| 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 | 45.6 | Very low | 50.9 | Low | 247 Ų | 247 | 165.1 Ų | 165.1 | 100% | 1.217 | 88% | 0.877 | S | S | * | * | 0 | 109.2 | 0 | -69.2 | 176.7 | 172.3 | 0 | 0 | 106.3 | |||||
| 2 | A | 50.4 | Low | 50.9 | Low | 107 Ų | 107 | 161.1 Ų | 161.1 | 88% | 0.884 | 87% | 0.867 | S | S | * | * | P | Polyproline II helix | trans | -95.6 | 133.6 | -173.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||
| 3 | S | 56 | Low | 51.3 | Low | 122 Ų | 122 | 163.1 Ų | 163.1 | 85% | 0.853 | 87% | 0.872 | S | S | * | * | P | Polyproline II helix | trans | -87.1 | 143.6 | -171.5 | -40.6 | 0 | 0 | 0 | 0 | 112 | ||
| 4 | T | 51.3 | Low | 51.9 | Low | 134 Ų | 134 | 161.4 Ų | 161.4 | 82% | 0.822 | 86% | 0.856 | S | S | * | * | P | Polyproline II helix | trans | -73 | 133.5 | -177.2 | 50.7 | 0 | 0 | 0 | 0 | 113.3 | ||
| 5 | S | 52.1 | Low | 52.4 | Low | 108 Ų | 108 | 159 Ų | 159 | 76% | 0.755 | 84% | 0.844 | S | S | * | * | trans | -128.4 | 125.7 | 157.4 | 54 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 6 | Y | 50.1 | Low | 53.2 | Low | 219 Ų | 219 | 152.4 Ų | 152.4 | 86% | 0.859 | 83% | 0.826 | S | S | * | * | trans | -135.6 | 103.9 | 162.7 | -83.6 | -79.4 | 0 | 0 | 0 | 106.9 | ||||
| 7 | D | 49.6 | Very low | 54.6 | Low | 163 Ų | 163 | 148.1 Ų | 148.1 | 87% | 0.872 | 80% | 0.802 | S | S | * | * | trans | -94.9 | 122.1 | 176.9 | -148.3 | -9.6 | 0 | 0 | 0 | 107.8 | C9 | D7-C9 PolarHBondContact O-N 3.39Š| ||
| 8 | Y | 53.8 | Low | 56.1 | Low | 219 Ų | 219 | 147.2 Ų | 147.2 | 86% | 0.859 | 79% | 0.789 | S | S | * | * | trans | -88.5 | 109 | -174.8 | -105.9 | -93.5 | 0 | 0 | 0 | 110 | R10 | Y8-R10 PolarHBondContact O-N 3.49Š| ||
| 9 | C | 49.1 | Very low | 57.4 | Low | 124 Ų | 124 | 150 Ų | 150 | 84% | 0.838 | 79% | 0.787 | S | S | * | * | trans | -65.9 | 121.5 | 169.5 | -80.2 | 0 | 0 | 0 | 0 | 111.3 | D7 | D7-C9 PolarHBondContact O-N 3.39Š| ||
| 10 | R | 49.2 | Very low | 58.5 | Low | 249 Ų | 249 | 146.8 Ų | 146.8 | 94% | 0.94 | 78% | 0.777 | S | S | * | * | trans | -90.7 | 112.4 | 177.2 | -149.3 | -175.2 | -145.5 | 172 | 5.7 | 109.2 | Y8 | Y8-R10 PolarHBondContact O-N 3.49Š| ||
| 11 | V | 52.9 | Low | 59.8 | Low | 124 Ų | 124 | 145.9 Ų | 145.9 | 75% | 0.752 | 77% | 0.766 | S | S | * | * | trans | -101.1 | 130.2 | 174.7 | -178.8 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 12 | P | 50.2 | Low | 61.8 | Low | 117 Ų | 117 | 139.6 Ų | 139.6 | 76% | 0.76 | 74% | 0.737 | S | S | * | * | trans | -88.7 | 132.4 | -174.4 | 33.8 | -32.7 | 0 | 0 | 0 | 112.7 | ||||
| 13 | M | 56.8 | Low | 63.6 | Low | 187 Ų | 187 | 140.4 Ų | 140.4 | 92% | 0.921 | 73% | 0.726 | S | S | * | * | trans | -110.4 | 99.2 | 176.1 | -72.8 | -86.3 | -160.2 | 0 | 0 | 108.4 | ||||
| 14 | E | 59.8 | Low | 65.2 | Low | 139 Ų | 139 | 140 Ų | 140 | 65% | 0.65 | 71% | 0.714 | S | S | * | * | trans | -127.4 | -4.1 | -177.5 | -130.2 | -157.1 | 126.8 | 0 | 0 | 116.6 | ||||
| 15 | D | 59.7 | Low | 67.1 | Low | 126 Ų | 126 | 135.4 Ų | 135.4 | 67% | 0.674 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -92.5 | -23.3 | -178.9 | -81.7 | -30.2 | 0 | 0 | 0 | 115 | D17 | D15-D17 PolarHBondContact O-N 2.63Š|
| 16 | G | 64.8 | Low | 69 | Low | 54 Ų | 54 | 134.2 Ų | 134.2 | 56% | 0.557 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -65.3 | -30.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113 | C20 | G16-C20 PolarHBondContact O-N 3.38Å; G16-C20 PolarHBondContact O-SG 3.42Å |
| 17 | D | 77.3 | Confident | 71.1 | Confident | 78 Ų | 78 | 125.7 Ų | 125.7 | 42% | 0.417 | 66% | 0.656 | S | S | . | * | H | α-helix | trans | -69.4 | -39.4 | -173.7 | -171.6 | 38 | 0 | 0 | 0 | 112.6 | D15 K21 | D15-D17 PolarHBondContact O-N 2.63Å; D17-K21 WeakPolarHBondContact O-CB 3.18Å; D17-K21 VanDerWaalsContact O-CG 3.28Å; D17-K21 WeakPolarHBondContact O-CG 3.28Å; D17-K21 PolarHBondContact O-N 2.94Å; D17-K21 WeakPolarHBondContact OD1-CE 3.31Å; D17-K21 IonicContact OD1-NZ 3.51Å; D17-K21 VanDerWaalsContact OD2-CE 3.25Å; D17-K21 WeakPolarHBondContact OD2-CE 3.4Å; D17-K21 IonicContact OD2-NZ 2.63Å; D17-K21 PolarHBondContact OD2-NZ 3.48Å |
| 18 | K | 81.2 | Confident | 73.2 | Confident | 132 Ų | 132 | 122.1 Ų | 122.1 | 57% | 0.574 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -66.8 | -43.2 | -178.6 | -66.3 | 174.8 | -172.2 | 157.8 | 0 | 112.7 | K21 L22 | K18-K21 PolarHBondContact O-N 3.45Å; K18-L22 WeakPolarHBondContact O-CB 3.25Å; K18-L22 PolarHBondContact O-N 3.35Å |
| 19 | R | 80.9 | Confident | 75.2 | Confident | 201 Ų | 201 | 116.5 Ų | 116.5 | 76% | 0.758 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -67 | -42.5 | 178.8 | -72.9 | -173.3 | 173.1 | -157.6 | -0.6 | 111.5 | L22 L23 | R19-L22 PolarHBondContact O-N 2.98Å; R19-L23 WeakPolarHBondContact O-CG 3.3Å; R19-L23 PolarHBondContact O-N 3.29Å |
| 20 | C | 79.6 | Confident | 77.3 | Confident | 86 Ų | 86 | 114 Ų | 114 | 58% | 0.581 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -61.5 | -45.5 | 175.2 | -75.1 | 0 | 0 | 0 | 0 | 111.8 | G16 L22 L23 L24 | G16-C20 PolarHBondContact O-N 3.38Å; G16-C20 PolarHBondContact O-SG 3.42Å; C20-L22 VanDerWaalsContact C-N 3.35Å; C20-L22 PolarHBondContact O-N 2.87Å; C20-L23 PolarHBondContact O-N 3.48Å; C20-L24 VanDerWaalsContact O-CB 3.31Å; C20-L24 WeakPolarHBondContact O-CB 3.26Å; C20-L24 PolarHBondContact O-N 2.98Å |
| 21 | K | 84.8 | Confident | 79.5 | Confident | 127 Ų | 127 | 107.2 Ų | 107.2 | 55% | 0.552 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -61.7 | -39.5 | 175.9 | -75.2 | 171.4 | 174.7 | 169.8 | 0 | 112.8 | D17 K18 G25 | D17-K21 WeakPolarHBondContact O-CB 3.18Å; D17-K21 VanDerWaalsContact O-CG 3.28Å; D17-K21 WeakPolarHBondContact O-CG 3.28Å; D17-K21 PolarHBondContact O-N 2.94Å; D17-K21 WeakPolarHBondContact OD1-CE 3.31Å; D17-K21 IonicContact OD1-NZ 3.51Å; D17-K21 VanDerWaalsContact OD2-CE 3.25Å; D17-K21 WeakPolarHBondContact OD2-CE 3.4Å; D17-K21 IonicContact OD2-NZ 2.63Å; D17-K21 PolarHBondContact OD2-NZ 3.48Å; K18-K21 PolarHBondContact O-N 3.45Å; K21-G25 PolarHBondContact O-N 3.3Å |
| 22 | L | 87.8 | Confident | 81.5 | Confident | 115 Ų | 115 | 105.8 Ų | 105.8 | 60% | 0.602 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -65.4 | -48.3 | 177 | -174.2 | 73.4 | 0 | 0 | 0 | 111.8 | K18 R19 C20 L24 G25 I26 | K18-L22 WeakPolarHBondContact O-CB 3.25Å; K18-L22 PolarHBondContact O-N 3.35Å; R19-L22 PolarHBondContact O-N 2.98Å; C20-L22 VanDerWaalsContact C-N 3.35Å; C20-L22 PolarHBondContact O-N 2.87Å; L22-L24 VanDerWaalsContact C-N 3.33Å; L22-L24 PolarHBondContact O-N 3.47Å; L22-G25 PolarHBondContact O-N 3.45Å; L22-I26 HydrophobicContact CD2-CD1 4.46Å; L22-I26 HydrophobicContact CG-CD1 3.99Å; L22-I26 VanDerWaalsContact O-CG1 3.32Å; L22-I26 WeakPolarHBondContact O-CG1 3.46Å; L22-I26 PolarHBondContact O-N 3.44Å |
| 23 | L | 88 | Confident | 83.6 | Confident | 124 Ų | 124 | 104.2 Ų | 104.2 | 65% | 0.649 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -62.8 | -40.8 | 178 | -71.5 | 176.1 | 0 | 0 | 0 | 111.7 | R19 C20 G25 I26 G27 | R19-L23 WeakPolarHBondContact O-CG 3.3Å; R19-L23 PolarHBondContact O-N 3.29Å; C20-L23 PolarHBondContact O-N 3.48Å; L23-G25 VanDerWaalsContact C-N 3.35Å; L23-I26 PolarHBondContact O-N 2.92Å; L23-G27 PolarHBondContact O-N 3.31Å |
| 24 | L | 90.3 | Very high | 85.4 | Confident | 115 Ų | 115 | 100.2 Ų | 100.2 | 60% | 0.602 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -61.3 | -45 | 173.6 | -173.9 | 67.9 | 0 | 0 | 0 | 110.9 | C20 L22 G27 I28 | C20-L24 VanDerWaalsContact O-CB 3.31Å; C20-L24 WeakPolarHBondContact O-CB 3.26Å; C20-L24 PolarHBondContact O-N 2.98Å; L22-L24 VanDerWaalsContact C-N 3.33Å; L22-L24 PolarHBondContact O-N 3.47Å; L24-G27 PolarHBondContact O-N 2.88Å; L24-I28 HydrophobicContact CG-CD1 4.06Å; L24-I28 VanDerWaalsContact O-CG1 3.26Å; L24-I28 WeakPolarHBondContact O-CG1 3.32Å; L24-I28 PolarHBondContact O-N 2.89Å |
| 25 | G | 91.2 | Very high | 87 | Confident | 36 Ų | 36 | 97.3 Ų | 97.3 | 37% | 0.371 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -61.8 | -43.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | K21 L22 L23 I28 L29 | K21-G25 PolarHBondContact O-N 3.3Å; L22-G25 PolarHBondContact O-N 3.45Å; L23-G25 VanDerWaalsContact C-N 3.35Å; G25-I28 PolarHBondContact O-N 3.19Å; G25-L29 WeakPolarHBondContact O-CB 3.37Å; G25-L29 PolarHBondContact O-N 3.47Å |
| 26 | I | 93 | Very high | 88.7 | Confident | 83 Ų | 83 | 96.7 Ų | 96.7 | 43% | 0.426 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.8 | -44.8 | 174.7 | -67.3 | 165.8 | 0 | 0 | 0 | 110.4 | L22 L23 I28 L29 V30 | L22-I26 HydrophobicContact CD2-CD1 4.46Å; L22-I26 HydrophobicContact CG-CD1 3.99Å; L22-I26 VanDerWaalsContact O-CG1 3.32Å; L22-I26 WeakPolarHBondContact O-CG1 3.46Å; L22-I26 PolarHBondContact O-N 3.44Å; L23-I26 PolarHBondContact O-N 2.92Å; I26-I28 VanDerWaalsContact C-N 3.34Å; I26-I28 PolarHBondContact O-N 2.88Å; I26-L29 PolarHBondContact O-N 3.01Å; I26-V30 HydrophobicContact CG2-CG2 4.26Å; I26-V30 WeakPolarHBondContact O-CG2 3.41Å; I26-V30 PolarHBondContact O-N 3.32Å |
| 27 | G | 92.7 | Very high | 90.1 | Very high | 40 Ų | 40 | 99.1 Ų | 99.1 | 41% | 0.412 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -59.6 | -44.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | L23 L24 V30 L31 | L23-G27 PolarHBondContact O-N 3.31Å; L24-G27 PolarHBondContact O-N 2.88Å; G27-V30 PolarHBondContact O-N 2.84Å; G27-L31 WeakPolarHBondContact O-CB 3.14Å; G27-L31 PolarHBondContact O-N 3.29Å |
| 28 | I | 94.3 | Very high | 90.9 | Very high | 89 Ų | 89 | 96.4 Ų | 96.4 | 46% | 0.456 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.5 | -45.4 | 174.1 | -67.7 | 165.8 | 0 | 0 | 0 | 110.5 | L24 G25 I26 V30 L31 L32 | L24-I28 HydrophobicContact CG-CD1 4.06Å; L24-I28 VanDerWaalsContact O-CG1 3.26Å; L24-I28 WeakPolarHBondContact O-CG1 3.32Å; L24-I28 PolarHBondContact O-N 2.89Å; G25-I28 PolarHBondContact O-N 3.19Å; I26-I28 VanDerWaalsContact C-N 3.34Å; I26-I28 PolarHBondContact O-N 2.88Å; I28-V30 PolarHBondContact O-N 3.42Å; I28-L31 PolarHBondContact O-N 2.84Å; I28-L32 HydrophobicContact CG2-CD1 4.07Å; I28-L32 HydrophobicContact CG2-CG 4.38Å; I28-L32 VanDerWaalsContact O-CG 3.3Å; I28-L32 WeakPolarHBondContact O-CG 3.3Å; I28-L32 PolarHBondContact O-N 3.2Å |
| 29 | L | 94.9 | Very high | 91.5 | Very high | 101 Ų | 101 | 93.6 Ų | 93.6 | 53% | 0.529 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60.1 | -45.9 | 178.1 | 179.4 | 63.7 | 0 | 0 | 0 | 111.9 | G25 I26 L32 I33 | G25-L29 WeakPolarHBondContact O-CB 3.37Å; G25-L29 PolarHBondContact O-N 3.47Å; I26-L29 PolarHBondContact O-N 3.01Å; L29-L32 PolarHBondContact O-N 3.47Å; L29-I33 HydrophobicContact CD1-CD1 4.4Å; L29-I33 HydrophobicContact CG-CD1 4.15Å; L29-I33 VanDerWaalsContact O-CG1 3.3Å; L29-I33 WeakPolarHBondContact O-CG1 3.47Å; L29-I33 PolarHBondContact O-N 3.48Å |
