| 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 | 39.9 | Very low | 36.6 | Very low | 242 Ų | 242 | 153.4 Ų | 153.4 | 100% | 1.192 | 83% | 0.833 | S | S | * | * | 0 | 112 | 0 | -55.4 | -177.6 | -175.1 | 0 | 0 | 104.2 | |||||
| 2 | S | 36.6 | Very low | 36.9 | Very low | 100 Ų | 100 | 151.7 Ų | 151.7 | 70% | 0.699 | 82% | 0.823 | S | S | * | * | cis | -164.6 | 127.3 | 38.1 | -40.7 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 3 | E | 34.9 | Very low | 37.5 | Very low | 194 Ų | 194 | 152.8 Ų | 152.8 | 91% | 0.907 | 82% | 0.82 | S | S | * | * | 85.1 | 120.5 | 106.3 | -74.9 | -170.4 | 127.6 | 0 | 0 | 115.9 | |||||
| 4 | A | 41.2 | Very low | 37.3 | Very low | 94 Ų | 94 | 149.1 Ų | 149.1 | 78% | 0.777 | 81% | 0.811 | S | S | * | * | trans | -68.8 | 148.6 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 5 | R | 36.3 | Very low | 37.5 | Very low | 252 Ų | 252 | 150.6 Ų | 150.6 | 95% | 0.951 | 81% | 0.811 | S | S | * | * | trans | -137.3 | 104 | 148.1 | -73.6 | -167.2 | 177.4 | -172.2 | -1.3 | 109.9 | ||||
| 6 | K | 35.1 | Very low | 37.8 | Very low | 208 Ų | 208 | 154.1 Ų | 154.1 | 90% | 0.904 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 119.5 | 164.2 | -171.2 | 176.3 | -177.5 | -175.6 | 0 | 106.8 | ||
| 7 | G | 32.9 | Very low | 38.4 | Very low | 62 Ų | 62 | 151.8 Ų | 151.8 | 64% | 0.639 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -78.7 | 151.1 | 169.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||
| 8 | P | 36.5 | Very low | 39.6 | Very low | 115 Ų | 115 | 146.4 Ų | 146.4 | 75% | 0.747 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 143 | -172.1 | 30.8 | -31.2 | 0 | 0 | 0 | 112.1 | E10 | P8-E10 PolarHBondContact O-N 2.99Š|
| 9 | D | 36.2 | Very low | 40.6 | Very low | 160 Ų | 160 | 139.8 Ų | 139.8 | 86% | 0.856 | 75% | 0.746 | S | S | * | * | trans | -57 | 115.2 | 158.6 | -97.7 | -41.2 | 0 | 0 | 0 | 108.3 | A11 | D9-A11 PolarHBondContact O-N 3.14Š| ||
| 10 | E | 35.3 | Very low | 41.7 | Very low | 183 Ų | 183 | 133.8 Ų | 133.8 | 86% | 0.855 | 71% | 0.714 | S | S | * | * | trans | -92.1 | 84.7 | 158.8 | -68.7 | -89.9 | 147.6 | 0 | 0 | 105.9 | P8 | P8-E10 PolarHBondContact O-N 2.99Š| ||
| 11 | A | 38 | Very low | 42.5 | Very low | 77 Ų | 77 | 133.2 Ų | 133.2 | 64% | 0.636 | 71% | 0.707 | S | S | * | * | trans | -81.9 | 157.7 | 152.4 | 0 | 0 | 0 | 0 | 0 | 108 | D9 | D9-A11 PolarHBondContact O-N 3.14Š| ||
| 12 | D | 39.8 | Very low | 43.5 | Very low | 133 Ų | 133 | 125.4 Ų | 125.4 | 71% | 0.711 | 68% | 0.676 | S | S | * | * | trans | 83.4 | 133.6 | 160.1 | -102.2 | 9.4 | 0 | 0 | 0 | 116.7 | ||||
| 13 | E | 44.5 | Very low | 44.7 | Very low | 167 Ų | 167 | 120.8 Ų | 120.8 | 78% | 0.78 | 64% | 0.644 | S | S | * | * | cis | -153.2 | 120.2 | 4.4 | -73.2 | 172.5 | 129.3 | 0 | 0 | 107.6 | ||||
| 14 | S | 35.2 | Very low | 45.9 | Very low | 100 Ų | 100 | 118.5 Ų | 118.5 | 70% | 0.699 | 63% | 0.627 | S | S | * | * | trans | -146.6 | 51.1 | 152.2 | 72.1 | 0 | 0 | 0 | 0 | 108.4 | Y16 | S14-Y16 VanDerWaalsContact C-N 3.34Å; S14-Y16 PolarHBondContact O-N 3.39Å | ||
| 15 | Q | 39.9 | Very low | 46.7 | Very low | 172 Ų | 172 | 117.2 Ų | 117.2 | 80% | 0.804 | 61% | 0.612 | S | S | * | * | trans | -70.7 | 97.9 | 165.9 | -92.3 | 177.6 | -26 | 0 | 0 | 107.1 | D17 | Q15-D17 PolarHBondContact O-N 3.15Å; Q15-D17 VanDerWaalsContact O-N 3.08Å | ||
| 16 | Y | 43.2 | Very low | 47.7 | Very low | 206 Ų | 206 | 108.3 Ų | 108.3 | 81% | 0.808 | 58% | 0.583 | S | S | * | * | trans | -60 | 109.6 | 156.7 | -67.6 | -86.7 | 0 | 0 | 0 | 106 | S14 S18 | S14-Y16 VanDerWaalsContact C-N 3.34Å; S14-Y16 PolarHBondContact O-N 3.39Å; Y16-S18 PolarHBondContact O-N 2.9Å | ||
| 17 | D | 46.7 | Very low | 48.6 | Very low | 116 Ų | 116 | 105.1 Ų | 105.1 | 62% | 0.62 | 57% | 0.565 | S | S | * | * | trans | -56 | 109.5 | 178.8 | -178.1 | 0.1 | 0 | 0 | 0 | 108.6 | Q15 G19 | Q15-D17 PolarHBondContact O-N 3.15Å; Q15-D17 VanDerWaalsContact O-N 3.08Å; D17-G19 PolarHBondContact O-N 3.19Å; D17-G19 VanDerWaalsContact O-N 3.13Å; D17-G19 PolarHBondContact OD1-N 3.34Å | ||
| 18 | S | 59.8 | Low | 49.1 | Very low | 54 Ų | 54 | 106.4 Ų | 106.4 | 38% | 0.378 | 57% | 0.565 | S | S | . | * | trans | -73.7 | 3.3 | -178.9 | 69 | 0 | 0 | 0 | 0 | 112.8 | Y16 I20 | Y16-S18 PolarHBondContact O-N 2.9Å; S18-I20 PolarHBondContact O-N 3.38Å; S18-I20 VanDerWaalsContact O-N 3.14Å; S18-I20 WeakPolarHBondContact OG-CB 3.39Å; S18-I20 VanDerWaalsContact OG-CD1 3.29Å; S18-I20 WeakPolarHBondContact OG-CD1 3.34Å; S18-I20 WeakPolarHBondContact OG-CG1 3.42Å | ||
| 19 | G | 59.9 | Low | 49.1 | Very low | 21 Ų | 21 | 107.4 Ų | 107.4 | 22% | 0.216 | 56% | 0.563 | C | S | . | * | S | Bend | trans | 72.8 | -3.6 | -175.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | D17 E21 S22 L23 | D17-G19 PolarHBondContact O-N 3.19Å; D17-G19 VanDerWaalsContact O-N 3.13Å; D17-G19 PolarHBondContact OD1-N 3.34Å; G19-E21 VanDerWaalsContact C-N 3.27Å; G19-E21 PolarHBondContact O-N 3.49Å; G19-S22 WeakPolarHBondContact O-CB 3.41Å; G19-S22 PolarHBondContact O-N 3.06Å; G19-S22 VanDerWaalsContact O-N 3.14Å; G19-L23 PolarHBondContact O-N 3.48Å |
| 20 | I | 61.4 | Low | 49 | Very low | 20 Ų | 20 | 105.4 Ų | 105.4 | 10% | 0.103 | 56% | 0.559 | C | S | . | * | H | α-helix | trans | -62.8 | -33 | -179.9 | -72.1 | 177.6 | 0 | 0 | 0 | 111.6 | S18 S22 L23 R24 I116 I150 | S18-I20 PolarHBondContact O-N 3.38Å; S18-I20 VanDerWaalsContact O-N 3.14Å; S18-I20 WeakPolarHBondContact OG-CB 3.39Å; S18-I20 VanDerWaalsContact OG-CD1 3.29Å; S18-I20 WeakPolarHBondContact OG-CD1 3.34Å; S18-I20 WeakPolarHBondContact OG-CG1 3.42Å; I20-S22 VanDerWaalsContact C-N 3.34Å; I20-L23 PolarHBondContact O-N 3.48Å; I20-R24 PolarHBondContact O-N 2.98Å; I20-I116 HydrophobicContact CB-CD1 4.24Å; I20-I116 HydrophobicContact CD1-CD1 4.34Å; I20-I116 HydrophobicContact CG1-CD1 4.04Å; I20-I116 HydrophobicContact CG2-CD1 3.45Å; I20-I116 VanDerWaalsContact CG2-CD1 3.45Å; I20-I150 HydrophobicContact CG1-CG2 3.95Å |
| 21 | E | 59.1 | Low | 49.1 | Very low | 122 Ų | 122 | 105 Ų | 105 | 57% | 0.57 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -70.7 | -30 | 177.3 | -64.3 | -163.9 | 163.2 | 0 | 0 | 112.8 | G19 L23 R24 S25 | G19-E21 VanDerWaalsContact C-N 3.27Å; G19-E21 PolarHBondContact O-N 3.49Å; E21-L23 VanDerWaalsContact C-N 3.33Å; E21-L23 PolarHBondContact O-N 3.25Å; E21-R24 PolarHBondContact O-N 2.73Å; E21-S25 WeakPolarHBondContact O-CB 3.48Å; E21-S25 PolarHBondContact O-N 3.31Å; E21-S25 PolarHBondContact O-OG 2.94Å |
| 22 | S | 61.6 | Low | 48.9 | Very low | 77 Ų | 77 | 107.4 Ų | 107.4 | 54% | 0.538 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -65 | -36.5 | 173.4 | -69.5 | 0 | 0 | 0 | 0 | 111.8 | G19 I20 S25 | G19-S22 WeakPolarHBondContact O-CB 3.41Å; G19-S22 PolarHBondContact O-N 3.06Å; G19-S22 VanDerWaalsContact O-N 3.14Å; I20-S22 VanDerWaalsContact C-N 3.34Å; S22-S25 PolarHBondContact O-N 2.96Å |
| 23 | L | 60.4 | Low | 48.3 | Very low | 4 Ų | 4 | 107.7 Ų | 107.7 | 2% | 0.021 | 57% | 0.573 | C | S | . | * | H | α-helix | trans | -66.9 | -42.2 | 171.9 | -91.5 | -173.4 | 0 | 0 | 0 | 113 | G19 I20 E21 S25 L26 T122 V147 I150 | G19-L23 PolarHBondContact O-N 3.48Å; I20-L23 PolarHBondContact O-N 3.48Å; E21-L23 VanDerWaalsContact C-N 3.33Å; E21-L23 PolarHBondContact O-N 3.25Å; L23-S25 PolarHBondContact O-N 3.15Å; L23-L26 HydrophobicContact CD2-CD1 3.88Å; L23-L26 WeakPolarHBondContact O-CB 3.25Å; L23-L26 PolarHBondContact O-N 3.34Å; L23-T122 HydrophobicContact CD1-CG2 4.27Å; L23-V147 HydrophobicContact CD1-CG1 4.07Å; L23-V147 HydrophobicContact CD2-CB 4.28Å; L23-V147 HydrophobicContact CD2-CG1 4.02Å; L23-V147 HydrophobicContact CD2-CG2 3.3Å; L23-V147 HydrophobicContact CG-CG1 4.39Å; L23-V147 HydrophobicContact CG-CG2 4.02Å; L23-I150 HydrophobicContact CB-CD1 4.46Å; L23-I150 HydrophobicContact CD1-CD1 3.21Å; L23-I150 HydrophobicContact CG-CD1 3.5Å |
| 24 | R | 61.6 | Low | 47.8 | Very low | 145 Ų | 145 | 105.4 Ų | 105.4 | 55% | 0.547 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -65.7 | -29.6 | 177.8 | -68.6 | -178.8 | -175.5 | 139 | 1.5 | 111.6 | I20 E21 L26 R27 | I20-R24 PolarHBondContact O-N 2.98Å; E21-R24 PolarHBondContact O-N 2.73Å; R24-L26 VanDerWaalsContact C-N 3.29Å; R24-L26 PolarHBondContact O-N 2.85Å; R24-R27 VanDerWaalsContact O-CB 3.25Å; R24-R27 WeakPolarHBondContact O-CB 3.37Å; R24-R27 PolarHBondContact O-N 3.43Å; R24-R27 VanDerWaalsContact O-N 3.08Å |
| 25 | S | 57.6 | Low | 47.4 | Very low | 67 Ų | 67 | 105.1 Ų | 105.1 | 47% | 0.469 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -69.6 | -19.8 | 175.6 | -60.1 | 0 | 0 | 0 | 0 | 113.9 | E21 S22 L23 R27 S28 | E21-S25 WeakPolarHBondContact O-CB 3.48Å; E21-S25 PolarHBondContact O-N 3.31Å; E21-S25 PolarHBondContact O-OG 2.94Å; S22-S25 PolarHBondContact O-N 2.96Å; L23-S25 PolarHBondContact O-N 3.15Å; S25-R27 PolarHBondContact O-N 3.03Å; S25-S28 PolarHBondContact O-N 2.97Å; S25-S28 VanDerWaalsContact O-N 3.15Å; S25-S28 PolarHBondContact O-OG 3.37Å |
| 26 | L | 57.3 | Low | 47.2 | Very low | 66 Ų | 66 | 103.1 Ų | 103.1 | 35% | 0.346 | 58% | 0.581 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -64.2 | -16.9 | 168.4 | -67.5 | 172.3 | 0 | 0 | 0 | 112.6 | L23 R24 P144 | L23-L26 HydrophobicContact CD2-CD1 3.88Å; L23-L26 WeakPolarHBondContact O-CB 3.25Å; L23-L26 PolarHBondContact O-N 3.34Å; R24-L26 VanDerWaalsContact C-N 3.29Å; R24-L26 PolarHBondContact O-N 2.85Å; L26-P144 HydrophobicContact CD1-CG 4.47Å |
| 27 | R | 53.4 | Low | 46.6 | Very low | 140 Ų | 140 | 98.2 Ų | 98.2 | 53% | 0.528 | 58% | 0.583 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -81.4 | -11.5 | 175.2 | -59.8 | -178.6 | 174.5 | -169.2 | -3.7 | 113.8 | R24 S25 T114 | R24-R27 VanDerWaalsContact O-CB 3.25Å; R24-R27 WeakPolarHBondContact O-CB 3.37Å; R24-R27 PolarHBondContact O-N 3.43Å; R24-R27 VanDerWaalsContact O-N 3.08Å; S25-R27 PolarHBondContact O-N 3.03Å; R27-T114 HydrophobicContact CG-CG2 4.5Å; R27-T114 PolarHBondContact NE-OG1 2.92Å; R27-T114 PolarHBondContact NH2-OG1 3.13Å |
| 28 | S | 44.3 | Very low | 45.8 | Very low | 90 Ų | 90 | 98.4 Ų | 98.4 | 63% | 0.629 | 59% | 0.593 | S | S | * | * | trans | -107.1 | 11.6 | -169.4 | 58.6 | 0 | 0 | 0 | 0 | 115.5 | S25 | S25-S28 PolarHBondContact O-N 2.97Å; S25-S28 VanDerWaalsContact O-N 3.15Å; S25-S28 PolarHBondContact O-OG 3.37Å | ||
| 29 | L | 35.8 | Very low | 44.2 | Very low | 136 Ų | 136 | 99.4 Ų | 99.4 | 71% | 0.712 | 61% | 0.612 | S | S | * | * | S | Bend | trans | -66.6 | 133.4 | 169.5 | -79 | 163.8 | 0 | 0 | 0 | 110.4 | E31 | L29-E31 PolarHBondContact O-N 3.14Š|
| 30 | P | 35.3 | Very low | 43.7 | Very low | 118 Ų | 118 | 104.7 Ų | 104.7 | 77% | 0.766 | 64% | 0.642 | S | S | * | * | P | Polyproline II helix | trans | -67 | 131 | -173.2 | 25 | -31.2 | 0 | 0 | 0 | 111.1 | ||
| 31 | E | 36.1 | Very low | 42.2 | Very low | 175 Ų | 175 | 108.8 Ų | 108.8 | 82% | 0.818 | 67% | 0.673 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 142.7 | 166.6 | -65.4 | -168.8 | 145.5 | 0 | 0 | 110 | L29 T33 | L29-E31 PolarHBondContact O-N 3.14Å; E31-T33 PolarHBondContact O-N 3.48Å |
| 32 | P | 33.9 | Very low | 40.8 | Very low | 127 Ų | 127 | 110.8 Ų | 110.8 | 83% | 0.825 | 69% | 0.687 | S | S | * | * | trans | -61.8 | 113.1 | 172.1 | 25.8 | -31.2 | 0 | 0 | 0 | 108.6 | S34 | P32-S34 PolarHBondContact O-N 3.27Å; P32-S34 VanDerWaalsContact O-N 3.14Å | ||
| 33 | T | 27.9 | Very low | 39.2 | Very low | 139 Ų | 139 | 110.8 Ų | 110.8 | 85% | 0.853 | 70% | 0.7 | S | S | * | * | trans | -51 | 114.9 | -179.2 | 49.9 | 0 | 0 | 0 | 0 | 111.3 | E31 | E31-T33 PolarHBondContact O-N 3.48Š| ||
| 34 | S | 33 | Very low | 37.8 | Very low | 119 Ų | 119 | 116.2 Ų | 116.2 | 83% | 0.832 | 74% | 0.738 | S | S | * | * | P | Polyproline II helix | trans | -75.1 | 119.5 | 163.7 | 49.6 | 0 | 0 | 0 | 0 | 109 | P32 | P32-S34 PolarHBondContact O-N 3.27Å; P32-S34 VanDerWaalsContact O-N 3.14Å |
| 35 | A | 28.2 | Very low | 36.6 | Very low | 93 Ų | 93 | 115.3 Ų | 115.3 | 77% | 0.769 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -78.1 | 153.4 | 173.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||
| 36 | P | 34.5 | Very low | 35.3 | Very low | 130 Ų | 130 | 120.8 Ų | 120.8 | 84% | 0.844 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -86.2 | 164.7 | -159.1 | 34.3 | -34.4 | 0 | 0 | 0 | 114.8 | ||
| 37 | A | 30.2 | Very low | 34.4 | Very low | 103 Ų | 103 | 122.4 Ų | 122.4 | 85% | 0.851 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 154.4 | -174.4 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||
| 38 | S | 30.1 | Very low | 33.1 | Very low | 121 Ų | 121 | 120.7 Ų | 120.7 | 85% | 0.846 | 79% | 0.792 | S | S | * | * | trans | -143.9 | 115.1 | 155 | 50.7 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 39 | G | 27.1 | Very low | 32.3 | Very low | 75 Ų | 75 | 122.6 Ų | 122.6 | 77% | 0.773 | 80% | 0.8 | S | S | * | * | trans | -85.3 | -156.3 | 171.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 40 | P | 48 | Very low | 31.9 | Very low | 131 Ų | 131 | 124.7 Ų | 124.7 | 85% | 0.851 | 81% | 0.806 | S | S | * | * | cis | -132.4 | 173.8 | -13.2 | 39.2 | -22.4 | 0 | 0 | 0 | 113.5 | ||||
| 41 | S | 30.2 | Very low | 32.3 | Very low | 106 Ų | 106 | 124.5 Ų | 124.5 | 74% | 0.741 | 81% | 0.805 | S | S | * | * | trans | -172.7 | 127.6 | 138.7 | -127.3 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 42 | D | 29.5 | Very low | 32.7 | Very low | 164 Ų | 164 | 122 Ų | 122 | 88% | 0.877 | 80% | 0.803 | S | S | * | * | trans | 43.2 | 131.5 | 143.5 | -67.8 | -39.2 | 0 | 0 | 0 | 124.1 | ||||
| 43 | G | 29.4 | Very low | 32.4 | Very low | 78 Ų | 78 | 119.1 Ų | 119.1 | 80% | 0.804 | 80% | 0.797 | S | S | * | * | trans | 142.4 | 76.8 | 145 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 44 | S | 30.3 | Very low | 33 | Very low | 118 Ų | 118 | 119 Ų | 119 | 83% | 0.825 | 80% | 0.799 | S | S | * | * | trans | -70.1 | 159.8 | 156.2 | -25.6 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 45 | P | 36.4 | Very low | 32.9 | Very low | 126 Ų | 126 | 117.5 Ų | 117.5 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | cis | -140 | 160.1 | 44.1 | 33.9 | -11.7 | 0 | 0 | 0 | 117.7 | ||||
| 46 | Q | 30.5 | Very low | 33.1 | Very low | 181 Ų | 181 | 123 Ų | 123 | 85% | 0.846 | 80% | 0.8 | S | S | * | * | trans | -66.7 | -170.6 | 164.5 | -64.9 | -160.9 | -35.6 | 0 | 0 | 112.1 | ||||
| 47 | P | 39.3 | Very low | 33 | Very low | 101 Ų | 101 | 125.6 Ų | 125.6 | 66% | 0.656 | 80% | 0.801 | S | S | * | * | cis | -137.7 | 172.6 | 3 | 25.1 | 3.2 | 0 | 0 | 0 | 113.5 | ||||
| 48 | C | 25.1 | Very low | 33.5 | Very low | 103 Ų | 103 | 125.7 Ų | 125.7 | 70% | 0.696 | 79% | 0.793 | S | S | * | * | 174.3 | 125.5 | 84.9 | -87.2 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 49 | T | 27.5 | Very low | 33.4 | Very low | 131 Ų | 131 | 127.5 Ų | 127.5 | 80% | 0.804 | 79% | 0.789 | S | S | * | * | 52.6 | 114.1 | 126.6 | 66.8 | 0 | 0 | 0 | 0 | 122 | |||||
| 50 | H | 26.5 | Very low | 33.5 | Very low | 180 Ų | 180 | 132.3 Ų | 132.3 | 83% | 0.833 | 79% | 0.791 | S | S | * | * | trans | -57.8 | -178.8 | 144.1 | -72.3 | -67.6 | 0 | 0 | 0 | 113.1 | ||||
| 51 | P | 44.9 | Very low | 32.8 | Very low | 114 Ų | 114 | 136 Ų | 136 | 74% | 0.74 | 79% | 0.793 | S | S | * | * | cis | -135.8 | -139 | -27.7 | 31 | -5.9 | 0 | 0 | 0 | 109.4 | ||||
| 52 | P | 43.8 | Very low | 32.9 | Very low | 121 Ų | 121 | 139 Ų | 139 | 79% | 0.786 | 80% | 0.796 | S | S | * | * | cis | -123 | -177.5 | -37.8 | 22.4 | 1.4 | 0 | 0 | 0 | 113.5 | ||||
| 53 | G | 28.4 | Very low | 32.9 | Very low | 68 Ų | 68 | 138.5 Ų | 138.5 | 70% | 0.701 | 79% | 0.793 | S | S | * | * | trans | -63.5 | -174.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 54 | P | 40.9 | Very low | 33 | Very low | 135 Ų | 135 | 138.7 Ų | 138.7 | 88% | 0.877 | 79% | 0.787 | S | S | * | * | -149.8 | 171.8 | 81.3 | 37.3 | -17.4 | 0 | 0 | 0 | 116.9 | |||||
| 55 | A | 29.9 | Very low | 33.1 | Very low | 89 Ų | 89 | 141 Ų | 141 | 74% | 0.736 | 79% | 0.79 | S | S | * | * | trans | -42 | 153.9 | 173.9 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 56 | K | 32 | Very low | 32.9 | Very low | 208 Ų | 208 | 138.4 Ų | 138.4 | 90% | 0.904 | 79% | 0.786 | S | S | * | * | trans | -172.9 | 104.5 | 132.3 | -103.8 | 172.4 | -176.7 | -175.6 | 0 | 111.4 | ||||
| 57 | E | 32.3 | Very low | 33.2 | Very low | 184 Ų | 184 | 138.7 Ų | 138.7 | 86% | 0.86 | 79% | 0.787 | S | S | * | * | trans | -82.9 | 156.7 | 140.2 | -78.3 | -168.7 | 148.7 | 0 | 0 | 107.6 | ||||
| 58 | P | 41.3 | Very low | 32.8 | Very low | 106 Ų | 106 | 145.1 Ų | 145.1 | 69% | 0.688 | 80% | 0.798 | S | S | * | * | -152.6 | 149.9 | 80.5 | 37.3 | -15.5 | 0 | 0 | 0 | 118 | |||||
| 59 | Q | 28.3 | Very low | 33.3 | Very low | 159 Ų | 159 | 143.7 Ų | 143.7 | 74% | 0.743 | 79% | 0.794 | S | S | * | * | 62.9 | 121.3 | 129.1 | -65.1 | 175.1 | -29.7 | 0 | 0 | 123 | |||||
| 60 | Q | 30.1 | Very low | 33.4 | Very low | 175 Ų | 175 | 144.5 Ų | 144.5 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | 61.9 | 122.2 | 125.5 | -63.8 | 178.1 | -11.7 | 0 | 0 | 120.8 | |||||
| 61 | K | 31.4 | Very low | 33.7 | Very low | 208 Ų | 208 | 141 Ų | 141 | 90% | 0.904 | 79% | 0.789 | S | S | * | * | -160.2 | 141.9 | 126.1 | -126.6 | 177.9 | 179.7 | -176.7 | 0 | 113.5 | |||||
| 62 | E | 32.5 | Very low | 33.1 | Very low | 169 Ų | 169 | 141.8 Ų | 141.8 | 79% | 0.79 | 79% | 0.792 | S | S | * | * | trans | -72.5 | 152.6 | -179.8 | -60.9 | 159.9 | 138 | 0 | 0 | 112.7 | ||||
| 63 | D | 30.4 | Very low | 32.6 | Very low | 154 Ų | 154 | 147.5 Ų | 147.5 | 82% | 0.824 | 80% | 0.8 | S | S | * | * | 154.6 | 131.5 | 115.2 | -86.7 | -32.4 | 0 | 0 | 0 | 114.7 | |||||
| 64 | A | 32.2 | Very low | 32.8 | Very low | 82 Ų | 82 | 147.4 Ų | 147.4 | 68% | 0.678 | 80% | 0.799 | S | S | * | * | trans | 59.3 | 123.2 | 137.7 | 0 | 0 | 0 | 0 | 0 | 124.3 | ||||
| 65 | D | 32.3 | Very low | 32.4 | Very low | 168 Ų | 168 | 147 Ų | 147 | 90% | 0.898 | 80% | 0.799 | S | S | * | * | trans | 64.2 | 129.4 | 132.8 | -65.7 | -37.4 | 0 | 0 | 0 | 123.6 | ||||
| 66 | G | 32.4 | Very low | 32.5 | Very low | 70 Ų | 70 | 149 Ų | 149 | 72% | 0.722 | 81% | 0.807 | S | S | * | * | 108.9 | 91.4 | 126.6 | 0 | 0 | 0 | 0 | 0 | 119.8 | |||||
| 67 | E | 34.8 | Very low | 32.4 | Very low | 188 Ų | 188 | 143.5 Ų | 143.5 | 88% | 0.879 | 80% | 0.796 | S | S | * | * | trans | 57 | 117 | 136 | -58.4 | -157.4 | 143.2 | 0 | 0 | 123.6 | ||||
| 68 | R | 32.1 | Very low | 32.3 | Very low | 235 Ų | 235 | 143.1 Ų | 143.1 | 89% | 0.887 | 80% | 0.798 | S | S | * | * | 99.2 | 115.7 | 122 | -159.5 | 168 | -165.8 | 175.5 | 5.2 | 121.3 | |||||
| 69 | A | 35.4 | Very low | 31.8 | Very low | 73 Ų | 73 | 143.6 Ų | 143.6 | 60% | 0.603 | 80% | 0.8 | S | S | * | * | trans | 86.4 | 125.6 | 136.8 | 0 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 70 | D | 29.8 | Very low | 31.9 | Very low | 149 Ų | 149 | 145.4 Ų | 145.4 | 80% | 0.797 | 81% | 0.808 | S | S | * | * | trans | 70.4 | 103.1 | 140.9 | -55.5 | -14.3 | 0 | 0 | 0 | 119.9 | ||||
| 71 | S | 33.5 | Very low | 31.8 | Very low | 105 Ų | 105 | 142.2 Ų | 142.2 | 73% | 0.734 | 81% | 0.805 | S | S | * | * | 156.7 | 131.1 | 82.9 | 45.3 | 0 | 0 | 0 | 0 | 113 | |||||
| 72 | T | 32.1 | Very low | 31.8 | Very low | 132 Ų | 132 | 140.4 Ų | 140.4 | 81% | 0.81 | 81% | 0.805 | S | S | * | * | trans | 48 | 119.4 | 148.3 | 45 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 73 | Y | 32.5 | Very low | 31.6 | Very low | 240 Ų | 240 | 137.8 Ų | 137.8 | 94% | 0.941 | 81% | 0.805 | S | S | * | * | 170.3 | 130.4 | 104.3 | -161.6 | -106.9 | 0 | 0 | 0 | 111.7 | |||||
| 74 | G | 33.2 | Very low | 31.4 | Very low | 66 Ų | 66 | 138.9 Ų | 138.9 | 68% | 0.68 | 81% | 0.809 | S | S | * | * | trans | 83.7 | 85.9 | 153.3 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 75 | S | 32.2 | Very low | 31.3 | Very low | 127 Ų | 127 | 143.9 Ų | 143.9 | 89% | 0.888 | 82% | 0.824 | S | S | * | * | trans | -129.8 | 124.6 | 155.5 | -75 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 76 | S | 32.5 | Very low | 31.1 | Very low | 130 Ų | 130 | 139.4 Ų | 139.4 | 91% | 0.909 | 82% | 0.818 | S | S | * | * | trans | -68.4 | 136.8 | -175.3 | -54.3 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 77 | S | 30.3 | Very low | 30.8 | Very low | 94 Ų | 94 | 139.5 Ų | 139.5 | 66% | 0.657 | 82% | 0.819 | S | S | * | * | trans | -74.5 | 133.1 | 176.5 | -167.2 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 78 | L | 29.6 | Very low | 31.1 | Very low | 175 Ų | 175 | 136.4 Ų | 136.4 | 92% | 0.916 | 82% | 0.815 | S | S | * | * | trans | -137.3 | 79.8 | 151.8 | -79.4 | 178.9 | 0 | 0 | 0 | 108.5 | ||||
| 79 | T | 30.3 | Very low | 30.9 | Very low | 116 Ų | 116 | 135 Ų | 135 | 71% | 0.712 | 82% | 0.819 | S | S | * | * | trans | -109.2 | 102.1 | 156.5 | 39.3 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 80 | E | 31.3 | Very low | 31.1 | Very low | 198 Ų | 198 | 136.1 Ų | 136.1 | 93% | 0.925 | 83% | 0.827 | S | S | * | * | trans | -93.5 | 97.3 | 164.5 | -109 | -176.2 | 160.5 | 0 | 0 | 107.8 | ||||
| 81 | S | 26.5 | Very low | 31.3 | Very low | 108 Ų | 108 | 138 Ų | 138 | 76% | 0.755 | 83% | 0.831 | S | S | * | * | trans | -103.4 | 120.7 | 161.7 | -68.4 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 82 | L | 32.2 | Very low | 31.3 | Very low | 170 Ų | 170 | 140.3 Ų | 140.3 | 89% | 0.89 | 84% | 0.836 | S | S | * | * | trans | 2.5 | 124.5 | 148.6 | -67.4 | 162.2 | 0 | 0 | 0 | 116.9 | ||||
| 83 | S | 28.5 | Very low | 31.4 | Very low | 113 Ų | 113 | 139.8 Ų | 139.8 | 79% | 0.79 | 83% | 0.834 | S | S | * | * | trans | -160.4 | 108.4 | 145.1 | -76.8 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 84 | L | 26.7 | Very low | 31.7 | Very low | 177 Ų | 177 | 132.5 Ų | 132.5 | 93% | 0.927 | 82% | 0.824 | S | S | * | * | -160.6 | 100.4 | 120.6 | -131.3 | 86.9 | 0 | 0 | 0 | 109.7 | |||||
| 85 | L | 29.9 | Very low | 31.9 | Very low | 187 Ų | 187 | 135.2 Ų | 135.2 | 98% | 0.979 | 83% | 0.829 | S | S | * | * | trans | -99.5 | 116.5 | 162.5 | -152.2 | 89.9 | 0 | 0 | 0 | 107 | ||||
| 86 | G | 26.6 | Very low | 32.1 | Very low | 75 Ų | 75 | 140.4 Ų | 140.4 | 77% | 0.773 | 83% | 0.829 | S | S | * | * | trans | -143.5 | 109 | 163.6 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 87 | G | 26.4 | Very low | 32.3 | Very low | 72 Ų | 72 | 139.8 Ų | 139.8 | 74% | 0.742 | 82% | 0.823 | S | S | * | * | trans | -93.5 | -165.3 | 169.6 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 88 | P | 42.4 | Very low | 32.4 | Very low | 123 Ų | 123 | 140.4 Ų | 140.4 | 80% | 0.799 | 82% | 0.824 | S | S | * | * | cis | -130.7 | 124.1 | -33.8 | 33.1 | -16.3 | 0 | 0 | 0 | 110.3 | ||||
| 89 | E | 27.3 | Very low | 32.8 | Very low | 206 Ų | 206 | 139.4 Ų | 139.4 | 96% | 0.963 | 82% | 0.819 | S | S | * | * | trans | -146.3 | 142 | 159.2 | -77 | -156.9 | 123.7 | 0 | 0 | 110.7 | ||||
| 90 | A | 40.3 | Very low | 33 | Very low | 95 Ų | 95 | 139.7 Ų | 139.7 | 79% | 0.785 | 82% | 0.823 | S | S | * | * | trans | -61.3 | 147.4 | -174.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 91 | E | 32.5 | Very low | 33.2 | Very low | 189 Ų | 189 | 138.4 Ų | 138.4 | 88% | 0.883 | 82% | 0.816 | S | S | * | * | trans | 172.2 | 127.1 | 132.3 | -81.2 | -107 | 116.5 | 0 | 0 | 110.2 | ||||
| 92 | D | 33.5 | Very low | 34 | Very low | 154 Ų | 154 | 139.6 Ų | 139.6 | 82% | 0.824 | 82% | 0.819 | S | S | * | * | trans | 42.8 | 130.6 | 161.1 | -121.9 | 3.8 | 0 | 0 | 0 | 122.5 | A94 | D92-A94 PolarHBondContact O-N 3.08Š| ||
| 93 | P | 35.3 | Very low | 34.7 | Very low | 120 Ų | 120 | 134 Ų | 134 | 78% | 0.779 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -79.2 | 118 | -179.8 | 32.3 | -27.4 | 0 | 0 | 0 | 111.2 | ||
| 94 | A | 37.3 | Very low | 36.2 | Very low | 87 Ų | 87 | 133.6 Ų | 133.6 | 72% | 0.719 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -58 | 149 | 167.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | D92 R96 | D92-A94 PolarHBondContact O-N 3.08Å; A94-R96 PolarHBondContact O-N 3.41Å |
| 95 | P | 37.4 | Very low | 37.9 | Very low | 123 Ų | 123 | 127.9 Ų | 127.9 | 80% | 0.799 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 139.1 | -175.1 | 25.3 | -32.3 | 0 | 0 | 0 | 110.9 | ||
