| 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 | 42.1 | Very low | 54.7 | Low | 247 Ų | 247 | 120.8 Ų | 120.8 | 100% | 1.217 | 70% | 0.696 | S | S | * | * | 0 | 109.2 | 0 | -77.5 | 155.8 | 116.7 | 0 | 0 | 107.5 | |||||
| 2 | A | 51.6 | Low | 55 | Low | 82 Ų | 82 | 127 Ų | 127 | 68% | 0.678 | 70% | 0.699 | S | S | * | * | trans | -77 | 148.8 | -169.5 | 0 | 0 | 0 | 0 | 0 | 112 | S4 | A2-S4 VanDerWaalsContact C-N 3.33Å; A2-S4 PolarHBondContact O-N 2.97Å | ||
| 3 | P | 50.9 | Low | 55.4 | Low | 110 Ų | 110 | 128.2 Ų | 128.2 | 71% | 0.714 | 70% | 0.703 | S | S | * | * | trans | -81.2 | 77.8 | -172.4 | 34.2 | -33.5 | 0 | 0 | 0 | 110.4 | A5 | P3-A5 PolarHBondContact O-N 3.47Š| ||
| 4 | S | 55.6 | Low | 55.7 | Low | 94 Ų | 94 | 128.6 Ų | 128.6 | 66% | 0.657 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.1 | 0.1 | -179.5 | -59.9 | 0 | 0 | 0 | 0 | 114.4 | A2 | A2-S4 VanDerWaalsContact C-N 3.33Å; A2-S4 PolarHBondContact O-N 2.97Å |
| 5 | A | 57 | Low | 56.3 | Low | 87 Ų | 87 | 124 Ų | 124 | 72% | 0.719 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.5 | -25 | -171.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | P3 | P3-A5 PolarHBondContact O-N 3.47Š|
| 6 | L | 54.8 | Low | 56.7 | Low | 146 Ų | 146 | 123.4 Ų | 123.4 | 76% | 0.764 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -92.5 | -14.5 | -174.1 | -72 | 170.3 | 0 | 0 | 0 | 114.8 | P9 | L6-P9 WeakPolarHBondContact O-CD 3.29Š|
| 7 | L | 55 | Low | 57.2 | Low | 124 Ų | 124 | 121.2 Ų | 121.2 | 65% | 0.649 | 69% | 0.693 | S | S | * | * | H | α-helix | trans | -85.9 | -18.8 | -177.2 | -70.5 | 167.2 | 0 | 0 | 0 | 113.7 | S11 | L7-S11 PolarHBondContact O-N 3.46Å; L7-S11 PolarHBondContact O-OG 2.67Å |
| 8 | R | 57.6 | Low | 57.6 | Low | 188 Ų | 188 | 127.8 Ų | 127.8 | 71% | 0.709 | 71% | 0.705 | S | S | * | * | H | α-helix | trans | -68.1 | -35 | -177.2 | -134.3 | 179.2 | -175.4 | -169.9 | 1.1 | 115.6 | S11 | R8-S11 PolarHBondContact O-OG 3.3Å |
| 9 | P | 59.1 | Low | 58 | Low | 79 Ų | 79 | 128.7 Ų | 128.7 | 51% | 0.513 | 71% | 0.708 | S | S | . | * | H | α-helix | trans | -77 | -35.5 | 174.3 | 26.6 | -31.4 | 0 | 0 | 0 | 112.4 | L6 S11 R12 | L6-P9 WeakPolarHBondContact O-CD 3.29Å; P9-S11 PolarHBondContact O-N 2.93Å; P9-R12 PolarHBondContact O-N 2.96Å |
| 10 | L | 58.2 | Low | 58.1 | Low | 98 Ų | 98 | 128.2 Ų | 128.2 | 51% | 0.513 | 71% | 0.71 | S | S | . | * | H | α-helix | trans | -69.1 | -34.2 | -179.2 | -165.5 | 68.7 | 0 | 0 | 0 | 112.2 | R12 L13 L14 | L10-R12 PolarHBondContact O-N 2.75Å; L10-L13 HydrophobicContact CD1-CD1 4.25Å; L10-L13 PolarHBondContact O-N 2.89Å; L10-L13 VanDerWaalsContact O-N 3.09Å; L10-L14 PolarHBondContact O-N 3.44Å |
| 11 | S | 59.9 | Low | 58.3 | Low | 74 Ų | 74 | 127.9 Ų | 127.9 | 52% | 0.517 | 72% | 0.717 | S | S | . | * | H | α-helix | trans | -64.6 | -21 | 175.9 | 64 | 0 | 0 | 0 | 0 | 113.7 | L7 R8 P9 | L7-S11 PolarHBondContact O-N 3.46Å; L7-S11 PolarHBondContact O-OG 2.67Å; R8-S11 PolarHBondContact O-OG 3.3Å; P9-S11 PolarHBondContact O-N 2.93Å |
| 12 | R | 58.4 | Low | 59.1 | Low | 195 Ų | 195 | 119 Ų | 119 | 74% | 0.736 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -81.2 | -27.2 | 172.8 | -91.4 | -178.2 | -122.6 | -179.2 | -2.6 | 113.1 | P9 L10 L14 A15 | P9-R12 PolarHBondContact O-N 2.96Å; L10-R12 PolarHBondContact O-N 2.75Å; R12-L14 VanDerWaalsContact C-N 3.35Å; R12-A15 VanDerWaalsContact O-CB 3.27Å; R12-A15 WeakPolarHBondContact O-CB 3.41Å; R12-A15 PolarHBondContact O-N 2.95Å |
| 13 | L | 59.9 | Low | 59.6 | Low | 143 Ų | 143 | 120 Ų | 120 | 75% | 0.749 | 69% | 0.691 | S | S | * | * | H | α-helix | trans | -74.8 | -28.1 | 174.5 | -75 | 164.2 | 0 | 0 | 0 | 112.1 | L10 A15 | L10-L13 HydrophobicContact CD1-CD1 4.25Å; L10-L13 PolarHBondContact O-N 2.89Å; L10-L13 VanDerWaalsContact O-N 3.09Å; L13-A15 VanDerWaalsContact C-N 3.28Å |
| 14 | L | 59.8 | Low | 60.1 | Low | 134 Ų | 134 | 120.2 Ų | 120.2 | 70% | 0.702 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.5 | 8.3 | 173.7 | -62.2 | 172.8 | 0 | 0 | 0 | 113 | L10 R12 P16 | L10-L14 PolarHBondContact O-N 3.44Å; R12-L14 VanDerWaalsContact C-N 3.35Å; L14-P16 WeakPolarHBondContact O-CD 3.37Å |
