| 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 | 36.8 | Very low | 50.7 | Low | 245 Ų | 245 | 142.6 Ų | 142.6 | 100% | 1.207 | 86% | 0.857 | S | S | * | * | 0 | 95.2 | 0 | -66.8 | -58.1 | 178.2 | 0 | 0 | 108.1 | |||||
| 2 | A | 36.5 | Very low | 50.9 | Low | 103 Ų | 103 | 150.4 Ų | 150.4 | 85% | 0.851 | 86% | 0.86 | S | S | * | * | trans | -91.8 | 117.6 | -176 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 3 | A | 42.9 | Very low | 51.1 | Low | 105 Ų | 105 | 151.8 Ų | 151.8 | 87% | 0.868 | 85% | 0.854 | S | S | * | * | trans | -87.9 | 108.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | G5 | A3-G5 PolarHBondContact O-N 3.32Š| ||
| 4 | V | 48.6 | Very low | 51.3 | Low | 146 Ų | 146 | 148.7 Ų | 148.7 | 89% | 0.885 | 85% | 0.848 | S | S | * | * | trans | -76.1 | 104.4 | 169 | 170.7 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 5 | G | 46.7 | Very low | 51.8 | Low | 67 Ų | 67 | 147.5 Ų | 147.5 | 69% | 0.691 | 84% | 0.844 | S | S | * | * | trans | -111 | 95.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | A3 L7 | A3-G5 PolarHBondContact O-N 3.32Å; G5-L7 PolarHBondContact O-N 3.24Å | ||
| 6 | S | 62 | Low | 52.2 | Low | 102 Ų | 102 | 146.1 Ų | 146.1 | 71% | 0.713 | 84% | 0.839 | S | S | * | * | trans | -67.5 | 105.1 | 173.9 | 163.6 | 0 | 0 | 0 | 0 | 111.2 | L8 | S6-L8 PolarHBondContact O-N 3.28Š| ||
| 7 | L | 57.5 | Low | 52.4 | Low | 175 Ų | 175 | 148.9 Ų | 148.9 | 92% | 0.916 | 84% | 0.84 | S | S | * | * | trans | -87.7 | 80.8 | 172 | -80.3 | 160.5 | 0 | 0 | 0 | 110.8 | G5 G9 | G5-L7 PolarHBondContact O-N 3.24Å; L7-G9 PolarHBondContact O-N 3.24Å | ||
| 8 | L | 57.1 | Low | 52.9 | Low | 166 Ų | 166 | 145.7 Ų | 145.7 | 87% | 0.869 | 84% | 0.835 | S | S | * | * | trans | -85.2 | 83.3 | 167.7 | -140.2 | 93.3 | 0 | 0 | 0 | 109.2 | S6 | S6-L8 PolarHBondContact O-N 3.28Š| ||
| 9 | G | 55.3 | Low | 53.3 | Low | 71 Ų | 71 | 145.7 Ų | 145.7 | 73% | 0.732 | 84% | 0.838 | S | S | * | * | trans | -98.7 | 87.7 | -174.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | L7 | L7-G9 PolarHBondContact O-N 3.24Š| ||
| 10 | R | 54.4 | Low | 53.9 | Low | 231 Ų | 231 | 141.1 Ų | 141.1 | 87% | 0.872 | 82% | 0.823 | S | S | * | * | trans | 30.2 | 90.4 | 151 | -63.2 | -173.9 | -177.1 | -149.3 | 2.4 | 118 | R12 | R10-R12 PolarHBondContact O-N 3.17Å; R10-R12 VanDerWaalsContact O-N 3.12Å | ||
| 11 | L | 59.5 | Low | 54.1 | Low | 158 Ų | 158 | 140.3 Ų | 140.3 | 83% | 0.827 | 82% | 0.823 | S | S | * | * | trans | -71.1 | 102.5 | 158 | -160.4 | 79.5 | 0 | 0 | 0 | 109 | Q13 | L11-Q13 PolarHBondContact O-N 3.12Å; L11-Q13 VanDerWaalsContact O-N 3.17Å | ||
| 12 | R | 53.8 | Low | 55.4 | Low | 236 Ų | 236 | 133.2 Ų | 133.2 | 89% | 0.891 | 80% | 0.803 | S | S | * | * | trans | -68 | 106.6 | 170.1 | -77.6 | -162.3 | 179.9 | -123.3 | 6.1 | 108.8 | R10 S14 | R10-R12 PolarHBondContact O-N 3.17Å; R10-R12 VanDerWaalsContact O-N 3.12Å; R12-S14 PolarHBondContact O-N 3.32Å | ||
| 13 | Q | 53.5 | Low | 56.4 | Low | 168 Ų | 168 | 136.3 Ų | 136.3 | 79% | 0.785 | 80% | 0.804 | S | S | * | * | trans | -77.5 | 110.1 | 166.7 | -67.7 | 180 | -4.4 | 0 | 0 | 108.3 | L11 T15 | L11-Q13 PolarHBondContact O-N 3.12Å; L11-Q13 VanDerWaalsContact O-N 3.17Å; Q13-T15 PolarHBondContact O-N 3.07Å | ||
| 14 | S | 52.9 | Low | 57.4 | Low | 109 Ų | 109 | 141.9 Ų | 141.9 | 76% | 0.762 | 80% | 0.803 | S | S | * | * | trans | -63 | 110.4 | 168.9 | 52.5 | 0 | 0 | 0 | 0 | 109 | R12 V16 | R12-S14 PolarHBondContact O-N 3.32Å; S14-V16 PolarHBondContact O-N 3.19Å; S14-V16 VanDerWaalsContact O-N 3.11Å | ||