| 96 | R | 36.8 | Very low | 40.2 | Very low | 236 Ų | 236 | 121 Ų | 121 | 89% | 0.891 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -48 | 139.6 | 176.5 | -63 | 176.9 | -169.4 | 164.1 | 3.1 | 110 | A94 | A94-R96 PolarHBondContact O-N 3.41Š|
| 97 | P | 36.2 | Very low | 42.3 | Very low | 118 Ų | 118 | 122.7 Ų | 122.7 | 77% | 0.766 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 139.3 | 173.9 | 25.3 | -31.6 | 0 | 0 | 0 | 108.9 | L99 | P97-L99 PolarHBondContact O-N 3.19Š|
| 98 | P | 33.9 | Very low | 44.5 | Very low | 107 Ų | 107 | 126.6 Ų | 126.6 | 70% | 0.695 | 74% | 0.74 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 136.5 | 178.3 | 24 | -30.2 | 0 | 0 | 0 | 108.8 | ||
| 99 | L | 37.8 | Very low | 45.9 | Very low | 154 Ų | 154 | 125.5 Ų | 125.5 | 81% | 0.806 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -47.7 | 139.5 | 167 | -70.6 | 161.5 | 0 | 0 | 0 | 108.1 | P97 H101 | P97-L99 PolarHBondContact O-N 3.19Å; L99-H101 PolarHBondContact O-N 3.37Å |
| 100 | P | 34.2 | Very low | 48 | Very low | 121 Ų | 121 | 118.8 Ų | 118.8 | 79% | 0.786 | 69% | 0.694 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 119.5 | -177.5 | 22 | -30.6 | 0 | 0 | 0 | 108.5 | V102 | P100-V102 PolarHBondContact O-N 3.2Š|
| 101 | H | 35.7 | Very low | 49.8 | Very low | 171 Ų | 171 | 120.2 Ų | 120.2 | 79% | 0.792 | 69% | 0.685 | S | S | * | * | P | Polyproline II helix | trans | -52.2 | 128.3 | 170.2 | -79.5 | -79.5 | 0 | 0 | 0 | 107.6 | L99 G103 | L99-H101 PolarHBondContact O-N 3.37Å; H101-G103 PolarHBondContact O-N 2.82Å |
| 102 | V | 42.6 | Very low | 51.8 | Low | 133 Ų | 133 | 113.7 Ų | 113.7 | 81% | 0.806 | 66% | 0.663 | S | S | * | * | trans | -62.4 | 87.1 | 170.1 | -178.9 | 0 | 0 | 0 | 0 | 106.6 | P100 | P100-V102 PolarHBondContact O-N 3.2Š| ||
| 103 | G | 46.8 | Very low | 53.8 | Low | 52 Ų | 52 | 107.2 Ų | 107.2 | 54% | 0.536 | 63% | 0.628 | S | S | . | * | P | Polyproline II helix | trans | -59.9 | 140.7 | 169.3 | 0 | 0 | 0 | 0 | 0 | 108.1 | H101 L105 | H101-G103 PolarHBondContact O-N 2.82Å; G103-L105 PolarHBondContact O-N 2.77Å |
| 104 | A | 60 | Low | 56 | Low | 106 Ų | 106 | 101.9 Ų | 101.9 | 88% | 0.876 | 59% | 0.594 | S | S | * | * | P | Polyproline II helix | trans | -50.4 | 119.7 | 172.7 | 0 | 0 | 0 | 0 | 0 | 108.5 | S106 | A104-S106 PolarHBondContact O-N 2.69Š|
| 105 | L | 63.4 | Low | 58.4 | Low | 57 Ų | 57 | 103.3 Ų | 103.3 | 30% | 0.298 | 58% | 0.581 | S | S | . | * | P | Polyproline II helix | trans | -55 | 138.8 | 179.6 | -72 | 161.7 | 0 | 0 | 0 | 109 | G103 Q109 L110 L113 L142 | G103-L105 PolarHBondContact O-N 2.77Å; L105-Q109 HydrophobicContact CB-CB 4.29Å; L105-Q109 HydrophobicContact CD2-CB 4.14Å; L105-L110 HydrophobicContact CD1-CD1 4.43Å; L105-L113 HydrophobicContact CD1-CD1 3.72Å; L105-L113 HydrophobicContact CD2-CD1 4.43Å; L105-L142 HydrophobicContact CD1-CD2 4.47Å; L105-L142 HydrophobicContact CD2-CD1 4Å; L105-L142 HydrophobicContact CD2-CD2 4.06Å |
| 106 | S | 77 | Confident | 60.9 | Low | 42 Ų | 42 | 99.2 Ų | 99.2 | 29% | 0.294 | 55% | 0.552 | S | S | . | * | P | Polyproline II helix | trans | -63.9 | 154.8 | 174.7 | 80.5 | 0 | 0 | 0 | 0 | 110.1 | A104 Q108 Q109 L110 | A104-S106 PolarHBondContact O-N 2.69Å; S106-Q108 PolarHBondContact O-N 2.71Å; S106-Q108 VanDerWaalsContact O-N 3.15Å; S106-Q109 WeakPolarHBondContact O-CB 3.36Å; S106-Q109 PolarHBondContact O-N 3.19Å; S106-Q109 WeakPolarHBondContact OG-CG 3.46Å; S106-Q109 PolarHBondContact OG-N 3.21Å; S106-Q109 PolarHBondContact OG-OE1 3.17Å; S106-L110 PolarHBondContact O-N 2.67Å |
| 107 | P | 71.7 | Confident | 63.6 | Low | 111 Ų | 111 | 88.9 Ų | 88.9 | 72% | 0.721 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -54.9 | -36.7 | 179.1 | -23 | 30.7 | 0 | 0 | 0 | 112.7 | L110 E111 | P107-L110 PolarHBondContact O-N 3.39Å; P107-E111 PolarHBondContact O-N 3Å |
| 108 | Q | 73.1 | Confident | 66.3 | Low | 153 Ų | 153 | 92.2 Ų | 92.2 | 72% | 0.715 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -67.6 | -36.6 | 177.3 | -66.4 | 169 | -5.4 | 0 | 0 | 112.4 | S106 E111 A112 | S106-Q108 PolarHBondContact O-N 2.71Å; S106-Q108 VanDerWaalsContact O-N 3.15Å; Q108-E111 PolarHBondContact O-N 3.38Å; Q108-A112 WeakPolarHBondContact O-CB 3.41Å; Q108-A112 PolarHBondContact O-N 3.13Å |
| 109 | Q | 71.7 | Confident | 69 | Low | 100 Ų | 100 | 92.2 Ų | 92.2 | 47% | 0.467 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -68.3 | -39.4 | 174.9 | -71.7 | 171.6 | -36.4 | 0 | 0 | 111 | L105 S106 E111 A112 L113 | L105-Q109 HydrophobicContact CB-CB 4.29Å; L105-Q109 HydrophobicContact CD2-CB 4.14Å; S106-Q109 WeakPolarHBondContact O-CB 3.36Å; S106-Q109 PolarHBondContact O-N 3.19Å; S106-Q109 WeakPolarHBondContact OG-CG 3.46Å; S106-Q109 PolarHBondContact OG-N 3.21Å; S106-Q109 PolarHBondContact OG-OE1 3.17Å; Q109-E111 VanDerWaalsContact C-N 3.34Å; Q109-A112 PolarHBondContact O-N 3.44Å; Q109-L113 WeakPolarHBondContact O-CB 3.33Å; Q109-L113 WeakPolarHBondContact O-CG 3.29Å; Q109-L113 PolarHBondContact O-N 3.45Å |
| 110 | L | 71.6 | Confident | 71.7 | Confident | 66 Ų | 66 | 85 Ų | 85 | 35% | 0.346 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -67.1 | -36.7 | 176.4 | -159.2 | 72 | 0 | 0 | 0 | 111.9 | L105 S106 P107 L113 T114 | L105-L110 HydrophobicContact CD1-CD1 4.43Å; S106-L110 PolarHBondContact O-N 2.67Å; P107-L110 PolarHBondContact O-N 3.39Å; L110-L113 PolarHBondContact O-N 2.96Å; L110-T114 WeakPolarHBondContact O-CG2 3.36Å; L110-T114 PolarHBondContact O-N 3.4Å; L110-T114 VanDerWaalsContact O-N 3.13Å; L110-T114 PolarHBondContact O-OG1 3.15Å |
| 111 | E | 77.7 | Confident | 74.6 | Confident | 125 Ų | 125 | 79.9 Ų | 79.9 | 58% | 0.584 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -63.3 | -47.4 | 173.5 | -173 | 172 | -160.6 | 0 | 0 | 111.6 | P107 Q108 Q109 L113 T114 Y115 | P107-E111 PolarHBondContact O-N 3Å; Q108-E111 PolarHBondContact O-N 3.38Å; Q109-E111 VanDerWaalsContact C-N 3.34Å; E111-L113 VanDerWaalsContact C-N 3.33Å; E111-L113 PolarHBondContact O-N 3.42Å; E111-T114 PolarHBondContact O-N 3.03Å; E111-T114 PolarHBondContact O-OG1 2.99Å; E111-Y115 PolarHBondContact O-N 3.35Å |
| 112 | A | 74.3 | Confident | 77.3 | Confident | 52 Ų | 52 | 71.9 Ų | 71.9 | 43% | 0.43 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -62.3 | -38.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q108 Q109 T114 Y115 | Q108-A112 WeakPolarHBondContact O-CB 3.41Å; Q108-A112 PolarHBondContact O-N 3.13Å; Q109-A112 PolarHBondContact O-N 3.44Å; A112-T114 VanDerWaalsContact C-N 3.3Å; A112-T114 PolarHBondContact O-N 3.47Å; A112-Y115 VanDerWaalsContact O-CB 3.28Å; A112-Y115 WeakPolarHBondContact O-CB 3.04Å; A112-Y115 PolarHBondContact O-N 3.23Å |
| 113 | L | 76.4 | Confident | 79.8 | Confident | 17 Ų | 17 | 67.6 Ų | 67.6 | 9% | 0.089 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -70.5 | -23.2 | 178.3 | -74.5 | 171.8 | 0 | 0 | 0 | 113.6 | L105 Q109 L110 E111 L123 L142 L143 | L105-L113 HydrophobicContact CD1-CD1 3.72Å; L105-L113 HydrophobicContact CD2-CD1 4.43Å; Q109-L113 WeakPolarHBondContact O-CB 3.33Å; Q109-L113 WeakPolarHBondContact O-CG 3.29Å; Q109-L113 PolarHBondContact O-N 3.45Å; L110-L113 PolarHBondContact O-N 2.96Å; E111-L113 VanDerWaalsContact C-N 3.33Å; E111-L113 PolarHBondContact O-N 3.42Å; L113-L123 HydrophobicContact CD2-CD2 4.13Å; L113-L142 HydrophobicContact CD1-CB 4.22Å; L113-L142 HydrophobicContact CD1-CD1 4.21Å; L113-L142 HydrophobicContact CD2-CD1 4.48Å; L113-L143 HydrophobicContact CB-CD2 4.06Å; L113-L143 HydrophobicContact CD2-CD1 4.43Å; L113-L143 HydrophobicContact CD2-CD2 4.04Å; L113-L143 HydrophobicContact CD2-CG 4.15Å; L113-L143 HydrophobicContact CG-CD2 4.46Å |
| 114 | T | 81.1 | Confident | 82.1 | Confident | 9 Ų | 9 | 65.2 Ų | 65.2 | 6% | 0.055 | 36% | 0.355 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -99 | 10.3 | 176.7 | 55.5 | 0 | 0 | 0 | 0 | 112.9 | R27 L110 E111 A112 | R27-T114 HydrophobicContact CG-CG2 4.5Å; R27-T114 PolarHBondContact NE-OG1 2.92Å; R27-T114 PolarHBondContact NH2-OG1 3.13Å; L110-T114 WeakPolarHBondContact O-CG2 3.36Å; L110-T114 PolarHBondContact O-N 3.4Å; L110-T114 VanDerWaalsContact O-N 3.13Å; L110-T114 PolarHBondContact O-OG1 3.15Å; E111-T114 PolarHBondContact O-N 3.03Å; E111-T114 PolarHBondContact O-OG1 2.99Å; A112-T114 VanDerWaalsContact C-N 3.3Å; A112-T114 PolarHBondContact O-N 3.47Å |
| 115 | Y | 86.6 | Confident | 83.8 | Confident | 116 Ų | 116 | 60.1 Ų | 60.1 | 46% | 0.455 | 31% | 0.314 | S | S | . | . | trans | -66.3 | 138.7 | 177.2 | 179 | -94.9 | 0 | 0 | 0 | 111.7 | E111 A112 L126 | E111-Y115 PolarHBondContact O-N 3.35Å; A112-Y115 VanDerWaalsContact O-CB 3.28Å; A112-Y115 WeakPolarHBondContact O-CB 3.04Å; A112-Y115 PolarHBondContact O-N 3.23Å; Y115-L126 HydrophobicContact CD1-CD1 4.01Å; Y115-L126 HydrophobicContact CE1-CD1 3.79Å | ||
| 116 | I | 90.6 | Very high | 85.4 | Confident | 37 Ų | 37 | 59.2 Ų | 59.2 | 19% | 0.19 | 31% | 0.309 | C | S | . | . | B | Isolated β-bridge | trans | -133.6 | 128.5 | 174.4 | -58.1 | 176.2 | 0 | 0 | 0 | 106.8 | I20 D121 | I20-I116 HydrophobicContact CB-CD1 4.24Å; I20-I116 HydrophobicContact CD1-CD1 4.34Å; I20-I116 HydrophobicContact CG1-CD1 4.04Å; I20-I116 HydrophobicContact CG2-CD1 3.45Å; I20-I116 VanDerWaalsContact CG2-CD1 3.45Å; I116-D121 WeakPolarHBondContact CA-O 3.2Å |
| 117 | S | 93.1 | Very high | 86.3 | Confident | 20 Ų | 20 | 57.5 Ų | 57.5 | 14% | 0.14 | 30% | 0.297 | C | S | . | . | trans | -72 | 173.3 | 177.9 | 81 | 0 | 0 | 0 | 0 | 112.2 | D119 G120 D121 | S117-D119 PolarHBondContact O-N 3.34Å; S117-D119 PolarHBondContact OG-N 3.43Å; S117-D119 VanDerWaalsContact OG-N 3.13Å; S117-G120 PolarHBondContact O-N 3.14Å; S117-G120 PolarHBondContact OG-N 3.2Å; S117-D121 PolarHBondContact N-O 3Å; S117-D121 WeakPolarHBondContact OG-CB 3.38Å; S117-D121 PolarHBondContact OG-N 2.9Å | ||
| 118 | E | 92.3 | Very high | 87.6 | Confident | 187 Ų | 187 | 52.2 Ų | 52.2 | 87% | 0.874 | 26% | 0.263 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.2 | -29.9 | 171.9 | -60.2 | -175.1 | 171.8 | 0 | 0 | 112.2 | G120 N153 | E118-G120 PolarHBondContact O-N 3.33Å; E118-N153 PolarHBondContact O-ND2 3.25Å |
| 119 | D | 92.1 | Very high | 88.7 | Confident | 107 Ų | 107 | 48 Ų | 48 | 57% | 0.572 | 24% | 0.244 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -82.5 | 1 | 176.7 | -61.1 | -52.6 | 0 | 0 | 0 | 113.2 | S117 D121 N153 | S117-D119 PolarHBondContact O-N 3.34Å; S117-D119 PolarHBondContact OG-N 3.43Å; S117-D119 VanDerWaalsContact OG-N 3.13Å; D119-D121 VanDerWaalsContact C-N 3.34Å; D119-N153 VanDerWaalsContact C-CG 3.45Å; D119-N153 WeakPolarHBondContact CA-ND2 3.46Å; D119-N153 VanDerWaalsContact O-CB 3.26Å; D119-N153 WeakPolarHBondContact O-CB 3.44Å; D119-N153 PolarHBondContact O-N 3.43Å; D119-N153 PolarHBondContact O-ND2 3.18Å |
| 120 | G | 93.2 | Very high | 89.9 | Confident | 3 Ų | 3 | 49.8 Ų | 49.8 | 3% | 0.031 | 25% | 0.253 | C | S | . | . | trans | 82.2 | 10.6 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | S117 E118 T122 | S117-G120 PolarHBondContact O-N 3.14Å; S117-G120 PolarHBondContact OG-N 3.2Å; E118-G120 PolarHBondContact O-N 3.33Å; G120-T122 PolarHBondContact O-N 3.15Å | ||
| 121 | D | 95.1 | Very high | 91.1 | Very high | 14 Ų | 14 | 52.9 Ų | 52.9 | 8% | 0.075 | 27% | 0.265 | C | S | . | . | trans | -77.7 | 121.2 | -179.4 | -67.3 | -45.5 | 0 | 0 | 0 | 111 | I116 S117 D119 H125 L126 N152 | I116-D121 WeakPolarHBondContact CA-O 3.2Å; S117-D121 PolarHBondContact N-O 3Å; S117-D121 WeakPolarHBondContact OG-CB 3.38Å; S117-D121 PolarHBondContact OG-N 2.9Å; D119-D121 VanDerWaalsContact C-N 3.34Å; D121-H125 HydrophobicContact CB-CB 3.68Å; D121-H125 IonicContact OD1-CD2 3.8Å; D121-H125 IonicContact OD1-CG 3.79Å; D121-L126 HydrophobicContact CB-CD2 3.95Å; D121-L126 HydrophobicContact CB-CG 4.15Å; D121-N152 WeakPolarHBondContact OD1-CB 3.41Å; D121-N152 PolarHBondContact OD1-ND2 3.38Å | ||
| 122 | T | 93.9 | Very high | 92 | Very high | 3 Ų | 3 | 48.2 Ų | 48.2 | 2% | 0.018 | 25% | 0.248 | C | C | . | . | B | Isolated β-bridge | trans | -70 | 169.3 | 168.2 | 72.5 | 0 | 0 | 0 | 0 | 110.9 | L23 G120 V124 H125 L126 I150 | L23-T122 HydrophobicContact CD1-CG2 4.27Å; G120-T122 PolarHBondContact O-N 3.15Å; T122-V124 PolarHBondContact O-N 3.34Å; T122-V124 VanDerWaalsContact O-N 3.08Å; T122-V124 PolarHBondContact OG1-N 3.28Å; T122-H125 PolarHBondContact N-ND1 2.88Å; T122-H125 WeakPolarHBondContact O-CB 3.36Å; T122-H125 PolarHBondContact O-N 3.48Å; T122-H125 PolarHBondContact OG1-N 3.08Å; T122-H125 PolarHBondContact OG1-ND1 3.2Å; T122-L126 PolarHBondContact O-N 2.98Å; T122-L126 VanDerWaalsContact O-N 3.09Å; T122-I150 HydrophobicContact CG2-CB 4.1Å; T122-I150 HydrophobicContact CG2-CD1 4.25Å; T122-I150 HydrophobicContact CG2-CG2 3.75Å |
| 123 | L | 93.5 | Very high | 93 | Very high | 43 Ų | 43 | 50 Ų | 50 | 23% | 0.225 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -54.2 | -33 | 171.8 | -167.6 | 65.1 | 0 | 0 | 0 | 114.1 | L113 L126 A127 | L113-L123 HydrophobicContact CD2-CD2 4.13Å; L123-L126 PolarHBondContact O-N 3.48Å; L123-A127 WeakPolarHBondContact O-CB 3.35Å; L123-A127 PolarHBondContact O-N 3.36Å |
| 124 | V | 95.3 | Very high | 93.8 | Very high | 1 Ų | 1 | 52.7 Ų | 52.7 | 1% | 0.006 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -64.7 | -44.9 | 175.2 | -170.1 | 0 | 0 | 0 | 0 | 112.1 | T122 A127 V128 L136 C139 L143 L148 A158 L174 | T122-V124 PolarHBondContact O-N 3.34Å; T122-V124 VanDerWaalsContact O-N 3.08Å; T122-V124 PolarHBondContact OG1-N 3.28Å; V124-A127 PolarHBondContact O-N 2.96Å; V124-V128 WeakPolarHBondContact O-CG2 3.5Å; V124-V128 PolarHBondContact O-N 2.95Å; V124-L136 HydrophobicContact CG1-CD1 3.76Å; V124-C139 HydrophobicContact CG2-CB 4.17Å; V124-L143 HydrophobicContact CG2-CD1 3.46Å; V124-L143 VanDerWaalsContact CG2-CD1 3.46Å; V124-L148 HydrophobicContact CG1-CD2 4.18Å; V124-L148 HydrophobicContact CG2-CD2 4.29Å; V124-A158 HydrophobicContact CB-CB 4.21Å; V124-A158 HydrophobicContact CG1-CB 3.6Å; V124-L174 HydrophobicContact CG1-CD2 3.99Å |
| 125 | H | 96.8 | Very high | 94.4 | Very high | 0 Ų | 0 | 55.4 Ų | 55.4 | 0% | 0 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -57.5 | -50.2 | 173.5 | -66.1 | 86.4 | 0 | 0 | 0 | 110.5 | D121 T122 A127 V128 I129 I150 Q156 T157 A158 L161 | D121-H125 HydrophobicContact CB-CB 3.68Å; D121-H125 IonicContact OD1-CD2 3.8Å; D121-H125 IonicContact OD1-CG 3.79Å; T122-H125 PolarHBondContact N-ND1 2.88Å; T122-H125 WeakPolarHBondContact O-CB 3.36Å; T122-H125 PolarHBondContact O-N 3.48Å; T122-H125 PolarHBondContact OG1-N 3.08Å; T122-H125 PolarHBondContact OG1-ND1 3.2Å; H125-A127 VanDerWaalsContact C-N 3.34Å; H125-A127 PolarHBondContact O-N 3.09Å; H125-V128 WeakPolarHBondContact O-CB 3.46Å; H125-V128 PolarHBondContact O-N 3.34Å; H125-V128 VanDerWaalsContact O-N 3.09Å; H125-I129 HydrophobicContact CB-CD1 4.49Å; H125-I129 VanDerWaalsContact O-CG1 3.29Å; H125-I129 WeakPolarHBondContact O-CG1 3.29Å; H125-I129 PolarHBondContact O-N 3.37Å; H125-I150 PolarHBondContact CE1-O 3.4Å; H125-I150 PolarHBondContact NE2-O 3.1Å; H125-Q156 PolarHBondContact NE2-O 3.4Å; H125-T157 VanDerWaalsContact NE2-C 3.26Å; H125-T157 WeakPolarHBondContact NE2-CA 3.43Å; H125-A158 PolarHBondContact CD2-N 2.82Å; H125-A158 PolarHBondContact NE2-N 3.25Å; H125-L161 HydrophobicContact CB-CD1 4.01Å |
| 126 | L | 96.2 | Very high | 94.8 | Very high | 38 Ų | 38 | 50.1 Ų | 50.1 | 20% | 0.199 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -61.7 | -39.8 | 179.9 | -63.2 | 176.7 | 0 | 0 | 0 | 112.5 | Y115 D121 T122 L123 V128 I129 H130 | Y115-L126 HydrophobicContact CD1-CD1 4.01Å; Y115-L126 HydrophobicContact CE1-CD1 3.79Å; D121-L126 HydrophobicContact CB-CD2 3.95Å; D121-L126 HydrophobicContact CB-CG 4.15Å; T122-L126 PolarHBondContact O-N 2.98Å; T122-L126 VanDerWaalsContact O-N 3.09Å; L123-L126 PolarHBondContact O-N 3.48Å; L126-V128 PolarHBondContact O-N 3.22Å; L126-I129 HydrophobicContact CD2-CD1 4.37Å; L126-I129 PolarHBondContact O-N 2.84Å; L126-H130 WeakPolarHBondContact O-CB 3.34Å; L126-H130 PolarHBondContact O-CD2 3.14Å; L126-H130 PolarHBondContact O-N 2.84Å |
| 127 | A | 96.4 | Very high | 95 | Very high | 6 Ų | 6 | 53.3 Ų | 53.3 | 5% | 0.05 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -61.5 | -34.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | L123 V124 H125 E131 A132 V135 L136 | L123-A127 WeakPolarHBondContact O-CB 3.35Å; L123-A127 PolarHBondContact O-N 3.36Å; V124-A127 PolarHBondContact O-N 2.96Å; H125-A127 VanDerWaalsContact C-N 3.34Å; H125-A127 PolarHBondContact O-N 3.09Å; A127-E131 PolarHBondContact O-N 3.07Å; A127-A132 PolarHBondContact O-N 3.27Å; A127-V135 HydrophobicContact CB-CB 4.22Å; A127-V135 HydrophobicContact CB-CG1 3.98Å; A127-L136 HydrophobicContact CB-CB 4.04Å; A127-L136 HydrophobicContact CB-CD1 4.5Å |
| 128 | V | 97.8 | Very high | 94.9 | Very high | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -73.9 | -47.4 | 174.7 | 171.4 | 0 | 0 | 0 | 0 | 111.3 | V124 H125 L126 H130 E131 L136 A158 L161 A162 L165 Q167 L174 | V124-V128 WeakPolarHBondContact O-CG2 3.5Å; V124-V128 PolarHBondContact O-N 2.95Å; H125-V128 WeakPolarHBondContact O-CB 3.46Å; H125-V128 PolarHBondContact O-N 3.34Å; H125-V128 VanDerWaalsContact O-N 3.09Å; L126-V128 PolarHBondContact O-N 3.22Å; V128-H130 VanDerWaalsContact C-N 3.29Å; V128-H130 PolarHBondContact O-N 3.12Å; V128-E131 PolarHBondContact O-N 2.93Å; V128-L136 HydrophobicContact CG2-CD1 4.08Å; V128-L136 HydrophobicContact CG2-CD2 4.14Å; V128-A158 HydrophobicContact CG2-CB 4.4Å; V128-L161 HydrophobicContact CG1-CB 3.93Å; V128-A162 VanDerWaalsContact CG1-CA 3.46Å; V128-A162 HydrophobicContact CG1-CB 3.77Å; V128-A162 HydrophobicContact CG2-CB 4.43Å; V128-L165 HydrophobicContact CG1-CD1 4.25Å; V128-Q167 PolarHBondContact O-NE2 3.5Å; V128-Q167 VanDerWaalsContact O-NE2 3.09Å; V128-L174 HydrophobicContact CG2-CD1 4.35Å |
| 129 | I | 97.1 | Very high | 94.9 | Very high | 64 Ų | 64 | 47.2 Ų | 47.2 | 33% | 0.328 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -57.7 | -42.4 | 179.3 | -68.4 | 163.8 | 0 | 0 | 0 | 111.3 | H125 L126 E131 L161 | H125-I129 HydrophobicContact CB-CD1 4.49Å; H125-I129 VanDerWaalsContact O-CG1 3.29Å; H125-I129 WeakPolarHBondContact O-CG1 3.29Å; H125-I129 PolarHBondContact O-N 3.37Å; L126-I129 HydrophobicContact CD2-CD1 4.37Å; L126-I129 PolarHBondContact O-N 2.84Å; I129-E131 VanDerWaalsContact C-N 3.28Å; I129-E131 PolarHBondContact O-N 2.86Å; I129-L161 HydrophobicContact CD1-CD1 3.8Å; I129-L161 HydrophobicContact CG1-CD1 3.78Å |
| 130 | H | 96.8 | Very high | 94.9 | Very high | 138 Ų | 138 | 42.7 Ų | 42.7 | 64% | 0.639 | 25% | 0.246 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -87.8 | 9.2 | 179.9 | -67.7 | -64.7 | 0 | 0 | 0 | 114 | L126 V128 A132 | L126-H130 WeakPolarHBondContact O-CB 3.34Å; L126-H130 PolarHBondContact O-CD2 3.14Å; L126-H130 PolarHBondContact O-N 2.84Å; V128-H130 VanDerWaalsContact C-N 3.29Å; V128-H130 PolarHBondContact O-N 3.12Å; H130-A132 PolarHBondContact O-N 3.28Å |
| 131 | E | 96.7 | Very high | 94.8 | Very high | 130 Ų | 130 | 46.3 Ų | 46.3 | 61% | 0.607 | 28% | 0.275 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.7 | 43.2 | 178.9 | -36.4 | -159.6 | 175 | 0 | 0 | 113.1 | A127 V128 I129 P133 Q167 | A127-E131 PolarHBondContact O-N 3.07Å; V128-E131 PolarHBondContact O-N 2.93Å; I129-E131 VanDerWaalsContact C-N 3.28Å; I129-E131 PolarHBondContact O-N 2.86Å; E131-P133 VanDerWaalsContact C-CD 3.47Å; E131-P133 WeakPolarHBondContact O-CD 3.25Å; E131-Q167 VanDerWaalsContact CG-NE2 3.28Å |
| 132 | A | 96.7 | Very high | 94.4 | Very high | 28 Ų | 28 | 49.3 Ų | 49.3 | 23% | 0.231 | 29% | 0.291 | C | S | . | . | trans | -104.2 | 79.1 | -174.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | A127 H130 A134 V135 L136 | A127-A132 PolarHBondContact O-N 3.27Å; H130-A132 PolarHBondContact O-N 3.28Å; A132-A134 VanDerWaalsContact C-N 3.28Å; A132-A134 PolarHBondContact O-N 3.02Å; A132-V135 HydrophobicContact CB-CB 4Å; A132-V135 HydrophobicContact CB-CG2 3.96Å; A132-V135 PolarHBondContact O-N 3.41Å; A132-V135 VanDerWaalsContact O-N 3.08Å; A132-L136 PolarHBondContact O-N 2.77Å | ||
| 133 | P | 94.6 | Very high | 94.1 | Very high | 89 Ų | 89 | 49.7 Ų | 49.7 | 58% | 0.578 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -63.1 | -32.9 | -172.3 | 25.7 | -36.3 | 0 | 0 | 0 | 112.9 | E131 L136 L137 | E131-P133 VanDerWaalsContact C-CD 3.47Å; E131-P133 WeakPolarHBondContact O-CD 3.25Å; P133-L136 PolarHBondContact O-N 3.42Å; P133-L137 WeakPolarHBondContact O-CB 3.22Å; P133-L137 VanDerWaalsContact O-CG 3.23Å; P133-L137 WeakPolarHBondContact O-CG 3.38Å; P133-L137 PolarHBondContact O-N 3.48Å |
| 134 | A | 94 | Very high | 93.7 | Very high | 73 Ų | 73 | 50.2 Ų | 50.2 | 60% | 0.603 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -64 | -43.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | A132 L137 C138 | A132-A134 VanDerWaalsContact C-N 3.28Å; A132-A134 PolarHBondContact O-N 3.02Å; A134-L137 PolarHBondContact O-N 3.43Å; A134-C138 WeakPolarHBondContact O-CB 3.28Å; A134-C138 PolarHBondContact O-N 3.32Å; A134-C138 PolarHBondContact O-SG 2.91Å |
| 135 | V | 93.3 | Very high | 93.2 | Very high | 66 Ų | 66 | 54.1 Ų | 54.1 | 40% | 0.4 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -66.6 | -43.6 | 176.9 | -178.6 | 0 | 0 | 0 | 0 | 109.9 | A127 A132 L137 C138 C139 | A127-V135 HydrophobicContact CB-CB 4.22Å; A127-V135 HydrophobicContact CB-CG1 3.98Å; A132-V135 HydrophobicContact CB-CB 4Å; A132-V135 HydrophobicContact CB-CG2 3.96Å; A132-V135 PolarHBondContact O-N 3.41Å; A132-V135 VanDerWaalsContact O-N 3.08Å; V135-L137 PolarHBondContact O-N 3.39Å; V135-C138 PolarHBondContact O-N 3Å; V135-C139 WeakPolarHBondContact O-CB 3.5Å; V135-C139 PolarHBondContact O-N 2.88Å; V135-C139 PolarHBondContact O-SG 3.43Å |
| 136 | L | 95.4 | Very high | 92.7 | Very high | 5 Ų | 5 | 60.6 Ų | 60.6 | 3% | 0.026 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -57.1 | -50.5 | 175.9 | 179.3 | 60.7 | 0 | 0 | 0 | 111.1 | V124 A127 V128 A132 P133 C138 C139 L140 A170 L174 | V124-L136 HydrophobicContact CG1-CD1 3.76Å; A127-L136 HydrophobicContact CB-CB 4.04Å; A127-L136 HydrophobicContact CB-CD1 4.5Å; V128-L136 HydrophobicContact CG2-CD1 4.08Å; V128-L136 HydrophobicContact CG2-CD2 4.14Å; A132-L136 PolarHBondContact O-N 2.77Å; P133-L136 PolarHBondContact O-N 3.42Å; L136-C138 VanDerWaalsContact C-N 3.34Å; L136-C138 PolarHBondContact O-N 3.06Å; L136-C139 WeakPolarHBondContact O-CB 3.4Å; L136-C139 PolarHBondContact O-N 3.48Å; L136-C139 VanDerWaalsContact O-N 3.12Å; L136-L140 HydrophobicContact CD1-CD1 4.3Å; L136-L140 HydrophobicContact CD1-CD2 4.44Å; L136-L140 HydrophobicContact CD1-CG 4.18Å; L136-L140 HydrophobicContact CG-CD1 4.15Å; L136-L140 HydrophobicContact CG-CG 4.39Å; L136-L140 VanDerWaalsContact O-CG 3.29Å; L136-L140 WeakPolarHBondContact O-CG 3.29Å; L136-L140 PolarHBondContact O-N 3Å; L136-A170 HydrophobicContact CD2-CB 3.56Å; L136-L174 HydrophobicContact CD1-CD2 4.41Å |
| 137 | L | 94.4 | Very high | 92.3 | Very high | 104 Ų | 104 | 59.1 Ų | 59.1 | 55% | 0.545 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -62.3 | -39.6 | 179.3 | -71 | 172.8 | 0 | 0 | 0 | 112.4 | P133 A134 V135 L140 A141 A173 | P133-L137 WeakPolarHBondContact O-CB 3.22Å; P133-L137 VanDerWaalsContact O-CG 3.23Å; P133-L137 WeakPolarHBondContact O-CG 3.38Å; P133-L137 PolarHBondContact O-N 3.48Å; A134-L137 PolarHBondContact O-N 3.43Å; V135-L137 PolarHBondContact O-N 3.39Å; L137-L140 PolarHBondContact O-N 3.22Å; L137-A141 WeakPolarHBondContact O-CB 3.39Å; L137-A141 PolarHBondContact O-N 3.17Å; L137-A173 HydrophobicContact CD2-CB 4.36Å |
| 138 | C | 91.9 | Very high | 92.1 | Very high | 77 Ų | 77 | 58.9 Ų | 58.9 | 52% | 0.52 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -61.3 | -44.7 | 172.2 | -72.5 | 0 | 0 | 0 | 0 | 111.6 | A134 V135 L136 L140 A141 L142 | A134-C138 WeakPolarHBondContact O-CB 3.28Å; A134-C138 PolarHBondContact O-N 3.32Å; A134-C138 PolarHBondContact O-SG 2.91Å; V135-C138 PolarHBondContact O-N 3Å; L136-C138 VanDerWaalsContact C-N 3.34Å; L136-C138 PolarHBondContact O-N 3.06Å; C138-L140 PolarHBondContact O-N 3.43Å; C138-A141 PolarHBondContact O-N 3.34Å; C138-L142 WeakPolarHBondContact O-CG 3.19Å; C138-L142 PolarHBondContact O-N 2.93Å; C138-L142 VanDerWaalsContact O-N 3.17Å |