| 30 | V | 94.2 | Very high | 92.2 | Very high | 71 Ų | 71 | 87.4 Ų | 87.4 | 43% | 0.43 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.9 | -43.7 | 177 | 171.3 | 0 | 0 | 0 | 0 | 110.8 | I26 G27 I28 L32 I33 I34 | I26-V30 HydrophobicContact CG2-CG2 4.26Å; I26-V30 WeakPolarHBondContact O-CG2 3.41Å; I26-V30 PolarHBondContact O-N 3.32Å; G27-V30 PolarHBondContact O-N 2.84Å; I28-V30 PolarHBondContact O-N 3.42Å; V30-L32 VanDerWaalsContact C-N 3.33Å; V30-L32 PolarHBondContact O-N 3.22Å; V30-I33 PolarHBondContact O-N 3.45Å; V30-I34 HydrophobicContact CG1-CD1 3.93Å; V30-I34 HydrophobicContact CG1-CG1 4.49Å; V30-I34 WeakPolarHBondContact O-CG1 3.32Å; V30-I34 PolarHBondContact O-N 3.45Å |
| 31 | L | 94.3 | Very high | 92.9 | Very high | 106 Ų | 106 | 88.4 Ų | 88.4 | 56% | 0.555 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -59.5 | -44.9 | 176 | -179 | 63.8 | 0 | 0 | 0 | 111.2 | G27 I28 I33 I34 V35 | G27-L31 WeakPolarHBondContact O-CB 3.14Å; G27-L31 PolarHBondContact O-N 3.29Å; I28-L31 PolarHBondContact O-N 2.84Å; L31-I33 VanDerWaalsContact C-N 3.35Å; L31-I33 PolarHBondContact O-N 3.3Å; L31-I34 PolarHBondContact O-N 2.94Å; L31-V35 HydrophobicContact CD1-CG2 4.47Å; L31-V35 VanDerWaalsContact O-CG2 3.32Å; L31-V35 WeakPolarHBondContact O-CG2 3.34Å; L31-V35 PolarHBondContact O-N 3.3Å |
| 32 | L | 95.3 | Very high | 93.4 | Very high | 95 Ų | 95 | 87.2 Ų | 87.2 | 50% | 0.497 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.2 | -44 | 175.8 | -72.2 | 173.3 | 0 | 0 | 0 | 111.5 | I28 L29 V30 I34 V35 I36 | I28-L32 HydrophobicContact CG2-CD1 4.07Å; I28-L32 HydrophobicContact CG2-CG 4.38Å; I28-L32 VanDerWaalsContact O-CG 3.3Å; I28-L32 WeakPolarHBondContact O-CG 3.3Å; I28-L32 PolarHBondContact O-N 3.2Å; L29-L32 PolarHBondContact O-N 3.47Å; V30-L32 VanDerWaalsContact C-N 3.33Å; V30-L32 PolarHBondContact O-N 3.22Å; L32-I34 PolarHBondContact O-N 2.96Å; L32-V35 PolarHBondContact O-N 2.93Å; L32-I36 HydrophobicContact CB-CD1 4.43Å; L32-I36 VanDerWaalsContact O-CB 3.3Å; L32-I36 WeakPolarHBondContact O-CB 3.37Å; L32-I36 WeakPolarHBondContact O-CD1 3.33Å; L32-I36 WeakPolarHBondContact O-CG1 3.3Å; L32-I36 PolarHBondContact O-N 2.84Å |
| 33 | I | 95.2 | Very high | 93.7 | Very high | 83 Ų | 83 | 86.6 Ų | 86.6 | 43% | 0.426 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61.2 | -45.4 | 177.1 | -68 | 165.4 | 0 | 0 | 0 | 111.1 | L29 V30 L31 V35 I36 L37 | L29-I33 HydrophobicContact CD1-CD1 4.4Å; L29-I33 HydrophobicContact CG-CD1 4.15Å; L29-I33 VanDerWaalsContact O-CG1 3.3Å; L29-I33 WeakPolarHBondContact O-CG1 3.47Å; L29-I33 PolarHBondContact O-N 3.48Å; V30-I33 PolarHBondContact O-N 3.45Å; L31-I33 VanDerWaalsContact C-N 3.35Å; L31-I33 PolarHBondContact O-N 3.3Å; I33-V35 VanDerWaalsContact C-N 3.32Å; I33-V35 PolarHBondContact O-N 2.94Å; I33-I36 PolarHBondContact O-N 3.04Å; I33-L37 HydrophobicContact CG2-CD1 3.94Å; I33-L37 WeakPolarHBondContact O-CB 3.35Å; I33-L37 PolarHBondContact O-N 3.3Å |
| 34 | I | 94 | Very high | 94 | Very high | 103 Ų | 103 | 87.4 Ų | 87.4 | 53% | 0.528 | 49% | 0.485 | S | S | . | . | I | π-helix | trans | -61.9 | -42.2 | 178 | -68.4 | 169.1 | 0 | 0 | 0 | 110.6 | V30 L31 L32 G38 | V30-I34 HydrophobicContact CG1-CD1 3.93Å; V30-I34 HydrophobicContact CG1-CG1 4.49Å; V30-I34 WeakPolarHBondContact O-CG1 3.32Å; V30-I34 PolarHBondContact O-N 3.45Å; L31-I34 PolarHBondContact O-N 2.94Å; L32-I34 PolarHBondContact O-N 2.96Å; I34-G38 WeakPolarHBondContact O-CA 3.15Å; I34-G38 PolarHBondContact O-N 3.18Å |
| 35 | V | 94.6 | Very high | 94.1 | Very high | 79 Ų | 79 | 85.8 Ų | 85.8 | 48% | 0.479 | 48% | 0.48 | S | S | . | . | I | π-helix | trans | -66.8 | -45.2 | 177.7 | 173.4 | 0 | 0 | 0 | 0 | 110.7 | L31 L32 I33 V39 | L31-V35 HydrophobicContact CD1-CG2 4.47Å; L31-V35 VanDerWaalsContact O-CG2 3.32Å; L31-V35 WeakPolarHBondContact O-CG2 3.34Å; L31-V35 PolarHBondContact O-N 3.3Å; L32-V35 PolarHBondContact O-N 2.93Å; I33-V35 VanDerWaalsContact C-N 3.32Å; I33-V35 PolarHBondContact O-N 2.94Å; V35-V39 WeakPolarHBondContact O-CB 3.18Å; V35-V39 WeakPolarHBondContact O-CG2 3.18Å; V35-V39 PolarHBondContact O-N 3.45Å |
| 36 | I | 94.6 | Very high | 94.3 | Very high | 113 Ų | 113 | 89.6 Ų | 89.6 | 58% | 0.579 | 49% | 0.491 | S | S | * | . | I | π-helix | trans | -67.4 | -40.2 | -176.8 | -69.5 | 165.6 | 0 | 0 | 0 | 112.1 | L32 I33 P40 | L32-I36 HydrophobicContact CB-CD1 4.43Å; L32-I36 VanDerWaalsContact O-CB 3.3Å; L32-I36 WeakPolarHBondContact O-CB 3.37Å; L32-I36 WeakPolarHBondContact O-CD1 3.33Å; L32-I36 WeakPolarHBondContact O-CG1 3.3Å; L32-I36 PolarHBondContact O-N 2.84Å; I33-I36 PolarHBondContact O-N 3.04Å; I36-P40 WeakPolarHBondContact O-CD 3.47Å; I36-P40 WeakPolarHBondContact O-CG 3.41Å |
| 37 | L | 94.6 | Very high | 94.3 | Very high | 104 Ų | 104 | 92.9 Ų | 92.9 | 55% | 0.545 | 50% | 0.502 | S | S | . | . | I | π-helix | trans | -99.2 | -40.1 | -177.4 | -63.6 | 179.3 | 0 | 0 | 0 | 112.9 | I33 P40 L41 | I33-L37 HydrophobicContact CG2-CD1 3.94Å; I33-L37 WeakPolarHBondContact O-CB 3.35Å; I33-L37 PolarHBondContact O-N 3.3Å; L37-P40 WeakPolarHBondContact O-CD 3.08Å; L37-L41 WeakPolarHBondContact O-CB 3.38Å; L37-L41 WeakPolarHBondContact O-CD1 3.45Å; L37-L41 WeakPolarHBondContact O-CG 3.41Å; L37-L41 PolarHBondContact O-N 3.37Å |
| 38 | G | 94 | Very high | 94.3 | Very high | 22 Ų | 22 | 93 Ų | 93 | 23% | 0.227 | 50% | 0.499 | C | S | . | . | I | π-helix | trans | -66.7 | -44.6 | -175.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | I34 L41 I42 | I34-G38 WeakPolarHBondContact O-CA 3.15Å; I34-G38 PolarHBondContact O-N 3.18Å; G38-L41 PolarHBondContact O-N 2.83Å; G38-I42 WeakPolarHBondContact O-CD1 3.49Å; G38-I42 VanDerWaalsContact O-CG1 3.25Å; G38-I42 WeakPolarHBondContact O-CG1 3.35Å; G38-I42 PolarHBondContact O-N 3.4Å |
| 39 | V | 93.6 | Very high | 94.2 | Very high | 73 Ų | 73 | 94 Ų | 94 | 44% | 0.442 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.9 | -49.5 | -179.1 | 176.3 | 0 | 0 | 0 | 0 | 111.7 | V35 L41 I42 I43 | V35-V39 WeakPolarHBondContact O-CB 3.18Å; V35-V39 WeakPolarHBondContact O-CG2 3.18Å; V35-V39 PolarHBondContact O-N 3.45Å; V39-L41 VanDerWaalsContact C-N 3.32Å; V39-L41 PolarHBondContact O-N 3.45Å; V39-I42 PolarHBondContact O-N 2.73Å; V39-I43 HydrophobicContact CG1-CD1 3.85Å; V39-I43 WeakPolarHBondContact O-CG1 3.5Å; V39-I43 PolarHBondContact O-N 2.87Å |
| 40 | P | 94.8 | Very high | 94.2 | Very high | 70 Ų | 70 | 91.1 Ų | 91.1 | 46% | 0.455 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.6 | -37.9 | 175.5 | -27.2 | 37.4 | 0 | 0 | 0 | 113.7 | I36 L37 I43 F44 | I36-P40 WeakPolarHBondContact O-CD 3.47Å; I36-P40 WeakPolarHBondContact O-CG 3.41Å; L37-P40 WeakPolarHBondContact O-CD 3.08Å; P40-I43 PolarHBondContact O-N 2.95Å; P40-F44 VanDerWaalsContact O-CB 3.26Å; P40-F44 WeakPolarHBondContact O-CB 3.25Å; P40-F44 PolarHBondContact O-N 2.86Å |
| 41 | L | 95.2 | Very high | 94.2 | Very high | 108 Ų | 108 | 95 Ų | 95 | 57% | 0.565 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -65.3 | -42.7 | 177.7 | -73.5 | 173.4 | 0 | 0 | 0 | 111.8 | L37 G38 V39 I43 F44 T45 | L37-L41 WeakPolarHBondContact O-CB 3.38Å; L37-L41 WeakPolarHBondContact O-CD1 3.45Å; L37-L41 WeakPolarHBondContact O-CG 3.41Å; L37-L41 PolarHBondContact O-N 3.37Å; G38-L41 PolarHBondContact O-N 2.83Å; V39-L41 VanDerWaalsContact C-N 3.32Å; V39-L41 PolarHBondContact O-N 3.45Å; L41-I43 VanDerWaalsContact C-N 3.35Å; L41-F44 PolarHBondContact O-N 3.31Å; L41-T45 VanDerWaalsContact O-CG2 3.31Å; L41-T45 WeakPolarHBondContact O-CG2 3.46Å; L41-T45 PolarHBondContact O-N 3.3Å; L41-T45 PolarHBondContact O-OG1 3.45Å |
| 42 | I | 94.4 | Very high | 94.2 | Very high | 101 Ų | 101 | 93.7 Ų | 93.7 | 52% | 0.518 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.4 | -43.4 | 175.9 | -66.3 | 163 | 0 | 0 | 0 | 110.6 | G38 V39 T45 I46 | G38-I42 WeakPolarHBondContact O-CD1 3.49Å; G38-I42 VanDerWaalsContact O-CG1 3.25Å; G38-I42 WeakPolarHBondContact O-CG1 3.35Å; G38-I42 PolarHBondContact O-N 3.4Å; V39-I42 PolarHBondContact O-N 2.73Å; I42-T45 WeakPolarHBondContact CA-OG1 3.26Å; I42-T45 PolarHBondContact O-N 3.06Å; I42-T45 PolarHBondContact O-OG1 2.91Å; I42-I46 HydrophobicContact CG2-CD1 3.92Å; I42-I46 VanDerWaalsContact O-CG1 3.26Å; I42-I46 WeakPolarHBondContact O-CG1 3.26Å; I42-I46 PolarHBondContact O-N 3.44Å |
| 43 | I | 94 | Very high | 94.2 | Very high | 102 Ų | 102 | 92 Ų | 92 | 52% | 0.523 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64.4 | -43.4 | 177 | -65.5 | 167.9 | 0 | 0 | 0 | 110.5 | V39 P40 L41 I46 K47 | V39-I43 HydrophobicContact CG1-CD1 3.85Å; V39-I43 WeakPolarHBondContact O-CG1 3.5Å; V39-I43 PolarHBondContact O-N 2.87Å; P40-I43 PolarHBondContact O-N 2.95Å; L41-I43 VanDerWaalsContact C-N 3.35Å; I43-I46 PolarHBondContact O-N 3.17Å; I43-K47 WeakPolarHBondContact O-CB 3.31Å; I43-K47 PolarHBondContact O-N 3.17Å |
| 44 | F | 94.4 | Very high | 94.2 | Very high | 142 Ų | 142 | 95.6 Ų | 95.6 | 62% | 0.623 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -62.7 | -43 | 178.2 | -178.9 | -96.3 | 0 | 0 | 0 | 111.7 | P40 L41 K47 A48 | P40-F44 VanDerWaalsContact O-CB 3.26Å; P40-F44 WeakPolarHBondContact O-CB 3.25Å; P40-F44 PolarHBondContact O-N 2.86Å; L41-F44 PolarHBondContact O-N 3.31Å; F44-K47 PolarHBondContact O-N 3.47Å; F44-A48 HydrophobicContact CE1-CB 4.26Å; F44-A48 WeakPolarHBondContact O-CB 3.29Å; F44-A48 PolarHBondContact O-N 2.97Å |
| 45 | T | 93.7 | Very high | 94.3 | Very high | 81 Ų | 81 | 94.5 Ų | 94.5 | 50% | 0.497 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -67.1 | -41.2 | 178.9 | 54.5 | 0 | 0 | 0 | 0 | 112 | L41 I42 K47 A48 N49 | L41-T45 VanDerWaalsContact O-CG2 3.31Å; L41-T45 WeakPolarHBondContact O-CG2 3.46Å; L41-T45 PolarHBondContact O-N 3.3Å; L41-T45 PolarHBondContact O-OG1 3.45Å; I42-T45 WeakPolarHBondContact CA-OG1 3.26Å; I42-T45 PolarHBondContact O-N 3.06Å; I42-T45 PolarHBondContact O-OG1 2.91Å; T45-K47 VanDerWaalsContact C-N 3.34Å; T45-K47 PolarHBondContact O-N 3.31Å; T45-A48 PolarHBondContact O-N 2.76Å; T45-N49 VanDerWaalsContact O-CB 3.25Å; T45-N49 WeakPolarHBondContact O-CB 3.23Å; T45-N49 PolarHBondContact O-N 2.63Å |
| 46 | I | 93.9 | Very high | 94.4 | Very high | 116 Ų | 116 | 92.4 Ų | 92.4 | 60% | 0.595 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -60.2 | -45.7 | 173.3 | -67.1 | 167.1 | 0 | 0 | 0 | 110.2 | I42 I43 S50 | I42-I46 HydrophobicContact CG2-CD1 3.92Å; I42-I46 VanDerWaalsContact O-CG1 3.26Å; I42-I46 WeakPolarHBondContact O-CG1 3.26Å; I42-I46 PolarHBondContact O-N 3.44Å; I43-I46 PolarHBondContact O-N 3.17Å; I46-S50 PolarHBondContact O-N 3.37Å |
| 47 | K | 93.5 | Very high | 94.5 | Very high | 152 Ų | 152 | 92.5 Ų | 92.5 | 66% | 0.661 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -68.4 | -43.2 | -179.8 | -174.5 | 168.4 | -178 | 168.4 | 0 | 112.6 | I43 F44 T45 N49 S50 C53 | I43-K47 WeakPolarHBondContact O-CB 3.31Å; I43-K47 PolarHBondContact O-N 3.17Å; F44-K47 PolarHBondContact O-N 3.47Å; T45-K47 VanDerWaalsContact C-N 3.34Å; T45-K47 PolarHBondContact O-N 3.31Å; K47-N49 VanDerWaalsContact C-N 3.31Å; K47-N49 PolarHBondContact O-N 2.94Å; K47-S50 VanDerWaalsContact O-CB 3.29Å; K47-S50 WeakPolarHBondContact O-CB 3.17Å; K47-S50 PolarHBondContact O-N 3.49Å; K47-S50 PolarHBondContact O-OG 3.5Å; K47-C53 VanDerWaalsContact O-CB 3.23Å; K47-C53 WeakPolarHBondContact O-CB 3.44Å |
