| 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 | 67.4 | Low | 76 | Confident | 239 Ų | 239 | 122.5 Ų | 122.5 | 100% | 1.177 | 65% | 0.645 | S | S | * | * | 0 | 101.7 | 0 | -76.7 | 149.6 | 91.6 | 0 | 0 | 107.8 | |||||
| 2 | A | 61.6 | Low | 75.5 | Confident | 72 Ų | 72 | 124.6 Ų | 124.6 | 60% | 0.595 | 66% | 0.656 | S | S | * | * | trans | -67.7 | 131.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 108.6 | R4 | A2-R4 PolarHBondContact O-N 3.24Š| ||
| 3 | P | 79.9 | Confident | 75.3 | Confident | 68 Ų | 68 | 125.8 Ų | 125.8 | 44% | 0.442 | 66% | 0.662 | S | S | . | * | trans | -65.1 | 122.6 | -177.7 | 27.7 | -34.1 | 0 | 0 | 0 | 108.4 | P5 L6 | P3-P5 HydrophobicContact CB-CG 4.1Å; P3-P5 WeakPolarHBondContact O-CD 3.36Å; P3-L6 HydrophobicContact CG-CB 4.22Å; P3-L6 HydrophobicContact CG-CD1 3.47Å; P3-L6 VanDerWaalsContact CG-CD1 3.47Å; P3-L6 HydrophobicContact CG-CG 3.79Å; P3-L6 WeakPolarHBondContact O-CB 3.47Å; P3-L6 PolarHBondContact O-N 3.45Å | ||
| 4 | R | 75.5 | Confident | 74.7 | Confident | 209 Ų | 209 | 120.5 Ų | 120.5 | 79% | 0.789 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -40.5 | -37.6 | 176.1 | -66 | -179.4 | 169.6 | 104.3 | -1.9 | 115.2 | A2 L6 L7 L8 | A2-R4 PolarHBondContact O-N 3.24Å; R4-L6 VanDerWaalsContact C-N 3.33Å; R4-L6 PolarHBondContact O-N 3.23Å; R4-L7 PolarHBondContact O-N 3.16Å; R4-L8 PolarHBondContact O-N 3.15Å |
| 5 | P | 81.1 | Confident | 73.7 | Confident | 92 Ų | 92 | 116.9 Ų | 116.9 | 60% | 0.597 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -65.3 | -30.7 | 176.2 | 24.8 | -37.4 | 0 | 0 | 0 | 114.3 | P3 L8 L9 | P3-P5 HydrophobicContact CB-CG 4.1Å; P3-P5 WeakPolarHBondContact O-CD 3.36Å; P5-L8 PolarHBondContact O-N 3.06Å; P5-L9 WeakPolarHBondContact O-CB 3.1Å; P5-L9 PolarHBondContact O-N 3.26Å |
| 6 | L | 79.6 | Confident | 73 | Confident | 89 Ų | 89 | 116.3 Ų | 116.3 | 47% | 0.466 | 66% | 0.661 | S | S | . | * | H | α-helix | trans | -68 | -38.3 | 176.2 | -74.6 | 179.4 | 0 | 0 | 0 | 111.1 | P3 R4 L8 L9 L10 | P3-L6 HydrophobicContact CG-CB 4.22Å; P3-L6 HydrophobicContact CG-CD1 3.47Å; P3-L6 VanDerWaalsContact CG-CD1 3.47Å; P3-L6 HydrophobicContact CG-CG 3.79Å; P3-L6 WeakPolarHBondContact O-CB 3.47Å; P3-L6 PolarHBondContact O-N 3.45Å; R4-L6 VanDerWaalsContact C-N 3.33Å; R4-L6 PolarHBondContact O-N 3.23Å; L6-L8 VanDerWaalsContact C-N 3.31Å; L6-L8 PolarHBondContact O-N 3.4Å; L6-L9 HydrophobicContact CD2-CD2 4.43Å; L6-L9 PolarHBondContact O-N 3.46Å; L6-L10 HydrophobicContact CB-CD1 4.31Å; L6-L10 WeakPolarHBondContact O-CB 3.47Å; L6-L10 WeakPolarHBondContact O-CD1 3.26Å; L6-L10 PolarHBondContact O-N 2.68Å |
| 7 | L | 78.4 | Confident | 72.3 | Confident | 109 Ų | 109 | 114.5 Ų | 114.5 | 57% | 0.571 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -63 | -38.9 | 175.6 | -67.9 | 171.4 | 0 | 0 | 0 | 111.8 | R4 L10 L11 | R4-L7 PolarHBondContact O-N 3.16Å; L7-L10 PolarHBondContact O-N 2.95Å; L7-L11 WeakPolarHBondContact O-CB 3.4Å; L7-L11 PolarHBondContact O-N 3.04Å |
| 8 | L | 78.3 | Confident | 71.9 | Confident | 121 Ų | 121 | 113.2 Ų | 113.2 | 63% | 0.634 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -66.2 | -41.3 | 174.7 | -66.2 | 173.1 | 0 | 0 | 0 | 111.8 | R4 P5 L6 L11 L12 | R4-L8 PolarHBondContact O-N 3.15Å; P5-L8 PolarHBondContact O-N 3.06Å; L6-L8 VanDerWaalsContact C-N 3.31Å; L6-L8 PolarHBondContact O-N 3.4Å; L8-L11 PolarHBondContact O-N 2.97Å; L8-L12 WeakPolarHBondContact O-CB 3.36Å; L8-L12 PolarHBondContact O-N 3.45Å |
| 9 | L | 79 | Confident | 71.4 | Confident | 100 Ų | 100 | 119.6 Ų | 119.6 | 52% | 0.524 | 68% | 0.68 | S | S | . | * | H | α-helix | trans | -65.6 | -41.9 | 176.5 | -175.5 | 63.9 | 0 | 0 | 0 | 111.9 | P5 L6 L11 L12 L13 | P5-L9 WeakPolarHBondContact O-CB 3.1Å; P5-L9 PolarHBondContact O-N 3.26Å; L6-L9 HydrophobicContact CD2-CD2 4.43Å; L6-L9 PolarHBondContact O-N 3.46Å; L9-L11 VanDerWaalsContact C-N 3.35Å; L9-L12 PolarHBondContact O-N 3.37Å; L9-L13 WeakPolarHBondContact O-CB 3.29Å; L9-L13 PolarHBondContact O-N 2.98Å |
| 10 | L | 79.4 | Confident | 71 | Confident | 118 Ų | 118 | 119.2 Ų | 119.2 | 62% | 0.618 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -65.9 | -35.5 | 174.1 | -88.5 | 111 | 0 | 0 | 0 | 112.2 | L6 L7 G14 | L6-L10 HydrophobicContact CB-CD1 4.31Å; L6-L10 WeakPolarHBondContact O-CB 3.47Å; L6-L10 WeakPolarHBondContact O-CD1 3.26Å; L6-L10 PolarHBondContact O-N 2.68Å; L7-L10 PolarHBondContact O-N 2.95Å; L10-G14 WeakPolarHBondContact O-CA 3.46Å; L10-G14 PolarHBondContact O-N 3.49Å |
| 11 | L | 75.3 | Confident | 70.9 | Confident | 131 Ų | 131 | 117.4 Ų | 117.4 | 69% | 0.686 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -69.6 | -40.2 | 175.7 | -169.7 | 68 | 0 | 0 | 0 | 111.5 | L7 L8 L9 G15 | L7-L11 WeakPolarHBondContact O-CB 3.4Å; L7-L11 PolarHBondContact O-N 3.04Å; L8-L11 PolarHBondContact O-N 2.97Å; L9-L11 VanDerWaalsContact C-N 3.35Å; L11-G15 PolarHBondContact O-N 3.19Å; L11-G15 VanDerWaalsContact O-N 3.12Å |
| 12 | L | 70.8 | Confident | 71.3 | Confident | 147 Ų | 147 | 111 Ų | 111 | 77% | 0.77 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -70.3 | -37.3 | 177.8 | -168.7 | 66 | 0 | 0 | 0 | 112 | L8 L9 | L8-L12 WeakPolarHBondContact O-CB 3.36Å; L8-L12 PolarHBondContact O-N 3.45Å; L9-L12 PolarHBondContact O-N 3.37Å |
| 13 | L | 73 | Confident | 71.8 | Confident | 140 Ų | 140 | 113.6 Ų | 113.6 | 73% | 0.733 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -83.1 | -34.2 | 179.9 | -166.8 | 62.8 | 0 | 0 | 0 | 112.7 | L9 | L9-L13 WeakPolarHBondContact O-CB 3.29Å; L9-L13 PolarHBondContact O-N 2.98Å |
