| 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 | 41.7 | Very low | 51 | Low | 251 Ų | 251 | 116.4 Ų | 116.4 | 100% | 1.236 | 69% | 0.688 | S | S | * | * | 0 | 96.1 | 0 | -88.5 | 159.3 | 156.5 | 0 | 0 | 107.7 | |||||
| 2 | A | 49.3 | Very low | 51.6 | Low | 89 Ų | 89 | 116.5 Ų | 116.5 | 74% | 0.736 | 68% | 0.683 | S | S | * | * | trans | -77 | 143.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | L4 | A2-L4 PolarHBondContact O-N 3.46Å; A2-L4 VanDerWaalsContact O-N 3.14Å | ||
| 3 | P | 49.9 | Very low | 52.1 | Low | 106 Ų | 106 | 115 Ų | 115 | 69% | 0.688 | 67% | 0.67 | S | S | * | * | trans | -75.2 | 109.3 | -170.2 | 30.3 | -31.6 | 0 | 0 | 0 | 110.1 | G5 | P3-G5 PolarHBondContact O-N 2.94Š| ||
| 4 | L | 56.6 | Low | 52.6 | Low | 158 Ų | 158 | 114.5 Ų | 114.5 | 83% | 0.827 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.9 | 23.3 | 172.3 | -69.9 | 165.4 | 0 | 0 | 0 | 113.3 | A2 | A2-L4 PolarHBondContact O-N 3.46Å; A2-L4 VanDerWaalsContact O-N 3.14Å |
| 5 | G | 46.6 | Very low | 53.5 | Low | 62 Ų | 62 | 114.1 Ų | 114.1 | 64% | 0.639 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.2 | -8.2 | -170 | 0 | 0 | 0 | 0 | 0 | 116.2 | P3 | P3-G5 PolarHBondContact O-N 2.94Š|
| 6 | F | 53.3 | Low | 54.3 | Low | 175 Ų | 175 | 118.7 Ų | 118.7 | 77% | 0.768 | 66% | 0.66 | S | S | * | * | S | Bend | trans | -119.3 | 1.9 | -178 | -76.1 | -81.2 | 0 | 0 | 0 | 114.7 | ||
| 7 | A | 52.3 | Low | 54.9 | Low | 61 Ų | 61 | 118.3 Ų | 118.3 | 50% | 0.504 | 65% | 0.652 | S | S | . | * | S | Bend | trans | -112.9 | -7.2 | -176.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||
| 8 | F | 52.3 | Low | 56 | Low | 159 Ų | 159 | 115.8 Ų | 115.8 | 70% | 0.697 | 64% | 0.644 | S | S | * | * | S | Bend | trans | -101.6 | -13.9 | 177.1 | -87 | -82.4 | 0 | 0 | 0 | 114 | ||
| 9 | G | 50 | Low | 57.1 | Low | 48 Ų | 48 | 112.5 Ų | 112.5 | 50% | 0.495 | 63% | 0.634 | S | S | . | * | S | Bend | trans | -86.9 | -21 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||
| 10 | T | 53.5 | Low | 58.4 | Low | 73 Ų | 73 | 109.8 Ų | 109.8 | 45% | 0.448 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -84.7 | -37.7 | -173.8 | 50.9 | 0 | 0 | 0 | 0 | 113.2 | L14 | T10-L14 WeakPolarHBondContact O-CB 3.21Å; T10-L14 WeakPolarHBondContact O-CD1 3.13Å; T10-L14 PolarHBondContact O-N 2.91Å |
| 11 | D | 55.8 | Low | 59.6 | Low | 98 Ų | 98 | 112.6 Ų | 112.6 | 52% | 0.524 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -69 | -41.3 | -176.4 | -71.2 | -42.7 | 0 | 0 | 0 | 112.4 | D13 L14 D15 | D11-D13 PolarHBondContact O-N 2.95Å; D11-L14 PolarHBondContact O-N 2.79Å; D11-D15 WeakPolarHBondContact O-CB 3.16Å; D11-D15 PolarHBondContact O-N 3.49Å |
| 12 | N | 57.8 | Low | 61.7 | Low | 118 Ų | 118 | 103.5 Ų | 103.5 | 63% | 0.631 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -66.4 | -34.6 | 178.5 | -77.6 | -62.9 | 0 | 0 | 0 | 113.2 | R16 | N12-R16 WeakPolarHBondContact O-CB 3.4Å; N12-R16 PolarHBondContact O-N 2.97Å; N12-R16 VanDerWaalsContact O-N 3.08Å |
| 13 | D | 58.3 | Low | 63.6 | Low | 97 Ų | 97 | 104 Ų | 104 | 52% | 0.519 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -74.8 | -39.9 | 175.4 | -85.5 | -47.3 | 0 | 0 | 0 | 111.1 | D11 R16 E17 | D11-D13 PolarHBondContact O-N 2.95Å; D13-R16 PolarHBondContact O-N 3.37Å; D13-E17 WeakPolarHBondContact O-CB 3.16Å; D13-E17 VanDerWaalsContact O-CG 3.31Å; D13-E17 WeakPolarHBondContact O-CG 3.39Å; D13-E17 PolarHBondContact O-N 3.44Å |
| 14 | L | 59.4 | Low | 65.5 | Low | 108 Ų | 108 | 104 Ų | 104 | 57% | 0.565 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -63.3 | -42.5 | 173.6 | -98.6 | 134.6 | 0 | 0 | 0 | 112.7 | T10 D11 R16 E17 S18 | T10-L14 WeakPolarHBondContact O-CB 3.21Å; T10-L14 WeakPolarHBondContact O-CD1 3.13Å; T10-L14 PolarHBondContact O-N 2.91Å; D11-L14 PolarHBondContact O-N 2.79Å; L14-R16 VanDerWaalsContact C-N 3.31Å; L14-E17 PolarHBondContact O-N 3.44Å; L14-S18 WeakPolarHBondContact O-CB 3.45Å; L14-S18 PolarHBondContact O-N 3.35Å |
| 15 | D | 65.7 | Low | 67.1 | Low | 109 Ų | 109 | 97.8 Ų | 97.8 | 58% | 0.583 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -65.5 | -36.5 | 175 | -80.8 | -44.8 | 0 | 0 | 0 | 111.4 | D11 A19 | D11-D15 WeakPolarHBondContact O-CB 3.16Å; D11-D15 PolarHBondContact O-N 3.49Å; D15-A19 VanDerWaalsContact O-CB 3.25Å; D15-A19 WeakPolarHBondContact O-CB 3.19Å; D15-A19 PolarHBondContact O-N 3.43Å |
