| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 45.9 | Very low | 67 | Low | 239 Ų | 239 | 157.2 Ų | 157.2 | 100% | 1.177 | 81% | 0.81 | S | S | * | * | 0 | 115.1 | 0 | -69.5 | -178 | -142.1 | 0 | 0 | 105.7 | D3 | M1-D3 PolarHBondContact O-N 3.29Š| |||
| 2 | E | 54 | Low | 68.6 | Low | 190 Ų | 190 | 151.2 Ų | 151.2 | 89% | 0.888 | 80% | 0.801 | S | S | * | * | trans | -67.1 | 123.7 | -158.2 | -65.2 | 165.1 | 161.9 | 0 | 0 | 112 | S4 | E2-S4 PolarHBondContact O-N 3.01Š| ||
| 3 | D | 57.5 | Low | 70.1 | Confident | 161 Ų | 161 | 149.5 Ų | 149.5 | 86% | 0.861 | 80% | 0.804 | S | S | * | * | trans | -67.7 | 88.6 | 163.9 | -71.5 | -33.9 | 0 | 0 | 0 | 107.6 | M1 V5 | M1-D3 PolarHBondContact O-N 3.29Å; D3-V5 PolarHBondContact O-N 3.42Å; D3-V5 VanDerWaalsContact O-N 3.12Å | ||
| 4 | S | 66.6 | Low | 71.5 | Confident | 69 Ų | 69 | 155.4 Ų | 155.4 | 48% | 0.483 | 81% | 0.809 | S | S | . | * | trans | -59.5 | 119.3 | 178.6 | 63.4 | 0 | 0 | 0 | 0 | 109.5 | E2 Y6 V7 | E2-S4 PolarHBondContact O-N 3.01Å; S4-Y6 PolarHBondContact O-N 2.91Å; S4-V7 PolarHBondContact O-N 3.37Å; S4-V7 WeakPolarHBondContact OG-CG2 3.49Å | ||
| 5 | V | 62.2 | Low | 72.7 | Confident | 140 Ų | 140 | 158.2 Ų | 158.2 | 85% | 0.848 | 82% | 0.817 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62 | -1.7 | -173.8 | -173.8 | 0 | 0 | 0 | 0 | 113.2 | D3 | D3-V5 PolarHBondContact O-N 3.42Å; D3-V5 VanDerWaalsContact O-N 3.12Å |
| 6 | Y | 64.7 | Low | 73.9 | Confident | 217 Ų | 217 | 152.8 Ų | 152.8 | 85% | 0.851 | 79% | 0.793 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.2 | 2.5 | -178.5 | -59.6 | -68.9 | 0 | 0 | 0 | 115.1 | S4 N8 | S4-Y6 PolarHBondContact O-N 2.91Å; Y6-N8 PolarHBondContact O-N 3.33Å |
| 7 | V | 67.7 | Low | 75 | Confident | 100 Ų | 100 | 147.5 Ų | 147.5 | 61% | 0.606 | 77% | 0.772 | S | S | * | * | trans | -87.8 | 90 | 174 | -178.1 | 0 | 0 | 0 | 0 | 108.5 | S4 K9 | S4-V7 PolarHBondContact O-N 3.37Å; S4-V7 WeakPolarHBondContact OG-CG2 3.49Å; V7-K9 VanDerWaalsContact C-N 3.27Å; V7-K9 PolarHBondContact O-N 3.37Å | ||
| 8 | N | 71.3 | Confident | 76 | Confident | 152 Ų | 152 | 144.9 Ų | 144.9 | 81% | 0.813 | 77% | 0.766 | S | S | * | * | trans | -60 | 95.6 | 162.6 | -94.6 | -44.7 | 0 | 0 | 0 | 108.1 | Y6 L10 | Y6-N8 PolarHBondContact O-N 3.33Å; N8-L10 VanDerWaalsContact C-N 3.33Å; N8-L10 PolarHBondContact O-N 2.92Å | ||
| 9 | K | 77 | Confident | 77.1 | Confident | 196 Ų | 196 | 143.8 Ų | 143.8 | 85% | 0.852 | 76% | 0.76 | S | S | * | * | trans | -71.6 | 90.9 | -179.6 | -164.4 | 174.5 | -173.2 | 178.3 | 0 | 108.3 | V7 | V7-K9 VanDerWaalsContact C-N 3.27Å; V7-K9 PolarHBondContact O-N 3.37Å | ||
| 10 | L | 83.7 | Confident | 77.9 | Confident | 149 Ų | 149 | 141.3 Ų | 141.3 | 78% | 0.78 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 143.1 | 173.8 | -66 | 172.1 | 0 | 0 | 0 | 109.4 | N8 | N8-L10 VanDerWaalsContact C-N 3.33Å; N8-L10 PolarHBondContact O-N 2.92Å |
| 11 | P | 86.4 | Confident | 78.7 | Confident | 116 Ų | 116 | 142.1 Ų | 142.1 | 75% | 0.753 | 74% | 0.738 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 149.7 | 173.6 | 26.7 | -34.1 | 0 | 0 | 0 | 109.8 | ||
| 12 | A | 86.3 | Confident | 81.1 | Confident | 85 Ų | 85 | 135 Ų | 135 | 70% | 0.702 | 71% | 0.709 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 142.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | R14 | A12-R14 PolarHBondContact O-N 3.03Š|
| 13 | P | 88.5 | Confident | 83.2 | Confident | 129 Ų | 129 | 128.2 Ų | 128.2 | 84% | 0.838 | 69% | 0.685 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 129.6 | 178 | -25.1 | 33.7 | 0 | 0 | 0 | 111.3 | ||
| 14 | R | 88.9 | Confident | 85 | Confident | 232 Ų | 232 | 128.1 Ų | 128.1 | 88% | 0.875 | 67% | 0.673 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 136.4 | 173.6 | -68.3 | -176.4 | -179.6 | -178.7 | -0.1 | 109.6 | A12 V16 | A12-R14 PolarHBondContact O-N 3.03Å; R14-V16 PolarHBondContact O-N 3.43Å |
| 15 | E | 90.6 | Very high | 86.5 | Confident | 198 Ų | 198 | 133 Ų | 133 | 93% | 0.925 | 68% | 0.681 | S | S | * | * | P | Polyproline II helix | trans | -61 | 125.3 | 173 | -62.9 | -168.7 | 166.2 | 0 | 0 | 109.7 | ||
| 16 | V | 90.4 | Very high | 88.2 | Confident | 71 Ų | 71 | 128.3 Ų | 128.3 | 43% | 0.43 | 66% | 0.66 | S | S | . | * | P | Polyproline II helix | trans | -92.6 | 137.6 | 177.1 | -68.6 | 0 | 0 | 0 | 0 | 109.4 | R14 | R14-V16 PolarHBondContact O-N 3.43Š|
| 17 | S | 92.7 | Very high | 89.8 | Confident | 64 Ų | 64 | 124.2 Ų | 124.2 | 45% | 0.448 | 65% | 0.652 | S | S | . | * | P | Polyproline II helix | trans | -55.5 | 139.2 | 173.3 | 171.9 | 0 | 0 | 0 | 0 | 110.7 | L19 I20 R21 | S17-L19 PolarHBondContact O-N 3.45Å; S17-L19 VanDerWaalsContact O-N 3.09Å; S17-L19 PolarHBondContact OG-N 3.45Å; S17-I20 PolarHBondContact O-N 2.99Å; S17-R21 PolarHBondContact O-N 2.95Å |
| 18 | P | 93.8 | Very high | 91.2 | Very high | 100 Ų | 100 | 123.9 Ų | 123.9 | 65% | 0.649 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -51.4 | -32.8 | 175.6 | -28 | 35 | 0 | 0 | 0 | 113.4 | I20 R21 T22 | P18-I20 VanDerWaalsContact C-N 3.34Å; P18-I20 PolarHBondContact O-N 2.87Å; P18-R21 PolarHBondContact O-N 2.75Å; P18-T22 WeakPolarHBondContact O-CG2 3.4Å; P18-T22 PolarHBondContact O-N 3.46Å; P18-T22 PolarHBondContact O-OG1 2.97Å |