| 14 | G | 66.1 | Low | 71.5 | Confident | 52 Ų | 52 | 121.1 Ų | 121.1 | 54% | 0.536 | 69% | 0.688 | S | S | . | * | H | α-helix | trans | -81.6 | -18.4 | 179.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | L10 S16 | L10-G14 WeakPolarHBondContact O-CA 3.46Å; L10-G14 PolarHBondContact O-N 3.49Å; G14-S16 PolarHBondContact O-N 3.28Å |
| 15 | G | 60.3 | Low | 71.2 | Confident | 67 Ų | 67 | 115.3 Ų | 115.3 | 69% | 0.691 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70 | -8.2 | 179.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | L11 | L11-G15 PolarHBondContact O-N 3.19Å; L11-G15 VanDerWaalsContact O-N 3.12Å |
| 16 | S | 63 | Low | 70.5 | Confident | 106 Ų | 106 | 121.5 Ų | 121.5 | 74% | 0.741 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.2 | -2.5 | -175.8 | -164.4 | 0 | 0 | 0 | 0 | 114.7 | G14 A18 | G14-S16 PolarHBondContact O-N 3.28Å; S16-A18 PolarHBondContact O-N 2.96Å |
| 17 | A | 61.2 | Low | 70.1 | Confident | 87 Ų | 87 | 125.3 Ų | 125.3 | 72% | 0.719 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -88.2 | 98 | 177 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||
| 18 | A | 63.5 | Low | 69.5 | Low | 90 Ų | 90 | 128 Ų | 128 | 74% | 0.744 | 71% | 0.714 | S | S | * | * | trans | 62.1 | 68.6 | 162.4 | 0 | 0 | 0 | 0 | 0 | 115.9 | S16 P20 | S16-A18 PolarHBondContact O-N 2.96Å; A18-P20 WeakPolarHBondContact O-CD 3.46Å | ||
| 19 | R | 63.8 | Low | 69 | Low | 235 Ų | 235 | 125.2 Ų | 125.2 | 89% | 0.887 | 70% | 0.704 | S | S | * | * | trans | -68.4 | 111.5 | 150 | -168.7 | 170.4 | 179.7 | 167.2 | -0.9 | 106.5 | A21 | R19-A21 PolarHBondContact O-N 3.42Å; R19-A21 VanDerWaalsContact O-N 3.08Å | ||
| 20 | P | 62 | Low | 68.4 | Low | 112 Ų | 112 | 124.4 Ų | 124.4 | 73% | 0.727 | 70% | 0.701 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 123.1 | 175.9 | 23 | -31.1 | 0 | 0 | 0 | 107 | A18 | A18-P20 WeakPolarHBondContact O-CD 3.46Š|
| 21 | A | 70.7 | Confident | 67.9 | Low | 81 Ų | 81 | 120.9 Ų | 120.9 | 67% | 0.669 | 69% | 0.692 | S | S | * | * | P | Polyproline II helix | trans | -53.1 | 132.3 | 178.9 | 0 | 0 | 0 | 0 | 0 | 107.9 | R19 | R19-A21 PolarHBondContact O-N 3.42Å; R19-A21 VanDerWaalsContact O-N 3.08Å |
| 22 | P | 75.1 | Confident | 67.6 | Low | 104 Ų | 104 | 118.7 Ų | 118.7 | 68% | 0.675 | 69% | 0.685 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 141.3 | 179.3 | 21.5 | -31.4 | 0 | 0 | 0 | 108.9 | R24 | P22-R24 PolarHBondContact O-N 2.91Š|
| 23 | P | 72.8 | Confident | 67.3 | Low | 127 Ų | 127 | 119.3 Ų | 119.3 | 83% | 0.825 | 68% | 0.682 | S | S | * | * | P | Polyproline II helix | trans | -51.8 | 117.4 | 179.4 | 21 | -31.5 | 0 | 0 | 0 | 107.8 | A25 | P23-A25 PolarHBondContact O-N 2.82Å; P23-A25 VanDerWaalsContact O-N 3.1Å |
| 24 | R | 71.9 | Confident | 67.4 | Low | 227 Ų | 227 | 116.7 Ų | 116.7 | 86% | 0.857 | 67% | 0.672 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 124.1 | -177.7 | -64.1 | -175.6 | -177.4 | -133.3 | -0.4 | 106.7 | P22 R26 | P22-R24 PolarHBondContact O-N 2.91Å; R24-R26 PolarHBondContact O-N 2.92Å |
| 25 | A | 69.8 | Low | 68.1 | Low | 87 Ų | 87 | 116.4 Ų | 116.4 | 72% | 0.719 | 66% | 0.661 | S | S | * | * | P | Polyproline II helix | trans | -48.6 | 133.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 108.9 | P23 R27 | P23-A25 PolarHBondContact O-N 2.82Å; P23-A25 VanDerWaalsContact O-N 3.1Å; A25-R27 VanDerWaalsContact C-N 3.33Å; A25-R27 PolarHBondContact O-N 3.27Å |
| 26 | R | 66.3 | Low | 69.4 | Low | 222 Ų | 222 | 117.2 Ų | 117.2 | 84% | 0.838 | 65% | 0.647 | S | S | * | * | trans | -58 | 93.3 | -177.9 | -179.2 | 173.6 | 173.1 | 177.4 | -3.5 | 108.9 | R24 H28 | R24-R26 PolarHBondContact O-N 2.92Å; R26-H28 PolarHBondContact O-N 3.35Å | ||
| 27 | R | 71.4 | Confident | 70.5 | Confident | 169 Ų | 169 | 116.8 Ų | 116.8 | 64% | 0.638 | 64% | 0.636 | S | S | * | * | trans | -67.8 | 122.2 | 170.7 | -57.7 | -171.6 | -179.4 | -99.4 | -1.7 | 105.7 | A25 S29 D30 | A25-R27 VanDerWaalsContact C-N 3.33Å; A25-R27 PolarHBondContact O-N 3.27Å; R27-S29 WeakPolarHBondContact CB-OG 3.4Å; R27-S29 PolarHBondContact O-N 3.46Å; R27-D30 HydrophobicContact CB-CB 4.16Å; R27-D30 WeakPolarHBondContact CB-OD2 3.41Å; R27-D30 WeakPolarHBondContact CD-OD2 3.49Å; R27-D30 PolarHBondContact O-N 3.46Å | ||
| 28 | H | 66.1 | Low | 71.8 | Confident | 166 Ų | 166 | 116.2 Ų | 116.2 | 77% | 0.769 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.6 | -21.1 | 178.4 | -64.5 | -57.7 | 0 | 0 | 0 | 112.5 | R26 | R26-H28 PolarHBondContact O-N 3.35Š|
| 29 | S | 66.8 | Low | 73.1 | Confident | 61 Ų | 61 | 119.5 Ų | 119.5 | 43% | 0.427 | 62% | 0.62 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -71.9 | -37.7 | 172.3 | 54.3 | 0 | 0 | 0 | 0 | 114.3 | R27 G31 | R27-S29 WeakPolarHBondContact CB-OG 3.4Å; R27-S29 PolarHBondContact O-N 3.46Å; S29-G31 PolarHBondContact O-N 3.42Å |
| 30 | D | 66.6 | Low | 74.5 | Confident | 84 Ų | 84 | 114.3 Ų | 114.3 | 45% | 0.449 | 61% | 0.609 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -78.6 | -14.6 | -168 | -63.9 | -1.5 | 0 | 0 | 0 | 111.4 | R27 T34 | R27-D30 HydrophobicContact CB-CB 4.16Å; R27-D30 WeakPolarHBondContact CB-OD2 3.41Å; R27-D30 WeakPolarHBondContact CD-OD2 3.49Å; R27-D30 PolarHBondContact O-N 3.46Å; D30-T34 PolarHBondContact O-OG1 2.86Å |
| 31 | G | 69.4 | Low | 76 | Confident | 43 Ų | 43 | 117.5 Ų | 117.5 | 44% | 0.443 | 61% | 0.607 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -94.3 | -22.2 | -175.7 | 0 | 0 | 0 | 0 | 0 | 116.2 | S29 S35 | S29-G31 PolarHBondContact O-N 3.42Å; G31-S35 WeakPolarHBondContact O-CB 3.41Å; G31-S35 PolarHBondContact O-OG 2.87Å |