| 15 | T | 60.1 | Low | 58 | Low | 130 Ų | 130 | 144.8 Ų | 144.8 | 80% | 0.798 | 80% | 0.798 | S | S | * | * | trans | -71.3 | 104.9 | 175.5 | -39.9 | 0 | 0 | 0 | 0 | 108.8 | Q13 K17 | Q13-T15 PolarHBondContact O-N 3.07Å; T15-K17 PolarHBondContact O-N 3.24Å; T15-K17 VanDerWaalsContact O-N 3.16Å | ||
| 16 | V | 58 | Low | 58.9 | Low | 125 Ų | 125 | 148.1 Ų | 148.1 | 76% | 0.758 | 80% | 0.799 | S | S | * | * | trans | -64.1 | 113.3 | 164.7 | 178.7 | 0 | 0 | 0 | 0 | 106.7 | S14 A18 | S14-V16 PolarHBondContact O-N 3.19Å; S14-V16 VanDerWaalsContact O-N 3.11Å; V16-A18 VanDerWaalsContact C-N 3.28Å; V16-A18 PolarHBondContact O-N 3.11Å | ||
| 17 | K | 55.4 | Low | 59 | Low | 195 Ų | 195 | 150.7 Ų | 150.7 | 85% | 0.848 | 80% | 0.799 | S | S | * | * | trans | -67 | 91.7 | 168.6 | -84.5 | -173.1 | 175.6 | -179.3 | 0 | 107.8 | T15 T19 | T15-K17 PolarHBondContact O-N 3.24Å; T15-K17 VanDerWaalsContact O-N 3.16Å; K17-T19 PolarHBondContact O-N 3.16Å | ||
| 18 | A | 60.5 | Low | 59.3 | Low | 91 Ų | 91 | 147.1 Ų | 147.1 | 75% | 0.752 | 79% | 0.785 | S | S | * | * | trans | -70.5 | 108.6 | 166.8 | 0 | 0 | 0 | 0 | 0 | 108.5 | V16 G20 | V16-A18 VanDerWaalsContact C-N 3.28Å; V16-A18 PolarHBondContact O-N 3.11Å; A18-G20 PolarHBondContact O-N 2.91Å | ||
| 19 | T | 61 | Low | 59.6 | Low | 146 Ų | 146 | 141.7 Ų | 141.7 | 90% | 0.896 | 76% | 0.761 | S | S | * | * | trans | -75.4 | 80.8 | 167.8 | -29.4 | 0 | 0 | 0 | 0 | 107.8 | K17 | K17-T19 PolarHBondContact O-N 3.16Š| ||
| 20 | G | 65.5 | Low | 60.1 | Low | 53 Ų | 53 | 144.5 Ų | 144.5 | 55% | 0.546 | 77% | 0.77 | S | S | . | * | trans | -73 | 150.1 | 172.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | A18 | A18-G20 PolarHBondContact O-N 2.91Š| ||
| 21 | P | 57.3 | Low | 60.6 | Low | 125 Ų | 125 | 145.2 Ų | 145.2 | 81% | 0.812 | 77% | 0.773 | S | S | * | * | trans | -61.9 | 144.9 | 179.5 | 27 | -33 | 0 | 0 | 0 | 110.6 | L23 | P21-L23 PolarHBondContact O-N 3.23Š| ||
| 22 | A | 64 | Low | 61.1 | Low | 95 Ų | 95 | 144.6 Ų | 144.6 | 79% | 0.785 | 76% | 0.759 | S | S | * | * | trans | -54.5 | 109.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | R24 | A22-R24 PolarHBondContact O-N 3.28Š| ||
| 23 | L | 59.3 | Low | 62.1 | Low | 169 Ų | 169 | 138.7 Ų | 138.7 | 89% | 0.885 | 76% | 0.761 | S | S | * | * | trans | -56.9 | 103.3 | 172.2 | -81.7 | 159.2 | 0 | 0 | 0 | 108.6 | P21 R25 | P21-L23 PolarHBondContact O-N 3.23Å; L23-R25 PolarHBondContact O-N 2.84Å | ||
| 24 | R | 62.5 | Low | 63.6 | Low | 221 Ų | 221 | 135 Ų | 135 | 83% | 0.834 | 75% | 0.746 | S | S | * | * | trans | -65.2 | 99.9 | 168.7 | -68.5 | -173.1 | 178.6 | -175.8 | -0.2 | 107.5 | A22 L26 | A22-R24 PolarHBondContact O-N 3.28Å; R24-L26 HydrophobicContact CB-CD1 4.04Å; R24-L26 HydrophobicContact CB-CG 4.05Å; R24-L26 PolarHBondContact O-N 2.78Å | ||
| 25 | R | 62.5 | Low | 65.1 | Low | 207 Ų | 207 | 135.1 Ų | 135.1 | 78% | 0.781 | 75% | 0.747 | S | S | * | * | trans | -73.6 | 66.9 | -178.3 | -159.1 | -172.3 | -62.2 | -108.6 | 4.4 | 109.7 | L23 T28 | L23-R25 PolarHBondContact O-N 2.84Å; R25-T28 HydrophobicContact CG-CG2 3.9Å | ||
| 26 | L | 65.2 | Low | 66.4 | Low | 137 Ų | 137 | 132.4 Ų | 132.4 | 72% | 0.717 | 73% | 0.734 | S | S | * | * | trans | -81.4 | -13.8 | -168.1 | -76.1 | 167.9 | 0 | 0 | 0 | 114.9 | R24 | R24-L26 HydrophobicContact CB-CD1 4.04Å; R24-L26 HydrophobicContact CB-CG 4.05Å; R24-L26 PolarHBondContact O-N 2.78Å | ||
| 27 | H | 64.3 | Low | 67.8 | Low | 156 Ų | 156 | 137.3 Ų | 137.3 | 72% | 0.722 | 74% | 0.739 | S | S | * | * | trans | -154 | 91.1 | 171.7 | -97.4 | -85.4 | 0 | 0 | 0 | 110.9 | ||||