| 19 | L | 96.1 | Very high | 92.5 | Very high | 125 Ų | 125 | 119.2 Ų | 119.2 | 65% | 0.654 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -58.5 | -43 | 176.2 | -178.5 | 67 | 0 | 0 | 0 | 112.5 | S17 R21 T22 A23 | S17-L19 PolarHBondContact O-N 3.45Å; S17-L19 VanDerWaalsContact O-N 3.09Å; S17-L19 PolarHBondContact OG-N 3.45Å; L19-R21 VanDerWaalsContact C-N 3.31Å; L19-T22 PolarHBondContact O-OG1 3.16Å; L19-A23 WeakPolarHBondContact O-CB 3.32Å; L19-A23 PolarHBondContact O-N 2.89Å |
| 20 | I | 94.6 | Very high | 93.5 | Very high | 93 Ų | 93 | 112.6 Ų | 112.6 | 48% | 0.477 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -69.6 | -37.1 | -179.2 | -62.2 | 173.7 | 0 | 0 | 0 | 109.8 | S17 P18 R24 | S17-I20 PolarHBondContact O-N 2.99Å; P18-I20 VanDerWaalsContact C-N 3.34Å; P18-I20 PolarHBondContact O-N 2.87Å; I20-R24 WeakPolarHBondContact O-CB 3.22Å; I20-R24 PolarHBondContact O-N 3.41Å |
| 21 | R | 93.8 | Very high | 94.2 | Very high | 158 Ų | 158 | 107.4 Ų | 107.4 | 60% | 0.596 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -66.9 | -46 | 178.3 | -171 | 178.4 | -84.7 | 165.2 | -6.2 | 110.9 | S17 P18 L19 R24 W25 | S17-R21 PolarHBondContact O-N 2.95Å; P18-R21 PolarHBondContact O-N 2.75Å; L19-R21 VanDerWaalsContact C-N 3.31Å; R21-R24 PolarHBondContact O-N 3.3Å; R21-W25 PolarHBondContact O-N 2.63Å |
| 22 | T | 96.6 | Very high | 94.7 | Very high | 90 Ų | 90 | 107.9 Ų | 107.9 | 55% | 0.552 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -68.1 | -40.4 | 177.1 | 57.2 | 0 | 0 | 0 | 0 | 111.9 | P18 L19 R24 W25 G26 | P18-T22 WeakPolarHBondContact O-CG2 3.4Å; P18-T22 PolarHBondContact O-N 3.46Å; P18-T22 PolarHBondContact O-OG1 2.97Å; L19-T22 PolarHBondContact O-OG1 3.16Å; T22-R24 VanDerWaalsContact C-N 3.34Å; T22-R24 PolarHBondContact O-N 3.26Å; T22-W25 PolarHBondContact O-N 3.12Å; T22-G26 PolarHBondContact O-N 2.94Å |
| 23 | A | 97.3 | Very high | 95.3 | Very high | 47 Ų | 47 | 108 Ų | 108 | 39% | 0.388 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -60.5 | -42.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | L19 G26 L27 | L19-A23 WeakPolarHBondContact O-CB 3.32Å; L19-A23 PolarHBondContact O-N 2.89Å; A23-G26 PolarHBondContact O-N 3.35Å; A23-L27 WeakPolarHBondContact O-CB 3.41Å; A23-L27 WeakPolarHBondContact O-CG 3.45Å; A23-L27 PolarHBondContact O-N 3.4Å |
| 24 | R | 96.7 | Very high | 95.8 | Very high | 159 Ų | 159 | 109 Ų | 109 | 60% | 0.6 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -58.7 | -53.2 | 176.5 | -177.1 | -176 | -60.9 | -164.7 | -0.6 | 111.5 | I20 R21 T22 G26 L27 L28 | I20-R24 WeakPolarHBondContact O-CB 3.22Å; I20-R24 PolarHBondContact O-N 3.41Å; R21-R24 PolarHBondContact O-N 3.3Å; T22-R24 VanDerWaalsContact C-N 3.34Å; T22-R24 PolarHBondContact O-N 3.26Å; R24-G26 VanDerWaalsContact C-N 3.33Å; R24-G26 PolarHBondContact O-N 2.73Å; R24-L27 PolarHBondContact O-N 2.86Å; R24-L28 HydrophobicContact CG-CD1 4.37Å; R24-L28 WeakPolarHBondContact O-CG 3.35Å; R24-L28 PolarHBondContact O-N 3.32Å |
| 25 | W | 96.8 | Very high | 96.2 | Very high | 173 Ų | 173 | 99.6 Ų | 99.6 | 66% | 0.655 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -66.9 | -35.6 | 179.9 | -73.4 | 111.2 | 0 | 0 | 0 | 112.3 | R21 T22 L28 A29 | R21-W25 PolarHBondContact O-N 2.63Å; T22-W25 PolarHBondContact O-N 3.12Å; W25-L28 HydrophobicContact CE3-CD1 4.05Å; W25-L28 HydrophobicContact CZ3-CD1 4.28Å; W25-L28 PolarHBondContact O-N 2.88Å; W25-A29 WeakPolarHBondContact O-CB 3.35Å; W25-A29 PolarHBondContact O-N 3.01Å |
| 26 | G | 97.8 | Very high | 96.6 | Very high | 40 Ų | 40 | 92.5 Ų | 92.5 | 41% | 0.412 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62.2 | -46.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | T22 A23 R24 A29 A30 | T22-G26 PolarHBondContact O-N 2.94Å; A23-G26 PolarHBondContact O-N 3.35Å; R24-G26 VanDerWaalsContact C-N 3.33Å; R24-G26 PolarHBondContact O-N 2.73Å; G26-A29 PolarHBondContact O-N 3.4Å; G26-A30 VanDerWaalsContact O-CB 3.25Å; G26-A30 WeakPolarHBondContact O-CB 3.39Å; G26-A30 PolarHBondContact O-N 3.03Å |
| 27 | L | 97.9 | Very high | 96.9 | Very high | 132 Ų | 132 | 94.5 Ų | 94.5 | 69% | 0.691 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -65.9 | -38.8 | 175.5 | -74.3 | 174.2 | 0 | 0 | 0 | 112.3 | A23 R24 G31 | A23-L27 WeakPolarHBondContact O-CB 3.41Å; A23-L27 WeakPolarHBondContact O-CG 3.45Å; A23-L27 PolarHBondContact O-N 3.4Å; R24-L27 PolarHBondContact O-N 2.86Å; L27-G31 PolarHBondContact O-N 3.37Å |
| 28 | L | 97.9 | Very high | 97.2 | Very high | 93 Ų | 93 | 97.1 Ų | 97.1 | 49% | 0.487 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -61.7 | -47.9 | 174.2 | -73.6 | 175.7 | 0 | 0 | 0 | 111.4 | R24 W25 G31 I32 | R24-L28 HydrophobicContact CG-CD1 4.37Å; R24-L28 WeakPolarHBondContact O-CG 3.35Å; R24-L28 PolarHBondContact O-N 3.32Å; W25-L28 HydrophobicContact CE3-CD1 4.05Å; W25-L28 HydrophobicContact CZ3-CD1 4.28Å; W25-L28 PolarHBondContact O-N 2.88Å; L28-G31 PolarHBondContact O-N 3.36Å; L28-I32 WeakPolarHBondContact O-CG1 3.43Å; L28-I32 PolarHBondContact O-N 3.26Å |
| 29 | A | 98.1 | Very high | 97.4 | Very high | 54 Ų | 54 | 97.7 Ų | 97.7 | 45% | 0.446 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -62.9 | -46.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | W25 G26 G31 I32 V33 | W25-A29 WeakPolarHBondContact O-CB 3.35Å; W25-A29 PolarHBondContact O-N 3.01Å; G26-A29 PolarHBondContact O-N 3.4Å; A29-G31 VanDerWaalsContact C-N 3.32Å; A29-G31 PolarHBondContact O-N 2.98Å; A29-I32 PolarHBondContact O-N 2.89Å; A29-V33 WeakPolarHBondContact O-CG2 3.47Å; A29-V33 PolarHBondContact O-N 3.42Å |
