| 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 | 43.1 | Very low | 59.8 | Low | 230 Ų | 230 | 161.5 Ų | 161.5 | 100% | 1.133 | 85% | 0.854 | S | S | * | * | 0 | 77.5 | 0 | -166.8 | -178.2 | -166.9 | 0 | 0 | 109.2 | |||||
| 2 | F | 53.8 | Low | 60 | Low | 222 Ų | 222 | 155.3 Ų | 155.3 | 97% | 0.974 | 83% | 0.834 | S | S | * | * | trans | -157 | 108.9 | 165.6 | -78.9 | -71.1 | 0 | 0 | 0 | 107.9 | ||||
| 3 | G | 58.5 | Low | 59.9 | Low | 75 Ų | 75 | 159.8 Ų | 159.8 | 77% | 0.773 | 84% | 0.841 | S | S | * | * | trans | -109.9 | 123.8 | -178.8 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 4 | V | 63.3 | Low | 59.8 | Low | 137 Ų | 137 | 159 Ų | 159 | 83% | 0.83 | 84% | 0.837 | S | S | * | * | trans | -80.6 | 113.9 | 177.1 | 178 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 5 | K | 67.7 | Low | 59.3 | Low | 192 Ų | 192 | 154.9 Ų | 154.9 | 84% | 0.835 | 84% | 0.835 | S | S | * | * | trans | -87.7 | 114.6 | 171.3 | -62.8 | -176.2 | -179.8 | -176 | 0 | 108.8 | ||||
| 6 | R | 60.4 | Low | 59 | Low | 230 Ų | 230 | 155.4 Ų | 155.4 | 87% | 0.868 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -79.7 | 117.9 | 170.8 | -71.2 | 179.3 | 176.5 | 122.1 | -2.2 | 108.8 | ||
| 7 | N | 63.5 | Low | 58.8 | Low | 155 Ų | 155 | 152.9 Ų | 152.9 | 83% | 0.829 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -79.8 | 125.3 | 170.9 | -75.2 | -40.9 | 0 | 0 | 0 | 109.4 | ||
| 8 | V | 63.5 | Low | 58.6 | Low | 138 Ų | 138 | 150.1 Ų | 150.1 | 84% | 0.836 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -90.3 | 119 | 171.1 | 175.4 | 0 | 0 | 0 | 0 | 107.9 | A10 | V8-A10 PolarHBondContact O-N 3.44Š|
| 9 | I | 59.5 | Low | 58.2 | Low | 152 Ų | 152 | 147.2 Ų | 147.2 | 78% | 0.779 | 81% | 0.813 | S | S | * | * | trans | -81.4 | 108 | 173.3 | -64.2 | 169.5 | 0 | 0 | 0 | 107.4 | I11 | I9-I11 PolarHBondContact O-N 3.49Š| ||
| 10 | A | 58.6 | Low | 57.8 | Low | 89 Ų | 89 | 145.2 Ų | 145.2 | 74% | 0.736 | 81% | 0.81 | S | S | * | * | trans | -78.2 | 112.8 | 167.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | V8 S12 | V8-A10 PolarHBondContact O-N 3.44Å; A10-S12 PolarHBondContact O-N 3.44Å | ||
| 11 | I | 66 | Low | 57.5 | Low | 157 Ų | 157 | 143.9 Ų | 143.9 | 81% | 0.805 | 81% | 0.81 | S | S | * | * | trans | -76.7 | 103.7 | 171.4 | -62 | 174.1 | 0 | 0 | 0 | 107.5 | I9 | I9-I11 PolarHBondContact O-N 3.49Š| ||
| 12 | S | 62.2 | Low | 58 | Low | 87 Ų | 87 | 136.2 Ų | 136.2 | 61% | 0.608 | 78% | 0.778 | S | S | * | * | trans | -68.4 | 127.5 | 171.3 | 35.1 | 0 | 0 | 0 | 0 | 110 | A10 L14 | A10-S12 PolarHBondContact O-N 3.44Å; S12-L14 VanDerWaalsContact C-N 3.3Å; S12-L14 PolarHBondContact O-N 3.27Å | ||
| 13 | K | 58.7 | Low | 58 | Low | 213 Ų | 213 | 134.9 Ų | 134.9 | 93% | 0.926 | 77% | 0.767 | S | S | * | * | trans | -69.4 | 82.8 | 173.8 | -62.5 | 176.3 | -176.7 | 178.1 | 0 | 109.4 | ||||
| 14 | L | 58.2 | Low | 57.7 | Low | 149 Ų | 149 | 138.8 Ų | 138.8 | 78% | 0.78 | 77% | 0.765 | S | S | * | * | trans | -124.5 | 131.3 | 173.8 | -84.8 | 151.1 | 0 | 0 | 0 | 109.5 | S12 | S12-L14 VanDerWaalsContact C-N 3.3Å; S12-L14 PolarHBondContact O-N 3.27Å | ||
