| 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 | N | 40.4 | Very low | 44 | Very low | 212 Ų | 212 | 154.4 Ų | 154.4 | 100% | 1.134 | 81% | 0.811 | S | S | * | * | 0 | 135.5 | 0 | -86.9 | -26.7 | 0 | 0 | 0 | 109.3 | |||||
| 2 | L | 44.6 | Very low | 44.5 | Very low | 157 Ų | 157 | 156.7 Ų | 156.7 | 82% | 0.822 | 81% | 0.809 | S | S | * | * | trans | 76.6 | 86.1 | -177.4 | -86 | 68.8 | 0 | 0 | 0 | 115.8 | ||||
| 3 | L | 40.8 | Very low | 44.6 | Very low | 165 Ų | 165 | 151.8 Ų | 151.8 | 86% | 0.864 | 79% | 0.791 | S | S | * | * | 67.8 | 108.7 | 77.1 | -82.7 | 143.6 | 0 | 0 | 0 | 115.2 | |||||
| 4 | C | 39.9 | Very low | 44.7 | Very low | 110 Ų | 110 | 152.6 Ų | 152.6 | 74% | 0.743 | 79% | 0.788 | S | S | * | * | trans | -20.9 | 139.5 | 159.3 | -56.5 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 5 | F | 38.6 | Very low | 45.2 | Very low | 188 Ų | 188 | 154.5 Ų | 154.5 | 83% | 0.825 | 79% | 0.788 | S | S | * | * | trans | -155.8 | 78.6 | 132.2 | -112.8 | -78 | 0 | 0 | 0 | 110.1 | K7 | F5-K7 HydrophobicContact CD1-CG 4.21Å; F5-K7 PolarHBondContact O-N 3.47Å | ||
| 6 | R | 46.5 | Very low | 45.6 | Very low | 233 Ų | 233 | 148.8 Ų | 148.8 | 88% | 0.879 | 78% | 0.779 | S | S | * | * | trans | -78.4 | 98.5 | 159.3 | -83.9 | -165.7 | 179 | -165.2 | 1.7 | 107.5 | N8 | R6-N8 PolarHBondContact O-N 3.2Å; R6-N8 VanDerWaalsContact O-N 3.1Å | ||
| 7 | K | 48.4 | Very low | 46 | Very low | 168 Ų | 168 | 148 Ų | 148 | 73% | 0.73 | 78% | 0.782 | S | S | * | * | trans | -69.5 | 98.3 | 165.9 | -78.4 | 179.3 | 174.9 | 175.3 | 0 | 108.1 | F5 V9 | F5-K7 HydrophobicContact CD1-CG 4.21Å; F5-K7 PolarHBondContact O-N 3.47Å; K7-V9 VanDerWaalsContact C-N 3.31Å; K7-V9 PolarHBondContact O-N 3.22Å | ||
| 8 | N | 45.7 | Very low | 46.7 | Very low | 152 Ų | 152 | 142.6 Ų | 142.6 | 81% | 0.813 | 76% | 0.758 | S | S | * | * | trans | -69.7 | 92.3 | 162.3 | -76 | -32.1 | 0 | 0 | 0 | 107.8 | R6 A10 | R6-N8 PolarHBondContact O-N 3.2Å; R6-N8 VanDerWaalsContact O-N 3.1Å; N8-A10 PolarHBondContact O-N 2.93Å | ||
| 9 | V | 47.5 | Very low | 48.1 | Very low | 128 Ų | 128 | 139.6 Ų | 139.6 | 78% | 0.776 | 75% | 0.746 | S | S | * | * | trans | -77 | 98.7 | 164.4 | 179 | 0 | 0 | 0 | 0 | 106 | K7 | K7-V9 VanDerWaalsContact C-N 3.31Å; K7-V9 PolarHBondContact O-N 3.22Å | ||
| 10 | A | 46.5 | Very low | 49.2 | Very low | 76 Ų | 76 | 144 Ų | 144 | 63% | 0.628 | 75% | 0.751 | S | S | * | * | trans | -56.9 | 124.8 | 166.8 | 0 | 0 | 0 | 0 | 0 | 108 | N8 K12 | N8-A10 PolarHBondContact O-N 2.93Å; A10-K12 PolarHBondContact O-N 3.21Å | ||
| 11 | P | 44.6 | Very low | 50.3 | Low | 109 Ų | 109 | 145 Ų | 145 | 71% | 0.708 | 75% | 0.746 | S | S | * | * | trans | -67.5 | 107.2 | 167.4 | 18.9 | -12.6 | 0 | 0 | 0 | 105.8 | V13 | P11-V13 HydrophobicContact CB-CG2 4.14Å; P11-V13 PolarHBondContact O-N 3.43Å | ||
| 12 | K | 50.7 | Low | 52.2 | Low | 182 Ų | 182 | 136 Ų | 136 | 79% | 0.791 | 70% | 0.703 | S | S | * | * | trans | -63.3 | 77.9 | 164.9 | -87 | -178.6 | 172 | -177.8 | 0 | 107.6 | A10 H14 | A10-K12 PolarHBondContact O-N 3.21Å; K12-H14 PolarHBondContact O-N 3.47Å | ||
| 13 | V | 45.3 | Very low | 54.1 | Low | 94 Ų | 94 | 133.4 Ų | 133.4 | 57% | 0.57 | 69% | 0.687 | S | S | * | * | trans | -74.4 | 84.7 | 165.5 | -177.7 | 0 | 0 | 0 | 0 | 105.6 | P11 K15 | P11-V13 HydrophobicContact CB-CG2 4.14Å; P11-V13 PolarHBondContact O-N 3.43Å; V13-K15 HydrophobicContact CG1-CB 3.92Å; V13-K15 HydrophobicContact CG1-CD 3.6Å; V13-K15 HydrophobicContact CG1-CG 3.41Å; V13-K15 VanDerWaalsContact CG1-CG 3.41Å; V13-K15 PolarHBondContact O-N 3.42Å | ||
| 14 | H | 46.6 | Very low | 56.2 | Low | 163 Ų | 163 | 130.2 Ų | 130.2 | 76% | 0.755 | 67% | 0.668 | S | S | * | * | trans | -69.3 | 71.9 | 156.4 | -73.8 | 77.2 | 0 | 0 | 0 | 106.8 | K12 G16 | K12-H14 PolarHBondContact O-N 3.47Å; H14-G16 VanDerWaalsContact C-N 3.25Å; H14-G16 PolarHBondContact O-N 2.96Å; H14-G16 VanDerWaalsContact O-N 3.09Å | ||
| 15 | K | 52 | Low | 58.4 | Low | 181 Ų | 181 | 128.2 Ų | 128.2 | 79% | 0.787 | 65% | 0.652 | S | S | * | * | trans | -71.5 | 97.9 | 155.8 | -89.7 | 170.9 | -174.4 | -169.3 | 0 | 104 | V13 V17 | V13-K15 HydrophobicContact CG1-CB 3.92Å; V13-K15 HydrophobicContact CG1-CD 3.6Å; V13-K15 HydrophobicContact CG1-CG 3.41Å; V13-K15 VanDerWaalsContact CG1-CG 3.41Å; V13-K15 PolarHBondContact O-N 3.42Å; K15-V17 PolarHBondContact O-N 3.44Å | ||
| 16 | G | 52.2 | Low | 60.8 | Low | 62 Ų | 62 | 124.3 Ų | 124.3 | 64% | 0.639 | 64% | 0.636 | S | S | * | * | trans | -44 | 138.4 | 164.1 | 0 | 0 | 0 | 0 | 0 | 108 | H14 S18 | H14-G16 VanDerWaalsContact C-N 3.25Å; H14-G16 PolarHBondContact O-N 2.96Å; H14-G16 VanDerWaalsContact O-N 3.09Å; G16-S18 VanDerWaalsContact C-N 3.33Å; G16-S18 PolarHBondContact O-N 2.83Å | ||
| 17 | V | 52.5 | Low | 62.9 | Low | 136 Ų | 136 | 117.9 Ų | 117.9 | 82% | 0.824 | 62% | 0.619 | S | S | * | * | trans | -46.9 | 100.4 | -178.8 | 179 | 0 | 0 | 0 | 0 | 107.9 | K15 T19 | K15-V17 PolarHBondContact O-N 3.44Å; V17-T19 VanDerWaalsContact C-N 3.34Å; V17-T19 PolarHBondContact O-N 3.42Å | ||
| 18 | S | 58.5 | Low | 65 | Low | 50 Ų | 50 | 115.8 Ų | 115.8 | 35% | 0.35 | 61% | 0.61 | S | S | . | * | trans | -64.7 | 105.4 | 176.5 | -178.3 | 0 | 0 | 0 | 0 | 104.4 | G16 Q23 | G16-S18 VanDerWaalsContact C-N 3.33Å; G16-S18 PolarHBondContact O-N 2.83Å; S18-Q23 WeakPolarHBondContact OG-CG 3.42Å | ||
| 19 | T | 72.5 | Confident | 67.2 | Low | 86 Ų | 86 | 113.8 Ų | 113.8 | 53% | 0.528 | 60% | 0.596 | S | S | . | * | trans | -59 | 145.3 | -176.7 | 57.9 | 0 | 0 | 0 | 0 | 107.2 | V17 Y21 G22 Q23 | V17-T19 VanDerWaalsContact C-N 3.34Å; V17-T19 PolarHBondContact O-N 3.42Å; T19-Y21 CarbonylContact O-C 3.6Å; T19-Y21 PolarHBondContact O-N 2.94Å; T19-G22 WeakPolarHBondContact O-CA 3.36Å; T19-G22 PolarHBondContact O-N 3.29Å; T19-G22 PolarHBondContact OG1-N 2.94Å; T19-Q23 PolarHBondContact O-N 2.84Å | ||
| 20 | R | 70.8 | Confident | 69.5 | Low | 227 Ų | 227 | 113.1 Ų | 113.1 | 86% | 0.857 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -47.7 | -30.4 | 179.3 | -175.2 | -179.5 | 178.4 | -170.2 | 0.3 | 112.8 | Q24 | R20-Q24 PolarHBondContact O-N 2.99Å |
| 21 | Y | 72.7 | Confident | 71.8 | Confident | 167 Ų | 167 | 114.1 Ų | 114.1 | 66% | 0.655 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -72.2 | -41.2 | 175 | -170.4 | -101.7 | 0 | 0 | 0 | 113.7 | T19 Q24 V25 | T19-Y21 CarbonylContact O-C 3.6Å; T19-Y21 PolarHBondContact O-N 2.94Å; Y21-Q24 WeakPolarHBondContact O-CB 3.32Å; Y21-Q24 PolarHBondContact O-N 3.22Å; Y21-V25 HydrophobicContact CD1-CG2 4.43Å; Y21-V25 HydrophobicContact CE1-CG2 4.1Å; Y21-V25 WeakPolarHBondContact O-CG2 3.22Å; Y21-V25 PolarHBondContact O-N 3.46Å; Y21-V25 VanDerWaalsContact O-N 3.11Å |
| 22 | G | 80.1 | Confident | 74.3 | Confident | 22 Ų | 22 | 115.4 Ų | 115.4 | 23% | 0.227 | 58% | 0.575 | C | S | . | * | H | α-helix | trans | -62.3 | -44.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | T19 Q24 V25 E26 | T19-G22 WeakPolarHBondContact O-CA 3.36Å; T19-G22 PolarHBondContact O-N 3.29Å; T19-G22 PolarHBondContact OG1-N 2.94Å; G22-Q24 PolarHBondContact O-N 3.41Å; G22-V25 PolarHBondContact O-N 3.41Å; G22-E26 PolarHBondContact O-N 2.92Å |
| 23 | Q | 84.3 | Confident | 76.5 | Confident | 103 Ų | 103 | 111.4 Ų | 111.4 | 48% | 0.481 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -60.3 | -36.2 | 174.3 | -63.1 | -178.2 | -23.7 | 0 | 0 | 112.2 | S18 T19 L27 | S18-Q23 WeakPolarHBondContact OG-CG 3.42Å; T19-Q23 PolarHBondContact O-N 2.84Å; Q23-L27 WeakPolarHBondContact O-CB 3.32Å; Q23-L27 VanDerWaalsContact O-CG 3.28Å; Q23-L27 WeakPolarHBondContact O-CG 3.49Å; Q23-L27 PolarHBondContact O-N 2.9Å |
| 24 | Q | 84.8 | Confident | 78.9 | Confident | 97 Ų | 97 | 112.3 Ų | 112.3 | 45% | 0.453 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -68.4 | -36.4 | 178.3 | -172.1 | -179.6 | 16.3 | 0 | 0 | 112.3 | R20 Y21 G22 K28 | R20-Q24 PolarHBondContact O-N 2.99Å; Y21-Q24 WeakPolarHBondContact O-CB 3.32Å; Y21-Q24 PolarHBondContact O-N 3.22Å; G22-Q24 PolarHBondContact O-N 3.41Å; Q24-K28 WeakPolarHBondContact O-CG 3.43Å; Q24-K28 PolarHBondContact O-N 2.85Å |
| 25 | V | 85.9 | Confident | 81.4 | Confident | 69 Ų | 69 | 108.2 Ų | 108.2 | 42% | 0.418 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -70.8 | -46.4 | 176.8 | 175.2 | 0 | 0 | 0 | 0 | 110.6 | Y21 G22 L27 K28 E29 | Y21-V25 HydrophobicContact CD1-CG2 4.43Å; Y21-V25 HydrophobicContact CE1-CG2 4.1Å; Y21-V25 WeakPolarHBondContact O-CG2 3.22Å; Y21-V25 PolarHBondContact O-N 3.46Å; Y21-V25 VanDerWaalsContact O-N 3.11Å; G22-V25 PolarHBondContact O-N 3.41Å; V25-L27 VanDerWaalsContact C-N 3.33Å; V25-L27 PolarHBondContact O-N 3.28Å; V25-K28 WeakPolarHBondContact O-CB 3.49Å; V25-K28 PolarHBondContact O-N 3.18Å; V25-K28 VanDerWaalsContact O-N 3.09Å; V25-E29 PolarHBondContact O-N 3.19Å |
| 26 | E | 88.6 | Confident | 83.5 | Confident | 106 Ų | 106 | 102.1 Ų | 102.1 | 50% | 0.495 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -58.5 | -42.9 | 176.8 | -72.3 | 173.5 | -165.3 | 0 | 0 | 112 | G22 K28 E29 Q30 | G22-E26 PolarHBondContact O-N 2.92Å; E26-K28 VanDerWaalsContact C-N 3.33Å; E26-K28 PolarHBondContact O-N 2.95Å; E26-E29 PolarHBondContact O-N 3.38Å; E26-Q30 WeakPolarHBondContact O-CB 3.49Å; E26-Q30 WeakPolarHBondContact O-CG 3.43Å; E26-Q30 PolarHBondContact O-N 2.95Å |