| 32 | T | 69.3 | Low | 77.1 | Confident | 85 Ų | 85 | 118.5 Ų | 118.5 | 52% | 0.521 | 60% | 0.597 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -104.7 | -46.3 | -172.9 | -48.5 | 0 | 0 | 0 | 0 | 112.6 | S35 E36 | T32-S35 PolarHBondContact O-OG 3.16Å; T32-E36 WeakPolarHBondContact O-CB 3.4Å; T32-E36 VanDerWaalsContact O-CG 3.31Å; T32-E36 WeakPolarHBondContact O-CG 3.39Å; T32-E36 PolarHBondContact O-N 2.99Å |
| 33 | F | 63.7 | Low | 78 | Confident | 161 Ų | 161 | 115.4 Ų | 115.4 | 71% | 0.706 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -74.1 | -36.4 | -177.1 | -66.5 | -74.4 | 0 | 0 | 0 | 112.5 | L37 | F33-L37 WeakPolarHBondContact O-CB 3.38Å; F33-L37 PolarHBondContact O-N 2.84Å; F33-L37 VanDerWaalsContact O-N 3.15Å |
| 34 | T | 76.2 | Confident | 79 | Confident | 85 Ų | 85 | 111.1 Ų | 111.1 | 52% | 0.521 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -75.3 | -36.5 | -178.6 | 70.1 | 0 | 0 | 0 | 0 | 111.6 | D30 S38 | D30-T34 PolarHBondContact O-OG1 2.86Å; T34-S38 WeakPolarHBondContact O-CB 3.46Å; T34-S38 PolarHBondContact O-N 3.3Å |
| 35 | S | 80.6 | Confident | 80.1 | Confident | 45 Ų | 45 | 108.2 Ų | 108.2 | 32% | 0.315 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -67.9 | -43.6 | 177.4 | 63.2 | 0 | 0 | 0 | 0 | 111.7 | G31 T32 S38 R39 | G31-S35 WeakPolarHBondContact O-CB 3.41Å; G31-S35 PolarHBondContact O-OG 2.87Å; T32-S35 PolarHBondContact O-OG 3.16Å; S35-S38 WeakPolarHBondContact O-CB 3.04Å; S35-S38 PolarHBondContact O-N 2.93Å; S35-R39 WeakPolarHBondContact O-CG 3.43Å; S35-R39 PolarHBondContact O-N 3.41Å |
| 36 | E | 86.6 | Confident | 81.4 | Confident | 85 Ų | 85 | 108.1 Ų | 108.1 | 40% | 0.397 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -68.8 | -41.6 | 179.3 | -70.3 | -59.4 | 109.6 | 0 | 0 | 111.5 | T32 S38 R39 L40 | T32-E36 WeakPolarHBondContact O-CB 3.4Å; T32-E36 VanDerWaalsContact O-CG 3.31Å; T32-E36 WeakPolarHBondContact O-CG 3.39Å; T32-E36 PolarHBondContact O-N 2.99Å; E36-S38 VanDerWaalsContact C-N 3.29Å; E36-S38 PolarHBondContact O-N 3.48Å; E36-R39 PolarHBondContact O-N 3.37Å; E36-R39 WeakPolarHBondContact OE1-CD 3.43Å; E36-R39 IonicContact OE1-NH1 3.11Å; E36-R39 PolarHBondContact OE1-NH1 3.31Å; E36-R39 VanDerWaalsContact OE1-NH1 3.11Å; E36-R39 IonicContact OE2-NH1 3.72Å; E36-L40 WeakPolarHBondContact O-CG 3.33Å; E36-L40 PolarHBondContact O-N 3.2Å |
| 37 | L | 87 | Confident | 82.6 | Confident | 97 Ų | 97 | 103.3 Ų | 103.3 | 51% | 0.508 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -60.9 | -39.9 | 172.6 | -179.8 | 60.4 | 0 | 0 | 0 | 111.7 | F33 L40 R41 | F33-L37 WeakPolarHBondContact O-CB 3.38Å; F33-L37 PolarHBondContact O-N 2.84Å; F33-L37 VanDerWaalsContact O-N 3.15Å; L37-L40 PolarHBondContact O-N 3.07Å; L37-R41 HydrophobicContact CD1-CG 4.28Å; L37-R41 WeakPolarHBondContact O-CB 3.46Å; L37-R41 VanDerWaalsContact O-CG 3.3Å; L37-R41 WeakPolarHBondContact O-CG 3.49Å; L37-R41 PolarHBondContact O-N 2.96Å |
| 38 | S | 88.6 | Confident | 83.6 | Confident | 75 Ų | 75 | 103.9 Ų | 103.9 | 52% | 0.524 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.4 | -43.3 | 174.6 | -167.5 | 0 | 0 | 0 | 0 | 111.6 | T34 S35 E36 R41 E42 | T34-S38 WeakPolarHBondContact O-CB 3.46Å; T34-S38 PolarHBondContact O-N 3.3Å; S35-S38 WeakPolarHBondContact O-CB 3.04Å; S35-S38 PolarHBondContact O-N 2.93Å; E36-S38 VanDerWaalsContact C-N 3.29Å; E36-S38 PolarHBondContact O-N 3.48Å; S38-R41 PolarHBondContact O-N 3.46Å; S38-E42 WeakPolarHBondContact O-CB 3.18Å; S38-E42 PolarHBondContact O-N 2.84Å |
| 39 | R | 89.8 | Confident | 84.9 | Confident | 159 Ų | 159 | 100.6 Ų | 100.6 | 60% | 0.6 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -63.1 | -44.6 | 176.7 | -74.1 | 174.6 | 93.6 | -152 | 6.6 | 112.1 | S35 E36 R41 E42 G43 | S35-R39 WeakPolarHBondContact O-CG 3.43Å; S35-R39 PolarHBondContact O-N 3.41Å; E36-R39 PolarHBondContact O-N 3.37Å; E36-R39 WeakPolarHBondContact OE1-CD 3.43Å; E36-R39 IonicContact OE1-NH1 3.11Å; E36-R39 PolarHBondContact OE1-NH1 3.31Å; E36-R39 VanDerWaalsContact OE1-NH1 3.11Å; E36-R39 IonicContact OE2-NH1 3.72Å; R39-R41 PolarHBondContact O-N 3.44Å; R39-E42 PolarHBondContact O-N 3.11Å; R39-G43 PolarHBondContact O-N 3.39Å |
| 40 | L | 93.8 | Very high | 86.1 | Confident | 126 Ų | 126 | 102 Ų | 102 | 66% | 0.66 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -60.7 | -44.4 | 177.3 | -71 | 174.4 | 0 | 0 | 0 | 111.7 | E36 L37 G43 A44 | E36-L40 WeakPolarHBondContact O-CG 3.33Å; E36-L40 PolarHBondContact O-N 3.2Å; L37-L40 PolarHBondContact O-N 3.07Å; L40-G43 PolarHBondContact O-N 2.9Å; L40-A44 PolarHBondContact O-N 3.17Å |
| 41 | R | 93.6 | Very high | 87.2 | Confident | 179 Ų | 179 | 103.2 Ų | 103.2 | 68% | 0.675 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -67.3 | -41 | 178.7 | -71 | 175.4 | 68.5 | 174 | 2.2 | 112.2 | L37 S38 R39 A44 R45 | L37-R41 HydrophobicContact CD1-CG 4.28Å; L37-R41 WeakPolarHBondContact O-CB 3.46Å; L37-R41 VanDerWaalsContact O-CG 3.3Å; L37-R41 WeakPolarHBondContact O-CG 3.49Å; L37-R41 PolarHBondContact O-N 2.96Å; S38-R41 PolarHBondContact O-N 3.46Å; R39-R41 PolarHBondContact O-N 3.44Å; R41-A44 PolarHBondContact O-N 2.82Å; R41-R45 WeakPolarHBondContact O-CB 3.35Å; R41-R45 PolarHBondContact O-N 3.42Å |
| 42 | E | 94.2 | Very high | 88.1 | Confident | 102 Ų | 102 | 103.4 Ų | 103.4 | 48% | 0.477 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.1 | -43.5 | 175.9 | -171.1 | 57 | -136.7 | 0 | 0 | 111 | S38 R39 A44 R45 L46 | S38-E42 WeakPolarHBondContact O-CB 3.18Å; S38-E42 PolarHBondContact O-N 2.84Å; R39-E42 PolarHBondContact O-N 3.11Å; E42-A44 PolarHBondContact O-N 3.44Å; E42-R45 WeakPolarHBondContact O-CB 3.14Å; E42-R45 PolarHBondContact O-N 3.15Å; E42-L46 WeakPolarHBondContact O-CB 3.16Å; E42-L46 PolarHBondContact O-N 3.42Å |