| 30 | A | 98.3 | Very high | 97.4 | Very high | 56 Ų | 56 | 99 Ų | 99 | 46% | 0.463 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -60.5 | -41.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | G26 V33 Y34 | G26-A30 VanDerWaalsContact O-CB 3.25Å; G26-A30 WeakPolarHBondContact O-CB 3.39Å; G26-A30 PolarHBondContact O-N 3.03Å; A30-V33 PolarHBondContact O-N 3.42Å; A30-Y34 VanDerWaalsContact O-CB 3.23Å; A30-Y34 WeakPolarHBondContact O-CB 3.47Å; A30-Y34 PolarHBondContact O-N 3.4Å |
| 31 | G | 98.2 | Very high | 97.5 | Very high | 41 Ų | 41 | 100.8 Ų | 100.8 | 42% | 0.423 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62 | -43.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | L27 L28 A29 G35 | L27-G31 PolarHBondContact O-N 3.37Å; L28-G31 PolarHBondContact O-N 3.36Å; A29-G31 VanDerWaalsContact C-N 3.32Å; A29-G31 PolarHBondContact O-N 2.98Å; G31-G35 PolarHBondContact O-N 3.04Å |
| 32 | I | 98.2 | Very high | 97.6 | Very high | 126 Ų | 126 | 95.9 Ų | 95.9 | 65% | 0.646 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -63.4 | -47.4 | 176.1 | -67.6 | 166.4 | 0 | 0 | 0 | 110.8 | L28 A29 G35 A36 | L28-I32 WeakPolarHBondContact O-CG1 3.43Å; L28-I32 PolarHBondContact O-N 3.26Å; A29-I32 PolarHBondContact O-N 2.89Å; I32-G35 PolarHBondContact O-N 2.92Å; I32-A36 WeakPolarHBondContact O-CB 3.49Å; I32-A36 PolarHBondContact O-N 3.34Å |
| 33 | V | 98.3 | Very high | 97.6 | Very high | 86 Ų | 86 | 94.2 Ų | 94.2 | 52% | 0.521 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.1 | -47.5 | 178.7 | 172.7 | 0 | 0 | 0 | 0 | 110.8 | A29 A30 G35 A36 L37 | A29-V33 WeakPolarHBondContact O-CG2 3.47Å; A29-V33 PolarHBondContact O-N 3.42Å; A30-V33 PolarHBondContact O-N 3.42Å; V33-G35 VanDerWaalsContact C-N 3.35Å; V33-G35 PolarHBondContact O-N 3.14Å; V33-A36 PolarHBondContact O-N 2.91Å; V33-L37 HydrophobicContact CG1-CD1 4.03Å; V33-L37 HydrophobicContact CG1-CG 4.5Å; V33-L37 WeakPolarHBondContact O-CG 3.39Å; V33-L37 PolarHBondContact O-N 3.15Å |
| 34 | Y | 98.4 | Very high | 97.5 | Very high | 150 Ų | 150 | 100 Ų | 100 | 59% | 0.588 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -59.3 | -46 | 176.4 | 175.3 | -103.5 | 0 | 0 | 0 | 111.5 | A30 A36 L37 R38 | A30-Y34 VanDerWaalsContact O-CB 3.23Å; A30-Y34 WeakPolarHBondContact O-CB 3.47Å; A30-Y34 PolarHBondContact O-N 3.4Å; Y34-A36 PolarHBondContact O-N 2.89Å; Y34-L37 PolarHBondContact O-N 3.44Å; Y34-R38 WeakPolarHBondContact O-CB 3.34Å; Y34-R38 PolarHBondContact O-N 2.98Å |
| 35 | G | 98.1 | Very high | 97.4 | Very high | 36 Ų | 36 | 99 Ų | 99 | 37% | 0.371 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -58.1 | -46.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | G31 I32 V33 R38 L39 | G31-G35 PolarHBondContact O-N 3.04Å; I32-G35 PolarHBondContact O-N 2.92Å; V33-G35 VanDerWaalsContact C-N 3.35Å; V33-G35 PolarHBondContact O-N 3.14Å; G35-R38 PolarHBondContact O-N 3.44Å; G35-L39 VanDerWaalsContact O-CB 3.27Å; G35-L39 WeakPolarHBondContact O-CB 3.36Å; G35-L39 PolarHBondContact O-N 3.45Å |
| 36 | A | 98 | Very high | 97.3 | Very high | 49 Ų | 49 | 96.3 Ų | 96.3 | 41% | 0.405 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.7 | -43.1 | 178 | 0 | 0 | 0 | 0 | 0 | 112.6 | I32 V33 Y34 K40 | I32-A36 WeakPolarHBondContact O-CB 3.49Å; I32-A36 PolarHBondContact O-N 3.34Å; V33-A36 PolarHBondContact O-N 2.91Å; Y34-A36 PolarHBondContact O-N 2.89Å; A36-K40 WeakPolarHBondContact O-CG 3.41Å; A36-K40 PolarHBondContact O-N 3.4Å; A36-K40 VanDerWaalsContact O-N 3.13Å |
| 37 | L | 98 | Very high | 97.2 | Very high | 113 Ų | 113 | 100.6 Ų | 100.6 | 59% | 0.592 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -66.4 | -43.5 | 177 | -68.9 | 175.1 | 0 | 0 | 0 | 111.5 | V33 Y34 K40 Y41 | V33-L37 HydrophobicContact CG1-CD1 4.03Å; V33-L37 HydrophobicContact CG1-CG 4.5Å; V33-L37 WeakPolarHBondContact O-CG 3.39Å; V33-L37 PolarHBondContact O-N 3.15Å; Y34-L37 PolarHBondContact O-N 3.44Å; L37-K40 PolarHBondContact O-N 3.28Å; L37-Y41 PolarHBondContact O-N 3.02Å |
| 38 | R | 97.7 | Very high | 97 | Very high | 118 Ų | 118 | 99.8 Ų | 99.8 | 45% | 0.445 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.4 | -43 | 179.4 | -175.9 | 62.8 | 176.3 | -154.5 | -0.8 | 111.6 | Y34 G35 Y41 L42 | Y34-R38 WeakPolarHBondContact O-CB 3.34Å; Y34-R38 PolarHBondContact O-N 2.98Å; G35-R38 PolarHBondContact O-N 3.44Å; R38-Y41 PolarHBondContact O-N 3.07Å; R38-L42 HydrophobicContact CG-CD1 4.13Å; R38-L42 HydrophobicContact CG-CG 4.49Å; R38-L42 WeakPolarHBondContact O-CG 3.4Å; R38-L42 PolarHBondContact O-N 2.96Å |
| 39 | L | 97.5 | Very high | 96.8 | Very high | 112 Ų | 112 | 98.8 Ų | 98.8 | 59% | 0.586 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -60.3 | -49 | 176.3 | -178.3 | 62.5 | 0 | 0 | 0 | 110.8 | G35 Y41 L42 T43 | G35-L39 VanDerWaalsContact O-CB 3.27Å; G35-L39 WeakPolarHBondContact O-CB 3.36Å; G35-L39 PolarHBondContact O-N 3.45Å; L39-Y41 VanDerWaalsContact C-N 3.3Å; L39-Y41 PolarHBondContact O-N 3.44Å; L39-L42 PolarHBondContact O-N 3.14Å; L39-T43 PolarHBondContact O-N 3.15Å; L39-T43 PolarHBondContact O-OG1 2.84Å |