| 15 | A | 53 | Low | 57.3 | Low | 98 Ų | 98 | 135 Ų | 135 | 81% | 0.81 | 75% | 0.748 | S | S | * | * | trans | 79.3 | 59.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 118.3 | S17 | A15-S17 PolarHBondContact O-N 3.15Å; A15-S17 VanDerWaalsContact O-N 3.15Å | ||
| 16 | L | 54.3 | Low | 56.7 | Low | 163 Ų | 163 | 133.9 Ų | 133.9 | 85% | 0.853 | 74% | 0.739 | S | S | * | * | trans | -75.8 | 84.9 | 141.9 | -87.7 | 133.3 | 0 | 0 | 0 | 107.9 | T18 | L16-T18 PolarHBondContact O-N 3.3Š| ||
| 17 | S | 55.4 | Low | 56.5 | Low | 113 Ų | 113 | 132 Ų | 132 | 79% | 0.79 | 74% | 0.737 | S | S | * | * | trans | -61.4 | 91.7 | 155.9 | -177.6 | 0 | 0 | 0 | 0 | 106.5 | A15 S19 | A15-S17 PolarHBondContact O-N 3.15Å; A15-S17 VanDerWaalsContact O-N 3.15Å; S17-S19 VanDerWaalsContact C-N 3.28Å; S17-S19 PolarHBondContact O-N 2.96Å | ||
| 18 | T | 54.9 | Low | 56.3 | Low | 102 Ų | 102 | 130.3 Ų | 130.3 | 63% | 0.626 | 73% | 0.732 | S | S | * | * | trans | -72.2 | 93 | 172.2 | 41.8 | 0 | 0 | 0 | 0 | 106.3 | L16 S20 | L16-T18 PolarHBondContact O-N 3.3Å; T18-S20 VanDerWaalsContact C-N 3.31Å; T18-S20 PolarHBondContact O-N 2.87Å | ||
| 19 | S | 51.5 | Low | 56.5 | Low | 94 Ų | 94 | 125 Ų | 125 | 66% | 0.657 | 70% | 0.703 | S | S | * | * | trans | -49.5 | 105.7 | 155.4 | 44.8 | 0 | 0 | 0 | 0 | 106.9 | S17 C21 | S17-S19 VanDerWaalsContact C-N 3.28Å; S17-S19 PolarHBondContact O-N 2.96Å; S19-C21 PolarHBondContact O-N 2.95Å | ||
| 20 | S | 50.6 | Low | 57.8 | Low | 107 Ų | 107 | 121.2 Ų | 121.2 | 75% | 0.748 | 68% | 0.684 | S | S | * | * | S | Bend | trans | -68.1 | 9.9 | -179.3 | 45 | 0 | 0 | 0 | 0 | 112.9 | T18 S22 | T18-S20 VanDerWaalsContact C-N 3.31Å; T18-S20 PolarHBondContact O-N 2.87Å; S20-S22 PolarHBondContact O-N 2.99Å |
| 21 | C | 51.5 | Low | 59.3 | Low | 119 Ų | 119 | 121.3 Ų | 121.3 | 80% | 0.804 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.7 | 48.3 | -178.1 | -160 | 0 | 0 | 0 | 0 | 113.1 | S19 | S19-C21 PolarHBondContact O-N 2.95Š|
| 22 | S | 53.6 | Low | 60.5 | Low | 68 Ų | 68 | 119.2 Ų | 119.2 | 48% | 0.476 | 67% | 0.667 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -148.6 | 2 | 170 | 67.5 | 0 | 0 | 0 | 0 | 115.7 | S20 R26 | S20-S22 PolarHBondContact O-N 2.99Å; S22-R26 PolarHBondContact O-NE 2.95Å |
| 23 | R | 53.6 | Low | 61.9 | Low | 195 Ų | 195 | 120.6 Ų | 120.6 | 74% | 0.736 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -97.7 | -27.8 | 173.2 | -64.1 | -173.6 | -149.9 | -134.6 | 3.8 | 113.2 | ||
| 24 | Q | 52.6 | Low | 63.4 | Low | 156 Ų | 156 | 114.2 Ų | 114.2 | 73% | 0.729 | 64% | 0.637 | S | S | * | * | S | Bend | trans | -77.4 | -31.8 | 173 | -105.2 | 81.1 | 19.9 | 0 | 0 | 113.8 | R26 K27 | Q24-R26 PolarHBondContact O-N 3.02Å; Q24-R26 VanDerWaalsContact O-N 3.15Å; Q24-K27 PolarHBondContact O-N 3.4Å |