| 43 | G | 93.7 | Very high | 89 | Confident | 38 Ų | 38 | 103.9 Ų | 103.9 | 39% | 0.392 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -57.7 | -47.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | R39 L40 R45 L46 Q47 | R39-G43 PolarHBondContact O-N 3.39Å; L40-G43 PolarHBondContact O-N 2.9Å; G43-R45 VanDerWaalsContact C-N 3.34Å; G43-R45 PolarHBondContact O-N 3.5Å; G43-L46 PolarHBondContact O-N 3.44Å; G43-Q47 WeakPolarHBondContact O-CB 3.43Å; G43-Q47 PolarHBondContact O-N 3.03Å |
| 44 | A | 94.6 | Very high | 89.8 | Confident | 38 Ų | 38 | 99.9 Ų | 99.9 | 31% | 0.314 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.7 | -38.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | L40 R41 E42 R48 | L40-A44 PolarHBondContact O-N 3.17Å; R41-A44 PolarHBondContact O-N 2.82Å; E42-A44 PolarHBondContact O-N 3.44Å; A44-R48 WeakPolarHBondContact O-CG 3.33Å; A44-R48 PolarHBondContact O-N 3.23Å; A44-R48 VanDerWaalsContact O-N 3.11Å |
| 45 | R | 94.4 | Very high | 89.2 | Confident | 165 Ų | 165 | 98.6 Ų | 98.6 | 62% | 0.623 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -65.1 | -46.9 | 176 | -175.2 | -174.7 | -176.6 | -173.7 | 1 | 111.2 | R41 E42 G43 Q47 R48 L49 | R41-R45 WeakPolarHBondContact O-CB 3.35Å; R41-R45 PolarHBondContact O-N 3.42Å; E42-R45 WeakPolarHBondContact O-CB 3.14Å; E42-R45 PolarHBondContact O-N 3.15Å; G43-R45 VanDerWaalsContact C-N 3.34Å; G43-R45 PolarHBondContact O-N 3.5Å; R45-Q47 VanDerWaalsContact C-N 3.35Å; R45-R48 PolarHBondContact O-N 2.93Å; R45-L49 PolarHBondContact O-N 3.37Å |
| 46 | L | 96.1 | Very high | 88.4 | Confident | 86 Ų | 86 | 105.3 Ų | 105.3 | 45% | 0.45 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -60.9 | -45 | 177.2 | -179.9 | 61.8 | 0 | 0 | 0 | 110.9 | E42 G43 R48 L49 L50 | E42-L46 WeakPolarHBondContact O-CB 3.16Å; E42-L46 PolarHBondContact O-N 3.42Å; G43-L46 PolarHBondContact O-N 3.44Å; L46-R48 VanDerWaalsContact C-N 3.33Å; L46-R48 PolarHBondContact O-N 2.89Å; L46-L49 WeakPolarHBondContact O-CB 3.34Å; L46-L49 PolarHBondContact O-N 3.47Å; L46-L49 VanDerWaalsContact O-N 3.16Å; L46-L50 HydrophobicContact CD1-CD1 4.38Å; L46-L50 HydrophobicContact CD1-CG 4.28Å; L46-L50 HydrophobicContact CG-CD1 4.13Å; L46-L50 HydrophobicContact CG-CG 4.44Å; L46-L50 WeakPolarHBondContact O-CG 3.36Å; L46-L50 PolarHBondContact O-N 3.06Å |
| 47 | Q | 93.2 | Very high | 86.9 | Confident | 120 Ų | 120 | 109 Ų | 109 | 56% | 0.561 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -59.8 | -44 | 178.1 | -161.3 | -164.2 | -26.7 | 0 | 0 | 111.3 | G43 R45 L49 L50 Q51 | G43-Q47 WeakPolarHBondContact O-CB 3.43Å; G43-Q47 PolarHBondContact O-N 3.03Å; R45-Q47 VanDerWaalsContact C-N 3.35Å; Q47-L49 VanDerWaalsContact C-N 3.35Å; Q47-L50 PolarHBondContact O-N 3.42Å; Q47-Q51 WeakPolarHBondContact O-CB 3.3Å; Q47-Q51 VanDerWaalsContact O-CG 3.26Å; Q47-Q51 WeakPolarHBondContact O-CG 3.41Å; Q47-Q51 PolarHBondContact O-N 3.28Å; Q47-Q51 PolarHBondContact O-NE2 3.46Å |
| 48 | R | 92.1 | Very high | 85.3 | Confident | 182 Ų | 182 | 108.2 Ų | 108.2 | 69% | 0.687 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -63.2 | -40.5 | 175.8 | -72.8 | 177.3 | -167.7 | 144.1 | 3.2 | 112.3 | A44 R45 L46 Q51 G52 | A44-R48 WeakPolarHBondContact O-CG 3.33Å; A44-R48 PolarHBondContact O-N 3.23Å; A44-R48 VanDerWaalsContact O-N 3.11Å; R45-R48 PolarHBondContact O-N 2.93Å; L46-R48 VanDerWaalsContact C-N 3.33Å; L46-R48 PolarHBondContact O-N 2.89Å; R48-Q51 PolarHBondContact O-N 3.31Å; R48-G52 PolarHBondContact O-N 2.86Å |
| 49 | L | 92.8 | Very high | 83.8 | Confident | 97 Ų | 97 | 114.2 Ų | 114.2 | 51% | 0.508 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -62.5 | -46 | 176.6 | -179.8 | 144.4 | 0 | 0 | 0 | 111.1 | R45 L46 Q47 G52 L53 | R45-L49 PolarHBondContact O-N 3.37Å; L46-L49 WeakPolarHBondContact O-CB 3.34Å; L46-L49 PolarHBondContact O-N 3.47Å; L46-L49 VanDerWaalsContact O-N 3.16Å; Q47-L49 VanDerWaalsContact C-N 3.35Å; L49-G52 PolarHBondContact O-N 3.5Å; L49-L53 HydrophobicContact CD2-CD1 3.56Å; L49-L53 HydrophobicContact CD2-CG 4.43Å; L49-L53 HydrophobicContact CG-CD1 4.32Å; L49-L53 WeakPolarHBondContact O-CG 3.38Å; L49-L53 PolarHBondContact O-N 2.97Å |
| 50 | L | 92.8 | Very high | 82 | Confident | 89 Ų | 89 | 114.9 Ų | 114.9 | 47% | 0.466 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -63.4 | -43.5 | 176.7 | -68.9 | 174.9 | 0 | 0 | 0 | 111.8 | L46 Q47 G52 L53 V54 | L46-L50 HydrophobicContact CD1-CD1 4.38Å; L46-L50 HydrophobicContact CD1-CG 4.28Å; L46-L50 HydrophobicContact CG-CD1 4.13Å; L46-L50 HydrophobicContact CG-CG 4.44Å; L46-L50 WeakPolarHBondContact O-CG 3.36Å; L46-L50 PolarHBondContact O-N 3.06Å; Q47-L50 PolarHBondContact O-N 3.42Å; L50-G52 VanDerWaalsContact C-N 3.32Å; L50-G52 PolarHBondContact O-N 2.92Å; L50-L53 PolarHBondContact O-N 3.36Å; L50-V54 WeakPolarHBondContact O-CB 3.38Å; L50-V54 VanDerWaalsContact O-CG2 3.29Å; L50-V54 WeakPolarHBondContact O-CG2 3.39Å; L50-V54 PolarHBondContact O-N 3.33Å |
| 51 | Q | 89.6 | Confident | 79.9 | Confident | 111 Ų | 111 | 112.4 Ų | 112.4 | 52% | 0.519 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -59.4 | -42.4 | 175.1 | -74.3 | 165 | 97.6 | 0 | 0 | 111.8 | Q47 R48 L53 G55 | Q47-Q51 WeakPolarHBondContact O-CB 3.3Å; Q47-Q51 VanDerWaalsContact O-CG 3.26Å; Q47-Q51 WeakPolarHBondContact O-CG 3.41Å; Q47-Q51 PolarHBondContact O-N 3.28Å; Q47-Q51 PolarHBondContact O-NE2 3.46Å; R48-Q51 PolarHBondContact O-N 3.31Å; Q51-L53 VanDerWaalsContact C-N 3.35Å; Q51-L53 PolarHBondContact O-N 2.87Å; Q51-G55 PolarHBondContact O-N 2.78Å |