| 15 | A | 64.1 | Low | 60.4 | Low | 59 Ų | 59 | 120.1 Ų | 120.1 | 49% | 0.488 | 70% | 0.7 | S | S | . | * | S | Bend | trans | -60.3 | 123.9 | 172.9 | 0 | 0 | 0 | 0 | 0 | 108.1 | R12 L13 A17 | R12-A15 VanDerWaalsContact O-CB 3.27Å; R12-A15 WeakPolarHBondContact O-CB 3.41Å; R12-A15 PolarHBondContact O-N 2.95Å; L13-A15 VanDerWaalsContact C-N 3.28Å; A15-A17 PolarHBondContact O-N 3.32Å |
| 16 | P | 63.3 | Low | 60.9 | Low | 115 Ų | 115 | 126.5 Ų | 126.5 | 75% | 0.747 | 71% | 0.705 | S | S | * | * | trans | -58.1 | 112.3 | 180 | -18.5 | 28.6 | 0 | 0 | 0 | 108 | L14 R18 | L14-P16 WeakPolarHBondContact O-CD 3.37Å; P16-R18 VanDerWaalsContact C-N 3.26Å; P16-R18 PolarHBondContact O-N 2.92Å | ||
| 17 | A | 64.9 | Low | 62 | Low | 85 Ų | 85 | 125.2 Ų | 125.2 | 70% | 0.702 | 71% | 0.709 | S | S | * | * | trans | -59.9 | 101.3 | 163.7 | 0 | 0 | 0 | 0 | 0 | 105 | A15 L19 | A15-A17 PolarHBondContact O-N 3.32Å; A17-L19 PolarHBondContact O-N 3.25Å | ||
| 18 | R | 64.1 | Low | 63 | Low | 241 Ų | 241 | 126.3 Ų | 126.3 | 91% | 0.909 | 71% | 0.708 | S | S | * | * | trans | -66 | 82.8 | 169.5 | -65.5 | -173.7 | -167.6 | -175.3 | 4.1 | 105.4 | P16 | P16-R18 VanDerWaalsContact C-N 3.26Å; P16-R18 PolarHBondContact O-N 2.92Å | ||
| 19 | L | 65.2 | Low | 64.2 | Low | 145 Ų | 145 | 125.9 Ų | 125.9 | 76% | 0.759 | 71% | 0.712 | S | S | * | * | trans | -50.2 | 126 | 164.7 | -70.5 | 168.2 | 0 | 0 | 0 | 104.9 | A17 S21 | A17-L19 PolarHBondContact O-N 3.25Å; L19-S21 PolarHBondContact O-N 3.45Å | ||
| 20 | P | 60.6 | Low | 65.6 | Low | 117 Ų | 117 | 128.8 Ų | 128.8 | 76% | 0.76 | 71% | 0.713 | S | S | * | * | trans | -56.9 | 108.9 | 174.3 | 21.5 | -29.2 | 0 | 0 | 0 | 106.2 | G22 | P20-G22 PolarHBondContact O-N 3.04Š| ||
| 21 | S | 62 | Low | 66.9 | Low | 123 Ų | 123 | 131.6 Ų | 131.6 | 86% | 0.86 | 73% | 0.734 | S | S | * | * | trans | -71.8 | 31.9 | 168.8 | 65.3 | 0 | 0 | 0 | 0 | 110.1 | L19 S23 | L19-S21 PolarHBondContact O-N 3.45Å; S21-S23 VanDerWaalsContact C-N 3.32Å; S21-S23 PolarHBondContact O-N 3.3Å | ||
| 22 | G | 59.4 | Low | 68.2 | Low | 60 Ų | 60 | 138.3 Ų | 138.3 | 62% | 0.619 | 75% | 0.748 | S | S | * | * | trans | -66.1 | 100.6 | 170.1 | 0 | 0 | 0 | 0 | 0 | 105.6 | P20 S24 | P20-G22 PolarHBondContact O-N 3.04Å; G22-S24 PolarHBondContact O-N 3.27Å | ||
| 23 | S | 62.7 | Low | 69.6 | Low | 103 Ų | 103 | 134.6 Ų | 134.6 | 72% | 0.72 | 74% | 0.739 | S | S | * | * | trans | -37.2 | 115.8 | 154.4 | 152.5 | 0 | 0 | 0 | 0 | 106.3 | S21 A25 | S21-S23 VanDerWaalsContact C-N 3.32Å; S21-S23 PolarHBondContact O-N 3.3Å; S23-A25 PolarHBondContact O-N 3.43Å | ||
| 24 | S | 60.1 | Low | 71 | Confident | 114 Ų | 114 | 130.6 Ų | 130.6 | 80% | 0.797 | 72% | 0.722 | S | S | * | * | trans | -54 | 92.4 | 172.9 | 171.4 | 0 | 0 | 0 | 0 | 107.3 | G22 R26 | G22-S24 PolarHBondContact O-N 3.27Å; S24-R26 PolarHBondContact O-N 3.23Å | ||
| 25 | A | 62.3 | Low | 72.3 | Confident | 92 Ų | 92 | 132.1 Ų | 132.1 | 76% | 0.76 | 73% | 0.73 | S | S | * | * | trans | -77.3 | 81.2 | -176 | 0 | 0 | 0 | 0 | 0 | 106.2 | S23 S27 | S23-A25 PolarHBondContact O-N 3.43Å; A25-S27 PolarHBondContact O-N 3.03Å | ||
| 26 | R | 68.4 | Low | 73.5 | Confident | 222 Ų | 222 | 136.2 Ų | 136.2 | 84% | 0.838 | 74% | 0.744 | S | S | * | * | trans | -53 | 128.5 | 166.7 | -166 | 174.7 | -173.2 | 158.9 | 1.8 | 106.3 | S24 K28 | S24-R26 PolarHBondContact O-N 3.23Å; R26-K28 PolarHBondContact O-N 2.85Å | ||
| 27 | S | 76.8 | Confident | 74.8 | Confident | 119 Ų | 119 | 133.3 Ų | 133.3 | 83% | 0.832 | 73% | 0.729 | S | S | * | * | trans | -44.5 | 112.4 | 173.2 | 176.1 | 0 | 0 | 0 | 0 | 108.7 | A25 | A25-S27 PolarHBondContact O-N 3.03Š| ||
| 28 | K | 75.3 | Confident | 76 | Confident | 146 Ų | 146 | 136.5 Ų | 136.5 | 64% | 0.635 | 73% | 0.727 | S | S | * | * | trans | -83.5 | 125.3 | 177.7 | -74.1 | -172.4 | 178.8 | -178.5 | 0 | 107.1 | R26 Y30 E33 | R26-K28 PolarHBondContact O-N 2.85Å; K28-Y30 VanDerWaalsContact C-N 3.25Å; K28-Y30 PolarHBondContact O-N 3.42Å; K28-E33 IonicContact NZ-OE1 2.71Å; K28-E33 PolarHBondContact NZ-OE1 3.28Å | ||
| 29 | F | 84.1 | Confident | 77.4 | Confident | 180 Ų | 180 | 128.6 Ų | 128.6 | 79% | 0.789 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -61.9 | -33.4 | -178.5 | -177.1 | -96.8 | 0 | 0 | 0 | 112.8 | ||