| 48 | A | 92.1 | Very high | 94.6 | Very high | 42 Ų | 42 | 95.2 Ų | 95.2 | 35% | 0.347 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66.6 | -33.3 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | F44 T45 | F44-A48 HydrophobicContact CE1-CB 4.26Å; F44-A48 WeakPolarHBondContact O-CB 3.29Å; F44-A48 PolarHBondContact O-N 2.97Å; T45-A48 PolarHBondContact O-N 2.76Å |
| 49 | N | 92.9 | Very high | 94.8 | Very high | 110 Ų | 110 | 96.7 Ų | 96.7 | 59% | 0.588 | 52% | 0.519 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.5 | -3.5 | 174.9 | -163.9 | 41.2 | 0 | 0 | 0 | 113.5 | T45 K47 | T45-N49 VanDerWaalsContact O-CB 3.25Å; T45-N49 WeakPolarHBondContact O-CB 3.23Å; T45-N49 PolarHBondContact O-N 2.63Å; K47-N49 VanDerWaalsContact C-N 3.31Å; K47-N49 PolarHBondContact O-N 2.94Å |
| 50 | S | 95 | Very high | 95 | Very high | 41 Ų | 41 | 97.6 Ų | 97.6 | 29% | 0.287 | 53% | 0.525 | S | S | . | . | S | Bend | trans | -61.5 | 142.2 | 175.7 | 72 | 0 | 0 | 0 | 0 | 110.3 | I46 K47 A52 C53 R54 | I46-S50 PolarHBondContact O-N 3.37Å; K47-S50 VanDerWaalsContact O-CB 3.29Å; K47-S50 WeakPolarHBondContact O-CB 3.17Å; K47-S50 PolarHBondContact O-N 3.49Å; K47-S50 PolarHBondContact O-OG 3.5Å; S50-A52 VanDerWaalsContact C-N 3.26Å; S50-A52 PolarHBondContact O-N 2.94Å; S50-C53 PolarHBondContact O-N 3.06Å; S50-C53 WeakPolarHBondContact OG-CB 3.36Å; S50-C53 PolarHBondContact OG-N 2.93Å; S50-R54 PolarHBondContact O-N 3.24Å; S50-R54 VanDerWaalsContact O-N 3.11Å |
| 51 | E | 95 | Very high | 95.1 | Very high | 153 Ų | 153 | 98.8 Ų | 98.8 | 72% | 0.715 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -53.3 | -45.6 | 179 | -172.9 | 171 | -168.7 | 0 | 0 | 111.1 | C53 R54 D55 | E51-C53 VanDerWaalsContact C-N 3.31Å; E51-C53 PolarHBondContact O-N 3.11Å; E51-R54 PolarHBondContact O-N 3.01Å; E51-D55 WeakPolarHBondContact O-CB 3.45Å; E51-D55 PolarHBondContact O-N 3.31Å |
| 52 | A | 94.4 | Very high | 95.2 | Very high | 77 Ų | 77 | 99.2 Ų | 99.2 | 64% | 0.636 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -56.7 | -38.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | S50 G56 | S50-A52 VanDerWaalsContact C-N 3.26Å; S50-A52 PolarHBondContact O-N 2.94Å; A52-G56 PolarHBondContact O-N 2.83Å |
| 53 | C | 94.3 | Very high | 95.4 | Very high | 59 Ų | 59 | 98.1 Ų | 98.1 | 40% | 0.399 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -71.7 | -38.4 | 177 | -170.8 | 0 | 0 | 0 | 0 | 111.7 | K47 S50 E51 L57 | K47-C53 VanDerWaalsContact O-CB 3.23Å; K47-C53 WeakPolarHBondContact O-CB 3.44Å; S50-C53 PolarHBondContact O-N 3.06Å; S50-C53 WeakPolarHBondContact OG-CB 3.36Å; S50-C53 PolarHBondContact OG-N 2.93Å; E51-C53 VanDerWaalsContact C-N 3.31Å; E51-C53 PolarHBondContact O-N 3.11Å; C53-L57 WeakPolarHBondContact O-CB 3.25Å; C53-L57 PolarHBondContact O-N 2.93Å |
| 54 | R | 95.3 | Very high | 95.6 | Very high | 159 Ų | 159 | 100.6 Ų | 100.6 | 60% | 0.6 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -69.9 | -40.1 | 178.1 | -65.1 | -173.1 | 86.9 | 166.7 | 4.1 | 111.5 | S50 E51 L57 R58 | S50-R54 PolarHBondContact O-N 3.24Å; S50-R54 VanDerWaalsContact O-N 3.11Å; E51-R54 PolarHBondContact O-N 3.01Å; R54-L57 PolarHBondContact O-N 2.84Å; R54-R58 WeakPolarHBondContact O-CB 3.33Å; R54-R58 PolarHBondContact O-N 3.26Å |
| 55 | D | 96.8 | Very high | 95.7 | Very high | 80 Ų | 80 | 98.7 Ų | 98.7 | 43% | 0.428 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -67.1 | -43.1 | 175.5 | -69.7 | -16 | 0 | 0 | 0 | 111.1 | E51 L57 R58 A59 | E51-D55 WeakPolarHBondContact O-CB 3.45Å; E51-D55 PolarHBondContact O-N 3.31Å; D55-L57 PolarHBondContact O-N 2.88Å; D55-R58 PolarHBondContact O-N 3.37Å; D55-A59 WeakPolarHBondContact O-CB 3.4Å; D55-A59 PolarHBondContact O-N 2.99Å |
| 56 | G | 96.5 | Very high | 95.9 | Very high | 36 Ų | 36 | 99.3 Ų | 99.3 | 37% | 0.371 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -59.3 | -45.1 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | A52 A59 V60 | A52-G56 PolarHBondContact O-N 2.83Å; G56-A59 PolarHBondContact O-N 2.87Å; G56-V60 WeakPolarHBondContact O-CG2 3.16Å; G56-V60 PolarHBondContact O-N 2.97Å |
| 57 | L | 96.3 | Very high | 96.1 | Very high | 115 Ų | 115 | 97.3 Ų | 97.3 | 60% | 0.602 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63.2 | -42.2 | 176.1 | -179.1 | 63.1 | 0 | 0 | 0 | 111.8 | C53 R54 D55 V60 M61 | C53-L57 WeakPolarHBondContact O-CB 3.25Å; C53-L57 PolarHBondContact O-N 2.93Å; R54-L57 PolarHBondContact O-N 2.84Å; D55-L57 PolarHBondContact O-N 2.88Å; L57-V60 PolarHBondContact O-N 3.39Å; L57-M61 WeakPolarHBondContact O-CG 3.37Å; L57-M61 PolarHBondContact O-N 3.47Å |
| 58 | R | 97.3 | Very high | 96.3 | Very high | 160 Ų | 160 | 94.6 Ų | 94.6 | 60% | 0.604 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -61.3 | -47.2 | 175.7 | -178.6 | 177.1 | -63.7 | -176.5 | 2 | 111.1 | R54 D55 V60 M61 E62 | R54-R58 WeakPolarHBondContact O-CB 3.33Å; R54-R58 PolarHBondContact O-N 3.26Å; D55-R58 PolarHBondContact O-N 3.37Å; R58-V60 VanDerWaalsContact C-N 3.31Å; R58-V60 PolarHBondContact O-N 2.88Å; R58-M61 WeakPolarHBondContact O-CB 3.38Å; R58-M61 PolarHBondContact O-N 3.41Å; R58-M61 VanDerWaalsContact O-N 3.12Å; R58-E62 HydrophobicContact CG-CG 4.45Å; R58-E62 WeakPolarHBondContact CG-OE1 3.32Å; R58-E62 WeakPolarHBondContact O-CG 3.48Å; R58-E62 PolarHBondContact O-N 3.37Å |
| 59 | A | 97.1 | Very high | 96.6 | Very high | 53 Ų | 53 | 97.3 Ų | 97.3 | 44% | 0.438 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.6 | -39.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | D55 G56 C63 | D55-A59 WeakPolarHBondContact O-CB 3.4Å; D55-A59 PolarHBondContact O-N 2.99Å; G56-A59 PolarHBondContact O-N 2.87Å; A59-C63 WeakPolarHBondContact O-CB 3.42Å; A59-C63 PolarHBondContact O-N 3.12Å |
| 60 | V | 97.6 | Very high | 96.8 | Very high | 93 Ų | 93 | 97 Ų | 97 | 56% | 0.564 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -63.3 | -43.6 | 173.8 | 169.3 | 0 | 0 | 0 | 0 | 111.3 | G56 L57 R58 C63 R64 | G56-V60 WeakPolarHBondContact O-CG2 3.16Å; G56-V60 PolarHBondContact O-N 2.97Å; L57-V60 PolarHBondContact O-N 3.39Å; R58-V60 VanDerWaalsContact C-N 3.31Å; R58-V60 PolarHBondContact O-N 2.88Å; V60-C63 PolarHBondContact O-N 3.19Å; V60-R64 VanDerWaalsContact O-CB 3.31Å; V60-R64 WeakPolarHBondContact O-CB 3.46Å; V60-R64 PolarHBondContact O-N 3.38Å |
| 61 | M | 97.6 | Very high | 97 | Very high | 95 Ų | 95 | 100.5 Ų | 100.5 | 47% | 0.468 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64.4 | -44.1 | 177.8 | -75.6 | -66.6 | -62.4 | 0 | 0 | 112.2 | L57 R58 R64 N65 | L57-M61 WeakPolarHBondContact O-CG 3.37Å; L57-M61 PolarHBondContact O-N 3.47Å; R58-M61 WeakPolarHBondContact O-CB 3.38Å; R58-M61 PolarHBondContact O-N 3.41Å; R58-M61 VanDerWaalsContact O-N 3.12Å; M61-R64 PolarHBondContact O-N 2.9Å; M61-N65 VanDerWaalsContact O-CG 3.31Å; M61-N65 PolarHBondContact O-N 3.27Å |
| 62 | E | 97.9 | Very high | 97.1 | Very high | 116 Ų | 116 | 98.9 Ų | 98.9 | 54% | 0.542 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.3 | -46.9 | 175.8 | -73 | 173.8 | -173.9 | 0 | 0 | 111.4 | R58 R64 N65 V66 | R58-E62 HydrophobicContact CG-CG 4.45Å; R58-E62 WeakPolarHBondContact CG-OE1 3.32Å; R58-E62 WeakPolarHBondContact O-CG 3.48Å; R58-E62 PolarHBondContact O-N 3.37Å; E62-R64 VanDerWaalsContact C-N 3.3Å; E62-R64 PolarHBondContact O-N 3.43Å; E62-N65 PolarHBondContact O-N 2.95Å; E62-V66 WeakPolarHBondContact O-CG2 3.31Å; E62-V66 PolarHBondContact O-N 2.71Å |
| 63 | C | 97.8 | Very high | 97.3 | Very high | 79 Ų | 79 | 100.1 Ų | 100.1 | 53% | 0.534 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59 | -42.4 | 176.2 | -175.7 | 0 | 0 | 0 | 0 | 111.5 | A59 V60 V66 T67 | A59-C63 WeakPolarHBondContact O-CB 3.42Å; A59-C63 PolarHBondContact O-N 3.12Å; V60-C63 PolarHBondContact O-N 3.19Å; C63-V66 PolarHBondContact O-N 2.96Å; C63-T67 VanDerWaalsContact O-CB 3.32Å; C63-T67 WeakPolarHBondContact O-CB 3.43Å; C63-T67 PolarHBondContact O-N 3.38Å; C63-T67 PolarHBondContact O-OG1 3.47Å |
| 64 | R | 97.9 | Very high | 97.5 | Very high | 153 Ų | 153 | 102.5 Ų | 102.5 | 58% | 0.577 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -64.5 | -42.2 | 176.5 | -173.6 | 178.7 | 178.2 | 176 | 1.8 | 112.2 | V60 M61 E62 T67 H68 | V60-R64 VanDerWaalsContact O-CB 3.31Å; V60-R64 WeakPolarHBondContact O-CB 3.46Å; V60-R64 PolarHBondContact O-N 3.38Å; M61-R64 PolarHBondContact O-N 2.9Å; E62-R64 VanDerWaalsContact C-N 3.3Å; E62-R64 PolarHBondContact O-N 3.43Å; R64-T67 PolarHBondContact O-N 3.28Å; R64-H68 PolarHBondContact NE-NE2 2.96Å; R64-H68 PolarHBondContact O-CD2 3.5Å; R64-H68 VanDerWaalsContact O-CD2 3.27Å; R64-H68 PolarHBondContact O-N 2.85Å |
| 65 | N | 97.1 | Very high | 97.6 | Very high | 102 Ų | 102 | 97.7 Ų | 97.7 | 55% | 0.545 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.4 | -46.7 | 176.7 | -75.2 | -9.6 | 0 | 0 | 0 | 111.3 | M61 E62 H68 L69 | M61-N65 VanDerWaalsContact O-CG 3.31Å; M61-N65 PolarHBondContact O-N 3.27Å; E62-N65 PolarHBondContact O-N 2.95Å; N65-H68 PolarHBondContact O-N 3.43Å; N65-L69 PolarHBondContact O-N 2.86Å; N65-L69 VanDerWaalsContact O-N 3.07Å |
| 66 | V | 97.8 | Very high | 97.7 | Very high | 94 Ų | 94 | 99.5 Ų | 99.5 | 57% | 0.57 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -64.8 | -40.1 | 177 | 175.2 | 0 | 0 | 0 | 0 | 111.3 | E62 C63 H68 L69 L70 | E62-V66 WeakPolarHBondContact O-CG2 3.31Å; E62-V66 PolarHBondContact O-N 2.71Å; C63-V66 PolarHBondContact O-N 2.96Å; V66-H68 PolarHBondContact O-N 3.41Å; V66-L69 PolarHBondContact O-N 3.35Å; V66-L70 WeakPolarHBondContact O-CB 3.28Å; V66-L70 PolarHBondContact O-N 3.45Å |
| 67 | T | 97.8 | Very high | 97.8 | Very high | 75 Ų | 75 | 100 Ų | 100 | 46% | 0.46 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.2 | -42.7 | 177.4 | -58.5 | 0 | 0 | 0 | 0 | 111.3 | C63 R64 L70 Q71 | C63-T67 VanDerWaalsContact O-CB 3.32Å; C63-T67 WeakPolarHBondContact O-CB 3.43Å; C63-T67 PolarHBondContact O-N 3.38Å; C63-T67 PolarHBondContact O-OG1 3.47Å; R64-T67 PolarHBondContact O-N 3.28Å; T67-L70 PolarHBondContact O-N 3.4Å; T67-Q71 VanDerWaalsContact O-CB 3.32Å; T67-Q71 WeakPolarHBondContact O-CB 3.4Å; T67-Q71 PolarHBondContact O-N 3.14Å |
| 68 | H | 97.7 | Very high | 97.9 | Very high | 95 Ų | 95 | 100.1 Ų | 100.1 | 44% | 0.44 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.5 | -42.9 | 175.8 | -82.7 | -55.5 | 0 | 0 | 0 | 112.2 | R64 N65 V66 Q71 Q72 | R64-H68 PolarHBondContact NE-NE2 2.96Å; R64-H68 PolarHBondContact O-CD2 3.5Å; R64-H68 VanDerWaalsContact O-CD2 3.27Å; R64-H68 PolarHBondContact O-N 2.85Å; N65-H68 PolarHBondContact O-N 3.43Å; V66-H68 PolarHBondContact O-N 3.41Å; H68-Q71 PolarHBondContact O-N 3.4Å; H68-Q72 PolarHBondContact O-N 3.37Å |