| 52 | G | 88.2 | Confident | 78 | Confident | 47 Ų | 47 | 107.9 Ų | 107.9 | 49% | 0.485 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -65.9 | -34.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | R48 L49 L50 K56 | R48-G52 PolarHBondContact O-N 2.86Å; L49-G52 PolarHBondContact O-N 3.5Å; L50-G52 VanDerWaalsContact C-N 3.32Å; L50-G52 PolarHBondContact O-N 2.92Å; G52-K56 PolarHBondContact O-N 3.12Å |
| 53 | L | 87.3 | Confident | 76.1 | Confident | 95 Ų | 95 | 112.1 Ų | 112.1 | 50% | 0.497 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -76.7 | -42.1 | 176.8 | -71.7 | 174.9 | 0 | 0 | 0 | 112.8 | L49 L50 Q51 K56 R57 | L49-L53 HydrophobicContact CD2-CD1 3.56Å; L49-L53 HydrophobicContact CD2-CG 4.43Å; L49-L53 HydrophobicContact CG-CD1 4.32Å; L49-L53 WeakPolarHBondContact O-CG 3.38Å; L49-L53 PolarHBondContact O-N 2.97Å; L50-L53 PolarHBondContact O-N 3.36Å; Q51-L53 VanDerWaalsContact C-N 3.35Å; Q51-L53 PolarHBondContact O-N 2.87Å; L53-K56 PolarHBondContact O-N 3.4Å; L53-R57 PolarHBondContact O-N 2.91Å |
| 54 | V | 80.1 | Confident | 74.2 | Confident | 77 Ų | 77 | 114.2 Ų | 114.2 | 47% | 0.467 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -68.7 | -42.5 | 178.2 | 172.7 | 0 | 0 | 0 | 0 | 110.5 | L50 K56 R57 S58 W68 | L50-V54 WeakPolarHBondContact O-CB 3.38Å; L50-V54 VanDerWaalsContact O-CG2 3.29Å; L50-V54 WeakPolarHBondContact O-CG2 3.39Å; L50-V54 PolarHBondContact O-N 3.33Å; V54-K56 PolarHBondContact O-N 3.21Å; V54-R57 PolarHBondContact O-N 3.3Å; V54-S58 PolarHBondContact O-N 2.91Å; V54-W68 HydrophobicContact CG1-CZ3 4.32Å |
| 55 | G | 65 | Low | 72.1 | Confident | 57 Ų | 57 | 114.1 Ų | 114.1 | 59% | 0.588 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -61.2 | -28.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | Q51 | Q51-G55 PolarHBondContact O-N 2.78Å |
| 56 | K | 62.3 | Low | 70.2 | Confident | 187 Ų | 187 | 111.5 Ų | 111.5 | 81% | 0.813 | 59% | 0.586 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.7 | -9.8 | 174.6 | -86.5 | -138.5 | 163.2 | -163.6 | 0 | 115.3 | G52 L53 V54 | G52-K56 PolarHBondContact O-N 3.12Å; L53-K56 PolarHBondContact O-N 3.4Å; V54-K56 PolarHBondContact O-N 3.21Å |
| 57 | R | 57 | Low | 67.8 | Low | 161 Ų | 161 | 110 Ų | 110 | 61% | 0.608 | 59% | 0.587 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.8 | -12.1 | 179 | -69.9 | -174.2 | -175.8 | -101.4 | 2.4 | 114.1 | L53 V54 E59 Q60 D61 | L53-R57 PolarHBondContact O-N 2.91Å; V54-R57 PolarHBondContact O-N 3.3Å; R57-E59 PolarHBondContact O-N 3.08Å; R57-Q60 PolarHBondContact O-N 2.9Å; R57-D61 PolarHBondContact O-N 3.28Å |
| 58 | S | 53.2 | Low | 65.6 | Low | 82 Ų | 82 | 108.6 Ų | 108.6 | 57% | 0.573 | 58% | 0.576 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.8 | -19.5 | -174.3 | -173 | 0 | 0 | 0 | 0 | 114.5 | V54 Q60 | V54-S58 PolarHBondContact O-N 2.91Å; S58-Q60 VanDerWaalsContact C-N 3.3Å |
| 59 | E | 55.4 | Low | 63.5 | Low | 201 Ų | 201 | 103.6 Ų | 103.6 | 94% | 0.939 | 57% | 0.57 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.4 | -14 | 179.8 | -149 | 165.2 | 162.1 | 0 | 0 | 112.5 | R57 | R57-E59 PolarHBondContact O-N 3.08Š|
| 60 | Q | 52.9 | Low | 61.5 | Low | 172 Ų | 172 | 109 Ų | 109 | 80% | 0.804 | 58% | 0.583 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -114.8 | -21 | -172 | -131.5 | 162.9 | 11.3 | 0 | 0 | 115 | R57 S58 | R57-Q60 PolarHBondContact O-N 2.9Å; S58-Q60 VanDerWaalsContact C-N 3.3Å |
| 61 | D | 49.6 | Very low | 59.5 | Low | 74 Ų | 74 | 110.1 Ų | 110.1 | 40% | 0.396 | 59% | 0.589 | S | S | . | * | trans | -143 | 65.8 | -174.2 | -67.3 | -52.5 | 0 | 0 | 0 | 113.5 | R57 E63 N64 S65 | R57-D61 PolarHBondContact O-N 3.28Å; D61-E63 PolarHBondContact O-N 3Å; D61-E63 VanDerWaalsContact O-N 3.16Å; D61-N64 HydrophobicContact CB-CB 4.3Å; D61-S65 PolarHBondContact O-OG 3.17Å | ||
| 62 | A | 52.9 | Low | 57.6 | Low | 85 Ų | 85 | 106.5 Ų | 106.5 | 70% | 0.702 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.2 | -16.1 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 63 | E | 55.7 | Low | 55.9 | Low | 190 Ų | 190 | 108.2 Ų | 108.2 | 89% | 0.888 | 59% | 0.591 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.1 | -23.5 | -171.1 | -35 | -173.6 | 159.8 | 0 | 0 | 113.4 | D61 | D61-E63 PolarHBondContact O-N 3Å; D61-E63 VanDerWaalsContact O-N 3.16Å |
| 64 | N | 54 | Low | 54 | Low | 82 Ų | 82 | 106.3 Ų | 106.3 | 44% | 0.439 | 59% | 0.594 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -94.8 | -14.2 | -175.5 | -167 | -25.8 | 0 | 0 | 0 | 112.3 | D61 T66 A67 W68 | D61-N64 HydrophobicContact CB-CB 4.3Å; N64-T66 PolarHBondContact O-N 3.38Å; N64-A67 PolarHBondContact O-N 3.48Å; N64-W68 HydrophobicContact CB-CZ2 4.35Å; N64-W68 PolarHBondContact O-NE1 2.88Å; N64-W68 PolarHBondContact OD1-NE1 3.03Å |
| 65 | S | 50.6 | Low | 52.7 | Low | 36 Ų | 36 | 109.1 Ų | 109.1 | 25% | 0.252 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -58.3 | -19.9 | -169.9 | -68.1 | 0 | 0 | 0 | 0 | 116.2 | D61 W68 S69 | D61-S65 PolarHBondContact O-OG 3.17Å; S65-W68 WeakPolarHBondContact OG-CH2 3.31Å; S65-W68 WeakPolarHBondContact OG-CZ2 3.47Å; S65-S69 PolarHBondContact O-OG 3.11Å |
| 66 | T | 53.7 | Low | 51.7 | Low | 110 Ų | 110 | 113.2 Ų | 113.2 | 68% | 0.675 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -80.2 | -24.9 | 178.5 | -41.5 | 0 | 0 | 0 | 0 | 113.1 | N64 | N64-T66 PolarHBondContact O-N 3.38Å |