| 27 | L | 91.1 | Very high | 85.6 | Confident | 98 Ų | 98 | 101.3 Ų | 101.3 | 51% | 0.513 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -65.4 | -34.2 | 176.1 | -76.4 | 170.1 | 0 | 0 | 0 | 113 | Q23 V25 N31 | Q23-L27 WeakPolarHBondContact O-CB 3.32Å; Q23-L27 VanDerWaalsContact O-CG 3.28Å; Q23-L27 WeakPolarHBondContact O-CG 3.49Å; Q23-L27 PolarHBondContact O-N 2.9Å; V25-L27 VanDerWaalsContact C-N 3.33Å; V25-L27 PolarHBondContact O-N 3.28Å; L27-N31 WeakPolarHBondContact O-CB 3.4Å; L27-N31 PolarHBondContact O-N 3.49Å; L27-N31 PolarHBondContact O-ND2 3.41Å |
| 28 | K | 92 | Very high | 87.8 | Confident | 124 Ų | 124 | 101.7 Ų | 101.7 | 54% | 0.539 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -68.2 | -43.9 | 175.4 | -79.3 | 178 | 178.5 | -176.3 | 0 | 111.1 | Q24 V25 E26 N31 Q32 | Q24-K28 WeakPolarHBondContact O-CG 3.43Å; Q24-K28 PolarHBondContact O-N 2.85Å; V25-K28 WeakPolarHBondContact O-CB 3.49Å; V25-K28 PolarHBondContact O-N 3.18Å; V25-K28 VanDerWaalsContact O-N 3.09Å; E26-K28 VanDerWaalsContact C-N 3.33Å; E26-K28 PolarHBondContact O-N 2.95Å; K28-N31 PolarHBondContact O-N 2.86Å; K28-Q32 WeakPolarHBondContact O-CG 3.37Å; K28-Q32 PolarHBondContact O-N 2.9Å |
| 29 | E | 93 | Very high | 89.6 | Confident | 110 Ų | 110 | 105.2 Ų | 105.2 | 51% | 0.514 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.4 | -44.6 | 177.3 | -173.7 | 177.8 | -174.9 | 0 | 0 | 111.4 | V25 E26 N31 Q32 N33 | V25-E29 PolarHBondContact O-N 3.19Å; E26-E29 PolarHBondContact O-N 3.38Å; E29-N31 VanDerWaalsContact C-N 3.34Å; E29-N31 PolarHBondContact O-N 3.45Å; E29-Q32 PolarHBondContact O-N 3.35Å; E29-N33 PolarHBondContact O-N 3.37Å; E29-N33 PolarHBondContact O-ND2 2.79Å |
| 30 | Q | 95.2 | Very high | 90.8 | Very high | 113 Ų | 113 | 107.3 Ų | 107.3 | 53% | 0.528 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -60 | -43 | 174 | -73.9 | 178.1 | 1.6 | 0 | 0 | 112.2 | E26 Q32 N33 L34 | E26-Q30 WeakPolarHBondContact O-CB 3.49Å; E26-Q30 WeakPolarHBondContact O-CG 3.43Å; E26-Q30 PolarHBondContact O-N 2.95Å; Q30-Q32 VanDerWaalsContact C-N 3.34Å; Q30-Q32 PolarHBondContact O-N 3.1Å; Q30-N33 PolarHBondContact O-N 2.94Å; Q30-L34 WeakPolarHBondContact O-CB 3.49Å; Q30-L34 VanDerWaalsContact O-CG 3.29Å; Q30-L34 WeakPolarHBondContact O-CG 3.24Å; Q30-L34 PolarHBondContact O-N 3.46Å |
| 31 | N | 95.4 | Very high | 92.1 | Very high | 98 Ų | 98 | 102.1 Ų | 102.1 | 52% | 0.524 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.7 | -40 | 175.7 | -84.4 | -49.3 | 0 | 0 | 0 | 112.2 | L27 K28 E29 L34 V35 | L27-N31 WeakPolarHBondContact O-CB 3.4Å; L27-N31 PolarHBondContact O-N 3.49Å; L27-N31 PolarHBondContact O-ND2 3.41Å; K28-N31 PolarHBondContact O-N 2.86Å; E29-N31 VanDerWaalsContact C-N 3.34Å; E29-N31 PolarHBondContact O-N 3.45Å; N31-L34 PolarHBondContact O-N 3.34Å; N31-V35 VanDerWaalsContact O-CG2 3.29Å; N31-V35 WeakPolarHBondContact O-CG2 3.29Å; N31-V35 PolarHBondContact O-N 3.32Å |
| 32 | Q | 96 | Very high | 93.4 | Very high | 135 Ų | 135 | 100.3 Ų | 100.3 | 63% | 0.631 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -63 | -45.3 | 175.5 | -74.4 | 174.1 | -15.2 | 0 | 0 | 111.5 | K28 E29 Q30 L34 V35 A36 | K28-Q32 WeakPolarHBondContact O-CG 3.37Å; K28-Q32 PolarHBondContact O-N 2.9Å; E29-Q32 PolarHBondContact O-N 3.35Å; Q30-Q32 VanDerWaalsContact C-N 3.34Å; Q30-Q32 PolarHBondContact O-N 3.1Å; Q32-L34 VanDerWaalsContact C-N 3.31Å; Q32-L34 PolarHBondContact O-N 2.91Å; Q32-V35 PolarHBondContact O-N 3.14Å; Q32-A36 PolarHBondContact O-N 3.33Å |
| 33 | N | 96.4 | Very high | 94.2 | Very high | 98 Ų | 98 | 105.4 Ų | 105.4 | 52% | 0.524 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -62.1 | -39.5 | 176.3 | -68.7 | -23.3 | 0 | 0 | 0 | 111.9 | E29 Q30 A36 A37 | E29-N33 PolarHBondContact O-N 3.37Å; E29-N33 PolarHBondContact O-ND2 2.79Å; Q30-N33 PolarHBondContact O-N 2.94Å; N33-A36 PolarHBondContact O-N 3.23Å; N33-A37 WeakPolarHBondContact O-CB 3.46Å; N33-A37 PolarHBondContact O-N 3.39Å |
| 34 | L | 97.3 | Very high | 94.9 | Very high | 114 Ų | 114 | 103.7 Ų | 103.7 | 60% | 0.597 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -65.9 | -38.7 | 175.3 | -74.6 | 172.3 | 0 | 0 | 0 | 112.3 | Q30 N31 Q32 K38 | Q30-L34 WeakPolarHBondContact O-CB 3.49Å; Q30-L34 VanDerWaalsContact O-CG 3.29Å; Q30-L34 WeakPolarHBondContact O-CG 3.24Å; Q30-L34 PolarHBondContact O-N 3.46Å; N31-L34 PolarHBondContact O-N 3.34Å; Q32-L34 VanDerWaalsContact C-N 3.31Å; Q32-L34 PolarHBondContact O-N 2.91Å; L34-K38 VanDerWaalsContact O-CB 3.23Å; L34-K38 WeakPolarHBondContact O-CB 3.36Å; L34-K38 PolarHBondContact O-N 2.77Å |
| 35 | V | 97.3 | Very high | 95.5 | Very high | 76 Ų | 76 | 103.8 Ų | 103.8 | 46% | 0.461 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -64.9 | -47.5 | 175.4 | 169.8 | 0 | 0 | 0 | 0 | 110.4 | N31 Q32 A37 K38 E39 | N31-V35 VanDerWaalsContact O-CG2 3.29Å; N31-V35 WeakPolarHBondContact O-CG2 3.29Å; N31-V35 PolarHBondContact O-N 3.32Å; Q32-V35 PolarHBondContact O-N 3.14Å; V35-A37 PolarHBondContact O-N 2.91Å; V35-K38 WeakPolarHBondContact O-CB 3.41Å; V35-K38 PolarHBondContact O-N 3.33Å; V35-E39 WeakPolarHBondContact O-CG 3.31Å; V35-E39 PolarHBondContact O-N 2.79Å |
| 36 | A | 96.8 | Very high | 96.1 | Very high | 54 Ų | 54 | 103.4 Ų | 103.4 | 45% | 0.446 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -60.1 | -46.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q32 N33 K38 E39 E40 | Q32-A36 PolarHBondContact O-N 3.33Å; N33-A36 PolarHBondContact O-N 3.23Å; A36-K38 VanDerWaalsContact C-N 3.31Å; A36-K38 PolarHBondContact O-N 2.95Å; A36-E39 PolarHBondContact O-N 3.01Å; A36-E40 PolarHBondContact O-N 2.94Å |
| 37 | A | 97.1 | Very high | 96.5 | Very high | 44 Ų | 44 | 102.6 Ų | 102.6 | 36% | 0.364 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62.9 | -37.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | N33 V35 L41 | N33-A37 WeakPolarHBondContact O-CB 3.46Å; N33-A37 PolarHBondContact O-N 3.39Å; V35-A37 PolarHBondContact O-N 2.91Å; A37-L41 WeakPolarHBondContact O-CB 3.44Å; A37-L41 VanDerWaalsContact O-CG 3.25Å; A37-L41 WeakPolarHBondContact O-CG 3.33Å; A37-L41 PolarHBondContact O-N 3.2Å |
| 38 | K | 97.4 | Very high | 96.9 | Very high | 144 Ų | 144 | 104.8 Ų | 104.8 | 63% | 0.626 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -63.9 | -44.9 | 175.6 | 179.2 | -174.7 | 172.8 | -173 | 0 | 111.5 | L34 V35 A36 L41 Q42 | L34-K38 VanDerWaalsContact O-CB 3.23Å; L34-K38 WeakPolarHBondContact O-CB 3.36Å; L34-K38 PolarHBondContact O-N 2.77Å; V35-K38 WeakPolarHBondContact O-CB 3.41Å; V35-K38 PolarHBondContact O-N 3.33Å; A36-K38 VanDerWaalsContact C-N 3.31Å; A36-K38 PolarHBondContact O-N 2.95Å; K38-L41 PolarHBondContact O-N 2.94Å; K38-Q42 WeakPolarHBondContact O-CB 3.32Å; K38-Q42 PolarHBondContact O-N 3.32Å |
| 39 | E | 97.8 | Very high | 97.2 | Very high | 125 Ų | 125 | 104.1 Ų | 104.1 | 58% | 0.584 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -63.2 | -43.3 | 178 | -72.8 | 174.3 | 178.2 | 0 | 0 | 111.4 | V35 A36 Q42 K43 | V35-E39 WeakPolarHBondContact O-CG 3.31Å; V35-E39 PolarHBondContact O-N 2.79Å; A36-E39 PolarHBondContact O-N 3.01Å; E39-Q42 PolarHBondContact O-N 2.92Å; E39-K43 WeakPolarHBondContact O-CB 3.3Å; E39-K43 PolarHBondContact O-N 2.68Å |
| 40 | E | 97.9 | Very high | 97.4 | Very high | 129 Ų | 129 | 104.1 Ų | 104.1 | 60% | 0.603 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -63.7 | -43.6 | 175.9 | -177.3 | 171.7 | -164.1 | 0 | 0 | 112.2 | A36 Q42 K43 N44 | A36-E40 PolarHBondContact O-N 2.94Å; E40-Q42 VanDerWaalsContact C-N 3.33Å; E40-Q42 PolarHBondContact O-N 3.43Å; E40-K43 PolarHBondContact O-N 2.93Å; E40-N44 WeakPolarHBondContact O-CB 3.35Å; E40-N44 PolarHBondContact O-N 3.08Å; E40-N44 PolarHBondContact O-ND2 3.34Å; E40-N44 VanDerWaalsContact O-ND2 3.12Å |
| 41 | L | 98.1 | Very high | 97.6 | Very high | 118 Ų | 118 | 104.2 Ų | 104.2 | 62% | 0.618 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -62 | -41.1 | 174.6 | -75.8 | 172.6 | 0 | 0 | 0 | 111.8 | A37 K38 N44 L45 | A37-L41 WeakPolarHBondContact O-CB 3.44Å; A37-L41 VanDerWaalsContact O-CG 3.25Å; A37-L41 WeakPolarHBondContact O-CG 3.33Å; A37-L41 PolarHBondContact O-N 3.2Å; K38-L41 PolarHBondContact O-N 2.94Å; L41-N44 PolarHBondContact O-N 3.33Å; L41-L45 VanDerWaalsContact O-CB 3.26Å; L41-L45 WeakPolarHBondContact O-CB 3.36Å; L41-L45 PolarHBondContact O-N 2.91Å |
| 42 | Q | 98.1 | Very high | 97.7 | Very high | 130 Ų | 130 | 103.1 Ų | 103.1 | 61% | 0.607 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -64.9 | -42.6 | 178.1 | -175.2 | 173.6 | -12.2 | 0 | 0 | 111.4 | K38 E39 E40 L45 S46 | K38-Q42 WeakPolarHBondContact O-CB 3.32Å; K38-Q42 PolarHBondContact O-N 3.32Å; E39-Q42 PolarHBondContact O-N 2.92Å; E40-Q42 VanDerWaalsContact C-N 3.33Å; E40-Q42 PolarHBondContact O-N 3.43Å; Q42-L45 PolarHBondContact O-N 3.06Å; Q42-S46 PolarHBondContact O-N 3.36Å; Q42-S46 PolarHBondContact O-OG 2.93Å |
| 43 | K | 98.1 | Very high | 97.8 | Very high | 129 Ų | 129 | 102.8 Ų | 102.8 | 56% | 0.561 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -60.5 | -52.1 | 174.2 | 179.3 | 180 | 169.6 | -175.5 | 0 | 111.2 | E39 E40 L45 S46 E47 | E39-K43 WeakPolarHBondContact O-CB 3.3Å; E39-K43 PolarHBondContact O-N 2.68Å; E40-K43 PolarHBondContact O-N 2.93Å; K43-L45 VanDerWaalsContact C-N 3.26Å; K43-L45 PolarHBondContact O-N 3.08Å; K43-S46 PolarHBondContact O-N 3.49Å; K43-S46 VanDerWaalsContact O-N 3.12Å; K43-S46 PolarHBondContact O-OG 3.14Å; K43-E47 WeakPolarHBondContact CE-OE1 3.3Å; K43-E47 IonicContact NZ-OE1 3.87Å; K43-E47 WeakPolarHBondContact O-CG 3.43Å; K43-E47 PolarHBondContact O-N 2.86Å |
