobicContact CD1-CD1 4.44Å; L228-I259 HydrophobicContact CD1-CG1 4.02Å; L228-I259 HydrophobicContact CD2-CG1 4.47Å; I255-I259 HydrophobicContact CG2-CD1 4.07Å; I255-I259 VanDerWaalsContact O-CG1 3.27Å; I255-I259 WeakPolarHBondContact O-CG1 3.39Å; I255-I259 PolarHBondContact O-N 3.47Å; Y256-I259 PolarHBondContact O-N 3.29Å; L257-I259 VanDerWaalsContact C-N 3.33Å; L257-I259 PolarHBondContact O-N 2.88Å; I259-I262 PolarHBondContact O-N 3.44Å; I259-F263 PolarHBondContact O-N 3.32Å |
| 260 | V | 97.7 | Very high | 94.9 | Very high | 5 Ų | 5 | 23.2 Ų | 23.2 | 3% | 0.03 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -68.4 | -37.6 | -179.5 | 173.4 | 0 | 0 | 0 | 0 | 112 | T76 L138 T142 Y256 L257 D258 F263 S264 | T76-V260 HydrophobicContact CG2-CG2 4.48Å; L138-V260 HydrophobicContact CD1-CG1 4.17Å; L138-V260 HydrophobicContact CD2-CB 3.94Å; L138-V260 HydrophobicContact CD2-CG1 3.82Å; L138-V260 HydrophobicContact CD2-CG2 4.06Å; L138-V260 HydrophobicContact CG-CG1 3.89Å; T142-V260 HydrophobicContact CG2-CG1 4.16Å; T142-V260 WeakPolarHBondContact OG1-CG1 3.3Å; Y256-V260 HydrophobicContact CD2-CG2 4.2Å; Y256-V260 HydrophobicContact CE1-CG2 4.3Å; Y256-V260 HydrophobicContact CE2-CG2 3.76Å; Y256-V260 WeakPolarHBondContact O-CG2 3.4Å; Y256-V260 PolarHBondContact O-N 2.93Å; Y256-V260 VanDerWaalsContact O-N 3.09Å; L257-V260 PolarHBondContact O-N 3.08Å; D258-V260 PolarHBondContact O-N 3.44Å; V260-F263 PolarHBondContact O-N 2.98Å; V260-S264 PolarHBondContact O-N 3.47Å; V260-S264 PolarHBondContact O-OG 2.99Å |
| 261 | Y | 96.6 | Very high | 94.9 | Very high | 73 Ų | 73 | 21.6 Ų | 21.6 | 29% | 0.286 | 11% | 0.108 | S | C | . | . | H | α-helix | trans | -71.8 | -39.4 | 175.8 | -78.2 | -61.1 | 0 | 0 | 0 | 112.1 | F224 L257 D258 F263 S264 F265 | F224-Y261 HydrophobicContact CD1-CD2 4.17Å; F224-Y261 HydrophobicContact CD1-CG 4.3Å; F224-Y261 AromaticContact CE1-CD2 3.42Å; F224-Y261 HydrophobicContact CE1-CD2 3.42Å; F224-Y261 VanDerWaalsContact CE1-CD2 3.42Å; F224-Y261 HydrophobicContact CE1-CE2 4.25Å; F224-Y261 AromaticContact CE1-CG 3.81Å; F224-Y261 HydrophobicContact CE1-CG 3.81Å; F224-Y261 HydrophobicContact CE2-CD2 4.49Å; F224-Y261 HydrophobicContact CE2-CG 4.17Å; F224-Y261 HydrophobicContact CZ-CD1 4.4Å; F224-Y261 AromaticContact CZ-CD2 3.6Å; F224-Y261 HydrophobicContact CZ-CD2 3.6Å; F224-Y261 HydrophobicContact CZ-CE2 4.23Å; F224-Y261 AromaticContact CZ-CG 3.71Å; F224-Y261 HydrophobicContact CZ-CG 3.71Å; L257-Y261 HydrophobicContact CB-CD2 4.18Å; L257-Y261 HydrophobicContact CB-CE2 4.27Å; L257-Y261 HydrophobicContact CD2-CE2 3.94Å; L257-Y261 WeakPolarHBondContact O-CB 3.37Å; L257-Y261 WeakPolarHBondContact O-CD2 3.04Å; L257-Y261 PolarHBondContact O-N 2.95Å; D258-Y261 PolarHBondContact O-N 3.24Å; Y261-F263 VanDerWaalsContact C-N 3.29Å; Y261-F263 PolarHBondContact O-N 2.77Å; Y261-S264 PolarHBondContact O-N 3.09Å; Y261-S264 VanDerWaalsContact O-N 3.13Å; Y261-F265 WeakPolarHBondContact O-CD2 3.13Å; Y261-F265 PolarHBondContact O-N 2.97Å |