| 67 | A | 45.5 | Very low | 50.8 | Low | 56 Ų | 56 | 108.9 Ų | 108.9 | 46% | 0.463 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -78.9 | -44.7 | -171.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | N64 R70 L71 | N64-A67 PolarHBondContact O-N 3.48Å; A67-R70 PolarHBondContact O-N 3.15Å; A67-L71 PolarHBondContact O-N 2.9Å |
| 68 | W | 46.2 | Very low | 50.4 | Low | 89 Ų | 89 | 107.1 Ų | 107.1 | 34% | 0.337 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -78.1 | -25.2 | 179.7 | 14 | -73.6 | 0 | 0 | 0 | 112.9 | V54 N64 S65 R70 L71 G72 | V54-W68 HydrophobicContact CG1-CZ3 4.32Å; N64-W68 HydrophobicContact CB-CZ2 4.35Å; N64-W68 PolarHBondContact O-NE1 2.88Å; N64-W68 PolarHBondContact OD1-NE1 3.03Å; S65-W68 WeakPolarHBondContact OG-CH2 3.31Å; S65-W68 WeakPolarHBondContact OG-CZ2 3.47Å; W68-R70 VanDerWaalsContact C-N 3.3Å; W68-R70 PolarHBondContact O-N 2.96Å; W68-L71 PolarHBondContact O-N 2.95Å; W68-G72 PolarHBondContact O-N 2.64Å |
| 69 | S | 49 | Very low | 50.4 | Low | 78 Ų | 78 | 108.8 Ų | 108.8 | 55% | 0.545 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -63.2 | -35.8 | 172 | -61 | 0 | 0 | 0 | 0 | 111.8 | S65 A73 | S65-S69 PolarHBondContact O-OG 3.11Å; S69-A73 PolarHBondContact O-N 2.85Å |
| 70 | R | 51.3 | Low | 49.9 | Very low | 210 Ų | 210 | 101.5 Ų | 101.5 | 79% | 0.792 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -73.1 | -35.3 | 172.6 | -97.1 | 175.6 | 84.5 | 158.2 | 2.8 | 113.3 | A67 W68 | A67-R70 PolarHBondContact O-N 3.15Å; W68-R70 VanDerWaalsContact C-N 3.3Å; W68-R70 PolarHBondContact O-N 2.96Å |
| 71 | L | 49.8 | Very low | 49.7 | Very low | 112 Ų | 112 | 98.3 Ų | 98.3 | 59% | 0.586 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -70.6 | -35.8 | 177.2 | -86.4 | 150 | 0 | 0 | 0 | 112.4 | A67 W68 A73 G74 L75 | A67-L71 PolarHBondContact O-N 2.9Å; W68-L71 PolarHBondContact O-N 2.95Å; L71-A73 VanDerWaalsContact C-N 3.34Å; L71-A73 PolarHBondContact O-N 3.25Å; L71-G74 PolarHBondContact O-N 3.28Å; L71-L75 HydrophobicContact CD2-CD1 4.27Å; L71-L75 WeakPolarHBondContact O-CB 3.49Å; L71-L75 PolarHBondContact O-N 3.1Å; L71-L75 VanDerWaalsContact O-N 3.07Å |
| 72 | G | 49.9 | Very low | 49.9 | Very low | 35 Ų | 35 | 101.8 Ų | 101.8 | 36% | 0.361 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -66.6 | -32 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | W68 G74 L76 | W68-G72 PolarHBondContact O-N 2.64Å; G72-G74 VanDerWaalsContact C-N 3.32Å; G72-G74 PolarHBondContact O-N 2.77Å; G72-L76 WeakPolarHBondContact O-CG 3.49Å |
| 73 | A | 51.6 | Low | 49.7 | Very low | 84 Ų | 84 | 103.5 Ų | 103.5 | 69% | 0.694 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -71.4 | -25 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | S69 L71 | S69-A73 PolarHBondContact O-N 2.85Å; L71-A73 VanDerWaalsContact C-N 3.34Å; L71-A73 PolarHBondContact O-N 3.25Å |
| 74 | G | 47.8 | Very low | 49.5 | Very low | 54 Ų | 54 | 99.4 Ų | 99.4 | 56% | 0.557 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -96.8 | -23 | 179.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | L71 G72 | L71-G74 PolarHBondContact O-N 3.28Å; G72-G74 VanDerWaalsContact C-N 3.32Å; G72-G74 PolarHBondContact O-N 2.77Å |
| 75 | L | 52.7 | Low | 49.5 | Very low | 136 Ų | 136 | 100.6 Ų | 100.6 | 71% | 0.712 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -94 | -10.2 | -177.9 | -85.6 | 158.8 | 0 | 0 | 0 | 114.4 | L71 C77 | L71-L75 HydrophobicContact CD2-CD1 4.27Å; L71-L75 WeakPolarHBondContact O-CB 3.49Å; L71-L75 PolarHBondContact O-N 3.1Å; L71-L75 VanDerWaalsContact O-N 3.07Å; L75-C77 PolarHBondContact O-N 3.02Å; L75-C77 VanDerWaalsContact O-N 3.15Å |
| 76 | L | 45.8 | Very low | 49.5 | Very low | 143 Ų | 143 | 105 Ų | 105 | 75% | 0.749 | 64% | 0.643 | S | S | * | * | trans | -86.1 | 64 | 166.6 | -62.6 | 174.1 | 0 | 0 | 0 | 109 | G72 P78 | G72-L76 WeakPolarHBondContact O-CG 3.49Å; L76-P78 WeakPolarHBondContact O-CD 2.98Å | ||
| 77 | C | 41.4 | Very low | 49.4 | Very low | 97 Ų | 97 | 106.2 Ų | 106.2 | 66% | 0.655 | 64% | 0.641 | S | S | * | * | trans | -63 | 120 | 160.3 | -66.1 | 0 | 0 | 0 | 0 | 107.4 | L75 S79 | L75-C77 PolarHBondContact O-N 3.02Å; L75-C77 VanDerWaalsContact O-N 3.15Å; C77-S79 PolarHBondContact O-N 2.93Å | ||
| 78 | P | 48.8 | Very low | 49.5 | Very low | 123 Ų | 123 | 108.2 Ų | 108.2 | 80% | 0.799 | 66% | 0.658 | S | S | * | * | trans | -74.3 | 73 | 152.1 | 31.7 | -23.8 | 0 | 0 | 0 | 106.1 | L76 G80 | L76-P78 WeakPolarHBondContact O-CD 2.98Å; P78-G80 PolarHBondContact O-N 3.32Å | ||
| 79 | S | 53.3 | Low | 49.9 | Very low | 117 Ų | 117 | 112.3 Ų | 112.3 | 82% | 0.818 | 67% | 0.673 | S | S | * | * | trans | -77.7 | 83.4 | 163.4 | -164.5 | 0 | 0 | 0 | 0 | 106.6 | C77 | C77-S79 PolarHBondContact O-N 2.93Š| ||
| 80 | G | 45.8 | Very low | 49.8 | Very low | 48 Ų | 48 | 112.6 Ų | 112.6 | 50% | 0.495 | 67% | 0.667 | S | S | . | * | trans | -168.9 | 46.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 106.4 | P78 D82 | P78-G80 PolarHBondContact O-N 3.32Å; G80-D82 PolarHBondContact O-N 3.28Å | ||
| 81 | S | 49.1 | Very low | 49.6 | Very low | 105 Ų | 105 | 107.4 Ų | 107.4 | 73% | 0.734 | 66% | 0.661 | S | S | * | * | trans | -70.2 | 56.5 | 166.5 | 59.6 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 82 | D | 53 | Low | 49.8 | Very low | 147 Ų | 147 | 110.2 Ų | 110.2 | 79% | 0.786 | 68% | 0.675 | S | S | * | * | trans | -108.8 | 74.6 | 154.8 | -70.3 | -46.4 | 0 | 0 | 0 | 104.2 | G80 P84 | G80-D82 PolarHBondContact O-N 3.28Å; D82-P84 WeakPolarHBondContact O-CD 3.33Å; D82-P84 VanDerWaalsContact O-N 3.16Å | ||