| 30 | Y | 87.4 | Confident | 78.8 | Confident | 140 Ų | 140 | 126.3 Ų | 126.3 | 55% | 0.549 | 70% | 0.696 | S | S | . | * | S | Bend | trans | -104.5 | 138.9 | 177.3 | -61.4 | -72.8 | 0 | 0 | 0 | 111.5 | K28 R32 P34 | K28-Y30 VanDerWaalsContact C-N 3.25Å; K28-Y30 PolarHBondContact O-N 3.42Å; Y30-R32 WeakPolarHBondContact CB-O 3.39Å; Y30-R32 PolarHBondContact O-N 3.47Å; Y30-P34 HydrophobicContact CD2-CG 3.91Å; Y30-P34 HydrophobicContact CE2-CG 4.22Å |
| 31 | V | 86.1 | Confident | 80.5 | Confident | 156 Ų | 156 | 130.1 Ų | 130.1 | 95% | 0.945 | 70% | 0.695 | S | S | * | * | S | Bend | trans | -62.2 | -33 | 173.1 | 176.7 | 0 | 0 | 0 | 0 | 111.7 | ||
| 32 | R | 87.8 | Confident | 82.2 | Confident | 215 Ų | 215 | 130.5 Ų | 130.5 | 81% | 0.811 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -119.7 | 144.9 | 174.9 | -66 | -177.3 | -179 | 179.5 | 0.3 | 109.8 | Y30 P34 | Y30-R32 WeakPolarHBondContact CB-O 3.39Å; Y30-R32 PolarHBondContact O-N 3.47Å; R32-P34 WeakPolarHBondContact O-CD 3.41Å |
| 33 | E | 86.6 | Confident | 84 | Confident | 117 Ų | 117 | 134.3 Ų | 134.3 | 55% | 0.547 | 69% | 0.686 | S | S | . | * | trans | -63.2 | 124.4 | 175.7 | -77.4 | -175.6 | 179.5 | 0 | 0 | 109.9 | K28 | K28-E33 IonicContact NZ-OE1 2.71Å; K28-E33 PolarHBondContact NZ-OE1 3.28Å | ||
| 34 | P | 89.6 | Confident | 85.7 | Confident | 59 Ų | 59 | 131.7 Ų | 131.7 | 38% | 0.383 | 67% | 0.666 | S | S | . | * | trans | -65.9 | 148.7 | 176 | 23.5 | -28.5 | 0 | 0 | 0 | 109.7 | Y30 R32 N36 A37 | Y30-P34 HydrophobicContact CD2-CG 3.91Å; Y30-P34 HydrophobicContact CE2-CG 4.22Å; R32-P34 WeakPolarHBondContact O-CD 3.41Å; P34-N36 PolarHBondContact O-N 2.86Å; P34-A37 HydrophobicContact CG-CB 3.83Å; P34-A37 WeakPolarHBondContact O-CB 3.08Å; P34-A37 PolarHBondContact O-N 3.18Å | ||
| 35 | L | 87.7 | Confident | 87.5 | Confident | 166 Ų | 166 | 128.4 Ų | 128.4 | 87% | 0.869 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.4 | -32.1 | -177.8 | -175.6 | 63.7 | 0 | 0 | 0 | 113 | ||
| 36 | N | 88.6 | Confident | 89.2 | Confident | 146 Ų | 146 | 129.3 Ų | 129.3 | 78% | 0.781 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.6 | 15.6 | 180 | -57.6 | -41.8 | 0 | 0 | 0 | 113.2 | P34 K38 | P34-N36 PolarHBondContact O-N 2.86Å; N36-K38 PolarHBondContact O-N 3.43Å |
| 37 | A | 90.5 | Very high | 90.7 | Very high | 54 Ų | 54 | 122.1 Ų | 122.1 | 45% | 0.446 | 62% | 0.622 | S | S | . | * | S | Bend | trans | -58.8 | -31.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | P34 | P34-A37 HydrophobicContact CG-CB 3.83Å; P34-A37 WeakPolarHBondContact O-CB 3.08Å; P34-A37 PolarHBondContact O-N 3.18Å |
| 38 | K | 90.7 | Very high | 91.7 | Very high | 152 Ų | 152 | 121.6 Ų | 121.6 | 66% | 0.661 | 61% | 0.609 | S | S | * | * | S | Bend | trans | -121.9 | 136.9 | 178.5 | -62.7 | 178.8 | -173.7 | 170.9 | 0 | 108.7 | N36 N40 | N36-K38 PolarHBondContact O-N 3.43Å; K38-N40 PolarHBondContact O-N 3Å |
| 39 | P | 93.2 | Very high | 92.8 | Very high | 74 Ų | 74 | 116.4 Ų | 116.4 | 48% | 0.481 | 60% | 0.597 | S | S | . | * | trans | -63.6 | 136.6 | 176.8 | 26.6 | -33.4 | 0 | 0 | 0 | 109.8 | W41 | P39-W41 HydrophobicContact CG-CD2 4.44Å; P39-W41 HydrophobicContact CG-CZ2 3.98Å; P39-W41 PolarHBondContact O-N 2.77Å | ||
| 40 | N | 95.3 | Very high | 93.5 | Very high | 98 Ų | 98 | 111.7 Ų | 111.7 | 52% | 0.524 | 58% | 0.583 | S | S | . | * | trans | -76.5 | 92.6 | 167.8 | -178.1 | -24 | 0 | 0 | 0 | 108.2 | K38 L42 K43 V44 | K38-N40 PolarHBondContact O-N 3Å; N40-L42 PolarHBondContact O-N 3.01Å; N40-L42 WeakPolarHBondContact OD1-CB 3.35Å; N40-L42 PolarHBondContact OD1-N 3.35Å; N40-K43 HydrophobicContact CB-CB 3.94Å; N40-K43 WeakPolarHBondContact O-CB 3.33Å; N40-K43 PolarHBondContact O-N 2.91Å; N40-K43 PolarHBondContact OD1-N 3.49Å; N40-V44 WeakPolarHBondContact O-CG2 3.49Å; N40-V44 PolarHBondContact O-N 3.46Å | ||
| 41 | W | 95.8 | Very high | 94.1 | Very high | 197 Ų | 197 | 108.3 Ų | 108.3 | 75% | 0.746 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -58.7 | -32 | -176.6 | -73.8 | 108.7 | 0 | 0 | 0 | 113.8 | P39 V44 G45 | P39-W41 HydrophobicContact CG-CD2 4.44Å; P39-W41 HydrophobicContact CG-CZ2 3.98Å; P39-W41 PolarHBondContact O-N 2.77Å; W41-V44 PolarHBondContact O-N 2.72Å; W41-G45 PolarHBondContact O-N 3.29Å |