| 69 | L | 97.8 | Very high | 97.9 | Very high | 99 Ų | 99 | 98.8 Ų | 98.8 | 52% | 0.518 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.6 | -47.9 | 175.9 | -175.8 | 67.1 | 0 | 0 | 0 | 111.1 | N65 V66 Q71 Q72 E73 | N65-L69 PolarHBondContact O-N 2.86Å; N65-L69 VanDerWaalsContact O-N 3.07Å; V66-L69 PolarHBondContact O-N 3.35Å; L69-Q71 VanDerWaalsContact C-N 3.33Å; L69-Q71 PolarHBondContact O-N 3.07Å; L69-Q72 WeakPolarHBondContact O-CB 3.39Å; L69-Q72 PolarHBondContact O-N 2.9Å; L69-Q72 VanDerWaalsContact O-N 3.14Å; L69-E73 WeakPolarHBondContact O-CG 3.4Å; L69-E73 PolarHBondContact O-N 3.39Å |
| 70 | L | 98.2 | Very high | 98 | Very high | 102 Ų | 102 | 98 Ų | 98 | 53% | 0.534 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.7 | -40.2 | 179 | -174.5 | 64.4 | 0 | 0 | 0 | 111.9 | V66 T67 Q72 E73 L74 | V66-L70 WeakPolarHBondContact O-CB 3.28Å; V66-L70 PolarHBondContact O-N 3.45Å; T67-L70 PolarHBondContact O-N 3.4Å; L70-Q72 VanDerWaalsContact C-N 3.29Å; L70-Q72 PolarHBondContact O-N 2.88Å; L70-E73 PolarHBondContact O-N 3.01Å; L70-L74 HydrophobicContact CG-CD1 4.2Å; L70-L74 HydrophobicContact CG-CG 4.47Å; L70-L74 WeakPolarHBondContact O-CB 3.06Å; L70-L74 VanDerWaalsContact O-CG 3.28Å; L70-L74 WeakPolarHBondContact O-CG 3.29Å; L70-L74 PolarHBondContact O-N 2.93Å |
| 71 | Q | 98.2 | Very high | 98 | Very high | 115 Ų | 115 | 100.7 Ų | 100.7 | 54% | 0.537 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.6 | -38.9 | 175.6 | -176 | 178.9 | -11.7 | 0 | 0 | 111.5 | T67 H68 L69 T75 | T67-Q71 VanDerWaalsContact O-CB 3.32Å; T67-Q71 WeakPolarHBondContact O-CB 3.4Å; T67-Q71 PolarHBondContact O-N 3.14Å; H68-Q71 PolarHBondContact O-N 3.4Å; L69-Q71 VanDerWaalsContact C-N 3.33Å; L69-Q71 PolarHBondContact O-N 3.07Å; Q71-T75 VanDerWaalsContact O-CB 3.27Å; Q71-T75 WeakPolarHBondContact O-CB 3.32Å; Q71-T75 PolarHBondContact O-N 2.87Å; Q71-T75 PolarHBondContact O-OG1 2.88Å |
| 72 | Q | 98.2 | Very high | 98 | Very high | 119 Ų | 119 | 101.2 Ų | 101.2 | 56% | 0.556 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -64.5 | -50.4 | 175.1 | -179.2 | 179.1 | -18.6 | 0 | 0 | 111.2 | H68 L69 L70 L74 T75 E76 | H68-Q72 PolarHBondContact O-N 3.37Å; L69-Q72 WeakPolarHBondContact O-CB 3.39Å; L69-Q72 PolarHBondContact O-N 2.9Å; L69-Q72 VanDerWaalsContact O-N 3.14Å; L70-Q72 VanDerWaalsContact C-N 3.29Å; L70-Q72 PolarHBondContact O-N 2.88Å; Q72-L74 PolarHBondContact O-N 3.3Å; Q72-T75 WeakPolarHBondContact O-CB 3.4Å; Q72-T75 PolarHBondContact O-N 3.44Å; Q72-T75 VanDerWaalsContact O-N 3.11Å; Q72-E76 PolarHBondContact O-N 3.42Å |
| 73 | E | 97.9 | Very high | 98 | Very high | 104 Ų | 104 | 101.1 Ų | 101.1 | 49% | 0.486 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -57.9 | -44.8 | 177.9 | -70.2 | -70.2 | 172.2 | 0 | 0 | 111.9 | L69 L70 T75 E76 A77 | L69-E73 WeakPolarHBondContact O-CG 3.4Å; L69-E73 PolarHBondContact O-N 3.39Å; L70-E73 PolarHBondContact O-N 3.01Å; E73-T75 VanDerWaalsContact C-N 3.33Å; E73-T75 PolarHBondContact O-N 3.11Å; E73-E76 PolarHBondContact O-N 2.84Å; E73-A77 WeakPolarHBondContact O-CB 3.27Å; E73-A77 PolarHBondContact O-N 3.4Å |
| 74 | L | 98.4 | Very high | 98.1 | Very high | 108 Ų | 108 | 101.3 Ų | 101.3 | 57% | 0.565 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -63.7 | -39.4 | 175.9 | -72.9 | 174.8 | 0 | 0 | 0 | 112.1 | L70 Q72 E76 Q78 | L70-L74 HydrophobicContact CG-CD1 4.2Å; L70-L74 HydrophobicContact CG-CG 4.47Å; L70-L74 WeakPolarHBondContact O-CB 3.06Å; L70-L74 VanDerWaalsContact O-CG 3.28Å; L70-L74 WeakPolarHBondContact O-CG 3.29Å; L70-L74 PolarHBondContact O-N 2.93Å; Q72-L74 PolarHBondContact O-N 3.3Å; L74-E76 VanDerWaalsContact C-N 3.34Å; L74-Q78 VanDerWaalsContact O-CB 3.29Å; L74-Q78 WeakPolarHBondContact O-CB 3.33Å; L74-Q78 PolarHBondContact O-N 2.85Å |
| 75 | T | 98.1 | Very high | 98.1 | Very high | 58 Ų | 58 | 100.8 Ų | 100.8 | 36% | 0.356 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -67 | -38 | 177.8 | -62 | 0 | 0 | 0 | 0 | 111.3 | Q71 Q72 E73 K79 | Q71-T75 VanDerWaalsContact O-CB 3.27Å; Q71-T75 WeakPolarHBondContact O-CB 3.32Å; Q71-T75 PolarHBondContact O-N 2.87Å; Q71-T75 PolarHBondContact O-OG1 2.88Å; Q72-T75 WeakPolarHBondContact O-CB 3.4Å; Q72-T75 PolarHBondContact O-N 3.44Å; Q72-T75 VanDerWaalsContact O-N 3.11Å; E73-T75 VanDerWaalsContact C-N 3.33Å; E73-T75 PolarHBondContact O-N 3.11Å; T75-K79 VanDerWaalsContact CG2-NZ 3.28Å; T75-K79 WeakPolarHBondContact O-CG 3.43Å; T75-K79 PolarHBondContact O-N 3Å; T75-K79 VanDerWaalsContact O-N 3.11Å |
| 76 | E | 98.4 | Very high | 98.1 | Very high | 119 Ų | 119 | 98.5 Ų | 98.5 | 56% | 0.556 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -69.7 | -46.2 | 175.9 | -173.7 | 166.5 | 175.2 | 0 | 0 | 111.4 | Q72 E73 L74 Q78 K79 G80 | Q72-E76 PolarHBondContact O-N 3.42Å; E73-E76 PolarHBondContact O-N 2.84Å; L74-E76 VanDerWaalsContact C-N 3.34Å; E76-Q78 VanDerWaalsContact C-N 3.33Å; E76-Q78 PolarHBondContact O-N 3.01Å; E76-K79 PolarHBondContact O-N 2.7Å; E76-G80 PolarHBondContact O-N 3.11Å |
| 77 | A | 98.1 | Very high | 98.1 | Very high | 46 Ų | 46 | 100.2 Ų | 100.2 | 38% | 0.38 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -57.7 | -44.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | E73 K79 G80 F81 | E73-A77 WeakPolarHBondContact O-CB 3.27Å; E73-A77 PolarHBondContact O-N 3.4Å; A77-K79 PolarHBondContact O-N 3.49Å; A77-G80 PolarHBondContact O-N 3.41Å; A77-F81 HydrophobicContact CB-CE2 4.44Å; A77-F81 WeakPolarHBondContact O-CD2 3.33Å; A77-F81 PolarHBondContact O-N 3.46Å |
| 78 | Q | 98.3 | Very high | 98.2 | Very high | 117 Ų | 117 | 99.3 Ų | 99.3 | 55% | 0.547 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.7 | -41.8 | 176.7 | -176.9 | 178.6 | -21.5 | 0 | 0 | 112.2 | L74 E76 F81 Q82 | L74-Q78 VanDerWaalsContact O-CB 3.29Å; L74-Q78 WeakPolarHBondContact O-CB 3.33Å; L74-Q78 PolarHBondContact O-N 2.85Å; E76-Q78 VanDerWaalsContact C-N 3.33Å; E76-Q78 PolarHBondContact O-N 3.01Å; Q78-F81 PolarHBondContact O-N 2.87Å; Q78-Q82 WeakPolarHBondContact O-CG 3.37Å; Q78-Q82 PolarHBondContact O-N 3.44Å |
| 79 | K | 98.4 | Very high | 98.2 | Very high | 133 Ų | 133 | 97.8 Ų | 97.8 | 58% | 0.578 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63.3 | -43.2 | 174 | -74.6 | -170.5 | -173 | 92.4 | 0 | 111.5 | T75 E76 A77 F81 Q82 D83 | T75-K79 VanDerWaalsContact CG2-NZ 3.28Å; T75-K79 WeakPolarHBondContact O-CG 3.43Å; T75-K79 PolarHBondContact O-N 3Å; T75-K79 VanDerWaalsContact O-N 3.11Å; E76-K79 PolarHBondContact O-N 2.7Å; A77-K79 PolarHBondContact O-N 3.49Å; K79-F81 PolarHBondContact O-N 3.17Å; K79-Q82 PolarHBondContact O-N 3.28Å; K79-D83 PolarHBondContact O-N 2.87Å |
| 80 | G | 98.2 | Very high | 98.2 | Very high | 36 Ų | 36 | 97.4 Ų | 97.4 | 37% | 0.371 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -59.6 | -43.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | E76 A77 D83 V84 | E76-G80 PolarHBondContact O-N 3.11Å; A77-G80 PolarHBondContact O-N 3.41Å; G80-D83 PolarHBondContact O-N 3.36Å; G80-V84 WeakPolarHBondContact O-CG2 3.39Å; G80-V84 PolarHBondContact O-N 3.21Å |
| 81 | F | 98 | Very high | 98.2 | Very high | 149 Ų | 149 | 96 Ų | 96 | 65% | 0.654 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -62.7 | -42.2 | 175.3 | -78.6 | -61.8 | 0 | 0 | 0 | 112.6 | A77 Q78 K79 V84 E85 | A77-F81 HydrophobicContact CB-CE2 4.44Å; A77-F81 WeakPolarHBondContact O-CD2 3.33Å; A77-F81 PolarHBondContact O-N 3.46Å; Q78-F81 PolarHBondContact O-N 2.87Å; K79-F81 PolarHBondContact O-N 3.17Å; F81-V84 PolarHBondContact O-N 2.98Å; F81-E85 WeakPolarHBondContact O-CB 3.35Å; F81-E85 PolarHBondContact O-N 2.95Å |
| 82 | Q | 98.3 | Very high | 98.2 | Very high | 107 Ų | 107 | 95.3 Ų | 95.3 | 50% | 0.5 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.7 | -38.8 | 177.2 | -74.1 | 178.8 | -5.5 | 0 | 0 | 112.5 | Q78 K79 E85 A86 | Q78-Q82 WeakPolarHBondContact O-CG 3.37Å; Q78-Q82 PolarHBondContact O-N 3.44Å; K79-Q82 PolarHBondContact O-N 3.28Å; Q82-E85 PolarHBondContact O-N 3.01Å; Q82-A86 WeakPolarHBondContact O-CB 3.33Å; Q82-A86 PolarHBondContact O-N 3.42Å |
| 83 | D | 98.2 | Very high | 98.2 | Very high | 114 Ų | 114 | 96.2 Ų | 96.2 | 61% | 0.61 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -65.1 | -45.3 | 176 | -172.2 | 64.3 | 0 | 0 | 0 | 111.5 | K79 G80 E85 A86 Q87 | K79-D83 PolarHBondContact O-N 2.87Å; G80-D83 PolarHBondContact O-N 3.36Å; D83-E85 VanDerWaalsContact C-N 3.35Å; D83-E85 PolarHBondContact O-N 3.47Å; D83-A86 PolarHBondContact O-N 2.92Å; D83-Q87 WeakPolarHBondContact O-CB 3.39Å; D83-Q87 PolarHBondContact O-N 3.38Å |
| 84 | V | 98.2 | Very high | 98.2 | Very high | 83 Ų | 83 | 94.4 Ų | 94.4 | 50% | 0.503 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.2 | -40.3 | 175.3 | 171.9 | 0 | 0 | 0 | 0 | 111.5 | G80 F81 Q87 A88 | G80-V84 WeakPolarHBondContact O-CG2 3.39Å; G80-V84 PolarHBondContact O-N 3.21Å; F81-V84 PolarHBondContact O-N 2.98Å; V84-Q87 PolarHBondContact O-N 3.3Å; V84-A88 VanDerWaalsContact O-CB 3.29Å; V84-A88 WeakPolarHBondContact O-CB 3.38Å; V84-A88 PolarHBondContact O-N 3.37Å |
| 85 | E | 98.3 | Very high | 98.3 | Very high | 141 Ų | 141 | 92.5 Ų | 92.5 | 66% | 0.659 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -63.6 | -44.4 | 176.1 | -174.3 | 176.1 | -173 | 0 | 0 | 111.4 | F81 Q82 D83 Q87 A88 A89 | F81-E85 WeakPolarHBondContact O-CB 3.35Å; F81-E85 PolarHBondContact O-N 2.95Å; Q82-E85 PolarHBondContact O-N 3.01Å; D83-E85 VanDerWaalsContact C-N 3.35Å; D83-E85 PolarHBondContact O-N 3.47Å; E85-Q87 PolarHBondContact O-N 2.82Å; E85-A88 PolarHBondContact O-N 2.86Å; E85-A89 WeakPolarHBondContact O-CB 3.29Å; E85-A89 PolarHBondContact O-N 3Å |
| 86 | A | 98 | Very high | 98.3 | Very high | 54 Ų | 54 | 95.6 Ų | 95.6 | 45% | 0.446 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.8 | -40.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q82 D83 A89 T90 | Q82-A86 WeakPolarHBondContact O-CB 3.33Å; Q82-A86 PolarHBondContact O-N 3.42Å; D83-A86 PolarHBondContact O-N 2.92Å; A86-A89 PolarHBondContact O-N 2.98Å; A86-T90 WeakPolarHBondContact O-CB 3.48Å; A86-T90 PolarHBondContact O-N 2.92Å; A86-T90 PolarHBondContact O-OG1 2.87Å |
| 87 | Q | 98.3 | Very high | 98.3 | Very high | 130 Ų | 130 | 92.3 Ų | 92.3 | 61% | 0.607 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -64.8 | -43 | 174.4 | -173 | 179.6 | 50.8 | 0 | 0 | 111.5 | D83 V84 E85 T90 C91 | D83-Q87 WeakPolarHBondContact O-CB 3.39Å; D83-Q87 PolarHBondContact O-N 3.38Å; V84-Q87 PolarHBondContact O-N 3.3Å; E85-Q87 PolarHBondContact O-N 2.82Å; Q87-T90 PolarHBondContact O-N 3.5Å; Q87-C91 VanDerWaalsContact O-CB 3.32Å; Q87-C91 WeakPolarHBondContact O-CB 3.37Å; Q87-C91 PolarHBondContact O-N 3.45Å |
| 88 | A | 98.3 | Very high | 98.3 | Very high | 57 Ų | 57 | 95.5 Ų | 95.5 | 47% | 0.471 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -63.3 | -41.6 | 177 | 0 | 0 | 0 | 0 | 0 | 111.7 | V84 E85 C91 N92 | V84-A88 VanDerWaalsContact O-CB 3.29Å; V84-A88 WeakPolarHBondContact O-CB 3.38Å; V84-A88 PolarHBondContact O-N 3.37Å; E85-A88 PolarHBondContact O-N 2.86Å; A88-C91 PolarHBondContact O-N 3.31Å; A88-N92 WeakPolarHBondContact O-CB 3.49Å; A88-N92 PolarHBondContact O-N 3.46Å |