| 25 | A | 53.2 | Low | 65 | Low | 58 Ų | 58 | 113.1 Ų | 113.1 | 48% | 0.479 | 63% | 0.628 | S | S | . | * | G | 310 helix | trans | -67.9 | -13.4 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | K27 T28 A29 | A25-K27 VanDerWaalsContact C-N 3.27Å; A25-K27 PolarHBondContact O-N 2.89Å; A25-T28 PolarHBondContact O-N 3.07Å; A25-A29 PolarHBondContact O-N 2.84Å |
| 26 | R | 55.9 | Low | 67 | Low | 169 Ų | 169 | 115 Ų | 115 | 64% | 0.638 | 62% | 0.618 | S | S | * | * | G | 310 helix | trans | -73.8 | -18 | 177.4 | -59.5 | -176.5 | -159.8 | 178.5 | -0 | 113.3 | S22 Q24 | S22-R26 PolarHBondContact O-NE 2.95Å; Q24-R26 PolarHBondContact O-N 3.02Å; Q24-R26 VanDerWaalsContact O-N 3.15Å |
| 27 | K | 57 | Low | 68.8 | Low | 189 Ų | 189 | 110.2 Ų | 110.2 | 82% | 0.822 | 60% | 0.595 | S | S | * | * | G | 310 helix | trans | -88.4 | -14.1 | 178.3 | -65.8 | -170.6 | 178 | -173.6 | 0 | 113.1 | Q24 A25 | Q24-K27 PolarHBondContact O-N 3.4Å; A25-K27 VanDerWaalsContact C-N 3.27Å; A25-K27 PolarHBondContact O-N 2.89Å |
| 28 | T | 58.5 | Low | 70.7 | Confident | 121 Ų | 121 | 108.5 Ų | 108.5 | 74% | 0.742 | 58% | 0.577 | S | S | * | * | S | Bend | trans | -122.1 | 22.4 | -177.3 | 55.1 | 0 | 0 | 0 | 0 | 112.4 | A25 | A25-T28 PolarHBondContact O-N 3.07Š|
| 29 | A | 67.8 | Low | 72.6 | Confident | 27 Ų | 27 | 110.7 Ų | 110.7 | 22% | 0.223 | 58% | 0.578 | C | S | . | * | S | Bend | trans | -75.9 | 136.3 | 169.6 | 0 | 0 | 0 | 0 | 0 | 108.7 | A25 Q34 | A25-A29 PolarHBondContact O-N 2.84Å; A29-Q34 HydrophobicContact CB-CG 3.92Å; A29-Q34 PolarHBondContact O-NE2 3.43Å |
| 30 | D | 87.6 | Confident | 74.7 | Confident | 72 Ų | 72 | 109.3 Ų | 109.3 | 39% | 0.385 | 56% | 0.563 | S | S | . | * | trans | -42.4 | 131.3 | 173.5 | 170.6 | 3 | 0 | 0 | 0 | 110.3 | I32 Q33 Q34 | D30-I32 PolarHBondContact O-N 3.4Å; D30-I32 PolarHBondContact OD1-N 3.5Å; D30-Q33 HydrophobicContact CB-CB 4.35Å; D30-Q33 HydrophobicContact CB-CG 3.99Å; D30-Q33 WeakPolarHBondContact O-CB 3.32Å; D30-Q33 PolarHBondContact O-N 3.39Å; D30-Q34 PolarHBondContact O-N 2.87Å | ||
| 31 | P | 89.5 | Confident | 76.9 | Confident | 91 Ų | 91 | 111.3 Ų | 111.3 | 59% | 0.591 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -43.2 | -37.7 | 174.7 | -30.4 | 34.2 | 0 | 0 | 0 | 113.8 | Q34 Q35 | P31-Q34 PolarHBondContact O-N 3.15Å; P31-Q35 WeakPolarHBondContact O-CG 3.44Å; P31-Q35 PolarHBondContact O-N 2.95Å |
| 32 | I | 89.9 | Confident | 78.9 | Confident | 113 Ų | 113 | 109.8 Ų | 109.8 | 58% | 0.579 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -65.8 | -44.4 | 178.6 | -63.4 | 172.3 | 0 | 0 | 0 | 111.1 | D30 Q34 Q35 F36 | D30-I32 PolarHBondContact O-N 3.4Å; D30-I32 PolarHBondContact OD1-N 3.5Å; I32-Q34 VanDerWaalsContact C-N 3.33Å; I32-Q34 PolarHBondContact O-N 3.25Å; I32-Q35 WeakPolarHBondContact O-CB 3.34Å; I32-Q35 PolarHBondContact O-N 3.45Å; I32-F36 PolarHBondContact O-N 2.88Å |