| 42 | L | 97.6 | Very high | 94.7 | Very high | 131 Ų | 131 | 105.2 Ų | 105.2 | 69% | 0.686 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -63.3 | -48.2 | 173.1 | -178.7 | 70.7 | 0 | 0 | 0 | 110.7 | N40 G45 L46 | N40-L42 PolarHBondContact O-N 3.01Å; N40-L42 WeakPolarHBondContact OD1-CB 3.35Å; N40-L42 PolarHBondContact OD1-N 3.35Å; L42-G45 PolarHBondContact O-N 2.98Å; L42-L46 HydrophobicContact CG-CD1 4.28Å; L42-L46 WeakPolarHBondContact O-CG 3.21Å; L42-L46 PolarHBondContact O-N 3.29Å |
| 43 | K | 97.6 | Very high | 95.2 | Very high | 139 Ų | 139 | 99.7 Ų | 99.7 | 60% | 0.604 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -62.1 | -44.4 | 177 | -173.6 | 177.5 | 179.9 | 179.3 | 0 | 111.2 | N40 L46 T47 | N40-K43 HydrophobicContact CB-CB 3.94Å; N40-K43 WeakPolarHBondContact O-CB 3.33Å; N40-K43 PolarHBondContact O-N 2.91Å; N40-K43 PolarHBondContact OD1-N 3.49Å; K43-L46 PolarHBondContact O-N 2.86Å; K43-T47 HydrophobicContact CG-CG2 4.43Å; K43-T47 WeakPolarHBondContact O-CG2 3.36Å; K43-T47 PolarHBondContact O-N 2.96Å; K43-T47 PolarHBondContact O-OG1 2.86Å; K43-T47 VanDerWaalsContact O-OG1 3.08Å |
| 44 | V | 98.3 | Very high | 95.8 | Very high | 49 Ų | 49 | 99.4 Ų | 99.4 | 30% | 0.297 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -58.9 | -49 | 177.5 | 173.3 | 0 | 0 | 0 | 0 | 110.7 | N40 W41 L46 T47 L48 | N40-V44 WeakPolarHBondContact O-CG2 3.49Å; N40-V44 PolarHBondContact O-N 3.46Å; W41-V44 PolarHBondContact O-N 2.72Å; V44-L46 PolarHBondContact O-N 3.46Å; V44-T47 WeakPolarHBondContact CA-OG1 3.49Å; V44-T47 PolarHBondContact O-N 2.93Å; V44-T47 PolarHBondContact O-OG1 3.43Å; V44-L48 HydrophobicContact CG1-CD1 3.98Å; V44-L48 HydrophobicContact CG1-CG 4.46Å; V44-L48 WeakPolarHBondContact O-CG 3.38Å; V44-L48 PolarHBondContact O-N 3.44Å |
| 45 | G | 98.4 | Very high | 96.2 | Very high | 44 Ų | 44 | 104 Ų | 104 | 45% | 0.454 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -58.3 | -47.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | W41 L42 T47 L48 G49 | W41-G45 PolarHBondContact O-N 3.29Å; L42-G45 PolarHBondContact O-N 2.98Å; G45-T47 PolarHBondContact O-N 3.24Å; G45-L48 PolarHBondContact O-N 3.01Å; G45-G49 PolarHBondContact O-N 3.3Å |
| 46 | L | 98.7 | Very high | 96.8 | Very high | 112 Ų | 112 | 100.5 Ų | 100.5 | 59% | 0.586 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -62.1 | -42.4 | 176.9 | -71.9 | 171.6 | 0 | 0 | 0 | 112.4 | L42 K43 V44 T50 | L42-L46 HydrophobicContact CG-CD1 4.28Å; L42-L46 WeakPolarHBondContact O-CG 3.21Å; L42-L46 PolarHBondContact O-N 3.29Å; K43-L46 PolarHBondContact O-N 2.86Å; V44-L46 PolarHBondContact O-N 3.46Å; L46-T50 WeakPolarHBondContact O-CB 3.35Å; L46-T50 PolarHBondContact O-N 3.31Å; L46-T50 PolarHBondContact O-OG1 3.43Å |
| 47 | T | 98.7 | Very high | 97.2 | Very high | 70 Ų | 70 | 100.7 Ų | 100.7 | 43% | 0.429 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62.9 | -50 | 178.4 | 50.2 | 0 | 0 | 0 | 0 | 111.8 | K43 V44 G45 G49 T50 T51 | K43-T47 HydrophobicContact CG-CG2 4.43Å; K43-T47 WeakPolarHBondContact O-CG2 3.36Å; K43-T47 PolarHBondContact O-N 2.96Å; K43-T47 PolarHBondContact O-OG1 2.86Å; K43-T47 VanDerWaalsContact O-OG1 3.08Å; V44-T47 WeakPolarHBondContact CA-OG1 3.49Å; V44-T47 PolarHBondContact O-N 2.93Å; V44-T47 PolarHBondContact O-OG1 3.43Å; G45-T47 PolarHBondContact O-N 3.24Å; T47-G49 PolarHBondContact O-N 3.42Å; T47-T50 PolarHBondContact O-N 3.47Å; T47-T51 WeakPolarHBondContact O-CB 3.47Å; T47-T51 PolarHBondContact O-N 3.48Å; T47-T51 PolarHBondContact O-OG1 2.93Å |
| 48 | L | 98.7 | Very high | 97.6 | Very high | 109 Ų | 109 | 102.7 Ų | 102.7 | 57% | 0.571 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -65 | -43 | -179.8 | -66.1 | 177.4 | 0 | 0 | 0 | 111.5 | V44 G45 T50 T51 V52 | V44-L48 HydrophobicContact CG1-CD1 3.98Å; V44-L48 HydrophobicContact CG1-CG 4.46Å; V44-L48 WeakPolarHBondContact O-CG 3.38Å; V44-L48 PolarHBondContact O-N 3.44Å; G45-L48 PolarHBondContact O-N 3.01Å; L48-T50 PolarHBondContact O-N 2.97Å; L48-T51 PolarHBondContact O-N 3.38Å; L48-V52 WeakPolarHBondContact O-CG2 3.3Å; L48-V52 PolarHBondContact O-N 2.89Å |