| 83 | T | 49.5 | Very low | 50.1 | Low | 121 Ų | 121 | 112.5 Ų | 112.5 | 74% | 0.742 | 70% | 0.699 | S | S | * | * | trans | -62.2 | 106.1 | 154.3 | 41.3 | 0 | 0 | 0 | 0 | 105.2 | T85 | T83-T85 PolarHBondContact O-N 2.95Š| ||
| 84 | P | 51.5 | Low | 50.3 | Low | 105 Ų | 105 | 112 Ų | 112 | 68% | 0.682 | 70% | 0.702 | S | S | * | * | trans | -62.2 | 116.4 | 163.4 | 28.9 | -31.9 | 0 | 0 | 0 | 104.1 | D82 L86 | D82-P84 WeakPolarHBondContact O-CD 3.33Å; D82-P84 VanDerWaalsContact O-N 3.16Å; P84-L86 PolarHBondContact O-N 2.65Å | ||
| 85 | T | 54.3 | Low | 50.6 | Low | 106 Ų | 106 | 114.8 Ų | 114.8 | 65% | 0.65 | 72% | 0.72 | S | S | * | * | trans | -52.5 | 86.4 | 175.2 | -49.8 | 0 | 0 | 0 | 0 | 108.6 | T83 Q87 A88 | T83-T85 PolarHBondContact O-N 2.95Å; T85-Q87 HydrophobicContact CG2-CB 3.76Å; T85-Q87 HydrophobicContact CG2-CG 4.18Å; T85-Q87 PolarHBondContact O-N 3.37Å; T85-A88 PolarHBondContact O-N 2.74Å | ||
| 86 | L | 49.7 | Very low | 50.1 | Low | 129 Ų | 129 | 118.4 Ų | 118.4 | 68% | 0.675 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.3 | 34 | 166.8 | -75.7 | 176.6 | 0 | 0 | 0 | 110.1 | P84 W89 | P84-L86 PolarHBondContact O-N 2.65Å; L86-W89 VanDerWaalsContact O-CD1 3.24Å; L86-W89 PolarHBondContact O-NE1 3.31Å |
| 87 | Q | 52.2 | Low | 50.2 | Low | 135 Ų | 135 | 116 Ų | 116 | 63% | 0.631 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.5 | -10.3 | 171.6 | -60.2 | -73.7 | 11.5 | 0 | 0 | 111.1 | T85 W89 M90 | T85-Q87 HydrophobicContact CG2-CB 3.76Å; T85-Q87 HydrophobicContact CG2-CG 4.18Å; T85-Q87 PolarHBondContact O-N 3.37Å; Q87-W89 PolarHBondContact O-N 3.35Å; Q87-M90 PolarHBondContact O-N 2.82Å |
| 88 | A | 47.8 | Very low | 50.9 | Low | 98 Ų | 98 | 115.3 Ų | 115.3 | 81% | 0.81 | 71% | 0.713 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.1 | -14.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 114 | T85 | T85-A88 PolarHBondContact O-N 2.74Š|
| 89 | W | 53.1 | Low | 51.2 | Low | 175 Ų | 175 | 121.4 Ų | 121.4 | 66% | 0.663 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.3 | -0.3 | 177.8 | 68.7 | -73.9 | 0 | 0 | 0 | 113.2 | L86 Q87 P91 | L86-W89 VanDerWaalsContact O-CD1 3.24Å; L86-W89 PolarHBondContact O-NE1 3.31Å; Q87-W89 PolarHBondContact O-N 3.35Å; W89-P91 WeakPolarHBondContact O-CD 3.38Å |
| 90 | M | 47.4 | Very low | 51.2 | Low | 85 Ų | 85 | 122.7 Ų | 122.7 | 42% | 0.419 | 72% | 0.718 | S | S | . | * | S | Bend | trans | -88.2 | 114.8 | 169.1 | -69.7 | -72.4 | 98.4 | 0 | 0 | 108 | Q87 L92 | Q87-M90 PolarHBondContact O-N 2.82Å; M90-L92 PolarHBondContact O-N 3.05Å |
| 91 | P | 47.4 | Very low | 51.4 | Low | 101 Ų | 101 | 125.7 Ų | 125.7 | 66% | 0.656 | 73% | 0.728 | S | S | * | * | trans | -68.3 | 109.4 | 169.7 | -10.2 | 26.8 | 0 | 0 | 0 | 107.2 | W89 G93 | W89-P91 WeakPolarHBondContact O-CD 3.38Å; P91-G93 PolarHBondContact O-N 3.35Å | ||
| 92 | L | 53.3 | Low | 51.4 | Low | 170 Ų | 170 | 127.1 Ų | 127.1 | 89% | 0.89 | 74% | 0.735 | S | S | * | * | trans | -53.5 | 131.9 | 164.8 | -125.5 | 71.7 | 0 | 0 | 0 | 107.6 | M90 | M90-L92 PolarHBondContact O-N 3.05Š| ||
| 93 | G | 57.3 | Low | 51.2 | Low | 84 Ų | 84 | 122.6 Ų | 122.6 | 87% | 0.866 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -37.1 | 130.1 | -163 | 0 | 0 | 0 | 0 | 0 | 116.6 | P91 | P91-G93 PolarHBondContact O-N 3.35Š|
| 94 | G | 56.2 | Low | 51.1 | Low | 73 Ų | 73 | 123.1 Ų | 123.1 | 75% | 0.753 | 73% | 0.729 | S | S | * | * | S | Bend | trans | 145.5 | 87.5 | 165.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||
| 95 | A | 53.4 | Low | 50.8 | Low | 112 Ų | 112 | 129.1 Ų | 129.1 | 93% | 0.926 | 74% | 0.738 | S | S | * | * | trans | 61.5 | 71.8 | 158.5 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 96 | W | 42.9 | Very low | 50.5 | Low | 213 Ų | 213 | 130.5 Ų | 130.5 | 81% | 0.807 | 75% | 0.748 | S | S | * | * | trans | -120.5 | 120.7 | 149.8 | 161 | -79.1 | 0 | 0 | 0 | 108.2 | P98 | W96-P98 HydrophobicContact CZ2-CB 4.09Š| ||
| 97 | S | 46.8 | Very low | 50.7 | Low | 93 Ų | 93 | 127.9 Ų | 127.9 | 65% | 0.65 | 75% | 0.753 | S | S | * | * | trans | -136.3 | 116.9 | 167.4 | -157.6 | 0 | 0 | 0 | 0 | 106.6 | W99 | S97-W99 PolarHBondContact O-N 3.14Å; S97-W99 VanDerWaalsContact O-N 3.14Å | ||
| 98 | P | 55.7 | Low | 50.2 | Low | 81 Ų | 81 | 127.3 Ų | 127.3 | 53% | 0.526 | 76% | 0.758 | S | S | . | * | trans | -78.1 | 104 | -178.4 | 28.6 | -27.1 | 0 | 0 | 0 | 108.6 | W96 L100 | W96-P98 HydrophobicContact CZ2-CB 4.09Å; P98-L100 PolarHBondContact O-N 3.42Å | ||
| 99 | W | 55.4 | Low | 50.2 | Low | 252 Ų | 252 | 130.9 Ų | 130.9 | 96% | 0.955 | 76% | 0.76 | S | S | * | * | trans | 38.3 | 77.9 | 160.5 | -71.9 | 83.6 | 0 | 0 | 0 | 116.1 | S97 | S97-W99 PolarHBondContact O-N 3.14Å; S97-W99 VanDerWaalsContact O-N 3.14Å | ||
| 100 | L | 53 | Low | 49.7 | Very low | 144 Ų | 144 | 128 Ų | 128 | 75% | 0.754 | 76% | 0.762 | S | S | * | * | trans | -101.9 | 133.3 | 150.4 | -73.3 | 157.8 | 0 | 0 | 0 | 106.9 | P98 | P98-L100 PolarHBondContact O-N 3.42Š| ||
| 101 | P | 50.7 | Low | 49.6 | Very low | 110 Ų | 110 | 129.1 Ų | 129.1 | 71% | 0.714 | 78% | 0.778 | S | S | * | * | trans | -58.4 | 143.6 | 170.1 | 26 | -32 | 0 | 0 | 0 | 108.6 | G103 | P101-G103 PolarHBondContact O-N 2.79Š| ||
| 102 | P | 48.8 | Very low | 50 | Low | 135 Ų | 135 | 132.1 Ų | 132.1 | 88% | 0.877 | 78% | 0.783 | S | S | * | * | trans | -63.5 | 97.2 | -179.4 | 24.2 | -31.3 | 0 | 0 | 0 | 109.8 | ||||