| 40 | K | 96.8 | Very high | 96.6 | Very high | 154 Ų | 154 | 99 Ų | 99 | 67% | 0.67 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -56.8 | -42.8 | 176.2 | -74.9 | 178.8 | 179.7 | -176.7 | 0 | 112.4 | A36 L37 K44 | A36-K40 WeakPolarHBondContact O-CG 3.41Å; A36-K40 PolarHBondContact O-N 3.4Å; A36-K40 VanDerWaalsContact O-N 3.13Å; L37-K40 PolarHBondContact O-N 3.28Å; K40-K44 WeakPolarHBondContact O-CB 3.29Å; K40-K44 PolarHBondContact O-N 3.26Å; K40-K44 VanDerWaalsContact O-N 3.15Å |
| 41 | Y | 96.8 | Very high | 96.5 | Very high | 130 Ų | 130 | 102.1 Ų | 102.1 | 51% | 0.51 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62 | -49.5 | 176.7 | 171.5 | -94.9 | 0 | 0 | 0 | 111.9 | L37 R38 L39 K44 R45 | L37-Y41 PolarHBondContact O-N 3.02Å; R38-Y41 PolarHBondContact O-N 3.07Å; L39-Y41 VanDerWaalsContact C-N 3.3Å; L39-Y41 PolarHBondContact O-N 3.44Å; Y41-K44 PolarHBondContact O-N 3.36Å; Y41-R45 WeakPolarHBondContact O-CB 3.38Å; Y41-R45 PolarHBondContact O-N 2.84Å |
| 42 | L | 97.1 | Very high | 96.3 | Very high | 54 Ų | 54 | 106.4 Ų | 106.4 | 28% | 0.283 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.8 | -46.6 | -179.1 | -69.8 | 175.2 | 0 | 0 | 0 | 111.5 | R38 L39 K44 R45 E46 | R38-L42 HydrophobicContact CG-CD1 4.13Å; R38-L42 HydrophobicContact CG-CG 4.49Å; R38-L42 WeakPolarHBondContact O-CG 3.4Å; R38-L42 PolarHBondContact O-N 2.96Å; L39-L42 PolarHBondContact O-N 3.14Å; L42-K44 VanDerWaalsContact C-N 3.32Å; L42-K44 PolarHBondContact O-N 2.89Å; L42-R45 WeakPolarHBondContact O-CB 3.45Å; L42-R45 PolarHBondContact O-N 3.24Å; L42-R45 VanDerWaalsContact O-N 3.08Å; L42-E46 WeakPolarHBondContact O-CB 3.28Å; L42-E46 WeakPolarHBondContact O-CG 3.2Å; L42-E46 PolarHBondContact O-N 3.08Å |
| 43 | T | 96 | Very high | 96.1 | Very high | 55 Ų | 55 | 104.2 Ų | 104.2 | 34% | 0.337 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -59.7 | -40.6 | 178.1 | -55.6 | 0 | 0 | 0 | 0 | 112.3 | L39 R45 K47 | L39-T43 PolarHBondContact O-N 3.15Å; L39-T43 PolarHBondContact O-OG1 2.84Å; T43-R45 VanDerWaalsContact C-N 3.35Å; T43-K47 HydrophobicContact CG2-CD 4.39Å; T43-K47 WeakPolarHBondContact O-CB 3.35Å; T43-K47 VanDerWaalsContact O-CG 3.29Å; T43-K47 WeakPolarHBondContact O-CG 3.4Å; T43-K47 PolarHBondContact O-N 3.3Å |
| 44 | K | 95.4 | Very high | 96.1 | Very high | 170 Ų | 170 | 107.5 Ų | 107.5 | 74% | 0.739 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -65.7 | -39.9 | 176.2 | -173.2 | 176.1 | -177.7 | 177.9 | 0 | 111.5 | K40 Y41 L42 K48 | K40-K44 WeakPolarHBondContact O-CB 3.29Å; K40-K44 PolarHBondContact O-N 3.26Å; K40-K44 VanDerWaalsContact O-N 3.15Å; Y41-K44 PolarHBondContact O-N 3.36Å; L42-K44 VanDerWaalsContact C-N 3.32Å; L42-K44 PolarHBondContact O-N 2.89Å; K44-K48 PolarHBondContact O-N 3.22Å |
| 45 | R | 94.1 | Very high | 95.9 | Very high | 138 Ų | 138 | 102.5 Ų | 102.5 | 52% | 0.521 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -67 | -46.8 | 178.2 | -179.4 | 179.5 | 165.7 | -173 | -6.4 | 111.5 | Y41 L42 T43 K48 I49 | Y41-R45 WeakPolarHBondContact O-CB 3.38Å; Y41-R45 PolarHBondContact O-N 2.84Å; L42-R45 WeakPolarHBondContact O-CB 3.45Å; L42-R45 PolarHBondContact O-N 3.24Å; L42-R45 VanDerWaalsContact O-N 3.08Å; T43-R45 VanDerWaalsContact C-N 3.35Å; R45-K48 PolarHBondContact O-N 3.39Å; R45-I49 HydrophobicContact CG-CD1 4.05Å; R45-I49 WeakPolarHBondContact O-CG1 3.45Å; R45-I49 PolarHBondContact O-N 2.92Å; R45-I49 VanDerWaalsContact O-N 3.14Å |
| 46 | E | 95.2 | Very high | 95.8 | Very high | 116 Ų | 116 | 105 Ų | 105 | 54% | 0.542 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.5 | -46.2 | 179.2 | -75.5 | 172.9 | -174.5 | 0 | 0 | 111.5 | L42 K48 I49 T50 | L42-E46 WeakPolarHBondContact O-CB 3.28Å; L42-E46 WeakPolarHBondContact O-CG 3.2Å; L42-E46 PolarHBondContact O-N 3.08Å; E46-K48 VanDerWaalsContact C-N 3.27Å; E46-K48 PolarHBondContact O-N 2.9Å; E46-I49 PolarHBondContact O-N 3.41Å; E46-T50 PolarHBondContact O-N 3.45Å; E46-T50 PolarHBondContact O-OG1 2.87Å; E46-T50 VanDerWaalsContact O-OG1 3.04Å |
| 47 | K | 94.6 | Very high | 95.7 | Very high | 129 Ų | 129 | 107.8 Ų | 107.8 | 56% | 0.561 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -52.7 | -46.2 | 174.3 | -76.9 | -179.5 | 177.5 | -170.9 | 0 | 112.2 | T43 I49 T50 E51 | T43-K47 HydrophobicContact CG2-CD 4.39Å; T43-K47 WeakPolarHBondContact O-CB 3.35Å; T43-K47 VanDerWaalsContact O-CG 3.29Å; T43-K47 WeakPolarHBondContact O-CG 3.4Å; T43-K47 PolarHBondContact O-N 3.3Å; K47-I49 VanDerWaalsContact C-N 3.27Å; K47-I49 PolarHBondContact O-N 2.99Å; K47-T50 PolarHBondContact O-N 3.27Å; K47-E51 WeakPolarHBondContact O-CB 3.46Å; K47-E51 VanDerWaalsContact O-CG 3.23Å; K47-E51 WeakPolarHBondContact O-CG 3.34Å; K47-E51 PolarHBondContact O-N 3.38Å |
| 48 | K | 93.7 | Very high | 95.6 | Very high | 116 Ų | 116 | 107.8 Ų | 107.8 | 50% | 0.504 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -66.8 | -25.3 | 179.3 | -156.5 | -163.7 | -178.2 | -180 | 0 | 113.7 | K44 R45 E46 R52 | K44-K48 PolarHBondContact O-N 3.22Å; R45-K48 PolarHBondContact O-N 3.39Å; E46-K48 VanDerWaalsContact C-N 3.27Å; E46-K48 PolarHBondContact O-N 2.9Å; K48-R52 WeakPolarHBondContact O-CG 3.35Å; K48-R52 PolarHBondContact O-NH1 3.48Å; K48-R52 VanDerWaalsContact O-NH1 3.08Å |