| 33 | Q | 91.8 | Very high | 80.8 | Confident | 115 Ų | 115 | 113.3 Ų | 113.3 | 54% | 0.537 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -64.4 | -39.4 | 178 | -66.3 | 179.2 | -4.4 | 0 | 0 | 111.5 | D30 F36 V37 | D30-Q33 HydrophobicContact CB-CB 4.35Å; D30-Q33 HydrophobicContact CB-CG 3.99Å; D30-Q33 WeakPolarHBondContact O-CB 3.32Å; D30-Q33 PolarHBondContact O-N 3.39Å; Q33-F36 PolarHBondContact O-N 3.25Å; Q33-V37 WeakPolarHBondContact O-CG2 3.4Å; Q33-V37 PolarHBondContact O-N 3.3Å |
| 34 | Q | 90 | Very high | 82.6 | Confident | 80 Ų | 80 | 109.6 Ų | 109.6 | 37% | 0.374 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -64.1 | -42.8 | 174.9 | -62.2 | -173.5 | 21 | 0 | 0 | 111.5 | A29 D30 P31 I32 F36 V37 N38 | A29-Q34 HydrophobicContact CB-CG 3.92Å; A29-Q34 PolarHBondContact O-NE2 3.43Å; D30-Q34 PolarHBondContact O-N 2.87Å; P31-Q34 PolarHBondContact O-N 3.15Å; I32-Q34 VanDerWaalsContact C-N 3.33Å; I32-Q34 PolarHBondContact O-N 3.25Å; Q34-F36 PolarHBondContact O-N 3.13Å; Q34-V37 PolarHBondContact O-N 3.21Å; Q34-N38 WeakPolarHBondContact O-CB 3.49Å; Q34-N38 PolarHBondContact O-N 2.92Å; Q34-N38 PolarHBondContact O-ND2 3.21Å |
| 35 | Q | 92.9 | Very high | 84.4 | Confident | 126 Ų | 126 | 107.7 Ų | 107.7 | 59% | 0.589 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -59.6 | -46.2 | 175.5 | -76.8 | -179.7 | -24.1 | 0 | 0 | 111.5 | P31 I32 N38 K39 | P31-Q35 WeakPolarHBondContact O-CG 3.44Å; P31-Q35 PolarHBondContact O-N 2.95Å; I32-Q35 WeakPolarHBondContact O-CB 3.34Å; I32-Q35 PolarHBondContact O-N 3.45Å; Q35-N38 PolarHBondContact O-N 3.04Å; Q35-K39 VanDerWaalsContact O-CG 3.3Å; Q35-K39 WeakPolarHBondContact O-CG 3.37Å; Q35-K39 PolarHBondContact O-N 2.91Å |
| 36 | F | 94.2 | Very high | 86.1 | Confident | 137 Ų | 137 | 110 Ų | 110 | 60% | 0.601 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -59.2 | -49.7 | 177.5 | 177.7 | -108.2 | 0 | 0 | 0 | 112.3 | I32 Q33 Q34 N38 K39 I40 | I32-F36 PolarHBondContact O-N 2.88Å; Q33-F36 PolarHBondContact O-N 3.25Å; Q34-F36 PolarHBondContact O-N 3.13Å; F36-N38 VanDerWaalsContact C-N 3.29Å; F36-N38 PolarHBondContact O-N 2.97Å; F36-K39 PolarHBondContact O-N 3.46Å; F36-K39 VanDerWaalsContact O-N 3.13Å; F36-I40 HydrophobicContact CD1-CD1 3.86Å; F36-I40 HydrophobicContact CE1-CD1 3.28Å; F36-I40 HydrophobicContact CE1-CG1 4.34Å; F36-I40 HydrophobicContact CE2-CD1 4.09Å; F36-I40 HydrophobicContact CE2-CG1 4.41Å; F36-I40 HydrophobicContact CG-CD1 4.49Å; F36-I40 HydrophobicContact CZ-CD1 3.43Å; F36-I40 VanDerWaalsContact CZ-CD1 3.43Å; F36-I40 HydrophobicContact CZ-CG1 4.22Å; F36-I40 PolarHBondContact O-N 2.97Å |
| 37 | V | 93.4 | Very high | 87.6 | Confident | 62 Ų | 62 | 106.8 Ų | 106.8 | 38% | 0.376 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.9 | -39.5 | 177.2 | 172.4 | 0 | 0 | 0 | 0 | 111.4 | Q33 Q34 I40 R41 | Q33-V37 WeakPolarHBondContact O-CG2 3.4Å; Q33-V37 PolarHBondContact O-N 3.3Å; Q34-V37 PolarHBondContact O-N 3.21Å; V37-I40 PolarHBondContact O-N 2.92Å; V37-R41 WeakPolarHBondContact O-CG 3.33Å; V37-R41 PolarHBondContact O-N 3.36Å |