| 28 | T | 62.4 | Low | 69.4 | Low | 100 Ų | 100 | 131.8 Ų | 131.8 | 61% | 0.613 | 73% | 0.729 | S | S | * | * | trans | -126 | 79.9 | 160.3 | 64.1 | 0 | 0 | 0 | 0 | 107.6 | R25 S30 | R25-T28 HydrophobicContact CG-CG2 3.9Å; T28-S30 PolarHBondContact O-N 2.76Å; T28-S30 VanDerWaalsContact O-N 3.16Å | ||
| 29 | S | 64.5 | Low | 70.7 | Confident | 52 Ų | 52 | 131 Ų | 131 | 36% | 0.364 | 72% | 0.718 | S | S | . | * | trans | -66.8 | 113.3 | 159.8 | 52.3 | 0 | 0 | 0 | 0 | 106.3 | W31 R32 | S29-W31 PolarHBondContact O-N 3.35Å; S29-R32 WeakPolarHBondContact OG-CD 3.49Å; S29-R32 WeakPolarHBondContact OG-CG 3.31Å; S29-R32 PolarHBondContact OG-NE 2.99Å | ||
| 30 | S | 65.1 | Low | 72.1 | Confident | 131 Ų | 131 | 131.6 Ų | 131.6 | 92% | 0.916 | 72% | 0.715 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.9 | -11.8 | -178 | 49.2 | 0 | 0 | 0 | 0 | 114.1 | T28 | T28-S30 PolarHBondContact O-N 2.76Å; T28-S30 VanDerWaalsContact O-N 3.16Å |
| 31 | W | 65.3 | Low | 73.4 | Confident | 246 Ų | 246 | 133 Ų | 133 | 93% | 0.932 | 71% | 0.713 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -135.9 | 51.5 | -170.9 | -161.3 | 8.8 | 0 | 0 | 0 | 113.1 | S29 | S29-W31 PolarHBondContact O-N 3.35Š|
| 32 | R | 70.5 | Confident | 75 | Confident | 145 Ų | 145 | 136.2 Ų | 136.2 | 55% | 0.547 | 71% | 0.709 | S | S | . | * | trans | -97.6 | 138.7 | 164.3 | -82.4 | -179.4 | -147 | -143.9 | 4.1 | 110.2 | S29 D34 | S29-R32 WeakPolarHBondContact OG-CD 3.49Å; S29-R32 WeakPolarHBondContact OG-CG 3.31Å; S29-R32 PolarHBondContact OG-NE 2.99Å; R32-D34 WeakPolarHBondContact CB-OD1 3.23Å; R32-D34 PolarHBondContact O-N 2.84Å | ||
| 33 | A | 74.3 | Confident | 76.5 | Confident | 112 Ų | 112 | 133.4 Ų | 133.4 | 93% | 0.926 | 68% | 0.682 | S | S | * | * | trans | -77.4 | 76.2 | 169.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 34 | D | 84.7 | Confident | 78.2 | Confident | 89 Ų | 89 | 134.2 Ų | 134.2 | 48% | 0.476 | 68% | 0.681 | S | S | . | * | trans | -81 | 139.9 | 178 | -61.5 | -35.8 | 0 | 0 | 0 | 110.5 | R32 S36 R37 | R32-D34 WeakPolarHBondContact CB-OD1 3.23Å; R32-D34 PolarHBondContact O-N 2.84Å; D34-S36 PolarHBondContact O-N 3.41Å; D34-R37 WeakPolarHBondContact O-CB 3.45Å; D34-R37 PolarHBondContact O-N 2.77Å | ||
| 35 | S | 84.2 | Confident | 79.8 | Confident | 113 Ų | 113 | 132.9 Ų | 132.9 | 79% | 0.79 | 68% | 0.676 | S | S | * | * | G | 310 helix | trans | -63 | -23.2 | 178.1 | 56 | 0 | 0 | 0 | 0 | 113.1 | R37 A38 | S35-R37 VanDerWaalsContact C-N 3.25Å; S35-R37 PolarHBondContact O-N 3.03Å; S35-A38 PolarHBondContact O-N 3.46Å |
| 36 | S | 87.4 | Confident | 81.4 | Confident | 73 Ų | 73 | 132.7 Ų | 132.7 | 51% | 0.51 | 68% | 0.684 | S | S | . | * | G | 310 helix | trans | -64.9 | -26.7 | 177 | 60.4 | 0 | 0 | 0 | 0 | 113.2 | D34 A38 S39 | D34-S36 PolarHBondContact O-N 3.41Å; S36-A38 PolarHBondContact O-N 2.92Å; S36-S39 PolarHBondContact O-N 3.38Å; S36-S39 VanDerWaalsContact O-N 3.16Å; S36-S39 PolarHBondContact O-OG 2.8Å |
| 37 | R | 87.8 | Confident | 82.8 | Confident | 228 Ų | 228 | 130.4 Ų | 130.4 | 86% | 0.86 | 69% | 0.685 | S | S | * | * | G | 310 helix | trans | -61.9 | -31.6 | -178.6 | -173.6 | 177.8 | 164.9 | 111.8 | -0.5 | 112.3 | D34 S35 | D34-R37 WeakPolarHBondContact O-CB 3.45Å; D34-R37 PolarHBondContact O-N 2.77Å; S35-R37 VanDerWaalsContact C-N 3.25Å; S35-R37 PolarHBondContact O-N 3.03Å |
| 38 | A | 89.5 | Confident | 84.3 | Confident | 78 Ų | 78 | 128.8 Ų | 128.8 | 65% | 0.645 | 67% | 0.673 | S | S | * | * | G | 310 helix | trans | -103.3 | 2.4 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | S35 S36 T41 | S35-A38 PolarHBondContact O-N 3.46Å; S36-A38 PolarHBondContact O-N 2.92Å; A38-T41 VanDerWaalsContact O-CG2 3.25Å; A38-T41 WeakPolarHBondContact O-CG2 3.39Å |