| 262 | I | 97.6 | Very high | 94.7 | Very high | 0 Ų | 0 | 25.1 Ų | 25.1 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -55 | -47.4 | 170.7 | -69.7 | 162.7 | 0 | 0 | 0 | 110.1 | T161 F224 L228 D258 I259 S264 F265 F266 | T161-I262 HydrophobicContact CG2-CB 4.41Å; T161-I262 HydrophobicContact CG2-CG2 4.03Å; F224-I262 HydrophobicContact CB-CD1 4.5Å; F224-I262 HydrophobicContact CB-CG1 3.74Å; L228-I262 HydrophobicContact CB-CD1 4.26Å; L228-I262 HydrophobicContact CD2-CD1 3.98Å; D258-I262 WeakPolarHBondContact O-CB 3.5Å; D258-I262 WeakPolarHBondContact O-CD1 3.2Å; D258-I262 WeakPolarHBondContact O-CG1 3.1Å; D258-I262 PolarHBondContact O-N 2.91Å; I259-I262 PolarHBondContact O-N 3.44Å; I262-S264 PolarHBondContact O-N 2.93Å; I262-F265 PolarHBondContact O-N 3.42Å; I262-F266 HydrophobicContact CG2-CD2 3.83Å; I262-F266 HydrophobicContact CG2-CE2 3.41Å; I262-F266 VanDerWaalsContact CG2-CE2 3.41Å; I262-F266 HydrophobicContact CG2-CZ 4.02Å; I262-F266 PolarHBondContact O-N 3.05Å |
| 263 | F | 97.8 | Very high | 94.2 | Very high | 9 Ų | 9 | 31.4 Ų | 31.4 | 4% | 0.039 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -58.5 | -46.5 | 174.9 | 169.9 | -108.4 | 0 | 0 | 0 | 112.8 | T142 V154 C157 L158 T161 I259 V260 Y261 F265 F266 L267 | T142-F263 HydrophobicContact CG2-CD1 3.49Å; T142-F263 VanDerWaalsContact CG2-CD1 3.49Å; T142-F263 HydrophobicContact CG2-CE1 3.41Å; T142-F263 VanDerWaalsContact CG2-CE1 3.41Å; V154-F263 HydrophobicContact CG1-CZ 4.23Å; C157-F263 HydrophobicContact CB-CD2 4.15Å; C157-F263 HydrophobicContact CB-CE2 3.9Å; L158-F263 HydrophobicContact CB-CE2 4.46Å; L158-F263 HydrophobicContact CD2-CD2 3.77Å; L158-F263 HydrophobicContact CD2-CE2 3.48Å; L158-F263 VanDerWaalsContact CD2-CE2 3.48Å; L158-F263 HydrophobicContact CD2-CG 4.45Å; L158-F263 HydrophobicContact CD2-CZ 3.92Å; L158-F263 HydrophobicContact CG-CD2 4.21Å; L158-F263 HydrophobicContact CG-CE2 3.59Å; L158-F263 HydrophobicContact CG-CZ 4.18Å; T161-F263 HydrophobicContact CG2-CB 4.06Å; T161-F263 VanDerWaalsContact OG1-CA 3.24Å; T161-F263 WeakPolarHBondContact OG1-CA 3Å; I259-F263 PolarHBondContact O-N 3.32Å; V260-F263 PolarHBondContact O-N 2.98Å; Y261-F263 VanDerWaalsContact C-N 3.29Å; Y261-F263 PolarHBondContact O-N 2.77Å; F263-F265 VanDerWaalsContact C-N 3.33Å; F263-F265 PolarHBondContact O-N 3.46Å; F263-F266 PolarHBondContact O-N 3.02Å; F263-L267 HydrophobicContact CD1-CD1 4.15Å; F263-L267 HydrophobicContact CD2-CG 4.39Å; F263-L267 HydrophobicContact CE1-CD1 3.38Å; F263-L267 HydrophobicContact CE1-CG 4.04Å; F263-L267 HydrophobicContact CE2-CD1 4.05Å; F263-L267 HydrophobicContact CE2-CD2 4.1Å; F263-L267 HydrophobicContact CE2-CG 3.82Å; F263-L267 HydrophobicContact CZ-CD1 3.34Å; F263-L267 HydrophobicContact CZ-CD2 4.03Å; F263-L267 HydrophobicContact CZ-CG 3.66Å; F263-L267 PolarHBondContact O-N 3.49Å |