| 16 | R | 66.3 | Low | 69.2 | Low | 187 Ų | 187 | 101 Ų | 101 | 71% | 0.706 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -70.9 | -41.8 | 177.1 | -173.6 | 175.7 | -176.5 | 176.2 | 0.9 | 112.3 | N12 D13 L14 A20 | N12-R16 WeakPolarHBondContact O-CB 3.4Å; N12-R16 PolarHBondContact O-N 2.97Å; N12-R16 VanDerWaalsContact O-N 3.08Å; D13-R16 PolarHBondContact O-N 3.37Å; L14-R16 VanDerWaalsContact C-N 3.31Å; R16-A20 WeakPolarHBondContact O-CB 3.25Å; R16-A20 PolarHBondContact O-N 3.41Å |
| 17 | E | 65.5 | Low | 71.1 | Confident | 112 Ų | 112 | 97.8 Ų | 97.8 | 52% | 0.523 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -65.2 | -44.9 | 173.2 | -73 | -175.6 | 147.3 | 0 | 0 | 110.8 | D13 L14 A19 A20 Y21 | D13-E17 WeakPolarHBondContact O-CB 3.16Å; D13-E17 VanDerWaalsContact O-CG 3.31Å; D13-E17 WeakPolarHBondContact O-CG 3.39Å; D13-E17 PolarHBondContact O-N 3.44Å; L14-E17 PolarHBondContact O-N 3.44Å; E17-A19 PolarHBondContact O-N 2.83Å; E17-A20 WeakPolarHBondContact O-CB 3.4Å; E17-A20 PolarHBondContact O-N 3.12Å; E17-A20 VanDerWaalsContact O-N 3.12Å; E17-Y21 HydrophobicContact CB-CE2 4.24Å; E17-Y21 WeakPolarHBondContact O-CD2 3.47Å; E17-Y21 PolarHBondContact O-N 3.46Å |
| 18 | S | 73.4 | Confident | 73.1 | Confident | 73 Ų | 73 | 99.3 Ų | 99.3 | 51% | 0.51 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -58.3 | -46.1 | 175.1 | -175.4 | 0 | 0 | 0 | 0 | 112 | L14 A20 Y21 A22 | L14-S18 WeakPolarHBondContact O-CB 3.45Å; L14-S18 PolarHBondContact O-N 3.35Å; S18-A20 VanDerWaalsContact C-N 3.33Å; S18-A20 PolarHBondContact O-N 2.92Å; S18-Y21 PolarHBondContact O-N 2.62Å; S18-A22 PolarHBondContact O-N 2.69Å |
| 19 | A | 78.3 | Confident | 75.2 | Confident | 53 Ų | 53 | 96.9 Ų | 96.9 | 44% | 0.438 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -61.8 | -39.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | D15 E17 A22 V23 | D15-A19 VanDerWaalsContact O-CB 3.25Å; D15-A19 WeakPolarHBondContact O-CB 3.19Å; D15-A19 PolarHBondContact O-N 3.43Å; E17-A19 PolarHBondContact O-N 2.83Å; A19-A22 PolarHBondContact O-N 2.73Å; A19-V23 VanDerWaalsContact O-CG2 3.29Å; A19-V23 WeakPolarHBondContact O-CG2 3.47Å; A19-V23 PolarHBondContact O-N 2.94Å |
| 20 | A | 81.7 | Confident | 77.3 | Confident | 59 Ų | 59 | 99 Ų | 99 | 49% | 0.488 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63.5 | -42.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112 | R16 E17 S18 V23 L24 | R16-A20 WeakPolarHBondContact O-CB 3.25Å; R16-A20 PolarHBondContact O-N 3.41Å; E17-A20 WeakPolarHBondContact O-CB 3.4Å; E17-A20 PolarHBondContact O-N 3.12Å; E17-A20 VanDerWaalsContact O-N 3.12Å; S18-A20 VanDerWaalsContact C-N 3.33Å; S18-A20 PolarHBondContact O-N 2.92Å; A20-V23 PolarHBondContact O-N 2.81Å; A20-L24 WeakPolarHBondContact O-CB 3.47Å; A20-L24 PolarHBondContact O-N 3.4Å |
| 21 | Y | 83.7 | Confident | 79.3 | Confident | 168 Ų | 168 | 100.1 Ų | 100.1 | 66% | 0.659 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -65.4 | -39 | 174.8 | -68.4 | -61.1 | 0 | 0 | 0 | 112.3 | E17 S18 L24 G25 | E17-Y21 HydrophobicContact CB-CE2 4.24Å; E17-Y21 WeakPolarHBondContact O-CD2 3.47Å; E17-Y21 PolarHBondContact O-N 3.46Å; S18-Y21 PolarHBondContact O-N 2.62Å; Y21-L24 PolarHBondContact O-N 2.89Å; Y21-G25 PolarHBondContact O-N 3.05Å |
| 22 | A | 85.7 | Confident | 81.2 | Confident | 61 Ų | 61 | 101 Ų | 101 | 50% | 0.504 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -63 | -44.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | S18 A19 G25 M26 | S18-A22 PolarHBondContact O-N 2.69Å; A19-A22 PolarHBondContact O-N 2.73Å; A22-G25 PolarHBondContact O-N 2.93Å; A22-M26 VanDerWaalsContact O-CG 3.3Å; A22-M26 WeakPolarHBondContact O-CG 3.41Å; A22-M26 PolarHBondContact O-N 2.71Å |
| 23 | V | 89.7 | Confident | 83.1 | Confident | 99 Ų | 99 | 101.9 Ų | 101.9 | 60% | 0.6 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -63.1 | -43.3 | 175.9 | 173.5 | 0 | 0 | 0 | 0 | 110.9 | A19 A20 G25 M26 L27 | A19-V23 VanDerWaalsContact O-CG2 3.29Å; A19-V23 WeakPolarHBondContact O-CG2 3.47Å; A19-V23 PolarHBondContact O-N 2.94Å; A20-V23 PolarHBondContact O-N 2.81Å; V23-G25 VanDerWaalsContact C-N 3.35Å; V23-G25 PolarHBondContact O-N 3.27Å; V23-M26 PolarHBondContact O-N 3.1Å; V23-L27 WeakPolarHBondContact O-CB 3.2Å; V23-L27 PolarHBondContact O-N 3.43Å |