| 39 | S | 88.3 | Confident | 85.9 | Confident | 74 Ų | 74 | 126.3 Ų | 126.3 | 52% | 0.517 | 66% | 0.663 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -79.3 | -32.9 | -176 | 70.7 | 0 | 0 | 0 | 0 | 113 | S36 T41 | S36-S39 PolarHBondContact O-N 3.38Å; S36-S39 VanDerWaalsContact O-N 3.16Å; S36-S39 PolarHBondContact O-OG 2.8Å; S39-T41 PolarHBondContact O-N 3.39Å |
| 40 | L | 89.5 | Confident | 87.3 | Confident | 160 Ų | 160 | 132.4 Ų | 132.4 | 84% | 0.838 | 68% | 0.678 | S | S | * | * | S | Bend | trans | -89.8 | 95.9 | 179.7 | -61.8 | 179.6 | 0 | 0 | 0 | 110.6 | ||
| 41 | T | 92.6 | Very high | 88.7 | Confident | 81 Ų | 81 | 129.1 Ų | 129.1 | 50% | 0.497 | 65% | 0.65 | S | S | . | * | trans | -130.8 | 157.8 | -175.9 | 61.5 | 0 | 0 | 0 | 0 | 113.4 | A38 S39 R67 | A38-T41 VanDerWaalsContact O-CG2 3.25Å; A38-T41 WeakPolarHBondContact O-CG2 3.39Å; S39-T41 PolarHBondContact O-N 3.39Å; T41-R67 PolarHBondContact O-NH1 2.88Å; T41-R67 PolarHBondContact O-NH2 3.46Å; T41-R67 PolarHBondContact OG1-NH1 3.16Å | ||
| 42 | R | 92.4 | Very high | 90.1 | Very high | 193 Ų | 193 | 120.5 Ų | 120.5 | 73% | 0.728 | 62% | 0.617 | S | S | * | * | trans | -116.8 | 149.4 | 171.1 | -175.6 | 179.7 | 174 | -175.7 | -0.5 | 110.2 | H44 | R42-H44 PolarHBondContact O-CD2 2.87Å; R42-H44 PolarHBondContact O-N 2.85Å | ||
| 43 | V | 94.6 | Very high | 91.3 | Very high | 36 Ų | 36 | 118.5 Ų | 118.5 | 22% | 0.218 | 62% | 0.623 | C | S | . | * | trans | -71.5 | 121.6 | 170.4 | -179.6 | 0 | 0 | 0 | 0 | 109 | R45 Y48 L51 | V43-R45 HydrophobicContact CG1-CB 4.03Å; V43-R45 HydrophobicContact CG1-CG 4.42Å; V43-Y48 HydrophobicContact CB-CD1 4.24Å; V43-Y48 HydrophobicContact CB-CD2 4.15Å; V43-Y48 HydrophobicContact CB-CE1 4.16Å; V43-Y48 HydrophobicContact CB-CE2 4.1Å; V43-Y48 HydrophobicContact CB-CG 4.24Å; V43-Y48 HydrophobicContact CG1-CD1 3.79Å; V43-Y48 HydrophobicContact CG1-CD2 4.08Å; V43-Y48 HydrophobicContact CG1-CE1 4.2Å; V43-Y48 HydrophobicContact CG1-CE2 4.49Å; V43-Y48 HydrophobicContact CG1-CG 3.74Å; V43-Y48 HydrophobicContact CG2-CD2 4.25Å; V43-Y48 HydrophobicContact CG2-CE2 4.26Å; V43-L51 HydrophobicContact CG2-CD1 4.07Å | ||
| 44 | H | 95.6 | Very high | 92.3 | Very high | 186 Ų | 186 | 113.1 Ų | 113.1 | 86% | 0.861 | 58% | 0.579 | S | S | * | * | trans | -85.2 | -9 | -178.5 | -69.7 | -84.7 | 0 | 0 | 0 | 114.2 | R42 | R42-H44 PolarHBondContact O-CD2 2.87Å; R42-H44 PolarHBondContact O-N 2.85Å | ||
| 45 | R | 95.5 | Very high | 92.9 | Very high | 194 Ų | 194 | 111.3 Ų | 111.3 | 73% | 0.732 | 57% | 0.569 | S | S | * | * | trans | -68.6 | 141.2 | 176.3 | -65.6 | -177.8 | -179.9 | -175.2 | -2.1 | 110.2 | V43 Y48 | V43-R45 HydrophobicContact CG1-CB 4.03Å; V43-R45 HydrophobicContact CG1-CG 4.42Å; R45-Y48 VanDerWaalsContact O-CD1 3.27Å; R45-Y48 WeakPolarHBondContact O-CD1 3.27Å | ||
| 46 | Q | 95.4 | Very high | 93.4 | Very high | 203 Ų | 203 | 108.5 Ų | 108.5 | 95% | 0.949 | 54% | 0.544 | S | S | * | . | S | Bend | trans | -67.7 | -40.4 | 179.2 | -172.4 | 178.2 | 10.7 | 0 | 0 | 112.5 | ||
| 47 | A | 95.8 | Very high | 93.9 | Very high | 89 Ų | 89 | 106.5 Ų | 106.5 | 74% | 0.736 | 53% | 0.529 | S | S | * | . | S | Bend | trans | -118 | 124.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||