| 49 | G | 98.6 | Very high | 98 | Very high | 37 Ų | 37 | 99.9 Ų | 99.9 | 38% | 0.381 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -59.3 | -46.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | G45 T47 T51 V52 V53 | G45-G49 PolarHBondContact O-N 3.3Å; T47-G49 PolarHBondContact O-N 3.42Å; G49-T51 PolarHBondContact O-N 3.49Å; G49-V52 PolarHBondContact O-N 2.92Å; G49-V53 WeakPolarHBondContact O-CG2 3.42Å; G49-V53 PolarHBondContact O-N 3.34Å |
| 50 | T | 98.8 | Very high | 98.3 | Very high | 81 Ų | 81 | 102.2 Ų | 102.2 | 50% | 0.497 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -63 | -43.3 | 177.8 | -52.4 | 0 | 0 | 0 | 0 | 111.3 | L46 T47 L48 V52 V53 L54 | L46-T50 WeakPolarHBondContact O-CB 3.35Å; L46-T50 PolarHBondContact O-N 3.31Å; L46-T50 PolarHBondContact O-OG1 3.43Å; T47-T50 PolarHBondContact O-N 3.47Å; L48-T50 PolarHBondContact O-N 2.97Å; T50-V52 PolarHBondContact O-N 3.5Å; T50-V53 PolarHBondContact O-N 3.32Å; T50-L54 HydrophobicContact CG2-CD1 4.22Å; T50-L54 WeakPolarHBondContact O-CG 3.36Å; T50-L54 PolarHBondContact O-N 3.48Å |
| 51 | T | 98.8 | Very high | 98.4 | Very high | 69 Ų | 69 | 100.5 Ų | 100.5 | 42% | 0.423 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -59.7 | -46.7 | 176.2 | -61.8 | 0 | 0 | 0 | 0 | 111.6 | T47 L48 G49 V53 L54 W55 | T47-T51 WeakPolarHBondContact O-CB 3.47Å; T47-T51 PolarHBondContact O-N 3.48Å; T47-T51 PolarHBondContact O-OG1 2.93Å; L48-T51 PolarHBondContact O-N 3.38Å; G49-T51 PolarHBondContact O-N 3.49Å; T51-V53 PolarHBondContact O-N 2.96Å; T51-L54 PolarHBondContact O-N 3.34Å; T51-W55 PolarHBondContact O-N 3.31Å |
| 52 | V | 98.8 | Very high | 98.6 | Very high | 91 Ų | 91 | 96.2 Ų | 96.2 | 55% | 0.552 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -61.3 | -45.2 | 177.7 | 170.7 | 0 | 0 | 0 | 0 | 111.3 | L48 G49 T50 L54 W55 V56 | L48-V52 WeakPolarHBondContact O-CG2 3.3Å; L48-V52 PolarHBondContact O-N 2.89Å; G49-V52 PolarHBondContact O-N 2.92Å; T50-V52 PolarHBondContact O-N 3.5Å; V52-L54 VanDerWaalsContact C-N 3.34Å; V52-L54 PolarHBondContact O-N 3.31Å; V52-W55 PolarHBondContact O-N 2.92Å; V52-V56 HydrophobicContact CG1-CG2 4.34Å; V52-V56 WeakPolarHBondContact O-CG2 3.33Å; V52-V56 PolarHBondContact O-N 3.47Å |
| 53 | V | 98.8 | Very high | 98.6 | Very high | 99 Ų | 99 | 93.9 Ų | 93.9 | 60% | 0.6 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -58.7 | -46.1 | 177.4 | 168.8 | 0 | 0 | 0 | 0 | 111.2 | G49 T50 T51 W55 V56 Y57 | G49-V53 WeakPolarHBondContact O-CG2 3.42Å; G49-V53 PolarHBondContact O-N 3.34Å; T50-V53 PolarHBondContact O-N 3.32Å; T51-V53 PolarHBondContact O-N 2.96Å; V53-W55 PolarHBondContact O-N 3.49Å; V53-V56 PolarHBondContact O-N 2.91Å; V53-Y57 WeakPolarHBondContact O-CB 3.35Å; V53-Y57 PolarHBondContact O-N 2.92Å |
| 54 | L | 98.8 | Very high | 98.6 | Very high | 111 Ų | 111 | 91.5 Ų | 91.5 | 58% | 0.581 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -61.4 | -42.9 | 177.5 | -73.2 | 171.7 | 0 | 0 | 0 | 112 | T50 T51 V52 Y57 L58 | T50-L54 HydrophobicContact CG2-CD1 4.22Å; T50-L54 WeakPolarHBondContact O-CG 3.36Å; T50-L54 PolarHBondContact O-N 3.48Å; T51-L54 PolarHBondContact O-N 3.34Å; V52-L54 VanDerWaalsContact C-N 3.34Å; V52-L54 PolarHBondContact O-N 3.31Å; L54-Y57 PolarHBondContact O-N 3Å; L54-L58 VanDerWaalsContact O-CB 3.26Å; L54-L58 WeakPolarHBondContact O-CB 3.47Å; L54-L58 PolarHBondContact O-N 3.48Å |
| 55 | W | 98.8 | Very high | 98.7 | Very high | 154 Ų | 154 | 93.2 Ų | 93.2 | 58% | 0.583 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -65.4 | -44.6 | 178.2 | -85.7 | 108.9 | 0 | 0 | 0 | 112.9 | T51 V52 V53 Y57 L58 I59 | T51-W55 PolarHBondContact O-N 3.31Å; V52-W55 PolarHBondContact O-N 2.92Å; V53-W55 PolarHBondContact O-N 3.49Å; W55-Y57 VanDerWaalsContact C-N 3.31Å; W55-Y57 PolarHBondContact O-N 3.36Å; W55-L58 HydrophobicContact CE3-CD2 4.18Å; W55-L58 HydrophobicContact CZ3-CD2 4.1Å; W55-L58 PolarHBondContact O-N 3.48Å; W55-I59 VanDerWaalsContact O-CG1 3.3Å; W55-I59 WeakPolarHBondContact O-CG1 3.27Å; W55-I59 PolarHBondContact O-N 2.98Å |
| 56 | V | 98.8 | Very high | 98.6 | Very high | 94 Ų | 94 | 94.1 Ų | 94.1 | 57% | 0.57 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -60.8 | -45 | 176.5 | 170.6 | 0 | 0 | 0 | 0 | 110.3 | V52 V53 I59 K60 | V52-V56 HydrophobicContact CG1-CG2 4.34Å; V52-V56 WeakPolarHBondContact O-CG2 3.33Å; V52-V56 PolarHBondContact O-N 3.47Å; V53-V56 PolarHBondContact O-N 2.91Å; V56-I59 PolarHBondContact O-N 3.46Å; V56-K60 WeakPolarHBondContact O-CB 3.35Å; V56-K60 PolarHBondContact O-N 2.9Å |