| 44 | N | 98.2 | Very high | 97.9 | Very high | 66 Ų | 66 | 101.7 Ų | 101.7 | 35% | 0.353 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -56.6 | -41.9 | 177.7 | -79.2 | -43.6 | 0 | 0 | 0 | 111.7 | E40 L41 E47 K48 | E40-N44 WeakPolarHBondContact O-CB 3.35Å; E40-N44 PolarHBondContact O-N 3.08Å; E40-N44 PolarHBondContact O-ND2 3.34Å; E40-N44 VanDerWaalsContact O-ND2 3.12Å; L41-N44 PolarHBondContact O-N 3.33Å; N44-E47 PolarHBondContact O-N 3.1Å; N44-K48 VanDerWaalsContact O-CG 3.26Å; N44-K48 WeakPolarHBondContact O-CG 3.22Å; N44-K48 PolarHBondContact O-N 3.42Å |
| 45 | L | 98.2 | Very high | 98 | Very high | 100 Ų | 100 | 99.7 Ų | 99.7 | 52% | 0.524 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.9 | -45.3 | 177.8 | -172.7 | 150.4 | 0 | 0 | 0 | 111.4 | L41 Q42 K43 K48 Q49 | L41-L45 VanDerWaalsContact O-CB 3.26Å; L41-L45 WeakPolarHBondContact O-CB 3.36Å; L41-L45 PolarHBondContact O-N 2.91Å; Q42-L45 PolarHBondContact O-N 3.06Å; K43-L45 VanDerWaalsContact C-N 3.26Å; K43-L45 PolarHBondContact O-N 3.08Å; L45-K48 PolarHBondContact O-N 2.98Å; L45-Q49 HydrophobicContact CD2-CG 4.17Å; L45-Q49 WeakPolarHBondContact O-CG 3.37Å; L45-Q49 PolarHBondContact O-N 3.28Å |
| 46 | S | 98 | Very high | 98 | Very high | 60 Ų | 60 | 101.6 Ų | 101.6 | 42% | 0.42 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.6 | -41.5 | 176.7 | 60.6 | 0 | 0 | 0 | 0 | 113 | Q42 K43 K48 Q49 Q50 | Q42-S46 PolarHBondContact O-N 3.36Å; Q42-S46 PolarHBondContact O-OG 2.93Å; K43-S46 PolarHBondContact O-N 3.49Å; K43-S46 VanDerWaalsContact O-N 3.12Å; K43-S46 PolarHBondContact O-OG 3.14Å; S46-K48 VanDerWaalsContact C-N 3.35Å; S46-K48 PolarHBondContact O-N 3.37Å; S46-Q49 PolarHBondContact O-N 2.87Å; S46-Q50 PolarHBondContact O-N 3.12Å |
| 47 | E | 98.2 | Very high | 98.1 | Very high | 89 Ų | 89 | 104 Ų | 104 | 42% | 0.416 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64.2 | -40.2 | 177.1 | -71.1 | 177.1 | -177.7 | 0 | 0 | 111.7 | K43 N44 R51 | K43-E47 WeakPolarHBondContact CE-OE1 3.3Å; K43-E47 IonicContact NZ-OE1 3.87Å; K43-E47 WeakPolarHBondContact O-CG 3.43Å; K43-E47 PolarHBondContact O-N 2.86Å; N44-E47 PolarHBondContact O-N 3.1Å; E47-R51 WeakPolarHBondContact O-CB 3.46Å; E47-R51 PolarHBondContact O-N 3.42Å |
| 48 | K | 97.9 | Very high | 98.1 | Very high | 145 Ų | 145 | 106.2 Ų | 106.2 | 63% | 0.63 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -68.4 | -39.1 | 176.1 | -65.5 | -57.3 | 177.5 | -168.3 | 0 | 112.1 | N44 L45 S46 R51 V52 | N44-K48 VanDerWaalsContact O-CG 3.26Å; N44-K48 WeakPolarHBondContact O-CG 3.22Å; N44-K48 PolarHBondContact O-N 3.42Å; L45-K48 PolarHBondContact O-N 2.98Å; S46-K48 VanDerWaalsContact C-N 3.35Å; S46-K48 PolarHBondContact O-N 3.37Å; K48-R51 PolarHBondContact O-N 3.31Å; K48-V52 WeakPolarHBondContact O-CG2 3.38Å; K48-V52 PolarHBondContact O-N 2.88Å |
| 49 | Q | 98.3 | Very high | 98.2 | Very high | 110 Ų | 110 | 104.1 Ų | 104.1 | 51% | 0.514 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.8 | -49.9 | 175.2 | -77.5 | 176.2 | -29.6 | 0 | 0 | 111.3 | L45 S46 R51 V52 E53 | L45-Q49 HydrophobicContact CD2-CG 4.17Å; L45-Q49 WeakPolarHBondContact O-CG 3.37Å; L45-Q49 PolarHBondContact O-N 3.28Å; S46-Q49 PolarHBondContact O-N 2.87Å; Q49-R51 VanDerWaalsContact C-N 3.26Å; Q49-R51 PolarHBondContact O-N 3.38Å; Q49-V52 WeakPolarHBondContact O-CB 3.47Å; Q49-V52 PolarHBondContact O-N 2.92Å; Q49-E53 PolarHBondContact O-N 3.32Å |
| 50 | Q | 98.3 | Very high | 98.2 | Very high | 109 Ų | 109 | 102.2 Ų | 102.2 | 51% | 0.509 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -57.4 | -42.2 | 175.6 | -175.8 | -175.2 | -21.3 | 0 | 0 | 111.4 | S46 V52 E53 E54 | S46-Q50 PolarHBondContact O-N 3.12Å; Q50-V52 VanDerWaalsContact C-N 3.29Å; Q50-V52 PolarHBondContact O-N 3.46Å; Q50-E53 PolarHBondContact O-N 3.3Å; Q50-E54 PolarHBondContact NE2-OE1 3.48Å; Q50-E54 WeakPolarHBondContact O-CG 3.34Å; Q50-E54 PolarHBondContact O-N 3.38Å |
| 51 | R | 98.2 | Very high | 98.2 | Very high | 116 Ų | 116 | 100.8 Ų | 100.8 | 44% | 0.438 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.4 | -34.7 | 178.3 | -175.5 | 56.3 | -179.7 | 167.4 | 5.8 | 112.9 | E47 K48 Q49 E54 L55 | E47-R51 WeakPolarHBondContact O-CB 3.46Å; E47-R51 PolarHBondContact O-N 3.42Å; K48-R51 PolarHBondContact O-N 3.31Å; Q49-R51 VanDerWaalsContact C-N 3.26Å; Q49-R51 PolarHBondContact O-N 3.38Å; R51-E54 IonicContact CZ-OE2 3.36Å; R51-E54 IonicContact NH1-OE2 2.89Å; R51-E54 PolarHBondContact NH1-OE2 2.9Å; R51-L55 HydrophobicContact CG-CD1 4.27Å; R51-L55 VanDerWaalsContact O-CG 3.27Å; R51-L55 WeakPolarHBondContact O-CG 3.46Å; R51-L55 PolarHBondContact O-N 3.28Å; R51-L55 VanDerWaalsContact O-N 3.15Å |
| 52 | V | 98.4 | Very high | 98.2 | Very high | 75 Ų | 75 | 100 Ų | 100 | 46% | 0.455 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -66 | -46.9 | 174.7 | 168.9 | 0 | 0 | 0 | 0 | 110 | K48 Q49 Q50 E54 L55 E56 | K48-V52 WeakPolarHBondContact O-CG2 3.38Å; K48-V52 PolarHBondContact O-N 2.88Å; Q49-V52 WeakPolarHBondContact O-CB 3.47Å; Q49-V52 PolarHBondContact O-N 2.92Å; Q50-V52 VanDerWaalsContact C-N 3.29Å; Q50-V52 PolarHBondContact O-N 3.46Å; V52-E54 VanDerWaalsContact C-N 3.32Å; V52-E54 PolarHBondContact O-N 3.07Å; V52-L55 PolarHBondContact O-N 2.95Å; V52-L55 VanDerWaalsContact O-N 3.09Å; V52-E56 HydrophobicContact CG1-CG 4.3Å; V52-E56 WeakPolarHBondContact O-CG 3.38Å; V52-E56 PolarHBondContact O-N 3.04Å |
| 53 | E | 98.2 | Very high | 98.2 | Very high | 128 Ų | 128 | 99.6 Ų | 99.6 | 60% | 0.598 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -58.4 | -42.5 | 177.5 | -67.9 | 172.5 | -171.9 | 0 | 0 | 112 | Q49 Q50 L55 E56 L57 | Q49-E53 PolarHBondContact O-N 3.32Å; Q50-E53 PolarHBondContact O-N 3.3Å; E53-L55 VanDerWaalsContact C-N 3.35Å; E53-L55 PolarHBondContact O-N 3.06Å; E53-E56 PolarHBondContact O-N 2.94Å; E53-L57 PolarHBondContact O-N 2.92Å |
| 54 | E | 98.3 | Very high | 98.2 | Very high | 74 Ų | 74 | 100.3 Ų | 100.3 | 35% | 0.346 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61 | -41.7 | 174.8 | -73.2 | 172 | -171.3 | 0 | 0 | 112.6 | Q50 R51 V52 L57 Q58 | Q50-E54 PolarHBondContact NE2-OE1 3.48Å; Q50-E54 WeakPolarHBondContact O-CG 3.34Å; Q50-E54 PolarHBondContact O-N 3.38Å; R51-E54 IonicContact CZ-OE2 3.36Å; R51-E54 IonicContact NH1-OE2 2.89Å; R51-E54 PolarHBondContact NH1-OE2 2.9Å; V52-E54 VanDerWaalsContact C-N 3.32Å; V52-E54 PolarHBondContact O-N 3.07Å; E54-L57 PolarHBondContact O-N 3.33Å; E54-Q58 WeakPolarHBondContact O-CG 3.45Å; E54-Q58 PolarHBondContact O-N 3.39Å; E54-Q58 VanDerWaalsContact O-N 3.12Å |
| 55 | L | 98.4 | Very high | 98.2 | Very high | 73 Ų | 73 | 101.9 Ų | 101.9 | 38% | 0.382 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -71.6 | -35.9 | -179.9 | -74 | 170.7 | 0 | 0 | 0 | 112.1 | R51 V52 E53 Q58 L59 | R51-L55 HydrophobicContact CG-CD1 4.27Å; R51-L55 VanDerWaalsContact O-CG 3.27Å; R51-L55 WeakPolarHBondContact O-CG 3.46Å; R51-L55 PolarHBondContact O-N 3.28Å; R51-L55 VanDerWaalsContact O-N 3.15Å; V52-L55 PolarHBondContact O-N 2.95Å; V52-L55 VanDerWaalsContact O-N 3.09Å; E53-L55 VanDerWaalsContact C-N 3.35Å; E53-L55 PolarHBondContact O-N 3.06Å; L55-Q58 PolarHBondContact O-N 2.86Å; L55-L59 WeakPolarHBondContact O-CB 3.49Å; L55-L59 PolarHBondContact O-N 3.37Å |
| 56 | E | 98.2 | Very high | 98.2 | Very high | 115 Ų | 115 | 101.2 Ų | 101.2 | 54% | 0.537 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.3 | -44.2 | 173.8 | -73.3 | 176.2 | 166.1 | 0 | 0 | 110.7 | V52 E53 Q58 L59 D60 | V52-E56 HydrophobicContact CG1-CG 4.3Å; V52-E56 WeakPolarHBondContact O-CG 3.38Å; V52-E56 PolarHBondContact O-N 3.04Å; E53-E56 PolarHBondContact O-N 2.94Å; E56-Q58 PolarHBondContact O-N 2.94Å; E56-L59 WeakPolarHBondContact O-CB 3.33Å; E56-L59 PolarHBondContact O-N 3.31Å; E56-D60 PolarHBondContact O-N 3.4Å |
| 57 | L | 98.2 | Very high | 98.2 | Very high | 104 Ų | 104 | 103 Ų | 103 | 55% | 0.545 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59.2 | -46.5 | 174.5 | -168.9 | 91.3 | 0 | 0 | 0 | 112 | E53 E54 L59 D60 E61 | E53-L57 PolarHBondContact O-N 2.92Å; E54-L57 PolarHBondContact O-N 3.33Å; L57-L59 VanDerWaalsContact C-N 3.31Å; L57-L59 PolarHBondContact O-N 3.16Å; L57-D60 PolarHBondContact O-N 3.13Å; L57-E61 WeakPolarHBondContact O-CG 3.44Å; L57-E61 PolarHBondContact O-N 2.92Å |
| 58 | Q | 98.3 | Very high | 98.2 | Very high | 92 Ų | 92 | 104.5 Ų | 104.5 | 43% | 0.43 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.8 | -38.1 | 177.9 | -73.1 | 179.6 | -3 | 0 | 0 | 112.2 | E54 L55 E56 E61 L62 | E54-Q58 WeakPolarHBondContact O-CG 3.45Å; E54-Q58 PolarHBondContact O-N 3.39Å; E54-Q58 VanDerWaalsContact O-N 3.12Å; L55-Q58 PolarHBondContact O-N 2.86Å; E56-Q58 PolarHBondContact O-N 2.94Å; Q58-E61 PolarHBondContact O-N 3.16Å; Q58-L62 WeakPolarHBondContact O-CB 3.46Å; Q58-L62 VanDerWaalsContact O-CG 3.28Å; Q58-L62 WeakPolarHBondContact O-CG 3.32Å; Q58-L62 PolarHBondContact O-N 3.24Å |