| 48 | Y | 95.8 | Very high | 94.3 | Very high | 121 Ų | 121 | 100.5 Ų | 100.5 | 48% | 0.475 | 51% | 0.509 | S | S | . | . | trans | -154.7 | 150.6 | 176 | 62.6 | -81.3 | 0 | 0 | 0 | 110.7 | V43 R45 | V43-Y48 HydrophobicContact CB-CD1 4.24Å; V43-Y48 HydrophobicContact CB-CD2 4.15Å; V43-Y48 HydrophobicContact CB-CE1 4.16Å; V43-Y48 HydrophobicContact CB-CE2 4.1Å; V43-Y48 HydrophobicContact CB-CG 4.24Å; V43-Y48 HydrophobicContact CG1-CD1 3.79Å; V43-Y48 HydrophobicContact CG1-CD2 4.08Å; V43-Y48 HydrophobicContact CG1-CE1 4.2Å; V43-Y48 HydrophobicContact CG1-CE2 4.49Å; V43-Y48 HydrophobicContact CG1-CG 3.74Å; V43-Y48 HydrophobicContact CG2-CD2 4.25Å; V43-Y48 HydrophobicContact CG2-CE2 4.26Å; R45-Y48 VanDerWaalsContact O-CD1 3.27Å; R45-Y48 WeakPolarHBondContact O-CD1 3.27Å | ||
| 49 | A | 94.3 | Very high | 94.5 | Very high | 48 Ų | 48 | 105.9 Ų | 105.9 | 40% | 0.397 | 52% | 0.521 | S | S | . | . | trans | -76.3 | 159.7 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111 | L51 | A49-L51 PolarHBondContact O-N 2.81Š| ||
| 50 | R | 94.3 | Very high | 94.9 | Very high | 181 Ų | 181 | 108.7 Ų | 108.7 | 68% | 0.683 | 53% | 0.53 | S | S | * | . | trans | -59.1 | 128.3 | 174.1 | -173.2 | 165.1 | 178 | -166.4 | 3.9 | 109.9 | Y52 | R50-Y52 HydrophobicContact CB-CE2 4.37Å; R50-Y52 VanDerWaalsContact CD-CZ 3.49Å; R50-Y52 VanDerWaalsContact CD-OH 3.23Å; R50-Y52 WeakPolarHBondContact CD-OH 3.29Å; R50-Y52 HydrophobicContact CG-CD2 4.44Å; R50-Y52 HydrophobicContact CG-CE1 4.22Å; R50-Y52 HydrophobicContact CG-CE2 3.86Å; R50-Y52 VanDerWaalsContact CZ-CE1 3.4Å; R50-Y52 VanDerWaalsContact CZ-OH 3.23Å; R50-Y52 VanDerWaalsContact NE-CE1 3.27Å; R50-Y52 VanDerWaalsContact NE-CZ 3.35Å; R50-Y52 PolarHBondContact NE-OH 2.91Å; R50-Y52 PolarHBondContact NH1-OH 2.98Å | ||
| 51 | L | 95.4 | Very high | 95 | Very high | 62 Ų | 62 | 103.6 Ų | 103.6 | 33% | 0.325 | 52% | 0.516 | S | S | . | . | trans | -111.2 | 130.1 | 175.8 | -60.1 | 172.8 | 0 | 0 | 0 | 109.1 | V43 A49 R67 Y68 R69 | V43-L51 HydrophobicContact CG2-CD1 4.07Å; A49-L51 PolarHBondContact O-N 2.81Å; L51-R67 HydrophobicContact CB-CB 3.91Å; L51-R67 HydrophobicContact CB-CG 4.48Å; L51-R67 HydrophobicContact CD1-CB 4.07Å; L51-Y68 CarbonylContact C-O 3.59Å; L51-Y68 VanDerWaalsContact CA-O 3.31Å; L51-Y68 WeakPolarHBondContact CA-O 3.27Å; L51-R69 HydrophobicContact CD2-CG 3.93Å | ||
| 52 | Y | 95 | Very high | 95.1 | Very high | 65 Ų | 65 | 102.1 Ų | 102.1 | 26% | 0.255 | 51% | 0.509 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.4 | 146 | 178.2 | -64 | -84.7 | 0 | 0 | 0 | 110.3 | R50 V54 R67 Y68 P71 | R50-Y52 HydrophobicContact CB-CE2 4.37Å; R50-Y52 VanDerWaalsContact CD-CZ 3.49Å; R50-Y52 VanDerWaalsContact CD-OH 3.23Å; R50-Y52 WeakPolarHBondContact CD-OH 3.29Å; R50-Y52 HydrophobicContact CG-CD2 4.44Å; R50-Y52 HydrophobicContact CG-CE1 4.22Å; R50-Y52 HydrophobicContact CG-CE2 3.86Å; R50-Y52 VanDerWaalsContact CZ-CE1 3.4Å; R50-Y52 VanDerWaalsContact CZ-OH 3.23Å; R50-Y52 VanDerWaalsContact NE-CE1 3.27Å; R50-Y52 VanDerWaalsContact NE-CZ 3.35Å; R50-Y52 PolarHBondContact NE-OH 2.91Å; R50-Y52 PolarHBondContact NH1-OH 2.98Å; Y52-V54 PolarHBondContact O-N 3.16Å; Y52-R67 WeakPolarHBondContact O-CA 3.46Å; Y52-Y68 PolarHBondContact N-O 3.33Å; Y52-Y68 PolarHBondContact O-N 2.85Å; Y52-P71 HydrophobicContact CD1-CB 4.19Å; Y52-P71 HydrophobicContact CD2-CB 3.7Å; Y52-P71 HydrophobicContact CD2-CG 4.26Å; Y52-P71 HydrophobicContact CE1-CB 4.38Å; Y52-P71 HydrophobicContact CE2-CB 3.91Å; Y52-P71 HydrophobicContact CE2-CG 4.09Å; Y52-P71 HydrophobicContact CG-CB 3.82Å |
| 53 | P | 94.5 | Very high | 95.3 | Very high | 102 Ų | 102 | 97.1 Ų | 97.1 | 66% | 0.662 | 50% | 0.5 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -67.6 | 123 | 169.5 | 29.5 | -32.1 | 0 | 0 | 0 | 108.8 | I66 | P53-I66 CarbonylContact C-O 3.54Å; P53-I66 WeakPolarHBondContact CA-O 3.25Å |