| 89 | A | 98 | Very high | 98.3 | Very high | 62 Ų | 62 | 95.5 Ų | 95.5 | 51% | 0.512 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -62.2 | -43.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | E85 A86 N92 H93 | E85-A89 WeakPolarHBondContact O-CB 3.29Å; E85-A89 PolarHBondContact O-N 3Å; A86-A89 PolarHBondContact O-N 2.98Å; A89-N92 PolarHBondContact O-N 3.33Å; A89-H93 PolarHBondContact O-N 2.86Å |
| 90 | T | 98.2 | Very high | 98.3 | Very high | 92 Ų | 92 | 92.2 Ų | 92.2 | 56% | 0.564 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -63.7 | -42.9 | 176.4 | -57.1 | 0 | 0 | 0 | 0 | 111.7 | A86 Q87 H93 T94 | A86-T90 WeakPolarHBondContact O-CB 3.48Å; A86-T90 PolarHBondContact O-N 2.92Å; A86-T90 PolarHBondContact O-OG1 2.87Å; Q87-T90 PolarHBondContact O-N 3.5Å; T90-H93 PolarHBondContact O-N 3.16Å; T90-T94 WeakPolarHBondContact O-CB 3.48Å; T90-T94 PolarHBondContact O-N 3.46Å; T90-T94 PolarHBondContact O-OG1 3.43Å |
| 91 | C | 98.5 | Very high | 98.3 | Very high | 73 Ų | 73 | 94 Ų | 94 | 49% | 0.493 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -61.5 | -47.5 | 175.8 | -177.5 | 0 | 0 | 0 | 0 | 111.1 | Q87 A88 H93 T94 V95 | Q87-C91 VanDerWaalsContact O-CB 3.32Å; Q87-C91 WeakPolarHBondContact O-CB 3.37Å; Q87-C91 PolarHBondContact O-N 3.45Å; A88-C91 PolarHBondContact O-N 3.31Å; C91-H93 PolarHBondContact O-N 3.24Å; C91-T94 WeakPolarHBondContact O-CB 3.4Å; C91-T94 PolarHBondContact O-N 2.83Å; C91-T94 VanDerWaalsContact O-N 3.16Å; C91-V95 WeakPolarHBondContact O-CG2 3.46Å; C91-V95 PolarHBondContact O-N 2.83Å |
| 92 | N | 98.3 | Very high | 98.4 | Very high | 99 Ų | 99 | 92 Ų | 92 | 53% | 0.529 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -58.2 | -49.6 | 177.6 | -171.1 | -37.9 | 0 | 0 | 0 | 111.3 | A88 A89 T94 V95 M96 | A88-N92 WeakPolarHBondContact O-CB 3.49Å; A88-N92 PolarHBondContact O-N 3.46Å; A89-N92 PolarHBondContact O-N 3.33Å; N92-T94 VanDerWaalsContact C-N 3.29Å; N92-T94 PolarHBondContact O-N 3.38Å; N92-V95 PolarHBondContact O-N 3.3Å; N92-M96 WeakPolarHBondContact O-CG 3.32Å; N92-M96 PolarHBondContact O-N 3.21Å |
| 93 | H | 98.2 | Very high | 98.4 | Very high | 139 Ų | 139 | 91.9 Ų | 91.9 | 64% | 0.644 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -58.2 | -42.2 | 176.2 | -172.9 | -71.7 | 0 | 0 | 0 | 112.2 | A89 T90 C91 M96 A97 | A89-H93 PolarHBondContact O-N 2.86Å; T90-H93 PolarHBondContact O-N 3.16Å; C91-H93 PolarHBondContact O-N 3.24Å; H93-M96 PolarHBondContact O-N 2.95Å; H93-A97 WeakPolarHBondContact O-CB 3.48Å; H93-A97 PolarHBondContact O-N 3.4Å |
| 94 | T | 98.5 | Very high | 98.4 | Very high | 66 Ų | 66 | 89.4 Ų | 89.4 | 41% | 0.405 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.7 | -46.5 | 178.1 | -58.3 | 0 | 0 | 0 | 0 | 111.2 | T90 C91 N92 M96 A97 L98 | T90-T94 WeakPolarHBondContact O-CB 3.48Å; T90-T94 PolarHBondContact O-N 3.46Å; T90-T94 PolarHBondContact O-OG1 3.43Å; C91-T94 WeakPolarHBondContact O-CB 3.4Å; C91-T94 PolarHBondContact O-N 2.83Å; C91-T94 VanDerWaalsContact O-N 3.16Å; N92-T94 VanDerWaalsContact C-N 3.29Å; N92-T94 PolarHBondContact O-N 3.38Å; T94-M96 VanDerWaalsContact C-N 3.33Å; T94-M96 PolarHBondContact O-N 3.47Å; T94-A97 PolarHBondContact O-N 2.86Å; T94-L98 HydrophobicContact CG2-CD1 3.59Å; T94-L98 WeakPolarHBondContact O-CD1 3.49Å; T94-L98 PolarHBondContact O-N 3.32Å |
| 95 | V | 98.6 | Very high | 98.4 | Very high | 67 Ų | 67 | 91.5 Ų | 91.5 | 41% | 0.406 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -60.2 | -43.6 | 176.9 | 169.8 | 0 | 0 | 0 | 0 | 111.1 | C91 N92 A97 L98 M99 | C91-V95 WeakPolarHBondContact O-CG2 3.46Å; C91-V95 PolarHBondContact O-N 2.83Å; N92-V95 PolarHBondContact O-N 3.3Å; V95-A97 PolarHBondContact O-N 2.99Å; V95-L98 PolarHBondContact O-N 2.99Å; V95-M99 HydrophobicContact CG1-CE 3.89Å; V95-M99 HydrophobicContact CG1-CG 4.46Å; V95-M99 HydrophobicContact CG1-SD 4.3Å; V95-M99 WeakPolarHBondContact O-CB 3.41Å; V95-M99 WeakPolarHBondContact O-CG 3.45Å; V95-M99 PolarHBondContact O-N 3.06Å |
| 96 | M | 98.3 | Very high | 98.4 | Very high | 123 Ų | 123 | 91 Ų | 91 | 61% | 0.606 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -61.5 | -43.3 | 175.9 | -72.3 | -172.9 | 70.2 | 0 | 0 | 112.1 | N92 H93 T94 M99 A100 | N92-M96 WeakPolarHBondContact O-CG 3.32Å; N92-M96 PolarHBondContact O-N 3.21Å; H93-M96 PolarHBondContact O-N 2.95Å; T94-M96 VanDerWaalsContact C-N 3.33Å; T94-M96 PolarHBondContact O-N 3.47Å; M96-M99 PolarHBondContact O-N 3.41Å; M96-A100 WeakPolarHBondContact O-CB 3.39Å; M96-A100 PolarHBondContact O-N 2.79Å |
| 97 | A | 98.4 | Very high | 98.4 | Very high | 51 Ų | 51 | 91 Ų | 91 | 42% | 0.421 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.5 | -41.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | H93 T94 V95 A100 S101 | H93-A97 WeakPolarHBondContact O-CB 3.48Å; H93-A97 PolarHBondContact O-N 3.4Å; T94-A97 PolarHBondContact O-N 2.86Å; V95-A97 PolarHBondContact O-N 2.99Å; A97-A100 PolarHBondContact O-N 3.46Å; A97-S101 WeakPolarHBondContact O-CB 3.39Å; A97-S101 PolarHBondContact O-N 2.91Å |
| 98 | L | 98.7 | Very high | 98.4 | Very high | 113 Ų | 113 | 90.2 Ų | 90.2 | 59% | 0.592 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -64.5 | -43 | 175.4 | -92.6 | 80.5 | 0 | 0 | 0 | 111.7 | T94 V95 S101 L102 | T94-L98 HydrophobicContact CG2-CD1 3.59Å; T94-L98 WeakPolarHBondContact O-CD1 3.49Å; T94-L98 PolarHBondContact O-N 3.32Å; V95-L98 PolarHBondContact O-N 2.99Å; L98-S101 PolarHBondContact O-N 2.85Å; L98-L102 VanDerWaalsContact O-CB 3.27Å; L98-L102 WeakPolarHBondContact O-CB 3.27Å; L98-L102 PolarHBondContact O-N 3.48Å |
| 99 | M | 98.6 | Very high | 98.4 | Very high | 117 Ų | 117 | 89 Ų | 89 | 58% | 0.576 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -60.3 | -47.8 | 176.1 | -77.3 | -176 | 177.1 | 0 | 0 | 111.2 | V95 M96 S101 L102 D103 | V95-M99 HydrophobicContact CG1-CE 3.89Å; V95-M99 HydrophobicContact CG1-CG 4.46Å; V95-M99 HydrophobicContact CG1-SD 4.3Å; V95-M99 WeakPolarHBondContact O-CB 3.41Å; V95-M99 WeakPolarHBondContact O-CG 3.45Å; V95-M99 PolarHBondContact O-N 3.06Å; M96-M99 PolarHBondContact O-N 3.41Å; M99-S101 VanDerWaalsContact C-N 3.34Å; M99-S101 PolarHBondContact O-N 2.86Å; M99-L102 PolarHBondContact O-N 3.35Å; M99-D103 PolarHBondContact O-N 2.95Å |
| 100 | A | 98.4 | Very high | 98.5 | Very high | 63 Ų | 63 | 92 Ų | 92 | 52% | 0.521 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.4 | -41.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | M96 A97 A104 | M96-A100 WeakPolarHBondContact O-CB 3.39Å; M96-A100 PolarHBondContact O-N 2.79Å; A97-A100 PolarHBondContact O-N 3.46Å; A100-A104 WeakPolarHBondContact O-CB 3.07Å; A100-A104 PolarHBondContact O-N 3.24Å |
| 101 | S | 98.4 | Very high | 98.5 | Very high | 74 Ų | 74 | 94.6 Ų | 94.6 | 52% | 0.517 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -65.8 | -41.9 | 175.9 | -170.1 | 0 | 0 | 0 | 0 | 112 | A97 L98 M99 A104 E105 | A97-S101 WeakPolarHBondContact O-CB 3.39Å; A97-S101 PolarHBondContact O-N 2.91Å; L98-S101 PolarHBondContact O-N 2.85Å; M99-S101 VanDerWaalsContact C-N 3.34Å; M99-S101 PolarHBondContact O-N 2.86Å; S101-A104 PolarHBondContact O-N 3.4Å; S101-E105 WeakPolarHBondContact O-CB 3.18Å; S101-E105 PolarHBondContact O-N 3.48Å |
| 102 | L | 98.7 | Very high | 98.5 | Very high | 108 Ų | 108 | 96.4 Ų | 96.4 | 57% | 0.565 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -64.7 | -42.4 | 178.9 | -178.4 | 64.4 | 0 | 0 | 0 | 111.3 | L98 M99 E105 K106 | L98-L102 VanDerWaalsContact O-CB 3.27Å; L98-L102 WeakPolarHBondContact O-CB 3.27Å; L98-L102 PolarHBondContact O-N 3.48Å; M99-L102 PolarHBondContact O-N 3.35Å; L102-E105 PolarHBondContact O-N 2.84Å; L102-K106 WeakPolarHBondContact O-CB 3.4Å; L102-K106 PolarHBondContact O-N 3.44Å |
| 103 | D | 98.6 | Very high | 98.5 | Very high | 104 Ų | 104 | 96.2 Ų | 96.2 | 56% | 0.556 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -64.6 | -41.6 | 176.6 | -75.7 | -26.3 | 0 | 0 | 0 | 111.6 | M99 K106 A107 | M99-D103 PolarHBondContact O-N 2.95Å; D103-K106 PolarHBondContact O-N 2.88Å; D103-A107 WeakPolarHBondContact O-CB 3.36Å; D103-A107 PolarHBondContact O-N 2.93Å |
| 104 | A | 98.5 | Very high | 98.5 | Very high | 61 Ų | 61 | 96.5 Ų | 96.5 | 50% | 0.504 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.3 | -45.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | A100 S101 A107 Q108 | A100-A104 WeakPolarHBondContact O-CB 3.07Å; A100-A104 PolarHBondContact O-N 3.24Å; S101-A104 PolarHBondContact O-N 3.4Å; A104-A107 PolarHBondContact O-N 3.38Å; A104-Q108 WeakPolarHBondContact O-CB 3.34Å; A104-Q108 PolarHBondContact O-N 2.91Å |
| 105 | E | 98.4 | Very high | 98.5 | Very high | 127 Ų | 127 | 98.6 Ų | 98.6 | 59% | 0.593 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -64.9 | -41.5 | 177.6 | -169.3 | -174.9 | 163.4 | 0 | 0 | 111.2 | S101 L102 Q108 G109 | S101-E105 WeakPolarHBondContact O-CB 3.18Å; S101-E105 PolarHBondContact O-N 3.48Å; L102-E105 PolarHBondContact O-N 2.84Å; E105-Q108 PolarHBondContact O-N 3.46Å; E105-G109 PolarHBondContact O-N 2.96Å |
| 106 | K | 98.5 | Very high | 98.5 | Very high | 130 Ų | 130 | 100.1 Ų | 100.1 | 57% | 0.565 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -62.3 | -45.9 | 175.5 | -177 | 179.7 | 178.4 | -179.1 | 0 | 111.6 | L102 D103 Q108 G109 Q110 | L102-K106 WeakPolarHBondContact O-CB 3.4Å; L102-K106 PolarHBondContact O-N 3.44Å; D103-K106 PolarHBondContact O-N 2.88Å; K106-Q108 VanDerWaalsContact C-N 3.33Å; K106-Q108 PolarHBondContact O-N 3.39Å; K106-G109 PolarHBondContact O-N 3.18Å; K106-Q110 WeakPolarHBondContact O-CG 3.45Å; K106-Q110 PolarHBondContact O-N 3.4Å |
| 107 | A | 98.4 | Very high | 98.5 | Very high | 55 Ų | 55 | 100.3 Ų | 100.3 | 46% | 0.455 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -62 | -42 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | D103 A104 Q110 K111 | D103-A107 WeakPolarHBondContact O-CB 3.36Å; D103-A107 PolarHBondContact O-N 2.93Å; A104-A107 PolarHBondContact O-N 3.38Å; A107-Q110 PolarHBondContact O-N 3.48Å; A107-K111 PolarHBondContact O-N 3.06Å |
| 108 | Q | 98.6 | Very high | 98.5 | Very high | 113 Ų | 113 | 99.4 Ų | 99.4 | 53% | 0.528 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -64.2 | -42.9 | 174.9 | -173.7 | -176.9 | 5.6 | 0 | 0 | 111.9 | A104 E105 K106 K111 K112 | A104-Q108 WeakPolarHBondContact O-CB 3.34Å; A104-Q108 PolarHBondContact O-N 2.91Å; E105-Q108 PolarHBondContact O-N 3.46Å; K106-Q108 VanDerWaalsContact C-N 3.33Å; K106-Q108 PolarHBondContact O-N 3.39Å; Q108-K111 PolarHBondContact O-N 3.48Å; Q108-K112 WeakPolarHBondContact O-CG 3.39Å; Q108-K112 PolarHBondContact O-N 3.04Å |
| 109 | G | 98.4 | Very high | 98.5 | Very high | 32 Ų | 32 | 99.6 Ų | 99.6 | 33% | 0.33 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.4 | -46.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | E105 K106 K111 K112 V113 | E105-G109 PolarHBondContact O-N 2.96Å; K106-G109 PolarHBondContact O-N 3.18Å; G109-K111 PolarHBondContact O-N 3.32Å; G109-K112 PolarHBondContact O-N 2.96Å; G109-V113 WeakPolarHBondContact O-CG2 3.07Å; G109-V113 PolarHBondContact O-N 3.44Å |