| 24 | L | 89 | Confident | 84.8 | Confident | 106 Ų | 106 | 101.4 Ų | 101.4 | 56% | 0.555 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -64.3 | -39.3 | 177.7 | -168.9 | 130.3 | 0 | 0 | 0 | 112 | A20 Y21 L27 L28 | A20-L24 WeakPolarHBondContact O-CB 3.47Å; A20-L24 PolarHBondContact O-N 3.4Å; Y21-L24 PolarHBondContact O-N 2.89Å; L24-L27 PolarHBondContact O-N 2.81Å; L24-L28 HydrophobicContact CD2-CD1 4.09Å; L24-L28 PolarHBondContact O-N 3.42Å |
| 25 | G | 90.6 | Very high | 86.6 | Confident | 28 Ų | 28 | 101 Ų | 101 | 29% | 0.289 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -62.7 | -46.4 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y21 A22 V23 L27 L28 I29 | Y21-G25 PolarHBondContact O-N 3.05Å; A22-G25 PolarHBondContact O-N 2.93Å; V23-G25 VanDerWaalsContact C-N 3.35Å; V23-G25 PolarHBondContact O-N 3.27Å; G25-L27 VanDerWaalsContact C-N 3.31Å; G25-L27 PolarHBondContact O-N 2.95Å; G25-L28 PolarHBondContact O-N 2.93Å; G25-I29 WeakPolarHBondContact O-CG1 3.4Å; G25-I29 PolarHBondContact O-N 3.32Å |
| 26 | M | 90.7 | Very high | 87.9 | Confident | 129 Ų | 129 | 97.3 Ų | 97.3 | 64% | 0.635 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -62.1 | -39.9 | 175.9 | -69.3 | -66.8 | -92.2 | 0 | 0 | 111.7 | A22 V23 L28 I29 V30 | A22-M26 VanDerWaalsContact O-CG 3.3Å; A22-M26 WeakPolarHBondContact O-CG 3.41Å; A22-M26 PolarHBondContact O-N 2.71Å; V23-M26 PolarHBondContact O-N 3.1Å; M26-L28 PolarHBondContact O-N 3.32Å; M26-I29 PolarHBondContact O-N 2.91Å; M26-I29 HydrophobicContact SD-CD1 4.42Å; M26-V30 WeakPolarHBondContact O-CG2 3.34Å; M26-V30 PolarHBondContact O-N 3.36Å |
| 27 | L | 93.8 | Very high | 89.3 | Confident | 107 Ų | 107 | 92.4 Ų | 92.4 | 56% | 0.56 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -63.9 | -40.9 | 177.2 | -163.6 | 121.9 | 0 | 0 | 0 | 112 | V23 L24 G25 V30 L31 | V23-L27 WeakPolarHBondContact O-CB 3.2Å; V23-L27 PolarHBondContact O-N 3.43Å; L24-L27 PolarHBondContact O-N 2.81Å; G25-L27 VanDerWaalsContact C-N 3.31Å; G25-L27 PolarHBondContact O-N 2.95Å; L27-V30 PolarHBondContact O-N 3.47Å; L27-L31 HydrophobicContact CD2-CD1 3.95Å; L27-L31 WeakPolarHBondContact O-CG 3.49Å; L27-L31 PolarHBondContact O-N 3.31Å |
| 28 | L | 94.1 | Very high | 90.6 | Very high | 94 Ų | 94 | 93.3 Ų | 93.3 | 49% | 0.492 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.9 | -43.2 | 173.4 | -88.8 | 167.2 | 0 | 0 | 0 | 112.5 | L24 G25 M26 V30 L31 L32 | L24-L28 HydrophobicContact CD2-CD1 4.09Å; L24-L28 PolarHBondContact O-N 3.42Å; G25-L28 PolarHBondContact O-N 2.93Å; M26-L28 PolarHBondContact O-N 3.32Å; L28-V30 VanDerWaalsContact C-N 3.33Å; L28-V30 PolarHBondContact O-N 3.42Å; L28-L31 PolarHBondContact O-N 3.25Å; L28-L32 WeakPolarHBondContact O-CG 3.49Å; L28-L32 PolarHBondContact O-N 3.25Å |
| 29 | I | 95.5 | Very high | 91.5 | Very high | 107 Ų | 107 | 94.6 Ų | 94.6 | 55% | 0.549 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61 | -44.6 | 177.5 | -68.3 | 164.7 | 0 | 0 | 0 | 110.4 | G25 M26 L31 L32 F33 | G25-I29 WeakPolarHBondContact O-CG1 3.4Å; G25-I29 PolarHBondContact O-N 3.32Å; M26-I29 PolarHBondContact O-N 2.91Å; M26-I29 HydrophobicContact SD-CD1 4.42Å; I29-L31 PolarHBondContact O-N 2.81Å; I29-L32 PolarHBondContact O-N 2.9Å; I29-F33 WeakPolarHBondContact O-CB 3.35Å; I29-F33 PolarHBondContact O-N 3.42Å |
| 30 | V | 95.5 | Very high | 92.1 | Very high | 92 Ų | 92 | 96.1 Ų | 96.1 | 56% | 0.558 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -62 | -42.9 | 177 | 173 | 0 | 0 | 0 | 0 | 111.1 | M26 L27 L28 F33 V34 | M26-V30 WeakPolarHBondContact O-CG2 3.34Å; M26-V30 PolarHBondContact O-N 3.36Å; L27-V30 PolarHBondContact O-N 3.47Å; L28-V30 VanDerWaalsContact C-N 3.33Å; L28-V30 PolarHBondContact O-N 3.42Å; V30-F33 PolarHBondContact O-N 3.04Å; V30-V34 WeakPolarHBondContact O-CG2 3.27Å; V30-V34 PolarHBondContact O-N 3.48Å |
| 31 | L | 95.4 | Very high | 92.4 | Very high | 97 Ų | 97 | 98.7 Ų | 98.7 | 51% | 0.508 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -61.1 | -46.7 | 176.5 | -78.3 | 166.1 | 0 | 0 | 0 | 112.3 | L27 L28 I29 F33 V34 L35 | L27-L31 HydrophobicContact CD2-CD1 3.95Å; L27-L31 WeakPolarHBondContact O-CG 3.49Å; L27-L31 PolarHBondContact O-N 3.31Å; L28-L31 PolarHBondContact O-N 3.25Å; I29-L31 PolarHBondContact O-N 2.81Å; L31-F33 VanDerWaalsContact C-N 3.3Å; L31-F33 PolarHBondContact O-N 2.89Å; L31-V34 PolarHBondContact O-N 3.44Å; L31-L35 WeakPolarHBondContact O-CG 3.35Å; L31-L35 PolarHBondContact O-N 3.49Å |
| 32 | L | 95.8 | Very high | 92.5 | Very high | 117 Ų | 117 | 95.9 Ų | 95.9 | 61% | 0.613 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -62.2 | -38.9 | 176.5 | -71.1 | 174.4 | 0 | 0 | 0 | 111.7 | L28 I29 L35 G36 | L28-L32 WeakPolarHBondContact O-CG 3.49Å; L28-L32 PolarHBondContact O-N 3.25Å; I29-L32 PolarHBondContact O-N 2.9Å; L32-L35 PolarHBondContact O-N 3.36Å; L32-G36 PolarHBondContact O-N 3.23Å |