| 54 | V | 96.6 | Very high | 95.3 | Very high | 0 Ų | 0 | 99.6 Ų | 99.6 | 0% | 0 | 51% | 0.511 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.6 | 137.8 | 178.8 | -179.3 | 0 | 0 | 0 | 0 | 108.4 | Y52 L56 I66 R72 L75 | Y52-V54 PolarHBondContact O-N 3.16Å; V54-L56 PolarHBondContact O-N 2.88Å; V54-I66 HydrophobicContact CB-CG1 4.38Å; V54-I66 PolarHBondContact N-O 3.39Å; V54-I66 PolarHBondContact O-N 3.35Å; V54-R72 HydrophobicContact CG1-CB 4.19Å; V54-R72 WeakPolarHBondContact CG1-O 3.35Å; V54-R72 VanDerWaalsContact CG2-O 3.27Å; V54-R72 WeakPolarHBondContact CG2-O 3.46Å; V54-L75 HydrophobicContact CG1-CD1 4.09Å; V54-L75 HydrophobicContact CG1-CG 3.87Å |
| 55 | L | 96.1 | Very high | 95.3 | Very high | 50 Ų | 50 | 97.9 Ų | 97.9 | 26% | 0.262 | 50% | 0.503 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.9 | 111.1 | 175.9 | -169.6 | 68.6 | 0 | 0 | 0 | 109.4 | V57 M74 L75 | L55-V57 HydrophobicContact CD2-CG2 4.27Å; L55-V57 HydrophobicContact CG-CG2 4.24Å; L55-M74 CarbonylContact O-C 3.55Å; L55-M74 VanDerWaalsContact O-CA 3.29Å; L55-M74 WeakPolarHBondContact O-CA 3.48Å; L55-L75 PolarHBondContact O-N 2.88Å |
| 56 | L | 96.1 | Very high | 95.2 | Very high | 54 Ų | 54 | 91.1 Ų | 91.1 | 28% | 0.283 | 48% | 0.481 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.8 | 119.8 | 169.6 | 177.9 | 65.2 | 0 | 0 | 0 | 108.7 | V54 T63 I64 I66 L75 | V54-L56 PolarHBondContact O-N 2.88Å; L56-T63 CarbonylContact O-C 3.58Å; L56-T63 WeakPolarHBondContact O-CA 3.44Å; L56-I64 PolarHBondContact N-O 2.86Å; L56-I64 PolarHBondContact O-N 3.18Å; L56-I66 HydrophobicContact CB-CD1 4.11Å; L56-I66 HydrophobicContact CB-CG1 4.17Å; L56-I66 HydrophobicContact CB-CG2 4.34Å; L56-I66 HydrophobicContact CD2-CD1 4.38Å; L56-I66 HydrophobicContact CD2-CG2 4.48Å; L56-L75 HydrophobicContact CD1-CB 3.72Å |
| 57 | V | 96.8 | Very high | 95.2 | Very high | 32 Ų | 32 | 87.4 Ų | 87.4 | 19% | 0.194 | 46% | 0.458 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.1 | 122.3 | 174.2 | -172.7 | 0 | 0 | 0 | 0 | 107.2 | L55 S62 T63 M74 L75 | L55-V57 HydrophobicContact CD2-CG2 4.27Å; L55-V57 HydrophobicContact CG-CG2 4.24Å; V57-S62 WeakPolarHBondContact CA-O 3.5Å; V57-T63 HydrophobicContact CG1-CG2 4.37Å; V57-T63 HydrophobicContact CG2-CG2 4.11Å; V57-M74 HydrophobicContact CG2-CG 3.78Å; V57-M74 HydrophobicContact CG2-SD 3.75Å; V57-L75 PolarHBondContact N-O 2.69Å |
| 58 | K | 95.5 | Very high | 95.2 | Very high | 102 Ų | 102 | 87.2 Ų | 87.2 | 44% | 0.443 | 44% | 0.439 | S | S | . | . | trans | -84.8 | 161.5 | 174.1 | -56.6 | -176.6 | 75.5 | -152.7 | 0 | 109.5 | D60 G61 S62 | K58-D60 IonicContact NZ-OD2 3.19Å; K58-D60 PolarHBondContact O-N 3.13Å; K58-D60 VanDerWaalsContact O-N 3.13Å; K58-G61 WeakPolarHBondContact O-CA 3.42Å; K58-G61 PolarHBondContact O-N 2.93Å; K58-S62 WeakPolarHBondContact CB-OG 3.14Å; K58-S62 WeakPolarHBondContact CD-OG 3.15Å; K58-S62 PolarHBondContact N-O 3.44Å | ||
| 59 | Q | 95.3 | Very high | 95.1 | Very high | 191 Ų | 191 | 90.1 Ų | 90.1 | 89% | 0.893 | 45% | 0.449 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.1 | -29.8 | 176 | -66.5 | 178.6 | -12.9 | 0 | 0 | 112.9 | G61 | Q59-G61 PolarHBondContact O-N 2.9Å; Q59-G61 VanDerWaalsContact O-N 3.16Å |
| 60 | D | 95.4 | Very high | 95.1 | Very high | 133 Ų | 133 | 92 Ų | 92 | 71% | 0.711 | 45% | 0.45 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.5 | -2.1 | 174.9 | -45.3 | -44.9 | 0 | 0 | 0 | 113.7 | K58 S62 | K58-D60 IonicContact NZ-OD2 3.19Å; K58-D60 PolarHBondContact O-N 3.13Å; K58-D60 VanDerWaalsContact O-N 3.13Å; D60-S62 VanDerWaalsContact C-N 3.27Å; D60-S62 PolarHBondContact O-N 3.23Å |