| 110 | Q | 98.5 | Very high | 98.5 | Very high | 125 Ų | 125 | 99.4 Ų | 99.4 | 58% | 0.584 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -60.2 | -44.3 | 175.9 | -75.6 | -177 | -53.2 | 0 | 0 | 112.1 | K106 A107 K112 V113 E114 | K106-Q110 WeakPolarHBondContact O-CG 3.45Å; K106-Q110 PolarHBondContact O-N 3.4Å; A107-Q110 PolarHBondContact O-N 3.48Å; Q110-K112 VanDerWaalsContact C-N 3.32Å; Q110-K112 PolarHBondContact O-N 2.87Å; Q110-V113 PolarHBondContact O-N 3.27Å; Q110-E114 PolarHBondContact O-N 2.78Å |
| 111 | K | 98.4 | Very high | 98.5 | Very high | 147 Ų | 147 | 100.1 Ų | 100.1 | 64% | 0.639 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -59.7 | -42.6 | 176.8 | -174.4 | 178.3 | 178.7 | -178.7 | 0 | 112.2 | A107 Q108 G109 E114 E115 | A107-K111 PolarHBondContact O-N 3.06Å; Q108-K111 PolarHBondContact O-N 3.48Å; G109-K111 PolarHBondContact O-N 3.32Å; K111-E114 PolarHBondContact O-N 2.93Å; K111-E115 WeakPolarHBondContact O-CB 3.47Å; K111-E115 PolarHBondContact O-N 2.99Å |
| 112 | K | 98.4 | Very high | 98.5 | Very high | 110 Ų | 110 | 100.3 Ų | 100.3 | 48% | 0.478 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64.5 | -40.7 | 176.1 | -72.7 | 178.7 | 179.8 | 178.2 | 0 | 111.8 | Q108 G109 Q110 E115 L116 | Q108-K112 WeakPolarHBondContact O-CG 3.39Å; Q108-K112 PolarHBondContact O-N 3.04Å; G109-K112 PolarHBondContact O-N 2.96Å; Q110-K112 VanDerWaalsContact C-N 3.32Å; Q110-K112 PolarHBondContact O-N 2.87Å; K112-E115 PolarHBondContact O-N 3.43Å; K112-L116 WeakPolarHBondContact O-CB 3.37Å; K112-L116 WeakPolarHBondContact O-CD1 3.34Å; K112-L116 PolarHBondContact O-N 2.97Å |
| 113 | V | 98.6 | Very high | 98.5 | Very high | 96 Ų | 96 | 100.9 Ų | 100.9 | 58% | 0.582 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -61.6 | -46 | 177.1 | 170.1 | 0 | 0 | 0 | 0 | 110.7 | G109 Q110 E115 L116 E117 | G109-V113 WeakPolarHBondContact O-CG2 3.07Å; G109-V113 PolarHBondContact O-N 3.44Å; Q110-V113 PolarHBondContact O-N 3.27Å; V113-E115 PolarHBondContact O-N 2.9Å; V113-L116 PolarHBondContact O-N 3.26Å; V113-E117 WeakPolarHBondContact O-CB 3.29Å; V113-E117 PolarHBondContact O-N 3.38Å |
| 114 | E | 98.4 | Very high | 98.5 | Very high | 145 Ų | 145 | 100.6 Ų | 100.6 | 68% | 0.678 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -62.6 | -42.1 | 177.7 | -172.9 | 179.2 | -178.2 | 0 | 0 | 112.2 | Q110 K111 E117 G118 | Q110-E114 PolarHBondContact O-N 2.78Å; K111-E114 PolarHBondContact O-N 2.93Å; E114-E117 PolarHBondContact O-N 3.5Å; E114-G118 PolarHBondContact O-N 3.41Å |
| 115 | E | 98.4 | Very high | 98.5 | Very high | 110 Ų | 110 | 104 Ų | 104 | 51% | 0.514 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -61.5 | -49.7 | 175.3 | -177.8 | 171.7 | -162.5 | 0 | 0 | 111.7 | K111 K112 V113 E117 G118 E119 | K111-E115 WeakPolarHBondContact O-CB 3.47Å; K111-E115 PolarHBondContact O-N 2.99Å; K112-E115 PolarHBondContact O-N 3.43Å; V113-E115 PolarHBondContact O-N 2.9Å; E115-E117 VanDerWaalsContact C-N 3.33Å; E115-E117 PolarHBondContact O-N 3.05Å; E115-G118 PolarHBondContact O-N 2.89Å; E115-E119 PolarHBondContact O-N 2.89Å |
| 116 | L | 98.5 | Very high | 98.5 | Very high | 99 Ų | 99 | 104.5 Ų | 104.5 | 52% | 0.518 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -63.6 | -38.3 | 178.2 | -91.2 | 79.7 | 0 | 0 | 0 | 112.1 | K112 V113 G118 E119 I120 | K112-L116 WeakPolarHBondContact O-CB 3.37Å; K112-L116 WeakPolarHBondContact O-CD1 3.34Å; K112-L116 PolarHBondContact O-N 2.97Å; V113-L116 PolarHBondContact O-N 3.26Å; L116-G118 VanDerWaalsContact C-N 3.35Å; L116-E119 PolarHBondContact O-N 3.35Å; L116-I120 WeakPolarHBondContact O-CB 3.41Å; L116-I120 VanDerWaalsContact O-CG1 3.24Å; L116-I120 WeakPolarHBondContact O-CG1 3.37Å; L116-I120 PolarHBondContact O-N 2.97Å |
| 117 | E | 98.4 | Very high | 98.5 | Very high | 126 Ų | 126 | 104.3 Ų | 104.3 | 59% | 0.589 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -63.7 | -41.8 | 175.4 | -172.4 | 173.9 | -178.2 | 0 | 0 | 111.2 | V113 E114 E115 I120 T121 | V113-E117 WeakPolarHBondContact O-CB 3.29Å; V113-E117 PolarHBondContact O-N 3.38Å; E114-E117 PolarHBondContact O-N 3.5Å; E115-E117 VanDerWaalsContact C-N 3.33Å; E115-E117 PolarHBondContact O-N 3.05Å; E117-I120 PolarHBondContact O-N 3.49Å; E117-T121 WeakPolarHBondContact O-CB 3.47Å; E117-T121 VanDerWaalsContact O-CG2 3.29Å; E117-T121 WeakPolarHBondContact O-CG2 3.24Å; E117-T121 PolarHBondContact O-N 2.91Å; E117-T121 PolarHBondContact O-OG1 3.43Å |
| 118 | G | 98.5 | Very high | 98.5 | Very high | 33 Ų | 33 | 107.4 Ų | 107.4 | 34% | 0.34 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -61.9 | -40.6 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | E114 E115 L116 T121 T122 | E114-G118 PolarHBondContact O-N 3.41Å; E115-G118 PolarHBondContact O-N 2.89Å; L116-G118 VanDerWaalsContact C-N 3.35Å; G118-T121 WeakPolarHBondContact CA-OG1 3.43Å; G118-T121 PolarHBondContact O-OG1 3.34Å; G118-T122 WeakPolarHBondContact O-CB 3.35Å; G118-T122 PolarHBondContact O-N 2.8Å; G118-T122 PolarHBondContact O-OG1 3.01Å |
| 119 | E | 98.5 | Very high | 98.4 | Very high | 117 Ų | 117 | 107.5 Ų | 107.5 | 55% | 0.547 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -67.2 | -45.2 | 175.9 | -73.9 | -173 | 175.7 | 0 | 0 | 112.1 | E115 L116 T121 T122 L123 | E115-E119 PolarHBondContact O-N 2.89Å; L116-E119 PolarHBondContact O-N 3.35Å; E119-T121 PolarHBondContact O-N 3.21Å; E119-T122 PolarHBondContact O-N 2.92Å; E119-L123 VanDerWaalsContact O-CB 3.27Å; E119-L123 WeakPolarHBondContact O-CB 3.24Å; E119-L123 PolarHBondContact O-N 3.4Å |
| 120 | I | 98.5 | Very high | 98.4 | Very high | 112 Ų | 112 | 108.5 Ų | 108.5 | 57% | 0.574 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -61.5 | -46 | 178.6 | -72.5 | 168.3 | 0 | 0 | 0 | 110.4 | L116 E117 L123 N124 | L116-I120 WeakPolarHBondContact O-CB 3.41Å; L116-I120 VanDerWaalsContact O-CG1 3.24Å; L116-I120 WeakPolarHBondContact O-CG1 3.37Å; L116-I120 PolarHBondContact O-N 2.97Å; E117-I120 PolarHBondContact O-N 3.49Å; I120-L123 PolarHBondContact O-N 3.44Å; I120-N124 VanDerWaalsContact O-CB 3.24Å; I120-N124 WeakPolarHBondContact O-CB 3.27Å; I120-N124 PolarHBondContact O-N 3.49Å |
| 121 | T | 98.5 | Very high | 98.4 | Very high | 79 Ų | 79 | 105.9 Ų | 105.9 | 49% | 0.485 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -62.6 | -44.2 | 178.3 | 49.6 | 0 | 0 | 0 | 0 | 111.5 | E117 G118 E119 N124 H125 | E117-T121 WeakPolarHBondContact O-CB 3.47Å; E117-T121 VanDerWaalsContact O-CG2 3.29Å; E117-T121 WeakPolarHBondContact O-CG2 3.24Å; E117-T121 PolarHBondContact O-N 2.91Å; E117-T121 PolarHBondContact O-OG1 3.43Å; G118-T121 WeakPolarHBondContact CA-OG1 3.43Å; G118-T121 PolarHBondContact O-OG1 3.34Å; E119-T121 PolarHBondContact O-N 3.21Å; T121-N124 PolarHBondContact O-N 3.34Å; T121-H125 PolarHBondContact O-N 2.86Å |
| 122 | T | 98.5 | Very high | 98.4 | Very high | 77 Ų | 77 | 101.5 Ų | 101.5 | 47% | 0.472 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -61.5 | -45.6 | 175.7 | -60.6 | 0 | 0 | 0 | 0 | 112 | G118 E119 H125 K126 | G118-T122 WeakPolarHBondContact O-CB 3.35Å; G118-T122 PolarHBondContact O-N 2.8Å; G118-T122 PolarHBondContact O-OG1 3.01Å; E119-T122 PolarHBondContact O-N 2.92Å; T122-H125 PolarHBondContact O-N 3.37Å; T122-K126 PolarHBondContact O-N 2.74Å |
| 123 | L | 98.4 | Very high | 98.4 | Very high | 120 Ų | 120 | 100.2 Ų | 100.2 | 63% | 0.628 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -68 | -38.8 | -178.8 | -170.2 | 63.1 | 0 | 0 | 0 | 111.5 | E119 I120 H125 K126 L127 | E119-L123 VanDerWaalsContact O-CB 3.27Å; E119-L123 WeakPolarHBondContact O-CB 3.24Å; E119-L123 PolarHBondContact O-N 3.4Å; I120-L123 PolarHBondContact O-N 3.44Å; L123-H125 VanDerWaalsContact C-N 3.33Å; L123-H125 PolarHBondContact O-N 3.07Å; L123-K126 PolarHBondContact O-N 3.05Å; L123-L127 WeakPolarHBondContact O-CB 3.38Å; L123-L127 PolarHBondContact O-N 3.28Å |
| 124 | N | 98.4 | Very high | 98.3 | Very high | 99 Ų | 99 | 100.2 Ų | 100.2 | 53% | 0.529 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -60.7 | -43.8 | 174.3 | -166.2 | -52.6 | 0 | 0 | 0 | 110.9 | I120 T121 K126 L127 Q128 | I120-N124 VanDerWaalsContact O-CB 3.24Å; I120-N124 WeakPolarHBondContact O-CB 3.27Å; I120-N124 PolarHBondContact O-N 3.49Å; T121-N124 PolarHBondContact O-N 3.34Å; N124-K126 PolarHBondContact O-N 3.44Å; N124-L127 PolarHBondContact O-N 3Å; N124-Q128 PolarHBondContact O-N 2.94Å |
| 125 | H | 98.5 | Very high | 98.3 | Very high | 131 Ų | 131 | 97.3 Ų | 97.3 | 61% | 0.606 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -64.3 | -40.8 | 178 | -152.1 | -26.6 | 0 | 0 | 0 | 112.7 | T121 T122 L123 Q128 D129 | T121-H125 PolarHBondContact O-N 2.86Å; T122-H125 PolarHBondContact O-N 3.37Å; L123-H125 VanDerWaalsContact C-N 3.33Å; L123-H125 PolarHBondContact O-N 3.07Å; H125-Q128 PolarHBondContact O-N 2.84Å; H125-D129 PolarHBondContact O-N 3.43Å |
| 126 | K | 98.3 | Very high | 98.3 | Very high | 138 Ų | 138 | 96.3 Ų | 96.3 | 60% | 0.6 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -64 | -40.9 | 173.7 | -73.7 | 179.2 | 179.3 | 177.5 | 0 | 112.2 | T122 L123 N124 Q128 D129 A130 | T122-K126 PolarHBondContact O-N 2.74Å; L123-K126 PolarHBondContact O-N 3.05Å; N124-K126 PolarHBondContact O-N 3.44Å; K126-Q128 VanDerWaalsContact C-N 3.33Å; K126-D129 PolarHBondContact O-N 3.34Å; K126-A130 WeakPolarHBondContact O-CB 3.35Å; K126-A130 PolarHBondContact O-N 2.93Å |
| 127 | L | 98.3 | Very high | 98.2 | Very high | 126 Ų | 126 | 95.1 Ų | 95.1 | 66% | 0.66 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -63.9 | -41.9 | 177.4 | -173.1 | 67.9 | 0 | 0 | 0 | 110.9 | L123 N124 S131 | L123-L127 WeakPolarHBondContact O-CB 3.38Å; L123-L127 PolarHBondContact O-N 3.28Å; N124-L127 PolarHBondContact O-N 3Å; L127-S131 WeakPolarHBondContact O-CB 3.33Å; L127-S131 PolarHBondContact O-N 2.9Å |
| 128 | Q | 98.4 | Very high | 98.2 | Very high | 120 Ų | 120 | 96.2 Ų | 96.2 | 56% | 0.561 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -62.4 | -47.3 | 175.9 | -169.7 | 179.1 | 14.9 | 0 | 0 | 111.7 | N124 H125 K126 S131 A132 | N124-Q128 PolarHBondContact O-N 2.94Å; H125-Q128 PolarHBondContact O-N 2.84Å; K126-Q128 VanDerWaalsContact C-N 3.33Å; Q128-S131 PolarHBondContact O-N 3.23Å; Q128-S131 PolarHBondContact O-OG 2.9Å; Q128-A132 PolarHBondContact O-N 3.46Å |
| 129 | D | 98.3 | Very high | 98.1 | Very high | 116 Ų | 116 | 101.7 Ų | 101.7 | 62% | 0.62 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -62 | -48.2 | 178.7 | -173.5 | 57.2 | 0 | 0 | 0 | 111.7 | H125 K126 S131 A132 E133 | H125-D129 PolarHBondContact O-N 3.43Å; K126-D129 PolarHBondContact O-N 3.34Å; D129-S131 VanDerWaalsContact C-N 3.3Å; D129-S131 PolarHBondContact O-N 3.35Å; D129-A132 PolarHBondContact O-N 3.5Å; D129-A132 VanDerWaalsContact O-N 3.15Å; D129-E133 PolarHBondContact O-N 3.35Å |