| 33 | F | 96 | Very high | 92.4 | Very high | 136 Ų | 136 | 96.7 Ų | 96.7 | 60% | 0.596 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -64 | -45.4 | 177.3 | -173 | -104.7 | 0 | 0 | 0 | 112.1 | I29 V30 L31 L35 G36 L37 | I29-F33 WeakPolarHBondContact O-CB 3.35Å; I29-F33 PolarHBondContact O-N 3.42Å; V30-F33 PolarHBondContact O-N 3.04Å; L31-F33 VanDerWaalsContact C-N 3.3Å; L31-F33 PolarHBondContact O-N 2.89Å; F33-L35 PolarHBondContact O-N 3.16Å; F33-G36 PolarHBondContact O-N 2.98Å; F33-L37 HydrophobicContact CD1-CD1 3.87Å; F33-L37 HydrophobicContact CD1-CG 4.33Å; F33-L37 HydrophobicContact CE1-CD1 3.47Å; F33-L37 VanDerWaalsContact CE1-CD1 3.47Å; F33-L37 HydrophobicContact CE1-CG 4.04Å; F33-L37 HydrophobicContact CZ-CD1 4.09Å; F33-L37 HydrophobicContact CZ-CD2 4.33Å; F33-L37 HydrophobicContact CZ-CG 4.27Å; F33-L37 WeakPolarHBondContact O-CG 3.14Å; F33-L37 PolarHBondContact O-N 3.44Å |
| 34 | V | 95.9 | Very high | 92 | Very high | 87 Ų | 87 | 96.6 Ų | 96.6 | 53% | 0.527 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.4 | -40.3 | 176.9 | 173.7 | 0 | 0 | 0 | 0 | 111.6 | V30 L31 L37 K38 | V30-V34 WeakPolarHBondContact O-CG2 3.27Å; V30-V34 PolarHBondContact O-N 3.48Å; L31-V34 PolarHBondContact O-N 3.44Å; V34-L37 PolarHBondContact O-N 3.28Å; V34-K38 PolarHBondContact O-N 2.92Å |
| 35 | L | 95.2 | Very high | 91.5 | Very high | 100 Ų | 100 | 96 Ų | 96 | 52% | 0.524 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.5 | -44.1 | 173.9 | -73.6 | 170.4 | 0 | 0 | 0 | 111.7 | L31 L32 F33 K38 I39 | L31-L35 WeakPolarHBondContact O-CG 3.35Å; L31-L35 PolarHBondContact O-N 3.49Å; L32-L35 PolarHBondContact O-N 3.36Å; F33-L35 PolarHBondContact O-N 3.16Å; L35-K38 PolarHBondContact O-N 2.9Å; L35-I39 WeakPolarHBondContact O-CG1 3.32Å; L35-I39 PolarHBondContact O-N 3.41Å |
| 36 | G | 94.2 | Very high | 90.6 | Very high | 32 Ų | 32 | 100 Ų | 100 | 33% | 0.33 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -59.2 | -46.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | L32 F33 K38 I39 C40 | L32-G36 PolarHBondContact O-N 3.23Å; F33-G36 PolarHBondContact O-N 2.98Å; G36-K38 VanDerWaalsContact C-N 3.33Å; G36-K38 PolarHBondContact O-N 3.47Å; G36-I39 PolarHBondContact O-N 3.47Å; G36-C40 PolarHBondContact O-N 3.47Å; G36-C40 PolarHBondContact O-SG 2.99Å |
| 37 | L | 94.7 | Very high | 89.5 | Confident | 84 Ų | 84 | 97 Ų | 97 | 44% | 0.44 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -60.3 | -41.6 | 175.5 | -72.6 | 178.9 | 0 | 0 | 0 | 112.2 | F33 V34 I39 C40 L41 | F33-L37 HydrophobicContact CD1-CD1 3.87Å; F33-L37 HydrophobicContact CD1-CG 4.33Å; F33-L37 HydrophobicContact CE1-CD1 3.47Å; F33-L37 VanDerWaalsContact CE1-CD1 3.47Å; F33-L37 HydrophobicContact CE1-CG 4.04Å; F33-L37 HydrophobicContact CZ-CD1 4.09Å; F33-L37 HydrophobicContact CZ-CD2 4.33Å; F33-L37 HydrophobicContact CZ-CG 4.27Å; F33-L37 WeakPolarHBondContact O-CG 3.14Å; F33-L37 PolarHBondContact O-N 3.44Å; V34-L37 PolarHBondContact O-N 3.28Å; L37-I39 VanDerWaalsContact C-N 3.35Å; L37-I39 PolarHBondContact O-N 2.95Å; L37-C40 PolarHBondContact O-N 2.91Å; L37-L41 WeakPolarHBondContact O-CB 3.33Å; L37-L41 WeakPolarHBondContact O-CG 3.37Å; L37-L41 PolarHBondContact O-N 2.98Å |
| 38 | K | 93.2 | Very high | 88.3 | Confident | 131 Ų | 131 | 97.7 Ų | 97.7 | 57% | 0.57 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -61.7 | -42.4 | 177 | -173 | 174.5 | -179.7 | 170.4 | 0 | 111.8 | V34 L35 G36 L41 Q42 | V34-K38 PolarHBondContact O-N 2.92Å; L35-K38 PolarHBondContact O-N 2.9Å; G36-K38 VanDerWaalsContact C-N 3.33Å; G36-K38 PolarHBondContact O-N 3.47Å; K38-L41 PolarHBondContact O-N 3.34Å; K38-Q42 WeakPolarHBondContact O-CG 3.44Å; K38-Q42 PolarHBondContact O-N 3.04Å |
| 39 | I | 92.2 | Very high | 86.7 | Confident | 100 Ų | 100 | 97.6 Ų | 97.6 | 51% | 0.513 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.4 | -45.2 | 176.3 | -64.7 | 162.3 | 0 | 0 | 0 | 110.5 | L35 G36 L37 L41 Q42 C43 | L35-I39 WeakPolarHBondContact O-CG1 3.32Å; L35-I39 PolarHBondContact O-N 3.41Å; G36-I39 PolarHBondContact O-N 3.47Å; L37-I39 VanDerWaalsContact C-N 3.35Å; L37-I39 PolarHBondContact O-N 2.95Å; I39-L41 VanDerWaalsContact C-N 3.33Å; I39-L41 PolarHBondContact O-N 2.85Å; I39-Q42 WeakPolarHBondContact O-CB 3.37Å; I39-Q42 PolarHBondContact O-N 3.36Å; I39-Q42 VanDerWaalsContact O-N 3.16Å; I39-C43 PolarHBondContact O-N 3.26Å; I39-C43 PolarHBondContact O-SG 3.29Å; I39-C43 VanDerWaalsContact O-SG 3.4Å |