| 59 | L | 98.2 | Very high | 98.2 | Very high | 100 Ų | 100 | 103.8 Ų | 103.8 | 52% | 0.524 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.9 | -43.1 | 174.8 | -88 | 170.7 | 0 | 0 | 0 | 111.5 | L55 E56 L57 E61 L62 Q63 | L55-L59 WeakPolarHBondContact O-CB 3.49Å; L55-L59 PolarHBondContact O-N 3.37Å; E56-L59 WeakPolarHBondContact O-CB 3.33Å; E56-L59 PolarHBondContact O-N 3.31Å; L57-L59 VanDerWaalsContact C-N 3.31Å; L57-L59 PolarHBondContact O-N 3.16Å; L59-E61 VanDerWaalsContact C-N 3.35Å; L59-E61 PolarHBondContact O-N 3.28Å; L59-L62 PolarHBondContact O-N 2.99Å; L59-Q63 WeakPolarHBondContact O-CB 3.46Å; L59-Q63 VanDerWaalsContact O-CG 3.28Å; L59-Q63 WeakPolarHBondContact O-CG 3.25Å; L59-Q63 PolarHBondContact O-N 2.95Å |
| 60 | D | 98.2 | Very high | 98.2 | Very high | 84 Ų | 84 | 103.4 Ų | 103.4 | 45% | 0.449 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.4 | -40.5 | 177.8 | -75.4 | -10.5 | 0 | 0 | 0 | 112.1 | E56 L57 Q63 K64 | E56-D60 PolarHBondContact O-N 3.4Å; L57-D60 PolarHBondContact O-N 3.13Å; D60-Q63 PolarHBondContact O-N 3.36Å; D60-K64 WeakPolarHBondContact O-CG 3.46Å; D60-K64 PolarHBondContact O-N 3.48Å; D60-K64 VanDerWaalsContact O-N 3.12Å |
| 61 | E | 98.1 | Very high | 98.1 | Very high | 100 Ų | 100 | 104.1 Ų | 104.1 | 47% | 0.467 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.7 | -49.7 | 174.2 | -71.8 | 177.3 | 172.8 | 0 | 0 | 111.5 | L57 Q58 L59 Q63 K64 E65 | L57-E61 WeakPolarHBondContact O-CG 3.44Å; L57-E61 PolarHBondContact O-N 2.92Å; Q58-E61 PolarHBondContact O-N 3.16Å; L59-E61 VanDerWaalsContact C-N 3.35Å; L59-E61 PolarHBondContact O-N 3.28Å; E61-Q63 VanDerWaalsContact C-N 3.29Å; E61-Q63 PolarHBondContact O-N 3.05Å; E61-K64 WeakPolarHBondContact O-CB 3.33Å; E61-K64 PolarHBondContact O-N 3.05Å; E61-K64 VanDerWaalsContact O-N 3.1Å; E61-E65 PolarHBondContact O-N 3.25Å |
| 62 | L | 98.3 | Very high | 98 | Very high | 101 Ų | 101 | 102 Ų | 102 | 53% | 0.529 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.4 | -36.2 | 177.9 | -74 | 171.5 | 0 | 0 | 0 | 112.5 | Q58 L59 E65 N66 | Q58-L62 WeakPolarHBondContact O-CB 3.46Å; Q58-L62 VanDerWaalsContact O-CG 3.28Å; Q58-L62 WeakPolarHBondContact O-CG 3.32Å; Q58-L62 PolarHBondContact O-N 3.24Å; L59-L62 PolarHBondContact O-N 2.99Å; L62-E65 PolarHBondContact O-N 2.94Å; L62-N66 VanDerWaalsContact O-CB 3.29Å; L62-N66 WeakPolarHBondContact O-CB 3.49Å; L62-N66 PolarHBondContact O-N 3Å |
| 63 | Q | 98.3 | Very high | 97.9 | Very high | 121 Ų | 121 | 104.4 Ų | 104.4 | 57% | 0.565 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -64.5 | -42 | 174.7 | -77.7 | 179 | 11.7 | 0 | 0 | 111.7 | L59 D60 E61 N66 V67 | L59-Q63 WeakPolarHBondContact O-CB 3.46Å; L59-Q63 VanDerWaalsContact O-CG 3.28Å; L59-Q63 WeakPolarHBondContact O-CG 3.25Å; L59-Q63 PolarHBondContact O-N 2.95Å; D60-Q63 PolarHBondContact O-N 3.36Å; E61-Q63 VanDerWaalsContact C-N 3.29Å; E61-Q63 PolarHBondContact O-N 3.05Å; Q63-N66 PolarHBondContact O-N 3.42Å; Q63-V67 WeakPolarHBondContact O-CG2 3.34Å; Q63-V67 PolarHBondContact O-N 3.44Å; Q63-V67 VanDerWaalsContact O-N 3.07Å |
| 64 | K | 98.1 | Very high | 97.7 | Very high | 145 Ų | 145 | 104.1 Ų | 104.1 | 63% | 0.63 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62.7 | -47.3 | 175.5 | -70.1 | 167.3 | -171.7 | 167 | 0 | 111.4 | D60 E61 N66 V67 E68 | D60-K64 WeakPolarHBondContact O-CG 3.46Å; D60-K64 PolarHBondContact O-N 3.48Å; D60-K64 VanDerWaalsContact O-N 3.12Å; E61-K64 WeakPolarHBondContact O-CB 3.33Å; E61-K64 PolarHBondContact O-N 3.05Å; E61-K64 VanDerWaalsContact O-N 3.1Å; K64-N66 VanDerWaalsContact C-N 3.32Å; K64-N66 PolarHBondContact O-N 2.97Å; K64-V67 PolarHBondContact O-N 3.25Å; K64-E68 PolarHBondContact O-N 3.39Å |
| 65 | E | 98.1 | Very high | 97.5 | Very high | 98 Ų | 98 | 103.6 Ų | 103.6 | 46% | 0.458 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60 | -41.6 | 176.7 | -71.6 | -175.4 | 178 | 0 | 0 | 111.8 | E61 L62 V67 E68 F69 | E61-E65 PolarHBondContact O-N 3.25Å; L62-E65 PolarHBondContact O-N 2.94Å; E65-V67 PolarHBondContact O-N 2.89Å; E65-E68 PolarHBondContact O-N 2.88Å; E65-F69 HydrophobicContact CB-CD2 4.41Å; E65-F69 HydrophobicContact CB-CE2 4.23Å; E65-F69 WeakPolarHBondContact O-CD2 3.29Å; E65-F69 WeakPolarHBondContact O-CG 3.26Å; E65-F69 PolarHBondContact O-N 2.95Å |
| 66 | N | 98.1 | Very high | 97.1 | Very high | 87 Ų | 87 | 103.4 Ų | 103.4 | 47% | 0.465 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.5 | -44.7 | 177.6 | -168.3 | -28.8 | 0 | 0 | 0 | 111.6 | L62 Q63 K64 E68 F69 Q70 | L62-N66 VanDerWaalsContact O-CB 3.29Å; L62-N66 WeakPolarHBondContact O-CB 3.49Å; L62-N66 PolarHBondContact O-N 3Å; Q63-N66 PolarHBondContact O-N 3.42Å; K64-N66 VanDerWaalsContact C-N 3.32Å; K64-N66 PolarHBondContact O-N 2.97Å; N66-E68 VanDerWaalsContact C-N 3.31Å; N66-E68 PolarHBondContact O-N 3.46Å; N66-F69 PolarHBondContact O-N 2.93Å; N66-Q70 VanDerWaalsContact O-CG 3.3Å; N66-Q70 WeakPolarHBondContact O-CG 3.42Å; N66-Q70 PolarHBondContact O-N 3.31Å; N66-Q70 PolarHBondContact OD1-NE2 3.39Å |
| 67 | V | 98.2 | Very high | 96.6 | Very high | 98 Ų | 98 | 103.2 Ų | 103.2 | 59% | 0.594 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -60.4 | -42.3 | 174.6 | 171.9 | 0 | 0 | 0 | 0 | 111.1 | Q63 K64 E65 Q70 K71 | Q63-V67 WeakPolarHBondContact O-CG2 3.34Å; Q63-V67 PolarHBondContact O-N 3.44Å; Q63-V67 VanDerWaalsContact O-N 3.07Å; K64-V67 PolarHBondContact O-N 3.25Å; E65-V67 PolarHBondContact O-N 2.89Å; V67-Q70 PolarHBondContact O-N 2.94Å; V67-K71 PolarHBondContact O-N 2.99Å |
| 68 | E | 98.1 | Very high | 96.2 | Very high | 120 Ų | 120 | 106.6 Ų | 106.6 | 56% | 0.561 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -63.9 | -45.2 | 176.7 | -173.2 | 172.9 | -177.7 | 0 | 0 | 112.1 | K64 E65 N66 Q70 K71 N72 | K64-E68 PolarHBondContact O-N 3.39Å; E65-E68 PolarHBondContact O-N 2.88Å; N66-E68 VanDerWaalsContact C-N 3.31Å; N66-E68 PolarHBondContact O-N 3.46Å; E68-Q70 VanDerWaalsContact C-N 3.35Å; E68-Q70 PolarHBondContact O-N 2.69Å; E68-K71 WeakPolarHBondContact O-CB 3.49Å; E68-K71 PolarHBondContact O-N 3.12Å; E68-N72 WeakPolarHBondContact O-CB 3.35Å; E68-N72 VanDerWaalsContact O-CG 3.26Å; E68-N72 PolarHBondContact O-N 3.38Å; E68-N72 PolarHBondContact O-ND2 3.23Å |
| 69 | F | 97.7 | Very high | 95.7 | Very high | 129 Ų | 129 | 107.8 Ų | 107.8 | 57% | 0.566 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -61.1 | -42 | 175.7 | -76.5 | -52.4 | 0 | 0 | 0 | 112.4 | E65 N66 K71 N72 L73 | E65-F69 HydrophobicContact CB-CD2 4.41Å; E65-F69 HydrophobicContact CB-CE2 4.23Å; E65-F69 WeakPolarHBondContact O-CD2 3.29Å; E65-F69 WeakPolarHBondContact O-CG 3.26Å; E65-F69 PolarHBondContact O-N 2.95Å; N66-F69 PolarHBondContact O-N 2.93Å; F69-K71 VanDerWaalsContact C-N 3.33Å; F69-K71 PolarHBondContact O-N 3.47Å; F69-N72 PolarHBondContact O-N 2.88Å; F69-L73 WeakPolarHBondContact O-CB 3.47Å; F69-L73 WeakPolarHBondContact O-CG 3.36Å; F69-L73 PolarHBondContact O-N 3.49Å |
| 70 | Q | 97.6 | Very high | 95.1 | Very high | 102 Ų | 102 | 105.7 Ų | 105.7 | 48% | 0.477 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61.5 | -42.9 | 176 | -73.6 | 177.7 | 16 | 0 | 0 | 111.7 | N66 V67 E68 L73 Q74 | N66-Q70 VanDerWaalsContact O-CG 3.3Å; N66-Q70 WeakPolarHBondContact O-CG 3.42Å; N66-Q70 PolarHBondContact O-N 3.31Å; N66-Q70 PolarHBondContact OD1-NE2 3.39Å; V67-Q70 PolarHBondContact O-N 2.94Å; E68-Q70 VanDerWaalsContact C-N 3.35Å; E68-Q70 PolarHBondContact O-N 2.69Å; Q70-L73 PolarHBondContact O-N 2.89Å; Q70-Q74 WeakPolarHBondContact O-CG 3.27Å; Q70-Q74 PolarHBondContact O-N 3.39Å |
| 71 | K | 97.6 | Very high | 94.3 | Very high | 125 Ų | 125 | 105.7 Ų | 105.7 | 54% | 0.543 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.4 | -48.5 | 175.2 | -176.1 | -174 | 173 | -169.5 | 0 | 111.1 | V67 E68 F69 L73 Q74 D75 | V67-K71 PolarHBondContact O-N 2.99Å; E68-K71 WeakPolarHBondContact O-CB 3.49Å; E68-K71 PolarHBondContact O-N 3.12Å; F69-K71 VanDerWaalsContact C-N 3.33Å; F69-K71 PolarHBondContact O-N 3.47Å; K71-L73 VanDerWaalsContact C-N 3.29Å; K71-L73 PolarHBondContact O-N 2.99Å; K71-Q74 WeakPolarHBondContact O-CB 3.48Å; K71-Q74 PolarHBondContact O-N 2.89Å; K71-Q74 VanDerWaalsContact O-N 3.12Å; K71-D75 PolarHBondContact O-N 2.86Å |
| 72 | N | 96.4 | Very high | 93.5 | Very high | 72 Ų | 72 | 105.2 Ų | 105.2 | 39% | 0.385 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.2 | -40.2 | 178.6 | -69.5 | -17.1 | 0 | 0 | 0 | 111.7 | E68 F69 D75 C76 | E68-N72 WeakPolarHBondContact O-CB 3.35Å; E68-N72 VanDerWaalsContact O-CG 3.26Å; E68-N72 PolarHBondContact O-N 3.38Å; E68-N72 PolarHBondContact O-ND2 3.23Å; F69-N72 PolarHBondContact O-N 2.88Å; N72-D75 PolarHBondContact O-N 3.32Å; N72-C76 WeakPolarHBondContact O-CB 3.47Å; N72-C76 PolarHBondContact O-N 2.93Å; N72-C76 PolarHBondContact O-SG 3.22Å |
| 73 | L | 94.8 | Very high | 92.7 | Very high | 124 Ų | 124 | 103 Ų | 103 | 65% | 0.649 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63.2 | -42.8 | 174.5 | -76.9 | 170.5 | 0 | 0 | 0 | 112.3 | F69 Q70 K71 C76 H77 | F69-L73 WeakPolarHBondContact O-CB 3.47Å; F69-L73 WeakPolarHBondContact O-CG 3.36Å; F69-L73 PolarHBondContact O-N 3.49Å; Q70-L73 PolarHBondContact O-N 2.89Å; K71-L73 VanDerWaalsContact C-N 3.29Å; K71-L73 PolarHBondContact O-N 2.99Å; L73-C76 PolarHBondContact O-N 3.38Å; L73-H77 WeakPolarHBondContact O-CB 3.43Å; L73-H77 PolarHBondContact O-N 3.36Å |