| 139 | C | 91.2 | Very high | 91.8 | Very high | 3 Ų | 3 | 61.3 Ų | 61.3 | 2% | 0.02 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -60.9 | -45.8 | 175.9 | -66.2 | 0 | 0 | 0 | 0 | 111.2 | V124 V135 L136 A141 L142 L143 | V124-C139 HydrophobicContact CG2-CB 4.17Å; V135-C139 WeakPolarHBondContact O-CB 3.5Å; V135-C139 PolarHBondContact O-N 2.88Å; V135-C139 PolarHBondContact O-SG 3.43Å; L136-C139 WeakPolarHBondContact O-CB 3.4Å; L136-C139 PolarHBondContact O-N 3.48Å; L136-C139 VanDerWaalsContact O-N 3.12Å; C139-A141 VanDerWaalsContact C-N 3.26Å; C139-A141 PolarHBondContact O-N 3.4Å; C139-L142 PolarHBondContact O-N 3.35Å; C139-L143 HydrophobicContact CB-CD1 3.95Å; C139-L143 VanDerWaalsContact O-CB 3.25Å; C139-L143 WeakPolarHBondContact O-CB 3.2Å; C139-L143 WeakPolarHBondContact O-CG 3.4Å; C139-L143 PolarHBondContact O-N 3.47Å |
| 140 | L | 92 | Very high | 91.7 | Very high | 12 Ų | 12 | 58.5 Ų | 58.5 | 6% | 0.063 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -65.7 | -27.2 | 177.7 | -63 | 179.5 | 0 | 0 | 0 | 112.7 | L136 L137 C138 L148 A173 L174 K177 | L136-L140 HydrophobicContact CD1-CD1 4.3Å; L136-L140 HydrophobicContact CD1-CD2 4.44Å; L136-L140 HydrophobicContact CD1-CG 4.18Å; L136-L140 HydrophobicContact CG-CD1 4.15Å; L136-L140 HydrophobicContact CG-CG 4.39Å; L136-L140 VanDerWaalsContact O-CG 3.29Å; L136-L140 WeakPolarHBondContact O-CG 3.29Å; L136-L140 PolarHBondContact O-N 3Å; L137-L140 PolarHBondContact O-N 3.22Å; C138-L140 PolarHBondContact O-N 3.43Å; L140-L148 HydrophobicContact CD2-CD1 4.16Å; L140-L148 HydrophobicContact CD2-CD2 3.51Å; L140-A173 HydrophobicContact CD1-CB 3.66Å; L140-L174 HydrophobicContact CD2-CD2 3.81Å; L140-K177 HydrophobicContact CB-CG 4.41Å; L140-K177 HydrophobicContact CD2-CB 4.21Å; L140-K177 HydrophobicContact CD2-CG 4.09Å; L140-K177 WeakPolarHBondContact O-CD 2.93Å; L140-K177 WeakPolarHBondContact O-CE 3.37Å; L140-K177 PolarHBondContact O-NZ 2.89Å |
| 141 | A | 91 | Very high | 91.6 | Very high | 78 Ų | 78 | 53.9 Ų | 53.9 | 65% | 0.645 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -73.2 | -34.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | L137 C138 C139 | L137-A141 WeakPolarHBondContact O-CB 3.39Å; L137-A141 PolarHBondContact O-N 3.17Å; C138-A141 PolarHBondContact O-N 3.34Å; C139-A141 VanDerWaalsContact C-N 3.26Å; C139-A141 PolarHBondContact O-N 3.4Å |
| 142 | L | 88.4 | Confident | 91.6 | Very high | 78 Ų | 78 | 48.3 Ų | 48.3 | 41% | 0.408 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -98.6 | -31.8 | -170.2 | -62.8 | 173.8 | 0 | 0 | 0 | 113.9 | L105 L113 C138 C139 | L105-L142 HydrophobicContact CD1-CD2 4.47Å; L105-L142 HydrophobicContact CD2-CD1 4Å; L105-L142 HydrophobicContact CD2-CD2 4.06Å; L113-L142 HydrophobicContact CD1-CB 4.22Å; L113-L142 HydrophobicContact CD1-CD1 4.21Å; L113-L142 HydrophobicContact CD2-CD1 4.48Å; C138-L142 WeakPolarHBondContact O-CG 3.19Å; C138-L142 PolarHBondContact O-N 2.93Å; C138-L142 VanDerWaalsContact O-N 3.17Å; C139-L142 PolarHBondContact O-N 3.35Å |
| 143 | L | 85.9 | Confident | 91.5 | Very high | 10 Ų | 10 | 51.8 Ų | 51.8 | 5% | 0.052 | 30% | 0.304 | C | S | . | . | S | Bend | trans | -87.4 | 145.9 | -174.2 | -64.4 | 170.7 | 0 | 0 | 0 | 112.1 | L113 V124 C139 V147 K177 | L113-L143 HydrophobicContact CB-CD2 4.06Å; L113-L143 HydrophobicContact CD2-CD1 4.43Å; L113-L143 HydrophobicContact CD2-CD2 4.04Å; L113-L143 HydrophobicContact CD2-CG 4.15Å; L113-L143 HydrophobicContact CG-CD2 4.46Å; V124-L143 HydrophobicContact CG2-CD1 3.46Å; V124-L143 VanDerWaalsContact CG2-CD1 3.46Å; C139-L143 HydrophobicContact CB-CD1 3.95Å; C139-L143 VanDerWaalsContact O-CB 3.25Å; C139-L143 WeakPolarHBondContact O-CB 3.2Å; C139-L143 WeakPolarHBondContact O-CG 3.4Å; C139-L143 PolarHBondContact O-N 3.47Å; L143-V147 HydrophobicContact CB-CB 4.42Å; L143-V147 HydrophobicContact CD1-CG1 4.03Å; L143-K177 WeakPolarHBondContact O-CE 3.37Å; L143-K177 PolarHBondContact O-NZ 3.45Å |
| 144 | P | 85.7 | Confident | 91.5 | Very high | 54 Ų | 54 | 51.5 Ų | 51.5 | 35% | 0.351 | 30% | 0.297 | S | S | . | . | trans | -73.2 | 164.2 | 171.7 | 33.2 | -32.5 | 0 | 0 | 0 | 110.6 | L26 E146 V147 | L26-P144 HydrophobicContact CD1-CG 4.47Å; P144-E146 VanDerWaalsContact C-N 3.31Å; P144-E146 WeakPolarHBondContact CB-OE2 3.23Å; P144-E146 PolarHBondContact O-N 3.42Å; P144-V147 HydrophobicContact CG-CG2 3.83Å; P144-V147 PolarHBondContact O-N 2.91Å | ||
| 145 | Q | 85 | Confident | 91.6 | Very high | 84 Ų | 84 | 54.3 Ų | 54.3 | 39% | 0.393 | 29% | 0.293 | S | S | . | . | G | 310 helix | trans | -67.1 | -33.5 | -168.9 | -177 | -178.7 | -19.7 | 0 | 0 | 112.3 | V147 L148 G178 | Q145-V147 PolarHBondContact O-N 2.88Å; Q145-V147 VanDerWaalsContact O-N 3.15Å; Q145-L148 VanDerWaalsContact O-CB 3.29Å; Q145-L148 WeakPolarHBondContact O-CB 3.43Å; Q145-L148 WeakPolarHBondContact O-CG 3.23Å; Q145-L148 PolarHBondContact O-N 3.47Å; Q145-G178 PolarHBondContact NE2-O 3.47Å |
| 146 | E | 85.4 | Confident | 91.8 | Very high | 136 Ų | 136 | 52.6 Ų | 52.6 | 64% | 0.636 | 28% | 0.281 | S | S | * | . | G | 310 helix | trans | -60.6 | -26.4 | -177.6 | -61.3 | 75 | -166.2 | 0 | 0 | 112 | P144 L148 D149 | P144-E146 VanDerWaalsContact C-N 3.31Å; P144-E146 WeakPolarHBondContact CB-OE2 3.23Å; P144-E146 PolarHBondContact O-N 3.42Å; E146-L148 VanDerWaalsContact C-N 3.27Å; E146-L148 PolarHBondContact O-N 3.13Å; E146-D149 PolarHBondContact O-N 2.93Å |
| 147 | V | 88.8 | Confident | 91.9 | Very high | 6 Ų | 6 | 52.4 Ų | 52.4 | 4% | 0.036 | 28% | 0.28 | C | S | . | . | G | 310 helix | trans | -70.9 | -25.3 | 178.4 | -178.8 | 0 | 0 | 0 | 0 | 112.2 | L23 L143 P144 Q145 D149 I150 | L23-V147 HydrophobicContact CD1-CG1 4.07Å; L23-V147 HydrophobicContact CD2-CB 4.28Å; L23-V147 HydrophobicContact CD2-CG1 4.02Å; L23-V147 HydrophobicContact CD2-CG2 3.3Å; L23-V147 HydrophobicContact CG-CG1 4.39Å; L23-V147 HydrophobicContact CG-CG2 4.02Å; L143-V147 HydrophobicContact CB-CB 4.42Å; L143-V147 HydrophobicContact CD1-CG1 4.03Å; P144-V147 HydrophobicContact CG-CG2 3.83Å; P144-V147 PolarHBondContact O-N 2.91Å; Q145-V147 PolarHBondContact O-N 2.88Å; Q145-V147 VanDerWaalsContact O-N 3.15Å; V147-D149 PolarHBondContact O-N 3.08Å; V147-I150 HydrophobicContact CG1-CD1 4.24Å; V147-I150 PolarHBondContact O-N 2.87Å |
| 148 | L | 91.2 | Very high | 92 | Very high | 2 Ų | 2 | 47.4 Ų | 47.4 | 1% | 0.01 | 25% | 0.254 | C | S | . | . | G | 310 helix | trans | -72.8 | -20 | 179.9 | -51.3 | -178.3 | 0 | 0 | 0 | 112.4 | V124 L140 Q145 E146 L174 K177 A179 | V124-L148 HydrophobicContact CG1-CD2 4.18Å; V124-L148 HydrophobicContact CG2-CD2 4.29Å; L140-L148 HydrophobicContact CD2-CD1 4.16Å; L140-L148 HydrophobicContact CD2-CD2 3.51Å; Q145-L148 VanDerWaalsContact O-CB 3.29Å; Q145-L148 WeakPolarHBondContact O-CB 3.43Å; Q145-L148 WeakPolarHBondContact O-CG 3.23Å; Q145-L148 PolarHBondContact O-N 3.47Å; E146-L148 VanDerWaalsContact C-N 3.27Å; E146-L148 PolarHBondContact O-N 3.13Å; L148-L174 HydrophobicContact CD2-CD2 4.15Å; L148-K177 HydrophobicContact CD1-CB 3.9Å; L148-K177 HydrophobicContact CD1-CG 3.51Å; L148-A179 HydrophobicContact CB-CB 3.95Å; L148-A179 HydrophobicContact CD1-CB 4.13Å |
| 149 | D | 93.3 | Very high | 92.3 | Very high | 50 Ų | 50 | 43.8 Ų | 43.8 | 27% | 0.267 | 23% | 0.229 | S | C | . | . | G | 310 helix | trans | -95.3 | -4.6 | -175.8 | -71.7 | -4.9 | 0 | 0 | 0 | 112.2 | E146 V147 Q151 S180 L183 | E146-D149 PolarHBondContact O-N 2.93Å; V147-D149 PolarHBondContact O-N 3.08Å; D149-Q151 PolarHBondContact O-N 3.23Å; D149-S180 WeakPolarHBondContact OD1-CB 3.45Å; D149-S180 PolarHBondContact OD1-N 3.21Å; D149-S180 WeakPolarHBondContact OD2-CB 3.39Å; D149-L183 HydrophobicContact CB-CD1 3.68Å; D149-L183 WeakPolarHBondContact O-CD1 3.28Å |
| 150 | I | 93.1 | Very high | 92.6 | Very high | 5 Ų | 5 | 43.8 Ų | 43.8 | 3% | 0.026 | 23% | 0.229 | C | C | . | . | trans | -63.4 | 134.3 | 174.4 | -65.5 | 176 | 0 | 0 | 0 | 109 | I20 L23 T122 H125 V147 | I20-I150 HydrophobicContact CG1-CG2 3.95Å; L23-I150 HydrophobicContact CB-CD1 4.46Å; L23-I150 HydrophobicContact CD1-CD1 3.21Å; L23-I150 HydrophobicContact CG-CD1 3.5Å; T122-I150 HydrophobicContact CG2-CB 4.1Å; T122-I150 HydrophobicContact CG2-CD1 4.25Å; T122-I150 HydrophobicContact CG2-CG2 3.75Å; H125-I150 PolarHBondContact CE1-O 3.4Å; H125-I150 PolarHBondContact NE2-O 3.1Å; V147-I150 HydrophobicContact CG1-CD1 4.24Å; V147-I150 PolarHBondContact O-N 2.87Å | ||
| 151 | Q | 95.9 | Very high | 92.9 | Very high | 41 Ų | 41 | 44 Ų | 44 | 19% | 0.192 | 23% | 0.23 | C | C | . | . | trans | -104.9 | 135.3 | 178.3 | -65.4 | 178.8 | -63.8 | 0 | 0 | 109.9 | D149 Y155 Q156 T157 Q184 | D149-Q151 PolarHBondContact O-N 3.23Å; Q151-Y155 PolarHBondContact NE2-O 3.38Å; Q151-Q156 WeakPolarHBondContact CA-O 3.5Å; Q151-T157 HydrophobicContact CG-CG2 3.69Å; Q151-Q184 PolarHBondContact NE2-O 2.84Å | ||
| 152 | N | 95.6 | Very high | 93.2 | Very high | 13 Ų | 13 | 40.3 Ų | 40.3 | 7% | 0.07 | 20% | 0.199 | C | C | . | . | trans | -72.8 | -174.7 | 173.1 | 73 | 5.6 | 0 | 0 | 0 | 111.7 | D121 L154 Y155 Q156 | D121-N152 WeakPolarHBondContact OD1-CB 3.41Å; D121-N152 PolarHBondContact OD1-ND2 3.38Å; N152-L154 PolarHBondContact O-N 3.37Å; N152-L154 WeakPolarHBondContact OD1-CA 3.29Å; N152-L154 WeakPolarHBondContact OD1-CB 3.35Å; N152-L154 PolarHBondContact OD1-N 3.18Å; N152-Y155 WeakPolarHBondContact O-CA 3.34Å; N152-Y155 PolarHBondContact O-N 2.89Å; N152-Y155 PolarHBondContact OD1-N 2.86Å; N152-Q156 PolarHBondContact N-O 3.13Å; N152-Q156 WeakPolarHBondContact OD1-CB 3.4Å; N152-Q156 PolarHBondContact OD1-N 3.29Å; N152-Q156 PolarHBondContact OD1-O 3.1Å | ||
| 153 | N | 95.3 | Very high | 93.7 | Very high | 101 Ų | 101 | 36.6 Ų | 36.6 | 54% | 0.54 | 18% | 0.18 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -63.1 | -14 | -178.1 | -65.3 | -14.2 | 0 | 0 | 0 | 113.9 | E118 D119 | E118-N153 PolarHBondContact O-ND2 3.25Å; D119-N153 VanDerWaalsContact C-CG 3.45Å; D119-N153 WeakPolarHBondContact CA-ND2 3.46Å; D119-N153 VanDerWaalsContact O-CB 3.26Å; D119-N153 WeakPolarHBondContact O-CB 3.44Å; D119-N153 PolarHBondContact O-N 3.43Å; D119-N153 PolarHBondContact O-ND2 3.18Å |
| 154 | L | 94.8 | Very high | 94.3 | Very high | 83 Ų | 83 | 39.4 Ų | 39.4 | 44% | 0.435 | 19% | 0.193 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -96.3 | 10.5 | 174.1 | -59.1 | 179.8 | 0 | 0 | 0 | 112.9 | N152 Q156 R186 | N152-L154 PolarHBondContact O-N 3.37Å; N152-L154 WeakPolarHBondContact OD1-CA 3.29Å; N152-L154 WeakPolarHBondContact OD1-CB 3.35Å; N152-L154 PolarHBondContact OD1-N 3.18Å; L154-Q156 HydrophobicContact CB-CG 4.09Å; L154-Q156 PolarHBondContact O-N 3.35Å; L154-R186 WeakPolarHBondContact O-CB 3.43Å; L154-R186 PolarHBondContact O-N 3.25Å |
| 155 | Y | 96.2 | Very high | 94.8 | Very high | 133 Ų | 133 | 40 Ų | 40 | 52% | 0.522 | 19% | 0.193 | S | C | . | . | S | Bend | trans | 62.2 | 20.5 | -174 | -57.6 | -94.9 | 0 | 0 | 0 | 113.1 | Q151 N152 D185 R186 | Q151-Y155 PolarHBondContact NE2-O 3.38Å; N152-Y155 WeakPolarHBondContact O-CA 3.34Å; N152-Y155 PolarHBondContact O-N 2.89Å; N152-Y155 PolarHBondContact OD1-N 2.86Å; Y155-D185 WeakPolarHBondContact O-CA 3.28Å; Y155-R186 HydrophobicContact CD2-CB 4.02Å |
| 156 | Q | 97.3 | Very high | 95.4 | Very high | 29 Ų | 29 | 39.6 Ų | 39.6 | 14% | 0.136 | 19% | 0.193 | C | C | . | . | trans | -94.1 | 134.2 | -179 | -64.6 | 177.8 | -43.1 | 0 | 0 | 109.9 | H125 Q151 N152 L154 H160 L161 D185 | H125-Q156 PolarHBondContact NE2-O 3.4Å; Q151-Q156 WeakPolarHBondContact CA-O 3.5Å; N152-Q156 PolarHBondContact N-O 3.13Å; N152-Q156 WeakPolarHBondContact OD1-CB 3.4Å; N152-Q156 PolarHBondContact OD1-N 3.29Å; N152-Q156 PolarHBondContact OD1-O 3.1Å; L154-Q156 HydrophobicContact CB-CG 4.09Å; L154-Q156 PolarHBondContact O-N 3.35Å; Q156-H160 HydrophobicContact CB-CB 4.06Å; Q156-H160 HydrophobicContact CG-CB 4.36Å; Q156-L161 HydrophobicContact CB-CD2 4.42Å; Q156-D185 HydrophobicContact CG-CB 4.13Å | ||
| 157 | T | 97.3 | Very high | 96 | Very high | 1 Ų | 1 | 34.5 Ų | 34.5 | 1% | 0.006 | 17% | 0.169 | C | C | . | . | trans | -85.3 | 166.6 | 165.5 | 66.6 | 0 | 0 | 0 | 0 | 110.6 | H125 Q151 L159 H160 L161 L183 | H125-T157 VanDerWaalsContact NE2-C 3.26Å; H125-T157 WeakPolarHBondContact NE2-CA 3.43Å; Q151-T157 HydrophobicContact CG-CG2 3.69Å; T157-L159 PolarHBondContact O-N 3.26Å; T157-L159 VanDerWaalsContact O-N 3.1Å; T157-L159 PolarHBondContact OG1-N 3.09Å; T157-H160 PolarHBondContact N-ND1 3.39Å; T157-H160 WeakPolarHBondContact O-CB 3.47Å; T157-H160 PolarHBondContact O-N 2.86Å; T157-H160 PolarHBondContact OG1-N 2.76Å; T157-H160 PolarHBondContact OG1-ND1 3Å; T157-L161 PolarHBondContact O-N 2.92Å; T157-L183 HydrophobicContact CG2-CB 4.27Å; T157-L183 HydrophobicContact CG2-CD1 3.65Å | ||
| 158 | A | 96.9 | Very high | 96.4 | Very high | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -56.9 | -28.1 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | V124 H125 V128 L161 A162 L174 | V124-A158 HydrophobicContact CB-CB 4.21Å; V124-A158 HydrophobicContact CG1-CB 3.6Å; H125-A158 PolarHBondContact CD2-N 2.82Å; H125-A158 PolarHBondContact NE2-N 3.25Å; V128-A158 HydrophobicContact CG2-CB 4.4Å; A158-L161 PolarHBondContact O-N 3.44Å; A158-A162 WeakPolarHBondContact O-CB 3.4Å; A158-A162 PolarHBondContact O-N 3.43Å; A158-L174 HydrophobicContact CB-CD1 4.38Å; A158-L174 HydrophobicContact CB-CD2 4.43Å |
| 159 | L | 97.4 | Very high | 96.6 | Very high | 1 Ų | 1 | 38.9 Ų | 38.9 | 1% | 0.005 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -68.1 | -40.2 | 174.4 | -174.4 | 63.5 | 0 | 0 | 0 | 112.3 | T157 L161 A162 V163 V171 L174 V175 A179 R181 A191 L207 | T157-L159 PolarHBondContact O-N 3.26Å; T157-L159 VanDerWaalsContact O-N 3.1Å; T157-L159 PolarHBondContact OG1-N 3.09Å; L159-L161 VanDerWaalsContact C-N 3.35Å; L159-A162 PolarHBondContact O-N 3Å; L159-V163 WeakPolarHBondContact O-CG2 3.39Å; L159-V163 PolarHBondContact O-N 3.08Å; L159-V163 VanDerWaalsContact O-N 3.14Å; L159-V171 HydrophobicContact CD1-CB 4.47Å; L159-V171 HydrophobicContact CD1-CG1 4.07Å; L159-L174 HydrophobicContact CB-CD1 4.44Å; L159-L174 HydrophobicContact CD1-CB 4.02Å; L159-L174 HydrophobicContact CD1-CD1 4.29Å; L159-V175 HydrophobicContact CD1-CG2 4.04Å; L159-V175 HydrophobicContact CD2-CG2 4.46Å; L159-A179 HydrophobicContact CD2-CB 4.4Å; L159-R181 HydrophobicContact CD2-CG 4.11Å; L159-A191 HydrophobicContact CD2-CB 3.96Å; L159-A191 HydrophobicContact CG-CB 3.8Å; L159-L207 HydrophobicContact CD1-CD2 3.98Å; L159-L207 HydrophobicContact CD2-CD2 3.98Å; L159-L207 HydrophobicContact CG-CD2 4.19Å |
| 160 | H | 98.3 | Very high | 96.8 | Very high | 2 Ų | 2 | 37 Ų | 37 | 1% | 0.009 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -60.3 | -46.7 | 173.9 | -70.3 | 86.3 | 0 | 0 | 0 | 110.8 | Q156 T157 V163 H164 L183 D189 A191 | Q156-H160 HydrophobicContact CB-CB 4.06Å; Q156-H160 HydrophobicContact CG-CB 4.36Å; T157-H160 PolarHBondContact N-ND1 3.39Å; T157-H160 WeakPolarHBondContact O-CB 3.47Å; T157-H160 PolarHBondContact O-N 2.86Å; T157-H160 PolarHBondContact OG1-N 2.76Å; T157-H160 PolarHBondContact OG1-ND1 3Å; H160-V163 PolarHBondContact O-N 2.86Å; H160-H164 WeakPolarHBondContact O-CB 3.37Å; H160-H164 PolarHBondContact O-N 3.4Å; H160-L183 PolarHBondContact CE1-O 3.47Å; H160-L183 PolarHBondContact NE2-O 3.5Å; H160-D189 PolarHBondContact NE2-O 2.95Å; H160-A191 PolarHBondContact NE2-N 2.87Å |
| 161 | L | 98.1 | Very high | 97 | Very high | 17 Ų | 17 | 36.8 Ų | 36.8 | 9% | 0.089 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -63.5 | -42 | 179 | -63.7 | -179.2 | 0 | 0 | 0 | 112.2 | H125 V128 I129 Q156 T157 A158 L159 V163 H164 L165 | H125-L161 HydrophobicContact CB-CD1 4.01Å; V128-L161 HydrophobicContact CG1-CB 3.93Å; I129-L161 HydrophobicContact CD1-CD1 3.8Å; I129-L161 HydrophobicContact CG1-CD1 3.78Å; Q156-L161 HydrophobicContact CB-CD2 4.42Å; T157-L161 PolarHBondContact O-N 2.92Å; A158-L161 PolarHBondContact O-N 3.44Å; L159-L161 VanDerWaalsContact C-N 3.35Å; L161-V163 VanDerWaalsContact C-N 3.28Å; L161-V163 PolarHBondContact O-N 3.01Å; L161-H164 WeakPolarHBondContact O-CB 3.45Å; L161-H164 PolarHBondContact O-N 3.31Å; L161-H164 VanDerWaalsContact O-N 3.11Å; L161-L165 WeakPolarHBondContact O-CB 3.37Å; L161-L165 WeakPolarHBondContact O-CG 3.33Å; L161-L165 PolarHBondContact O-N 3.02Å |
| 162 | A | 98.3 | Very high | 97 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -61.9 | -39 | 179.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | V128 A158 L159 D166 Q167 A170 V171 L174 | V128-A162 VanDerWaalsContact CG1-CA 3.46Å; V128-A162 HydrophobicContact CG1-CB 3.77Å; V128-A162 HydrophobicContact CG2-CB 4.43Å; A158-A162 WeakPolarHBondContact O-CB 3.4Å; A158-A162 PolarHBondContact O-N 3.43Å; L159-A162 PolarHBondContact O-N 3Å; A162-D166 PolarHBondContact O-N 2.94Å; A162-Q167 PolarHBondContact O-N 3.42Å; A162-A170 HydrophobicContact CB-CB 3.97Å; A162-V171 HydrophobicContact CB-CG2 3.77Å; A162-L174 HydrophobicContact CB-CD1 3.95Å |
| 163 | V | 98.3 | Very high | 96.9 | Very high | 0 Ų | 0 | 40.4 Ų | 40.4 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -70.1 | -43 | 173.2 | 175.8 | 0 | 0 | 0 | 0 | 111 | L159 H160 L161 L165 D166 V171 A191 V194 A195 H200 C203 L207 | L159-V163 WeakPolarHBondContact O-CG2 3.39Å; L159-V163 PolarHBondContact O-N 3.08Å; L159-V163 VanDerWaalsContact O-N 3.14Å; H160-V163 PolarHBondContact O-N 2.86Å; L161-V163 VanDerWaalsContact C-N 3.28Å; L161-V163 PolarHBondContact O-N 3.01Å; V163-L165 PolarHBondContact O-N 3.45Å; V163-D166 PolarHBondContact O-N 2.89Å; V163-V171 HydrophobicContact CB-CG2 4.49Å; V163-V171 HydrophobicContact CG2-CG1 4.42Å; V163-V171 HydrophobicContact CG2-CG2 3.63Å; V163-A191 WeakPolarHBondContact CG1-O 3.43Å; V163-A191 HydrophobicContact CG2-CB 4.13Å; V163-V194 HydrophobicContact CG1-CB 4.19Å; V163-V194 HydrophobicContact CG1-CG1 4.03Å; V163-A195 VanDerWaalsContact CG1-CA 3.5Å; V163-A195 HydrophobicContact CG1-CB 3.57Å; V163-H200 PolarHBondContact O-CE1 3.13Å; V163-H200 PolarHBondContact O-ND1 3.01Å; V163-C203 HydrophobicContact CG1-CB 4.19Å; V163-C203 HydrophobicContact CG2-CB 4.34Å; V163-L207 HydrophobicContact CG2-CD1 3.99Å; V163-L207 HydrophobicContact CG2-CG 4.48Å |
| 164 | H | 97.2 | Very high | 96.9 | Very high | 70 Ų | 70 | 35.7 Ų | 35.7 | 32% | 0.324 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -59.7 | -35.8 | -178.8 | -168.3 | 96 | 0 | 0 | 0 | 112.4 | H160 L161 D166 V194 R198 | H160-H164 WeakPolarHBondContact O-CB 3.37Å; H160-H164 PolarHBondContact O-N 3.4Å; L161-H164 WeakPolarHBondContact O-CB 3.45Å; L161-H164 PolarHBondContact O-N 3.31Å; L161-H164 VanDerWaalsContact O-N 3.11Å; H164-D166 VanDerWaalsContact C-N 3.34Å; H164-V194 HydrophobicContact CB-CG1 4.32Å; H164-R198 PolarHBondContact CE1-NH2 3.46Å; H164-R198 PolarHBondContact NE2-NH2 2.92Å |
| 165 | L | 97.6 | Very high | 96.8 | Very high | 67 Ų | 67 | 32.5 Ų | 32.5 | 35% | 0.351 | 17% | 0.172 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -89 | 6.6 | 177.9 | -61 | 173.8 | 0 | 0 | 0 | 113.7 | V128 L161 V163 Q167 | V128-L165 HydrophobicContact CG1-CD1 4.25Å; L161-L165 WeakPolarHBondContact O-CB 3.37Å; L161-L165 WeakPolarHBondContact O-CG 3.33Å; L161-L165 PolarHBondContact O-N 3.02Å; V163-L165 PolarHBondContact O-N 3.45Å; L165-Q167 HydrophobicContact CB-CG 4.11Å; L165-Q167 PolarHBondContact O-N 3.05Å |
| 166 | D | 97.9 | Very high | 96.6 | Very high | 75 Ų | 75 | 30.4 Ų | 30.4 | 40% | 0.401 | 17% | 0.169 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 52.2 | 48.4 | -176.7 | -158.6 | 25.6 | 0 | 0 | 0 | 114.7 | A162 V163 H164 P168 H200 C203 | A162-D166 PolarHBondContact O-N 2.94Å; V163-D166 PolarHBondContact O-N 2.89Å; H164-D166 VanDerWaalsContact C-N 3.34Å; D166-P168 VanDerWaalsContact C-CD 3.46Å; D166-P168 WeakPolarHBondContact O-CD 3.34Å; D166-H200 VanDerWaalsContact CB-CE1 3.49Å; D166-H200 WeakPolarHBondContact CB-CE1 3.46Å; D166-H200 WeakPolarHBondContact OD1-CB 3.41Å; D166-H200 IonicContact OD1-CD2 2.78Å; D166-H200 IonicContact OD1-CG 2.98Å; D166-H200 IonicContact OD1-ND1 3.64Å; D166-C203 PolarHBondContact OD1-SG 3.23Å |
| 167 | Q | 97.6 | Very high | 96.3 | Very high | 29 Ų | 29 | 32 Ų | 32 | 14% | 0.136 | 18% | 0.176 | C | C | . | . | trans | -104.3 | 80.1 | 179.7 | -64.3 | 179.7 | 8.3 | 0 | 0 | 111.5 | V128 E131 A162 L165 G169 A170 V171 | V128-Q167 PolarHBondContact O-NE2 3.5Å; V128-Q167 VanDerWaalsContact O-NE2 3.09Å; E131-Q167 VanDerWaalsContact CG-NE2 3.28Å; A162-Q167 PolarHBondContact O-N 3.42Å; L165-Q167 HydrophobicContact CB-CG 4.11Å; L165-Q167 PolarHBondContact O-N 3.05Å; Q167-G169 PolarHBondContact O-N 3.32Å; Q167-G169 VanDerWaalsContact O-N 3.14Å; Q167-A170 HydrophobicContact CB-CB 3.85Å; Q167-A170 PolarHBondContact O-N 2.78Å; Q167-V171 WeakPolarHBondContact O-CG2 3.34Å; Q167-V171 PolarHBondContact O-N 2.98Å | ||
| 168 | P | 96.8 | Very high | 95.9 | Very high | 46 Ų | 46 | 32.8 Ų | 32.8 | 30% | 0.299 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -61.8 | -29.1 | -175.8 | 24.9 | -35.3 | 0 | 0 | 0 | 112.9 | D166 R172 A202 | D166-P168 VanDerWaalsContact C-CD 3.46Å; D166-P168 WeakPolarHBondContact O-CD 3.34Å; P168-R172 VanDerWaalsContact O-CB 3.27Å; P168-R172 WeakPolarHBondContact O-CB 3.44Å; P168-R172 PolarHBondContact O-N 3.35Å; P168-A202 HydrophobicContact CB-CB 4.1Å; P168-A202 HydrophobicContact CG-CB 4.29Å |
| 169 | G | 96.1 | Very high | 95.7 | Very high | 53 Ų | 53 | 33 Ų | 33 | 55% | 0.546 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -65.1 | -44.8 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q167 R172 A173 | Q167-G169 PolarHBondContact O-N 3.32Å; Q167-G169 VanDerWaalsContact O-N 3.14Å; G169-R172 PolarHBondContact O-N 3.19Å; G169-A173 WeakPolarHBondContact O-CB 3.26Å; G169-A173 PolarHBondContact O-N 2.92Å |
| 170 | A | 96.9 | Very high | 95.5 | Very high | 11 Ų | 11 | 34.7 Ų | 34.7 | 9% | 0.091 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -67.2 | -43.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | L136 A162 Q167 R172 A173 L174 | L136-A170 HydrophobicContact CD2-CB 3.56Å; A162-A170 HydrophobicContact CB-CB 3.97Å; Q167-A170 HydrophobicContact CB-CB 3.85Å; Q167-A170 PolarHBondContact O-N 2.78Å; A170-R172 PolarHBondContact O-N 2.86Å; A170-A173 PolarHBondContact O-N 3.19Å; A170-L174 WeakPolarHBondContact O-CB 3.28Å; A170-L174 WeakPolarHBondContact O-CG 3.25Å; A170-L174 PolarHBondContact O-N 2.75Å |
| 171 | V | 97.3 | Very high | 95.2 | Very high | 0 Ų | 0 | 36.5 Ų | 36.5 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -55.6 | -50.6 | 174.5 | 173.7 | 0 | 0 | 0 | 0 | 110.5 | L159 A162 V163 Q167 A173 L174 V175 C203 C206 L207 | L159-V171 HydrophobicContact CD1-CB 4.47Å; L159-V171 HydrophobicContact CD1-CG1 4.07Å; A162-V171 HydrophobicContact CB-CG2 3.77Å; V163-V171 HydrophobicContact CB-CG2 4.49Å; V163-V171 HydrophobicContact CG2-CG1 4.42Å; V163-V171 HydrophobicContact CG2-CG2 3.63Å; Q167-V171 WeakPolarHBondContact O-CG2 3.34Å; Q167-V171 PolarHBondContact O-N 2.98Å; V171-A173 PolarHBondContact O-N 2.78Å; V171-L174 PolarHBondContact O-N 3.04Å; V171-V175 HydrophobicContact CG1-CG2 4.38Å; V171-V175 WeakPolarHBondContact O-CB 3.31Å; V171-V175 VanDerWaalsContact O-CG2 3.29Å; V171-V175 WeakPolarHBondContact O-CG2 3.44Å; V171-V175 PolarHBondContact O-N 3.29Å; V171-C203 HydrophobicContact CG2-CB 4.39Å; V171-C206 HydrophobicContact CB-CB 4.34Å; V171-C206 HydrophobicContact CG1-CB 3.75Å; V171-L207 HydrophobicContact CG1-CD2 3.87Å; V171-L207 HydrophobicContact CG1-CG 3.89Å |
| 172 | R | 95.4 | Very high | 95 | Very high | 110 Ų | 110 | 38.5 Ų | 38.5 | 42% | 0.415 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -60.4 | -44.2 | 178.4 | -174.5 | 179.7 | -67.5 | -90.7 | -4.5 | 111.5 | P168 G169 A170 L176 C206 E209 | P168-R172 VanDerWaalsContact O-CB 3.27Å; P168-R172 WeakPolarHBondContact O-CB 3.44Å; P168-R172 PolarHBondContact O-N 3.35Å; G169-R172 PolarHBondContact O-N 3.19Å; A170-R172 PolarHBondContact O-N 2.86Å; R172-L176 HydrophobicContact CG-CD1 3.88Å; R172-L176 HydrophobicContact CG-CG 4.3Å; R172-L176 VanDerWaalsContact O-CB 3.23Å; R172-L176 WeakPolarHBondContact O-CB 3.27Å; R172-L176 WeakPolarHBondContact O-CG 3.36Å; R172-L176 PolarHBondContact O-N 3.34Å; R172-C206 HydrophobicContact CB-CB 4.37Å; R172-E209 IonicContact CZ-OE2 3.72Å; R172-E209 VanDerWaalsContact CZ-OE2 3.31Å; R172-E209 IonicContact NH1-OE2 3.76Å; R172-E209 PolarHBondContact NH1-OE2 3.03Å; R172-E209 IonicContact NH2-OE2 2.83Å; R172-E209 PolarHBondContact NH2-OE2 3.37Å |