| 38 | N | 94.8 | Very high | 89 | Confident | 77 Ų | 77 | 101.8 Ų | 101.8 | 41% | 0.412 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.5 | -40.7 | 175.7 | -71.7 | -22.4 | 0 | 0 | 0 | 111.7 | Q34 Q35 F36 R41 L42 | Q34-N38 WeakPolarHBondContact O-CB 3.49Å; Q34-N38 PolarHBondContact O-N 2.92Å; Q34-N38 PolarHBondContact O-ND2 3.21Å; Q35-N38 PolarHBondContact O-N 3.04Å; F36-N38 VanDerWaalsContact C-N 3.29Å; F36-N38 PolarHBondContact O-N 2.97Å; N38-R41 PolarHBondContact O-N 3.41Å; N38-L42 WeakPolarHBondContact O-CG 3.49Å; N38-L42 PolarHBondContact O-N 3.03Å |
| 39 | K | 95.5 | Very high | 90.2 | Very high | 148 Ų | 148 | 103 Ų | 103 | 64% | 0.643 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -63.3 | -42 | 175.4 | -69 | -67 | -175.9 | -180 | 0 | 112 | Q35 F36 R41 L42 Y43 | Q35-K39 VanDerWaalsContact O-CG 3.3Å; Q35-K39 WeakPolarHBondContact O-CG 3.37Å; Q35-K39 PolarHBondContact O-N 2.91Å; F36-K39 PolarHBondContact O-N 3.46Å; F36-K39 VanDerWaalsContact O-N 3.13Å; K39-R41 PolarHBondContact O-N 3.49Å; K39-L42 PolarHBondContact O-N 3.34Å; K39-Y43 WeakPolarHBondContact O-CB 3.3Å; K39-Y43 PolarHBondContact O-N 3Å |
| 40 | I | 95.7 | Very high | 90.5 | Very high | 66 Ų | 66 | 102.6 Ų | 102.6 | 34% | 0.338 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.5 | -46.1 | 174.1 | -71.2 | 176.8 | 0 | 0 | 0 | 111 | F36 V37 L42 Y43 F44 | F36-I40 HydrophobicContact CD1-CD1 3.86Å; F36-I40 HydrophobicContact CE1-CD1 3.28Å; F36-I40 HydrophobicContact CE1-CG1 4.34Å; F36-I40 HydrophobicContact CE2-CD1 4.09Å; F36-I40 HydrophobicContact CE2-CG1 4.41Å; F36-I40 HydrophobicContact CG-CD1 4.49Å; F36-I40 HydrophobicContact CZ-CD1 3.43Å; F36-I40 VanDerWaalsContact CZ-CD1 3.43Å; F36-I40 HydrophobicContact CZ-CG1 4.22Å; F36-I40 PolarHBondContact O-N 2.97Å; V37-I40 PolarHBondContact O-N 2.92Å; I40-L42 PolarHBondContact O-N 2.96Å; I40-Y43 WeakPolarHBondContact O-CB 3.21Å; I40-Y43 PolarHBondContact O-N 3.41Å; I40-F44 HydrophobicContact CG2-CD2 3.58Å; I40-F44 HydrophobicContact CG2-CE2 3.29Å; I40-F44 HydrophobicContact CG2-CZ 4.41Å; I40-F44 WeakPolarHBondContact O-CD2 3.41Å; I40-F44 PolarHBondContact O-N 3.27Å |
| 41 | R | 95.5 | Very high | 89.9 | Confident | 148 Ų | 148 | 101.1 Ų | 101.1 | 56% | 0.558 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.8 | -44.3 | 178.3 | -72.4 | 174 | 179.9 | 172 | 1.6 | 112.2 | V37 N38 K39 Y43 F44 Q45 | V37-R41 WeakPolarHBondContact O-CG 3.33Å; V37-R41 PolarHBondContact O-N 3.36Å; N38-R41 PolarHBondContact O-N 3.41Å; K39-R41 PolarHBondContact O-N 3.49Å; R41-Y43 VanDerWaalsContact C-N 3.32Å; R41-Y43 PolarHBondContact O-N 2.84Å; R41-F44 PolarHBondContact O-N 3.35Å; R41-Q45 WeakPolarHBondContact O-CG 3.33Å; R41-Q45 PolarHBondContact O-N 3.49Å |
| 42 | L | 93.8 | Very high | 89.2 | Confident | 87 Ų | 87 | 106.7 Ų | 106.7 | 46% | 0.455 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -62.1 | -40.3 | 176.3 | -71.5 | 171.8 | 0 | 0 | 0 | 111.6 | N38 K39 I40 Q45 K46 | N38-L42 WeakPolarHBondContact O-CG 3.49Å; N38-L42 PolarHBondContact O-N 3.03Å; K39-L42 PolarHBondContact O-N 3.34Å; I40-L42 PolarHBondContact O-N 2.96Å; L42-Q45 PolarHBondContact O-N 3.48Å; L42-K46 WeakPolarHBondContact O-CG 3.37Å; L42-K46 PolarHBondContact O-N 3.35Å |