| 74 | Q | 94.4 | Very high | 91.8 | Very high | 123 Ų | 123 | 106.6 Ų | 106.6 | 58% | 0.575 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -64.1 | -41.5 | 175.9 | -73.2 | 178.4 | 2.8 | 0 | 0 | 112 | Q70 K71 H77 R78 | Q70-Q74 WeakPolarHBondContact O-CG 3.27Å; Q70-Q74 PolarHBondContact O-N 3.39Å; K71-Q74 WeakPolarHBondContact O-CB 3.48Å; K71-Q74 PolarHBondContact O-N 2.89Å; K71-Q74 VanDerWaalsContact O-N 3.12Å; Q74-H77 PolarHBondContact O-N 2.9Å; Q74-R78 WeakPolarHBondContact O-CB 3.3Å; Q74-R78 PolarHBondContact O-N 3.42Å |
| 75 | D | 94.4 | Very high | 90.4 | Very high | 63 Ų | 63 | 102.8 Ų | 102.8 | 34% | 0.337 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -65.3 | -45.7 | 177.7 | -73 | -20 | 0 | 0 | 0 | 110.9 | K71 N72 H77 R78 L79 | K71-D75 PolarHBondContact O-N 2.86Å; N72-D75 PolarHBondContact O-N 3.32Å; D75-H77 PolarHBondContact O-N 3.32Å; D75-R78 WeakPolarHBondContact O-CB 3.48Å; D75-R78 PolarHBondContact O-N 3.44Å; D75-L79 WeakPolarHBondContact O-CG 3.43Å; D75-L79 PolarHBondContact O-N 3.44Å |
| 76 | C | 89.9 | Confident | 88.9 | Confident | 69 Ų | 69 | 100.3 Ų | 100.3 | 47% | 0.466 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -58.1 | -47.2 | 172.6 | -75.4 | 0 | 0 | 0 | 0 | 111.8 | N72 L73 R78 L79 L80 | N72-C76 WeakPolarHBondContact O-CB 3.47Å; N72-C76 PolarHBondContact O-N 2.93Å; N72-C76 PolarHBondContact O-SG 3.22Å; L73-C76 PolarHBondContact O-N 3.38Å; C76-R78 VanDerWaalsContact C-N 3.31Å; C76-R78 PolarHBondContact O-N 3.29Å; C76-L79 PolarHBondContact O-N 2.87Å; C76-L80 VanDerWaalsContact O-CG 3.27Å; C76-L80 WeakPolarHBondContact O-CG 3.33Å; C76-L80 PolarHBondContact O-N 3.42Å |
| 77 | H | 87.7 | Confident | 87.3 | Confident | 111 Ų | 111 | 100 Ų | 100 | 51% | 0.514 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -58 | -44.6 | 177.3 | 179.6 | 70.3 | 0 | 0 | 0 | 111.6 | L73 Q74 D75 L79 L80 V81 | L73-H77 WeakPolarHBondContact O-CB 3.43Å; L73-H77 PolarHBondContact O-N 3.36Å; Q74-H77 PolarHBondContact O-N 2.9Å; D75-H77 PolarHBondContact O-N 3.32Å; H77-L79 PolarHBondContact O-N 3.04Å; H77-L80 PolarHBondContact O-N 3.23Å; H77-V81 WeakPolarHBondContact O-CG2 3.38Å; H77-V81 PolarHBondContact O-N 3.47Å |
| 78 | R | 89.3 | Confident | 85.7 | Confident | 174 Ų | 174 | 101.4 Ų | 101.4 | 66% | 0.657 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -60.1 | -44.8 | 176.9 | -169.8 | -171.1 | -56.2 | -121.5 | 0.1 | 111.9 | Q74 D75 C76 S82 | Q74-R78 WeakPolarHBondContact O-CB 3.3Å; Q74-R78 PolarHBondContact O-N 3.42Å; D75-R78 WeakPolarHBondContact O-CB 3.48Å; D75-R78 PolarHBondContact O-N 3.44Å; C76-R78 VanDerWaalsContact C-N 3.31Å; C76-R78 PolarHBondContact O-N 3.29Å; R78-S82 VanDerWaalsContact O-CB 3.29Å; R78-S82 WeakPolarHBondContact O-CB 3.28Å; R78-S82 PolarHBondContact O-N 3.19Å; R78-S82 PolarHBondContact O-OG 3.26Å |
| 79 | L | 88.8 | Confident | 83.8 | Confident | 117 Ų | 117 | 99.4 Ų | 99.4 | 61% | 0.613 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -61.2 | -47 | 177 | -70.9 | 174.3 | 0 | 0 | 0 | 111.3 | D75 C76 H77 S82 A83 | D75-L79 WeakPolarHBondContact O-CG 3.43Å; D75-L79 PolarHBondContact O-N 3.44Å; C76-L79 PolarHBondContact O-N 2.87Å; H77-L79 PolarHBondContact O-N 3.04Å; L79-S82 WeakPolarHBondContact CA-OG 3.44Å; L79-S82 PolarHBondContact O-N 2.92Å; L79-S82 PolarHBondContact O-OG 3.07Å; L79-A83 WeakPolarHBondContact O-CB 3.36Å; L79-A83 PolarHBondContact O-N 3.47Å |
| 80 | L | 84.3 | Confident | 81.8 | Confident | 57 Ų | 57 | 96.2 Ų | 96.2 | 30% | 0.298 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.1 | -47.1 | 179.9 | -66.8 | 169.5 | 0 | 0 | 0 | 111.8 | C76 H77 S82 A83 K84 I85 P87 | C76-L80 VanDerWaalsContact O-CG 3.27Å; C76-L80 WeakPolarHBondContact O-CG 3.33Å; C76-L80 PolarHBondContact O-N 3.42Å; H77-L80 PolarHBondContact O-N 3.23Å; L80-S82 VanDerWaalsContact C-N 3.34Å; L80-S82 PolarHBondContact O-N 3.49Å; L80-A83 CarbonylContact O-C 3.58Å; L80-A83 PolarHBondContact O-N 2.99Å; L80-K84 PolarHBondContact O-N 2.88Å; L80-K84 VanDerWaalsContact O-N 3.13Å; L80-I85 HydrophobicContact CD2-CB 4.04Å; L80-I85 HydrophobicContact CD2-CG2 3.7Å; L80-I85 PolarHBondContact O-N 3.39Å; L80-P87 HydrophobicContact CD1-CB 4Å |
| 81 | V | 83.2 | Confident | 79.8 | Confident | 84 Ų | 84 | 98.9 Ų | 98.9 | 51% | 0.509 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -61 | -43.2 | 175.1 | 172.4 | 0 | 0 | 0 | 0 | 111.3 | H77 A83 K84 | H77-V81 WeakPolarHBondContact O-CG2 3.38Å; H77-V81 PolarHBondContact O-N 3.47Å; V81-A83 VanDerWaalsContact C-N 3.27Å; V81-A83 PolarHBondContact O-N 2.82Å; V81-K84 PolarHBondContact O-N 3.46Å |
| 82 | S | 81.3 | Confident | 77.9 | Confident | 89 Ų | 89 | 100.2 Ų | 100.2 | 62% | 0.622 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -62.4 | -36.2 | 178.5 | 76.3 | 0 | 0 | 0 | 0 | 112.6 | R78 L79 L80 K84 | R78-S82 VanDerWaalsContact O-CB 3.29Å; R78-S82 WeakPolarHBondContact O-CB 3.28Å; R78-S82 PolarHBondContact O-N 3.19Å; R78-S82 PolarHBondContact O-OG 3.26Å; L79-S82 WeakPolarHBondContact CA-OG 3.44Å; L79-S82 PolarHBondContact O-N 2.92Å; L79-S82 PolarHBondContact O-OG 3.07Å; L80-S82 VanDerWaalsContact C-N 3.34Å; L80-S82 PolarHBondContact O-N 3.49Å; S82-K84 PolarHBondContact O-N 3.33Å |
| 83 | A | 81.4 | Confident | 76 | Confident | 56 Ų | 56 | 100 Ų | 100 | 46% | 0.463 | 53% | 0.533 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.6 | -0.2 | 176 | 0 | 0 | 0 | 0 | 0 | 113.1 | L79 L80 V81 I85 | L79-A83 WeakPolarHBondContact O-CB 3.36Å; L79-A83 PolarHBondContact O-N 3.47Å; L80-A83 CarbonylContact O-C 3.58Å; L80-A83 PolarHBondContact O-N 2.99Å; V81-A83 VanDerWaalsContact C-N 3.27Å; V81-A83 PolarHBondContact O-N 2.82Å; A83-I85 HydrophobicContact CB-CB 4.34Å; A83-I85 HydrophobicContact CB-CD1 3.56Å; A83-I85 HydrophobicContact CB-CG1 3.65Å; A83-I85 PolarHBondContact O-N 3.5Å; A83-I85 VanDerWaalsContact O-N 3.16Å |
| 84 | K | 78.3 | Confident | 74.4 | Confident | 196 Ų | 196 | 95.7 Ų | 95.7 | 85% | 0.852 | 52% | 0.519 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.8 | 28.3 | -170.6 | -55.4 | -178.9 | -179.5 | -179.6 | 0 | 112.6 | L80 V81 S82 | L80-K84 PolarHBondContact O-N 2.88Å; L80-K84 VanDerWaalsContact O-N 3.13Å; V81-K84 PolarHBondContact O-N 3.46Å; S82-K84 PolarHBondContact O-N 3.33Å |
| 85 | I | 69.3 | Low | 73.2 | Confident | 64 Ų | 64 | 93.8 Ų | 93.8 | 33% | 0.328 | 51% | 0.513 | S | S | . | . | trans | -86.1 | 119.8 | 176.4 | -65.5 | 174.8 | 0 | 0 | 0 | 106.9 | L80 A83 P87 V93 | L80-I85 HydrophobicContact CD2-CB 4.04Å; L80-I85 HydrophobicContact CD2-CG2 3.7Å; L80-I85 PolarHBondContact O-N 3.39Å; A83-I85 HydrophobicContact CB-CB 4.34Å; A83-I85 HydrophobicContact CB-CD1 3.56Å; A83-I85 HydrophobicContact CB-CG1 3.65Å; A83-I85 PolarHBondContact O-N 3.5Å; A83-I85 VanDerWaalsContact O-N 3.16Å; I85-P87 VanDerWaalsContact O-CD 3.26Å; I85-P87 WeakPolarHBondContact O-CD 3.13Å; I85-V93 HydrophobicContact CG2-CG2 3.77Å | ||
| 86 | D | 66.4 | Low | 72 | Confident | 46 Ų | 46 | 93.5 Ų | 93.5 | 25% | 0.246 | 52% | 0.519 | C | S | . | . | trans | -77.5 | 113.1 | 175 | -171 | -24.4 | 0 | 0 | 0 | 109.4 | V88 L89 R92 | D86-V88 PolarHBondContact O-N 3.12Å; D86-V88 WeakPolarHBondContact OD1-CB 3.29Å; D86-V88 PolarHBondContact OD1-N 3.03Å; D86-L89 HydrophobicContact CB-CB 4.36Å; D86-L89 PolarHBondContact OD1-N 3.44Å; D86-L89 WeakPolarHBondContact OD2-CD1 3.5Å; D86-R92 IonicContact OD2-NH1 2.86Å | ||
| 87 | P | 63.9 | Low | 71.2 | Confident | 80 Ų | 80 | 93.1 Ų | 93.1 | 52% | 0.519 | 52% | 0.521 | S | S | . | . | S | Bend | trans | -67.5 | -17.9 | -179.6 | 24 | -30.4 | 0 | 0 | 0 | 113.8 | L80 I85 | L80-P87 HydrophobicContact CD1-CB 4Å; I85-P87 VanDerWaalsContact O-CD 3.26Å; I85-P87 WeakPolarHBondContact O-CD 3.13Å |
| 88 | V | 64.6 | Low | 70.8 | Confident | 128 Ų | 128 | 95.9 Ų | 95.9 | 78% | 0.776 | 53% | 0.527 | S | S | * | . | S | Bend | trans | -94.2 | -23.9 | -174.2 | -173.5 | 0 | 0 | 0 | 0 | 111.5 | D86 | D86-V88 PolarHBondContact O-N 3.12Å; D86-V88 WeakPolarHBondContact OD1-CB 3.29Å; D86-V88 PolarHBondContact OD1-N 3.03Å |
| 89 | L | 57.6 | Low | 70.5 | Confident | 79 Ų | 79 | 93.3 Ų | 93.3 | 41% | 0.414 | 52% | 0.523 | S | S | . | . | trans | -116.4 | 78.3 | -178.4 | -65.4 | 172.5 | 0 | 0 | 0 | 110.1 | D86 E91 R92 | D86-L89 HydrophobicContact CB-CB 4.36Å; D86-L89 PolarHBondContact OD1-N 3.44Å; D86-L89 WeakPolarHBondContact OD2-CD1 3.5Å; L89-E91 PolarHBondContact O-N 3.22Å; L89-R92 HydrophobicContact CB-CB 4.31Å; L89-R92 HydrophobicContact CB-CG 3.88Å; L89-R92 HydrophobicContact CD1-CG 4.21Å; L89-R92 PolarHBondContact O-N 2.99Å | ||
| 90 | G | 56.2 | Low | 70.3 | Confident | 62 Ų | 62 | 95.1 Ų | 95.1 | 64% | 0.639 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -53.1 | -22.6 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||
| 91 | E | 55.8 | Low | 70.5 | Confident | 157 Ų | 157 | 96.3 Ų | 96.3 | 73% | 0.734 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -67 | -38.4 | 174.6 | -160.9 | 169 | -151.1 | 0 | 0 | 112.8 | L89 V93 G94 D95 | L89-E91 PolarHBondContact O-N 3.22Å; E91-V93 PolarHBondContact O-N 3.5Å; E91-G94 PolarHBondContact O-N 3.37Å; E91-G94 VanDerWaalsContact O-N 3.16Å; E91-D95 PolarHBondContact O-N 2.96Å |
| 92 | R | 57.4 | Low | 70.9 | Confident | 153 Ų | 153 | 96.4 Ų | 96.4 | 58% | 0.577 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -69.7 | -20.1 | -179.7 | -65.5 | -173.9 | 76.1 | -156.5 | 4.3 | 113.4 | D86 L89 A96 | D86-R92 IonicContact OD2-NH1 2.86Å; L89-R92 HydrophobicContact CB-CB 4.31Å; L89-R92 HydrophobicContact CB-CG 3.88Å; L89-R92 HydrophobicContact CD1-CG 4.21Å; L89-R92 PolarHBondContact O-N 2.99Å; R92-A96 PolarHBondContact O-N 3.1Å; R92-A96 VanDerWaalsContact O-N 3.14Å |