| 49 | I | 93.7 | Very high | 95.5 | Very high | 72 Ų | 72 | 108.7 Ų | 108.7 | 37% | 0.369 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -80.2 | -52 | 175.4 | -68.2 | 167.3 | 0 | 0 | 0 | 108.3 | R45 E46 K47 E51 R52 D53 | R45-I49 HydrophobicContact CG-CD1 4.05Å; R45-I49 WeakPolarHBondContact O-CG1 3.45Å; R45-I49 PolarHBondContact O-N 2.92Å; R45-I49 VanDerWaalsContact O-N 3.14Å; E46-I49 PolarHBondContact O-N 3.41Å; K47-I49 VanDerWaalsContact C-N 3.27Å; K47-I49 PolarHBondContact O-N 2.99Å; I49-E51 VanDerWaalsContact C-N 3.31Å; I49-E51 PolarHBondContact O-N 2.85Å; I49-R52 WeakPolarHBondContact O-CB 3.3Å; I49-R52 PolarHBondContact O-N 3.33Å; I49-D53 WeakPolarHBondContact CG2-OD2 3.21Å; I49-D53 PolarHBondContact O-N 3.14Å |
| 50 | T | 94.9 | Very high | 95.5 | Very high | 59 Ų | 59 | 111.2 Ų | 111.2 | 36% | 0.362 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -56 | -40.9 | 177.9 | -55.4 | 0 | 0 | 0 | 0 | 112.9 | E46 K47 R52 D53 R54 | E46-T50 PolarHBondContact O-N 3.45Å; E46-T50 PolarHBondContact O-OG1 2.87Å; E46-T50 VanDerWaalsContact O-OG1 3.04Å; K47-T50 PolarHBondContact O-N 3.27Å; T50-R52 VanDerWaalsContact C-N 3.32Å; T50-R52 PolarHBondContact O-N 2.99Å; T50-D53 PolarHBondContact O-N 3.08Å; T50-R54 HydrophobicContact CG2-CG 4.37Å; T50-R54 WeakPolarHBondContact O-CB 3.41Å; T50-R54 VanDerWaalsContact O-CG 3.22Å; T50-R54 WeakPolarHBondContact O-CG 3.44Å; T50-R54 PolarHBondContact O-N 2.81Å |
| 51 | E | 95.2 | Very high | 95.5 | Very high | 121 Ų | 121 | 108.5 Ų | 108.5 | 57% | 0.565 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -61.5 | -39.1 | 176 | -77.2 | 165.6 | -165.2 | 0 | 0 | 112.2 | K47 I49 A55 | K47-E51 WeakPolarHBondContact O-CB 3.46Å; K47-E51 VanDerWaalsContact O-CG 3.23Å; K47-E51 WeakPolarHBondContact O-CG 3.34Å; K47-E51 PolarHBondContact O-N 3.38Å; I49-E51 VanDerWaalsContact C-N 3.31Å; I49-E51 PolarHBondContact O-N 2.85Å; E51-A55 PolarHBondContact O-N 3.33Å |
| 52 | R | 94.2 | Very high | 95.5 | Very high | 131 Ų | 131 | 108 Ų | 108 | 49% | 0.494 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -71.9 | -43.5 | 176.8 | -71.2 | -172.3 | -178.3 | 110.3 | -21.5 | 112 | K48 I49 T50 R54 A55 I56 | K48-R52 WeakPolarHBondContact O-CG 3.35Å; K48-R52 PolarHBondContact O-NH1 3.48Å; K48-R52 VanDerWaalsContact O-NH1 3.08Å; I49-R52 WeakPolarHBondContact O-CB 3.3Å; I49-R52 PolarHBondContact O-N 3.33Å; T50-R52 VanDerWaalsContact C-N 3.32Å; T50-R52 PolarHBondContact O-N 2.99Å; R52-R54 VanDerWaalsContact C-N 3.32Å; R52-R54 PolarHBondContact O-N 3.29Å; R52-A55 PolarHBondContact O-N 3.26Å; R52-I56 WeakPolarHBondContact O-CG1 3.46Å; R52-I56 PolarHBondContact O-N 3.32Å; R52-I56 VanDerWaalsContact O-N 3.08Å |
| 53 | D | 95.5 | Very high | 95.4 | Very high | 79 Ų | 79 | 110.9 Ų | 110.9 | 42% | 0.422 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.9 | -41.4 | -179.8 | -65.8 | -16.1 | 0 | 0 | 0 | 110.5 | I49 T50 I56 I57 | I49-D53 WeakPolarHBondContact CG2-OD2 3.21Å; I49-D53 PolarHBondContact O-N 3.14Å; T50-D53 PolarHBondContact O-N 3.08Å; D53-I56 PolarHBondContact O-N 3.04Å; D53-I57 WeakPolarHBondContact O-CB 3.36Å; D53-I57 WeakPolarHBondContact O-CD1 3.22Å; D53-I57 WeakPolarHBondContact O-CG1 3.41Å; D53-I57 PolarHBondContact O-N 3.2Å |
| 54 | R | 96.3 | Very high | 95.5 | Very high | 156 Ų | 156 | 115.2 Ų | 115.2 | 59% | 0.589 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -58.2 | -49.3 | 173.4 | -76.4 | 176.2 | -176.6 | -177.8 | 1.3 | 112.2 | T50 R52 I56 I57 E58 | T50-R54 HydrophobicContact CG2-CG 4.37Å; T50-R54 WeakPolarHBondContact O-CB 3.41Å; T50-R54 VanDerWaalsContact O-CG 3.22Å; T50-R54 WeakPolarHBondContact O-CG 3.44Å; T50-R54 PolarHBondContact O-N 2.81Å; R52-R54 VanDerWaalsContact C-N 3.32Å; R52-R54 PolarHBondContact O-N 3.29Å; R54-I56 PolarHBondContact O-N 3.08Å; R54-I57 PolarHBondContact O-N 2.93Å; R54-I57 VanDerWaalsContact O-N 3.14Å; R54-E58 WeakPolarHBondContact O-CB 3.46Å; R54-E58 VanDerWaalsContact O-CG 3.3Å; R54-E58 WeakPolarHBondContact O-CG 3.32Å; R54-E58 PolarHBondContact O-N 3.06Å |
| 55 | A | 95.4 | Very high | 95.5 | Very high | 45 Ų | 45 | 111.2 Ų | 111.2 | 37% | 0.372 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.2 | -32.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113 | E51 R52 K59 | E51-A55 PolarHBondContact O-N 3.33Å; R52-A55 PolarHBondContact O-N 3.26Å; A55-K59 WeakPolarHBondContact O-CG 3.43Å; A55-K59 PolarHBondContact O-N 3.4Å |
| 56 | I | 95.5 | Very high | 95.6 | Very high | 87 Ų | 87 | 110.9 Ų | 110.9 | 45% | 0.446 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -73.3 | -43.6 | 175.2 | -66.1 | 165.2 | 0 | 0 | 0 | 110.8 | R52 D53 R54 R60 | R52-I56 WeakPolarHBondContact O-CG1 3.46Å; R52-I56 PolarHBondContact O-N 3.32Å; R52-I56 VanDerWaalsContact O-N 3.08Å; D53-I56 PolarHBondContact O-N 3.04Å; R54-I56 PolarHBondContact O-N 3.08Å; I56-R60 WeakPolarHBondContact O-CG 3.34Å; I56-R60 PolarHBondContact O-N 3.03Å; I56-R60 VanDerWaalsContact O-N 3.07Å |
| 57 | I | 96.5 | Very high | 95.7 | Very high | 108 Ų | 108 | 110.9 Ų | 110.9 | 55% | 0.554 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -64.6 | -43.6 | 180 | -69.4 | 163.8 | 0 | 0 | 0 | 110.6 | D53 R54 R60 L61 | D53-I57 WeakPolarHBondContact O-CB 3.36Å; D53-I57 WeakPolarHBondContact O-CD1 3.22Å; D53-I57 WeakPolarHBondContact O-CG1 3.41Å; D53-I57 PolarHBondContact O-N 3.2Å; R54-I57 PolarHBondContact O-N 2.93Å; R54-I57 VanDerWaalsContact O-N 3.14Å; I57-R60 PolarHBondContact O-N 2.89Å; I57-L61 VanDerWaalsContact O-CB 3.32Å; I57-L61 WeakPolarHBondContact O-CB 3.37Å; I57-L61 PolarHBondContact O-N 3.15Å |