| 57 | Y | 98.7 | Very high | 98.6 | Very high | 149 Ų | 149 | 94 Ų | 94 | 58% | 0.584 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -61.6 | -45.2 | 176.9 | -175.7 | -98.8 | 0 | 0 | 0 | 111.8 | V53 L54 W55 I59 K60 Q61 | V53-Y57 WeakPolarHBondContact O-CB 3.35Å; V53-Y57 PolarHBondContact O-N 2.92Å; L54-Y57 PolarHBondContact O-N 3Å; W55-Y57 VanDerWaalsContact C-N 3.31Å; W55-Y57 PolarHBondContact O-N 3.36Å; Y57-I59 PolarHBondContact O-N 3.45Å; Y57-K60 PolarHBondContact O-N 3.38Å; Y57-Q61 WeakPolarHBondContact O-CB 3.38Å; Y57-Q61 PolarHBondContact O-N 2.69Å |
| 58 | L | 98.8 | Very high | 98.5 | Very high | 97 Ų | 97 | 93.1 Ų | 93.1 | 51% | 0.508 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -62.8 | -43.9 | 179.9 | -174.8 | 68.4 | 0 | 0 | 0 | 112.2 | L54 W55 K60 Q61 H62 | L54-L58 VanDerWaalsContact O-CB 3.26Å; L54-L58 WeakPolarHBondContact O-CB 3.47Å; L54-L58 PolarHBondContact O-N 3.48Å; W55-L58 HydrophobicContact CE3-CD2 4.18Å; W55-L58 HydrophobicContact CZ3-CD2 4.1Å; W55-L58 PolarHBondContact O-N 3.48Å; L58-K60 VanDerWaalsContact C-N 3.34Å; L58-Q61 PolarHBondContact O-N 3.18Å; L58-H62 VanDerWaalsContact O-CB 3.27Å; L58-H62 WeakPolarHBondContact O-CB 3.38Å; L58-H62 PolarHBondContact O-N 3.41Å |
| 59 | I | 98.7 | Very high | 98.5 | Very high | 93 Ų | 93 | 94.2 Ų | 94.2 | 48% | 0.477 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -65 | -42.1 | 177.8 | -68.3 | 165.5 | 0 | 0 | 0 | 110.3 | W55 V56 Y57 H62 N63 | W55-I59 VanDerWaalsContact O-CG1 3.3Å; W55-I59 WeakPolarHBondContact O-CG1 3.27Å; W55-I59 PolarHBondContact O-N 2.98Å; V56-I59 PolarHBondContact O-N 3.46Å; Y57-I59 PolarHBondContact O-N 3.45Å; I59-H62 PolarHBondContact O-N 3.24Å; I59-N63 VanDerWaalsContact O-CG 3.27Å; I59-N63 PolarHBondContact O-N 3.22Å; I59-N63 PolarHBondContact O-ND2 3.09Å |
| 60 | K | 98.7 | Very high | 98.5 | Very high | 122 Ų | 122 | 96.7 Ų | 96.7 | 53% | 0.53 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -59.9 | -50.7 | 176.3 | -174.4 | -174.2 | 173 | -162.2 | 0 | 110.7 | V56 Y57 L58 H62 N63 E64 | V56-K60 WeakPolarHBondContact O-CB 3.35Å; V56-K60 PolarHBondContact O-N 2.9Å; Y57-K60 PolarHBondContact O-N 3.38Å; L58-K60 VanDerWaalsContact C-N 3.34Å; K60-H62 VanDerWaalsContact C-N 3.33Å; K60-H62 PolarHBondContact O-N 2.93Å; K60-N63 PolarHBondContact O-N 3.36Å; K60-E64 WeakPolarHBondContact CE-OE1 3.37Å; K60-E64 IonicContact NZ-OE1 2.72Å; K60-E64 WeakPolarHBondContact O-CG 3.26Å; K60-E64 PolarHBondContact O-N 3.48Å |
| 61 | Q | 98.7 | Very high | 98.4 | Very high | 63 Ų | 63 | 100.4 Ų | 100.4 | 29% | 0.294 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -57.3 | -47.2 | 177.4 | -174.8 | 65.2 | 36.3 | 0 | 0 | 111.2 | Y57 L58 N63 E64 D65 | Y57-Q61 WeakPolarHBondContact O-CB 3.38Å; Y57-Q61 PolarHBondContact O-N 2.69Å; L58-Q61 PolarHBondContact O-N 3.18Å; Q61-N63 VanDerWaalsContact C-N 3.31Å; Q61-N63 PolarHBondContact O-N 3.48Å; Q61-E64 PolarHBondContact O-N 2.99Å; Q61-D65 PolarHBondContact NE2-OD1 2.89Å; Q61-D65 WeakPolarHBondContact O-CB 3.33Å; Q61-D65 PolarHBondContact O-N 3.01Å |
| 62 | H | 98.6 | Very high | 98.3 | Very high | 106 Ų | 106 | 106.1 Ų | 106.1 | 49% | 0.491 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -57.9 | -42.5 | 178.8 | 177.3 | 65.9 | 0 | 0 | 0 | 112.8 | L58 I59 K60 D65 I66 | L58-H62 VanDerWaalsContact O-CB 3.27Å; L58-H62 WeakPolarHBondContact O-CB 3.38Å; L58-H62 PolarHBondContact O-N 3.41Å; I59-H62 PolarHBondContact O-N 3.24Å; K60-H62 VanDerWaalsContact C-N 3.33Å; K60-H62 PolarHBondContact O-N 2.93Å; H62-D65 PolarHBondContact O-N 2.95Å; H62-I66 VanDerWaalsContact CE1-CD1 3.47Å; H62-I66 WeakPolarHBondContact CE1-CD1 3.44Å; H62-I66 WeakPolarHBondContact NE2-CD1 3.45Å; H62-I66 WeakPolarHBondContact O-CG1 3.49Å; H62-I66 PolarHBondContact O-N 3.24Å |
| 63 | N | 98.4 | Very high | 98.3 | Very high | 83 Ų | 83 | 106 Ų | 106 | 44% | 0.444 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -66.5 | -42.7 | 177.3 | -69.4 | -25.1 | 0 | 0 | 0 | 111.7 | I59 K60 Q61 D65 I66 L67 | I59-N63 VanDerWaalsContact O-CG 3.27Å; I59-N63 PolarHBondContact O-N 3.22Å; I59-N63 PolarHBondContact O-ND2 3.09Å; K60-N63 PolarHBondContact O-N 3.36Å; Q61-N63 VanDerWaalsContact C-N 3.31Å; Q61-N63 PolarHBondContact O-N 3.48Å; N63-D65 VanDerWaalsContact C-N 3.33Å; N63-I66 PolarHBondContact O-N 3.25Å; N63-L67 VanDerWaalsContact O-CG 3.29Å; N63-L67 WeakPolarHBondContact O-CG 3.45Å; N63-L67 PolarHBondContact O-N 3.04Å |