| 40 | C | 90.4 | Very high | 84.8 | Confident | 84 Ų | 84 | 99.8 Ų | 99.8 | 57% | 0.568 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -58.7 | -44.2 | 176.6 | -75 | 0 | 0 | 0 | 0 | 112.2 | G36 L37 C43 L44 | G36-C40 PolarHBondContact O-N 3.47Å; G36-C40 PolarHBondContact O-SG 2.99Å; L37-C40 PolarHBondContact O-N 2.91Å; C40-C43 PolarHBondContact O-N 3.42Å; C40-L44 WeakPolarHBondContact O-CB 3.33Å; C40-L44 PolarHBondContact O-N 3Å |
| 41 | L | 88.9 | Confident | 82.8 | Confident | 114 Ų | 114 | 100.3 Ų | 100.3 | 60% | 0.597 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -63 | -40.9 | 175.2 | -75.1 | 167.6 | 0 | 0 | 0 | 111.7 | L37 K38 I39 L44 D45 | L37-L41 WeakPolarHBondContact O-CB 3.33Å; L37-L41 WeakPolarHBondContact O-CG 3.37Å; L37-L41 PolarHBondContact O-N 2.98Å; K38-L41 PolarHBondContact O-N 3.34Å; I39-L41 VanDerWaalsContact C-N 3.33Å; I39-L41 PolarHBondContact O-N 2.85Å; L41-L44 PolarHBondContact O-N 3.49Å; L41-D45 VanDerWaalsContact O-CB 3.27Å; L41-D45 WeakPolarHBondContact O-CB 3.47Å; L41-D45 PolarHBondContact O-N 3.48Å |
| 42 | Q | 85.4 | Confident | 80.9 | Confident | 108 Ų | 108 | 99.4 Ų | 99.4 | 51% | 0.505 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -63.2 | -41.5 | 174.5 | -75 | -179.8 | -29.8 | 0 | 0 | 112.3 | K38 I39 L44 D45 I46 | K38-Q42 WeakPolarHBondContact O-CG 3.44Å; K38-Q42 PolarHBondContact O-N 3.04Å; I39-Q42 WeakPolarHBondContact O-CB 3.37Å; I39-Q42 PolarHBondContact O-N 3.36Å; I39-Q42 VanDerWaalsContact O-N 3.16Å; Q42-L44 VanDerWaalsContact C-N 3.35Å; Q42-D45 PolarHBondContact O-N 3Å; Q42-I46 WeakPolarHBondContact O-CB 3.41Å; Q42-I46 WeakPolarHBondContact O-CD1 3.41Å; Q42-I46 WeakPolarHBondContact O-CG1 3.42Å; Q42-I46 PolarHBondContact O-N 2.94Å |
| 43 | C | 83.4 | Confident | 79 | Confident | 78 Ų | 78 | 99.4 Ų | 99.4 | 53% | 0.527 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -64.2 | -40.7 | 175.3 | -69.4 | 0 | 0 | 0 | 0 | 112 | I39 C40 A47 | I39-C43 PolarHBondContact O-N 3.26Å; I39-C43 PolarHBondContact O-SG 3.29Å; I39-C43 VanDerWaalsContact O-SG 3.4Å; C40-C43 PolarHBondContact O-N 3.42Å; C43-A47 WeakPolarHBondContact O-CB 3.3Å; C43-A47 PolarHBondContact O-N 3.36Å |
| 44 | L | 83.1 | Confident | 76.8 | Confident | 98 Ų | 98 | 102.6 Ų | 102.6 | 51% | 0.513 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -66.4 | -43.7 | 176.8 | -171.9 | 69.6 | 0 | 0 | 0 | 111.2 | C40 L41 Q42 I46 A47 I48 | C40-L44 WeakPolarHBondContact O-CB 3.33Å; C40-L44 PolarHBondContact O-N 3Å; L41-L44 PolarHBondContact O-N 3.49Å; Q42-L44 VanDerWaalsContact C-N 3.35Å; L44-I46 PolarHBondContact O-N 3.27Å; L44-A47 WeakPolarHBondContact O-CB 3.41Å; L44-A47 PolarHBondContact O-N 3.39Å; L44-A47 VanDerWaalsContact O-N 3.1Å; L44-I48 HydrophobicContact CD1-CD1 3.99Å; L44-I48 HydrophobicContact CD1-CG1 4.49Å; L44-I48 HydrophobicContact CD2-CD1 4.3Å; L44-I48 HydrophobicContact CG-CD1 3.74Å; L44-I48 HydrophobicContact CG-CG1 4.47Å; L44-I48 WeakPolarHBondContact O-CG1 3.37Å; L44-I48 PolarHBondContact O-N 3Å |
| 45 | D | 77.8 | Confident | 74.7 | Confident | 94 Ų | 94 | 107.9 Ų | 107.9 | 50% | 0.503 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -61.5 | -44 | 177.1 | -169.8 | 58.7 | 0 | 0 | 0 | 111.3 | L41 Q42 A47 I48 V49 | L41-D45 VanDerWaalsContact O-CB 3.27Å; L41-D45 WeakPolarHBondContact O-CB 3.47Å; L41-D45 PolarHBondContact O-N 3.48Å; Q42-D45 PolarHBondContact O-N 3Å; D45-A47 VanDerWaalsContact C-N 3.28Å; D45-A47 PolarHBondContact O-N 2.91Å; D45-I48 PolarHBondContact O-N 3.33Å; D45-V49 WeakPolarHBondContact O-CB 3.38Å; D45-V49 PolarHBondContact O-N 3.01Å; D45-V49 WeakPolarHBondContact OD1-CG2 3.37Å |
| 46 | I | 71.2 | Confident | 72.4 | Confident | 112 Ų | 112 | 108.8 Ų | 108.8 | 57% | 0.574 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -59.6 | -40.5 | 173.1 | -68.5 | 163 | 0 | 0 | 0 | 111 | Q42 L44 K50 | Q42-I46 WeakPolarHBondContact O-CB 3.41Å; Q42-I46 WeakPolarHBondContact O-CD1 3.41Å; Q42-I46 WeakPolarHBondContact O-CG1 3.42Å; Q42-I46 PolarHBondContact O-N 2.94Å; L44-I46 PolarHBondContact O-N 3.27Å; I46-K50 CarbonylContact O-C 3.54Å; I46-K50 PolarHBondContact O-N 3.43Å |