| 58 | E | 96.6 | Very high | 95.8 | Very high | 114 Ų | 114 | 109.7 Ų | 109.7 | 53% | 0.533 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -58.8 | -49.6 | 178 | -75 | 166.6 | -171.7 | 0 | 0 | 111.1 | R54 R60 L61 E62 | R54-E58 WeakPolarHBondContact O-CB 3.46Å; R54-E58 VanDerWaalsContact O-CG 3.3Å; R54-E58 WeakPolarHBondContact O-CG 3.32Å; R54-E58 PolarHBondContact O-N 3.06Å; E58-R60 PolarHBondContact O-N 3.29Å; E58-L61 WeakPolarHBondContact O-CB 3.45Å; E58-L61 PolarHBondContact O-N 3.01Å; E58-L61 VanDerWaalsContact O-N 3.15Å; E58-E62 WeakPolarHBondContact O-CG 3.41Å; E58-E62 PolarHBondContact O-N 2.86Å |
| 59 | K | 95.7 | Very high | 95.9 | Very high | 137 Ų | 137 | 106.4 Ų | 106.4 | 60% | 0.596 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -58.6 | -44.7 | 175.4 | -72.9 | -179 | 178.4 | -169 | 0 | 113 | A55 L61 E62 E63 | A55-K59 WeakPolarHBondContact O-CG 3.43Å; A55-K59 PolarHBondContact O-N 3.4Å; K59-L61 VanDerWaalsContact C-N 3.29Å; K59-L61 PolarHBondContact O-N 3.4Å; K59-E62 PolarHBondContact O-N 3.32Å; K59-E63 WeakPolarHBondContact O-CG 3.49Å; K59-E63 PolarHBondContact O-N 3.02Å |
| 60 | R | 96.2 | Very high | 96 | Very high | 165 Ų | 165 | 107.3 Ų | 107.3 | 62% | 0.623 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -65.8 | -34.2 | 178 | -73 | 179.1 | -175.1 | -86 | 1.8 | 112.2 | I56 I57 E58 Y64 | I56-R60 WeakPolarHBondContact O-CG 3.34Å; I56-R60 PolarHBondContact O-N 3.03Å; I56-R60 VanDerWaalsContact O-N 3.07Å; I57-R60 PolarHBondContact O-N 2.89Å; E58-R60 PolarHBondContact O-N 3.29Å; R60-Y64 WeakPolarHBondContact O-CB 3.48Å; R60-Y64 PolarHBondContact O-N 3.33Å |
| 61 | L | 97.3 | Very high | 96.1 | Very high | 96 Ų | 96 | 110.9 Ų | 110.9 | 50% | 0.503 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -69 | -41.2 | 177.4 | -178.4 | 62.6 | 0 | 0 | 0 | 110.9 | I57 E58 K59 Y64 N65 | I57-L61 VanDerWaalsContact O-CB 3.32Å; I57-L61 WeakPolarHBondContact O-CB 3.37Å; I57-L61 PolarHBondContact O-N 3.15Å; E58-L61 WeakPolarHBondContact O-CB 3.45Å; E58-L61 PolarHBondContact O-N 3.01Å; E58-L61 VanDerWaalsContact O-N 3.15Å; K59-L61 VanDerWaalsContact C-N 3.29Å; K59-L61 PolarHBondContact O-N 3.4Å; L61-Y64 PolarHBondContact O-N 3.46Å; L61-N65 WeakPolarHBondContact O-CB 3.5Å; L61-N65 PolarHBondContact O-N 3.46Å; L61-N65 PolarHBondContact O-ND2 2.83Å; L61-N65 VanDerWaalsContact O-ND2 3.15Å |
| 62 | E | 96.6 | Very high | 96.1 | Very high | 121 Ų | 121 | 106.9 Ų | 106.9 | 57% | 0.565 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -59.1 | -53.8 | 172.6 | -70.6 | 171.3 | 177.9 | 0 | 0 | 111 | E58 K59 Y64 N65 E66 | E58-E62 WeakPolarHBondContact O-CG 3.41Å; E58-E62 PolarHBondContact O-N 2.86Å; K59-E62 PolarHBondContact O-N 3.32Å; E62-Y64 VanDerWaalsContact C-N 3.32Å; E62-Y64 PolarHBondContact O-N 2.84Å; E62-N65 PolarHBondContact O-N 3.33Å; E62-N65 VanDerWaalsContact O-N 3.14Å; E62-E66 WeakPolarHBondContact O-CG 3.23Å; E62-E66 PolarHBondContact O-N 3.13Å |
| 63 | E | 96 | Very high | 96 | Very high | 114 Ų | 114 | 106 Ų | 106 | 53% | 0.533 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -56.3 | -44.3 | 176.7 | -71 | 171 | -172.4 | 0 | 0 | 112.1 | K59 E66 L67 | K59-E63 WeakPolarHBondContact O-CG 3.49Å; K59-E63 PolarHBondContact O-N 3.02Å; E63-E66 PolarHBondContact O-N 3.43Å; E63-L67 VanDerWaalsContact O-CG 3.29Å; E63-L67 WeakPolarHBondContact O-CG 3.44Å; E63-L67 PolarHBondContact O-N 3Å |
| 64 | Y | 96.2 | Very high | 96 | Very high | 145 Ų | 145 | 108.5 Ų | 108.5 | 57% | 0.569 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63 | -42.7 | 177.9 | 178.1 | -95.2 | 0 | 0 | 0 | 112 | R60 L61 E62 L67 H68 | R60-Y64 WeakPolarHBondContact O-CB 3.48Å; R60-Y64 PolarHBondContact O-N 3.33Å; L61-Y64 PolarHBondContact O-N 3.46Å; E62-Y64 VanDerWaalsContact C-N 3.32Å; E62-Y64 PolarHBondContact O-N 2.84Å; Y64-L67 PolarHBondContact O-N 2.84Å; Y64-H68 VanDerWaalsContact O-CB 3.28Å; Y64-H68 WeakPolarHBondContact O-CB 3.36Å; Y64-H68 PolarHBondContact O-N 2.83Å |
| 65 | N | 96.9 | Very high | 95.8 | Very high | 86 Ų | 86 | 103.4 Ų | 103.4 | 46% | 0.46 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66.2 | -40.2 | 179.2 | -71.8 | -23.1 | 0 | 0 | 0 | 111.8 | L61 E62 H68 A69 | L61-N65 WeakPolarHBondContact O-CB 3.5Å; L61-N65 PolarHBondContact O-N 3.46Å; L61-N65 PolarHBondContact O-ND2 2.83Å; L61-N65 VanDerWaalsContact O-ND2 3.15Å; E62-N65 PolarHBondContact O-N 3.33Å; E62-N65 VanDerWaalsContact O-N 3.14Å; N65-H68 PolarHBondContact O-N 3.27Å; N65-A69 WeakPolarHBondContact O-CB 3.5Å; N65-A69 PolarHBondContact O-N 3.42Å |
| 66 | E | 96.3 | Very high | 95.6 | Very high | 132 Ų | 132 | 105.9 Ų | 105.9 | 62% | 0.617 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -61.7 | -48.6 | 174.7 | -71.3 | 179.5 | 177.3 | 0 | 0 | 111.4 | E62 E63 H68 A69 L70 | E62-E66 WeakPolarHBondContact O-CG 3.23Å; E62-E66 PolarHBondContact O-N 3.13Å; E63-E66 PolarHBondContact O-N 3.43Å; E66-H68 VanDerWaalsContact C-N 3.32Å; E66-H68 PolarHBondContact O-N 3.04Å; E66-A69 PolarHBondContact O-N 3.35Å; E66-L70 WeakPolarHBondContact O-CG 3.23Å; E66-L70 PolarHBondContact O-N 3.41Å |