| 264 | S | 95.9 | Very high | 93 | Very high | 20 Ų | 20 | 37.8 Ų | 37.8 | 14% | 0.14 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -63.1 | -39.3 | -179.2 | -56.5 | 0 | 0 | 0 | 0 | 111.9 | V260 Y261 I262 L267 Q268 | V260-S264 PolarHBondContact O-N 3.47Å; V260-S264 PolarHBondContact O-OG 2.99Å; Y261-S264 PolarHBondContact O-N 3.09Å; Y261-S264 VanDerWaalsContact O-N 3.13Å; I262-S264 PolarHBondContact O-N 2.93Å; S264-L267 WeakPolarHBondContact O-CB 3.49Å; S264-L267 PolarHBondContact O-N 3.49Å; S264-Q268 PolarHBondContact O-N 3.09Å |
| 265 | F | 96.6 | Very high | 91.1 | Very high | 20 Ų | 20 | 47.5 Ų | 47.5 | 9% | 0.088 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -69.2 | -38.1 | 174.2 | -73.5 | -58.1 | 0 | 0 | 0 | 112.8 | Y216 A217 G220 A221 F224 Y261 I262 F263 L267 Q268 I269 | Y216-F265 HydrophobicContact CD1-CE1 4.25Å; Y216-F265 AromaticContact CE1-CE1 3.95Å; Y216-F265 HydrophobicContact CE1-CE1 3.95Å; Y216-F265 HydrophobicContact CE1-CZ 4.49Å; A217-F265 HydrophobicContact CB-CD1 4.13Å; G220-F265 VanDerWaalsContact C-CD2 3.46Å; A221-F265 HydrophobicContact CB-CB 3.91Å; F224-F265 HydrophobicContact CD2-CD2 4.04Å; F224-F265 AromaticContact CD2-CE2 3.42Å; F224-F265 HydrophobicContact CD2-CE2 3.42Å; F224-F265 VanDerWaalsContact CD2-CE2 3.42Å; F224-F265 HydrophobicContact CD2-CZ 4.42Å; F224-F265 AromaticContact CE2-CE2 3.56Å; F224-F265 HydrophobicContact CE2-CE2 3.56Å; F224-F265 HydrophobicContact CE2-CZ 4.26Å; F224-F265 HydrophobicContact CG-CE2 4.49Å; Y261-F265 WeakPolarHBondContact O-CD2 3.13Å; Y261-F265 PolarHBondContact O-N 2.97Å; I262-F265 PolarHBondContact O-N 3.42Å; F263-F265 VanDerWaalsContact C-N 3.33Å; F263-F265 PolarHBondContact O-N 3.46Å; F265-L267 VanDerWaalsContact C-N 3.35Å; F265-Q268 WeakPolarHBondContact O-CB 3.3Å; F265-Q268 PolarHBondContact O-N 3.07Å; F265-Q268 VanDerWaalsContact O-N 3.12Å; F265-I269 VanDerWaalsContact O-CG1 3.31Å; F265-I269 WeakPolarHBondContact O-CG1 3.34Å; F265-I269 PolarHBondContact O-N 3.04Å |
| 266 | F | 96.1 | Very high | 90.8 | Very high | 21 Ų | 21 | 49.8 Ų | 49.8 | 9% | 0.092 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -65.2 | -37.2 | 172.5 | -72.5 | -29.5 | 0 | 0 | 0 | 112.7 | C157 I160 T161 V164 A221 I262 F263 Q268 I269 F270 | C157-F266 HydrophobicContact CB-CB 4.21Å; C157-F266 VanDerWaalsContact SG-C 3.59Å; C157-F266 PolarHBondContact SG-O 3.39Å; C157-F266 VanDerWaalsContact SG-O 3.38Å; I160-F266 HydrophobicContact CB-CD2 4.23Å; I160-F266 HydrophobicContact CB-CE2 4.41Å; I160-F266 HydrophobicContact CG2-CD2 3.74Å; I160-F266 HydrophobicContact CG2-CE1 4.42Å; I160-F266 HydrophobicContact CG2-CE2 3.53Å; I160-F266 HydrophobicContact CG2-CG 4.32Å; I160-F266 HydrophobicContact CG2-CZ 3.91Å; T161-F266 WeakPolarHBondContact OG1-CD2 3.43Å; V164-F266 HydrophobicContact CB-CE2 4.35Å; V164-F266 HydrophobicContact CG2-CE2 3.98Å; V164-F266 HydrophobicContact CG2-CZ 3.96Å; A221-F266 HydrophobicContact CB-CD1 4.3Å; A221-F266 HydrophobicContact CB-CE1 3.92Å; I262-F266 