| 47 | A | 68.1 | Low | 70.3 | Confident | 66 Ų | 66 | 114.9 Ų | 114.9 | 55% | 0.545 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -70 | -33.2 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | C43 L44 D45 | C43-A47 WeakPolarHBondContact O-CB 3.3Å; C43-A47 PolarHBondContact O-N 3.36Å; L44-A47 WeakPolarHBondContact O-CB 3.41Å; L44-A47 PolarHBondContact O-N 3.39Å; L44-A47 VanDerWaalsContact O-N 3.1Å; D45-A47 VanDerWaalsContact C-N 3.28Å; D45-A47 PolarHBondContact O-N 2.91Å |
| 48 | I | 67.8 | Low | 68.2 | Low | 121 Ų | 121 | 114.2 Ų | 114.2 | 62% | 0.621 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -90.7 | -48.3 | -176.2 | -62.8 | 172.3 | 0 | 0 | 0 | 111.9 | L44 D45 | L44-I48 HydrophobicContact CD1-CD1 3.99Å; L44-I48 HydrophobicContact CD1-CG1 4.49Å; L44-I48 HydrophobicContact CD2-CD1 4.3Å; L44-I48 HydrophobicContact CG-CD1 3.74Å; L44-I48 HydrophobicContact CG-CG1 4.47Å; L44-I48 WeakPolarHBondContact O-CG1 3.37Å; L44-I48 PolarHBondContact O-N 3Å; D45-I48 PolarHBondContact O-N 3.33Å |
| 49 | V | 60.3 | Low | 66.2 | Low | 92 Ų | 92 | 115.6 Ų | 115.6 | 56% | 0.558 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -81.9 | -27.9 | -170.4 | 179.3 | 0 | 0 | 0 | 0 | 112.4 | D45 | D45-V49 WeakPolarHBondContact O-CB 3.38Å; D45-V49 PolarHBondContact O-N 3.01Å; D45-V49 WeakPolarHBondContact OD1-CG2 3.37Å |
| 50 | K | 56.5 | Low | 64.3 | Low | 153 Ų | 153 | 116.3 Ų | 116.3 | 67% | 0.665 | 63% | 0.628 | S | S | * | * | S | Bend | trans | -126 | 93.6 | 175 | -71 | -179.7 | -176.6 | 173.9 | 0 | 108.4 | I46 | I46-K50 CarbonylContact O-C 3.54Å; I46-K50 PolarHBondContact O-N 3.43Å |
| 51 | P | 53.8 | Low | 62.4 | Low | 103 Ų | 103 | 114.6 Ų | 114.6 | 67% | 0.669 | 62% | 0.624 | S | S | * | * | trans | -49.7 | 125.5 | 163.7 | 22.5 | -32 | 0 | 0 | 0 | 106.1 | ||||
| 52 | P | 55.8 | Low | 60.5 | Low | 77 Ų | 77 | 113.6 Ų | 113.6 | 50% | 0.5 | 62% | 0.616 | S | S | . | * | trans | -50.7 | 123.7 | -172 | 18.3 | -31.2 | 0 | 0 | 0 | 106.9 | K54 R55 | P52-K54 PolarHBondContact O-N 3.43Å; P52-R55 HydrophobicContact CB-CG 4.31Å | ||
| 53 | P | 54.8 | Low | 58.8 | Low | 117 Ų | 117 | 114.2 Ų | 114.2 | 76% | 0.76 | 62% | 0.619 | S | S | * | * | trans | -53 | 112.7 | 178.1 | 21.8 | -31.6 | 0 | 0 | 0 | 104.6 | R55 | P53-R55 VanDerWaalsContact C-N 3.3Å; P53-R55 WeakPolarHBondContact O-CA 3.12Å; P53-R55 PolarHBondContact O-N 2.83Å | ||
| 54 | K | 51.2 | Low | 57.2 | Low | 203 Ų | 203 | 114.6 Ų | 114.6 | 88% | 0.883 | 62% | 0.619 | S | S | * | * | trans | -20.1 | 94.6 | -166.6 | -77.9 | 176.1 | 177.3 | 174.6 | 0 | 108.2 | P52 P56 | P52-K54 PolarHBondContact O-N 3.43Å; K54-P56 WeakPolarHBondContact O-CD 3.29Å | ||
| 55 | R | 50.3 | Low | 55.6 | Low | 199 Ų | 199 | 116.6 Ų | 116.6 | 75% | 0.751 | 63% | 0.625 | S | S | * | * | trans | -49.2 | 122.4 | -178.6 | -74 | -174.1 | -175.9 | -172 | 2 | 103 | P52 P53 K57 | P52-R55 HydrophobicContact CB-CG 4.31Å; P53-R55 VanDerWaalsContact C-N 3.3Å; P53-R55 WeakPolarHBondContact O-CA 3.12Å; P53-R55 PolarHBondContact O-N 2.83Å; R55-K57 VanDerWaalsContact C-N 3.27Å; R55-K57 WeakPolarHBondContact O-CA 3.41Å; R55-K57 PolarHBondContact O-N 3.49Å | ||
| 56 | P | 47.6 | Very low | 54.4 | Low | 118 Ų | 118 | 115.4 Ų | 115.4 | 77% | 0.766 | 62% | 0.622 | S | S | * | * | trans | -52.8 | 110.5 | 171.8 | 21.8 | -29.1 | 0 | 0 | 0 | 102.2 | K54 A58 | K54-P56 WeakPolarHBondContact O-CD 3.29Å; P56-A58 VanDerWaalsContact C-N 3.32Å; P56-A58 WeakPolarHBondContact O-CA 2.98Å; P56-A58 PolarHBondContact O-N 2.81Å | ||
| 57 | K | 50.1 | Low | 53.6 | Low | 160 Ų | 160 | 115.3 Ų | 115.3 | 70% | 0.696 | 62% | 0.621 | S | S | * | * | trans | -40.6 | 107.8 | -166.5 | -80.2 | -173.8 | 177.1 | -177.8 | 0 | 104.6 | R55 K59 | R55-K57 VanDerWaalsContact C-N 3.27Å; R55-K57 WeakPolarHBondContact O-CA 3.41Å; R55-K57 PolarHBondContact O-N 3.49Å; K57-K59 PolarHBondContact O-N 3.32Å | ||
| 58 | A | 49.5 | Very low | 52.7 | Low | 71 Ų | 71 | 120.5 Ų | 120.5 | 59% | 0.587 | 63% | 0.628 | S | S | * | * | trans | -51.5 | 122.8 | -176.2 | 0 | 0 | 0 | 0 | 0 | 103.1 | P56 V60 | P56-A58 VanDerWaalsContact C-N 3.32Å; P56-A58 WeakPolarHBondContact O-CA 2.98Å; P56-A58 PolarHBondContact O-N 2.81Å; A58-V60 HydrophobicContact CB-CG2 4.22Å; A58-V60 PolarHBondContact O-N 2.93Å | ||
| 59 | K | 52.6 | Low | 52 | Low | 160 Ų | 160 | 118.6 Ų | 118.6 | 70% | 0.696 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.3 | 51.5 | -168.3 | -67.4 | 173 | 171.6 | 177.7 | 0 | 110.9 | K57 Q63 | K57-K59 PolarHBondContact O-N 3.32Å; K59-Q63 WeakPolarHBondContact O-CB 3.41Å; K59-Q63 PolarHBondContact O-OE1 3.43Å |