| 173 | A | 94.9 | Very high | 94.8 | Very high | 21 Ų | 21 | 40.8 Ų | 40.8 | 17% | 0.174 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -63.3 | -43.5 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | L137 L140 G169 A170 V171 L176 K177 | L137-A173 HydrophobicContact CD2-CB 4.36Å; L140-A173 HydrophobicContact CD1-CB 3.66Å; G169-A173 WeakPolarHBondContact O-CB 3.26Å; G169-A173 PolarHBondContact O-N 2.92Å; A170-A173 PolarHBondContact O-N 3.19Å; V171-A173 PolarHBondContact O-N 2.78Å; A173-L176 PolarHBondContact O-N 3.42Å; A173-K177 WeakPolarHBondContact O-CB 3.37Å; A173-K177 PolarHBondContact O-N 3.01Å |
| 174 | L | 94.8 | Very high | 94.7 | Very high | 1 Ų | 1 | 43.4 Ų | 43.4 | 1% | 0.005 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -64.6 | -48 | 177.5 | -73.8 | 163.9 | 0 | 0 | 0 | 111.7 | V124 V128 L136 L140 L148 A158 L159 A162 A170 V171 L176 K177 G178 A179 | V124-L174 HydrophobicContact CG1-CD2 3.99Å; V128-L174 HydrophobicContact CG2-CD1 4.35Å; L136-L174 HydrophobicContact CD1-CD2 4.41Å; L140-L174 HydrophobicContact CD2-CD2 3.81Å; L148-L174 HydrophobicContact CD2-CD2 4.15Å; A158-L174 HydrophobicContact CB-CD1 4.38Å; A158-L174 HydrophobicContact CB-CD2 4.43Å; L159-L174 HydrophobicContact CB-CD1 4.44Å; L159-L174 HydrophobicContact CD1-CB 4.02Å; L159-L174 HydrophobicContact CD1-CD1 4.29Å; A162-L174 HydrophobicContact CB-CD1 3.95Å; A170-L174 WeakPolarHBondContact O-CB 3.28Å; A170-L174 WeakPolarHBondContact O-CG 3.25Å; A170-L174 PolarHBondContact O-N 2.75Å; V171-L174 PolarHBondContact O-N 3.04Å; L174-L176 PolarHBondContact O-N 2.86Å; L174-K177 PolarHBondContact O-N 3.15Å; L174-G178 PolarHBondContact O-N 3.5Å; L174-A179 HydrophobicContact CB-CB 4.03Å; L174-A179 WeakPolarHBondContact O-CB 3.37Å; L174-A179 PolarHBondContact O-N 2.96Å |
| 175 | V | 92.9 | Very high | 94.7 | Very high | 17 Ų | 17 | 40.4 Ų | 40.4 | 10% | 0.103 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -62.4 | -42.6 | 176.8 | 172.6 | 0 | 0 | 0 | 0 | 111 | L159 V171 K177 G178 R181 L207 | L159-V175 HydrophobicContact CD1-CG2 4.04Å; L159-V175 HydrophobicContact CD2-CG2 4.46Å; V171-V175 HydrophobicContact CG1-CG2 4.38Å; V171-V175 WeakPolarHBondContact O-CB 3.31Å; V171-V175 VanDerWaalsContact O-CG2 3.29Å; V171-V175 WeakPolarHBondContact O-CG2 3.44Å; V171-V175 PolarHBondContact O-N 3.29Å; V175-K177 VanDerWaalsContact C-N 3.3Å; V175-K177 PolarHBondContact O-N 3.21Å; V175-G178 PolarHBondContact O-N 3.14Å; V175-G178 VanDerWaalsContact O-N 3.09Å; V175-R181 HydrophobicContact CG2-CG 4.34Å; V175-L207 HydrophobicContact CG2-CD2 4.01Å |
| 176 | L | 91.1 | Very high | 94.6 | Very high | 88 Ų | 88 | 43.3 Ų | 43.3 | 46% | 0.461 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -64.6 | -32.2 | 176.5 | -77.7 | 174.8 | 0 | 0 | 0 | 112.8 | R172 A173 L174 G178 R211 | R172-L176 HydrophobicContact CG-CD1 3.88Å; R172-L176 HydrophobicContact CG-CG 4.3Å; R172-L176 VanDerWaalsContact O-CB 3.23Å; R172-L176 WeakPolarHBondContact O-CB 3.27Å; R172-L176 WeakPolarHBondContact O-CG 3.36Å; R172-L176 PolarHBondContact O-N 3.34Å; A173-L176 PolarHBondContact O-N 3.42Å; L174-L176 PolarHBondContact O-N 2.86Å; L176-G178 VanDerWaalsContact C-N 3.3Å; L176-R211 HydrophobicContact CD2-CG 4.27Å; L176-R211 PolarHBondContact O-NE 3.45Å; L176-R211 PolarHBondContact O-NH2 2.9Å |
| 177 | K | 90.8 | Very high | 94.6 | Very high | 63 Ų | 63 | 43.3 Ų | 43.3 | 27% | 0.274 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -75.3 | -22.4 | 174.6 | -176 | 66.5 | -177.5 | -163 | 0 | 112.1 | L140 L143 L148 A173 L174 V175 | L140-K177 HydrophobicContact CB-CG 4.41Å; L140-K177 HydrophobicContact CD2-CB 4.21Å; L140-K177 HydrophobicContact CD2-CG 4.09Å; L140-K177 WeakPolarHBondContact O-CD 2.93Å; L140-K177 WeakPolarHBondContact O-CE 3.37Å; L140-K177 PolarHBondContact O-NZ 2.89Å; L143-K177 WeakPolarHBondContact O-CE 3.37Å; L143-K177 PolarHBondContact O-NZ 3.45Å; L148-K177 HydrophobicContact CD1-CB 3.9Å; L148-K177 HydrophobicContact CD1-CG 3.51Å; A173-K177 WeakPolarHBondContact O-CB 3.37Å; A173-K177 PolarHBondContact O-N 3.01Å; L174-K177 PolarHBondContact O-N 3.15Å; V175-K177 VanDerWaalsContact C-N 3.3Å; V175-K177 PolarHBondContact O-N 3.21Å |
| 178 | G | 90 | Very high | 94.5 | Very high | 17 Ų | 17 | 42 Ų | 42 | 18% | 0.175 | 23% | 0.231 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 112.3 | 19 | 175.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | Q145 L174 V175 L176 S180 | Q145-G178 PolarHBondContact NE2-O 3.47Å; L174-G178 PolarHBondContact O-N 3.5Å; V175-G178 PolarHBondContact O-N 3.14Å; V175-G178 VanDerWaalsContact O-N 3.09Å; L176-G178 VanDerWaalsContact C-N 3.3Å; G178-S180 PolarHBondContact O-N 3.41Å |
| 179 | A | 92.6 | Very high | 94.6 | Very high | 6 Ų | 6 | 40.1 Ų | 40.1 | 5% | 0.05 | 22% | 0.219 | C | C | . | . | trans | -53.7 | 134.2 | 174 | 0 | 0 | 0 | 0 | 0 | 110.8 | L148 L159 L174 R181 | L148-A179 HydrophobicContact CB-CB 3.95Å; L148-A179 HydrophobicContact CD1-CB 4.13Å; L159-A179 HydrophobicContact CD2-CB 4.4Å; L174-A179 HydrophobicContact CB-CB 4.03Å; L174-A179 WeakPolarHBondContact O-CB 3.37Å; L174-A179 PolarHBondContact O-N 2.96Å; A179-R181 PolarHBondContact O-N 3.06Å | ||
| 180 | S | 92.3 | Very high | 94.7 | Very high | 35 Ų | 35 | 37.8 Ų | 37.8 | 25% | 0.245 | 19% | 0.194 | C | C | . | . | trans | -64 | 130.6 | 179.5 | -179.7 | 0 | 0 | 0 | 0 | 110.7 | D149 G178 A182 | D149-S180 WeakPolarHBondContact OD1-CB 3.45Å; D149-S180 PolarHBondContact OD1-N 3.21Å; D149-S180 WeakPolarHBondContact OD2-CB 3.39Å; G178-S180 PolarHBondContact O-N 3.41Å; S180-A182 PolarHBondContact OG-N 2.88Å | ||
| 181 | R | 92.8 | Very high | 94.7 | Very high | 41 Ų | 41 | 37.3 Ų | 37.3 | 16% | 0.155 | 19% | 0.19 | C | C | . | . | S | Bend | trans | -95.3 | -3.9 | 179 | -64.1 | 166.7 | 54.4 | -174.8 | -4.8 | 112.8 | L159 V175 A179 L207 L208 L222 | L159-R181 HydrophobicContact CD2-CG 4.11Å; V175-R181 HydrophobicContact CG2-CG 4.34Å; A179-R181 PolarHBondContact O-N 3.06Å; R181-L207 HydrophobicContact CG-CD2 4.48Å; R181-L207 VanDerWaalsContact CZ-C 3.41Å; R181-L207 PolarHBondContact NE-O 2.99Å; R181-L207 PolarHBondContact NH1-O 3.42Å; R181-L207 PolarHBondContact NH2-O 2.93Å; R181-L208 VanDerWaalsContact NH2-CA 3.33Å; R181-L222 HydrophobicContact CB-CD1 4.04Å |
| 182 | A | 93 | Very high | 94.7 | Very high | 58 Ų | 58 | 37.5 Ų | 37.5 | 48% | 0.479 | 19% | 0.191 | S | C | . | . | S | Bend | trans | -102.2 | -12.8 | -173.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | S180 | S180-A182 PolarHBondContact OG-N 2.88Š|
| 183 | L | 94.6 | Very high | 94.9 | Very high | 48 Ų | 48 | 32.4 Ų | 32.4 | 25% | 0.251 | 17% | 0.172 | S | C | . | . | trans | -64.3 | 139.7 | 177.3 | -67.2 | 172.8 | 0 | 0 | 0 | 110.2 | D149 T157 H160 T190 | D149-L183 HydrophobicContact CB-CD1 3.68Å; D149-L183 WeakPolarHBondContact O-CD1 3.28Å; T157-L183 HydrophobicContact CG2-CB 4.27Å; T157-L183 HydrophobicContact CG2-CD1 3.65Å; H160-L183 PolarHBondContact CE1-O 3.47Å; H160-L183 PolarHBondContact NE2-O 3.5Å; L183-T190 WeakPolarHBondContact O-CA 3.38Å | ||
| 184 | Q | 96.4 | Very high | 95 | Very high | 56 Ų | 56 | 31.7 Ų | 31.7 | 26% | 0.262 | 17% | 0.165 | S | C | . | . | B | Isolated β-bridge | trans | -110.1 | 139.1 | -177.8 | -70 | -177.6 | -53.9 | 0 | 0 | 110.2 | Q151 G188 D189 T190 L226 Q227 | Q151-Q184 PolarHBondContact NE2-O 2.84Å; Q184-G188 VanDerWaalsContact CD-O 3.26Å; Q184-G188 VanDerWaalsContact CG-O 3.28Å; Q184-G188 WeakPolarHBondContact CG-O 3.29Å; Q184-G188 PolarHBondContact NE2-O 3.14Å; Q184-D189 WeakPolarHBondContact CA-O 3.31Å; Q184-T190 HydrophobicContact CG-CG2 3.85Å; Q184-L226 HydrophobicContact CG-CD2 4.4Å; Q184-Q227 PolarHBondContact NE2-O 2.86Å |
| 185 | D | 97.1 | Very high | 95.2 | Very high | 7 Ų | 7 | 31.6 Ų | 31.6 | 4% | 0.037 | 17% | 0.165 | C | C | . | . | trans | -79.3 | -170.1 | 173.9 | 78.6 | -0.8 | 0 | 0 | 0 | 112.9 | Y155 Q156 H187 G188 D189 | Y155-D185 WeakPolarHBondContact O-CA 3.28Å; Q156-D185 HydrophobicContact CG-CB 4.13Å; D185-H187 PolarHBondContact O-N 3.38Å; D185-H187 WeakPolarHBondContact OD1-CA 3.41Å; D185-H187 WeakPolarHBondContact OD1-CB 3.37Å; D185-H187 PolarHBondContact OD1-N 3.04Å; D185-G188 PolarHBondContact O-N 2.97Å; D185-G188 PolarHBondContact OD1-N 3.43Å; D185-D189 PolarHBondContact N-O 3.49Å; D185-D189 WeakPolarHBondContact OD1-CB 3.38Å; D185-D189 PolarHBondContact OD1-N 3.41Å | ||
| 186 | R | 96.6 | Very high | 95.4 | Very high | 127 Ų | 127 | 30.8 Ų | 30.8 | 48% | 0.479 | 16% | 0.16 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -62.5 | -0.7 | 177.9 | 64 | 172.6 | -92.4 | -122.1 | 1.8 | 115.8 | L154 Y155 W229 | L154-R186 WeakPolarHBondContact O-CB 3.43Å; L154-R186 PolarHBondContact O-N 3.25Å; Y155-R186 HydrophobicContact CD2-CB 4.02Å; R186-W229 WeakPolarHBondContact O-CZ3 3.48Å |
| 187 | H | 96.4 | Very high | 95.7 | Very high | 76 Ų | 76 | 31.3 Ų | 31.3 | 35% | 0.352 | 16% | 0.16 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -114.6 | 1 | 174.3 | -61.9 | -58.1 | 0 | 0 | 0 | 111.8 | D185 D189 W229 | D185-H187 PolarHBondContact O-N 3.38Å; D185-H187 WeakPolarHBondContact OD1-CA 3.41Å; D185-H187 WeakPolarHBondContact OD1-CB 3.37Å; D185-H187 PolarHBondContact OD1-N 3.04Å; H187-D189 WeakPolarHBondContact CB-OD2 3.5Å; H187-W229 WeakPolarHBondContact O-CB 3.4Å; H187-W229 PolarHBondContact O-N 3.38Å; H187-W229 VanDerWaalsContact O-N 3.07Å |
| 188 | G | 96.9 | Very high | 96.1 | Very high | 0 Ų | 0 | 34.2 Ų | 34.2 | 0% | 0 | 17% | 0.169 | C | C | . | . | S | Bend | trans | 78.2 | 7.3 | -167.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q184 D185 N228 | Q184-G188 VanDerWaalsContact CD-O 3.26Å; Q184-G188 VanDerWaalsContact CG-O 3.28Å; Q184-G188 WeakPolarHBondContact CG-O 3.29Å; Q184-G188 PolarHBondContact NE2-O 3.14Å; D185-G188 PolarHBondContact O-N 2.97Å; D185-G188 PolarHBondContact OD1-N 3.43Å; G188-N228 VanDerWaalsContact O-CA 3.28Å; G188-N228 WeakPolarHBondContact O-CA 3.42Å; G188-N228 VanDerWaalsContact O-CB 3.31Å; G188-N228 WeakPolarHBondContact O-CB 3.44Å |
| 189 | D | 97.9 | Very high | 96.4 | Very high | 8 Ų | 8 | 37.7 Ų | 37.7 | 4% | 0.043 | 18% | 0.181 | C | C | . | . | trans | -82.6 | 126.2 | -175.8 | -71.6 | -43.6 | 0 | 0 | 0 | 109.3 | H160 Q184 D185 H187 H193 V194 N228 | H160-D189 PolarHBondContact NE2-O 2.95Å; Q184-D189 WeakPolarHBondContact CA-O 3.31Å; D185-D189 PolarHBondContact N-O 3.49Å; D185-D189 WeakPolarHBondContact OD1-CB 3.38Å; D185-D189 PolarHBondContact OD1-N 3.41Å; H187-D189 WeakPolarHBondContact CB-OD2 3.5Å; D189-H193 HydrophobicContact CB-CB 3.71Å; D189-H193 WeakPolarHBondContact OD1-CB 3.17Å; D189-H193 IonicContact OD1-CG 3.31Å; D189-V194 HydrophobicContact CB-CG2 4.09Å; D189-N228 VanDerWaalsContact OD1-CB 3.24Å; D189-N228 WeakPolarHBondContact OD1-CB 3.47Å; D189-N228 PolarHBondContact OD1-ND2 3.11Å | ||
| 190 | T | 97.7 | Very high | 96.7 | Very high | 3 Ų | 3 | 39 Ų | 39 | 2% | 0.018 | 19% | 0.186 | C | C | . | . | B | Isolated β-bridge | trans | -76.1 | 167.4 | 163.9 | 70.5 | 0 | 0 | 0 | 0 | 110.3 | L183 Q184 L192 H193 V194 L226 | L183-T190 WeakPolarHBondContact O-CA 3.38Å; Q184-T190 HydrophobicContact CG-CG2 3.85Å; T190-L192 PolarHBondContact O-N 3.09Å; T190-L192 PolarHBondContact OG1-N 3.35Å; T190-H193 PolarHBondContact N-ND1 3.12Å; T190-H193 WeakPolarHBondContact O-CA 2.83Å; T190-H193 WeakPolarHBondContact O-CB 3.42Å; T190-H193 PolarHBondContact O-N 3.09Å; T190-H193 PolarHBondContact OG1-N 2.91Å; T190-H193 PolarHBondContact OG1-ND1 3.33Å; T190-V194 PolarHBondContact O-N 3.19Å; T190-L226 HydrophobicContact CG2-CD2 3.63Å |
| 191 | A | 97.3 | Very high | 96.9 | Very high | 2 Ų | 2 | 39.8 Ų | 39.8 | 2% | 0.017 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -52 | -31.9 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | L159 H160 V163 A195 L207 | L159-A191 HydrophobicContact CD2-CB 3.96Å; L159-A191 HydrophobicContact CG-CB 3.8Å; H160-A191 PolarHBondContact NE2-N 2.87Å; V163-A191 WeakPolarHBondContact CG1-O 3.43Å; V163-A191 HydrophobicContact CG2-CB 4.13Å; A191-A195 PolarHBondContact O-N 3.23Å; A191-L207 HydrophobicContact CB-CD1 4.21Å; A191-L207 HydrophobicContact CB-CD2 4.1Å |
| 192 | L | 97.8 | Very high | 97.1 | Very high | 4 Ų | 4 | 40.1 Ų | 40.1 | 2% | 0.021 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -73.7 | -37.1 | 175.3 | -172.5 | 63.3 | 0 | 0 | 0 | 112.5 | T190 V194 A195 C196 A204 L207 L208 L222 L224 C234 L250 | T190-L192 PolarHBondContact O-N 3.09Å; T190-L192 PolarHBondContact OG1-N 3.35Å; L192-V194 VanDerWaalsContact C-N 3.33Å; L192-A195 WeakPolarHBondContact O-CB 3.5Å; L192-A195 PolarHBondContact O-N 3.05Å; L192-C196 PolarHBondContact O-N 3.35Å; L192-C196 PolarHBondContact O-SG 3.21Å; L192-A204 HydrophobicContact CD1-CB 3.97Å; L192-L207 HydrophobicContact CB-CD1 4.05Å; L192-L207 HydrophobicContact CD1-CB 4.32Å; L192-L207 HydrophobicContact CD1-CD1 3.96Å; L192-L208 HydrophobicContact CD1-CD1 4.46Å; L192-L208 HydrophobicContact CD1-CG 4.3Å; L192-L208 HydrophobicContact CD2-CD2 3.89Å; L192-L208 HydrophobicContact CD2-CG 4.41Å; L192-L222 HydrophobicContact CB-CD2 4.42Å; L192-L222 HydrophobicContact CD2-CD2 3.6Å; L192-L224 HydrophobicContact CD2-CD2 3.57Å; L192-C234 HydrophobicContact CD2-CB 4.42Å; L192-C234 HydrophobicContact CG-CB 4.47Å; L192-L250 HydrophobicContact CD2-CD2 3.9Å; L192-L250 HydrophobicContact CG-CD2 4.46Å |
| 193 | H | 98.4 | Very high | 97.3 | Very high | 3 Ų | 3 | 37.3 Ų | 37.3 | 1% | 0.014 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -59.9 | -45.8 | 172.5 | -68.4 | 88 | 0 | 0 | 0 | 110.6 | D189 T190 A195 C196 Q197 L226 L232 I237 | D189-H193 HydrophobicContact CB-CB 3.71Å; D189-H193 WeakPolarHBondContact OD1-CB 3.17Å; D189-H193 IonicContact OD1-CG 3.31Å; T190-H193 PolarHBondContact N-ND1 3.12Å; T190-H193 WeakPolarHBondContact O-CA 2.83Å; T190-H193 WeakPolarHBondContact O-CB 3.42Å; T190-H193 PolarHBondContact O-N 3.09Å; T190-H193 PolarHBondContact OG1-N 2.91Å; T190-H193 PolarHBondContact OG1-ND1 3.33Å; H193-A195 VanDerWaalsContact C-N 3.33Å; H193-A195 PolarHBondContact O-N 3.42Å; H193-C196 WeakPolarHBondContact O-CB 3.34Å; H193-C196 PolarHBondContact O-N 3.26Å; H193-C196 VanDerWaalsContact O-N 3.08Å; H193-Q197 WeakPolarHBondContact O-CB 3.27Å; H193-Q197 PolarHBondContact O-N 3.04Å; H193-L226 PolarHBondContact CE1-O 3.04Å; H193-L226 PolarHBondContact NE2-O 3.02Å; H193-L226 VanDerWaalsContact NE2-O 3.12Å; H193-L232 PolarHBondContact CD2-O 3.46Å; H193-L232 PolarHBondContact NE2-O 2.84Å; H193-I237 HydrophobicContact CB-CD1 4.05Å |
| 194 | V | 98.1 | Very high | 97.4 | Very high | 5 Ų | 5 | 35 Ų | 35 | 3% | 0.03 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -59.2 | -44 | 175.6 | -179.1 | 0 | 0 | 0 | 0 | 111 | V163 H164 D189 T190 L192 C196 Q197 R198 | V163-V194 HydrophobicContact CG1-CB 4.19Å; V163-V194 HydrophobicContact CG1-CG1 4.03Å; H164-V194 HydrophobicContact CB-CG1 4.32Å; D189-V194 HydrophobicContact CB-CG2 4.09Å; T190-V194 PolarHBondContact O-N 3.19Å; L192-V194 VanDerWaalsContact C-N 3.33Å; V194-C196 VanDerWaalsContact C-N 3.27Å; V194-C196 PolarHBondContact O-N 2.76Å; V194-Q197 PolarHBondContact O-N 3.2Å; V194-R198 HydrophobicContact CG1-CG 4.26Å; V194-R198 WeakPolarHBondContact O-CB 3.37Å; V194-R198 WeakPolarHBondContact O-CG 3.46Å; V194-R198 PolarHBondContact O-N 2.99Å |
| 195 | A | 98.2 | Very high | 97.4 | Very high | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -60 | -39.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | V163 A191 L192 H193 Q199 H200 A204 L207 | V163-A195 VanDerWaalsContact CG1-CA 3.5Å; V163-A195 HydrophobicContact CG1-CB 3.57Å; A191-A195 PolarHBondContact O-N 3.23Å; L192-A195 WeakPolarHBondContact O-CB 3.5Å; L192-A195 PolarHBondContact O-N 3.05Å; H193-A195 VanDerWaalsContact C-N 3.33Å; H193-A195 PolarHBondContact O-N 3.42Å; A195-Q199 CarbonylContact O-C 3.58Å; A195-Q199 WeakPolarHBondContact O-CA 2.98Å; A195-Q199 PolarHBondContact O-N 3.47Å; A195-H200 PolarHBondContact O-N 2.81Å; A195-A204 HydrophobicContact CB-CB 4.04Å; A195-L207 HydrophobicContact CB-CD1 4.21Å |
| 196 | C | 98.1 | Very high | 97.3 | Very high | 0 Ų | 0 | 37.5 Ų | 37.5 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -68.7 | -45.3 | 178.8 | -63.3 | 0 | 0 | 0 | 0 | 112.3 | L192 H193 V194 R198 Q199 I237 L246 | L192-C196 PolarHBondContact O-N 3.35Å; L192-C196 PolarHBondContact O-SG 3.21Å; H193-C196 WeakPolarHBondContact O-CB 3.34Å; H193-C196 PolarHBondContact O-N 3.26Å; H193-C196 VanDerWaalsContact O-N 3.08Å; V194-C196 VanDerWaalsContact C-N 3.27Å; V194-C196 PolarHBondContact O-N 2.76Å; C196-R198 VanDerWaalsContact C-N 3.32Å; C196-R198 PolarHBondContact O-N 3.04Å; C196-Q199 PolarHBondContact O-N 2.89Å; C196-I237 HydrophobicContact CB-CB 4.08Å; C196-I237 HydrophobicContact CB-CG2 3.79Å; C196-L246 VanDerWaalsContact CA-CD2 3.48Å; C196-L246 HydrophobicContact CB-CD2 3.75Å |
| 197 | Q | 97.7 | Very high | 97.2 | Very high | 99 Ų | 99 | 31.6 Ų | 31.6 | 46% | 0.463 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -63.1 | -39.8 | 179.4 | -172.8 | -175 | 12.7 | 0 | 0 | 111.8 | H193 V194 Q199 I237 | H193-Q197 WeakPolarHBondContact O-CB 3.27Å; H193-Q197 PolarHBondContact O-N 3.04Å; V194-Q197 PolarHBondContact O-N 3.2Å; Q197-Q199 VanDerWaalsContact C-N 3.33Å; Q197-I237 HydrophobicContact CB-CG2 4.03Å |
| 198 | R | 97.4 | Very high | 97 | Very high | 124 Ų | 124 | 28.8 Ų | 28.8 | 47% | 0.468 | 14% | 0.137 | S | C | . | . | H | α-helix | trans | -84.9 | -5.2 | 178.1 | -63.9 | -61.9 | -143.2 | 174.8 | 7.4 | 113.9 | H164 V194 C196 H200 | H164-R198 PolarHBondContact CE1-NH2 3.46Å; H164-R198 PolarHBondContact NE2-NH2 2.92Å; V194-R198 HydrophobicContact CG1-CG 4.26Å; V194-R198 WeakPolarHBondContact O-CB 3.37Å; V194-R198 WeakPolarHBondContact O-CG 3.46Å; V194-R198 PolarHBondContact O-N 2.99Å; C196-R198 VanDerWaalsContact C-N 3.32Å; C196-R198 PolarHBondContact O-N 3.04Å; R198-H200 PolarHBondContact O-CD2 3.3Å; R198-H200 PolarHBondContact O-N 2.97Å |
| 199 | Q | 97.4 | Very high | 96.3 | Very high | 90 Ų | 90 | 33.2 Ų | 33.2 | 42% | 0.421 | 16% | 0.157 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 61.9 | 27.1 | -177.7 | -52.5 | -176.5 | 35.5 | 0 | 0 | 114 | A195 C196 Q197 L201 Q241 N243 | A195-Q199 CarbonylContact O-C 3.58Å; A195-Q199 WeakPolarHBondContact O-CA 2.98Å; A195-Q199 PolarHBondContact O-N 3.47Å; C196-Q199 PolarHBondContact O-N 2.89Å; Q197-Q199 VanDerWaalsContact C-N 3.33Å; Q199-L201 PolarHBondContact O-N 3.02Å; Q199-Q241 HydrophobicContact CG-CB 4.05Å; Q199-Q241 HydrophobicContact CG-CG 4.23Å; Q199-N243 WeakPolarHBondContact CB-ND2 3.4Å |
| 200 | H | 97.8 | Very high | 94.6 | Very high | 34 Ų | 34 | 35 Ų | 35 | 16% | 0.157 | 18% | 0.178 | C | C | . | . | trans | -81.4 | 78.9 | -178.7 | -64.7 | 171.2 | 0 | 0 | 0 | 111.2 | V163 D166 A195 R198 A202 C203 A204 | V163-H200 PolarHBondContact O-CE1 3.13Å; V163-H200 PolarHBondContact O-ND1 3.01Å; D166-H200 VanDerWaalsContact CB-CE1 3.49Å; D166-H200 WeakPolarHBondContact CB-CE1 3.46Å; D166-H200 WeakPolarHBondContact OD1-CB 3.41Å; D166-H200 IonicContact OD1-CD2 2.78Å; D166-H200 IonicContact OD1-CG 2.98Å; D166-H200 IonicContact OD1-ND1 3.64Å; A195-H200 PolarHBondContact O-N 2.81Å; R198-H200 PolarHBondContact O-CD2 3.3Å; R198-H200 PolarHBondContact O-N 2.97Å; H200-A202 VanDerWaalsContact C-N 3.32Å; H200-A202 PolarHBondContact O-N 2.96Å; H200-C203 HydrophobicContact CB-CB 3.94Å; H200-C203 PolarHBondContact O-N 2.86Å; H200-A204 PolarHBondContact O-N 2.79Å | ||
| 201 | L | 97.3 | Very high | 92.7 | Very high | 50 Ų | 50 | 41.2 Ų | 41.2 | 26% | 0.262 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -58.9 | -39.4 | -175.5 | -176 | 66.1 | 0 | 0 | 0 | 113.1 | Q199 A204 R205 P245 L246 L249 | Q199-L201 PolarHBondContact O-N 3.02Å; L201-A204 PolarHBondContact O-N 3.46Å; L201-R205 WeakPolarHBondContact O-CG 3.34Å; L201-R205 PolarHBondContact O-N 3.1Å; L201-P245 HydrophobicContact CD1-CB 4.5Å; L201-P245 HydrophobicContact CD2-CB 4.06Å; L201-L246 HydrophobicContact CD1-CB 4.32Å; L201-L246 HydrophobicContact CD1-CD1 4.04Å; L201-L249 HydrophobicContact CD1-CB 4.44Å; L201-L249 HydrophobicContact CD1-CD2 3.86Å |
| 202 | A | 97.2 | Very high | 90.3 | Very high | 48 Ų | 48 | 46.6 Ų | 46.6 | 40% | 0.397 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -65.7 | -41.8 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | P168 H200 R205 C206 | P168-A202 HydrophobicContact CB-CB 4.1Å; P168-A202 HydrophobicContact CG-CB 4.29Å; H200-A202 VanDerWaalsContact C-N 3.32Å; H200-A202 PolarHBondContact O-N 2.96Å; A202-R205 PolarHBondContact O-N 3.26Å; A202-C206 PolarHBondContact O-N 2.95Å; A202-C206 PolarHBondContact O-SG 2.96Å |
| 203 | C | 97.3 | Very high | 87.9 | Confident | 0 Ų | 0 | 51.9 Ų | 51.9 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -64.6 | -44.8 | 173.4 | -69.6 | 0 | 0 | 0 | 0 | 111.4 | V163 D166 V171 H200 R205 C206 L207 | V163-C203 HydrophobicContact CG1-CB 4.19Å; V163-C203 HydrophobicContact CG2-CB 4.34Å; D166-C203 PolarHBondContact OD1-SG 3.23Å; V171-C203 HydrophobicContact CG2-CB 4.39Å; H200-C203 HydrophobicContact CB-CB 3.94Å; H200-C203 PolarHBondContact O-N 2.86Å; C203-R205 VanDerWaalsContact C-N 3.31Å; C203-R205 PolarHBondContact O-N 3.48Å; C203-C206 PolarHBondContact O-N 3.46Å; C203-C206 VanDerWaalsContact O-N 3.15Å; C203-L207 WeakPolarHBondContact O-CG 3.3Å; C203-L207 PolarHBondContact O-N 3.03Å |
| 204 | A | 97 | Very high | 85.5 | Confident | 0 Ų | 0 | 57.8 Ų | 57.8 | 0% | 0 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -58.2 | -41.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | L192 A195 H200 L201 L207 L208 L246 L249 | L192-A204 HydrophobicContact CD1-CB 3.97Å; A195-A204 HydrophobicContact CB-CB 4.04Å; H200-A204 PolarHBondContact O-N 2.79Å; L201-A204 PolarHBondContact O-N 3.46Å; A204-L207 PolarHBondContact O-N 3.47Å; A204-L208 WeakPolarHBondContact O-CB 3.48Å; A204-L208 VanDerWaalsContact O-CG 3.31Å; A204-L208 WeakPolarHBondContact O-CG 3.39Å; A204-L208 PolarHBondContact O-N 3.37Å; A204-L246 HydrophobicContact CB-CD1 3.53Å; A204-L249 HydrophobicContact CB-CD2 4Å |
| 205 | R | 95.6 | Very high | 83.4 | Confident | 106 Ų | 106 | 61.8 Ų | 61.8 | 40% | 0.4 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -61.4 | -48.9 | 172.8 | -73.9 | -179.2 | -178 | -80.3 | -4.2 | 111.8 | L201 A202 C203 L207 L208 E209 L249 | L201-R205 WeakPolarHBondContact O-CG 3.34Å; L201-R205 PolarHBondContact O-N 3.1Å; A202-R205 PolarHBondContact O-N 3.26Å; C203-R205 VanDerWaalsContact C-N 3.31Å; C203-R205 PolarHBondContact O-N 3.48Å; R205-L207 VanDerWaalsContact C-N 3.26Å; R205-L207 PolarHBondContact O-N 3.22Å; R205-L208 PolarHBondContact O-N 3.37Å; R205-E209 WeakPolarHBondContact O-CB 3.42Å; R205-E209 VanDerWaalsContact O-CG 3.28Å; R205-E209 WeakPolarHBondContact O-CG 3.39Å; R205-E209 PolarHBondContact O-N 3.23Å; R205-L249 HydrophobicContact CB-CD2 4.38Å; R205-L249 HydrophobicContact CG-CD1 3.91Å; R205-L249 HydrophobicContact CG-CD2 3.51Å; R205-L249 HydrophobicContact CG-CG 4.38Å |
| 206 | C | 94.8 | Very high | 80.8 | Confident | 9 Ų | 9 | 71.1 Ų | 71.1 | 6% | 0.061 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -63 | -33.5 | 179.5 | -66.1 | 0 | 0 | 0 | 0 | 112.7 | V171 R172 A202 C203 | V171-C206 HydrophobicContact CB-CB 4.34Å; V171-C206 HydrophobicContact CG1-CB 3.75Å; R172-C206 HydrophobicContact CB-CB 4.37Å; A202-C206 PolarHBondContact O-N 2.95Å; A202-C206 PolarHBondContact O-SG 2.96Å; C203-C206 PolarHBondContact O-N 3.46Å; C203-C206 VanDerWaalsContact O-N 3.15Å |
| 207 | L | 94.7 | Very high | 78.1 | Confident | 2 Ų | 2 | 73.9 Ų | 73.9 | 1% | 0.01 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -63.9 | -62.6 | 169.7 | -68.5 | 168.4 | 0 | 0 | 0 | 108.3 | L159 V163 V171 V175 R181 A191 L192 A195 C203 A204 R205 E209 | L159-L207 HydrophobicContact CD1-CD2 3.98Å; L159-L207 HydrophobicContact CD2-CD2 3.98Å; L159-L207 HydrophobicContact CG-CD2 4.19Å; V163-L207 HydrophobicContact CG2-CD1 3.99Å; V163-L207 HydrophobicContact CG2-CG 4.48Å; V171-L207 HydrophobicContact CG1-CD2 3.87Å; V171-L207 HydrophobicContact CG1-CG 3.89Å; V175-L207 HydrophobicContact CG2-CD2 4.01Å; R181-L207 HydrophobicContact CG-CD2 4.48Å; R181-L207 VanDerWaalsContact CZ-C 3.41Å; R181-L207 PolarHBondContact NE-O 2.99Å; R181-L207 PolarHBondContact NH1-O 3.42Å; R181-L207 PolarHBondContact NH2-O 2.93Å; A191-L207 HydrophobicContact CB-CD1 4.21Å; A191-L207 HydrophobicContact CB-CD2 4.1Å; L192-L207 HydrophobicContact CB-CD1 4.05Å; L192-L207 HydrophobicContact CD1-CB 4.32Å; L192-L207 HydrophobicContact CD1-CD1 3.96Å; A195-L207 HydrophobicContact CB-CD1 4.21Å; C203-L207 WeakPolarHBondContact O-CG 3.3Å; C203-L207 PolarHBondContact O-N 3.03Å; A204-L207 PolarHBondContact O-N 3.47Å; R205-L207 VanDerWaalsContact C-N 3.26Å; R205-L207 PolarHBondContact O-N 3.22Å; L207-E209 VanDerWaalsContact C-N 3.29Å; L207-E209 PolarHBondContact O-N 3.33Å |