| 67 | L | 96.3 | Very high | 95.4 | Very high | 115 Ų | 115 | 106 Ų | 106 | 60% | 0.602 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -61.2 | -41.2 | 176.8 | -70 | 174.4 | 0 | 0 | 0 | 112 | E63 Y64 L70 Q71 | E63-L67 VanDerWaalsContact O-CG 3.29Å; E63-L67 WeakPolarHBondContact O-CG 3.44Å; E63-L67 PolarHBondContact O-N 3Å; Y64-L67 PolarHBondContact O-N 2.84Å; L67-L70 PolarHBondContact O-N 2.86Å; L67-Q71 WeakPolarHBondContact O-CB 3.21Å; L67-Q71 PolarHBondContact O-N 2.93Å |
| 68 | H | 96.5 | Very high | 95.2 | Very high | 104 Ų | 104 | 107.2 Ų | 107.2 | 48% | 0.481 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.2 | -40.8 | 177.1 | -174.2 | -86.9 | 0 | 0 | 0 | 111.8 | Y64 N65 E66 Q71 A72 | Y64-H68 VanDerWaalsContact O-CB 3.28Å; Y64-H68 WeakPolarHBondContact O-CB 3.36Å; Y64-H68 PolarHBondContact O-N 2.83Å; N65-H68 PolarHBondContact O-N 3.27Å; E66-H68 VanDerWaalsContact C-N 3.32Å; E66-H68 PolarHBondContact O-N 3.04Å; H68-Q71 PolarHBondContact O-N 3.31Å; H68-A72 WeakPolarHBondContact O-CB 3.29Å; H68-A72 PolarHBondContact O-N 3.49Å |
| 69 | A | 96.2 | Very high | 94.9 | Very high | 48 Ų | 48 | 106.9 Ų | 106.9 | 40% | 0.397 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62.8 | -42.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | N65 E66 A72 Q73 | N65-A69 WeakPolarHBondContact O-CB 3.5Å; N65-A69 PolarHBondContact O-N 3.42Å; E66-A69 PolarHBondContact O-N 3.35Å; A69-A72 PolarHBondContact O-N 2.87Å; A69-Q73 WeakPolarHBondContact O-CG 3.39Å; A69-Q73 PolarHBondContact O-N 3.38Å |
| 70 | L | 96.2 | Very high | 94.7 | Very high | 90 Ų | 90 | 101.4 Ų | 101.4 | 47% | 0.471 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.5 | -40.8 | 174.7 | -68.9 | 174.4 | 0 | 0 | 0 | 112 | E66 L67 Q73 K74 | E66-L70 WeakPolarHBondContact O-CG 3.23Å; E66-L70 PolarHBondContact O-N 3.41Å; L67-L70 PolarHBondContact O-N 2.86Å; L70-Q73 PolarHBondContact O-N 2.89Å; L70-K74 WeakPolarHBondContact O-CG 3.25Å; L70-K74 PolarHBondContact O-N 2.98Å |
| 71 | Q | 96.1 | Very high | 94.4 | Very high | 134 Ų | 134 | 101.2 Ų | 101.2 | 63% | 0.626 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -65.3 | -41.1 | 176.3 | -174.9 | 175 | -2.3 | 0 | 0 | 111.4 | L67 H68 K74 S75 | L67-Q71 WeakPolarHBondContact O-CB 3.21Å; L67-Q71 PolarHBondContact O-N 2.93Å; H68-Q71 PolarHBondContact O-N 3.31Å; Q71-K74 PolarHBondContact O-N 3Å; Q71-S75 WeakPolarHBondContact O-CB 3.41Å; Q71-S75 PolarHBondContact O-N 3.43Å; Q71-S75 PolarHBondContact O-OG 2.9Å |
| 72 | A | 95.1 | Very high | 94.1 | Very high | 37 Ų | 37 | 100.7 Ų | 100.7 | 31% | 0.306 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -59.3 | -47.2 | 175 | 0 | 0 | 0 | 0 | 0 | 111.1 | H68 A69 S75 L76 | H68-A72 WeakPolarHBondContact O-CB 3.29Å; H68-A72 PolarHBondContact O-N 3.49Å; A69-A72 PolarHBondContact O-N 2.87Å; A72-S75 PolarHBondContact O-N 3.41Å; A72-S75 PolarHBondContact O-OG 3.01Å; A72-L76 WeakPolarHBondContact O-CG 3.27Å; A72-L76 PolarHBondContact O-N 3.44Å |
| 73 | Q | 93.6 | Very high | 93.9 | Very high | 112 Ų | 112 | 99.3 Ų | 99.3 | 52% | 0.523 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.3 | -48.3 | 175.7 | -71.5 | 175.4 | 7.4 | 0 | 0 | 112.3 | A69 L70 S75 L76 E77 | A69-Q73 WeakPolarHBondContact O-CG 3.39Å; A69-Q73 PolarHBondContact O-N 3.38Å; L70-Q73 PolarHBondContact O-N 2.89Å; Q73-S75 VanDerWaalsContact C-N 3.33Å; Q73-S75 PolarHBondContact O-N 3.5Å; Q73-L76 WeakPolarHBondContact O-CB 3.34Å; Q73-L76 PolarHBondContact O-N 3.42Å; Q73-L76 VanDerWaalsContact O-N 3.16Å; Q73-E77 WeakPolarHBondContact O-CG 3.34Å; Q73-E77 PolarHBondContact O-N 3.38Å |
| 74 | K | 94.8 | Very high | 93.2 | Very high | 132 Ų | 132 | 97.1 Ų | 97.1 | 57% | 0.574 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -59.5 | -42.7 | 176.9 | -72.6 | 177.1 | -179.1 | 179.6 | 0 | 112.4 | L70 Q71 L76 E77 E78 | L70-K74 WeakPolarHBondContact O-CG 3.25Å; L70-K74 PolarHBondContact O-N 2.98Å; Q71-K74 PolarHBondContact O-N 3Å; K74-L76 VanDerWaalsContact C-N 3.32Å; K74-L76 PolarHBondContact O-N 2.98Å; K74-E77 PolarHBondContact O-N 3.42Å; K74-E78 WeakPolarHBondContact O-CG 3.15Å; K74-E78 PolarHBondContact O-N 3.09Å |
| 75 | S | 92.6 | Very high | 92.6 | Very high | 50 Ų | 50 | 94.2 Ų | 94.2 | 35% | 0.35 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.1 | -37.8 | 177.5 | 73.1 | 0 | 0 | 0 | 0 | 112 | Q71 A72 Q73 E78 L79 | Q71-S75 WeakPolarHBondContact O-CB 3.41Å; Q71-S75 PolarHBondContact O-N 3.43Å; Q71-S75 PolarHBondContact O-OG 2.9Å; A72-S75 PolarHBondContact O-N 3.41Å; A72-S75 PolarHBondContact O-OG 3.01Å; Q73-S75 VanDerWaalsContact C-N 3.33Å; Q73-S75 PolarHBondContact O-N 3.5Å; S75-E78 PolarHBondContact O-N 3.24Å; S75-L79 WeakPolarHBondContact O-CB 3.48Å; S75-L79 WeakPolarHBondContact O-CG 3.35Å; S75-L79 PolarHBondContact O-N 2.8Å |
| 76 | L | 91.2 | Very high | 91.6 | Very high | 97 Ų | 97 | 94.3 Ų | 94.3 | 51% | 0.508 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -66.1 | -40.9 | 174.8 | -72.4 | 171.9 | 0 | 0 | 0 | 111.5 | A72 Q73 K74 L79 S80 L87 | A72-L76 WeakPolarHBondContact O-CG 3.27Å; A72-L76 PolarHBondContact O-N 3.44Å; Q73-L76 WeakPolarHBondContact O-CB 3.34Å; Q73-L76 PolarHBondContact O-N 3.42Å; Q73-L76 VanDerWaalsContact O-N 3.16Å; K74-L76 VanDerWaalsContact C-N 3.32Å; K74-L76 PolarHBondContact O-N 2.98Å; L76-L79 PolarHBondContact O-N 2.93Å; L76-S80 WeakPolarHBondContact O-CB 3.33Å; L76-S80 PolarHBondContact O-N 3.38Å; L76-L87 HydrophobicContact CB-CD2 4.33Å |