| 61 | G | 92.8 | Very high | 94.9 | Very high | 52 Ų | 52 | 87.9 Ų | 87.9 | 54% | 0.536 | 45% | 0.447 | S | S | . | . | S | Bend | trans | 80.6 | -1.5 | -175.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | K58 Q59 | K58-G61 WeakPolarHBondContact O-CA 3.42Å; K58-G61 PolarHBondContact O-N 2.93Å; Q59-G61 PolarHBondContact O-N 2.9Å; Q59-G61 VanDerWaalsContact O-N 3.16Å |
| 62 | S | 94.6 | Very high | 94.8 | Very high | 50 Ų | 50 | 91 Ų | 91 | 35% | 0.35 | 45% | 0.454 | S | S | . | . | trans | -69.8 | 141 | 175.4 | 54.6 | 0 | 0 | 0 | 0 | 111.7 | V57 K58 D60 | V57-S62 WeakPolarHBondContact CA-O 3.5Å; K58-S62 WeakPolarHBondContact CB-OG 3.14Å; K58-S62 WeakPolarHBondContact CD-OG 3.15Å; K58-S62 PolarHBondContact N-O 3.44Å; D60-S62 VanDerWaalsContact C-N 3.27Å; D60-S62 PolarHBondContact O-N 3.23Å | ||
| 63 | T | 96.3 | Very high | 94.4 | Very high | 88 Ų | 88 | 99.3 Ų | 99.3 | 54% | 0.54 | 49% | 0.485 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.9 | 136.4 | -175.2 | 63.3 | 0 | 0 | 0 | 0 | 112 | L56 V57 | L56-T63 CarbonylContact O-C 3.58Å; L56-T63 WeakPolarHBondContact O-CA 3.44Å; V57-T63 HydrophobicContact CG1-CG2 4.37Å; V57-T63 HydrophobicContact CG2-CG2 4.11Å |
| 64 | I | 95.1 | Very high | 94.2 | Very high | 88 Ų | 88 | 99.8 Ų | 99.8 | 45% | 0.451 | 48% | 0.48 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -139 | 131.3 | -178.9 | -52.4 | 176.3 | 0 | 0 | 0 | 109.4 | L56 I66 | L56-I64 PolarHBondContact N-O 2.86Å; L56-I64 PolarHBondContact O-N 3.18Å; I64-I66 HydrophobicContact CG2-CG2 4.04Å; I64-I66 PolarHBondContact O-N 3.2Å |
| 65 | H | 94.4 | Very high | 93.8 | Very high | 150 Ų | 150 | 101.6 Ų | 101.6 | 69% | 0.694 | 49% | 0.489 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -79.4 | 112.4 | 170.8 | -70.3 | 103.5 | 0 | 0 | 0 | 110.1 | ||
| 66 | I | 94.6 | Very high | 93.2 | Very high | 52 Ų | 52 | 104.8 Ų | 104.8 | 27% | 0.267 | 52% | 0.523 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.2 | 156.5 | 176.8 | 65.7 | 164.4 | 0 | 0 | 0 | 111 | P53 V54 L56 I64 L75 | P53-I66 CarbonylContact C-O 3.54Å; P53-I66 WeakPolarHBondContact CA-O 3.25Å; V54-I66 HydrophobicContact CB-CG1 4.38Å; V54-I66 PolarHBondContact N-O 3.39Å; V54-I66 PolarHBondContact O-N 3.35Å; L56-I66 HydrophobicContact CB-CD1 4.11Å; L56-I66 HydrophobicContact CB-CG1 4.17Å; L56-I66 HydrophobicContact CB-CG2 4.34Å; L56-I66 HydrophobicContact CD2-CD1 4.38Å; L56-I66 HydrophobicContact CD2-CG2 4.48Å; I64-I66 HydrophobicContact CG2-CG2 4.04Å; I64-I66 PolarHBondContact O-N 3.2Å; I66-L75 HydrophobicContact CD1-CD1 4.12Å |
| 67 | R | 94.6 | Very high | 93 | Very high | 125 Ų | 125 | 107.3 Ų | 107.3 | 47% | 0.472 | 54% | 0.535 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.8 | 114.4 | 173.4 | -77.4 | -175.7 | 178.6 | 168.6 | 0.4 | 109.2 | T41 L51 Y52 | T41-R67 PolarHBondContact O-NH1 2.88Å; T41-R67 PolarHBondContact O-NH2 3.46Å; T41-R67 PolarHBondContact OG1-NH1 3.16Å; L51-R67 HydrophobicContact CB-CB 3.91Å; L51-R67 HydrophobicContact CB-CG 4.48Å; L51-R67 HydrophobicContact CD1-CB 4.07Å; Y52-R67 WeakPolarHBondContact O-CA 3.46Å |
| 68 | Y | 95.4 | Very high | 92.8 | Very high | 86 Ų | 86 | 111.3 Ų | 111.3 | 34% | 0.337 | 55% | 0.553 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -122.6 | 155.6 | -176.5 | -164.3 | -113.1 | 0 | 0 | 0 | 112.2 | L51 Y52 E70 | L51-Y68 CarbonylContact C-O 3.59Å; L51-Y68 VanDerWaalsContact CA-O 3.31Å; L51-Y68 WeakPolarHBondContact CA-O 3.27Å; Y52-Y68 PolarHBondContact N-O 3.33Å; Y52-Y68 PolarHBondContact O-N 2.85Å; Y68-E70 HydrophobicContact CD1-CB 3.98Å; Y68-E70 WeakPolarHBondContact CD1-O 3.43Å; Y68-E70 HydrophobicContact CE1-CB 3.87Å; Y68-E70 HydrophobicContact CE1-CG 4.24Å |