| 130 | A | 98.1 | Very high | 98.1 | Very high | 52 Ų | 52 | 100.1 Ų | 100.1 | 43% | 0.43 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -59.6 | -39.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | K126 E133 V134 | K126-A130 WeakPolarHBondContact O-CB 3.35Å; K126-A130 PolarHBondContact O-N 2.93Å; A130-E133 PolarHBondContact O-N 2.95Å; A130-V134 WeakPolarHBondContact O-CG2 3.48Å; A130-V134 PolarHBondContact O-N 2.9Å |
| 131 | S | 98.1 | Very high | 97.9 | Very high | 70 Ų | 70 | 99 Ų | 99 | 49% | 0.49 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65 | -40 | 176.5 | 81.8 | 0 | 0 | 0 | 0 | 112.3 | L127 Q128 D129 E133 V134 E135 | L127-S131 WeakPolarHBondContact O-CB 3.33Å; L127-S131 PolarHBondContact O-N 2.9Å; Q128-S131 PolarHBondContact O-N 3.23Å; Q128-S131 PolarHBondContact O-OG 2.9Å; D129-S131 VanDerWaalsContact C-N 3.3Å; D129-S131 PolarHBondContact O-N 3.35Å; S131-E133 VanDerWaalsContact C-N 3.35Å; S131-V134 PolarHBondContact O-N 3.15Å; S131-E135 PolarHBondContact O-N 3.09Å; S131-E135 VanDerWaalsContact O-N 3.09Å |
| 132 | A | 98 | Very high | 97.8 | Very high | 56 Ų | 56 | 100.4 Ų | 100.4 | 46% | 0.463 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -66.8 | -39.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | Q128 D129 E135 R136 | Q128-A132 PolarHBondContact O-N 3.46Å; D129-A132 PolarHBondContact O-N 3.5Å; D129-A132 VanDerWaalsContact O-N 3.15Å; A132-E135 PolarHBondContact O-N 3.33Å; A132-R136 WeakPolarHBondContact O-CB 3.46Å; A132-R136 PolarHBondContact O-N 2.78Å |
| 133 | E | 98 | Very high | 97.6 | Very high | 82 Ų | 82 | 100.1 Ų | 100.1 | 38% | 0.383 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.4 | -43 | 177.9 | -178.1 | 63.7 | -179.6 | 0 | 0 | 112.2 | D129 A130 S131 E135 R136 L137 | D129-E133 PolarHBondContact O-N 3.35Å; A130-E133 PolarHBondContact O-N 2.95Å; S131-E133 VanDerWaalsContact C-N 3.35Å; E133-E135 VanDerWaalsContact C-N 3.33Å; E133-E135 PolarHBondContact O-N 3.36Å; E133-R136 VanDerWaalsContact CD-NH2 3.34Å; E133-R136 WeakPolarHBondContact O-CB 3.42Å; E133-R136 PolarHBondContact O-N 3.26Å; E133-R136 IonicContact OE1-CZ 3.56Å; E133-R136 IonicContact OE1-NE 3.67Å; E133-R136 IonicContact OE1-NH2 3.35Å; E133-R136 PolarHBondContact OE1-NH2 2.9Å; E133-R136 IonicContact OE2-CZ 3.48Å; E133-R136 IonicContact OE2-NE 2.78Å; E133-R136 PolarHBondContact OE2-NE 3.38Å; E133-R136 IonicContact OE2-NH2 2.66Å; E133-R136 PolarHBondContact OE2-NH2 3.39Å; E133-L137 HydrophobicContact CG-CD1 4.27Å; E133-L137 WeakPolarHBondContact O-CG 3.35Å; E133-L137 PolarHBondContact O-N 2.65Å |
| 134 | V | 98.1 | Very high | 97.4 | Very high | 96 Ų | 96 | 98.6 Ų | 98.6 | 58% | 0.582 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -60.1 | -43.8 | 173.3 | 168.7 | 0 | 0 | 0 | 0 | 111 | A130 S131 R136 L137 R138 | A130-V134 WeakPolarHBondContact O-CG2 3.48Å; A130-V134 PolarHBondContact O-N 2.9Å; S131-V134 PolarHBondContact O-N 3.15Å; V134-R136 VanDerWaalsContact C-N 3.34Å; V134-R136 PolarHBondContact O-N 3.17Å; V134-L137 PolarHBondContact O-N 2.99Å; V134-R138 WeakPolarHBondContact O-CB 3.35Å; V134-R138 PolarHBondContact O-N 2.66Å |
| 135 | E | 97.8 | Very high | 97.2 | Very high | 84 Ų | 84 | 97 Ų | 97 | 39% | 0.393 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -68.7 | -32.7 | 178.8 | -167.4 | 56.2 | -135.5 | 0 | 0 | 112.4 | S131 A132 E133 R139 | S131-E135 PolarHBondContact O-N 3.09Å; S131-E135 VanDerWaalsContact O-N 3.09Å; A132-E135 PolarHBondContact O-N 3.33Å; E133-E135 VanDerWaalsContact C-N 3.33Å; E133-E135 PolarHBondContact O-N 3.36Å; E135-R139 WeakPolarHBondContact O-CG 3.36Å; E135-R139 PolarHBondContact O-N 3.48Å; E135-R139 PolarHBondContact O-NE 2.92Å |
| 136 | R | 98 | Very high | 96.9 | Very high | 90 Ų | 90 | 95 Ų | 95 | 34% | 0.34 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63.6 | -51.9 | 171.3 | -173.7 | -172.3 | 69.9 | 77.8 | 2.4 | 110.9 | A132 E133 V134 R138 R139 E140 | A132-R136 WeakPolarHBondContact O-CB 3.46Å; A132-R136 PolarHBondContact O-N 2.78Å; E133-R136 VanDerWaalsContact CD-NH2 3.34Å; E133-R136 WeakPolarHBondContact O-CB 3.42Å; E133-R136 PolarHBondContact O-N 3.26Å; E133-R136 IonicContact OE1-CZ 3.56Å; E133-R136 IonicContact OE1-NE 3.67Å; E133-R136 IonicContact OE1-NH2 3.35Å; E133-R136 PolarHBondContact OE1-NH2 2.9Å; E133-R136 IonicContact OE2-CZ 3.48Å; E133-R136 IonicContact OE2-NE 2.78Å; E133-R136 PolarHBondContact OE2-NE 3.38Å; E133-R136 IonicContact OE2-NH2 2.66Å; E133-R136 PolarHBondContact OE2-NH2 3.39Å; V134-R136 VanDerWaalsContact C-N 3.34Å; V134-R136 PolarHBondContact O-N 3.17Å; R136-R138 VanDerWaalsContact C-N 3.27Å; R136-R138 PolarHBondContact O-N 3.45Å; R136-R139 PolarHBondContact O-N 3.35Å; R136-E140 IonicContact CZ-OE1 3.83Å; R136-E140 IonicContact CZ-OE2 3.86Å; R136-E140 IonicContact NH1-OE1 2.65Å; R136-E140 PolarHBondContact NH1-OE1 3.29Å; R136-E140 IonicContact NH1-OE2 2.9Å; R136-E140 PolarHBondContact NH1-OE2 2.99Å; R136-E140 PolarHBondContact O-N 2.89Å |
| 137 | L | 97.5 | Very high | 96.6 | Very high | 73 Ų | 73 | 96.2 Ų | 96.2 | 38% | 0.382 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62 | -34.4 | 178.8 | -75 | 168 | 0 | 0 | 0 | 112.5 | E133 V134 E140 N141 | E133-L137 HydrophobicContact CG-CD1 4.27Å; E133-L137 WeakPolarHBondContact O-CG 3.35Å; E133-L137 PolarHBondContact O-N 2.65Å; V134-L137 PolarHBondContact O-N 2.99Å; L137-E140 PolarHBondContact O-N 2.94Å; L137-N141 WeakPolarHBondContact O-CB 3.38Å; L137-N141 PolarHBondContact O-N 3.46Å; L137-N141 PolarHBondContact O-ND2 3.17Å |
| 138 | R | 97.6 | Very high | 96.3 | Very high | 149 Ų | 149 | 95 Ų | 95 | 56% | 0.562 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -62.9 | -46.5 | 174.2 | -168.9 | -179.7 | -154.3 | 155.2 | 7.4 | 111.5 | V134 R136 N141 Q142 | V134-R138 WeakPolarHBondContact O-CB 3.35Å; V134-R138 PolarHBondContact O-N 2.66Å; R136-R138 VanDerWaalsContact C-N 3.27Å; R136-R138 PolarHBondContact O-N 3.45Å; R138-N141 PolarHBondContact O-N 2.98Å; R138-Q142 WeakPolarHBondContact O-CG 3.44Å; R138-Q142 PolarHBondContact O-N 3.41Å |
| 139 | R | 97 | Very high | 95.8 | Very high | 148 Ų | 148 | 91.9 Ų | 91.9 | 56% | 0.558 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -63.3 | -42.1 | 176.2 | -74 | -176.2 | -78 | 172.5 | -4.9 | 111.9 | E135 R136 Q142 V143 | E135-R139 WeakPolarHBondContact O-CG 3.36Å; E135-R139 PolarHBondContact O-N 3.48Å; E135-R139 PolarHBondContact O-NE 2.92Å; R136-R139 PolarHBondContact O-N 3.35Å; R139-Q142 PolarHBondContact O-N 2.93Å; R139-V143 WeakPolarHBondContact O-CG2 3.4Å; R139-V143 PolarHBondContact O-N 3.34Å |
| 140 | E | 97 | Very high | 95.3 | Very high | 85 Ų | 85 | 91.4 Ų | 91.4 | 40% | 0.397 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -63.2 | -43.4 | 176.1 | -73.3 | 177.8 | 176.6 | 0 | 0 | 112.5 | R136 L137 Q142 V143 L144 | R136-E140 IonicContact CZ-OE1 3.83Å; R136-E140 IonicContact CZ-OE2 3.86Å; R136-E140 IonicContact NH1-OE1 2.65Å; R136-E140 PolarHBondContact NH1-OE1 3.29Å; R136-E140 IonicContact NH1-OE2 2.9Å; R136-E140 PolarHBondContact NH1-OE2 2.99Å; R136-E140 PolarHBondContact O-N 2.89Å; L137-E140 PolarHBondContact O-N 2.94Å; E140-Q142 VanDerWaalsContact C-N 3.34Å; E140-Q142 PolarHBondContact O-N 2.88Å; E140-V143 PolarHBondContact O-N 3.38Å; E140-L144 WeakPolarHBondContact O-CB 3.37Å; E140-L144 WeakPolarHBondContact O-CG 3.4Å; E140-L144 PolarHBondContact O-N 3.25Å |
| 141 | N | 95.8 | Very high | 94.6 | Very high | 88 Ų | 88 | 96.9 Ų | 96.9 | 47% | 0.471 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62 | -39.6 | 174.5 | -90.4 | -65.6 | 0 | 0 | 0 | 112.5 | L137 R138 L144 S145 | L137-N141 WeakPolarHBondContact O-CB 3.38Å; L137-N141 PolarHBondContact O-N 3.46Å; L137-N141 PolarHBondContact O-ND2 3.17Å; R138-N141 PolarHBondContact O-N 2.98Å; N141-L144 PolarHBondContact O-N 3.1Å; N141-S145 WeakPolarHBondContact O-CB 3.42Å; N141-S145 PolarHBondContact O-N 3.26Å; N141-S145 PolarHBondContact O-OG 3.1Å |
| 142 | Q | 95.8 | Very high | 93.6 | Very high | 109 Ų | 109 | 101.8 Ų | 101.8 | 51% | 0.509 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.9 | -43.5 | 173.9 | -74.4 | 174.8 | -2.8 | 0 | 0 | 111.9 | R138 R139 E140 L144 S145 V146 | R138-Q142 WeakPolarHBondContact O-CG 3.44Å; R138-Q142 PolarHBondContact O-N 3.41Å; R139-Q142 PolarHBondContact O-N 2.93Å; E140-Q142 VanDerWaalsContact C-N 3.34Å; E140-Q142 PolarHBondContact O-N 2.88Å; Q142-L144 PolarHBondContact O-N 3.46Å; Q142-S145 PolarHBondContact O-N 3.04Å; Q142-S145 PolarHBondContact O-OG 3.48Å; Q142-V146 WeakPolarHBondContact O-CG2 3.28Å; Q142-V146 PolarHBondContact O-N 2.89Å; Q142-V146 VanDerWaalsContact O-N 3.1Å |
| 143 | V | 95.1 | Very high | 92.4 | Very high | 70 Ų | 70 | 108.1 Ų | 108.1 | 42% | 0.424 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.6 | -42.4 | 176.9 | 169.5 | 0 | 0 | 0 | 0 | 111.4 | R139 E140 R147 | R139-V143 WeakPolarHBondContact O-CG2 3.4Å; R139-V143 PolarHBondContact O-N 3.34Å; E140-V143 PolarHBondContact O-N 3.38Å; V143-R147 VanDerWaalsContact CG1-NH2 3.33Å; V143-R147 WeakPolarHBondContact O-CG 3.43Å; V143-R147 PolarHBondContact O-N 3.46Å; V143-R147 VanDerWaalsContact O-N 3.1Å |
| 144 | L | 94.4 | Very high | 90.4 | Very high | 88 Ų | 88 | 113.3 Ų | 113.3 | 46% | 0.461 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -66.3 | -40.6 | 177.2 | -74.7 | 168.5 | 0 | 0 | 0 | 112 | E140 N141 Q142 V146 R147 I148 | E140-L144 WeakPolarHBondContact O-CB 3.37Å; E140-L144 WeakPolarHBondContact O-CG 3.4Å; E140-L144 PolarHBondContact O-N 3.25Å; N141-L144 PolarHBondContact O-N 3.1Å; Q142-L144 PolarHBondContact O-N 3.46Å; L144-V146 VanDerWaalsContact C-N 3.35Å; L144-V146 PolarHBondContact O-N 2.93Å; L144-R147 PolarHBondContact O-N 2.88Å; L144-I148 VanDerWaalsContact O-CG1 3.28Å; L144-I148 WeakPolarHBondContact O-CG1 3.46Å; L144-I148 PolarHBondContact O-N 3.49Å |
| 145 | S | 93.6 | Very high | 88.4 | Confident | 67 Ų | 67 | 113.4 Ų | 113.4 | 47% | 0.469 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -64.2 | -39.4 | 178.9 | 71.5 | 0 | 0 | 0 | 0 | 111.9 | N141 Q142 I148 A149 | N141-S145 WeakPolarHBondContact O-CB 3.42Å; N141-S145 PolarHBondContact O-N 3.26Å; N141-S145 PolarHBondContact O-OG 3.1Å; Q142-S145 PolarHBondContact O-N 3.04Å; Q142-S145 PolarHBondContact O-OG 3.48Å; S145-I148 PolarHBondContact O-N 3.35Å; S145-A149 PolarHBondContact O-N 3.43Å |
| 146 | V | 92.5 | Very high | 86.3 | Confident | 87 Ų | 87 | 115 Ų | 115 | 53% | 0.527 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -62.9 | -47.1 | 172 | 175.7 | 0 | 0 | 0 | 0 | 111.3 | Q142 L144 I148 A149 D150 | Q142-V146 WeakPolarHBondContact O-CG2 3.28Å; Q142-V146 PolarHBondContact O-N 2.89Å; Q142-V146 VanDerWaalsContact O-N 3.1Å; L144-V146 VanDerWaalsContact C-N 3.35Å; L144-V146 PolarHBondContact O-N 2.93Å; V146-I148 VanDerWaalsContact C-N 3.3Å; V146-I148 PolarHBondContact O-N 3.34Å; V146-A149 WeakPolarHBondContact O-CB 3.42Å; V146-A149 PolarHBondContact O-N 3.17Å; V146-A149 VanDerWaalsContact O-N 3.08Å; V146-D150 PolarHBondContact O-N 3.49Å |