| 64 | E | 98.4 | Very high | 98 | Very high | 88 Ų | 88 | 104.3 Ų | 104.3 | 41% | 0.411 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60.8 | -43.2 | 174.9 | -71.7 | 178 | 178 | 0 | 0 | 111.3 | K60 Q61 I66 L67 E68 | K60-E64 WeakPolarHBondContact CE-OE1 3.37Å; K60-E64 IonicContact NZ-OE1 2.72Å; K60-E64 WeakPolarHBondContact O-CG 3.26Å; K60-E64 PolarHBondContact O-N 3.48Å; Q61-E64 PolarHBondContact O-N 2.99Å; E64-I66 PolarHBondContact O-N 2.73Å; E64-L67 PolarHBondContact O-N 3.25Å; E64-E68 WeakPolarHBondContact O-CB 3.44Å; E64-E68 PolarHBondContact O-N 3.08Å |
| 65 | D | 98.4 | Very high | 97.7 | Very high | 85 Ų | 85 | 103.7 Ų | 103.7 | 46% | 0.455 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.8 | -40.5 | 177.9 | -66.2 | -18.6 | 0 | 0 | 0 | 111.7 | Q61 H62 N63 E68 Y69 | Q61-D65 PolarHBondContact NE2-OD1 2.89Å; Q61-D65 WeakPolarHBondContact O-CB 3.33Å; Q61-D65 PolarHBondContact O-N 3.01Å; H62-D65 PolarHBondContact O-N 2.95Å; N63-D65 VanDerWaalsContact C-N 3.33Å; D65-E68 PolarHBondContact O-N 2.91Å; D65-Y69 WeakPolarHBondContact O-CB 3.42Å; D65-Y69 PolarHBondContact O-N 3.44Å |
| 66 | I | 98.2 | Very high | 96.6 | Very high | 64 Ų | 64 | 106.3 Ų | 106.3 | 33% | 0.328 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.8 | -44.8 | 174.8 | -73.4 | 170.8 | 0 | 0 | 0 | 111.1 | H62 N63 E64 E68 Y69 K70 | H62-I66 VanDerWaalsContact CE1-CD1 3.47Å; H62-I66 WeakPolarHBondContact CE1-CD1 3.44Å; H62-I66 WeakPolarHBondContact NE2-CD1 3.45Å; H62-I66 WeakPolarHBondContact O-CG1 3.49Å; H62-I66 PolarHBondContact O-N 3.24Å; N63-I66 PolarHBondContact O-N 3.25Å; E64-I66 PolarHBondContact O-N 2.73Å; I66-E68 VanDerWaalsContact C-N 3.3Å; I66-E68 PolarHBondContact O-N 3.41Å; I66-Y69 PolarHBondContact O-N 3.06Å; I66-K70 HydrophobicContact CG2-CD 4.29Å; I66-K70 WeakPolarHBondContact O-CG 3.34Å; I66-K70 PolarHBondContact O-N 2.95Å |
| 67 | L | 97.7 | Very high | 96.5 | Very high | 108 Ų | 108 | 106.9 Ų | 106.9 | 57% | 0.565 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -61.6 | -44 | 178.2 | -72.8 | 172.8 | 0 | 0 | 0 | 110.5 | N63 E64 Y69 K70 R71 | N63-L67 VanDerWaalsContact O-CG 3.29Å; N63-L67 WeakPolarHBondContact O-CG 3.45Å; N63-L67 PolarHBondContact O-N 3.04Å; E64-L67 PolarHBondContact O-N 3.25Å; L67-Y69 VanDerWaalsContact C-N 3.34Å; L67-Y69 PolarHBondContact O-N 3.01Å; L67-K70 PolarHBondContact O-N 3.24Å; L67-R71 WeakPolarHBondContact O-CB 3.16Å; L67-R71 PolarHBondContact O-N 2.83Å |
| 68 | E | 97.7 | Very high | 96.3 | Very high | 52 Ų | 52 | 104.7 Ų | 104.7 | 24% | 0.243 | 51% | 0.505 | C | S | . | . | H | α-helix | trans | -62.3 | -42.4 | 177.1 | -176.1 | 61.4 | -173 | 0 | 0 | 112.2 | E64 D65 I66 R71 R72 | E64-E68 WeakPolarHBondContact O-CB 3.44Å; E64-E68 PolarHBondContact O-N 3.08Å; D65-E68 PolarHBondContact O-N 2.91Å; I66-E68 VanDerWaalsContact C-N 3.3Å; I66-E68 PolarHBondContact O-N 3.41Å; E68-R71 PolarHBondContact O-N 3.06Å; E68-R71 IonicContact OE1-CZ 3.67Å; E68-R71 IonicContact OE1-NE 3.82Å; E68-R71 IonicContact OE1-NH2 2.75Å; E68-R71 PolarHBondContact OE1-NH2 2.96Å; E68-R71 IonicContact OE2-CZ 2.99Å; E68-R71 IonicContact OE2-NE 2.89Å; E68-R71 PolarHBondContact OE2-NE 2.84Å; E68-R71 IonicContact OE2-NH2 2.67Å; E68-R71 PolarHBondContact OE2-NH2 3.24Å; E68-R72 WeakPolarHBondContact O-CG 3.27Å; E68-R72 PolarHBondContact O-N 2.91Å; E68-R72 IonicContact OE1-CZ 3.73Å; E68-R72 IonicContact OE1-NE 2.77Å; E68-R72 PolarHBondContact OE1-NE 2.9Å; E68-R72 IonicContact OE1-NH2 3.16Å; E68-R72 PolarHBondContact OE1-NH2 3.07Å |
| 69 | Y | 97.9 | Very high | 96.2 | Very high | 132 Ų | 132 | 105.1 Ų | 105.1 | 52% | 0.518 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.6 | -49.1 | 174.9 | 172.7 | -98.5 | 0 | 0 | 0 | 111.7 | D65 I66 L67 R71 R72 N73 L75 | D65-Y69 WeakPolarHBondContact O-CB 3.42Å; D65-Y69 PolarHBondContact O-N 3.44Å; I66-Y69 PolarHBondContact O-N 3.06Å; L67-Y69 VanDerWaalsContact C-N 3.34Å; L67-Y69 PolarHBondContact O-N 3.01Å; Y69-R71 VanDerWaalsContact C-N 3.34Å; Y69-R71 PolarHBondContact O-N 2.8Å; Y69-R72 PolarHBondContact O-N 2.81Å; Y69-N73 WeakPolarHBondContact CE2-ND2 3.15Å; Y69-N73 WeakPolarHBondContact O-CB 3.42Å; Y69-N73 PolarHBondContact O-N 2.66Å; Y69-N73 PolarHBondContact O-OD1 2.72Å; Y69-L75 HydrophobicContact CD1-CD1 4.42Å; Y69-L75 HydrophobicContact CE1-CD1 3.66Å |