HydrophobicContact CG2-CD2 3.83Å; I262-F266 HydrophobicContact CG2-CE2 3.41Å; I262-F266 VanDerWaalsContact CG2-CE2 3.41Å; I262-F266 HydrophobicContact CG2-CZ 4.02Å; I262-F266 PolarHBondContact O-N 3.05Å; F263-F266 PolarHBondContact O-N 3.02Å; F266-Q268 VanDerWaalsContact C-N 3.27Å; F266-Q268 PolarHBondContact O-N 3.21Å; F266-I269 HydrophobicContact CD1-CD1 4.3Å; F266-I269 PolarHBondContact O-N 3.21Å; F266-F270 HydrophobicContact CB-CD2 4.17Å; F266-F270 HydrophobicContact CD1-CD2 4.25Å; F266-F270 AromaticContact CD1-CE2 3.79Å; F266-F270 HydrophobicContact CD1-CE2 3.79Å; F266-F270 HydrophobicContact CE1-CE2 4.38Å; F266-F270 HydrophobicContact CG-CD2 4.46Å; F266-F270 HydrophobicContact CG-CE2 4.35Å; F266-F270 WeakPolarHBondContact O-CD2 3.43Å; F266-F270 PolarHBondContact O-N 2.94Å |
| 267 | L | 94.4 | Very high | 90.5 | Very high | 0 Ų | 0 | 52.4 Ų | 52.4 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -59.8 | -38.5 | 169.5 | -79 | -178.1 | 0 | 0 | 0 | 111.8 | Y149 V154 C157 F263 S264 F265 I269 G271 | Y149-L267 HydrophobicContact CD2-CB 4.41Å; Y149-L267 HydrophobicContact CD2-CD1 4.3Å; Y149-L267 HydrophobicContact CD2-CD2 4.41Å; Y149-L267 WeakPolarHBondContact CE1-O 3.41Å; Y149-L267 HydrophobicContact CE2-CB 4.21Å; Y149-L267 HydrophobicContact CG-CD2 4.47Å; V154-L267 HydrophobicContact CB-CD2 4.32Å; V154-L267 HydrophobicContact CG2-CD2 3.93Å; C157-L267 HydrophobicContact CB-CD2 3.9Å; C157-L267 HydrophobicContact CB-CG 4.27Å; F263-L267 HydrophobicContact CD1-CD1 4.15Å; F263-L267 HydrophobicContact CD2-CG 4.39Å; F263-L267 HydrophobicContact CE1-CD1 3.38Å; F263-L267 HydrophobicContact CE1-CG 4.04Å; F263-L267 HydrophobicContact CE2-CD1 4.05Å; F263-L267 HydrophobicContact CE2-CD2 4.1Å; F263-L267 HydrophobicContact CE2-CG 3.82Å; F263-L267 HydrophobicContact CZ-CD1 3.34Å; F263-L267 HydrophobicContact CZ-CD2 4.03Å; F263-L267 HydrophobicContact CZ-CG 3.66Å; F263-L267 PolarHBondContact O-N 3.49Å; S264-L267 WeakPolarHBondContact O-CB 3.49Å; S264-L267 PolarHBondContact O-N 3.49Å; F265-L267 VanDerWaalsContact C-N 3.35Å; L267-I269 VanDerWaalsContact C-N 3.34Å; L267-I269 PolarHBondContact O-N 2.94Å; L267-G271 WeakPolarHBondContact O-CA 3.26Å; L267-G271 PolarHBondContact O-N 3.04Å |
| 268 | Q | 92.1 | Very high | 90.1 | Very high | 60 Ų | 60 | 54.6 Ų | 54.6 | 28% | 0.28 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -68.8 | -32.7 | 178.2 | -167.3 | 171.6 | 18.9 | 0 | 0 | 112.6 | D213 A217 S264 F265 F266 | D213-Q268 PolarHBondContact OD1-NE2 3.49Å; A217-Q268 HydrophobicContact CB-CB 3.82Å; A217-Q268 HydrophobicContact CB-CG 3.74Å; S264-Q268 PolarHBondContact O-N 3.09Å; F265-Q268 WeakPolarHBondContact O-CB 3.3Å; F265-Q268 PolarHBondContact O-N 3.07Å; F265-Q268 VanDerWaalsContact O-N 3.12Å; F266-Q268 VanDerWaalsContact C-N 3.27Å; F266-Q268 PolarHBondContact O-N 3.21Å |