| 60 | V | 52.2 | Low | 51.6 | Low | 115 Ų | 115 | 121.1 Ų | 121.1 | 70% | 0.697 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.6 | -39.6 | -179.9 | -167 | 0 | 0 | 0 | 0 | 107.5 | A58 | A58-V60 HydrophobicContact CB-CG2 4.22Å; A58-V60 PolarHBondContact O-N 2.93Å |
| 61 | G | 50.4 | Low | 51.6 | Low | 48 Ų | 48 | 121.5 Ų | 121.5 | 50% | 0.495 | 64% | 0.642 | S | S | . | * | S | Bend | trans | -86.7 | -29.9 | 164.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | Q65 | G61-Q65 PolarHBondContact O-N 3.12Å; G61-Q65 VanDerWaalsContact O-N 3.12Å |
| 62 | Q | 48 | Very low | 51.7 | Low | 92 Ų | 92 | 122 Ų | 122 | 43% | 0.43 | 65% | 0.646 | S | S | . | * | H | α-helix | trans | -80.2 | -26.2 | -178.5 | -148.7 | 178.2 | 9.5 | 0 | 0 | 112.5 | V64 Q65 T66 | Q62-V64 VanDerWaalsContact C-N 3.32Å; Q62-Q65 PolarHBondContact O-N 3Å; Q62-T66 HydrophobicContact CG-CG2 4.23Å; Q62-T66 WeakPolarHBondContact O-CB 3.34Å; Q62-T66 VanDerWaalsContact O-CG2 3.25Å; Q62-T66 WeakPolarHBondContact O-CG2 3.31Å; Q62-T66 PolarHBondContact O-N 3.45Å; Q62-T66 PolarHBondContact O-OG1 3.27Å |
| 63 | Q | 50.1 | Low | 51.9 | Low | 122 Ų | 122 | 123.6 Ų | 123.6 | 57% | 0.57 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -70.1 | -31.2 | 172.3 | -171.2 | 173.8 | 7.7 | 0 | 0 | 111.4 | K59 I67 | K59-Q63 WeakPolarHBondContact O-CB 3.41Å; K59-Q63 PolarHBondContact O-OE1 3.43Å; Q63-I67 HydrophobicContact CG-CD1 4.25Å; Q63-I67 WeakPolarHBondContact O-CD1 3.25Å; Q63-I67 WeakPolarHBondContact O-CG1 3.14Å; Q63-I67 PolarHBondContact O-N 2.94Å |
| 64 | V | 50.5 | Low | 52.1 | Low | 85 Ų | 85 | 127.2 Ų | 127.2 | 52% | 0.515 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -71.4 | -46.6 | 171.1 | -171.5 | 0 | 0 | 0 | 0 | 110 | Q62 T66 I67 Y68 | Q62-V64 VanDerWaalsContact C-N 3.32Å; V64-T66 PolarHBondContact O-N 2.87Å; V64-I67 PolarHBondContact O-N 2.93Å; V64-Y68 HydrophobicContact CG1-CD2 4.12Å; V64-Y68 HydrophobicContact CG1-CE2 3.88Å; V64-Y68 WeakPolarHBondContact O-CD2 3.47Å; V64-Y68 PolarHBondContact O-N 3.42Å |
| 65 | Q | 48.7 | Very low | 52.6 | Low | 140 Ų | 140 | 125.1 Ų | 125.1 | 65% | 0.654 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -67.5 | -32.3 | 179.3 | -74.6 | -174.5 | 4.2 | 0 | 0 | 114.5 | G61 Q62 Y68 A69 | G61-Q65 PolarHBondContact O-N 3.12Å; G61-Q65 VanDerWaalsContact O-N 3.12Å; Q62-Q65 PolarHBondContact O-N 3Å; Q65-Y68 PolarHBondContact O-N 3.34Å; Q65-A69 WeakPolarHBondContact O-CB 3.34Å; Q65-A69 PolarHBondContact O-N 2.94Å |
| 66 | T | 53.9 | Low | 53.2 | Low | 70 Ų | 70 | 119.3 Ų | 119.3 | 43% | 0.429 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -78.5 | -19.8 | 177.8 | 57.5 | 0 | 0 | 0 | 0 | 113.4 | Q62 V64 | Q62-T66 HydrophobicContact CG-CG2 4.23Å; Q62-T66 WeakPolarHBondContact O-CB 3.34Å; Q62-T66 VanDerWaalsContact O-CG2 3.25Å; Q62-T66 WeakPolarHBondContact O-CG2 3.31Å; Q62-T66 PolarHBondContact O-N 3.45Å; Q62-T66 PolarHBondContact O-OG1 3.27Å; V64-T66 PolarHBondContact O-N 2.87Å |
| 67 | I | 54.1 | Low | 54 | Low | 109 Ų | 109 | 119.1 Ų | 119.1 | 56% | 0.559 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -73.7 | -33 | 171.9 | -67.4 | 167 | 0 | 0 | 0 | 110.4 | Q63 V64 | Q63-I67 HydrophobicContact CG-CD1 4.25Å; Q63-I67 WeakPolarHBondContact O-CD1 3.25Å; Q63-I67 WeakPolarHBondContact O-CG1 3.14Å; Q63-I67 PolarHBondContact O-N 2.94Å; V64-I67 PolarHBondContact O-N 2.93Å |
| 68 | Y | 47.7 | Very low | 54.6 | Low | 176 Ų | 176 | 113.7 Ų | 113.7 | 69% | 0.69 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -90.2 | -23.7 | 178.7 | -68.2 | -73.6 | 0 | 0 | 0 | 114.6 | V64 Q65 | V64-Y68 HydrophobicContact CG1-CD2 4.12Å; V64-Y68 HydrophobicContact CG1-CE2 3.88Å; V64-Y68 WeakPolarHBondContact O-CD2 3.47Å; V64-Y68 PolarHBondContact O-N 3.42Å; Q65-Y68 PolarHBondContact O-N 3.34Å |
| 69 | A | 53.9 | Low | 55.1 | Low | 81 Ų | 81 | 113.4 Ų | 113.4 | 67% | 0.669 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -84.4 | -13.9 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | Q65 | Q65-A69 WeakPolarHBondContact O-CB 3.34Å; Q65-A69 PolarHBondContact O-N 2.94Å |
| 70 | N | 52.6 | Low | 55.4 | Low | 144 Ų | 144 | 111.9 Ų | 111.9 | 77% | 0.77 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.9 | 12.3 | -175.7 | -110.2 | -12.3 | 0 | 0 | 0 | 114.7 | ||
| 71 | K | 56 | Low | 55.9 | Low | 162 Ų | 162 | 114 Ų | 114 | 70% | 0.704 | 61% | 0.607 | S | S | * | * | S | Bend | trans | -118.3 | 120.3 | 161.3 | -69.1 | -174.8 | -178.1 | -177 | 0 | 107.1 | I73 | K71-I73 PolarHBondContact O-N 2.99Š|