| 93 | V | 56.6 | Low | 71.5 | Confident | 67 Ų | 67 | 96.8 Ų | 96.8 | 41% | 0.406 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -69.9 | -37.3 | 175.1 | -172.7 | 0 | 0 | 0 | 0 | 110.8 | I85 E91 A97 | I85-V93 HydrophobicContact CG2-CG2 3.77Å; E91-V93 PolarHBondContact O-N 3.5Å; V93-A97 PolarHBondContact O-N 3.1Å |
| 94 | G | 61.8 | Low | 72 | Confident | 35 Ų | 35 | 101.3 Ų | 101.3 | 36% | 0.361 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -66.5 | -41.3 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | E91 A97 R98 | E91-G94 PolarHBondContact O-N 3.37Å; E91-G94 VanDerWaalsContact O-N 3.16Å; G94-A97 PolarHBondContact O-N 3.49Å; G94-R98 VanDerWaalsContact O-CG 3.32Å; G94-R98 WeakPolarHBondContact O-CG 3.48Å; G94-R98 PolarHBondContact O-N 2.92Å |
| 95 | D | 68.1 | Low | 72.8 | Confident | 82 Ų | 82 | 97.1 Ų | 97.1 | 44% | 0.439 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -70.7 | -41.3 | -176.6 | -64.5 | -27 | 0 | 0 | 0 | 112.9 | E91 A97 R98 Q99 | E91-D95 PolarHBondContact O-N 2.96Å; D95-A97 VanDerWaalsContact C-N 3.31Å; D95-A97 PolarHBondContact O-N 2.96Å; D95-R98 PolarHBondContact O-N 3.25Å; D95-Q99 WeakPolarHBondContact O-CB 3.48Å; D95-Q99 PolarHBondContact O-N 3.23Å |
| 96 | A | 70.6 | Confident | 74.1 | Confident | 57 Ų | 57 | 100.6 Ų | 100.6 | 47% | 0.471 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.3 | -36.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | R92 K100 | R92-A96 PolarHBondContact O-N 3.1Å; R92-A96 VanDerWaalsContact O-N 3.14Å; A96-K100 PolarHBondContact O-N 3.07Å; A96-K100 VanDerWaalsContact O-N 3.1Å |
| 97 | A | 73.1 | Confident | 75.5 | Confident | 62 Ų | 62 | 103.3 Ų | 103.3 | 51% | 0.512 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -68.3 | -42.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | V93 G94 D95 K100 E101 | V93-A97 PolarHBondContact O-N 3.1Å; G94-A97 PolarHBondContact O-N 3.49Å; D95-A97 VanDerWaalsContact C-N 3.31Å; D95-A97 PolarHBondContact O-N 2.96Å; A97-K100 PolarHBondContact O-N 3.36Å; A97-E101 PolarHBondContact O-N 3.45Å |
| 98 | R | 79.3 | Confident | 77 | Confident | 168 Ų | 168 | 105 Ų | 105 | 63% | 0.634 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -61 | -48.5 | 174.4 | -75.9 | 173.7 | 177.8 | 173.7 | -0.7 | 111.5 | G94 D95 K100 E101 D102 | G94-R98 VanDerWaalsContact O-CG 3.32Å; G94-R98 WeakPolarHBondContact O-CG 3.48Å; G94-R98 PolarHBondContact O-N 2.92Å; D95-R98 PolarHBondContact O-N 3.25Å; R98-K100 PolarHBondContact O-N 2.89Å; R98-E101 WeakPolarHBondContact O-CB 3.49Å; R98-E101 PolarHBondContact O-N 3.09Å; R98-D102 PolarHBondContact O-N 3.38Å |
| 99 | Q | 83.5 | Confident | 78.6 | Confident | 120 Ų | 120 | 101.5 Ų | 101.5 | 56% | 0.561 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -60 | -43.6 | 179.6 | -170.4 | 174.3 | 7.5 | 0 | 0 | 112 | D95 E101 D102 E103 | D95-Q99 WeakPolarHBondContact O-CB 3.48Å; D95-Q99 PolarHBondContact O-N 3.23Å; Q99-E101 VanDerWaalsContact C-N 3.31Å; Q99-E101 PolarHBondContact O-N 3.43Å; Q99-D102 PolarHBondContact O-N 3.12Å; Q99-E103 WeakPolarHBondContact O-CB 3.39Å; Q99-E103 WeakPolarHBondContact O-CG 3.5Å; Q99-E103 PolarHBondContact O-N 3.15Å |
| 100 | K | 84.1 | Confident | 80.5 | Confident | 155 Ų | 155 | 102.2 Ų | 102.2 | 67% | 0.674 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -64 | -35 | 174.4 | -82.8 | -147.7 | 177.1 | -170 | 0 | 113.4 | A96 A97 R98 R104 | A96-K100 PolarHBondContact O-N 3.07Å; A96-K100 VanDerWaalsContact O-N 3.1Å; A97-K100 PolarHBondContact O-N 3.36Å; R98-K100 PolarHBondContact O-N 2.89Å; K100-R104 WeakPolarHBondContact O-CB 3.34Å; K100-R104 PolarHBondContact O-N 3.18Å |
| 101 | E | 88.3 | Confident | 82.4 | Confident | 82 Ų | 82 | 102.1 Ų | 102.1 | 38% | 0.383 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -69.2 | -40 | 175.9 | -175 | 174.8 | 158.9 | 0 | 0 | 111.6 | A97 R98 Q99 R104 K105 | A97-E101 PolarHBondContact O-N 3.45Å; R98-E101 WeakPolarHBondContact O-CB 3.49Å; R98-E101 PolarHBondContact O-N 3.09Å; Q99-E101 VanDerWaalsContact C-N 3.31Å; Q99-E101 PolarHBondContact O-N 3.43Å; E101-R104 WeakPolarHBondContact O-CB 3.44Å; E101-R104 PolarHBondContact O-N 3.41Å; E101-K105 WeakPolarHBondContact O-CG 3.28Å; E101-K105 PolarHBondContact O-N 2.94Å; E101-K105 VanDerWaalsContact OE1-CE 3.25Å; E101-K105 WeakPolarHBondContact OE1-CE 3.47Å; E101-K105 IonicContact OE1-NZ 3.66Å; E101-K105 PolarHBondContact OE1-NZ 3.26Å |
| 102 | D | 91.4 | Very high | 84.4 | Confident | 86 Ų | 86 | 97.7 Ų | 97.7 | 46% | 0.46 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -67.6 | -45.1 | 177.4 | -66.4 | -24.3 | 0 | 0 | 0 | 111.4 | R98 Q99 R104 K105 E106 | R98-D102 PolarHBondContact O-N 3.38Å; Q99-D102 PolarHBondContact O-N 3.12Å; D102-R104 VanDerWaalsContact C-N 3.27Å; D102-R104 PolarHBondContact O-N 3.46Å; D102-K105 WeakPolarHBondContact O-CB 3.42Å; D102-K105 PolarHBondContact O-N 2.97Å; D102-K105 VanDerWaalsContact O-N 3.07Å; D102-K105 IonicContact OD1-NZ 3.93Å; D102-E106 PolarHBondContact O-N 3.03Å |
| 103 | E | 93 | Very high | 86.3 | Confident | 98 Ų | 98 | 93.8 Ų | 93.8 | 46% | 0.458 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -55.5 | -42.9 | 170.7 | -74.8 | 172.8 | -173.8 | 0 | 0 | 111.3 | Q99 K105 E106 V107 | Q99-E103 WeakPolarHBondContact O-CB 3.39Å; Q99-E103 WeakPolarHBondContact O-CG 3.5Å; Q99-E103 PolarHBondContact O-N 3.15Å; E103-K105 VanDerWaalsContact C-N 3.33Å; E103-K105 PolarHBondContact O-N 3.29Å; E103-E106 PolarHBondContact O-N 3.39Å; E103-V107 VanDerWaalsContact O-CG2 3.3Å; E103-V107 WeakPolarHBondContact O-CG2 3.27Å; E103-V107 PolarHBondContact O-N 3.03Å |
| 104 | R | 93.1 | Very high | 88.3 | Confident | 151 Ų | 151 | 95.1 Ų | 95.1 | 57% | 0.57 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -64 | -39.1 | 177.5 | -166.5 | -177.5 | 82.4 | -121.3 | 3 | 111.8 | K100 E101 D102 M108 | K100-R104 WeakPolarHBondContact O-CB 3.34Å; K100-R104 PolarHBondContact O-N 3.18Å; E101-R104 WeakPolarHBondContact O-CB 3.44Å; E101-R104 PolarHBondContact O-N 3.41Å; D102-R104 VanDerWaalsContact C-N 3.27Å; D102-R104 PolarHBondContact O-N 3.46Å; R104-M108 WeakPolarHBondContact O-CB 3.36Å; R104-M108 PolarHBondContact O-N 3.31Å |
| 105 | K | 95.4 | Very high | 90 | Very high | 108 Ų | 108 | 99 Ų | 99 | 47% | 0.47 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -66.2 | -44 | 177 | -75.1 | 170.1 | -174.6 | 155.8 | 0 | 111.2 | E101 D102 E103 M108 S109 | E101-K105 WeakPolarHBondContact O-CG 3.28Å; E101-K105 PolarHBondContact O-N 2.94Å; E101-K105 VanDerWaalsContact OE1-CE 3.25Å; E101-K105 WeakPolarHBondContact OE1-CE 3.47Å; E101-K105 IonicContact OE1-NZ 3.66Å; E101-K105 PolarHBondContact OE1-NZ 3.26Å; D102-K105 WeakPolarHBondContact O-CB 3.42Å; D102-K105 PolarHBondContact O-N 2.97Å; D102-K105 VanDerWaalsContact O-N 3.07Å; D102-K105 IonicContact OD1-NZ 3.93Å; E103-K105 VanDerWaalsContact C-N 3.33Å; E103-K105 PolarHBondContact O-N 3.29Å; K105-M108 WeakPolarHBondContact O-CB 3.38Å; K105-M108 PolarHBondContact O-N 2.99Å; K105-S109 PolarHBondContact O-N 2.96Å |
| 106 | E | 96.3 | Very high | 91.4 | Very high | 136 Ų | 136 | 103 Ų | 103 | 64% | 0.636 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -63.2 | -45.8 | 176.6 | -73.3 | -166 | 159.5 | 0 | 0 | 112.1 | D102 E103 M108 S109 V110 | D102-E106 PolarHBondContact O-N 3.03Å; E103-E106 PolarHBondContact O-N 3.39Å; E106-M108 VanDerWaalsContact C-N 3.25Å; E106-M108 PolarHBondContact O-N 3.06Å; E106-S109 PolarHBondContact O-N 3.3Å; E106-S109 PolarHBondContact O-OG 3.12Å; E106-V110 WeakPolarHBondContact O-CG2 3.43Å; E106-V110 PolarHBondContact O-N 2.88Å |
| 107 | V | 96.4 | Very high | 92.7 | Very high | 103 Ų | 103 | 106.7 Ų | 106.7 | 62% | 0.624 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -59.4 | -41.7 | 176 | 170.1 | 0 | 0 | 0 | 0 | 110.5 | E103 S111 | E103-V107 VanDerWaalsContact O-CG2 3.3Å; E103-V107 WeakPolarHBondContact O-CG2 3.27Å; E103-V107 PolarHBondContact O-N 3.03Å; V107-S111 WeakPolarHBondContact O-CB 3.26Å; V107-S111 PolarHBondContact O-N 3.02Å |
| 108 | M | 95.3 | Very high | 93.9 | Very high | 115 Ų | 115 | 108.8 Ų | 108.8 | 57% | 0.567 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -64 | -45 | 177.3 | -164.5 | 65.7 | 60.4 | 0 | 0 | 111.6 | R104 K105 E106 S111 T112 | R104-M108 WeakPolarHBondContact O-CB 3.36Å; R104-M108 PolarHBondContact O-N 3.31Å; K105-M108 WeakPolarHBondContact O-CB 3.38Å; K105-M108 PolarHBondContact O-N 2.99Å; E106-M108 VanDerWaalsContact C-N 3.25Å; E106-M108 PolarHBondContact O-N 3.06Å; M108-S111 PolarHBondContact O-N 3.45Å; M108-T112 WeakPolarHBondContact O-CG2 3.26Å; M108-T112 PolarHBondContact O-N 3.38Å; M108-T112 PolarHBondContact O-OG1 2.97Å |
| 109 | S | 97.1 | Very high | 94.8 | Very high | 55 Ų | 55 | 107.9 Ų | 107.9 | 39% | 0.385 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -63.7 | -48.5 | -179.6 | 68.7 | 0 | 0 | 0 | 0 | 111.3 | K105 E106 S111 T112 D113 | K105-S109 PolarHBondContact O-N 2.96Å; E106-S109 PolarHBondContact O-N 3.3Å; E106-S109 PolarHBondContact O-OG 3.12Å; S109-S111 VanDerWaalsContact C-N 3.29Å; S109-S111 PolarHBondContact O-N 2.89Å; S109-T112 WeakPolarHBondContact CA-OG1 3.33Å; S109-T112 PolarHBondContact O-N 2.95Å; S109-T112 VanDerWaalsContact O-N 3.08Å; S109-T112 PolarHBondContact O-OG1 3.02Å; S109-D113 PolarHBondContact O-N 3.46Å |