| 77 | E | 91.2 | Very high | 90.2 | Very high | 90 Ų | 90 | 92.9 Ų | 92.9 | 42% | 0.421 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.1 | -42.6 | 174.2 | -71.9 | 179.2 | -164.5 | 0 | 0 | 113 | Q73 K74 S80 K81 L87 | Q73-E77 WeakPolarHBondContact O-CG 3.34Å; Q73-E77 PolarHBondContact O-N 3.38Å; K74-E77 PolarHBondContact O-N 3.42Å; E77-S80 PolarHBondContact O-N 3.03Å; E77-K81 VanDerWaalsContact O-CG 3.32Å; E77-K81 WeakPolarHBondContact O-CG 3.42Å; E77-K81 PolarHBondContact O-N 3.37Å; E77-L87 HydrophobicContact CB-CD1 4.41Å; E77-L87 HydrophobicContact CG-CD1 3.81Å |
| 78 | E | 92.4 | Very high | 88.4 | Confident | 133 Ų | 133 | 94.6 Ų | 94.6 | 62% | 0.621 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -64.2 | -43.8 | 176.2 | -72.8 | 172.7 | -176 | 0 | 0 | 111.6 | K74 S75 K81 A82 | K74-E78 WeakPolarHBondContact O-CG 3.15Å; K74-E78 PolarHBondContact O-N 3.09Å; S75-E78 PolarHBondContact O-N 3.24Å; E78-K81 PolarHBondContact O-N 3.3Å; E78-A82 WeakPolarHBondContact O-CB 3.45Å; E78-A82 PolarHBondContact O-N 3.26Å |
| 79 | L | 90.2 | Very high | 86.1 | Confident | 106 Ų | 106 | 101.5 Ų | 101.5 | 56% | 0.555 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -65.3 | -39.5 | 176.1 | -70.2 | 172.4 | 0 | 0 | 0 | 112.4 | S75 L76 A82 T83 | S75-L79 WeakPolarHBondContact O-CB 3.48Å; S75-L79 WeakPolarHBondContact O-CG 3.35Å; S75-L79 PolarHBondContact O-N 2.8Å; L76-L79 PolarHBondContact O-N 2.93Å; L79-A82 PolarHBondContact O-N 3.21Å; L79-T83 WeakPolarHBondContact O-CB 3.4Å; L79-T83 WeakPolarHBondContact O-CG2 3.37Å; L79-T83 PolarHBondContact O-N 2.9Å; L79-T83 PolarHBondContact O-OG1 3.22Å |
| 80 | S | 90.8 | Very high | 85.6 | Confident | 23 Ų | 23 | 104.2 Ų | 104.2 | 16% | 0.161 | 57% | 0.568 | C | S | . | * | H | α-helix | trans | -61.4 | -44.9 | 174.7 | 168.7 | 0 | 0 | 0 | 0 | 111.5 | L76 E77 A82 T83 G84 V85 | L76-S80 WeakPolarHBondContact O-CB 3.33Å; L76-S80 PolarHBondContact O-N 3.38Å; E77-S80 PolarHBondContact O-N 3.03Å; S80-A82 VanDerWaalsContact C-N 3.32Å; S80-A82 PolarHBondContact O-N 2.82Å; S80-T83 PolarHBondContact O-N 3.29Å; S80-T83 PolarHBondContact O-OG1 3.18Å; S80-G84 PolarHBondContact O-N 2.86Å; S80-V85 WeakPolarHBondContact CB-O 3.2Å; S80-V85 PolarHBondContact OG-O 3.5Å |
| 81 | K | 90.1 | Very high | 85.1 | Confident | 161 Ų | 161 | 104.9 Ų | 104.9 | 70% | 0.7 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -62.3 | -38.1 | 175.5 | -72.2 | 169.9 | -173.3 | 166.8 | 0 | 112.3 | E77 E78 | E77-K81 VanDerWaalsContact O-CG 3.32Å; E77-K81 WeakPolarHBondContact O-CG 3.42Å; E77-K81 PolarHBondContact O-N 3.37Å; E78-K81 PolarHBondContact O-N 3.3Å |
| 82 | A | 92 | Very high | 84.5 | Confident | 85 Ų | 85 | 103.3 Ų | 103.3 | 70% | 0.702 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -73.6 | -34 | 179 | 0 | 0 | 0 | 0 | 0 | 113.5 | E78 L79 S80 | E78-A82 WeakPolarHBondContact O-CB 3.45Å; E78-A82 PolarHBondContact O-N 3.26Å; L79-A82 PolarHBondContact O-N 3.21Å; S80-A82 VanDerWaalsContact C-N 3.32Å; S80-A82 PolarHBondContact O-N 2.82Å |
| 83 | T | 90.7 | Very high | 83.9 | Confident | 91 Ų | 91 | 107.2 Ų | 107.2 | 56% | 0.558 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -94.1 | -14.2 | -176.2 | 56 | 0 | 0 | 0 | 0 | 113.9 | L79 S80 V85 | L79-T83 WeakPolarHBondContact O-CB 3.4Å; L79-T83 WeakPolarHBondContact O-CG2 3.37Å; L79-T83 PolarHBondContact O-N 2.9Å; L79-T83 PolarHBondContact O-OG1 3.22Å; S80-T83 PolarHBondContact O-N 3.29Å; S80-T83 PolarHBondContact O-OG1 3.18Å; T83-V85 PolarHBondContact O-N 3.12Å |
| 84 | G | 81.4 | Confident | 83.2 | Confident | 68 Ų | 68 | 106.9 Ų | 106.9 | 70% | 0.701 | 59% | 0.59 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 71.2 | 10.4 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114 | S80 | S80-G84 PolarHBondContact O-N 2.86Š|
| 85 | V | 83.9 | Confident | 82.5 | Confident | 84 Ų | 84 | 105.2 Ų | 105.2 | 51% | 0.509 | 59% | 0.591 | S | S | . | * | trans | -89.4 | 123.9 | 178.4 | -178.2 | 0 | 0 | 0 | 0 | 109.2 | S80 T83 | S80-V85 WeakPolarHBondContact CB-O 3.2Å; S80-V85 PolarHBondContact OG-O 3.5Å; T83-V85 PolarHBondContact O-N 3.12Å | ||
| 86 | P | 76.9 | Confident | 81.8 | Confident | 88 Ų | 88 | 109.1 Ų | 109.1 | 57% | 0.571 | 61% | 0.608 | S | S | * | * | trans | -68.3 | 140.3 | 178.5 | 28.2 | -34 | 0 | 0 | 0 | 111.5 | N88 | P86-N88 PolarHBondContact O-N 2.9Å; P86-N88 VanDerWaalsContact O-N 3.12Å | ||
| 87 | L | 66.6 | Low | 81 | Confident | 102 Ų | 102 | 110.1 Ų | 110.1 | 53% | 0.534 | 62% | 0.616 | S | S | . | * | S | Bend | trans | -71.1 | 2.4 | -180 | -75.2 | 168.5 | 0 | 0 | 0 | 115.1 | L76 E77 | L76-L87 HydrophobicContact CB-CD2 4.33Å; E77-L87 HydrophobicContact CB-CD1 4.41Å; E77-L87 HydrophobicContact CG-CD1 3.81Å |
| 88 | N | 59.2 | Low | 80.2 | Confident | 152 Ų | 152 | 111.8 Ų | 111.8 | 81% | 0.813 | 63% | 0.632 | S | S | * | * | trans | -112.7 | 97.9 | 176.7 | -79.4 | -4.5 | 0 | 0 | 0 | 109.9 | P86 | P86-N88 PolarHBondContact O-N 2.9Å; P86-N88 VanDerWaalsContact O-N 3.12Å | ||
| 89 | Q | 48.1 | Very low | 79.1 | Confident | 248 Ų | 248 | 109.8 Ų | 109.8 | 100% | 1.159 | 63% | 0.633 | S | S | * | * | trans | -131.7 | 0 | 154 | -75.8 | -167.8 | -3.1 | 0 | 0 | 109 |
Retrieved 89 of 89 residues in 16.5 ms
(Link to these results)