| 208 | L | 91.4 | Very high | 75.5 | Confident | 17 Ų | 17 | 75.9 Ų | 75.9 | 9% | 0.089 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -58.5 | -33 | -172.8 | -68.7 | 167.8 | 0 | 0 | 0 | 114.7 | R181 L192 A204 R205 G210 L222 L224 L249 L250 N253 | R181-L208 VanDerWaalsContact NH2-CA 3.33Å; L192-L208 HydrophobicContact CD1-CD1 4.46Å; L192-L208 HydrophobicContact CD1-CG 4.3Å; L192-L208 HydrophobicContact CD2-CD2 3.89Å; L192-L208 HydrophobicContact CD2-CG 4.41Å; A204-L208 WeakPolarHBondContact O-CB 3.48Å; A204-L208 VanDerWaalsContact O-CG 3.31Å; A204-L208 WeakPolarHBondContact O-CG 3.39Å; A204-L208 PolarHBondContact O-N 3.37Å; R205-L208 PolarHBondContact O-N 3.37Å; L208-G210 PolarHBondContact O-N 2.93Å; L208-L222 HydrophobicContact CD2-CD2 4.17Å; L208-L224 HydrophobicContact CD2-CD1 4.49Å; L208-L224 HydrophobicContact CD2-CD2 3.65Å; L208-L249 HydrophobicContact CD1-CD1 4.34Å; L208-L249 HydrophobicContact CD1-CD2 3.76Å; L208-L249 HydrophobicContact CD1-CG 3.61Å; L208-L250 HydrophobicContact CD1-CD2 4.28Å; L208-N253 HydrophobicContact CD1-CB 4.43Å; L208-N253 HydrophobicContact CD2-CB 4.1Å |
| 209 | E | 83.8 | Confident | 72.9 | Confident | 93 Ų | 93 | 73.2 Ų | 73.2 | 44% | 0.435 | 43% | 0.425 | S | S | . | . | S | Bend | trans | -63.1 | 92.2 | 171.2 | -73.4 | 170.6 | -160.6 | 0 | 0 | 111.1 | R172 R205 L207 | R172-E209 IonicContact CZ-OE2 3.72Å; R172-E209 VanDerWaalsContact CZ-OE2 3.31Å; R172-E209 IonicContact NH1-OE2 3.76Å; R172-E209 PolarHBondContact NH1-OE2 3.03Å; R172-E209 IonicContact NH2-OE2 2.83Å; R172-E209 PolarHBondContact NH2-OE2 3.37Å; R205-E209 WeakPolarHBondContact O-CB 3.42Å; R205-E209 VanDerWaalsContact O-CG 3.28Å; R205-E209 WeakPolarHBondContact O-CG 3.39Å; R205-E209 PolarHBondContact O-N 3.23Å; L207-E209 VanDerWaalsContact C-N 3.29Å; L207-E209 PolarHBondContact O-N 3.33Å |
| 210 | G | 62.6 | Low | 70.7 | Confident | 47 Ų | 47 | 77 Ų | 77 | 49% | 0.485 | 44% | 0.442 | S | S | . | . | trans | -69.9 | 153.6 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113 | L208 P212 | L208-G210 PolarHBondContact O-N 2.93Å; G210-P212 WeakPolarHBondContact O-CD 3.47Å | ||
| 211 | R | 55.8 | Low | 69.1 | Low | 132 Ų | 132 | 80.6 Ų | 80.6 | 50% | 0.498 | 47% | 0.471 | S | S | . | . | trans | -47.8 | 118.1 | 174.7 | -109.7 | -170.7 | -170.3 | 174.7 | 2.9 | 110.4 | L176 E213 | L176-R211 HydrophobicContact CD2-CG 4.27Å; L176-R211 PolarHBondContact O-NE 3.45Å; L176-R211 PolarHBondContact O-NH2 2.9Å; R211-E213 HydrophobicContact CB-CG 4.22Å; R211-E213 PolarHBondContact O-N 3.24Å | ||
| 212 | P | 48.5 | Very low | 68.4 | Low | 115 Ų | 115 | 79.8 Ų | 79.8 | 75% | 0.747 | 47% | 0.467 | S | S | * | . | trans | -78.2 | 77.9 | 170.9 | 31.6 | -31.6 | 0 | 0 | 0 | 108.8 | G210 P214 | G210-P212 WeakPolarHBondContact O-CD 3.47Å; P212-P214 WeakPolarHBondContact O-CD 3.49Å | ||
| 213 | E | 47.4 | Very low | 68.1 | Low | 116 Ų | 116 | 82 Ų | 82 | 54% | 0.542 | 47% | 0.472 | S | S | . | . | trans | -91.7 | 111.7 | 171.1 | -68.5 | -62.7 | 151.8 | 0 | 0 | 109.5 | R211 G215 | R211-E213 HydrophobicContact CB-CG 4.22Å; R211-E213 PolarHBondContact O-N 3.24Å; E213-G215 PolarHBondContact O-N 3.05Å | ||
| 214 | P | 46.8 | Very low | 67.9 | Low | 127 Ų | 127 | 82.6 Ų | 82.6 | 83% | 0.825 | 48% | 0.475 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69 | 115.7 | 177 | 26.9 | -31.2 | 0 | 0 | 0 | 110.1 | P212 | P212-P214 WeakPolarHBondContact O-CD 3.49Š|
| 215 | G | 53.5 | Low | 67.8 | Low | 88 Ų | 88 | 84.9 Ų | 84.9 | 91% | 0.907 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 104.1 | 1.9 | 167.5 | 0 | 0 | 0 | 0 | 0 | 116.8 | E213 | E213-G215 PolarHBondContact O-N 3.05Š|
| 216 | R | 45.1 | Very low | 67.8 | Low | 196 Ų | 196 | 82.4 Ų | 82.4 | 74% | 0.74 | 48% | 0.48 | S | S | * | . | S | Bend | trans | -108.7 | 115.4 | 168.1 | -143 | 176.9 | -153.4 | -133.3 | 6.1 | 108.5 | T218 | R216-T218 PolarHBondContact O-N 3.39Š|
| 217 | G | 40.7 | Very low | 68 | Low | 59 Ų | 59 | 85 Ų | 85 | 61% | 0.608 | 49% | 0.491 | S | S | * | . | trans | -50.5 | 133.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | S219 | G217-S219 VanDerWaalsContact C-N 3.31Å; G217-S219 PolarHBondContact O-N 3.2Å; G217-S219 PolarHBondContact O-OG 3.3Å | ||
| 218 | T | 43.5 | Very low | 68.1 | Low | 141 Ų | 141 | 85.2 Ų | 85.2 | 87% | 0.865 | 49% | 0.493 | S | S | * | . | trans | 0.2 | 72 | 168.8 | 55 | 0 | 0 | 0 | 0 | 114.9 | R216 H220 | R216-T218 PolarHBondContact O-N 3.39Å; T218-H220 PolarHBondContact O-N 3.04Å | ||
| 219 | S | 42.7 | Very low | 68.4 | Low | 68 Ų | 68 | 92.7 Ų | 92.7 | 48% | 0.476 | 52% | 0.52 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.7 | 108 | -179.6 | -65.9 | 0 | 0 | 0 | 0 | 107.4 | G217 | G217-S219 VanDerWaalsContact C-N 3.31Å; G217-S219 PolarHBondContact O-N 3.2Å; G217-S219 PolarHBondContact O-OG 3.3Å |
| 220 | H | 51.3 | Low | 69 | Low | 170 Ų | 170 | 94.1 Ų | 94.1 | 79% | 0.787 | 53% | 0.526 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 84.4 | 62.9 | -177 | -43.4 | -67.4 | 0 | 0 | 0 | 115.4 | T218 L222 | T218-H220 PolarHBondContact O-N 3.04Å; H220-L222 PolarHBondContact O-N 3.14Å; H220-L222 VanDerWaalsContact O-N 3.14Å |
| 221 | S | 64.3 | Low | 70.7 | Confident | 108 Ų | 108 | 92.3 Ų | 92.3 | 76% | 0.755 | 51% | 0.508 | S | S | * | . | trans | -55.5 | 114.1 | 157.9 | -179.3 | 0 | 0 | 0 | 0 | 108.4 | D223 | S221-D223 PolarHBondContact O-N 2.87Š| ||
| 222 | L | 83.3 | Confident | 72.7 | Confident | 33 Ų | 33 | 87.1 Ų | 87.1 | 17% | 0.173 | 49% | 0.49 | C | S | . | . | trans | -66.7 | 124.2 | 171.4 | 178.5 | 63.1 | 0 | 0 | 0 | 108 | R181 L192 L208 H220 L224 | R181-L222 HydrophobicContact CB-CD1 4.04Å; L192-L222 HydrophobicContact CB-CD2 4.42Å; L192-L222 HydrophobicContact CD2-CD2 3.6Å; L208-L222 HydrophobicContact CD2-CD2 4.17Å; H220-L222 PolarHBondContact O-N 3.14Å; H220-L222 VanDerWaalsContact O-N 3.14Å; L222-L224 HydrophobicContact CD2-CD2 3.75Å; L222-L224 HydrophobicContact CG-CD2 3.99Å; L222-L224 PolarHBondContact O-N 3.08Å; L222-L224 VanDerWaalsContact O-N 3.17Å | ||
| 223 | D | 90.2 | Very high | 75.1 | Confident | 95 Ų | 95 | 81.6 Ų | 81.6 | 51% | 0.508 | 45% | 0.454 | S | S | . | . | trans | -74.3 | 104.4 | 171.9 | -175.2 | 2 | 0 | 0 | 0 | 109.5 | S221 Q225 L226 | S221-D223 PolarHBondContact O-N 2.87Å; D223-Q225 PolarHBondContact O-N 2.95Å; D223-Q225 WeakPolarHBondContact OD1-CA 3.46Å; D223-Q225 WeakPolarHBondContact OD1-CB 3.49Å; D223-Q225 PolarHBondContact OD1-N 3.41Å; D223-L226 HydrophobicContact CB-CB 4.34Å; D223-L226 PolarHBondContact OD1-N 2.9Å | ||
| 224 | L | 93.4 | Very high | 77.5 | Confident | 12 Ų | 12 | 76.2 Ų | 76.2 | 6% | 0.063 | 43% | 0.429 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.5 | -9.6 | 178.3 | -60.6 | -179.7 | 0 | 0 | 0 | 112.9 | L192 L208 L222 N253 A255 | L192-L224 HydrophobicContact CD2-CD2 3.57Å; L208-L224 HydrophobicContact CD2-CD1 4.49Å; L208-L224 HydrophobicContact CD2-CD2 3.65Å; L222-L224 HydrophobicContact CD2-CD2 3.75Å; L222-L224 HydrophobicContact CG-CD2 3.99Å; L222-L224 PolarHBondContact O-N 3.08Å; L222-L224 VanDerWaalsContact O-N 3.17Å; L224-N253 HydrophobicContact CD1-CB 4.08Å; L224-N253 VanDerWaalsContact CD1-O 3.25Å; L224-N253 WeakPolarHBondContact CD1-O 3.39Å; L224-A255 HydrophobicContact CB-CB 4.24Å; L224-A255 HydrophobicContact CD1-CB 4.08Å |
| 225 | Q | 94.9 | Very high | 79.9 | Confident | 49 Ų | 49 | 70.3 Ų | 70.3 | 23% | 0.229 | 39% | 0.39 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -96 | -9 | 179.1 | -50.7 | -39 | -54.5 | 0 | 0 | 112.4 | D223 Q227 D256 V259 | D223-Q225 PolarHBondContact O-N 2.95Å; D223-Q225 WeakPolarHBondContact OD1-CA 3.46Å; D223-Q225 WeakPolarHBondContact OD1-CB 3.49Å; D223-Q225 PolarHBondContact OD1-N 3.41Å; Q225-Q227 WeakPolarHBondContact O-CG 3.33Å; Q225-Q227 PolarHBondContact O-N 3.25Å; Q225-D256 HydrophobicContact CG-CB 4.32Å; Q225-V259 VanDerWaalsContact OE1-CB 3.22Å |
| 226 | L | 95.9 | Very high | 82.1 | Confident | 54 Ų | 54 | 66.1 Ų | 66.1 | 28% | 0.283 | 35% | 0.347 | S | S | . | . | trans | -53.8 | 127.9 | 172.4 | -178.8 | 65.4 | 0 | 0 | 0 | 109.5 | Q184 T190 H193 D223 | Q184-L226 HydrophobicContact CG-CD2 4.4Å; T190-L226 HydrophobicContact CG2-CD2 3.63Å; H193-L226 PolarHBondContact CE1-O 3.04Å; H193-L226 PolarHBondContact NE2-O 3.02Å; H193-L226 VanDerWaalsContact NE2-O 3.12Å; D223-L226 HydrophobicContact CB-CB 4.34Å; D223-L226 PolarHBondContact OD1-N 2.9Å | ||
| 227 | Q | 97.4 | Very high | 84.6 | Confident | 62 Ų | 62 | 57.2 Ų | 57.2 | 29% | 0.29 | 31% | 0.314 | S | S | . | . | trans | -102.5 | 144.7 | -177.9 | -59.1 | -175 | -13.6 | 0 | 0 | 110.5 | Q184 Q225 G231 A233 Q260 | Q184-Q227 PolarHBondContact NE2-O 2.86Å; Q225-Q227 WeakPolarHBondContact O-CG 3.33Å; Q225-Q227 PolarHBondContact O-N 3.25Å; Q227-G231 PolarHBondContact OE1-O 3.36Å; Q227-A233 HydrophobicContact CG-CB 4.35Å; Q227-Q260 PolarHBondContact NE2-O 3.37Å | ||
| 228 | N | 97.8 | Very high | 87.4 | Confident | 8 Ų | 8 | 54.4 Ų | 54.4 | 4% | 0.043 | 29% | 0.285 | C | S | . | . | trans | -72.9 | -178.7 | 167.6 | 73.1 | 6.1 | 0 | 0 | 0 | 111.6 | G188 D189 Q230 G231 L232 | G188-N228 VanDerWaalsContact O-CA 3.28Å; G188-N228 WeakPolarHBondContact O-CA 3.42Å; G188-N228 VanDerWaalsContact O-CB 3.31Å; G188-N228 WeakPolarHBondContact O-CB 3.44Å; D189-N228 VanDerWaalsContact OD1-CB 3.24Å; D189-N228 WeakPolarHBondContact OD1-CB 3.47Å; D189-N228 PolarHBondContact OD1-ND2 3.11Å; N228-Q230 PolarHBondContact O-N 2.77Å; N228-Q230 VanDerWaalsContact O-N 3.11Å; N228-Q230 WeakPolarHBondContact OD1-CA 3.47Å; N228-Q230 WeakPolarHBondContact OD1-CB 3.36Å; N228-Q230 PolarHBondContact OD1-N 3.04Å; N228-G231 PolarHBondContact O-N 3.3Å; N228-G231 PolarHBondContact OD1-N 3.34Å; N228-L232 PolarHBondContact N-O 2.89Å; N228-L232 PolarHBondContact OD1-N 2.93Å; N228-L232 PolarHBondContact OD1-O 3.32Å | ||
| 229 | W | 97.4 | Very high | 90 | Very high | 174 Ų | 174 | 47.7 Ų | 47.7 | 66% | 0.659 | 24% | 0.244 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -70.3 | -8.6 | -177.5 | -59.5 | -16.7 | 0 | 0 | 0 | 114 | R186 H187 G231 | R186-W229 WeakPolarHBondContact O-CZ3 3.48Å; H187-W229 WeakPolarHBondContact O-CB 3.4Å; H187-W229 PolarHBondContact O-N 3.38Å; H187-W229 VanDerWaalsContact O-N 3.07Å; W229-G231 VanDerWaalsContact C-N 3.29Å |
| 230 | Q | 96.8 | Very high | 92.6 | Very high | 123 Ų | 123 | 48 Ų | 48 | 58% | 0.575 | 24% | 0.24 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -87.8 | 1.4 | 169.8 | -57.1 | 177.4 | -23.9 | 0 | 0 | 112.1 | N228 L232 T263 | N228-Q230 PolarHBondContact O-N 2.77Å; N228-Q230 VanDerWaalsContact O-N 3.11Å; N228-Q230 WeakPolarHBondContact OD1-CA 3.47Å; N228-Q230 WeakPolarHBondContact OD1-CB 3.36Å; N228-Q230 PolarHBondContact OD1-N 3.04Å; Q230-L232 VanDerWaalsContact C-N 3.3Å; Q230-L232 HydrophobicContact CB-CD1 4.24Å; Q230-L232 HydrophobicContact CB-CG 4.18Å; Q230-T263 WeakPolarHBondContact O-CG2 3.41Å |
| 231 | G | 97.7 | Very high | 94.8 | Very high | 9 Ų | 9 | 43.2 Ų | 43.2 | 9% | 0.093 | 22% | 0.218 | C | C | . | . | S | Bend | trans | 76.2 | 15.7 | -175.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | Q227 N228 W229 E261 G262 | Q227-G231 PolarHBondContact OE1-O 3.36Å; N228-G231 PolarHBondContact O-N 3.3Å; N228-G231 PolarHBondContact OD1-N 3.34Å; W229-G231 VanDerWaalsContact C-N 3.29Å; G231-E261 CarbonylContact O-C 3.52Å; G231-E261 WeakPolarHBondContact O-CA 3.25Å; G231-E261 VanDerWaalsContact O-CB 3.25Å; G231-E261 WeakPolarHBondContact O-CB 3.18Å; G231-G262 PolarHBondContact O-N 3.41Å |
| 232 | L | 98.4 | Very high | 96.4 | Very high | 22 Ų | 22 | 42.7 Ų | 42.7 | 12% | 0.115 | 20% | 0.202 | C | C | . | . | trans | -100.8 | 118.8 | -177 | -59.3 | 175.4 | 0 | 0 | 0 | 110.9 | H193 N228 Q230 H236 I237 L240 E261 | H193-L232 PolarHBondContact CD2-O 3.46Å; H193-L232 PolarHBondContact NE2-O 2.84Å; N228-L232 PolarHBondContact N-O 2.89Å; N228-L232 PolarHBondContact OD1-N 2.93Å; N228-L232 PolarHBondContact OD1-O 3.32Å; Q230-L232 VanDerWaalsContact C-N 3.3Å; Q230-L232 HydrophobicContact CB-CD1 4.24Å; Q230-L232 HydrophobicContact CB-CG 4.18Å; L232-H236 HydrophobicContact CB-CB 4.25Å; L232-H236 HydrophobicContact CD2-CB 3.81Å; L232-I237 HydrophobicContact CB-CG1 4.08Å; L232-I237 HydrophobicContact CD1-CG1 4.36Å; L232-L240 HydrophobicContact CD1-CD1 4.14Å; L232-E261 HydrophobicContact CD2-CB 3.86Å; L232-E261 HydrophobicContact CD2-CG 4.31Å | ||
| 233 | A | 98.2 | Very high | 97 | Very high | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 20% | 0.199 | C | C | . | . | trans | -70.5 | 164.5 | 159 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q227 L235 H236 I237 V259 | Q227-A233 HydrophobicContact CG-CB 4.35Å; A233-L235 VanDerWaalsContact C-N 3.28Å; A233-L235 PolarHBondContact O-N 3.22Å; A233-H236 PolarHBondContact N-ND1 2.79Å; A233-H236 WeakPolarHBondContact O-CB 3.25Å; A233-H236 PolarHBondContact O-N 3.19Å; A233-I237 PolarHBondContact O-N 2.99Å; A233-V259 HydrophobicContact CB-CG1 4.47Å; A233-V259 HydrophobicContact CB-CG2 4.46Å | ||
| 234 | C | 98.2 | Very high | 97.4 | Very high | 3 Ų | 3 | 41 Ų | 41 | 2% | 0.02 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -55.3 | -37.5 | -179.1 | -72 | 0 | 0 | 0 | 0 | 113.8 | L192 H236 I237 A238 L250 | L192-C234 HydrophobicContact CD2-CB 4.42Å; L192-C234 HydrophobicContact CG-CB 4.47Å; C234-H236 VanDerWaalsContact C-N 3.33Å; C234-H236 PolarHBondContact O-N 3.44Å; C234-I237 PolarHBondContact O-N 3.07Å; C234-A238 WeakPolarHBondContact O-CB 3.44Å; C234-A238 PolarHBondContact O-N 3.28Å; C234-L250 HydrophobicContact CB-CD1 4.03Å; C234-L250 HydrophobicContact CB-CD2 3.97Å |
| 235 | L | 98.3 | Very high | 97.6 | Very high | 2 Ų | 2 | 43.4 Ų | 43.4 | 1% | 0.01 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -63.9 | -37.8 | 178.5 | -176.1 | 63.9 | 0 | 0 | 0 | 111.9 | A233 A238 T239 M247 L251 D256 A268 | A233-L235 VanDerWaalsContact C-N 3.28Å; A233-L235 PolarHBondContact O-N 3.22Å; L235-A238 PolarHBondContact O-N 3.37Å; L235-T239 WeakPolarHBondContact O-CB 3.37Å; L235-T239 PolarHBondContact O-N 3.06Å; L235-T239 PolarHBondContact O-OG1 3.21Å; L235-M247 HydrophobicContact CD1-CB 4.19Å; L235-M247 HydrophobicContact CD1-CG 4.26Å; L235-L251 HydrophobicContact CD1-CD2 4.26Å; L235-L251 HydrophobicContact CD1-CG 4.24Å; L235-L251 HydrophobicContact CD2-CD2 3.97Å; L235-D256 WeakPolarHBondContact CD2-O 3.41Å; L235-A268 HydrophobicContact CD2-CB 3.92Å; L235-A268 HydrophobicContact CG-CB 4Å |
| 236 | H | 98.6 | Very high | 97.7 | Very high | 0 Ų | 0 | 41.1 Ų | 41.1 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -63.7 | -46.3 | 175.4 | -59.2 | 125.7 | 0 | 0 | 0 | 111.4 | L232 A233 C234 A238 T239 L240 V259 E261 K266 L271 | L232-H236 HydrophobicContact CB-CB 4.25Å; L232-H236 HydrophobicContact CD2-CB 3.81Å; A233-H236 PolarHBondContact N-ND1 2.79Å; A233-H236 WeakPolarHBondContact O-CB 3.25Å; A233-H236 PolarHBondContact O-N 3.19Å; C234-H236 VanDerWaalsContact C-N 3.33Å; C234-H236 PolarHBondContact O-N 3.44Å; H236-A238 PolarHBondContact O-N 2.89Å; H236-T239 WeakPolarHBondContact O-CB 3.39Å; H236-T239 PolarHBondContact O-N 3.46Å; H236-L240 WeakPolarHBondContact O-CG 3.24Å; H236-L240 PolarHBondContact O-N 3.02Å; H236-V259 PolarHBondContact NE2-O 2.95Å; H236-E261 PolarHBondContact CE1-N 2.86Å; H236-E261 VanDerWaalsContact CE1-N 3.32Å; H236-K266 PolarHBondContact NE2-O 2.8Å; H236-L271 HydrophobicContact CB-CD1 3.6Å |
| 237 | I | 98.5 | Very high | 97.8 | Very high | 10 Ų | 10 | 38.5 Ų | 38.5 | 5% | 0.051 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -60.6 | -48.4 | 177.6 | -60.1 | -179.1 | 0 | 0 | 0 | 110.3 | H193 C196 Q197 L232 A233 C234 T239 L240 Q241 | H193-I237 HydrophobicContact CB-CD1 4.05Å; C196-I237 HydrophobicContact CB-CB 4.08Å; C196-I237 HydrophobicContact CB-CG2 3.79Å; Q197-I237 HydrophobicContact CB-CG2 4.03Å; L232-I237 HydrophobicContact CB-CG1 4.08Å; L232-I237 HydrophobicContact CD1-CG1 4.36Å; A233-I237 PolarHBondContact O-N 2.99Å; C234-I237 PolarHBondContact O-N 3.07Å; I237-T239 PolarHBondContact O-N 2.98Å; I237-L240 PolarHBondContact O-N 3.21Å; I237-Q241 HydrophobicContact CG2-CG 4.33Å; I237-Q241 VanDerWaalsContact O-CG 3.3Å; I237-Q241 WeakPolarHBondContact O-CG 3.41Å; I237-Q241 PolarHBondContact O-N 3.41Å |
| 238 | A | 98.2 | Very high | 97.8 | Very high | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -58.8 | -37.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | C234 L235 H236 Q241 K242 N243 L246 M247 L250 | C234-A238 WeakPolarHBondContact O-CB 3.44Å; C234-A238 PolarHBondContact O-N 3.28Å; L235-A238 PolarHBondContact O-N 3.37Å; H236-A238 PolarHBondContact O-N 2.89Å; A238-Q241 PolarHBondContact O-N 2.99Å; A238-K242 PolarHBondContact O-N 3.11Å; A238-N243 PolarHBondContact O-N 3.07Å; A238-L246 HydrophobicContact CB-CB 4.38Å; A238-L246 HydrophobicContact CB-CD2 3.63Å; A238-L246 HydrophobicContact CB-CG 4Å; A238-M247 HydrophobicContact CB-CG 3.7Å; A238-L250 HydrophobicContact CB-CD1 3.85Å |
| 239 | T | 98.2 | Very high | 97.8 | Very high | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -66 | -47.1 | 175.7 | -54.3 | 0 | 0 | 0 | 0 | 111.8 | L235 H236 I237 Q241 K242 M247 A268 L271 A272 | L235-T239 WeakPolarHBondContact O-CB 3.37Å; L235-T239 PolarHBondContact O-N 3.06Å; L235-T239 PolarHBondContact O-OG1 3.21Å; H236-T239 WeakPolarHBondContact O-CB 3.39Å; H236-T239 PolarHBondContact O-N 3.46Å; I237-T239 PolarHBondContact O-N 2.98Å; T239-Q241 VanDerWaalsContact C-N 3.25Å; T239-Q241 PolarHBondContact O-N 3.13Å; T239-K242 WeakPolarHBondContact O-CA 3.33Å; T239-K242 PolarHBondContact O-N 3.28Å; T239-M247 HydrophobicContact CG2-CE 4.2Å; T239-M247 WeakPolarHBondContact OG1-CE 3.36Å; T239-A268 WeakPolarHBondContact CG2-O 3.49Å; T239-L271 HydrophobicContact CG2-CB 3.94Å; T239-A272 HydrophobicContact CG2-CB 4.02Å |
| 240 | L | 97.9 | Very high | 97.8 | Very high | 74 Ų | 74 | 30.5 Ų | 30.5 | 39% | 0.387 | 15% | 0.153 | S | C | . | . | H | α-helix | trans | -62.1 | -33.8 | 176.9 | -71.9 | 170.3 | 0 | 0 | 0 | 112.3 | L232 H236 I237 K242 L271 | L232-L240 HydrophobicContact CD1-CD1 4.14Å; H236-L240 WeakPolarHBondContact O-CG 3.24Å; H236-L240 PolarHBondContact O-N 3.02Å; I237-L240 PolarHBondContact O-N 3.21Å; L240-K242 PolarHBondContact O-N 3.11Å; L240-L271 HydrophobicContact CD2-CB 4.44Å; L240-L271 HydrophobicContact CD2-CD2 4.25Å; L240-L271 HydrophobicContact CG-CD1 4.25Å |
| 241 | Q | 97.7 | Very high | 97.7 | Very high | 69 Ų | 69 | 26.4 Ų | 26.4 | 32% | 0.322 | 14% | 0.135 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -77 | -1.6 | 174.1 | -65.6 | -56.1 | -37.4 | 0 | 0 | 113.8 | Q199 I237 A238 T239 N243 | Q199-Q241 HydrophobicContact CG-CB 4.05Å; Q199-Q241 HydrophobicContact CG-CG 4.23Å; I237-Q241 HydrophobicContact CG2-CG 4.33Å; I237-Q241 VanDerWaalsContact O-CG 3.3Å; I237-Q241 WeakPolarHBondContact O-CG 3.41Å; I237-Q241 PolarHBondContact O-N 3.41Å; A238-Q241 PolarHBondContact O-N 2.99Å; T239-Q241 VanDerWaalsContact C-N 3.25Å; T239-Q241 PolarHBondContact O-N 3.13Å; Q241-N243 HydrophobicContact CB-CB 4.38Å; Q241-N243 PolarHBondContact O-N 2.85Å; Q241-N243 VanDerWaalsContact O-N 3.17Å |
| 242 | K | 97.4 | Very high | 97.6 | Very high | 98 Ų | 98 | 32.6 Ų | 32.6 | 43% | 0.426 | 16% | 0.161 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 56.2 | 27.3 | -177 | -54.7 | 174.3 | 169.8 | -165.1 | 0 | 113.6 | A238 T239 L240 Q244 T275 E277 L280 | A238-K242 PolarHBondContact O-N 3.11Å; T239-K242 WeakPolarHBondContact O-CA 3.33Å; T239-K242 PolarHBondContact O-N 3.28Å; L240-K242 PolarHBondContact O-N 3.11Å; K242-Q244 PolarHBondContact O-N 3.11Å; K242-T275 HydrophobicContact CG-CG2 4.38Å; K242-T275 PolarHBondContact NZ-O 3.23Å; K242-E277 HydrophobicContact CD-CG 3.62Å; K242-E277 VanDerWaalsContact CE-CG 3.48Å; K242-E277 HydrophobicContact CG-CG 3.98Å; K242-E277 IonicContact NZ-OE1 2.72Å; K242-E277 PolarHBondContact NZ-OE1 3.17Å; K242-L280 HydrophobicContact CB-CD1 3.88Å; K242-L280 HydrophobicContact CG-CD1 4.03Å |
| 243 | N | 96.6 | Very high | 97.3 | Very high | 21 Ų | 21 | 35 Ų | 35 | 11% | 0.112 | 17% | 0.174 | C | C | . | . | trans | -97.4 | 84.5 | -172.6 | -170.3 | -30 | 0 | 0 | 0 | 110.9 | Q199 A238 Q241 P245 L246 M247 | Q199-N243 WeakPolarHBondContact CB-ND2 3.4Å; A238-N243 PolarHBondContact O-N 3.07Å; Q241-N243 HydrophobicContact CB-CB 4.38Å; Q241-N243 PolarHBondContact O-N 2.85Å; Q241-N243 VanDerWaalsContact O-N 3.17Å; N243-P245 VanDerWaalsContact OD1-CD 3.29Å; N243-P245 WeakPolarHBondContact OD1-CD 3.32Å; N243-L246 HydrophobicContact CB-CB 4.07Å; N243-L246 PolarHBondContact O-N 3.21Å; N243-L246 WeakPolarHBondContact OD1-CB 3.44Å; N243-L246 PolarHBondContact OD1-N 3.32Å; N243-L246 VanDerWaalsContact OD1-N 3.11Å; N243-M247 WeakPolarHBondContact O-CG 3.34Å; N243-M247 PolarHBondContact O-N 3.22Å | ||
| 244 | Q | 97.1 | Very high | 97.1 | Very high | 71 Ų | 71 | 37.9 Ų | 37.9 | 33% | 0.332 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -56.9 | -44.8 | 179.8 | -174.3 | -174.4 | -38.5 | 0 | 0 | 113.7 | K242 L246 M247 E248 L280 F283 | K242-Q244 PolarHBondContact O-N 3.11Å; Q244-L246 PolarHBondContact O-N 3.09Å; Q244-M247 WeakPolarHBondContact O-CB 3.4Å; Q244-M247 PolarHBondContact O-N 3.21Å; Q244-M247 VanDerWaalsContact O-N 3.1Å; Q244-E248 HydrophobicContact CG-CG 4.37Å; Q244-E248 PolarHBondContact NE2-OE1 3.05Å; Q244-E248 WeakPolarHBondContact O-CG 3.48Å; Q244-E248 PolarHBondContact O-N 2.89Å; Q244-L280 HydrophobicContact CB-CD2 3.97Å; Q244-F283 HydrophobicContact CG-CD1 4.18Å; Q244-F283 HydrophobicContact CG-CD2 3.88Å; Q244-F283 HydrophobicContact CG-CE1 4.38Å; Q244-F283 HydrophobicContact CG-CE2 4.09Å; Q244-F283 HydrophobicContact CG-CG 3.93Å; Q244-F283 HydrophobicContact CG-CZ 4.34Å |
| 245 | P | 97.9 | Very high | 97 | Very high | 63 Ų | 63 | 38.2 Ų | 38.2 | 41% | 0.409 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -56.6 | -35.4 | 177.1 | -27.7 | 34.4 | 0 | 0 | 0 | 114.2 | L201 N243 L249 | L201-P245 HydrophobicContact CD1-CB 4.5Å; L201-P245 HydrophobicContact CD2-CB 4.06Å; N243-P245 VanDerWaalsContact OD1-CD 3.29Å; N243-P245 WeakPolarHBondContact OD1-CD 3.32Å; P245-L249 WeakPolarHBondContact O-CB 3.35Å; P245-L249 PolarHBondContact O-N 3.05Å; P245-L249 VanDerWaalsContact O-N 3.11Å |
| 246 | L | 97.6 | Very high | 96.9 | Very high | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -74.9 | -39.6 | 177.1 | -174.9 | 72.9 | 0 | 0 | 0 | 111.6 | C196 L201 A204 A238 N243 Q244 L249 L250 | C196-L246 VanDerWaalsContact CA-CD2 3.48Å; C196-L246 HydrophobicContact CB-CD2 3.75Å; L201-L246 HydrophobicContact CD1-CB 4.32Å; L201-L246 HydrophobicContact CD1-CD1 4.04Å; A204-L246 HydrophobicContact CB-CD1 3.53Å; A238-L246 HydrophobicContact CB-CB 4.38Å; A238-L246 HydrophobicContact CB-CD2 3.63Å; A238-L246 HydrophobicContact CB-CG 4Å; N243-L246 HydrophobicContact CB-CB 4.07Å; N243-L246 PolarHBondContact O-N 3.21Å; N243-L246 WeakPolarHBondContact OD1-CB 3.44Å; N243-L246 PolarHBondContact OD1-N 3.32Å; N243-L246 VanDerWaalsContact OD1-N 3.11Å; Q244-L246 PolarHBondContact O-N 3.09Å; L246-L249 WeakPolarHBondContact O-CB 3.47Å; L246-L249 PolarHBondContact O-N 3.01Å; L246-L250 HydrophobicContact CG-CD1 4.47Å; L246-L250 VanDerWaalsContact O-CG 3.32Å; L246-L250 WeakPolarHBondContact O-CG 3.32Å; L246-L250 PolarHBondContact O-N 2.9Å |
| 247 | M | 98.1 | Very high | 96.9 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -59.8 | -46.2 | 172.4 | -63.8 | 169.5 | 68.2 | 0 | 0 | 111.2 | L235 A238 T239 N243 Q244 L249 L250 L251 L280 F283 L284 | L235-M247 HydrophobicContact CD1-CB 4.19Å; L235-M247 HydrophobicContact CD1-CG 4.26Å; A238-M247 HydrophobicContact CB-CG 3.7Å; T239-M247 HydrophobicContact CG2-CE 4.2Å; T239-M247 WeakPolarHBondContact OG1-CE 3.36Å; N243-M247 WeakPolarHBondContact O-CG 3.34Å; N243-M247 PolarHBondContact O-N 3.22Å; Q244-M247 WeakPolarHBondContact O-CB 3.4Å; Q244-M247 PolarHBondContact O-N 3.21Å; Q244-M247 VanDerWaalsContact O-N 3.1Å; M247-L249 VanDerWaalsContact C-N 3.31Å; M247-L249 PolarHBondContact O-N 3.35Å; M247-L250 PolarHBondContact O-N 3.17Å; M247-L251 VanDerWaalsContact O-CG 3.32Å; M247-L251 WeakPolarHBondContact O-CG 3.49Å; M247-L251 PolarHBondContact O-N 3.46Å; M247-L280 HydrophobicContact SD-CD2 4Å; M247-F283 HydrophobicContact CB-CE1 3.86Å; M247-F283 HydrophobicContact CB-CZ 4.43Å; M247-F283 HydrophobicContact CE-CD1 4.01Å; M247-F283 HydrophobicContact CE-CE1 3.99Å; M247-L284 HydrophobicContact CE-CD1 3.92Å; M247-L284 HydrophobicContact CE-CD2 3.55Å; M247-L284 HydrophobicContact CE-CG 3.75Å |