| 147 | R | 91.6 | Very high | 83.7 | Confident | 164 Ų | 164 | 116 Ų | 116 | 62% | 0.619 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -61.2 | -37.1 | 178.2 | -71.5 | -173.3 | -140.4 | -169.4 | 6 | 113.1 | V143 L144 A149 K151 | V143-R147 VanDerWaalsContact CG1-NH2 3.33Å; V143-R147 WeakPolarHBondContact O-CG 3.43Å; V143-R147 PolarHBondContact O-N 3.46Å; V143-R147 VanDerWaalsContact O-N 3.1Å; L144-R147 PolarHBondContact O-N 2.88Å; R147-A149 VanDerWaalsContact C-N 3.34Å; R147-K151 WeakPolarHBondContact O-CB 3.34Å; R147-K151 PolarHBondContact O-N 3.47Å |
| 148 | I | 91.2 | Very high | 80.9 | Confident | 101 Ų | 101 | 121 Ų | 121 | 52% | 0.518 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -66.1 | -39.6 | 175.5 | -69.6 | 166.3 | 0 | 0 | 0 | 110.4 | L144 S145 V146 K152 | L144-I148 VanDerWaalsContact O-CG1 3.28Å; L144-I148 WeakPolarHBondContact O-CG1 3.46Å; L144-I148 PolarHBondContact O-N 3.49Å; S145-I148 PolarHBondContact O-N 3.35Å; V146-I148 VanDerWaalsContact C-N 3.3Å; V146-I148 PolarHBondContact O-N 3.34Å; I148-K152 WeakPolarHBondContact O-CG 3.42Å; I148-K152 PolarHBondContact O-N 3.45Å |
| 149 | A | 89 | Confident | 77.8 | Confident | 55 Ų | 55 | 121 Ų | 121 | 46% | 0.455 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -64 | -45.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | S145 V146 R147 K151 K152 Y153 | S145-A149 PolarHBondContact O-N 3.43Å; V146-A149 WeakPolarHBondContact O-CB 3.42Å; V146-A149 PolarHBondContact O-N 3.17Å; V146-A149 VanDerWaalsContact O-N 3.08Å; R147-A149 VanDerWaalsContact C-N 3.34Å; A149-K151 PolarHBondContact O-N 3.28Å; A149-K152 PolarHBondContact O-N 3.41Å; A149-Y153 PolarHBondContact O-N 3.02Å |
| 150 | D | 87.3 | Confident | 75 | Confident | 105 Ų | 105 | 119.6 Ų | 119.6 | 56% | 0.561 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -61.5 | -44.9 | 177 | -83.9 | -3 | 0 | 0 | 0 | 112.4 | V146 K152 Y153 Y154 | V146-D150 PolarHBondContact O-N 3.49Å; D150-K152 VanDerWaalsContact C-N 3.26Å; D150-K152 PolarHBondContact O-N 2.97Å; D150-Y153 PolarHBondContact O-N 3.49Å; D150-Y154 PolarHBondContact O-N 2.95Å |
| 151 | K | 82.6 | Confident | 72.2 | Confident | 168 Ų | 168 | 120.7 Ų | 120.7 | 73% | 0.73 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -65.5 | -28.7 | 179.3 | -170.1 | 164.4 | -176.7 | 166.7 | 0 | 112.9 | R147 A149 | R147-K151 WeakPolarHBondContact O-CB 3.34Å; R147-K151 PolarHBondContact O-N 3.47Å; A149-K151 PolarHBondContact O-N 3.28Å |
| 152 | K | 77.2 | Confident | 69.5 | Low | 172 Ų | 172 | 121.6 Ų | 121.6 | 75% | 0.748 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -71.7 | -29.8 | 171.1 | -76.4 | 179.4 | -179 | 179.5 | 0 | 112.4 | I148 A149 D150 | I148-K152 WeakPolarHBondContact O-CG 3.42Å; I148-K152 PolarHBondContact O-N 3.45Å; A149-K152 PolarHBondContact O-N 3.41Å; D150-K152 VanDerWaalsContact C-N 3.26Å; D150-K152 PolarHBondContact O-N 2.97Å |
| 153 | Y | 73.3 | Confident | 67.1 | Low | 190 Ų | 190 | 121.4 Ų | 121.4 | 75% | 0.745 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -85.1 | -28.8 | -177.5 | -148.2 | -96.1 | 0 | 0 | 0 | 113.1 | A149 D150 | A149-Y153 PolarHBondContact O-N 3.02Å; D150-Y153 PolarHBondContact O-N 3.49Å |
| 154 | Y | 55.9 | Low | 64.7 | Low | 190 Ų | 190 | 122 Ų | 122 | 75% | 0.745 | 68% | 0.682 | S | S | * | * | S | Bend | trans | -126.6 | 85.4 | 172.6 | -76 | -88.2 | 0 | 0 | 0 | 111.8 | D150 S156 | D150-Y154 PolarHBondContact O-N 2.95Å; Y154-S156 PolarHBondContact O-N 3.08Å; Y154-S156 VanDerWaalsContact O-N 3.08Å |
| 155 | P | 56.3 | Low | 62.8 | Low | 99 Ų | 99 | 122.2 Ų | 122.2 | 64% | 0.643 | 70% | 0.697 | S | S | * | * | trans | -69.1 | 105 | 171.3 | 26.9 | -31.1 | 0 | 0 | 0 | 109.6 | S157 | P155-S157 PolarHBondContact O-N 3.06Š| ||
| 156 | S | 52.8 | Low | 60.8 | Low | 116 Ų | 116 | 123.4 Ų | 123.4 | 81% | 0.811 | 70% | 0.703 | S | S | * | * | trans | -55.9 | 113.5 | 167.7 | -171.6 | 0 | 0 | 0 | 0 | 108.4 | Y154 Q158 | Y154-S156 PolarHBondContact O-N 3.08Å; Y154-S156 VanDerWaalsContact O-N 3.08Å; S156-Q158 PolarHBondContact O-N 3.17Å | ||
| 157 | S | 43.7 | Very low | 59.1 | Low | 113 Ų | 113 | 126.4 Ų | 126.4 | 79% | 0.79 | 71% | 0.711 | S | S | * | * | trans | -69.4 | 94 | -177.2 | -31.7 | 0 | 0 | 0 | 0 | 109.1 | P155 | P155-S157 PolarHBondContact O-N 3.06Š| ||
| 158 | Q | 39.2 | Very low | 57.3 | Low | 176 Ų | 176 | 125 Ų | 125 | 82% | 0.822 | 72% | 0.715 | S | S | * | * | trans | -155.2 | 87.8 | 160.1 | -108.6 | 171.4 | 30.6 | 0 | 0 | 109 | S156 | S156-Q158 PolarHBondContact O-N 3.17Š| ||
| 159 | D | 33.5 | Very low | 55.7 | Low | 149 Ų | 149 | 125.8 Ų | 125.8 | 80% | 0.797 | 72% | 0.72 | S | S | * | * | trans | 32.5 | 126.2 | 137.1 | -58.5 | -27.1 | 0 | 0 | 0 | 122.1 | ||||
| 160 | S | 36.1 | Very low | 54.6 | Low | 119 Ų | 119 | 129 Ų | 129 | 83% | 0.832 | 73% | 0.728 | S | S | * | * | 87.5 | 132.1 | 128.6 | 58.4 | 0 | 0 | 0 | 0 | 123.3 | |||||
| 161 | S | 38.5 | Very low | 53.7 | Low | 109 Ų | 109 | 128.4 Ų | 128.4 | 76% | 0.762 | 73% | 0.728 | S | S | * | * | trans | 83.2 | 90.4 | 163.4 | -168.1 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 162 | S | 39.9 | Very low | 52.9 | Low | 107 Ų | 107 | 125.7 Ų | 125.7 | 75% | 0.748 | 72% | 0.721 | S | S | * | * | 72 | 116.2 | 82.3 | 79.5 | 0 | 0 | 0 | 0 | 115.7 | |||||
| 163 | A | 45 | Very low | 52.3 | Low | 104 Ų | 104 | 123 Ų | 123 | 86% | 0.86 | 71% | 0.714 | S | S | * | * | trans | 85.9 | 78.6 | 159.1 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 164 | A | 45.2 | Very low | 52 | Low | 82 Ų | 82 | 116.1 Ų | 116.1 | 68% | 0.678 | 70% | 0.701 | S | S | * | * | trans | -165 | 68.4 | 146.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 165 | A | 53.4 | Low | 52.5 | Low | 93 Ų | 93 | 111.3 Ų | 111.3 | 77% | 0.769 | 69% | 0.688 | S | S | * | * | trans | -94.4 | 9.3 | -177 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 166 | P | 53 | Low | 53 | Low | 92 Ų | 92 | 109.8 Ų | 109.8 | 60% | 0.597 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -96.8 | -19.3 | 172.7 | -7.2 | 26.1 | 0 | 0 | 0 | 116.2 | ||
| 167 | Q | 56.6 | Low | 53.4 | Low | 150 Ų | 150 | 107.8 Ų | 107.8 | 70% | 0.701 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -79.4 | -28.7 | -167.6 | -62 | -174.6 | 20 | 0 | 0 | 113.8 | L169 I170 | Q167-L169 PolarHBondContact O-N 3.33Å; Q167-I170 PolarHBondContact O-N 3.49Å |
| 168 | L | 54.2 | Low | 54.5 | Low | 135 Ų | 135 | 109.7 Ų | 109.7 | 71% | 0.707 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -71.9 | -29.4 | -176.4 | -111.8 | 151 | 0 | 0 | 0 | 113.9 | L172 | L168-L172 PolarHBondContact O-N 3.42Å |
| 169 | L | 57.6 | Low | 55.3 | Low | 117 Ų | 117 | 108.7 Ų | 108.7 | 61% | 0.613 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -72.3 | -34.9 | 178.1 | -105.8 | 155.9 | 0 | 0 | 0 | 112.3 | Q167 L172 L173 | Q167-L169 PolarHBondContact O-N 3.33Å; L169-L172 PolarHBondContact O-N 3.38Å; L169-L173 WeakPolarHBondContact O-CG 3.45Å; L169-L173 PolarHBondContact O-N 3.44Å; L169-L173 VanDerWaalsContact O-N 3.11Å |
| 170 | I | 65 | Low | 56.3 | Low | 122 Ų | 122 | 113.2 Ų | 113.2 | 63% | 0.626 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -67.6 | -39.5 | 179.3 | -61.3 | 174.4 | 0 | 0 | 0 | 110.6 | Q167 L173 G174 | Q167-I170 PolarHBondContact O-N 3.49Å; I170-L173 PolarHBondContact O-N 3.11Å; I170-G174 PolarHBondContact O-N 3.49Å |
| 171 | V | 68.3 | Low | 57.3 | Low | 93 Ų | 93 | 112.9 Ų | 112.9 | 56% | 0.564 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -66 | -40.4 | 178 | 179.3 | 0 | 0 | 0 | 0 | 111.4 | G174 L175 | V171-G174 PolarHBondContact O-N 2.82Å; V171-L175 HydrophobicContact CG1-CD1 4.21Å; V171-L175 PolarHBondContact O-N 3.38Å; V171-L175 VanDerWaalsContact O-N 3.17Å |
| 172 | L | 66.5 | Low | 58.3 | Low | 112 Ų | 112 | 113.1 Ų | 113.1 | 59% | 0.586 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -64.8 | -39.7 | 176.7 | -75.4 | 166.5 | 0 | 0 | 0 | 112.4 | L168 L169 L175 S176 | L168-L172 PolarHBondContact O-N 3.42Å; L169-L172 PolarHBondContact O-N 3.38Å; L172-L175 PolarHBondContact O-N 3.5Å; L172-S176 PolarHBondContact O-N 2.99Å; L172-S176 PolarHBondContact O-OG 3.19Å |
| 173 | L | 65.5 | Low | 59.3 | Low | 114 Ų | 114 | 113.4 Ų | 113.4 | 60% | 0.597 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -69.7 | -37.5 | 177 | -72.4 | 169.7 | 0 | 0 | 0 | 112.4 | L169 I170 L175 S176 A177 | L169-L173 WeakPolarHBondContact O-CG 3.45Å; L169-L173 PolarHBondContact O-N 3.44Å; L169-L173 VanDerWaalsContact O-N 3.11Å; I170-L173 PolarHBondContact O-N 3.11Å; L173-L175 VanDerWaalsContact C-N 3.31Å; L173-L175 PolarHBondContact O-N 3.08Å; L173-S176 PolarHBondContact O-N 3Å; L173-S176 PolarHBondContact O-OG 3.33Å; L173-A177 PolarHBondContact O-N 3.27Å |
| 174 | G | 66.4 | Low | 60.2 | Low | 46 Ų | 46 | 114 Ų | 114 | 47% | 0.474 | 66% | 0.66 | S | S | . | * | H | α-helix | trans | -61.9 | -36.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | I170 V171 L178 | I170-G174 PolarHBondContact O-N 3.49Å; V171-G174 PolarHBondContact O-N 2.82Å; G174-L178 PolarHBondContact O-N 3.02Å |
| 175 | L | 67 | Low | 61.1 | Low | 89 Ų | 89 | 116 Ų | 116 | 47% | 0.466 | 66% | 0.658 | S | S | . | * | H | α-helix | trans | -70.5 | -34.5 | 177.3 | -83.1 | 156.3 | 0 | 0 | 0 | 113.2 | V171 L172 L173 | V171-L175 HydrophobicContact CG1-CD1 4.21Å; V171-L175 PolarHBondContact O-N 3.38Å; V171-L175 VanDerWaalsContact O-N 3.17Å; L172-L175 PolarHBondContact O-N 3.5Å; L173-L175 VanDerWaalsContact C-N 3.31Å; L173-L175 PolarHBondContact O-N 3.08Å |
| 176 | S | 64.8 | Low | 61.6 | Low | 68 Ų | 68 | 117.5 Ų | 117.5 | 48% | 0.476 | 65% | 0.651 | S | S | . | * | H | α-helix | trans | -71 | -31.7 | 176.1 | 46.6 | 0 | 0 | 0 | 0 | 113.4 | L172 L173 L178 L179 | L172-S176 PolarHBondContact O-N 2.99Å; L172-S176 PolarHBondContact O-OG 3.19Å; L173-S176 PolarHBondContact O-N 3Å; L173-S176 PolarHBondContact O-OG 3.33Å; S176-L178 VanDerWaalsContact C-N 3.34Å; S176-L179 PolarHBondContact O-N 2.99Å |
| 177 | A | 62 | Low | 62.3 | Low | 74 Ų | 74 | 119.4 Ų | 119.4 | 61% | 0.612 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -75.7 | -21.2 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | L173 L179 | L173-A177 PolarHBondContact O-N 3.27Å; A177-L179 VanDerWaalsContact C-N 3.33Å |
| 178 | L | 66.6 | Low | 62.7 | Low | 153 Ų | 153 | 117 Ų | 117 | 80% | 0.801 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.1 | -4.1 | 177.9 | -151.9 | 76 | 0 | 0 | 0 | 113.1 | G174 S176 | G174-L178 PolarHBondContact O-N 3.02Å; S176-L178 VanDerWaalsContact C-N 3.34Å |
| 179 | L | 56.5 | Low | 63.4 | Low | 155 Ų | 155 | 115.5 Ų | 115.5 | 81% | 0.812 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.1 | 6.1 | -173.9 | -135.4 | 94.9 | 0 | 0 | 0 | 114.2 | S176 A177 | S176-L179 PolarHBondContact O-N 2.99Å; A177-L179 VanDerWaalsContact C-N 3.33Å |
| 180 | Q | 54.9 | Low | 63.9 | Low | 243 Ų | 243 | 115.4 Ų | 115.4 | 100% | 1.136 | 65% | 0.65 | S | S | * | * | trans | -115.4 | 0 | 172 | -84.5 | 178.4 | -49.7 | 0 | 0 | 110 |
Retrieved 180 of 180 residues in 149.4 ms
(Link to these results)