| 110 | V | 97.3 | Very high | 95.4 | Very high | 94 Ų | 94 | 104.3 Ų | 104.3 | 57% | 0.57 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -59.3 | -42.3 | 177 | 173.9 | 0 | 0 | 0 | 0 | 110.7 | E106 T112 D113 L114 | E106-V110 WeakPolarHBondContact O-CG2 3.43Å; E106-V110 PolarHBondContact O-N 2.88Å; V110-T112 VanDerWaalsContact C-N 3.32Å; V110-T112 PolarHBondContact O-N 3.37Å; V110-D113 PolarHBondContact O-N 2.98Å; V110-L114 WeakPolarHBondContact O-CB 3.25Å; V110-L114 PolarHBondContact O-N 3.29Å |
| 111 | S | 96.9 | Very high | 96.1 | Very high | 60 Ų | 60 | 103.9 Ų | 103.9 | 42% | 0.42 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -65.6 | -35.1 | 177.8 | -160.1 | 0 | 0 | 0 | 0 | 112.4 | V107 M108 S109 L115 | V107-S111 WeakPolarHBondContact O-CB 3.26Å; V107-S111 PolarHBondContact O-N 3.02Å; M108-S111 PolarHBondContact O-N 3.45Å; S109-S111 VanDerWaalsContact C-N 3.29Å; S109-S111 PolarHBondContact O-N 2.89Å; S111-L115 WeakPolarHBondContact O-CB 3.44Å; S111-L115 PolarHBondContact O-N 3.36Å; S111-L115 VanDerWaalsContact O-N 3.12Å |
| 112 | T | 97.4 | Very high | 96.5 | Very high | 65 Ų | 65 | 101.4 Ų | 101.4 | 40% | 0.399 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -71.2 | -36.5 | 175 | 56.9 | 0 | 0 | 0 | 0 | 113.1 | M108 S109 V110 L115 R116 | M108-T112 WeakPolarHBondContact O-CG2 3.26Å; M108-T112 PolarHBondContact O-N 3.38Å; M108-T112 PolarHBondContact O-OG1 2.97Å; S109-T112 WeakPolarHBondContact CA-OG1 3.33Å; S109-T112 PolarHBondContact O-N 2.95Å; S109-T112 VanDerWaalsContact O-N 3.08Å; S109-T112 PolarHBondContact O-OG1 3.02Å; V110-T112 VanDerWaalsContact C-N 3.32Å; V110-T112 PolarHBondContact O-N 3.37Å; T112-L115 PolarHBondContact O-N 3.2Å; T112-R116 PolarHBondContact O-N 2.96Å; T112-R116 VanDerWaalsContact O-N 3.08Å |
| 113 | D | 97.8 | Very high | 96.8 | Very high | 71 Ų | 71 | 102 Ų | 102 | 38% | 0.38 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -69.7 | -43.7 | 177 | -71.4 | -27 | 0 | 0 | 0 | 110.8 | S109 V110 L115 R116 E117 | S109-D113 PolarHBondContact O-N 3.46Å; V110-D113 PolarHBondContact O-N 2.98Å; D113-L115 VanDerWaalsContact C-N 3.32Å; D113-L115 PolarHBondContact O-N 2.74Å; D113-R116 WeakPolarHBondContact O-CB 3.5Å; D113-R116 PolarHBondContact O-N 2.9Å; D113-R116 IonicContact OD1-CZ 3.67Å; D113-R116 IonicContact OD1-NH1 3.96Å; D113-R116 IonicContact OD1-NH2 3.78Å; D113-R116 PolarHBondContact OD1-NH2 3.36Å; D113-E117 PolarHBondContact O-N 3.29Å |
| 114 | L | 97.7 | Very high | 97 | Very high | 95 Ų | 95 | 101.6 Ų | 101.6 | 50% | 0.497 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -58.2 | -43.7 | 173.7 | 179.5 | 62.4 | 0 | 0 | 0 | 111.8 | V110 R116 E117 L118 | V110-L114 WeakPolarHBondContact O-CB 3.25Å; V110-L114 PolarHBondContact O-N 3.29Å; L114-R116 VanDerWaalsContact C-N 3.29Å; L114-R116 PolarHBondContact O-N 2.93Å; L114-E117 PolarHBondContact O-N 3.12Å; L114-L118 HydrophobicContact CD1-CD1 4.33Å; L114-L118 HydrophobicContact CD1-CG 4.26Å; L114-L118 HydrophobicContact CG-CD1 4.1Å; L114-L118 HydrophobicContact CG-CG 4.46Å; L114-L118 WeakPolarHBondContact O-CB 3.37Å; L114-L118 VanDerWaalsContact O-CG 3.32Å; L114-L118 WeakPolarHBondContact O-CG 3.42Å; L114-L118 PolarHBondContact O-N 2.91Å |
| 115 | L | 97.8 | Very high | 97.2 | Very high | 115 Ų | 115 | 96.3 Ų | 96.3 | 60% | 0.602 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -59.8 | -40.2 | 175.2 | -97.7 | 162.1 | 0 | 0 | 0 | 112.2 | S111 T112 D113 K119 | S111-L115 WeakPolarHBondContact O-CB 3.44Å; S111-L115 PolarHBondContact O-N 3.36Å; S111-L115 VanDerWaalsContact O-N 3.12Å; T112-L115 PolarHBondContact O-N 3.2Å; D113-L115 VanDerWaalsContact C-N 3.32Å; D113-L115 PolarHBondContact O-N 2.74Å; L115-K119 WeakPolarHBondContact O-CB 2.88Å; L115-K119 PolarHBondContact O-N 2.69Å; L115-K119 VanDerWaalsContact O-N 3.1Å |
| 116 | R | 97.9 | Very high | 97.3 | Very high | 167 Ų | 167 | 94.6 Ų | 94.6 | 63% | 0.63 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -65.6 | -44.9 | 177.5 | -169.2 | -173.1 | -57 | 152.6 | 13.8 | 111.2 | T112 D113 L114 K119 A120 | T112-R116 PolarHBondContact O-N 2.96Å; T112-R116 VanDerWaalsContact O-N 3.08Å; D113-R116 WeakPolarHBondContact O-CB 3.5Å; D113-R116 PolarHBondContact O-N 2.9Å; D113-R116 IonicContact OD1-CZ 3.67Å; D113-R116 IonicContact OD1-NH1 3.96Å; D113-R116 IonicContact OD1-NH2 3.78Å; D113-R116 PolarHBondContact OD1-NH2 3.36Å; L114-R116 VanDerWaalsContact C-N 3.29Å; L114-R116 PolarHBondContact O-N 2.93Å; R116-K119 PolarHBondContact O-N 3.35Å; R116-A120 PolarHBondContact O-N 3.42Å |
| 117 | E | 98.1 | Very high | 97.2 | Very high | 135 Ų | 135 | 93.7 Ų | 93.7 | 63% | 0.631 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -63.8 | -45.2 | 177.5 | -74.3 | -174.1 | 179.9 | 0 | 0 | 112.1 | D113 L114 K119 A120 F121 | D113-E117 PolarHBondContact O-N 3.29Å; L114-E117 PolarHBondContact O-N 3.12Å; E117-K119 VanDerWaalsContact C-N 3.27Å; E117-K119 PolarHBondContact O-N 2.89Å; E117-A120 PolarHBondContact O-N 3.47Å; E117-F121 WeakPolarHBondContact O-CB 3.44Å; E117-F121 PolarHBondContact O-N 3.41Å |
| 118 | L | 97.9 | Very high | 97.2 | Very high | 106 Ų | 106 | 94 Ų | 94 | 56% | 0.555 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -60.2 | -39.1 | 177 | -74.7 | 172.9 | 0 | 0 | 0 | 111.9 | L114 G122 | L114-L118 HydrophobicContact CD1-CD1 4.33Å; L114-L118 HydrophobicContact CD1-CG 4.26Å; L114-L118 HydrophobicContact CG-CD1 4.1Å; L114-L118 HydrophobicContact CG-CG 4.46Å; L114-L118 WeakPolarHBondContact O-CB 3.37Å; L114-L118 VanDerWaalsContact O-CG 3.32Å; L114-L118 WeakPolarHBondContact O-CG 3.42Å; L114-L118 PolarHBondContact O-N 2.91Å; L118-G122 PolarHBondContact O-N 3.41Å |
| 119 | K | 97.7 | Very high | 97.2 | Very high | 149 Ų | 149 | 96.5 Ų | 96.5 | 65% | 0.648 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -65.1 | -49.2 | 175.4 | -169.4 | 179.6 | -178.7 | -176.4 | 0 | 111.4 | L115 R116 E117 F121 G122 D123 | L115-K119 WeakPolarHBondContact O-CB 2.88Å; L115-K119 PolarHBondContact O-N 2.69Å; L115-K119 VanDerWaalsContact O-N 3.1Å; R116-K119 PolarHBondContact O-N 3.35Å; E117-K119 VanDerWaalsContact C-N 3.27Å; E117-K119 PolarHBondContact O-N 2.89Å; K119-F121 VanDerWaalsContact C-N 3.3Å; K119-F121 PolarHBondContact O-N 2.9Å; K119-G122 PolarHBondContact O-N 3.41Å; K119-G122 VanDerWaalsContact O-N 3.14Å; K119-D123 VanDerWaalsContact O-CG 3.29Å; K119-D123 PolarHBondContact O-N 2.93Å |
| 120 | A | 97.6 | Very high | 97 | Very high | 45 Ų | 45 | 98.2 Ų | 98.2 | 37% | 0.372 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60 | -41.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | R116 E117 D123 I124 | R116-A120 PolarHBondContact O-N 3.42Å; E117-A120 PolarHBondContact O-N 3.47Å; A120-D123 PolarHBondContact O-N 3.46Å; A120-I124 WeakPolarHBondContact O-CD1 3.44Å; A120-I124 VanDerWaalsContact O-CG1 3.24Å; A120-I124 WeakPolarHBondContact O-CG1 3.29Å; A120-I124 PolarHBondContact O-N 2.98Å |
| 121 | F | 97.9 | Very high | 96.8 | Very high | 146 Ų | 146 | 99 Ų | 99 | 64% | 0.64 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61.1 | -45.5 | 174.3 | 179.4 | -96.2 | 0 | 0 | 0 | 111.6 | E117 K119 D123 I124 A125 | E117-F121 WeakPolarHBondContact O-CB 3.44Å; E117-F121 PolarHBondContact O-N 3.41Å; K119-F121 VanDerWaalsContact C-N 3.3Å; K119-F121 PolarHBondContact O-N 2.9Å; F121-D123 VanDerWaalsContact C-N 3.34Å; F121-D123 PolarHBondContact O-N 3.47Å; F121-I124 PolarHBondContact O-N 3.18Å; F121-A125 VanDerWaalsContact O-CB 3.31Å; F121-A125 WeakPolarHBondContact O-CB 3.33Å; F121-A125 PolarHBondContact O-N 2.85Å |
| 122 | G | 97.3 | Very high | 96.6 | Very high | 29 Ų | 29 | 102 Ų | 102 | 30% | 0.299 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.5 | -41.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | L118 K119 S126 | L118-G122 PolarHBondContact O-N 3.41Å; K119-G122 PolarHBondContact O-N 3.41Å; K119-G122 VanDerWaalsContact O-N 3.14Å; G122-S126 VanDerWaalsContact O-CB 3.3Å; G122-S126 WeakPolarHBondContact O-CB 3.49Å; G122-S126 PolarHBondContact O-N 3.09Å; G122-S126 PolarHBondContact O-OG 3.04Å |
| 123 | D | 97.4 | Very high | 96.3 | Very high | 99 Ų | 99 | 103 Ų | 103 | 53% | 0.529 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.8 | -46.9 | 176.2 | -66.9 | -24 | 0 | 0 | 0 | 110.8 | K119 A120 F121 S126 Q127 | K119-D123 VanDerWaalsContact O-CG 3.29Å; K119-D123 PolarHBondContact O-N 2.93Å; A120-D123 PolarHBondContact O-N 3.46Å; F121-D123 VanDerWaalsContact C-N 3.34Å; F121-D123 PolarHBondContact O-N 3.47Å; D123-S126 PolarHBondContact O-N 2.94Å; D123-Q127 WeakPolarHBondContact O-CB 3.23Å; D123-Q127 PolarHBondContact O-N 3.38Å |
| 124 | I | 97.3 | Very high | 95.7 | Very high | 90 Ų | 90 | 101.9 Ų | 101.9 | 46% | 0.462 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.2 | -46.1 | 177.6 | -67.7 | 164.5 | 0 | 0 | 0 | 111.1 | A120 F121 S126 Q127 Q128 | A120-I124 WeakPolarHBondContact O-CD1 3.44Å; A120-I124 VanDerWaalsContact O-CG1 3.24Å; A120-I124 WeakPolarHBondContact O-CG1 3.29Å; A120-I124 PolarHBondContact O-N 2.98Å; F121-I124 PolarHBondContact O-N 3.18Å; I124-S126 VanDerWaalsContact C-N 3.3Å; I124-S126 PolarHBondContact O-N 3.28Å; I124-Q127 WeakPolarHBondContact O-CB 3.36Å; I124-Q127 PolarHBondContact O-N 2.92Å; I124-Q128 HydrophobicContact CG2-CG 4.41Å; I124-Q128 WeakPolarHBondContact O-CB 3.2Å; I124-Q128 WeakPolarHBondContact O-CG 3.28Å; I124-Q128 PolarHBondContact O-N 2.91Å |