| 43 | Y | 93.2 | Very high | 88.5 | Confident | 143 Ų | 143 | 105.4 Ų | 105.4 | 56% | 0.561 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -59.7 | -50.7 | 174.3 | 172.6 | -94.2 | 0 | 0 | 0 | 111.5 | K39 I40 R41 Q45 K46 Q47 | K39-Y43 WeakPolarHBondContact O-CB 3.3Å; K39-Y43 PolarHBondContact O-N 3Å; I40-Y43 WeakPolarHBondContact O-CB 3.21Å; I40-Y43 PolarHBondContact O-N 3.41Å; R41-Y43 VanDerWaalsContact C-N 3.32Å; R41-Y43 PolarHBondContact O-N 2.84Å; Y43-Q45 VanDerWaalsContact C-N 3.3Å; Y43-Q45 PolarHBondContact O-N 3.46Å; Y43-K46 PolarHBondContact O-N 3.39Å; Y43-Q47 WeakPolarHBondContact O-CB 3.46Å; Y43-Q47 PolarHBondContact O-N 3.22Å |
| 44 | F | 91 | Very high | 87.8 | Confident | 117 Ų | 117 | 104.1 Ų | 104.1 | 51% | 0.513 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.1 | -34.6 | 178.3 | -74.9 | -57.9 | 0 | 0 | 0 | 113.2 | I40 R41 A48 | I40-F44 HydrophobicContact CG2-CD2 3.58Å; I40-F44 HydrophobicContact CG2-CE2 3.29Å; I40-F44 HydrophobicContact CG2-CZ 4.41Å; I40-F44 WeakPolarHBondContact O-CD2 3.41Å; I40-F44 PolarHBondContact O-N 3.27Å; R41-F44 PolarHBondContact O-N 3.35Å; F44-A48 WeakPolarHBondContact O-CB 3.31Å; F44-A48 PolarHBondContact O-N 3.22Å |
| 45 | Q | 90.6 | Very high | 87.5 | Confident | 116 Ų | 116 | 105 Ų | 105 | 54% | 0.542 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -64.4 | -47.7 | 173 | -74.4 | 173.3 | -3.1 | 0 | 0 | 111.4 | R41 L42 Y43 Q47 A48 L49 | R41-Q45 WeakPolarHBondContact O-CG 3.33Å; R41-Q45 PolarHBondContact O-N 3.49Å; L42-Q45 PolarHBondContact O-N 3.48Å; Y43-Q45 VanDerWaalsContact C-N 3.3Å; Y43-Q45 PolarHBondContact O-N 3.46Å; Q45-Q47 VanDerWaalsContact C-N 3.34Å; Q45-Q47 PolarHBondContact O-N 3.35Å; Q45-A48 PolarHBondContact O-N 3.18Å; Q45-L49 VanDerWaalsContact O-CG 3.31Å; Q45-L49 WeakPolarHBondContact O-CG 3.34Å; Q45-L49 PolarHBondContact O-N 2.96Å |
| 46 | K | 90.2 | Very high | 87.1 | Confident | 107 Ų | 107 | 101.8 Ų | 101.8 | 47% | 0.465 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -61.9 | -41.1 | 176.4 | -75 | -172.4 | 172.2 | -145.2 | 0 | 112.4 | L42 Y43 A48 L49 S50 V56 D57 | L42-K46 WeakPolarHBondContact O-CG 3.37Å; L42-K46 PolarHBondContact O-N 3.35Å; Y43-K46 PolarHBondContact O-N 3.39Å; K46-A48 VanDerWaalsContact C-N 3.34Å; K46-L49 PolarHBondContact O-N 3.04Å; K46-S50 WeakPolarHBondContact O-CB 3.3Å; K46-S50 PolarHBondContact O-N 3.03Å; K46-V56 HydrophobicContact CB-CG1 4.1Å; K46-V56 HydrophobicContact CD-CG1 4.3Å; K46-V56 HydrophobicContact CG-CG1 4.31Å; K46-D57 IonicContact NZ-OD2 3.87Å |
| 47 | Q | 87.1 | Confident | 86.6 | Confident | 100 Ų | 100 | 101.2 Ų | 101.2 | 47% | 0.467 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -64 | -37.2 | 175.4 | -173.4 | -172.9 | 5.5 | 0 | 0 | 112.1 | Y43 Q45 | Y43-Q47 WeakPolarHBondContact O-CB 3.46Å; Y43-Q47 PolarHBondContact O-N 3.22Å; Q45-Q47 VanDerWaalsContact C-N 3.34Å; Q45-Q47 PolarHBondContact O-N 3.35Å |