| 70 | K | 97.8 | Very high | 96.1 | Very high | 90 Ų | 90 | 105.8 Ų | 105.8 | 39% | 0.391 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.1 | -43.9 | 178.7 | -72 | -179.3 | 178.1 | -172.2 | 0 | 111.8 | I66 L67 R72 N73 G74 L75 E76 | I66-K70 HydrophobicContact CG2-CD 4.29Å; I66-K70 WeakPolarHBondContact O-CG 3.34Å; I66-K70 PolarHBondContact O-N 2.95Å; L67-K70 PolarHBondContact O-N 3.24Å; K70-R72 PolarHBondContact O-N 2.71Å; K70-N73 CarbonylContact O-C 3.58Å; K70-N73 PolarHBondContact O-N 3.27Å; K70-G74 PolarHBondContact O-N 2.93Å; K70-L75 HydrophobicContact CB-CB 4.31Å; K70-L75 HydrophobicContact CG-CB 4.26Å; K70-L75 PolarHBondContact O-N 3.4Å; K70-E76 HydrophobicContact CB-CG 4.48Å |
| 71 | R | 97.3 | Very high | 95.9 | Very high | 159 Ų | 159 | 104.8 Ų | 104.8 | 60% | 0.6 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -58.6 | -44.4 | 177 | -175.8 | 178.3 | 72.7 | 147.8 | 6.9 | 112.2 | L67 E68 Y69 N73 | L67-R71 WeakPolarHBondContact O-CB 3.16Å; L67-R71 PolarHBondContact O-N 2.83Å; E68-R71 PolarHBondContact O-N 3.06Å; E68-R71 IonicContact OE1-CZ 3.67Å; E68-R71 IonicContact OE1-NE 3.82Å; E68-R71 IonicContact OE1-NH2 2.75Å; E68-R71 PolarHBondContact OE1-NH2 2.96Å; E68-R71 IonicContact OE2-CZ 2.99Å; E68-R71 IonicContact OE2-NE 2.89Å; E68-R71 PolarHBondContact OE2-NE 2.84Å; E68-R71 IonicContact OE2-NH2 2.67Å; E68-R71 PolarHBondContact OE2-NH2 3.24Å; Y69-R71 VanDerWaalsContact C-N 3.34Å; Y69-R71 PolarHBondContact O-N 2.8Å; R71-N73 VanDerWaalsContact C-N 3.33Å |
| 72 | R | 97.4 | Very high | 95.7 | Very high | 189 Ų | 189 | 107.6 Ų | 107.6 | 71% | 0.713 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -71.7 | -27.7 | -180 | -71.7 | -179 | -174 | -170.1 | 6.6 | 113.4 | E68 Y69 K70 | E68-R72 WeakPolarHBondContact O-CG 3.27Å; E68-R72 PolarHBondContact O-N 2.91Å; E68-R72 IonicContact OE1-CZ 3.73Å; E68-R72 IonicContact OE1-NE 2.77Å; E68-R72 PolarHBondContact OE1-NE 2.9Å; E68-R72 IonicContact OE1-NH2 3.16Å; E68-R72 PolarHBondContact OE1-NH2 3.07Å; Y69-R72 PolarHBondContact O-N 2.81Å; K70-R72 PolarHBondContact O-N 2.71Å |
| 73 | N | 97.5 | Very high | 95.5 | Very high | 87 Ų | 87 | 107.7 Ų | 107.7 | 47% | 0.465 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -100.4 | -0.8 | -176.7 | -70.4 | 43.6 | 0 | 0 | 0 | 113.1 | Y69 K70 R71 L75 | Y69-N73 WeakPolarHBondContact CE2-ND2 3.15Å; Y69-N73 WeakPolarHBondContact O-CB 3.42Å; Y69-N73 PolarHBondContact O-N 2.66Å; Y69-N73 PolarHBondContact O-OD1 2.72Å; K70-N73 CarbonylContact O-C 3.58Å; K70-N73 PolarHBondContact O-N 3.27Å; R71-N73 VanDerWaalsContact C-N 3.33Å; N73-L75 VanDerWaalsContact C-N 3.32Å; N73-L75 HydrophobicContact CB-CD1 3.72Å; N73-L75 HydrophobicContact CB-CG 3.73Å; N73-L75 PolarHBondContact O-N 3.34Å |
| 74 | G | 93.8 | Very high | 95.3 | Very high | 65 Ų | 65 | 109.6 Ų | 109.6 | 67% | 0.67 | 53% | 0.526 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 64.6 | 33.3 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | K70 | K70-G74 PolarHBondContact O-N 2.93Š|
| 75 | L | 92.1 | Very high | 95 | Very high | 97 Ų | 97 | 111.4 Ų | 111.4 | 51% | 0.508 | 54% | 0.536 | S | S | . | . | trans | -99.1 | 27.1 | -175.8 | -57.1 | 173.9 | 0 | 0 | 0 | 112.8 | Y69 K70 N73 | Y69-L75 HydrophobicContact CD1-CD1 4.42Å; Y69-L75 HydrophobicContact CE1-CD1 3.66Å; K70-L75 HydrophobicContact CB-CB 4.31Å; K70-L75 HydrophobicContact CG-CB 4.26Å; K70-L75 PolarHBondContact O-N 3.4Å; N73-L75 VanDerWaalsContact C-N 3.32Å; N73-L75 HydrophobicContact CB-CD1 3.72Å; N73-L75 HydrophobicContact CB-CG 3.73Å; N73-L75 PolarHBondContact O-N 3.34Å | ||
| 76 | E | 74.8 | Confident | 94.7 | Very high | 209 Ų | 209 | 113.8 Ų | 113.8 | 98% | 0.977 | 54% | 0.544 | S | S | * | . | trans | -85.2 | 0 | 176.7 | -72.7 | -172.5 | 172.6 | 0 | 0 | 112.8 | K70 | K70-E76 HydrophobicContact CB-CG 4.48Š|
Retrieved 76 of 76 residues in 13.3 ms
(Link to these results)