| 248 | E | 97.6 | Very high | 96.9 | Very high | 68 Ų | 68 | 44.8 Ų | 44.8 | 32% | 0.318 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -55.7 | -46.5 | 174.5 | -76.3 | 174.3 | -165.9 | 0 | 0 | 111.6 | Q244 L250 L251 Q252 F283 | Q244-E248 HydrophobicContact CG-CG 4.37Å; Q244-E248 PolarHBondContact NE2-OE1 3.05Å; Q244-E248 WeakPolarHBondContact O-CG 3.48Å; Q244-E248 PolarHBondContact O-N 2.89Å; E248-L250 PolarHBondContact O-N 3.48Å; E248-L251 PolarHBondContact O-N 3.35Å; E248-Q252 WeakPolarHBondContact O-CB 3.4Å; E248-Q252 WeakPolarHBondContact O-CG 3.46Å; E248-Q252 PolarHBondContact O-N 3.47Å; E248-F283 HydrophobicContact CB-CZ 4.35Å; E248-F283 HydrophobicContact CG-CD2 4.48Å; E248-F283 HydrophobicContact CG-CE2 3.35Å; E248-F283 HydrophobicContact CG-CZ 3.39Å |
| 249 | L | 96.9 | Very high | 96.9 | Very high | 7 Ų | 7 | 45.6 Ų | 45.6 | 4% | 0.037 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -61.2 | -43.8 | 178.5 | -178.7 | 68 | 0 | 0 | 0 | 112 | L201 A204 R205 L208 P245 L246 M247 N253 | L201-L249 HydrophobicContact CD1-CB 4.44Å; L201-L249 HydrophobicContact CD1-CD2 3.86Å; A204-L249 HydrophobicContact CB-CD2 4Å; R205-L249 HydrophobicContact CB-CD2 4.38Å; R205-L249 HydrophobicContact CG-CD1 3.91Å; R205-L249 HydrophobicContact CG-CD2 3.51Å; R205-L249 HydrophobicContact CG-CG 4.38Å; L208-L249 HydrophobicContact CD1-CD1 4.34Å; L208-L249 HydrophobicContact CD1-CD2 3.76Å; L208-L249 HydrophobicContact CD1-CG 3.61Å; P245-L249 WeakPolarHBondContact O-CB 3.35Å; P245-L249 PolarHBondContact O-N 3.05Å; P245-L249 VanDerWaalsContact O-N 3.11Å; L246-L249 WeakPolarHBondContact O-CB 3.47Å; L246-L249 PolarHBondContact O-N 3.01Å; M247-L249 VanDerWaalsContact C-N 3.31Å; M247-L249 PolarHBondContact O-N 3.35Å; L249-N253 PolarHBondContact O-N 3.3Å; L249-N253 PolarHBondContact O-ND2 3.23Å |
| 250 | L | 97 | Very high | 96.9 | Very high | 0 Ų | 0 | 49.7 Ų | 49.7 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -65 | -47.2 | 179 | -69.8 | 168 | 0 | 0 | 0 | 111.6 | L192 L208 C234 A238 L246 M247 E248 Q252 N253 G254 A255 | L192-L250 HydrophobicContact CD2-CD2 3.9Å; L192-L250 HydrophobicContact CG-CD2 4.46Å; L208-L250 HydrophobicContact CD1-CD2 4.28Å; C234-L250 HydrophobicContact CB-CD1 4.03Å; C234-L250 HydrophobicContact CB-CD2 3.97Å; A238-L250 HydrophobicContact CB-CD1 3.85Å; L246-L250 HydrophobicContact CG-CD1 4.47Å; L246-L250 VanDerWaalsContact O-CG 3.32Å; L246-L250 WeakPolarHBondContact O-CG 3.32Å; L246-L250 PolarHBondContact O-N 2.9Å; M247-L250 PolarHBondContact O-N 3.17Å; E248-L250 PolarHBondContact O-N 3.48Å; L250-Q252 PolarHBondContact O-N 2.94Å; L250-N253 CarbonylContact O-C 3.58Å; L250-N253 PolarHBondContact O-N 2.92Å; L250-N253 VanDerWaalsContact O-N 3.1Å; L250-G254 PolarHBondContact O-N 3.45Å; L250-A255 HydrophobicContact CB-CB 3.98Å; L250-A255 VanDerWaalsContact O-CB 3.27Å; L250-A255 WeakPolarHBondContact O-CB 3.41Å; L250-A255 PolarHBondContact O-N 2.89Å |
| 251 | L | 96.2 | Very high | 96.8 | Very high | 37 Ų | 37 | 46.5 Ų | 46.5 | 19% | 0.194 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -63 | -41.3 | 179 | -67.7 | 173 | 0 | 0 | 0 | 111.8 | L235 M247 E248 N253 G254 I257 F283 A287 | L235-L251 HydrophobicContact CD1-CD2 4.26Å; L235-L251 HydrophobicContact CD1-CG 4.24Å; L235-L251 HydrophobicContact CD2-CD2 3.97Å; M247-L251 VanDerWaalsContact O-CG 3.32Å; M247-L251 WeakPolarHBondContact O-CG 3.49Å; M247-L251 PolarHBondContact O-N 3.46Å; E248-L251 PolarHBondContact O-N 3.35Å; L251-N253 PolarHBondContact O-N 3.5Å; L251-G254 PolarHBondContact O-N 2.97Å; L251-I257 HydrophobicContact CD1-CD1 4.23Å; L251-I257 HydrophobicContact CD2-CB 3.83Å; L251-I257 HydrophobicContact CD2-CD1 4.21Å; L251-I257 HydrophobicContact CD2-CG1 4.03Å; L251-F283 HydrophobicContact CD1-CE1 3.93Å; L251-F283 HydrophobicContact CD1-CZ 3.92Å; L251-A287 HydrophobicContact CD1-CB 4.06Å |
| 252 | Q | 94.8 | Very high | 96.7 | Very high | 140 Ų | 140 | 45.6 Ų | 45.6 | 65% | 0.654 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -61.7 | -26.2 | 174.8 | -74.9 | 169.3 | 12.7 | 0 | 0 | 113.2 | E248 L250 G254 | E248-Q252 WeakPolarHBondContact O-CB 3.4Å; E248-Q252 WeakPolarHBondContact O-CG 3.46Å; E248-Q252 PolarHBondContact O-N 3.47Å; L250-Q252 PolarHBondContact O-N 2.94Å; Q252-G254 VanDerWaalsContact C-N 3.35Å |
| 253 | N | 93 | Very high | 96.7 | Very high | 73 Ų | 73 | 45.8 Ų | 45.8 | 39% | 0.39 | 27% | 0.268 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.9 | 12.5 | 177.3 | -75.5 | -88.9 | 0 | 0 | 0 | 113 | L208 L224 L249 L250 L251 | L208-N253 HydrophobicContact CD1-CB 4.43Å; L208-N253 HydrophobicContact CD2-CB 4.1Å; L224-N253 HydrophobicContact CD1-CB 4.08Å; L224-N253 VanDerWaalsContact CD1-O 3.25Å; L224-N253 WeakPolarHBondContact CD1-O 3.39Å; L249-N253 PolarHBondContact O-N 3.3Å; L249-N253 PolarHBondContact O-ND2 3.23Å; L250-N253 CarbonylContact O-C 3.58Å; L250-N253 PolarHBondContact O-N 2.92Å; L250-N253 VanDerWaalsContact O-N 3.1Å; L251-N253 PolarHBondContact O-N 3.5Å |
| 254 | G | 92.7 | Very high | 96.7 | Very high | 60 Ų | 60 | 46.2 Ų | 46.2 | 62% | 0.619 | 27% | 0.272 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 87.7 | 24.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | L250 L251 Q252 D256 | L250-G254 PolarHBondContact O-N 3.45Å; L251-G254 PolarHBondContact O-N 2.97Å; Q252-G254 VanDerWaalsContact C-N 3.35Å; G254-D256 PolarHBondContact O-N 2.71Å |
| 255 | A | 95.9 | Very high | 96.7 | Very high | 10 Ų | 10 | 42.9 Ų | 42.9 | 8% | 0.083 | 26% | 0.257 | C | S | . | . | trans | -63.2 | 130.4 | 166.1 | 0 | 0 | 0 | 0 | 0 | 109.7 | L224 L250 I257 | L224-A255 HydrophobicContact CB-CB 4.24Å; L224-A255 HydrophobicContact CD1-CB 4.08Å; L250-A255 HydrophobicContact CB-CB 3.98Å; L250-A255 VanDerWaalsContact O-CB 3.27Å; L250-A255 WeakPolarHBondContact O-CB 3.41Å; L250-A255 PolarHBondContact O-N 2.89Å; A255-I257 PolarHBondContact O-N 3.35Å | ||
| 256 | D | 97.4 | Very high | 96.7 | Very high | 82 Ų | 82 | 41.5 Ų | 41.5 | 44% | 0.439 | 24% | 0.244 | S | C | . | . | trans | -65.5 | 124.4 | 171.4 | -175.3 | -0.4 | 0 | 0 | 0 | 109.2 | Q225 L235 G254 D258 V259 | Q225-D256 HydrophobicContact CG-CB 4.32Å; L235-D256 WeakPolarHBondContact CD2-O 3.41Å; G254-D256 PolarHBondContact O-N 2.71Å; D256-D258 VanDerWaalsContact C-N 3.3Å; D256-D258 PolarHBondContact OD1-N 3.19Å; D256-V259 HydrophobicContact CB-CB 4.29Å; D256-V259 VanDerWaalsContact O-CG1 3.3Å; D256-V259 WeakPolarHBondContact O-CG1 3.36Å | ||
| 257 | I | 98.1 | Very high | 96.8 | Very high | 21 Ų | 21 | 41.6 Ų | 41.6 | 11% | 0.108 | 25% | 0.245 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -74.1 | -25.8 | -177.5 | -167.1 | 162.3 | 0 | 0 | 0 | 112.3 | L251 A255 L284 A287 A289 | L251-I257 HydrophobicContact CD1-CD1 4.23Å; L251-I257 HydrophobicContact CD2-CB 3.83Å; L251-I257 HydrophobicContact CD2-CD1 4.21Å; L251-I257 HydrophobicContact CD2-CG1 4.03Å; A255-I257 PolarHBondContact O-N 3.35Å; I257-L284 HydrophobicContact CD1-CD2 4.04Å; I257-L284 HydrophobicContact CG1-CD2 4.07Å; I257-A287 HydrophobicContact CD1-CB 3.59Å; I257-A289 HydrophobicContact CD1-CB 3.76Å; I257-A289 HydrophobicContact CG1-CB 3.86Å |
| 258 | D | 98.1 | Very high | 96.8 | Very high | 47 Ų | 47 | 41.6 Ų | 41.6 | 25% | 0.251 | 25% | 0.245 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -106.4 | 13.6 | -175.6 | -66.1 | -42.8 | 0 | 0 | 0 | 112.5 | D256 Q260 T267 Q290 | D256-D258 VanDerWaalsContact C-N 3.3Å; D256-D258 PolarHBondContact OD1-N 3.19Å; D258-Q260 PolarHBondContact O-N 3.44Å; D258-T267 WeakPolarHBondContact O-CG2 3.36Å; D258-Q290 PolarHBondContact OD1-N 3.35Å; D258-Q290 WeakPolarHBondContact OD2-CB 3.48Å; D258-Q290 PolarHBondContact OD2-N 2.98Å |
| 259 | V | 97.9 | Very high | 96.8 | Very high | 16 Ų | 16 | 38.3 Ų | 38.3 | 10% | 0.097 | 23% | 0.23 | C | C | . | . | P | Polyproline II helix | trans | -52.3 | 136 | 169.9 | 64.1 | 0 | 0 | 0 | 0 | 110 | Q225 A233 H236 D256 T267 | Q225-V259 VanDerWaalsContact OE1-CB 3.22Å; A233-V259 HydrophobicContact CB-CG1 4.47Å; A233-V259 HydrophobicContact CB-CG2 4.46Å; H236-V259 PolarHBondContact NE2-O 2.95Å; D256-V259 HydrophobicContact CB-CB 4.29Å; D256-V259 VanDerWaalsContact O-CG1 3.3Å; D256-V259 WeakPolarHBondContact O-CG1 3.36Å; V259-T267 WeakPolarHBondContact O-CA 3.35Å |
| 260 | Q | 98.3 | Very high | 96.9 | Very high | 87 Ų | 87 | 38 Ų | 38 | 41% | 0.407 | 23% | 0.228 | S | C | . | . | P | Polyproline II helix | trans | -101.1 | 130.1 | -179.9 | -69.6 | -172 | -28.9 | 0 | 0 | 110.3 | Q227 D258 T267 R294 | Q227-Q260 PolarHBondContact NE2-O 3.37Å; D258-Q260 PolarHBondContact O-N 3.44Å; Q260-T267 HydrophobicContact CG-CG2 3.98Å; Q260-R294 PolarHBondContact NE2-O 3.11Å |
| 261 | E | 97.6 | Very high | 96.9 | Very high | 7 Ų | 7 | 38.3 Ų | 38.3 | 3% | 0.033 | 23% | 0.23 | C | C | . | . | P | Polyproline II helix | trans | -69.8 | 149.9 | 171.9 | 64.4 | 72.9 | -148.9 | 0 | 0 | 112.3 | G231 L232 H236 T263 S264 G265 K266 | G231-E261 CarbonylContact O-C 3.52Å; G231-E261 WeakPolarHBondContact O-CA 3.25Å; G231-E261 VanDerWaalsContact O-CB 3.25Å; G231-E261 WeakPolarHBondContact O-CB 3.18Å; L232-E261 HydrophobicContact CD2-CB 3.86Å; L232-E261 HydrophobicContact CD2-CG 4.31Å; H236-E261 PolarHBondContact CE1-N 2.86Å; H236-E261 VanDerWaalsContact CE1-N 3.32Å; E261-T263 VanDerWaalsContact C-N 3.34Å; E261-T263 VanDerWaalsContact CD-OG1 3.31Å; E261-T263 PolarHBondContact O-N 2.87Å; E261-T263 PolarHBondContact OE1-OG1 3.29Å; E261-T263 WeakPolarHBondContact OE2-CA 3.36Å; E261-T263 VanDerWaalsContact OE2-CB 3.28Å; E261-T263 WeakPolarHBondContact OE2-CB 3.5Å; E261-T263 PolarHBondContact OE2-N 2.95Å; E261-T263 PolarHBondContact OE2-OG1 2.85Å; E261-S264 VanDerWaalsContact OE1-CA 3.22Å; E261-S264 WeakPolarHBondContact OE1-CA 3.37Å; E261-S264 WeakPolarHBondContact OE1-CB 3.22Å; E261-S264 PolarHBondContact OE1-N 3.05Å; E261-S264 PolarHBondContact OE1-OG 3.41Å; E261-S264 PolarHBondContact OE2-N 2.76Å; E261-G265 VanDerWaalsContact O-CA 3.25Å; E261-G265 WeakPolarHBondContact O-CA 3.48Å; E261-G265 PolarHBondContact O-N 3.04Å; E261-G265 PolarHBondContact OE1-N 3.42Å; E261-K266 HydrophobicContact CG-CB 3.78Å; E261-K266 WeakPolarHBondContact CG-O 3.28Å; E261-K266 PolarHBondContact N-O 3.1Å; E261-K266 PolarHBondContact OE1-N 2.58Å; E261-K266 VanDerWaalsContact OE1-N 3.1Å |
| 262 | G | 95.3 | Very high | 97 | Very high | 50 Ų | 50 | 36.6 Ų | 36.6 | 52% | 0.515 | 22% | 0.22 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -71.5 | -14.9 | -166 | 0 | 0 | 0 | 0 | 0 | 116.9 | G231 | G231-G262 PolarHBondContact O-N 3.41Š|
| 263 | T | 96.1 | Very high | 97.2 | Very high | 102 Ų | 102 | 29.9 Ų | 29.9 | 63% | 0.626 | 19% | 0.189 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -90.9 | -46.1 | -173.5 | 69.2 | 0 | 0 | 0 | 0 | 113.8 | Q230 E261 | Q230-T263 WeakPolarHBondContact O-CG2 3.41Å; E261-T263 VanDerWaalsContact C-N 3.34Å; E261-T263 VanDerWaalsContact CD-OG1 3.31Å; E261-T263 PolarHBondContact O-N 2.87Å; E261-T263 PolarHBondContact OE1-OG1 3.29Å; E261-T263 WeakPolarHBondContact OE2-CA 3.36Å; E261-T263 VanDerWaalsContact OE2-CB 3.28Å; E261-T263 WeakPolarHBondContact OE2-CB 3.5Å; E261-T263 PolarHBondContact OE2-N 2.95Å; E261-T263 PolarHBondContact OE2-OG1 2.85Å |
| 264 | S | 96.4 | Very high | 97.3 | Very high | 29 Ų | 29 | 28.5 Ų | 28.5 | 20% | 0.203 | 18% | 0.18 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -130.1 | 1.6 | -176.1 | 66.9 | 0 | 0 | 0 | 0 | 113.5 | E261 K266 M295 L296 | E261-S264 VanDerWaalsContact OE1-CA 3.22Å; E261-S264 WeakPolarHBondContact OE1-CA 3.37Å; E261-S264 WeakPolarHBondContact OE1-CB 3.22Å; E261-S264 PolarHBondContact OE1-N 3.05Å; E261-S264 PolarHBondContact OE1-OG 3.41Å; E261-S264 PolarHBondContact OE2-N 2.76Å; S264-K266 VanDerWaalsContact C-N 3.29Å; S264-K266 VanDerWaalsContact OG-CD 3.3Å; S264-K266 WeakPolarHBondContact OG-CD 3.22Å; S264-K266 VanDerWaalsContact OG-CE 3.28Å; S264-K266 WeakPolarHBondContact OG-CE 3.41Å; S264-K266 VanDerWaalsContact OG-CG 3.3Å; S264-K266 WeakPolarHBondContact OG-CG 3.36Å; S264-M295 WeakPolarHBondContact O-CB 3.24Å; S264-L296 WeakPolarHBondContact O-CG 3.48Å; S264-L296 PolarHBondContact O-N 3.47Å |
| 265 | G | 97.6 | Very high | 97.5 | Very high | 1 Ų | 1 | 26.7 Ų | 26.7 | 1% | 0.01 | 16% | 0.157 | C | C | . | . | trans | 71.5 | 23.4 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | E261 | E261-G265 VanDerWaalsContact O-CA 3.25Å; E261-G265 WeakPolarHBondContact O-CA 3.48Å; E261-G265 PolarHBondContact O-N 3.04Å; E261-G265 PolarHBondContact OE1-N 3.42Å | ||
| 266 | K | 98.4 | Very high | 97.4 | Very high | 35 Ų | 35 | 32 Ų | 32 | 15% | 0.152 | 18% | 0.18 | C | C | . | . | trans | -70.1 | 135.6 | 177.3 | -74.1 | 170.1 | -174.7 | 174.7 | 0 | 110.4 | H236 E261 S264 H270 L271 E274 M295 | H236-K266 PolarHBondContact NE2-O 2.8Å; E261-K266 HydrophobicContact CG-CB 3.78Å; E261-K266 WeakPolarHBondContact CG-O 3.28Å; E261-K266 PolarHBondContact N-O 3.1Å; E261-K266 PolarHBondContact OE1-N 2.58Å; E261-K266 VanDerWaalsContact OE1-N 3.1Å; S264-K266 VanDerWaalsContact C-N 3.29Å; S264-K266 VanDerWaalsContact OG-CD 3.3Å; S264-K266 WeakPolarHBondContact OG-CD 3.22Å; S264-K266 VanDerWaalsContact OG-CE 3.28Å; S264-K266 WeakPolarHBondContact OG-CE 3.41Å; S264-K266 VanDerWaalsContact OG-CG 3.3Å; S264-K266 WeakPolarHBondContact OG-CG 3.36Å; K266-H270 HydrophobicContact CB-CB 3.83Å; K266-H270 HydrophobicContact CG-CB 3.87Å; K266-L271 HydrophobicContact CB-CD2 4.1Å; K266-L271 HydrophobicContact CB-CG 4.33Å; K266-L271 HydrophobicContact CD-CD2 3.79Å; K266-E274 WeakPolarHBondContact CE-OE1 3.49Å; K266-E274 IonicContact NZ-OE1 2.68Å; K266-E274 PolarHBondContact NZ-OE1 3.27Å; K266-E274 IonicContact NZ-OE2 3.97Å; K266-E274 PolarHBondContact NZ-OE2 3.07Å; K266-M295 HydrophobicContact CD-CE 4.3Å; K266-M295 HydrophobicContact CD-SD 4.46Å; K266-M295 HydrophobicContact CG-CE 3.76Å; K266-M295 HydrophobicContact CG-CG 3.87Å; K266-M295 HydrophobicContact CG-SD 3.66Å | ||
| 267 | T | 98.5 | Very high | 97.2 | Very high | 1 Ų | 1 | 31.9 Ų | 31.9 | 1% | 0.006 | 18% | 0.177 | C | C | . | . | trans | -86.7 | 171.5 | 166.5 | 65.7 | 0 | 0 | 0 | 0 | 110.8 | D258 V259 Q260 L269 H270 L271 A293 | D258-T267 WeakPolarHBondContact O-CG2 3.36Å; V259-T267 WeakPolarHBondContact O-CA 3.35Å; Q260-T267 HydrophobicContact CG-CG2 3.98Å; T267-L269 PolarHBondContact O-N 3.37Å; T267-L269 VanDerWaalsContact O-N 3.17Å; T267-L269 PolarHBondContact OG1-N 2.56Å; T267-H270 PolarHBondContact N-ND1 3.46Å; T267-H270 WeakPolarHBondContact O-CB 3.21Å; T267-H270 PolarHBondContact O-N 3.24Å; T267-H270 PolarHBondContact OG1-ND1 2.71Å; T267-L271 PolarHBondContact O-N 3.38Å; T267-L271 VanDerWaalsContact O-N 3.12Å; T267-A293 HydrophobicContact CG2-CB 3.86Å | ||
| 268 | A | 98.3 | Very high | 97.1 | Very high | 0 Ų | 0 | 36.8 Ų | 36.8 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -52.1 | -37 | 171.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | L235 T239 H270 L271 A272 L284 | L235-A268 HydrophobicContact CD2-CB 3.92Å; L235-A268 HydrophobicContact CG-CB 4Å; T239-A268 WeakPolarHBondContact CG2-O 3.49Å; A268-H270 PolarHBondContact O-N 2.89Å; A268-L271 PolarHBondContact O-N 3.07Å; A268-A272 WeakPolarHBondContact O-CB 3.21Å; A268-A272 PolarHBondContact O-N 3.44Å; A268-L284 VanDerWaalsContact C-CD1 3.47Å; A268-L284 HydrophobicContact CB-CD1 3.94Å; A268-L284 HydrophobicContact CB-CD2 4.1Å; A268-L284 WeakPolarHBondContact O-CD1 3.4Å |
| 269 | L | 98.6 | Very high | 97.1 | Very high | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -64.8 | -39.9 | 178.6 | -174.8 | 59.4 | 0 | 0 | 0 | 112.3 | T267 A272 V273 V281 L284 L285 A289 P301 L317 | T267-L269 PolarHBondContact O-N 3.37Å; T267-L269 VanDerWaalsContact O-N 3.17Å; T267-L269 PolarHBondContact OG1-N 2.56Å; L269-A272 PolarHBondContact O-N 2.81Å; L269-V273 WeakPolarHBondContact O-CG2 3.47Å; L269-V273 PolarHBondContact O-N 3.47Å; L269-V281 HydrophobicContact CD1-CG1 4.04Å; L269-L284 HydrophobicContact CB-CD1 4.46Å; L269-L284 HydrophobicContact CD1-CB 4.12Å; L269-L284 HydrophobicContact CD1-CD1 4.49Å; L269-L285 HydrophobicContact CD1-CD2 4.23Å; L269-L285 HydrophobicContact CD1-CG 4.1Å; L269-L285 HydrophobicContact CD2-CD2 3.82Å; L269-A289 HydrophobicContact CB-CB 4.34Å; L269-A289 HydrophobicContact CD2-CB 4.23Å; L269-P301 HydrophobicContact CB-CG 4.39Å; L269-P301 HydrophobicContact CD2-CB 4.33Å; L269-P301 HydrophobicContact CD2-CG 3.81Å; L269-P301 HydrophobicContact CG-CB 4.12Å; L269-P301 HydrophobicContact CG-CG 3.84Å; L269-L317 HydrophobicContact CD1-CD2 4.44Å; L269-L317 HydrophobicContact CD2-CD2 4.4Å |
| 270 | H | 98.6 | Very high | 97.1 | Very high | 0 Ų | 0 | 36.1 Ų | 36.1 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -62.4 | -48.5 | 173.8 | -66.6 | 88.2 | 0 | 0 | 0 | 111.1 | K266 T267 A268 A272 V273 E274 A293 C299 P301 L304 | K266-H270 HydrophobicContact CB-CB 3.83Å; K266-H270 HydrophobicContact CG-CB 3.87Å; T267-H270 PolarHBondContact N-ND1 3.46Å; T267-H270 WeakPolarHBondContact O-CB 3.21Å; T267-H270 PolarHBondContact O-N 3.24Å; T267-H270 PolarHBondContact OG1-ND1 2.71Å; A268-H270 PolarHBondContact O-N 2.89Å; H270-A272 VanDerWaalsContact C-N 3.3Å; H270-A272 PolarHBondContact O-N 2.94Å; H270-V273 WeakPolarHBondContact O-CB 3.33Å; H270-V273 PolarHBondContact O-N 2.95Å; H270-V273 VanDerWaalsContact O-N 3.12Å; H270-E274 WeakPolarHBondContact O-CG 3.5Å; H270-E274 PolarHBondContact O-N 3.23Å; H270-A293 PolarHBondContact CE1-O 3.31Å; H270-A293 PolarHBondContact NE2-O 3.03Å; H270-C299 PolarHBondContact NE2-O 3.02Å; H270-P301 VanDerWaalsContact NE2-CD 3.3Å; H270-P301 WeakPolarHBondContact NE2-CD 3.4Å; H270-L304 HydrophobicContact CB-CD1 3.89Å |
| 271 | L | 98.3 | Very high | 97.1 | Very high | 7 Ų | 7 | 32 Ų | 32 | 4% | 0.037 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -60.9 | -40 | 179.1 | -61.1 | 178.1 | 0 | 0 | 0 | 111.3 | H236 T239 L240 K266 T267 A268 V273 E274 T275 | H236-L271 HydrophobicContact CB-CD1 3.6Å; T239-L271 HydrophobicContact CG2-CB 3.94Å; L240-L271 HydrophobicContact CD2-CB 4.44Å; L240-L271 HydrophobicContact CD2-CD2 4.25Å; L240-L271 HydrophobicContact CG-CD1 4.25Å; K266-L271 HydrophobicContact CB-CD2 4.1Å; K266-L271 HydrophobicContact CB-CG 4.33Å; K266-L271 HydrophobicContact CD-CD2 3.79Å; T267-L271 PolarHBondContact O-N 3.38Å; T267-L271 VanDerWaalsContact O-N 3.12Å; A268-L271 PolarHBondContact O-N 3.07Å; L271-V273 VanDerWaalsContact C-N 3.31Å; L271-V273 PolarHBondContact O-N 3.1Å; L271-E274 WeakPolarHBondContact O-CA 3.46Å; L271-E274 WeakPolarHBondContact O-CB 3.29Å; L271-E274 PolarHBondContact O-N 3.43Å; L271-T275 WeakPolarHBondContact O-CG2 3.37Å; L271-T275 PolarHBondContact O-N 3.17Å |
| 272 | A | 98.1 | Very high | 97.1 | Very high | 0 Ų | 0 | 34.9 Ų | 34.9 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -59.4 | -40.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | T239 A268 L269 H270 E274 T275 Q276 L280 V281 L284 | T239-A272 HydrophobicContact CG2-CB 4.02Å; A268-A272 WeakPolarHBondContact O-CB 3.21Å; A268-A272 PolarHBondContact O-N 3.44Å; L269-A272 PolarHBondContact O-N 2.81Å; H270-A272 VanDerWaalsContact C-N 3.3Å; H270-A272 PolarHBondContact O-N 2.94Å; A272-E274 VanDerWaalsContact C-N 3.32Å; A272-E274 PolarHBondContact O-N 3.35Å; A272-T275 PolarHBondContact O-N 3.16Å; A272-T275 PolarHBondContact O-OG1 3.05Å; A272-Q276 PolarHBondContact O-N 3.44Å; A272-L280 HydrophobicContact CB-CB 4.06Å; A272-V281 HydrophobicContact CB-CG2 3.91Å; A272-L284 HydrophobicContact CB-CD1 3.7Å |
| 273 | V | 98.1 | Very high | 97.3 | Very high | 0 Ų | 0 | 33.7 Ų | 33.7 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -60.9 | -42.1 | 171.5 | 175.9 | 0 | 0 | 0 | 0 | 110.8 | L269 H270 L271 T275 Q276 V281 P301 L304 A305 L310 I313 L317 | L269-V273 WeakPolarHBondContact O-CG2 3.47Å; L269-V273 PolarHBondContact O-N 3.47Å; H270-V273 WeakPolarHBondContact O-CB 3.33Å; H270-V273 PolarHBondContact O-N 2.95Å; H270-V273 VanDerWaalsContact O-N 3.12Å; L271-V273 VanDerWaalsContact C-N 3.31Å; L271-V273 PolarHBondContact O-N 3.1Å; V273-T275 VanDerWaalsContact C-N 3.31Å; V273-T275 PolarHBondContact O-N 3.26Å; V273-Q276 PolarHBondContact O-N 3.39Å; V273-V281 HydrophobicContact CG2-CG2 4.05Å; V273-P301 HydrophobicContact CG2-CB 4.05Å; V273-L304 HydrophobicContact CG1-CB 4.03Å; V273-A305 HydrophobicContact CG1-CB 3.86Å; V273-L310 HydrophobicContact CG1-CD1 4.04Å; V273-I313 HydrophobicContact CB-CG2 4.47Å; V273-I313 HydrophobicContact CG1-CG2 4.19Å; V273-I313 HydrophobicContact CG2-CG2 3.87Å; V273-L317 HydrophobicContact CG2-CD1 4.15Å |
| 274 | E | 96 | Very high | 97.4 | Very high | 43 Ų | 43 | 28.9 Ų | 28.9 | 20% | 0.201 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -65.3 | -33.7 | 179.5 | -61.4 | -162.8 | 123.2 | 0 | 0 | 113.7 | K266 H270 L271 A272 Q276 L304 R308 | K266-E274 WeakPolarHBondContact CE-OE1 3.49Å; K266-E274 IonicContact NZ-OE1 2.68Å; K266-E274 PolarHBondContact NZ-OE1 3.27Å; K266-E274 IonicContact NZ-OE2 3.97Å; K266-E274 PolarHBondContact NZ-OE2 3.07Å; H270-E274 WeakPolarHBondContact O-CG 3.5Å; H270-E274 PolarHBondContact O-N 3.23Å; L271-E274 WeakPolarHBondContact O-CA 3.46Å; L271-E274 WeakPolarHBondContact O-CB 3.29Å; L271-E274 PolarHBondContact O-N 3.43Å; A272-E274 VanDerWaalsContact C-N 3.32Å; A272-E274 PolarHBondContact O-N 3.35Å; E274-Q276 PolarHBondContact O-N 3.47Å; E274-L304 HydrophobicContact CG-CD1 4.32Å; E274-R308 VanDerWaalsContact CA-NH1 3.25Å; E274-R308 VanDerWaalsContact CB-NH1 3.35Å; E274-R308 PolarHBondContact O-NH1 3.12Å; E274-R308 IonicContact OE1-CZ 3.89Å; E274-R308 IonicContact OE1-NH1 3.4Å; E274-R308 IonicContact OE1-NH2 2.7Å; E274-R308 PolarHBondContact OE1-NH2 3.44Å |
| 275 | T | 95.8 | Very high | 97.5 | Very high | 22 Ų | 22 | 28.9 Ų | 28.9 | 14% | 0.135 | 14% | 0.142 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -70.7 | -9.9 | 174.8 | 70.1 | 0 | 0 | 0 | 0 | 113.8 | K242 L271 A272 V273 E277 | K242-T275 HydrophobicContact CG-CG2 4.38Å; K242-T275 PolarHBondContact NZ-O 3.23Å; L271-T275 WeakPolarHBondContact O-CG2 3.37Å; L271-T275 PolarHBondContact O-N 3.17Å; A272-T275 PolarHBondContact O-N 3.16Å; A272-T275 PolarHBondContact O-OG1 3.05Å; V273-T275 VanDerWaalsContact C-N 3.31Å; V273-T275 PolarHBondContact O-N 3.26Å; T275-E277 PolarHBondContact O-N 3.18Å |
| 276 | Q | 95.1 | Very high | 97.5 | Very high | 122 Ų | 122 | 36.5 Ų | 36.5 | 57% | 0.57 | 18% | 0.178 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 60.7 | 16 | -175.9 | -51.9 | -177 | 12.2 | 0 | 0 | 114.5 | A272 V273 E274 R278 L310 | A272-Q276 PolarHBondContact O-N 3.44Å; V273-Q276 PolarHBondContact O-N 3.39Å; E274-Q276 PolarHBondContact O-N 3.47Å; Q276-R278 PolarHBondContact O-N 3.12Å; Q276-L310 HydrophobicContact CB-CD2 4.41Å; Q276-L310 HydrophobicContact CG-CD1 4.05Å; Q276-L310 HydrophobicContact CG-CD2 3.88Å |
| 277 | E | 92.8 | Very high | 97.4 | Very high | 79 Ų | 79 | 37.2 Ų | 37.2 | 37% | 0.369 | 19% | 0.19 | S | C | . | . | trans | -89.4 | 93.2 | 179.7 | -67 | -59.6 | 152.4 | 0 | 0 | 110.9 | K242 T275 G279 L280 V281 | K242-E277 HydrophobicContact CD-CG 3.62Å; K242-E277 VanDerWaalsContact CE-CG 3.48Å; K242-E277 HydrophobicContact CG-CG 3.98Å; K242-E277 IonicContact NZ-OE1 2.72Å; K242-E277 PolarHBondContact NZ-OE1 3.17Å; T275-E277 PolarHBondContact O-N 3.18Å; E277-G279 PolarHBondContact O-N 3.43Å; E277-G279 VanDerWaalsContact O-N 3.09Å; E277-L280 HydrophobicContact CB-CB 4.09Å; E277-L280 HydrophobicContact CB-CD1 3.74Å; E277-L280 HydrophobicContact CB-CG 3.83Å; E277-L280 HydrophobicContact CG-CD1 4.09Å; E277-L280 PolarHBondContact O-N 3.38Å; E277-V281 PolarHBondContact O-N 3.3Å | ||