| 69 | R | 93.6 | Very high | 92.7 | Very high | 181 Ų | 181 | 111.8 Ų | 111.8 | 68% | 0.683 | 56% | 0.559 | S | S | * | * | S | Bend | trans | -70.8 | -41.1 | -174.3 | -63.1 | 177.4 | 78.9 | 176.7 | 4 | 112.1 | L51 | L51-R69 HydrophobicContact CD2-CG 3.93Š|
| 70 | E | 93.9 | Very high | 92.5 | Very high | 87 Ų | 87 | 107.1 Ų | 107.1 | 41% | 0.407 | 54% | 0.539 | S | S | . | . | S | Bend | trans | -90.4 | 136.8 | 179.3 | -64.3 | 169.2 | -167.6 | 0 | 0 | 109.9 | Y68 R72 | Y68-E70 HydrophobicContact CD1-CB 3.98Å; Y68-E70 WeakPolarHBondContact CD1-O 3.43Å; Y68-E70 HydrophobicContact CE1-CB 3.87Å; Y68-E70 HydrophobicContact CE1-CG 4.24Å; E70-R72 HydrophobicContact CB-CG 4.18Å; E70-R72 PolarHBondContact O-N 3.16Å; E70-R72 IonicContact OE2-CZ 2.78Å; E70-R72 IonicContact OE2-NE 2.76Å; E70-R72 PolarHBondContact OE2-NE 3Å; E70-R72 IonicContact OE2-NH2 3.92Å; E70-R72 PolarHBondContact OE2-NH2 2.96Å |
| 71 | P | 91.5 | Very high | 92.4 | Very high | 95 Ų | 95 | 105.5 Ų | 105.5 | 62% | 0.617 | 53% | 0.528 | S | S | * | . | trans | -74.1 | 81.2 | 175.5 | 30.7 | -33.4 | 0 | 0 | 0 | 110 | Y52 | Y52-P71 HydrophobicContact CD1-CB 4.19Å; Y52-P71 HydrophobicContact CD2-CB 3.7Å; Y52-P71 HydrophobicContact CD2-CG 4.26Å; Y52-P71 HydrophobicContact CE1-CB 4.38Å; Y52-P71 HydrophobicContact CE2-CB 3.91Å; Y52-P71 HydrophobicContact CE2-CG 4.09Å; Y52-P71 HydrophobicContact CG-CB 3.82Å | ||
| 72 | R | 91.8 | Very high | 92.3 | Very high | 127 Ų | 127 | 109.1 Ų | 109.1 | 48% | 0.479 | 53% | 0.528 | S | S | . | . | trans | -99.6 | 146 | 172.5 | -64.1 | -176.8 | 179.1 | -139.8 | 1.8 | 109.5 | V54 E70 | V54-R72 HydrophobicContact CG1-CB 4.19Å; V54-R72 WeakPolarHBondContact CG1-O 3.35Å; V54-R72 VanDerWaalsContact CG2-O 3.27Å; V54-R72 WeakPolarHBondContact CG2-O 3.46Å; E70-R72 HydrophobicContact CB-CG 4.18Å; E70-R72 PolarHBondContact O-N 3.16Å; E70-R72 IonicContact OE2-CZ 2.78Å; E70-R72 IonicContact OE2-NE 2.76Å; E70-R72 PolarHBondContact OE2-NE 3Å; E70-R72 IonicContact OE2-NH2 3.92Å; E70-R72 PolarHBondContact OE2-NH2 2.96Å | ||
| 73 | R | 87.9 | Confident | 92.2 | Very high | 241 Ų | 241 | 113.3 Ų | 113.3 | 91% | 0.909 | 54% | 0.541 | S | S | * | . | S | Bend | trans | -74.9 | -38.3 | 175.7 | -69.9 | -176.4 | 179.1 | 178.9 | 0.1 | 111.7 | ||
| 74 | M | 89.1 | Confident | 91.8 | Very high | 111 Ų | 111 | 115.2 Ų | 115.2 | 55% | 0.547 | 54% | 0.541 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -150.4 | 145.1 | -174.4 | -168.4 | 170 | 68.3 | 0 | 0 | 110.9 | L55 V57 | L55-M74 CarbonylContact O-C 3.55Å; L55-M74 VanDerWaalsContact O-CA 3.29Å; L55-M74 WeakPolarHBondContact O-CA 3.48Å; V57-M74 HydrophobicContact CG2-CG 3.78Å; V57-M74 HydrophobicContact CG2-SD 3.75Å |
| 75 | L | 89.3 | Confident | 91.6 | Very high | 38 Ų | 38 | 117.5 Ų | 117.5 | 20% | 0.199 | 55% | 0.548 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.4 | 133.1 | 164.2 | -65 | 173.1 | 0 | 0 | 0 | 106.8 | V54 L55 L56 V57 I66 | V54-L75 HydrophobicContact CG1-CD1 4.09Å; V54-L75 HydrophobicContact CG1-CG 3.87Å; L55-L75 PolarHBondContact O-N 2.88Å; L56-L75 HydrophobicContact CD1-CB 3.72Å; V57-L75 PolarHBondContact N-O 2.69Å; I66-L75 HydrophobicContact CD1-CD1 4.12Å |
| 76 | A | 82.8 | Confident | 91.3 | Very high | 117 Ų | 117 | 114.5 Ų | 114.5 | 97% | 0.967 | 54% | 0.535 | S | S | * | . | trans | -129.9 | 0 | -179.6 | 0 | 0 | 0 | 0 | 0 | 109.2 |
Retrieved 76 of 76 residues in 24.5 ms
(Link to these results)