| 72 | P | 56.2 | Low | 56.3 | Low | 114 Ų | 114 | 115.8 Ų | 115.8 | 74% | 0.74 | 62% | 0.618 | S | S | * | * | trans | -57.7 | 115.3 | 161.2 | 25.2 | -30 | 0 | 0 | 0 | 105.8 | K74 | P72-K74 PolarHBondContact O-N 3.42Š| ||
| 73 | I | 60.4 | Low | 56.5 | Low | 109 Ų | 109 | 120 Ų | 120 | 56% | 0.559 | 64% | 0.639 | S | S | * | * | trans | -62.3 | 96.5 | 166.6 | -61.9 | 166.7 | 0 | 0 | 0 | 104.4 | K71 W75 | K71-I73 PolarHBondContact O-N 2.99Å; I73-W75 HydrophobicContact CB-CZ2 4.43Å; I73-W75 HydrophobicContact CD1-CZ2 4.15Å; I73-W75 HydrophobicContact CG2-CD2 3.58Å; I73-W75 VanDerWaalsContact CG2-CE2 3.48Å; I73-W75 HydrophobicContact CG2-CE3 4.03Å; I73-W75 HydrophobicContact CG2-CG 3.95Å; I73-W75 HydrophobicContact CG2-CH2 4.3Å; I73-W75 HydrophobicContact CG2-CZ2 3.87Å; I73-W75 HydrophobicContact CG2-CZ3 4.36Å; I73-W75 VanDerWaalsContact O-CD1 3.24Å; I73-W75 PolarHBondContact O-N 2.82Å | ||
| 74 | K | 58.7 | Low | 56.4 | Low | 193 Ų | 193 | 126.1 Ų | 126.1 | 84% | 0.839 | 66% | 0.664 | S | S | * | * | trans | -66.2 | 90.8 | 161.8 | -77.6 | -174.9 | 177.1 | -176.8 | 0 | 104.9 | P72 | P72-K74 PolarHBondContact O-N 3.42Š| ||
| 75 | W | 61.2 | Low | 56.7 | Low | 159 Ų | 159 | 128.2 Ų | 128.2 | 60% | 0.602 | 67% | 0.672 | S | S | * | * | trans | -58 | 125.8 | 171.7 | -64.5 | 98.1 | 0 | 0 | 0 | 107.6 | I73 V79 | I73-W75 HydrophobicContact CB-CZ2 4.43Å; I73-W75 HydrophobicContact CD1-CZ2 4.15Å; I73-W75 HydrophobicContact CG2-CD2 3.58Å; I73-W75 VanDerWaalsContact CG2-CE2 3.48Å; I73-W75 HydrophobicContact CG2-CE3 4.03Å; I73-W75 HydrophobicContact CG2-CG 3.95Å; I73-W75 HydrophobicContact CG2-CH2 4.3Å; I73-W75 HydrophobicContact CG2-CZ2 3.87Å; I73-W75 HydrophobicContact CG2-CZ3 4.36Å; I73-W75 VanDerWaalsContact O-CD1 3.24Å; I73-W75 PolarHBondContact O-N 2.82Å; W75-V79 HydrophobicContact CE3-CG1 3.94Å; W75-V79 HydrophobicContact CZ3-CG1 4.38Å | ||
| 76 | P | 63.2 | Low | 57.1 | Low | 78 Ų | 78 | 127.6 Ų | 127.6 | 51% | 0.506 | 67% | 0.673 | S | S | . | * | trans | -60.9 | 143.3 | 176.2 | 16.2 | -20 | 0 | 0 | 0 | 109.2 | G78 V79 | P76-G78 PolarHBondContact O-N 3.08Å; P76-V79 HydrophobicContact CG-CG2 3.78Å; P76-V79 PolarHBondContact O-N 3.26Å | ||
| 77 | P | 64.3 | Low | 57.3 | Low | 113 Ų | 113 | 130.8 Ų | 130.8 | 73% | 0.734 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -56 | -23.4 | -169 | 17.5 | -30 | 0 | 0 | 0 | 114.4 | ||
| 78 | G | 63.5 | Low | 57.5 | Low | 46 Ų | 46 | 132.1 Ų | 132.1 | 47% | 0.474 | 69% | 0.693 | S | S | . | * | H | α-helix | trans | -77.5 | -11.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 116.3 | P76 A82 | P76-G78 PolarHBondContact O-N 3.08Å; G78-A82 PolarHBondContact O-N 3.14Å |
| 79 | V | 59.6 | Low | 58.1 | Low | 65 Ų | 65 | 129.3 Ų | 129.3 | 39% | 0.394 | 69% | 0.694 | S | S | . | * | H | α-helix | trans | -83.3 | -28.9 | -179 | 179.7 | 0 | 0 | 0 | 0 | 111.7 | W75 P76 E81 | W75-V79 HydrophobicContact CE3-CG1 3.94Å; W75-V79 HydrophobicContact CZ3-CG1 4.38Å; P76-V79 HydrophobicContact CG-CG2 3.78Å; P76-V79 PolarHBondContact O-N 3.26Å; V79-E81 VanDerWaalsContact C-N 3.34Å |
| 80 | L | 58.8 | Low | 58.4 | Low | 128 Ų | 128 | 132.5 Ų | 132.5 | 67% | 0.67 | 70% | 0.695 | S | S | * | * | H | α-helix | trans | -75.2 | -24.8 | 173.9 | -73.3 | 166.8 | 0 | 0 | 0 | 112.3 | ||
| 81 | E | 62.1 | Low | 58.8 | Low | 160 Ų | 160 | 131.7 Ų | 131.7 | 75% | 0.748 | 69% | 0.69 | S | S | * | * | H | α-helix | trans | -79.6 | -24.7 | 175.6 | -67.8 | -164.8 | 161.2 | 0 | 0 | 113.2 | V79 M83 | V79-E81 VanDerWaalsContact C-N 3.34Å; E81-M83 VanDerWaalsContact C-N 3.29Å; E81-M83 PolarHBondContact O-N 2.94Å |
| 82 | A | 59.3 | Low | 59 | Low | 86 Ų | 86 | 129.4 Ų | 129.4 | 71% | 0.711 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.3 | -4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | G78 | G78-A82 PolarHBondContact O-N 3.14Š|
| 83 | M | 52.6 | Low | 59.2 | Low | 179 Ų | 179 | 130.7 Ų | 130.7 | 88% | 0.882 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.1 | 10 | -175 | -130.4 | 178.4 | -159.6 | 0 | 0 | 113.6 | E81 | E81-M83 VanDerWaalsContact C-N 3.29Å; E81-M83 PolarHBondContact O-N 2.94Å |
| 84 | K | 47.2 | Very low | 59.1 | Low | 252 Ų | 252 | 132.6 Ų | 132.6 | 100% | 1.096 | 70% | 0.696 | S | S | * | * | trans | -105.6 | 0 | 174.3 | -166.4 | 180 | -174.4 | -177.3 | 0 | 110 |
Retrieved 84 of 84 residues in 141.9 ms
(Link to these results)