| 125 | A | 96.9 | Very high | 95 | Very high | 39 Ų | 39 | 100.3 Ų | 100.3 | 32% | 0.322 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.9 | -38.6 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | F121 Q128 R129 | F121-A125 VanDerWaalsContact O-CB 3.31Å; F121-A125 WeakPolarHBondContact O-CB 3.33Å; F121-A125 PolarHBondContact O-N 2.85Å; A125-Q128 PolarHBondContact O-N 2.93Å; A125-R129 WeakPolarHBondContact O-CB 3.4Å; A125-R129 PolarHBondContact O-N 2.93Å |
| 126 | S | 96.4 | Very high | 94.1 | Very high | 72 Ų | 72 | 101 Ų | 101 | 50% | 0.503 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -66 | -42.1 | 175.2 | -60.9 | 0 | 0 | 0 | 0 | 111.5 | G122 D123 I124 R129 T130 | G122-S126 VanDerWaalsContact O-CB 3.3Å; G122-S126 WeakPolarHBondContact O-CB 3.49Å; G122-S126 PolarHBondContact O-N 3.09Å; G122-S126 PolarHBondContact O-OG 3.04Å; D123-S126 PolarHBondContact O-N 2.94Å; I124-S126 VanDerWaalsContact C-N 3.3Å; I124-S126 PolarHBondContact O-N 3.28Å; S126-R129 PolarHBondContact O-N 3.3Å; S126-T130 PolarHBondContact O-N 3.21Å; S126-T130 PolarHBondContact O-OG1 2.73Å |
| 127 | Q | 96.2 | Very high | 93.3 | Very high | 118 Ų | 118 | 102.4 Ų | 102.4 | 55% | 0.551 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -62.2 | -47.7 | 175.1 | -174.9 | 177.5 | -2 | 0 | 0 | 111.5 | D123 I124 R129 T130 Q131 | D123-Q127 WeakPolarHBondContact O-CB 3.23Å; D123-Q127 PolarHBondContact O-N 3.38Å; I124-Q127 WeakPolarHBondContact O-CB 3.36Å; I124-Q127 PolarHBondContact O-N 2.92Å; Q127-R129 PolarHBondContact O-N 3.42Å; Q127-T130 WeakPolarHBondContact O-CB 3.29Å; Q127-T130 PolarHBondContact O-N 3.02Å; Q127-Q131 PolarHBondContact O-N 3.34Å |
| 128 | Q | 95.6 | Very high | 92.4 | Very high | 109 Ų | 109 | 103.2 Ų | 103.2 | 51% | 0.509 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -59.8 | -44 | 176.2 | -75.5 | -177.9 | -15.1 | 0 | 0 | 111.8 | I124 A125 T130 Q131 L132 | I124-Q128 HydrophobicContact CG2-CG 4.41Å; I124-Q128 WeakPolarHBondContact O-CB 3.2Å; I124-Q128 WeakPolarHBondContact O-CG 3.28Å; I124-Q128 PolarHBondContact O-N 2.91Å; A125-Q128 PolarHBondContact O-N 2.93Å; Q128-T130 VanDerWaalsContact C-N 3.29Å; Q128-T130 PolarHBondContact O-N 3.48Å; Q128-Q131 PolarHBondContact O-N 2.96Å; Q128-L132 WeakPolarHBondContact O-CG 3.41Å; Q128-L132 PolarHBondContact O-N 3.19Å |
| 129 | R | 94.4 | Very high | 91.3 | Very high | 168 Ų | 168 | 105.1 Ų | 105.1 | 63% | 0.634 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -58.5 | -42.8 | 175.4 | -178.6 | 177.5 | 178.5 | 167.6 | 2.3 | 111.6 | A125 S126 Q127 L132 Q133 | A125-R129 WeakPolarHBondContact O-CB 3.4Å; A125-R129 PolarHBondContact O-N 2.93Å; S126-R129 PolarHBondContact O-N 3.3Å; Q127-R129 PolarHBondContact O-N 3.42Å; R129-L132 PolarHBondContact O-N 2.94Å; R129-Q133 WeakPolarHBondContact O-CB 3.33Å; R129-Q133 VanDerWaalsContact O-CG 3.29Å; R129-Q133 WeakPolarHBondContact O-CG 3.48Å; R129-Q133 PolarHBondContact O-N 3.41Å |
| 130 | T | 94.2 | Very high | 89.2 | Confident | 90 Ų | 90 | 101.1 Ų | 101.1 | 55% | 0.552 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -66.1 | -43 | 179.8 | -52.5 | 0 | 0 | 0 | 0 | 111 | S126 Q127 Q128 Q133 A134 | S126-T130 PolarHBondContact O-N 3.21Å; S126-T130 PolarHBondContact O-OG1 2.73Å; Q127-T130 WeakPolarHBondContact O-CB 3.29Å; Q127-T130 PolarHBondContact O-N 3.02Å; Q128-T130 VanDerWaalsContact C-N 3.29Å; Q128-T130 PolarHBondContact O-N 3.48Å; T130-Q133 PolarHBondContact O-N 3.33Å; T130-A134 WeakPolarHBondContact O-CB 3.43Å; T130-A134 PolarHBondContact O-N 3.31Å |
| 131 | Q | 92.7 | Very high | 87.4 | Confident | 110 Ų | 110 | 104.6 Ų | 104.6 | 51% | 0.514 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -60.8 | -48.2 | 174.5 | -75.3 | 178.5 | -15.8 | 0 | 0 | 111.9 | Q127 Q128 Q133 A134 S135 | Q127-Q131 PolarHBondContact O-N 3.34Å; Q128-Q131 PolarHBondContact O-N 2.96Å; Q131-Q133 VanDerWaalsContact C-N 3.35Å; Q131-Q133 PolarHBondContact O-N 3.19Å; Q131-A134 PolarHBondContact O-N 3.21Å; Q131-S135 PolarHBondContact O-N 3.41Å; Q131-S135 PolarHBondContact O-OG 3.22Å |
| 132 | L | 91.9 | Very high | 85.1 | Confident | 123 Ų | 123 | 109.7 Ų | 109.7 | 64% | 0.644 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -61.9 | -40.8 | 178.2 | -73.8 | 171 | 0 | 0 | 0 | 112.3 | Q128 R129 S135 H136 | Q128-L132 WeakPolarHBondContact O-CG 3.41Å; Q128-L132 PolarHBondContact O-N 3.19Å; R129-L132 PolarHBondContact O-N 2.94Å; L132-S135 PolarHBondContact O-N 2.92Å; L132-H136 VanDerWaalsContact O-CB 3.32Å; L132-H136 WeakPolarHBondContact O-CB 3.4Å; L132-H136 PolarHBondContact O-N 3.36Å |
| 133 | Q | 90.8 | Very high | 84.5 | Confident | 87 Ų | 87 | 113.8 Ų | 113.8 | 41% | 0.407 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -64.5 | -39.9 | 174.8 | -74.8 | 178.6 | -9.3 | 0 | 0 | 112.2 | R129 T130 Q131 R137 | R129-Q133 WeakPolarHBondContact O-CB 3.33Å; R129-Q133 VanDerWaalsContact O-CG 3.29Å; R129-Q133 WeakPolarHBondContact O-CG 3.48Å; R129-Q133 PolarHBondContact O-N 3.41Å; T130-Q133 PolarHBondContact O-N 3.33Å; Q131-Q133 VanDerWaalsContact C-N 3.35Å; Q131-Q133 PolarHBondContact O-N 3.19Å; Q133-R137 WeakPolarHBondContact O-CB 3.46Å; Q133-R137 VanDerWaalsContact O-CG 3.32Å; Q133-R137 WeakPolarHBondContact O-CG 3.34Å; Q133-R137 PolarHBondContact O-N 3.47Å |
| 134 | A | 85.6 | Confident | 83.8 | Confident | 48 Ų | 48 | 114.5 Ų | 114.5 | 40% | 0.397 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -65 | -45.9 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | T130 Q131 R137 L138 | T130-A134 WeakPolarHBondContact O-CB 3.43Å; T130-A134 PolarHBondContact O-N 3.31Å; Q131-A134 PolarHBondContact O-N 3.21Å; A134-R137 PolarHBondContact O-N 3.03Å; A134-L138 WeakPolarHBondContact O-CG 3.4Å; A134-L138 PolarHBondContact O-N 3.17Å |
| 135 | S | 83.4 | Confident | 83.1 | Confident | 61 Ų | 61 | 115.9 Ų | 115.9 | 43% | 0.427 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -62 | -44.2 | 175.2 | -64.1 | 0 | 0 | 0 | 0 | 112.1 | Q131 L132 R137 L138 L139 | Q131-S135 PolarHBondContact O-N 3.41Å; Q131-S135 PolarHBondContact O-OG 3.22Å; L132-S135 PolarHBondContact O-N 2.92Å; S135-R137 PolarHBondContact O-N 3.09Å; S135-L138 PolarHBondContact O-N 3.45Å; S135-L139 WeakPolarHBondContact O-CB 3.49Å; S135-L139 PolarHBondContact O-N 2.89Å |
| 136 | H | 79.8 | Confident | 82.2 | Confident | 131 Ų | 131 | 120.4 Ų | 120.4 | 61% | 0.606 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -60.9 | -43.2 | 174.9 | -178.2 | -43.8 | 0 | 0 | 0 | 111.5 | L132 L138 L139 S140 | L132-H136 VanDerWaalsContact O-CB 3.32Å; L132-H136 WeakPolarHBondContact O-CB 3.4Å; L132-H136 PolarHBondContact O-N 3.36Å; H136-L138 VanDerWaalsContact C-N 3.28Å; H136-L138 PolarHBondContact O-N 3.11Å; H136-L139 CarbonylContact O-C 3.55Å; H136-L139 PolarHBondContact O-N 2.98Å; H136-S140 PolarHBondContact O-N 2.8Å; H136-S140 PolarHBondContact O-OG 2.9Å |
| 137 | R | 80.1 | Confident | 81.4 | Confident | 195 Ų | 195 | 123.4 Ų | 123.4 | 74% | 0.736 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -63.7 | -33.5 | 176.4 | -78 | 177.1 | 179.8 | 175.2 | 0.8 | 112.7 | Q133 A134 S135 | Q133-R137 WeakPolarHBondContact O-CB 3.46Å; Q133-R137 VanDerWaalsContact O-CG 3.32Å; Q133-R137 WeakPolarHBondContact O-CG 3.34Å; Q133-R137 PolarHBondContact O-N 3.47Å; A134-R137 PolarHBondContact O-N 3.03Å; S135-R137 PolarHBondContact O-N 3.09Å |
| 138 | L | 78.5 | Confident | 80.4 | Confident | 152 Ų | 152 | 123.8 Ų | 123.8 | 80% | 0.796 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -75.7 | -26.4 | 175.6 | -73.9 | 163.5 | 0 | 0 | 0 | 112.9 | A134 S135 H136 | A134-L138 WeakPolarHBondContact O-CG 3.4Å; A134-L138 PolarHBondContact O-N 3.17Å; S135-L138 PolarHBondContact O-N 3.45Å; H136-L138 VanDerWaalsContact C-N 3.28Å; H136-L138 PolarHBondContact O-N 3.11Å |
| 139 | L | 75.6 | Confident | 79.3 | Confident | 146 Ų | 146 | 124.9 Ų | 124.9 | 76% | 0.764 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -97.4 | -6.7 | -178.8 | -85.4 | 150.3 | 0 | 0 | 0 | 114.4 | S135 H136 P141 | S135-L139 WeakPolarHBondContact O-CB 3.49Å; S135-L139 PolarHBondContact O-N 2.89Å; H136-L139 CarbonylContact O-C 3.55Å; H136-L139 PolarHBondContact O-N 2.98Å; L139-P141 VanDerWaalsContact O-CD 3.22Å; L139-P141 WeakPolarHBondContact O-CD 3.48Å |
| 140 | S | 54 | Low | 78.1 | Confident | 65 Ų | 65 | 121.5 Ų | 121.5 | 46% | 0.455 | 65% | 0.646 | S | S | . | * | trans | -93.7 | 103.6 | 170.5 | 69.2 | 0 | 0 | 0 | 0 | 110.4 | H136 | H136-S140 PolarHBondContact O-N 2.8Å; H136-S140 PolarHBondContact O-OG 2.9Å | ||
| 141 | P | 60.2 | Low | 76.8 | Confident | 119 Ų | 119 | 124.2 Ų | 124.2 | 77% | 0.773 | 65% | 0.654 | S | S | * | * | trans | -73.2 | 135.7 | 165.5 | 31.3 | -28.2 | 0 | 0 | 0 | 108.6 | L139 | L139-P141 VanDerWaalsContact O-CD 3.22Å; L139-P141 WeakPolarHBondContact O-CD 3.48Å | ||
| 142 | L | 49 | Very low | 75.3 | Confident | 253 Ų | 253 | 125.5 Ų | 125.5 | 100% | 1.325 | 67% | 0.666 | S | S | * | * | trans | 12.5 | 0 | 167.4 | -77.1 | 158.1 | 0 | 0 | 0 | 117.4 |
Retrieved 142 of 142 residues in 60.6 ms
(Link to these results)