| 269 | I | 91.6 | Very high | 89.7 | Confident | 59 Ų | 59 | 57.4 Ų | 57.4 | 30% | 0.303 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -81.5 | -49.6 | 179.8 | -62.2 | 165 | 0 | 0 | 0 | 112.1 | A217 A218 A221 F265 F266 L267 | A217-I269 HydrophobicContact CB-CD1 4.17Å; A217-I269 HydrophobicContact CB-CG1 3.55Å; A218-I269 HydrophobicContact CB-CD1 4.24Å; A221-I269 HydrophobicContact CB-CD1 4.45Å; F265-I269 VanDerWaalsContact O-CG1 3.31Å; F265-I269 WeakPolarHBondContact O-CG1 3.34Å; F265-I269 PolarHBondContact O-N 3.04Å; F266-I269 HydrophobicContact CD1-CD1 4.3Å; F266-I269 PolarHBondContact O-N 3.21Å; L267-I269 VanDerWaalsContact C-N 3.34Å; L267-I269 PolarHBondContact O-N 2.94Å |
| 270 | F | 92.1 | Very high | 89.3 | Confident | 93 Ų | 93 | 59.6 Ų | 59.6 | 41% | 0.408 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -105.9 | -8.2 | -170.7 | -55.8 | -63.8 | 0 | 0 | 0 | 113.2 | I160 F266 T272 | I160-F270 HydrophobicContact CD1-CD2 4.01Å; I160-F270 HydrophobicContact CD1-CE2 4.05Å; F266-F270 HydrophobicContact CB-CD2 4.17Å; F266-F270 HydrophobicContact CD1-CD2 4.25Å; F266-F270 AromaticContact CD1-CE2 3.79Å; F266-F270 HydrophobicContact CD1-CE2 3.79Å; F266-F270 HydrophobicContact CE1-CE2 4.38Å; F266-F270 HydrophobicContact CG-CD2 4.46Å; F266-F270 HydrophobicContact CG-CE2 4.35Å; F266-F270 WeakPolarHBondContact O-CD2 3.43Å; F266-F270 PolarHBondContact O-N 2.94Å; F270-T272 PolarHBondContact O-N 3.5Å |
| 271 | G | 89 | Confident | 88.7 | Confident | 16 Ų | 16 | 63.3 Ų | 63.3 | 17% | 0.165 | 31% | 0.308 | C | S | . | . | P | Polyproline II helix | trans | -71.3 | 118.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | Y149 L267 | Y149-G271 VanDerWaalsContact CD1-CA 3.44Å; L267-G271 WeakPolarHBondContact O-CA 3.26Å; L267-G271 PolarHBondContact O-N 3.04Å |
| 272 | T | 87.1 | Confident | 88.1 | Confident | 86 Ų | 86 | 62.6 Ų | 62.6 | 53% | 0.528 | 31% | 0.309 | S | S | . | . | P | Polyproline II helix | trans | -84.9 | 117.8 | 167 | -47 | 0 | 0 | 0 | 0 | 107.9 | N150 S153 F270 | N150-T272 PolarHBondContact N-O 2.85Å; N150-T272 PolarHBondContact ND2-O 3.36Å; S153-T272 PolarHBondContact OG-N 3.05Å; S153-T272 PolarHBondContact OG-OG1 3.28Å; F270-T272 PolarHBondContact O-N 3.5Å |
| 273 | K | 81.8 | Confident | 87.4 | Confident | 131 Ų | 131 | 67.4 Ų | 67.4 | 57% | 0.57 | 33% | 0.333 | S | S | * | . | B | Isolated β-bridge | trans | -55.6 | 142 | 172.7 | -67 | -176.7 | -179 | 176.1 | 0 | 109 | Y149 N150 | Y149-K273 HydrophobicContact CE1-CG 4.41Å; N150-K273 PolarHBondContact ND2-O 3.43Å |
| 274 | R | 68.1 | Low | 86.5 | Confident | 134 Ų | 134 | 72.3 Ų | 72.3 | 51% | 0.506 | 36% | 0.358 | S | S | . | . | P | Polyproline II helix | trans | -79.3 | 135.1 | 176.6 | -175 | 174.8 | 167.9 | 142.7 | -8.7 | 109.3 | F148 | F148-R274 PolarHBondContact O-N 2.83Š|
| 275 | D | 53.9 | Low | 85.7 | Confident | 227 Ų | 227 | 77 Ų | 77 | 100% | 1.214 | 38% | 0.377 | S | S | * | . | trans | -68.8 | 0 | 174 | -62.3 | -37.6 | 0 | 0 | 0 | 112.1 |
Retrieved 275 of 275 residues in 61.6 ms
(Link to these results)