| 278 | R | 96.2 | Very high | 97.4 | Very high | 125 Ų | 125 | 39.6 Ų | 39.6 | 47% | 0.472 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -54.7 | -31.5 | 177 | -175 | 174.2 | 57.2 | 75.5 | -0.3 | 112.9 | Q276 V281 Q282 G312 I313 | Q276-R278 PolarHBondContact O-N 3.12Å; R278-V281 PolarHBondContact O-N 2.87Å; R278-Q282 WeakPolarHBondContact O-CG 3.36Å; R278-Q282 PolarHBondContact O-N 3.37Å; R278-G312 WeakPolarHBondContact CD-O 3.41Å; R278-I313 HydrophobicContact CB-CG1 3.96Å; R278-I313 HydrophobicContact CG-CG1 4.31Å |
| 279 | G | 97.4 | Very high | 97.4 | Very high | 39 Ų | 39 | 40 Ų | 40 | 40% | 0.402 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -62.3 | -43.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113 | E277 Q282 F283 | E277-G279 PolarHBondContact O-N 3.43Å; E277-G279 VanDerWaalsContact O-N 3.09Å; G279-Q282 PolarHBondContact O-N 2.95Å; G279-F283 WeakPolarHBondContact O-CB 3.33Å; G279-F283 PolarHBondContact O-N 3.35Å |
| 280 | L | 97.6 | Very high | 97.4 | Very high | 10 Ų | 10 | 44.9 Ų | 44.9 | 5% | 0.052 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -68.6 | -38.1 | 177.8 | -65.4 | 178.4 | 0 | 0 | 0 | 112.1 | K242 Q244 M247 A272 E277 Q282 F283 L284 | K242-L280 HydrophobicContact CB-CD1 3.88Å; K242-L280 HydrophobicContact CG-CD1 4.03Å; Q244-L280 HydrophobicContact CB-CD2 3.97Å; M247-L280 HydrophobicContact SD-CD2 4Å; A272-L280 HydrophobicContact CB-CB 4.06Å; E277-L280 HydrophobicContact CB-CB 4.09Å; E277-L280 HydrophobicContact CB-CD1 3.74Å; E277-L280 HydrophobicContact CB-CG 3.83Å; E277-L280 HydrophobicContact CG-CD1 4.09Å; E277-L280 PolarHBondContact O-N 3.38Å; L280-Q282 VanDerWaalsContact C-N 3.33Å; L280-Q282 PolarHBondContact O-N 3.2Å; L280-F283 WeakPolarHBondContact O-CB 3.3Å; L280-F283 PolarHBondContact O-N 3.3Å; L280-L284 PolarHBondContact O-N 2.61Å |
| 281 | V | 98.4 | Very high | 97.3 | Very high | 0 Ų | 0 | 45.7 Ų | 45.7 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -59.2 | -47.4 | 173.2 | 174.9 | 0 | 0 | 0 | 0 | 110.2 | L269 A272 V273 E277 R278 F283 L284 L285 I313 T316 L317 | L269-V281 HydrophobicContact CD1-CG1 4.04Å; A272-V281 HydrophobicContact CB-CG2 3.91Å; V273-V281 HydrophobicContact CG2-CG2 4.05Å; E277-V281 PolarHBondContact O-N 3.3Å; R278-V281 PolarHBondContact O-N 2.87Å; V281-F283 PolarHBondContact O-N 2.93Å; V281-L284 PolarHBondContact O-N 3.44Å; V281-L285 HydrophobicContact CG1-CD1 3.78Å; V281-L285 HydrophobicContact CG1-CG 4.5Å; V281-L285 WeakPolarHBondContact O-CB 3.44Å; V281-L285 WeakPolarHBondContact O-CD1 3.47Å; V281-L285 WeakPolarHBondContact O-CG 3.45Å; V281-L285 PolarHBondContact O-N 2.88Å; V281-L285 VanDerWaalsContact O-N 3.07Å; V281-I313 HydrophobicContact CG1-CG2 4.34Å; V281-I313 HydrophobicContact CG2-CG2 4.1Å; V281-T316 HydrophobicContact CG1-CG2 4.29Å; V281-L317 HydrophobicContact CG1-CD2 4.06Å; V281-L317 HydrophobicContact CG1-CG 4.34Å |
| 282 | Q | 98.4 | Very high | 97.3 | Very high | 67 Ų | 67 | 46.9 Ų | 46.9 | 31% | 0.313 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -61.8 | -43 | 176.9 | -72 | 179.7 | -1.7 | 0 | 0 | 112.3 | R278 G279 L280 L285 Q286 T316 | R278-Q282 WeakPolarHBondContact O-CG 3.36Å; R278-Q282 PolarHBondContact O-N 3.37Å; G279-Q282 PolarHBondContact O-N 2.95Å; L280-Q282 VanDerWaalsContact C-N 3.33Å; L280-Q282 PolarHBondContact O-N 3.2Å; Q282-L285 PolarHBondContact O-N 3.09Å; Q282-Q286 WeakPolarHBondContact O-CB 3.45Å; Q282-Q286 WeakPolarHBondContact O-CG 3.3Å; Q282-Q286 PolarHBondContact O-N 2.83Å; Q282-T316 HydrophobicContact CG-CG2 3.51Å |
| 283 | F | 98.4 | Very high | 97.3 | Very high | 26 Ų | 26 | 47.4 Ų | 47.4 | 11% | 0.114 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -58.3 | -51.2 | 176.9 | 168 | -101 | 0 | 0 | 0 | 112 | Q244 M247 E248 L251 G279 L280 V281 L285 Q286 A287 | Q244-F283 HydrophobicContact CG-CD1 4.18Å; Q244-F283 HydrophobicContact CG-CD2 3.88Å; Q244-F283 HydrophobicContact CG-CE1 4.38Å; Q244-F283 HydrophobicContact CG-CE2 4.09Å; Q244-F283 HydrophobicContact CG-CG 3.93Å; Q244-F283 HydrophobicContact CG-CZ 4.34Å; M247-F283 HydrophobicContact CB-CE1 3.86Å; M247-F283 HydrophobicContact CB-CZ 4.43Å; M247-F283 HydrophobicContact CE-CD1 4.01Å; M247-F283 HydrophobicContact CE-CE1 3.99Å; E248-F283 HydrophobicContact CB-CZ 4.35Å; E248-F283 HydrophobicContact CG-CD2 4.48Å; E248-F283 HydrophobicContact CG-CE2 3.35Å; E248-F283 HydrophobicContact CG-CZ 3.39Å; L251-F283 HydrophobicContact CD1-CE1 3.93Å; L251-F283 HydrophobicContact CD1-CZ 3.92Å; G279-F283 WeakPolarHBondContact O-CB 3.33Å; G279-F283 PolarHBondContact O-N 3.35Å; L280-F283 WeakPolarHBondContact O-CB 3.3Å; L280-F283 PolarHBondContact O-N 3.3Å; V281-F283 PolarHBondContact O-N 2.93Å; F283-L285 PolarHBondContact O-N 3.44Å; F283-Q286 PolarHBondContact O-N 3.16Å; F283-A287 WeakPolarHBondContact O-CB 3.27Å; F283-A287 PolarHBondContact O-N 2.9Å |
| 284 | L | 98.3 | Very high | 97.3 | Very high | 0 Ų | 0 | 52.3 Ų | 52.3 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -63.7 | -40.2 | -179.5 | -74.5 | 171.2 | 0 | 0 | 0 | 112.4 | M247 I257 A268 L269 A272 L280 V281 A287 G288 A289 | M247-L284 HydrophobicContact CE-CD1 3.92Å; M247-L284 HydrophobicContact CE-CD2 3.55Å; M247-L284 HydrophobicContact CE-CG 3.75Å; I257-L284 HydrophobicContact CD1-CD2 4.04Å; I257-L284 HydrophobicContact CG1-CD2 4.07Å; A268-L284 VanDerWaalsContact C-CD1 3.47Å; A268-L284 HydrophobicContact CB-CD1 3.94Å; A268-L284 HydrophobicContact CB-CD2 4.1Å; A268-L284 WeakPolarHBondContact O-CD1 3.4Å; L269-L284 HydrophobicContact CB-CD1 4.46Å; L269-L284 HydrophobicContact CD1-CB 4.12Å; L269-L284 HydrophobicContact CD1-CD1 4.49Å; A272-L284 HydrophobicContact CB-CD1 3.7Å; L280-L284 PolarHBondContact O-N 2.61Å; V281-L284 PolarHBondContact O-N 3.44Å; L284-A287 CarbonylContact O-C 3.57Å; L284-A287 PolarHBondContact O-N 3.03Å; L284-G288 PolarHBondContact O-N 3.22Å; L284-A289 HydrophobicContact CB-CB 4.13Å; L284-A289 WeakPolarHBondContact O-CB 3.5Å; L284-A289 PolarHBondContact O-N 3.02Å |
| 285 | L | 98.3 | Very high | 97.4 | Very high | 30 Ų | 30 | 51.1 Ų | 51.1 | 16% | 0.157 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -64 | -41.3 | 175.3 | -68.2 | 165.8 | 0 | 0 | 0 | 111.8 | L269 V281 Q282 F283 A287 G288 V291 T316 L317 A320 | L269-L285 HydrophobicContact CD1-CD2 4.23Å; L269-L285 HydrophobicContact CD1-CG 4.1Å; L269-L285 HydrophobicContact CD2-CD2 3.82Å; V281-L285 HydrophobicContact CG1-CD1 3.78Å; V281-L285 HydrophobicContact CG1-CG 4.5Å; V281-L285 WeakPolarHBondContact O-CB 3.44Å; V281-L285 WeakPolarHBondContact O-CD1 3.47Å; V281-L285 WeakPolarHBondContact O-CG 3.45Å; V281-L285 PolarHBondContact O-N 2.88Å; V281-L285 VanDerWaalsContact O-N 3.07Å; Q282-L285 PolarHBondContact O-N 3.09Å; F283-L285 PolarHBondContact O-N 3.44Å; L285-A287 VanDerWaalsContact C-N 3.29Å; L285-A287 PolarHBondContact O-N 3.16Å; L285-G288 PolarHBondContact O-N 3.46Å; L285-G288 VanDerWaalsContact O-N 3.13Å; L285-V291 HydrophobicContact CD2-CB 4Å; L285-V291 HydrophobicContact CD2-CG2 3.91Å; L285-T316 HydrophobicContact CD1-CG2 4.11Å; L285-L317 HydrophobicContact CD1-CD2 4.21Å; L285-L317 HydrophobicContact CD2-CD2 4.43Å; L285-A320 HydrophobicContact CD1-CB 3.73Å; L285-A320 HydrophobicContact CD2-CB 3.96Å; L285-A320 HydrophobicContact CG-CB 4.28Å |
| 286 | Q | 97.9 | Very high | 97.5 | Very high | 160 Ų | 160 | 55.6 Ų | 55.6 | 75% | 0.748 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -66.7 | -31.9 | 175.2 | -73.1 | 170.7 | 11.1 | 0 | 0 | 112.3 | Q282 F283 G288 | Q282-Q286 WeakPolarHBondContact O-CB 3.45Å; Q282-Q286 WeakPolarHBondContact O-CG 3.3Å; Q282-Q286 PolarHBondContact O-N 2.83Å; F283-Q286 PolarHBondContact O-N 3.16Å; Q286-G288 PolarHBondContact O-N 3.26Å |
| 287 | A | 97.1 | Very high | 97.5 | Very high | 50 Ų | 50 | 52.7 Ų | 52.7 | 41% | 0.413 | 28% | 0.281 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.9 | -2.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | L251 I257 F283 L284 L285 | L251-A287 HydrophobicContact CD1-CB 4.06Å; I257-A287 HydrophobicContact CD1-CB 3.59Å; F283-A287 WeakPolarHBondContact O-CB 3.27Å; F283-A287 PolarHBondContact O-N 2.9Å; L284-A287 CarbonylContact O-C 3.57Å; L284-A287 PolarHBondContact O-N 3.03Å; L285-A287 VanDerWaalsContact C-N 3.29Å; L285-A287 PolarHBondContact O-N 3.16Å |
| 288 | G | 97.2 | Very high | 97.8 | Very high | 52 Ų | 52 | 49.2 Ų | 49.2 | 54% | 0.536 | 27% | 0.266 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 94.1 | 20.2 | 173.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | L284 L285 Q286 | L284-G288 PolarHBondContact O-N 3.22Å; L285-G288 PolarHBondContact O-N 3.46Å; L285-G288 VanDerWaalsContact O-N 3.13Å; Q286-G288 PolarHBondContact O-N 3.26Å |
| 289 | A | 98.1 | Very high | 97.8 | Very high | 9 Ų | 9 | 43.7 Ų | 43.7 | 7% | 0.074 | 25% | 0.247 | C | C | . | . | trans | -59 | 140.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | I257 L269 L284 V291 | I257-A289 HydrophobicContact CD1-CB 3.76Å; I257-A289 HydrophobicContact CG1-CB 3.86Å; L269-A289 HydrophobicContact CB-CB 4.34Å; L269-A289 HydrophobicContact CD2-CB 4.23Å; L284-A289 HydrophobicContact CB-CB 4.13Å; L284-A289 WeakPolarHBondContact O-CB 3.5Å; L284-A289 PolarHBondContact O-N 3.02Å; A289-V291 PolarHBondContact O-N 3.21Å | ||
| 290 | Q | 98.4 | Very high | 97.9 | Very high | 102 Ų | 102 | 41.8 Ų | 41.8 | 48% | 0.477 | 23% | 0.227 | S | C | . | . | trans | -66.7 | 108.2 | 176.2 | -178.4 | 61.9 | 49.2 | 0 | 0 | 110.1 | D258 D292 A293 | D258-Q290 PolarHBondContact OD1-N 3.35Å; D258-Q290 WeakPolarHBondContact OD2-CB 3.48Å; D258-Q290 PolarHBondContact OD2-N 2.98Å; Q290-D292 PolarHBondContact O-N 3.06Å; Q290-A293 HydrophobicContact CB-CB 4.23Å; Q290-A293 HydrophobicContact CG-CB 4.3Å; Q290-A293 WeakPolarHBondContact O-CB 3.28Å; Q290-A293 PolarHBondContact O-N 3.02Å; Q290-A293 VanDerWaalsContact O-N 3.09Å | ||
| 291 | V | 98.3 | Very high | 97.9 | Very high | 16 Ų | 16 | 41.3 Ų | 41.3 | 10% | 0.097 | 23% | 0.225 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -58.6 | -35.3 | -175.3 | 67 | 0 | 0 | 0 | 0 | 113.1 | L285 A289 P301 L317 A320 A322 | L285-V291 HydrophobicContact CD2-CB 4Å; L285-V291 HydrophobicContact CD2-CG2 3.91Å; A289-V291 PolarHBondContact O-N 3.21Å; V291-P301 WeakPolarHBondContact O-CD 3.49Å; V291-P301 WeakPolarHBondContact O-CG 3.27Å; V291-L317 HydrophobicContact CG2-CD2 4.23Å; V291-A320 HydrophobicContact CG2-CB 4.38Å; V291-A322 HydrophobicContact CG2-CB 3.64Å |
| 292 | D | 98.3 | Very high | 97.9 | Very high | 33 Ų | 33 | 41.7 Ų | 41.7 | 18% | 0.176 | 23% | 0.227 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -104 | 26.2 | -179.7 | -63.9 | -40.9 | 0 | 0 | 0 | 113 | Q290 R294 A322 D323 L326 | Q290-D292 PolarHBondContact O-N 3.06Å; D292-R294 WeakPolarHBondContact O-CG 3.43Å; D292-R294 PolarHBondContact O-N 3.38Å; D292-A322 WeakPolarHBondContact OD1-CA 3.48Å; D292-D323 PolarHBondContact OD1-N 2.72Å; D292-D323 PolarHBondContact OD2-N 3.5Å; D292-L326 HydrophobicContact CB-CD1 3.7Å |
| 293 | A | 98.1 | Very high | 97.9 | Very high | 11 Ų | 11 | 38.5 Ų | 38.5 | 9% | 0.091 | 21% | 0.212 | C | C | . | . | trans | -53.2 | 142.6 | 172.2 | 0 | 0 | 0 | 0 | 0 | 109.9 | T267 H270 Q290 T300 P301 | T267-A293 HydrophobicContact CG2-CB 3.86Å; H270-A293 PolarHBondContact CE1-O 3.31Å; H270-A293 PolarHBondContact NE2-O 3.03Å; Q290-A293 HydrophobicContact CB-CB 4.23Å; Q290-A293 HydrophobicContact CG-CB 4.3Å; Q290-A293 WeakPolarHBondContact O-CB 3.28Å; Q290-A293 PolarHBondContact O-N 3.02Å; Q290-A293 VanDerWaalsContact O-N 3.09Å; A293-T300 WeakPolarHBondContact O-CA 3.3Å; A293-P301 WeakPolarHBondContact O-CD 3.49Å | ||
| 294 | R | 97.7 | Very high | 97.8 | Very high | 103 Ų | 103 | 38.6 Ų | 38.6 | 39% | 0.389 | 21% | 0.213 | S | C | . | . | trans | -114.2 | 128 | -173.5 | -54.3 | -169.1 | 71.1 | 158.6 | -0.2 | 110.9 | Q260 D292 G298 C299 T300 R327 | Q260-R294 PolarHBondContact NE2-O 3.11Å; D292-R294 WeakPolarHBondContact O-CG 3.43Å; D292-R294 PolarHBondContact O-N 3.38Å; R294-G298 PolarHBondContact NE-O 2.92Å; R294-G298 VanDerWaalsContact NE-O 3.11Å; R294-G298 PolarHBondContact NH2-O 3.24Å; R294-C299 WeakPolarHBondContact CA-O 3.3Å; R294-T300 HydrophobicContact CG-CG2 4.32Å; R294-R327 PolarHBondContact NH2-O 3.28Å | ||
| 295 | M | 97.9 | Very high | 97.7 | Very high | 17 Ų | 17 | 38.6 Ų | 38.6 | 8% | 0.084 | 21% | 0.213 | C | C | . | . | trans | -63.6 | 172.6 | 165.8 | -71.6 | 178.5 | 55.3 | 0 | 0 | 111.7 | S264 K266 N297 G298 C299 L304 | S264-M295 WeakPolarHBondContact O-CB 3.24Å; K266-M295 HydrophobicContact CD-CE 4.3Å; K266-M295 HydrophobicContact CD-SD 4.46Å; K266-M295 HydrophobicContact CG-CE 3.76Å; K266-M295 HydrophobicContact CG-CG 3.87Å; K266-M295 HydrophobicContact CG-SD 3.66Å; M295-N297 VanDerWaalsContact CB-OD1 3.28Å; M295-N297 WeakPolarHBondContact CB-OD1 3.33Å; M295-N297 PolarHBondContact O-N 3.38Å; M295-G298 WeakPolarHBondContact O-CA 3.28Å; M295-G298 PolarHBondContact O-N 3.47Å; M295-C299 PolarHBondContact N-O 3.3Å; M295-C299 HydrophobicContact SD-CB 4.27Å; M295-L304 HydrophobicContact SD-CD1 3.92Å; M295-L304 HydrophobicContact SD-CD2 4.08Å; M295-L304 HydrophobicContact SD-CG 4.24Å | ||
| 296 | L | 97.5 | Very high | 97.6 | Very high | 117 Ų | 117 | 37.6 Ų | 37.6 | 61% | 0.613 | 21% | 0.21 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -60.8 | -31.9 | 176.8 | -63.7 | 179.5 | 0 | 0 | 0 | 113.2 | S264 G298 | S264-L296 WeakPolarHBondContact O-CG 3.48Å; S264-L296 PolarHBondContact O-N 3.47Å; L296-G298 PolarHBondContact O-N 2.99Å |
| 297 | N | 96.3 | Very high | 97.4 | Very high | 60 Ų | 60 | 31.5 Ų | 31.5 | 32% | 0.321 | 19% | 0.19 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -84.8 | 11.8 | 172.8 | 70.2 | -13.6 | 0 | 0 | 0 | 112.9 | M295 C299 V329 | M295-N297 VanDerWaalsContact CB-OD1 3.28Å; M295-N297 WeakPolarHBondContact CB-OD1 3.33Å; M295-N297 PolarHBondContact O-N 3.38Å; N297-C299 PolarHBondContact ND2-SG 3.03Å; N297-C299 PolarHBondContact O-N 2.88Å; N297-C299 VanDerWaalsContact O-N 3.16Å; N297-C299 WeakPolarHBondContact OD1-CB 3.4Å; N297-C299 PolarHBondContact OD1-N 3.21Å; N297-V329 VanDerWaalsContact C-CG1 3.5Å; N297-V329 HydrophobicContact CB-CG2 4.1Å; N297-V329 WeakPolarHBondContact O-CG1 3.31Å; N297-V329 VanDerWaalsContact O-CG2 3.24Å; N297-V329 WeakPolarHBondContact O-CG2 3.43Å; N297-V329 PolarHBondContact O-N 3.45Å |
| 298 | G | 97.3 | Very high | 97.2 | Very high | 6 Ų | 6 | 34.5 Ų | 34.5 | 6% | 0.062 | 19% | 0.19 | C | C | . | . | S | Bend | trans | 74.2 | -1.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | R294 M295 L296 | R294-G298 PolarHBondContact NE-O 2.92Å; R294-G298 VanDerWaalsContact NE-O 3.11Å; R294-G298 PolarHBondContact NH2-O 3.24Å; M295-G298 WeakPolarHBondContact O-CA 3.28Å; M295-G298 PolarHBondContact O-N 3.47Å; L296-G298 PolarHBondContact O-N 2.99Å |
| 299 | C | 97.9 | Very high | 97 | Very high | 9 Ų | 9 | 34.5 Ų | 34.5 | 6% | 0.061 | 19% | 0.191 | C | C | . | . | trans | -65.5 | 141.9 | 174.2 | -72.8 | 0 | 0 | 0 | 0 | 111 | H270 R294 M295 N297 H303 | H270-C299 PolarHBondContact NE2-O 3.02Å; R294-C299 WeakPolarHBondContact CA-O 3.3Å; M295-C299 PolarHBondContact N-O 3.3Å; M295-C299 HydrophobicContact SD-CB 4.27Å; N297-C299 PolarHBondContact ND2-SG 3.03Å; N297-C299 PolarHBondContact O-N 2.88Å; N297-C299 VanDerWaalsContact O-N 3.16Å; N297-C299 WeakPolarHBondContact OD1-CB 3.4Å; N297-C299 PolarHBondContact OD1-N 3.21Å; C299-H303 HydrophobicContact CB-CB 3.92Å | ||
| 300 | T | 98.4 | Very high | 96.8 | Very high | 0 Ų | 0 | 35.3 Ų | 35.3 | 0% | 0 | 19% | 0.194 | C | C | . | . | trans | -99.4 | 170.8 | 172.5 | 70 | 0 | 0 | 0 | 0 | 110.7 | A293 R294 L302 H303 L304 L326 | A293-T300 WeakPolarHBondContact O-CA 3.3Å; R294-T300 HydrophobicContact CG-CG2 4.32Å; T300-L302 PolarHBondContact O-N 3.16Å; T300-L302 VanDerWaalsContact O-N 3.16Å; T300-L302 PolarHBondContact OG1-N 2.84Å; T300-H303 PolarHBondContact N-ND1 3.09Å; T300-H303 WeakPolarHBondContact O-CB 3.47Å; T300-H303 PolarHBondContact O-N 3.12Å; T300-H303 PolarHBondContact OG1-ND1 3.33Å; T300-L304 PolarHBondContact O-N 3.4Å; T300-L326 HydrophobicContact CG2-CB 4.43Å; T300-L326 HydrophobicContact CG2-CD1 3.92Å | ||
| 301 | P | 98.4 | Very high | 96.6 | Very high | 0 Ų | 0 | 35.5 Ų | 35.5 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -56 | -32 | 173.2 | -25.9 | 35.8 | 0 | 0 | 0 | 112.7 | L269 H270 V273 V291 A293 L304 A305 L317 | L269-P301 HydrophobicContact CB-CG 4.39Å; L269-P301 HydrophobicContact CD2-CB 4.33Å; L269-P301 HydrophobicContact CD2-CG 3.81Å; L269-P301 HydrophobicContact CG-CB 4.12Å; L269-P301 HydrophobicContact CG-CG 3.84Å; H270-P301 VanDerWaalsContact NE2-CD 3.3Å; H270-P301 WeakPolarHBondContact NE2-CD 3.4Å; V273-P301 HydrophobicContact CG2-CB 4.05Å; V291-P301 WeakPolarHBondContact O-CD 3.49Å; V291-P301 WeakPolarHBondContact O-CG 3.27Å; A293-P301 WeakPolarHBondContact O-CD 3.49Å; P301-L304 PolarHBondContact O-N 2.84Å; P301-A305 WeakPolarHBondContact O-CB 3.33Å; P301-A305 PolarHBondContact O-N 3.42Å; P301-L317 HydrophobicContact CB-CD1 4.05Å; P301-L317 HydrophobicContact CB-CD2 4.08Å |
| 302 | L | 98.2 | Very high | 96.5 | Very high | 7 Ų | 7 | 36.7 Ų | 36.7 | 4% | 0.037 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -69.2 | -37.3 | 177.1 | -174.3 | 60.1 | 0 | 0 | 0 | 112.3 | T300 L304 A305 A306 L317 A322 P334 | T300-L302 PolarHBondContact O-N 3.16Å; T300-L302 VanDerWaalsContact O-N 3.16Å; T300-L302 PolarHBondContact OG1-N 2.84Å; L302-L304 VanDerWaalsContact C-N 3.34Å; L302-L304 PolarHBondContact O-N 2.99Å; L302-A305 PolarHBondContact O-N 3.39Å; L302-A306 VanDerWaalsContact O-CB 3.31Å; L302-A306 WeakPolarHBondContact O-CB 3.35Å; L302-A306 PolarHBondContact O-N 3.06Å; L302-L317 HydrophobicContact CB-CD1 4.38Å; L302-L317 HydrophobicContact CD1-CB 4.25Å; L302-L317 HydrophobicContact CD1-CD1 4.41Å; L302-A322 HydrophobicContact CB-CB 4.28Å; L302-A322 HydrophobicContact CD2-CB 3.93Å; L302-P334 HydrophobicContact CB-CB 4.48Å; L302-P334 HydrophobicContact CB-CG 4.21Å; L302-P334 HydrophobicContact CD2-CB 4.25Å; L302-P334 HydrophobicContact CD2-CG 3.98Å; L302-P334 HydrophobicContact CG-CB 3.83Å; L302-P334 HydrophobicContact CG-CG 3.88Å |
| 303 | H | 97.6 | Very high | 96.4 | Very high | 1 Ų | 1 | 35.4 Ų | 35.4 | 1% | 0.005 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -58.7 | -46.7 | 172.2 | -70.1 | 80.9 | 0 | 0 | 0 | 110.9 | C299 T300 A305 A306 G307 L326 E332 P334 L337 | C299-H303 HydrophobicContact CB-CB 3.92Å; T300-H303 PolarHBondContact N-ND1 3.09Å; T300-H303 WeakPolarHBondContact O-CB 3.47Å; T300-H303 PolarHBondContact O-N 3.12Å; T300-H303 PolarHBondContact OG1-ND1 3.33Å; H303-A305 PolarHBondContact O-N 3.34Å; H303-A306 PolarHBondContact O-N 2.99Å; H303-G307 PolarHBondContact O-N 3.38Å; H303-L326 PolarHBondContact CE1-O 3.32Å; H303-L326 PolarHBondContact NE2-O 3.49Å; H303-L326 VanDerWaalsContact NE2-O 3.17Å; H303-E332 PolarHBondContact NE2-O 2.73Å; H303-E332 VanDerWaalsContact NE2-O 3.11Å; H303-P334 WeakPolarHBondContact NE2-CD 3.32Å; H303-L337 HydrophobicContact CB-CD1 3.79Å |
| 304 | L | 96.6 | Very high | 96.4 | Very high | 27 Ų | 27 | 35 Ų | 35 | 14% | 0.141 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -63.4 | -41.2 | 178.1 | -64.3 | -174.8 | 0 | 0 | 0 | 112.4 | H270 V273 E274 M295 T300 P301 L302 R308 | H270-L304 HydrophobicContact CB-CD1 3.89Å; V273-L304 HydrophobicContact CG1-CB 4.03Å; E274-L304 HydrophobicContact CG-CD1 4.32Å; M295-L304 HydrophobicContact SD-CD1 3.92Å; M295-L304 HydrophobicContact SD-CD2 4.08Å; M295-L304 HydrophobicContact SD-CG 4.24Å; T300-L304 PolarHBondContact O-N 3.4Å; P301-L304 PolarHBondContact O-N 2.84Å; L302-L304 VanDerWaalsContact C-N 3.34Å; L302-L304 PolarHBondContact O-N 2.99Å; L304-R308 WeakPolarHBondContact O-CB 3.39Å; L304-R308 WeakPolarHBondContact O-CG 3.46Å; L304-R308 PolarHBondContact O-N 3.46Å |
| 305 | A | 96.8 | Very high | 96.3 | Very high | 0 Ų | 0 | 32.2 Ų | 32.2 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -66.5 | -42.5 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | V273 P301 L302 H303 R308 G309 L310 I313 S314 L317 | V273-A305 HydrophobicContact CG1-CB 3.86Å; P301-A305 WeakPolarHBondContact O-CB 3.33Å; P301-A305 PolarHBondContact O-N 3.42Å; L302-A305 PolarHBondContact O-N 3.39Å; H303-A305 PolarHBondContact O-N 3.34Å; A305-R308 PolarHBondContact O-N 2.93Å; A305-G309 PolarHBondContact O-N 3.48Å; A305-L310 HydrophobicContact CB-CB 4.41Å; A305-L310 PolarHBondContact O-N 3.11Å; A305-I313 HydrophobicContact CB-CG2 3.99Å; A305-S314 WeakPolarHBondContact CB-OG 3.41Å; A305-L317 HydrophobicContact CB-CD1 3.97Å |
| 306 | A | 95.1 | Very high | 96.3 | Very high | 10 Ų | 10 | 32.2 Ų | 32.2 | 8% | 0.083 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -68 | -47.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | L302 H303 R308 G309 P334 T338 | L302-A306 VanDerWaalsContact O-CB 3.31Å; L302-A306 WeakPolarHBondContact O-CB 3.35Å; L302-A306 PolarHBondContact O-N 3.06Å; H303-A306 PolarHBondContact O-N 2.99Å; A306-R308 PolarHBondContact O-N 3.17Å; A306-R308 VanDerWaalsContact O-N 3.1Å; A306-G309 PolarHBondContact O-N 3.05Å; A306-P334 HydrophobicContact CB-CB 4.04Å; A306-P334 WeakPolarHBondContact CB-O 3.44Å; A306-T338 HydrophobicContact CB-CG2 3.9Å |
| 307 | G | 93.6 | Very high | 96.3 | Very high | 32 Ų | 32 | 26.7 Ų | 26.7 | 33% | 0.33 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -62 | -18 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | H303 L337 | H303-G307 PolarHBondContact O-N 3.38Å; G307-L337 WeakPolarHBondContact CA-O 3.5Å |
| 308 | R | 93.1 | Very high | 96.3 | Very high | 112 Ų | 112 | 26.1 Ų | 26.1 | 42% | 0.423 | 17% | 0.169 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -104.3 | 3.4 | 175.1 | -66.2 | -176.9 | -176.8 | -165.5 | 5.7 | 113.9 | E274 L304 A305 A306 L310 | E274-R308 VanDerWaalsContact CA-NH1 3.25Å; E274-R308 VanDerWaalsContact CB-NH1 3.35Å; E274-R308 PolarHBondContact O-NH1 3.12Å; E274-R308 IonicContact OE1-CZ 3.89Å; E274-R308 IonicContact OE1-NH1 3.4Å; E274-R308 IonicContact OE1-NH2 2.7Å; E274-R308 PolarHBondContact OE1-NH2 3.44Å; L304-R308 WeakPolarHBondContact O-CB 3.39Å; L304-R308 WeakPolarHBondContact O-CG 3.46Å; L304-R308 PolarHBondContact O-N 3.46Å; A305-R308 PolarHBondContact O-N 2.93Å; A306-R308 PolarHBondContact O-N 3.17Å; A306-R308 VanDerWaalsContact O-N 3.1Å; R308-L310 VanDerWaalsContact C-N 3.27Å; R308-L310 HydrophobicContact CB-CD1 3.88Å; R308-L310 HydrophobicContact CB-CG 3.76Å; R308-L310 PolarHBondContact O-N 3.25Å |
| 309 | G | 93.1 | Very high | 96.3 | Very high | 53 Ų | 53 | 34.1 Ų | 34.1 | 55% | 0.546 | 20% | 0.202 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 64.9 | 24.9 | -178.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | A305 A306 M311 | A305-G309 PolarHBondContact O-N 3.48Å; A306-G309 PolarHBondContact O-N 3.05Å; G309-M311 VanDerWaalsContact C-N 3.26Å; G309-M311 PolarHBondContact O-N 3.04Å |
| 310 | L | 94.9 | Very high | 96.3 | Very high | 25 Ų | 25 | 36 Ų | 36 | 13% | 0.131 | 22% | 0.219 | C | C | . | . | trans | -82.6 | 63.6 | -174.5 | -59 | 174.2 | 0 | 0 | 0 | 111.8 | V273 Q276 A305 R308 G312 I313 S314 | V273-L310 HydrophobicContact CG1-CD1 4.04Å; Q276-L310 HydrophobicContact CB-CD2 4.41Å; Q276-L310 HydrophobicContact CG-CD1 4.05Å; Q276-L310 HydrophobicContact CG-CD2 3.88Å; A305-L310 HydrophobicContact CB-CB 4.41Å; A305-L310 PolarHBondContact O-N 3.11Å; R308-L310 VanDerWaalsContact C-N 3.27Å; R308-L310 HydrophobicContact CB-CD1 3.88Å; R308-L310 HydrophobicContact CB-CG 3.76Å; R308-L310 PolarHBondContact O-N 3.25Å; L310-G312 VanDerWaalsContact C-N 3.27Å; L310-G312 PolarHBondContact O-N 3.43Å; L310-G312 VanDerWaalsContact O-N 3.08Å; L310-I313 HydrophobicContact CB-CB 4.09Å; L310-I313 HydrophobicContact CB-CD1 4.35Å; L310-I313 HydrophobicContact CD1-CD1 4.15Å; L310-I313 WeakPolarHBondContact O-CA 3.45Å; L310-I313 PolarHBondContact O-N 2.7Å; L310-S314 PolarHBondContact O-N 2.8Å; L310-S314 PolarHBondContact O-OG 2.8Å | ||
| 311 | M | 93.4 | Very high | 96.2 | Very high | 106 Ų | 106 | 38.4 Ų | 38.4 | 52% | 0.522 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -51 | -40.3 | -171.1 | -62.8 | -57.2 | -72.4 | 0 | 0 | 114.6 | G309 I313 S315 L344 | G309-M311 VanDerWaalsContact C-N 3.26Å; G309-M311 PolarHBondContact O-N 3.04Å; M311-I313 VanDerWaalsContact C-N 3.34Å; M311-I313 PolarHBondContact O-N 2.68Å; M311-S315 WeakPolarHBondContact O-CB 3.46Å; M311-S315 PolarHBondContact O-N 2.77Å; M311-L344 HydrophobicContact CE-CD1 3.59Å; M311-L344 HydrophobicContact CE-CG 4.25Å; M311-L344 HydrophobicContact SD-CD1 4.24Å |