| 48 | A | 85.7 | Confident | 86.1 | Confident | 85 Ų | 85 | 99.5 Ų | 99.5 | 70% | 0.702 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -73.7 | -31.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | F44 Q45 K46 | F44-A48 WeakPolarHBondContact O-CB 3.31Å; F44-A48 PolarHBondContact O-N 3.22Å; Q45-A48 PolarHBondContact O-N 3.18Å; K46-A48 VanDerWaalsContact C-N 3.34Å |
| 49 | L | 83.2 | Confident | 85.8 | Confident | 147 Ų | 147 | 97.9 Ų | 97.9 | 77% | 0.77 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -74.4 | -37.6 | 176.9 | -68.3 | 171.2 | 0 | 0 | 0 | 112.1 | Q45 K46 G51 | Q45-L49 VanDerWaalsContact O-CG 3.31Å; Q45-L49 WeakPolarHBondContact O-CG 3.34Å; Q45-L49 PolarHBondContact O-N 2.96Å; K46-L49 PolarHBondContact O-N 3.04Å; L49-G51 PolarHBondContact O-N 3.39Å |
| 50 | S | 75.5 | Confident | 85.5 | Confident | 18 Ų | 18 | 95.3 Ų | 95.3 | 13% | 0.126 | 52% | 0.523 | C | S | . | . | S | Bend | trans | -94.2 | 96 | 179.1 | -152.5 | 0 | 0 | 0 | 0 | 108.9 | K46 T54 V56 | K46-S50 WeakPolarHBondContact O-CB 3.3Å; K46-S50 PolarHBondContact O-N 3.03Å; S50-T54 PolarHBondContact OG-O 3.29Å; S50-T54 PolarHBondContact OG-OG1 3.16Å; S50-V56 VanDerWaalsContact OG-CA 3.3Å; S50-V56 WeakPolarHBondContact OG-CA 3.43Å; S50-V56 WeakPolarHBondContact OG-CG2 3.32Å; S50-V56 PolarHBondContact OG-N 3.09Å; S50-V56 VanDerWaalsContact OG-N 3.15Å |
| 51 | G | 74.3 | Confident | 85.3 | Confident | 41 Ų | 41 | 97.9 Ų | 97.9 | 42% | 0.423 | 53% | 0.534 | S | S | . | . | trans | -52.1 | 158.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | L49 G53 T54 | L49-G51 PolarHBondContact O-N 3.39Å; G51-G53 PolarHBondContact O-N 2.94Å; G51-T54 PolarHBondContact N-OG1 3.22Å; G51-T54 PolarHBondContact O-N 2.63Å; G51-T54 PolarHBondContact O-OG1 3.06Å | ||
| 52 | E | 75.3 | Confident | 85.2 | Confident | 207 Ų | 207 | 94.4 Ų | 94.4 | 97% | 0.967 | 53% | 0.526 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.4 | 124.8 | 179.7 | -169.2 | 171.4 | -174.4 | 0 | 0 | 110.9 | ||
| 53 | G | 73.8 | Confident | 85 | Confident | 87 Ų | 87 | 94.8 Ų | 94.8 | 90% | 0.897 | 53% | 0.525 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 86.1 | -0.4 | -179.9 | 0 | 0 | 0 | 0 | 0 | 116.3 | G51 | G51-G53 PolarHBondContact O-N 2.94Š|
| 54 | T | 78.7 | Confident | 85.1 | Confident | 88 Ų | 88 | 90.4 Ų | 90.4 | 54% | 0.54 | 52% | 0.515 | S | S | . | . | P | Polyproline II helix | trans | -102.5 | 142.6 | 175.1 | 61 | 0 | 0 | 0 | 0 | 111.8 | S50 G51 | S50-T54 PolarHBondContact OG-O 3.29Å; S50-T54 PolarHBondContact OG-OG1 3.16Å; G51-T54 PolarHBondContact N-OG1 3.22Å; G51-T54 PolarHBondContact O-N 2.63Å; G51-T54 PolarHBondContact O-OG1 3.06Å |
| 55 | L | 83.7 | Confident | 85.2 | Confident | 97 Ų | 97 | 90.8 Ų | 90.8 | 51% | 0.508 | 52% | 0.519 | S | S | . | . | P | Polyproline II helix | trans | -77.7 | 123.8 | 178.6 | -178.4 | 65.3 | 0 | 0 | 0 | 110.1 | D57 A58 I62 | L55-D57 PolarHBondContact O-N 2.79Å; L55-A58 HydrophobicContact CB-CB 3.86Å; L55-A58 HydrophobicContact CD2-CB 3.58Å; L55-A58 HydrophobicContact CG-CB 3.75Å; L55-I62 HydrophobicContact CD2-CB 4.38Å; L55-I62 HydrophobicContact CD2-CG2 3.52Å |