| 103 | G | 48.2 | Very low | 49.4 | Very low | 52 Ų | 52 | 130 Ų | 130 | 54% | 0.536 | 78% | 0.779 | S | S | . | * | P | Polyproline II helix | trans | -72.8 | 145.4 | 165.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | P101 R105 | P101-G103 PolarHBondContact O-N 2.79Å; G103-R105 PolarHBondContact O-N 3.23Å |
| 104 | P | 48.2 | Very low | 48.8 | Very low | 133 Ų | 133 | 130.1 Ų | 130.1 | 86% | 0.864 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 124.2 | -177.9 | 25.2 | -33 | 0 | 0 | 0 | 110.2 | ||
| 105 | R | 44.5 | Very low | 47.8 | Very low | 230 Ų | 230 | 130.2 Ų | 130.2 | 87% | 0.868 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -69.9 | 132.9 | -178.7 | -75.3 | -176.8 | 158.8 | 152.3 | -3.6 | 110.8 | G103 G107 | G103-R105 PolarHBondContact O-N 3.23Å; R105-G107 PolarHBondContact O-N 3.44Å |
| 106 | P | 49.7 | Very low | 47.1 | Very low | 135 Ų | 135 | 129.6 Ų | 129.6 | 88% | 0.877 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.2 | 118.7 | 166.4 | 31.9 | -29.6 | 0 | 0 | 0 | 107.5 | ||
| 107 | G | 52.4 | Low | 47.1 | Very low | 75 Ų | 75 | 124.3 Ų | 124.3 | 77% | 0.773 | 77% | 0.77 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 139.9 | 7.4 | 173.1 | 0 | 0 | 0 | 0 | 0 | 117.4 | R105 M109 | R105-G107 PolarHBondContact O-N 3.44Å; G107-M109 PolarHBondContact O-N 3.29Å |
| 108 | V | 41.4 | Very low | 47.1 | Very low | 123 Ų | 123 | 124.4 Ų | 124.4 | 75% | 0.745 | 78% | 0.776 | S | S | * | * | trans | -85.6 | 89.5 | 157 | 173.2 | 0 | 0 | 0 | 0 | 107.1 | V110 | V108-V110 HydrophobicContact CG1-CB 4.19Å; V108-V110 HydrophobicContact CG1-CG2 3.84Å; V108-V110 PolarHBondContact O-N 3.02Å | ||
| 109 | M | 49.3 | Very low | 46.4 | Very low | 173 Ų | 173 | 130 Ų | 130 | 85% | 0.852 | 80% | 0.796 | S | S | * | * | trans | -66.5 | 90.1 | 151 | -73.8 | -126.6 | 75 | 0 | 0 | 106.3 | G107 S111 | G107-M109 PolarHBondContact O-N 3.29Å; M109-S111 PolarHBondContact O-N 3.29Å | ||
| 110 | V | 41.8 | Very low | 46 | Very low | 115 Ų | 115 | 121.2 Ų | 121.2 | 70% | 0.697 | 78% | 0.783 | S | S | * | * | trans | -70.5 | 113 | 156.8 | 134.4 | 0 | 0 | 0 | 0 | 105 | V108 E112 | V108-V110 HydrophobicContact CG1-CB 4.19Å; V108-V110 HydrophobicContact CG1-CG2 3.84Å; V108-V110 PolarHBondContact O-N 3.02Å; V110-E112 PolarHBondContact O-N 3.2Å | ||
| 111 | S | 46.3 | Very low | 45.7 | Very low | 107 Ų | 107 | 121 Ų | 121 | 75% | 0.748 | 79% | 0.788 | S | S | * | * | trans | -56.3 | 118.1 | 168.3 | -56.6 | 0 | 0 | 0 | 0 | 108.3 | M109 P113 | M109-S111 PolarHBondContact O-N 3.29Å; S111-P113 VanDerWaalsContact O-CD 3.24Å; S111-P113 WeakPolarHBondContact O-CD 3.24Å | ||
| 112 | E | 53.9 | Low | 45.5 | Very low | 165 Ų | 165 | 122.9 Ų | 122.9 | 77% | 0.771 | 79% | 0.791 | S | S | * | * | trans | -69.2 | 118.1 | 163.7 | -178.1 | -169.8 | 116.8 | 0 | 0 | 108 | V110 A114 | V110-E112 PolarHBondContact O-N 3.2Å; E112-A114 PolarHBondContact O-N 3.31Å | ||
| 113 | P | 42.6 | Very low | 45.2 | Very low | 124 Ų | 124 | 127.1 Ų | 127.1 | 81% | 0.805 | 79% | 0.789 | S | S | * | * | trans | -79.5 | 102.8 | 160 | 30.2 | -28.8 | 0 | 0 | 0 | 108.1 | S111 | S111-P113 VanDerWaalsContact O-CD 3.24Å; S111-P113 WeakPolarHBondContact O-CD 3.24Å | ||
| 114 | A | 43.4 | Very low | 45.7 | Very low | 87 Ų | 87 | 129.4 Ų | 129.4 | 72% | 0.719 | 80% | 0.795 | S | S | * | * | trans | -69 | 129.8 | 164 | 0 | 0 | 0 | 0 | 0 | 109.7 | E112 | E112-A114 PolarHBondContact O-N 3.31Š| ||
| 115 | G | 36.2 | Very low | 45.4 | Very low | 75 Ų | 75 | 138.4 Ų | 138.4 | 77% | 0.773 | 81% | 0.812 | S | S | * | * | trans | 133.7 | 100.2 | 158.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 116 | A | 38.8 | Very low | 45.5 | Very low | 99 Ų | 99 | 133.9 Ų | 133.9 | 82% | 0.818 | 81% | 0.809 | S | S | * | * | 157.3 | 122.7 | 94.6 | 0 | 0 | 0 | 0 | 0 | 111 | |||||
| 117 | A | 41.7 | Very low | 45.2 | Very low | 103 Ų | 103 | 133.8 Ų | 133.8 | 85% | 0.851 | 81% | 0.805 | S | S | * | * | trans | 7.2 | 122.5 | 141.1 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 118 | A | 47.5 | Very low | 44.8 | Very low | 94 Ų | 94 | 137.1 Ų | 137.1 | 78% | 0.777 | 81% | 0.807 | S | S | * | * | trans | -176.3 | 103.1 | 131.2 | 0 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 119 | E | 41 | Very low | 45 | Very low | 200 Ų | 200 | 137.9 Ų | 137.9 | 94% | 0.935 | 81% | 0.811 | S | S | * | * | 62.1 | 117 | 88.5 | -163.9 | 179.5 | 125.6 | 0 | 0 | 113 | |||||
| 120 | G | 46.4 | Very low | 44.8 | Very low | 66 Ų | 66 | 135.7 Ų | 135.7 | 68% | 0.68 | 81% | 0.808 | S | S | * | * | trans | 109.5 | 116.7 | 145 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 121 | T | 46.8 | Very low | 45 | Very low | 141 Ų | 141 | 137.1 Ų | 137.1 | 87% | 0.865 | 82% | 0.815 | S | S | * | * | trans | 109.4 | 87.1 | 136.5 | -42.1 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 122 | L | 46.3 | Very low | 44.9 | Very low | 148 Ų | 148 | 139.2 Ų | 139.2 | 78% | 0.775 | 82% | 0.82 | S | S | * | * | trans | 2.9 | 137 | 132.6 | -122.9 | 109.7 | 0 | 0 | 0 | 118.9 | ||||
| 123 | R | 42.1 | Very low | 44.2 | Very low | 225 Ų | 225 | 137.2 Ų | 137.2 | 85% | 0.849 | 82% | 0.824 | S | S | * | * | trans | 177.2 | 161.8 | 130.9 | -96.1 | -33.2 | -151.6 | 161.2 | 8.4 | 111.3 | ||||
| 124 | P | 59.5 | Low | 44.3 | Very low | 100 Ų | 100 | 138.3 Ų | 138.3 | 65% | 0.649 | 83% | 0.826 | S | S | * | * | -123.2 | 167.2 | -128.1 | 39.1 | -23.6 | 0 | 0 | 0 | 115 | |||||
| 125 | R | 42.3 | Very low | 44.4 | Very low | 322 Ų | 322 | 143 Ų | 143 | 100% | 1.215 | 84% | 0.835 | S | S | * | * | trans | -159.9 | 0 | 131.3 | -118.6 | -177.8 | 176.1 | 144.8 | 0.8 | 111.3 |
Retrieved 125 of 125 residues in 22.9 ms
(Link to these results)