| 312 | G | 95.4 | Very high | 96.1 | Very high | 41 Ų | 41 | 39 Ų | 39 | 42% | 0.423 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -66.7 | -34.1 | 178 | 0 | 0 | 0 | 0 | 0 | 113.6 | R278 L310 T316 | R278-G312 WeakPolarHBondContact CD-O 3.41Å; L310-G312 VanDerWaalsContact C-N 3.27Å; L310-G312 PolarHBondContact O-N 3.43Å; L310-G312 VanDerWaalsContact O-N 3.08Å; G312-T316 PolarHBondContact O-N 3.36Å; G312-T316 PolarHBondContact O-OG1 2.87Å |
| 313 | I | 97.4 | Very high | 96 | Very high | 7 Ų | 7 | 41.8 Ų | 41.8 | 4% | 0.036 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -78.4 | -44.4 | 176.3 | -68.5 | 174.2 | 0 | 0 | 0 | 109.8 | V273 R278 V281 A305 L310 M311 S315 T316 L317 | V273-I313 HydrophobicContact CB-CG2 4.47Å; V273-I313 HydrophobicContact CG1-CG2 4.19Å; V273-I313 HydrophobicContact CG2-CG2 3.87Å; R278-I313 HydrophobicContact CB-CG1 3.96Å; R278-I313 HydrophobicContact CG-CG1 4.31Å; V281-I313 HydrophobicContact CG1-CG2 4.34Å; V281-I313 HydrophobicContact CG2-CG2 4.1Å; A305-I313 HydrophobicContact CB-CG2 3.99Å; L310-I313 HydrophobicContact CB-CB 4.09Å; L310-I313 HydrophobicContact CB-CD1 4.35Å; L310-I313 HydrophobicContact CD1-CD1 4.15Å; L310-I313 WeakPolarHBondContact O-CA 3.45Å; L310-I313 PolarHBondContact O-N 2.7Å; M311-I313 VanDerWaalsContact C-N 3.34Å; M311-I313 PolarHBondContact O-N 2.68Å; I313-S315 VanDerWaalsContact C-N 3.31Å; I313-S315 PolarHBondContact O-N 3.44Å; I313-T316 WeakPolarHBondContact O-CA 3.38Å; I313-T316 WeakPolarHBondContact O-CB 3.36Å; I313-T316 PolarHBondContact O-N 2.94Å; I313-L317 HydrophobicContact CG2-CD1 3.97Å; I313-L317 HydrophobicContact CG2-CG 4.39Å; I313-L317 WeakPolarHBondContact O-CG 3.46Å; I313-L317 PolarHBondContact O-N 3.38Å |
| 314 | S | 97 | Very high | 95.9 | Very high | 3 Ų | 3 | 44.7 Ų | 44.7 | 2% | 0.021 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -54.9 | -47 | 173.6 | -53.9 | 0 | 0 | 0 | 0 | 111.2 | A305 L310 T316 L317 C318 | A305-S314 WeakPolarHBondContact CB-OG 3.41Å; L310-S314 PolarHBondContact O-N 2.8Å; L310-S314 PolarHBondContact O-OG 2.8Å; S314-T316 VanDerWaalsContact C-N 3.28Å; S314-T316 PolarHBondContact O-N 3.16Å; S314-L317 PolarHBondContact O-N 3.04Å; S314-C318 PolarHBondContact O-N 2.79Å; S314-C318 PolarHBondContact O-SG 2.91Å |
| 315 | S | 96.1 | Very high | 95.9 | Very high | 44 Ų | 44 | 49.6 Ų | 49.6 | 31% | 0.308 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -60.1 | -37.3 | 174.9 | -176.5 | 0 | 0 | 0 | 0 | 112.7 | M311 I313 K319 | M311-S315 WeakPolarHBondContact O-CB 3.46Å; M311-S315 PolarHBondContact O-N 2.77Å; I313-S315 VanDerWaalsContact C-N 3.31Å; I313-S315 PolarHBondContact O-N 3.44Å; S315-K319 WeakPolarHBondContact O-CB 2.96Å; S315-K319 WeakPolarHBondContact O-CD 3.3Å; S315-K319 WeakPolarHBondContact O-CG 3.49Å; S315-K319 PolarHBondContact O-N 3.32Å |
| 316 | T | 97.9 | Very high | 95.8 | Very high | 17 Ų | 17 | 51.6 Ų | 51.6 | 10% | 0.104 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -67.4 | -44.4 | 177.6 | -60.3 | 0 | 0 | 0 | 0 | 111.2 | V281 Q282 L285 G312 I313 S314 K319 A320 | V281-T316 HydrophobicContact CG1-CG2 4.29Å; Q282-T316 HydrophobicContact CG-CG2 3.51Å; L285-T316 HydrophobicContact CD1-CG2 4.11Å; G312-T316 PolarHBondContact O-N 3.36Å; G312-T316 PolarHBondContact O-OG1 2.87Å; I313-T316 WeakPolarHBondContact O-CA 3.38Å; I313-T316 WeakPolarHBondContact O-CB 3.36Å; I313-T316 PolarHBondContact O-N 2.94Å; S314-T316 VanDerWaalsContact C-N 3.28Å; S314-T316 PolarHBondContact O-N 3.16Å; T316-K319 PolarHBondContact O-N 2.95Å; T316-A320 PolarHBondContact O-N 3.24Å |
| 317 | L | 97.7 | Very high | 95.9 | Very high | 0 Ų | 0 | 57 Ų | 57 | 0% | 0 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -63.4 | -46.6 | 177 | -70.2 | 167.4 | 0 | 0 | 0 | 111.4 | L269 V273 V281 L285 V291 P301 L302 A305 I313 S314 K319 A320 G321 A322 | L269-L317 HydrophobicContact CD1-CD2 4.44Å; L269-L317 HydrophobicContact CD2-CD2 4.4Å; V273-L317 HydrophobicContact CG2-CD1 4.15Å; V281-L317 HydrophobicContact CG1-CD2 4.06Å; V281-L317 HydrophobicContact CG1-CG 4.34Å; L285-L317 HydrophobicContact CD1-CD2 4.21Å; L285-L317 HydrophobicContact CD2-CD2 4.43Å; V291-L317 HydrophobicContact CG2-CD2 4.23Å; P301-L317 HydrophobicContact CB-CD1 4.05Å; P301-L317 HydrophobicContact CB-CD2 4.08Å; L302-L317 HydrophobicContact CB-CD1 4.38Å; L302-L317 HydrophobicContact CD1-CB 4.25Å; L302-L317 HydrophobicContact CD1-CD1 4.41Å; A305-L317 HydrophobicContact CB-CD1 3.97Å; I313-L317 HydrophobicContact CG2-CD1 3.97Å; I313-L317 HydrophobicContact CG2-CG 4.39Å; I313-L317 WeakPolarHBondContact O-CG 3.46Å; I313-L317 PolarHBondContact O-N 3.38Å; S314-L317 PolarHBondContact O-N 3.04Å; L317-K319 VanDerWaalsContact C-N 3.32Å; L317-K319 PolarHBondContact O-N 2.97Å; L317-A320 CarbonylContact O-C 3.45Å; L317-A320 WeakPolarHBondContact O-CA 3.43Å; L317-A320 WeakPolarHBondContact O-CB 3.3Å; L317-A320 PolarHBondContact O-N 3.36Å; L317-G321 PolarHBondContact O-N 2.9Å; L317-A322 HydrophobicContact CB-CB 3.98Å; L317-A322 VanDerWaalsContact O-CB 3.27Å; L317-A322 WeakPolarHBondContact O-CB 3.21Å; L317-A322 PolarHBondContact O-N 3.48Å |
| 318 | C | 96.7 | Very high | 96 | Very high | 48 Ų | 48 | 56 Ų | 56 | 32% | 0.324 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -61 | -40.4 | 176.4 | -62.7 | 0 | 0 | 0 | 0 | 112.1 | S314 A320 G321 | S314-C318 PolarHBondContact O-N 2.79Å; S314-C318 PolarHBondContact O-SG 2.91Å; C318-A320 PolarHBondContact O-N 3.23Å; C318-G321 PolarHBondContact O-N 2.88Å |
| 319 | K | 97.1 | Very high | 96.2 | Very high | 174 Ų | 174 | 55.6 Ų | 55.6 | 76% | 0.757 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -64.4 | -28.3 | 174.6 | -76.4 | 170.7 | -177.1 | 171 | 0 | 112.9 | S315 T316 L317 | S315-K319 WeakPolarHBondContact O-CB 2.96Å; S315-K319 WeakPolarHBondContact O-CD 3.3Å; S315-K319 WeakPolarHBondContact O-CG 3.49Å; S315-K319 PolarHBondContact O-N 3.32Å; T316-K319 PolarHBondContact O-N 2.95Å; L317-K319 VanDerWaalsContact C-N 3.32Å; L317-K319 PolarHBondContact O-N 2.97Å |
| 320 | A | 96.8 | Very high | 96.3 | Very high | 49 Ų | 49 | 59.6 Ų | 59.6 | 41% | 0.405 | 34% | 0.34 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.6 | 4.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | L285 V291 T316 L317 C318 | L285-A320 HydrophobicContact CD1-CB 3.73Å; L285-A320 HydrophobicContact CD2-CB 3.96Å; L285-A320 HydrophobicContact CG-CB 4.28Å; V291-A320 HydrophobicContact CG2-CB 4.38Å; T316-A320 PolarHBondContact O-N 3.24Å; L317-A320 CarbonylContact O-C 3.45Å; L317-A320 WeakPolarHBondContact O-CA 3.43Å; L317-A320 WeakPolarHBondContact O-CB 3.3Å; L317-A320 PolarHBondContact O-N 3.36Å; C318-A320 PolarHBondContact O-N 3.23Å |
| 321 | G | 96.3 | Very high | 96.3 | Very high | 51 Ų | 51 | 63.1 Ų | 63.1 | 53% | 0.526 | 36% | 0.359 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 92.6 | 17.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | L317 C318 D323 | L317-G321 PolarHBondContact O-N 2.9Å; C318-G321 PolarHBondContact O-N 2.88Å; G321-D323 PolarHBondContact O-N 2.87Å |
| 322 | A | 97.1 | Very high | 96.4 | Very high | 12 Ų | 12 | 61 Ų | 61 | 10% | 0.099 | 35% | 0.347 | C | S | . | . | trans | -56.9 | 130.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | V291 D292 L302 L317 S324 | V291-A322 HydrophobicContact CG2-CB 3.64Å; D292-A322 WeakPolarHBondContact OD1-CA 3.48Å; L302-A322 HydrophobicContact CB-CB 4.28Å; L302-A322 HydrophobicContact CD2-CB 3.93Å; L317-A322 HydrophobicContact CB-CB 3.98Å; L317-A322 VanDerWaalsContact O-CB 3.27Å; L317-A322 WeakPolarHBondContact O-CB 3.21Å; L317-A322 PolarHBondContact O-N 3.48Å; A322-S324 PolarHBondContact O-N 3.29Å | ||
| 323 | D | 96.4 | Very high | 96.4 | Very high | 65 Ų | 65 | 59.8 Ų | 59.8 | 35% | 0.348 | 33% | 0.332 | S | S | . | . | trans | -81 | 111.4 | 177.4 | -176.3 | -1.4 | 0 | 0 | 0 | 110.6 | D292 G321 L325 L326 | D292-D323 PolarHBondContact OD1-N 2.72Å; D292-D323 PolarHBondContact OD2-N 3.5Å; G321-D323 PolarHBondContact O-N 2.87Å; D323-L325 PolarHBondContact O-N 3.25Å; D323-L325 WeakPolarHBondContact OD1-CB 3.43Å; D323-L325 PolarHBondContact OD1-N 2.93Å; D323-L326 HydrophobicContact CB-CD1 3.92Å; D323-L326 HydrophobicContact CB-CG 3.8Å | ||
| 324 | S | 94.8 | Very high | 96.3 | Very high | 63 Ų | 63 | 59.6 Ų | 59.6 | 44% | 0.441 | 33% | 0.331 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76 | -3.7 | 179.1 | 63.9 | 0 | 0 | 0 | 0 | 114.1 | A322 P334 | A322-S324 PolarHBondContact O-N 3.29Å; S324-P334 WeakPolarHBondContact O-CD 3.4Å |
| 325 | L | 96.2 | Very high | 96 | Very high | 130 Ų | 130 | 64.3 Ų | 64.3 | 68% | 0.681 | 35% | 0.353 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -102.5 | -8.1 | -179.1 | -56 | 179.7 | 0 | 0 | 0 | 113 | D323 R327 | D323-L325 PolarHBondContact O-N 3.25Å; D323-L325 WeakPolarHBondContact OD1-CB 3.43Å; D323-L325 PolarHBondContact OD1-N 2.93Å; L325-R327 PolarHBondContact O-N 3.23Å |
| 326 | L | 96.1 | Very high | 95.8 | Very high | 42 Ų | 42 | 67 Ų | 67 | 22% | 0.22 | 36% | 0.364 | C | S | . | . | trans | -61.5 | 134.7 | 174.8 | -69.6 | 176.4 | 0 | 0 | 0 | 109.8 | D292 T300 H303 D323 P334 | D292-L326 HydrophobicContact CB-CD1 3.7Å; T300-L326 HydrophobicContact CG2-CB 4.43Å; T300-L326 HydrophobicContact CG2-CD1 3.92Å; H303-L326 PolarHBondContact CE1-O 3.32Å; H303-L326 PolarHBondContact NE2-O 3.49Å; H303-L326 VanDerWaalsContact NE2-O 3.17Å; D323-L326 HydrophobicContact CB-CD1 3.92Å; D323-L326 HydrophobicContact CB-CG 3.8Å; L326-P334 WeakPolarHBondContact O-CD 3.34Å | ||
| 327 | R | 96.3 | Very high | 95.4 | Very high | 123 Ų | 123 | 68.4 Ų | 68.4 | 46% | 0.464 | 37% | 0.37 | S | S | . | . | trans | -108.2 | 134.6 | -179.1 | -59.7 | -172.8 | 175 | -150.5 | -16.4 | 111.2 | R294 L325 D331 E332 T333 | R294-R327 PolarHBondContact NH2-O 3.28Å; L325-R327 PolarHBondContact O-N 3.23Å; R327-D331 WeakPolarHBondContact CD-OD1 3.36Å; R327-D331 IonicContact CZ-OD1 3.67Å; R327-D331 IonicContact NE-OD1 3.83Å; R327-D331 IonicContact NH1-OD1 2.8Å; R327-D331 PolarHBondContact NH1-OD1 3.37Å; R327-D331 IonicContact NH1-OD2 2.8Å; R327-D331 PolarHBondContact NH1-OD2 2.92Å; R327-E332 CarbonylContact C-O 3.54Å; R327-E332 VanDerWaalsContact CA-O 3.27Å; R327-E332 WeakPolarHBondContact CA-O 3.46Å; R327-T333 HydrophobicContact CG-CG2 3.91Å | ||
| 328 | N | 95.9 | Very high | 94.8 | Very high | 10 Ų | 10 | 70.8 Ų | 70.8 | 5% | 0.053 | 39% | 0.385 | C | S | . | . | trans | -68.3 | -175.1 | 173.2 | 73.2 | 4 | 0 | 0 | 0 | 111.8 | E330 D331 E332 | N328-E330 PolarHBondContact O-N 3.37Å; N328-E330 VanDerWaalsContact OD1-C 3.32Å; N328-E330 VanDerWaalsContact OD1-CA 3.3Å; N328-E330 WeakPolarHBondContact OD1-CA 3.47Å; N328-E330 WeakPolarHBondContact OD1-CB 3.33Å; N328-E330 PolarHBondContact OD1-N 2.66Å; N328-D331 PolarHBondContact O-N 3.03Å; N328-D331 VanDerWaalsContact O-N 3.16Å; N328-D331 PolarHBondContact OD1-N 3.12Å; N328-D331 VanDerWaalsContact OD1-N 3.16Å; N328-E332 PolarHBondContact N-O 3.28Å; N328-E332 PolarHBondContact ND2-OE2 3.48Å; N328-E332 WeakPolarHBondContact OD1-CB 3.03Å; N328-E332 PolarHBondContact OD1-N 3.42Å; N328-E332 PolarHBondContact OD1-O 3.45Å | ||
| 329 | V | 96.9 | Very high | 93.4 | Very high | 104 Ų | 104 | 77.3 Ų | 77.3 | 63% | 0.63 | 41% | 0.411 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.3 | -15.9 | 178.1 | -62.3 | 0 | 0 | 0 | 0 | 113.8 | N297 D331 | N297-V329 VanDerWaalsContact C-CG1 3.5Å; N297-V329 HydrophobicContact CB-CG2 4.1Å; N297-V329 WeakPolarHBondContact O-CG1 3.31Å; N297-V329 VanDerWaalsContact O-CG2 3.24Å; N297-V329 WeakPolarHBondContact O-CG2 3.43Å; N297-V329 PolarHBondContact O-N 3.45Å; V329-D331 VanDerWaalsContact C-N 3.31Å |
| 330 | E | 95.4 | Very high | 91.4 | Very high | 137 Ų | 137 | 75.6 Ų | 75.6 | 64% | 0.64 | 41% | 0.405 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.7 | 8.9 | 176.9 | -59 | -176.4 | 116.8 | 0 | 0 | 112 | N328 E332 | N328-E330 PolarHBondContact O-N 3.37Å; N328-E330 VanDerWaalsContact OD1-C 3.32Å; N328-E330 VanDerWaalsContact OD1-CA 3.3Å; N328-E330 WeakPolarHBondContact OD1-CA 3.47Å; N328-E330 WeakPolarHBondContact OD1-CB 3.33Å; N328-E330 PolarHBondContact OD1-N 2.66Å; E330-E332 HydrophobicContact CB-CG 4.15Å; E330-E332 PolarHBondContact O-N 3.23Å |
| 331 | D | 95.8 | Very high | 89.1 | Confident | 99 Ų | 99 | 79.1 Ų | 79.1 | 53% | 0.529 | 43% | 0.427 | S | S | . | . | S | Bend | trans | 65.4 | 18.9 | -178 | -159.7 | 42.9 | 0 | 0 | 0 | 114.1 | R327 N328 V329 | R327-D331 WeakPolarHBondContact CD-OD1 3.36Å; R327-D331 IonicContact CZ-OD1 3.67Å; R327-D331 IonicContact NE-OD1 3.83Å; R327-D331 IonicContact NH1-OD1 2.8Å; R327-D331 PolarHBondContact NH1-OD1 3.37Å; R327-D331 IonicContact NH1-OD2 2.8Å; R327-D331 PolarHBondContact NH1-OD2 2.92Å; N328-D331 PolarHBondContact O-N 3.03Å; N328-D331 VanDerWaalsContact O-N 3.16Å; N328-D331 PolarHBondContact OD1-N 3.12Å; N328-D331 VanDerWaalsContact OD1-N 3.16Å; V329-D331 VanDerWaalsContact C-N 3.31Å |
| 332 | E | 95.1 | Very high | 86.7 | Confident | 61 Ų | 61 | 82.6 Ų | 82.6 | 29% | 0.285 | 43% | 0.433 | S | S | . | . | trans | -94.4 | 134.3 | 179.7 | -58 | 170.7 | 138.2 | 0 | 0 | 110.6 | H303 R327 N328 E330 D336 L337 | H303-E332 PolarHBondContact NE2-O 2.73Å; H303-E332 VanDerWaalsContact NE2-O 3.11Å; R327-E332 CarbonylContact C-O 3.54Å; R327-E332 VanDerWaalsContact CA-O 3.27Å; R327-E332 WeakPolarHBondContact CA-O 3.46Å; N328-E332 PolarHBondContact N-O 3.28Å; N328-E332 PolarHBondContact ND2-OE2 3.48Å; N328-E332 WeakPolarHBondContact OD1-CB 3.03Å; N328-E332 PolarHBondContact OD1-N 3.42Å; N328-E332 PolarHBondContact OD1-O 3.45Å; E330-E332 HydrophobicContact CB-CG 4.15Å; E330-E332 PolarHBondContact O-N 3.23Å; E332-D336 HydrophobicContact CB-CB 4.07Å; E332-L337 HydrophobicContact CB-CD2 4.45Å; E332-L337 VanDerWaalsContact OE2-CD2 3.3Å; E332-L337 WeakPolarHBondContact OE2-CD2 3.36Å | ||
| 333 | T | 96.4 | Very high | 84.5 | Confident | 16 Ų | 16 | 86.1 Ų | 86.1 | 10% | 0.098 | 45% | 0.453 | C | S | . | . | trans | -80.6 | 166.2 | 166.8 | 67.1 | 0 | 0 | 0 | 0 | 110.5 | R327 Q335 D336 | R327-T333 HydrophobicContact CG-CG2 3.91Å; T333-Q335 PolarHBondContact O-N 3.08Å; T333-Q335 VanDerWaalsContact O-N 3.12Å; T333-Q335 PolarHBondContact OG1-N 3.1Å; T333-D336 WeakPolarHBondContact CB-OD2 3.35Å; T333-D336 PolarHBondContact N-OD2 3.26Å; T333-D336 PolarHBondContact O-N 2.87Å; T333-D336 VanDerWaalsContact OG1-CG 3.23Å; T333-D336 PolarHBondContact OG1-N 2.85Å; T333-D336 PolarHBondContact OG1-OD2 3.28Å | ||
| 334 | P | 93.9 | Very high | 82.2 | Confident | 4 Ų | 4 | 87 Ų | 87 | 3% | 0.026 | 46% | 0.457 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -54.1 | -33.5 | 172.2 | -25.7 | 33.6 | 0 | 0 | 0 | 113.3 | L302 H303 A306 S324 L326 L337 | L302-P334 HydrophobicContact CB-CB 4.48Å; L302-P334 HydrophobicContact CB-CG 4.21Å; L302-P334 HydrophobicContact CD2-CB 4.25Å; L302-P334 HydrophobicContact CD2-CG 3.98Å; L302-P334 HydrophobicContact CG-CB 3.83Å; L302-P334 HydrophobicContact CG-CG 3.88Å; H303-P334 WeakPolarHBondContact NE2-CD 3.32Å; A306-P334 HydrophobicContact CB-CB 4.04Å; A306-P334 WeakPolarHBondContact CB-O 3.44Å; S324-P334 WeakPolarHBondContact O-CD 3.4Å; L326-P334 WeakPolarHBondContact O-CD 3.34Å; P334-L337 PolarHBondContact O-N 3.11Å |
| 335 | Q | 91.3 | Very high | 80 | Confident | 102 Ų | 102 | 88 Ų | 88 | 48% | 0.477 | 46% | 0.457 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71 | -32.4 | 179.5 | -173.3 | 173 | 1.6 | 0 | 0 | 112.3 | T333 L337 T338 | T333-Q335 PolarHBondContact O-N 3.08Å; T333-Q335 VanDerWaalsContact O-N 3.12Å; T333-Q335 PolarHBondContact OG1-N 3.1Å; Q335-L337 PolarHBondContact O-N 2.94Å; Q335-T338 PolarHBondContact O-N 3.32Å; Q335-T338 PolarHBondContact O-OG1 3.27Å |
| 336 | D | 92.3 | Very high | 77.7 | Confident | 99 Ų | 99 | 87 Ų | 87 | 53% | 0.529 | 46% | 0.459 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.4 | -24.1 | 177.9 | -59.6 | -47.7 | 0 | 0 | 0 | 111.6 | E332 T333 | E332-D336 HydrophobicContact CB-CB 4.07Å; T333-D336 WeakPolarHBondContact CB-OD2 3.35Å; T333-D336 PolarHBondContact N-OD2 3.26Å; T333-D336 PolarHBondContact O-N 2.87Å; T333-D336 VanDerWaalsContact OG1-CG 3.23Å; T333-D336 PolarHBondContact OG1-N 2.85Å; T333-D336 PolarHBondContact OG1-OD2 3.28Å |
| 337 | L | 89 | Confident | 75.3 | Confident | 47 Ų | 47 | 91.5 Ų | 91.5 | 25% | 0.246 | 48% | 0.477 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -83.6 | -7.1 | 177.6 | -63.2 | 177.8 | 0 | 0 | 0 | 114.3 | H303 G307 E332 P334 Q335 E339 | H303-L337 HydrophobicContact CB-CD1 3.79Å; G307-L337 WeakPolarHBondContact CA-O 3.5Å; E332-L337 HydrophobicContact CB-CD2 4.45Å; E332-L337 VanDerWaalsContact OE2-CD2 3.3Å; E332-L337 WeakPolarHBondContact OE2-CD2 3.36Å; P334-L337 PolarHBondContact O-N 3.11Å; Q335-L337 PolarHBondContact O-N 2.94Å; L337-E339 PolarHBondContact O-N 3.23Å |
| 338 | T | 85.7 | Confident | 72.9 | Confident | 51 Ų | 51 | 92.3 Ų | 92.3 | 31% | 0.313 | 49% | 0.491 | S | S | . | . | trans | -71.9 | 120.4 | 179.9 | 58.7 | 0 | 0 | 0 | 0 | 110.5 | A306 Q335 E340 | A306-T338 HydrophobicContact CB-CG2 3.9Å; Q335-T338 PolarHBondContact O-N 3.32Å; Q335-T338 PolarHBondContact O-OG1 3.27Å; T338-E340 PolarHBondContact O-N 3.19Å; T338-E340 PolarHBondContact OG1-O 2.97Å | ||
| 339 | E | 67.3 | Low | 70.6 | Confident | 184 Ų | 184 | 99.5 Ų | 99.5 | 86% | 0.86 | 53% | 0.529 | S | S | * | . | S | Bend | trans | -59.9 | -12.9 | 175.8 | -70 | -86.6 | 156.2 | 0 | 0 | 113.4 | L337 | L337-E339 PolarHBondContact O-N 3.23Š|
| 340 | E | 54.6 | Low | 67.9 | Low | 138 Ų | 138 | 100.7 Ų | 100.7 | 65% | 0.645 | 53% | 0.531 | S | S | * | . | S | Bend | trans | -124.8 | 124.2 | 171.5 | -64.8 | -160.2 | 169.7 | 0 | 0 | 111.7 | T338 L342 | T338-E340 PolarHBondContact O-N 3.19Å; T338-E340 PolarHBondContact OG1-O 2.97Å; E340-L342 PolarHBondContact O-N 3.02Å |
| 341 | S | 48.7 | Very low | 65.5 | Low | 123 Ų | 123 | 103.7 Ų | 103.7 | 86% | 0.86 | 54% | 0.542 | S | S | * | . | trans | -66.4 | 65.6 | 167.9 | -172.5 | 0 | 0 | 0 | 0 | 111 | ||||
| 342 | L | 46.2 | Very low | 63.2 | Low | 124 Ų | 124 | 106 Ų | 106 | 65% | 0.649 | 55% | 0.553 | S | S | * | * | trans | -140.1 | 86.2 | 176.3 | -71.1 | 178.6 | 0 | 0 | 0 | 111.6 | E340 | E340-L342 PolarHBondContact O-N 3.02Š| ||
| 343 | V | 49.6 | Very low | 60.7 | Low | 86 Ų | 86 | 108.2 Ų | 108.2 | 52% | 0.521 | 58% | 0.575 | S | S | . | * | trans | 42.8 | 88.8 | 141.4 | -164.7 | 0 | 0 | 0 | 0 | 116.5 | L345 | V343-L345 HydrophobicContact CG1-CB 3.93Å; V343-L345 HydrophobicContact CG1-CD1 4.22Å; V343-L345 HydrophobicContact CG1-CG 3.99Å | ||
| 344 | L | 49.1 | Very low | 58.2 | Low | 83 Ų | 83 | 110.8 Ų | 110.8 | 44% | 0.435 | 60% | 0.604 | S | S | . | * | trans | -107.2 | 53.4 | 151.4 | -136.8 | 156.1 | 0 | 0 | 0 | 108.1 | M311 | M311-L344 HydrophobicContact CE-CD1 3.59Å; M311-L344 HydrophobicContact CE-CG 4.25Å; M311-L344 HydrophobicContact SD-CD1 4.24Å | ||
| 345 | L | 47.8 | Very low | 55.8 | Low | 84 Ų | 84 | 119.5 Ų | 119.5 | 44% | 0.44 | 64% | 0.642 | S | S | . | * | trans | -83 | 130.7 | 176 | -69.6 | 179.3 | 0 | 0 | 0 | 109.7 | V343 F347 | V343-L345 HydrophobicContact CG1-CB 3.93Å; V343-L345 HydrophobicContact CG1-CD1 4.22Å; V343-L345 HydrophobicContact CG1-CG 3.99Å; L345-F347 HydrophobicContact CB-CB 4.49Å; L345-F347 HydrophobicContact CB-CD2 4.35Å; L345-F347 HydrophobicContact CD2-CD2 4.35Å; L345-F347 PolarHBondContact O-N 2.94Å; L345-F347 VanDerWaalsContact O-N 3.11Å | ||
| 346 | P | 47.4 | Very low | 53.3 | Low | 110 Ų | 110 | 121.9 Ų | 121.9 | 71% | 0.714 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.5 | 12.5 | 170.1 | 32.4 | -35.9 | 0 | 0 | 0 | 113.1 | ||
| 347 | F | 46.4 | Very low | 51 | Low | 136 Ų | 136 | 125 Ų | 125 | 60% | 0.596 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.9 | 3.1 | -170.1 | -69.5 | -73.4 | 0 | 0 | 0 | 115.3 | L345 D349 L350 | L345-F347 HydrophobicContact CB-CB 4.49Å; L345-F347 HydrophobicContact CB-CD2 4.35Å; L345-F347 HydrophobicContact CD2-CD2 4.35Å; L345-F347 PolarHBondContact O-N 2.94Å; L345-F347 VanDerWaalsContact O-N 3.11Å; F347-D349 PolarHBondContact O-N 2.81Å; F347-L350 HydrophobicContact CD1-CD1 4.27Å; F347-L350 PolarHBondContact O-N 3Å |
| 348 | D | 46.8 | Very low | 48.7 | Very low | 141 Ų | 141 | 129.3 Ų | 129.3 | 75% | 0.754 | 70% | 0.696 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.6 | -6.4 | -179.3 | -82 | -20.1 | 0 | 0 | 0 | 114.5 | ||
| 349 | D | 46 | Very low | 46.6 | Very low | 160 Ų | 160 | 132.8 Ų | 132.8 | 86% | 0.856 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.4 | 0.7 | 177.9 | -86.2 | -26 | 0 | 0 | 0 | 115.6 | F347 K351 | F347-D349 PolarHBondContact O-N 2.81Å; D349-K351 VanDerWaalsContact C-N 3.28Å; D349-K351 PolarHBondContact O-N 3.29Å |
| 350 | L | 42.3 | Very low | 45.5 | Very low | 129 Ų | 129 | 130.2 Ų | 130.2 | 68% | 0.675 | 72% | 0.717 | S | S | * | * | trans | -79.4 | 79.1 | 169.5 | -97.8 | 138.5 | 0 | 0 | 0 | 110.5 | F347 I352 | F347-L350 HydrophobicContact CD1-CD1 4.27Å; F347-L350 PolarHBondContact O-N 3Å; L350-I352 PolarHBondContact O-N 2.77Å | ||
| 351 | K | 44.8 | Very low | 45.1 | Very low | 200 Ų | 200 | 135.1 Ų | 135.1 | 87% | 0.87 | 75% | 0.748 | S | S | * | * | trans | -60.1 | 88 | 155.5 | -88.8 | 165.8 | 177.8 | 158.4 | 0 | 108.5 | D349 S353 | D349-K351 VanDerWaalsContact C-N 3.28Å; D349-K351 PolarHBondContact O-N 3.29Å; K351-S353 VanDerWaalsContact C-N 3.25Å; K351-S353 PolarHBondContact O-N 2.88Å | ||
| 352 | I | 45.7 | Very low | 44.9 | Very low | 149 Ų | 149 | 135.8 Ų | 135.8 | 76% | 0.764 | 74% | 0.743 | S | S | * | * | trans | -63 | 94.6 | 163.7 | -58.9 | 170.9 | 0 | 0 | 0 | 106 | L350 G354 | L350-I352 PolarHBondContact O-N 2.77Å; I352-G354 PolarHBondContact O-N 2.87Å | ||
| 353 | S | 44.1 | Very low | 44.9 | Very low | 106 Ų | 106 | 136.4 Ų | 136.4 | 74% | 0.741 | 75% | 0.748 | S | S | * | * | trans | -67.6 | 87.9 | 166.9 | -172.8 | 0 | 0 | 0 | 0 | 107.2 | K351 K355 | K351-S353 VanDerWaalsContact C-N 3.25Å; K351-S353 PolarHBondContact O-N 2.88Å; S353-K355 VanDerWaalsContact C-N 3.32Å; S353-K355 PolarHBondContact O-N 2.85Å | ||
| 354 | G | 43.5 | Very low | 44.6 | Very low | 70 Ų | 70 | 139.2 Ų | 139.2 | 72% | 0.722 | 76% | 0.76 | S | S | * | * | trans | -64.9 | 89.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | I352 | I352-G354 PolarHBondContact O-N 2.87Š| ||
| 355 | K | 42.7 | Very low | 44.3 | Very low | 188 Ų | 188 | 142.5 Ų | 142.5 | 82% | 0.817 | 78% | 0.779 | S | S | * | * | trans | -84.5 | 109.7 | 154.6 | -81.4 | -174.1 | 177.3 | 178.1 | 0 | 107.6 | S353 L357 | S353-K355 VanDerWaalsContact C-N 3.32Å; S353-K355 PolarHBondContact O-N 2.85Å; K355-L357 PolarHBondContact O-N 3.48Å; K355-L357 VanDerWaalsContact O-N 3.1Å | ||
| 356 | L | 39.3 | Very low | 44.1 | Very low | 151 Ų | 151 | 146.1 Ų | 146.1 | 79% | 0.791 | 80% | 0.801 | S | S | * | * | trans | -61.3 | 106.7 | 170.3 | -156.4 | 83.3 | 0 | 0 | 0 | 108.2 | L358 | L356-L358 HydrophobicContact CD2-CG 4.24Å; L356-L358 PolarHBondContact O-N 3.11Å; L356-L358 VanDerWaalsContact O-N 3.11Å | ||
| 357 | L | 43.7 | Very low | 43.9 | Very low | 164 Ų | 164 | 148.5 Ų | 148.5 | 86% | 0.859 | 81% | 0.806 | S | S | * | * | trans | -73.1 | 96.4 | 166.1 | -87.2 | 161.4 | 0 | 0 | 0 | 107.4 | K355 C359 | K355-L357 PolarHBondContact O-N 3.48Å; K355-L357 VanDerWaalsContact O-N 3.1Å; L357-C359 PolarHBondContact O-N 3.3Å | ||
| 358 | L | 40.1 | Very low | 43.7 | Very low | 139 Ų | 139 | 149.4 Ų | 149.4 | 73% | 0.728 | 82% | 0.821 | S | S | * | * | trans | -72 | 106.7 | 162.7 | -83.7 | 155.8 | 0 | 0 | 0 | 107.5 | L356 T360 | L356-L358 HydrophobicContact CD2-CG 4.24Å; L356-L358 PolarHBondContact O-N 3.11Å; L356-L358 VanDerWaalsContact O-N 3.11Å; L358-T360 PolarHBondContact O-N 3.1Å | ||
| 359 | C | 43.4 | Very low | 43.5 | Very low | 124 Ų | 124 | 150.1 Ų | 150.1 | 84% | 0.838 | 83% | 0.827 | S | S | * | * | trans | -66.7 | 124.6 | 160.4 | -66.1 | 0 | 0 | 0 | 0 | 108 | L357 | L357-C359 PolarHBondContact O-N 3.3Š| ||
| 360 | T | 42.9 | Very low | 43.3 | Very low | 129 Ų | 129 | 149.3 Ų | 149.3 | 79% | 0.791 | 82% | 0.824 | S | S | * | * | trans | -116.6 | 121 | 163.4 | 51.1 | 0 | 0 | 0 | 0 | 107.5 | L358 | L358-T360 PolarHBondContact O-N 3.1Š| ||
| 361 | D | 46.6 | Very low | 43.3 | Very low | 242 Ų | 242 | 151.1 Ų | 151.1 | 100% | 1.294 | 84% | 0.838 | S | S | * | * | trans | -67.4 | 0 | 166.7 | -69 | -44.5 | 0 | 0 | 0 | 112 |
Retrieved 361 of 361 residues in 60.2 ms
(Link to these results)