| 56 | V | 84.8 | Confident | 85.4 | Confident | 60 Ų | 60 | 89.8 Ų | 89.8 | 36% | 0.364 | 52% | 0.517 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.8 | 124.5 | 179.9 | -176.2 | 0 | 0 | 0 | 0 | 109.2 | K46 S50 A58 | K46-V56 HydrophobicContact CB-CG1 4.1Å; K46-V56 HydrophobicContact CD-CG1 4.3Å; K46-V56 HydrophobicContact CG-CG1 4.31Å; S50-V56 VanDerWaalsContact OG-CA 3.3Å; S50-V56 WeakPolarHBondContact OG-CA 3.43Å; S50-V56 WeakPolarHBondContact OG-CG2 3.32Å; S50-V56 PolarHBondContact OG-N 3.09Å; S50-V56 VanDerWaalsContact OG-N 3.15Å; V56-A58 VanDerWaalsContact C-N 3.26Å; V56-A58 PolarHBondContact O-N 3.15Å |
| 57 | D | 82.5 | Confident | 85.5 | Confident | 125 Ų | 125 | 91 Ų | 91 | 67% | 0.668 | 52% | 0.522 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.1 | 36.7 | 175.4 | -55.1 | -36 | 0 | 0 | 0 | 114.4 | K46 L55 S59 | K46-D57 IonicContact NZ-OD2 3.87Å; L55-D57 PolarHBondContact O-N 2.79Å; D57-S59 PolarHBondContact O-N 3.18Å; D57-S59 VanDerWaalsContact O-N 3.09Å |
| 58 | A | 83.9 | Confident | 85.9 | Confident | 26 Ų | 26 | 91.9 Ų | 91.9 | 22% | 0.215 | 53% | 0.526 | C | S | . | . | trans | -63.2 | 109 | -178 | 0 | 0 | 0 | 0 | 0 | 112.8 | L55 V56 Q63 | L55-A58 HydrophobicContact CB-CB 3.86Å; L55-A58 HydrophobicContact CD2-CB 3.58Å; L55-A58 HydrophobicContact CG-CB 3.75Å; V56-A58 VanDerWaalsContact C-N 3.26Å; V56-A58 PolarHBondContact O-N 3.15Å; A58-Q63 HydrophobicContact CB-CG 4.04Å | ||
| 59 | S | 87.6 | Confident | 86.3 | Confident | 43 Ų | 43 | 92.6 Ų | 92.6 | 30% | 0.301 | 52% | 0.515 | S | S | . | . | trans | -69.3 | 156.8 | 168.3 | 108.3 | 0 | 0 | 0 | 0 | 110.4 | D57 Q61 I62 Q63 | D57-S59 PolarHBondContact O-N 3.18Å; D57-S59 VanDerWaalsContact O-N 3.09Å; S59-Q61 PolarHBondContact O-N 3.25Å; S59-Q61 VanDerWaalsContact O-N 3.16Å; S59-Q61 PolarHBondContact OG-N 3.01Å; S59-Q61 PolarHBondContact OG-OE1 3.44Å; S59-I62 PolarHBondContact O-N 2.75Å; S59-Q63 PolarHBondContact O-N 3.48Å | ||
| 60 | P | 89.6 | Confident | 86.8 | Confident | 94 Ų | 94 | 90.4 Ų | 90.4 | 61% | 0.61 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -59.7 | -27.7 | -179.7 | 23 | -31.9 | 0 | 0 | 0 | 112.9 | Q63 S64 | P60-Q63 PolarHBondContact O-N 3.2Å; P60-S64 PolarHBondContact O-N 2.77Å; P60-S64 PolarHBondContact O-OG 3.39Å |
| 61 | Q | 92 | Very high | 87.6 | Confident | 119 Ų | 119 | 94.9 Ų | 94.9 | 56% | 0.556 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -65.6 | -42.7 | 174.3 | -66 | 82.4 | -2 | 0 | 0 | 112.5 | S59 Q63 S64 E65 | S59-Q61 PolarHBondContact O-N 3.25Å; S59-Q61 VanDerWaalsContact O-N 3.16Å; S59-Q61 PolarHBondContact OG-N 3.01Å; S59-Q61 PolarHBondContact OG-OE1 3.44Å; Q61-Q63 VanDerWaalsContact C-N 3.28Å; Q61-Q63 PolarHBondContact O-N 3.43Å; Q61-S64 WeakPolarHBondContact CA-OG 3.29Å; Q61-S64 PolarHBondContact O-N 2.96Å; Q61-S64 PolarHBondContact O-OG 2.96Å; Q61-E65 PolarHBondContact O-N 3.22Å |
| 62 | I | 92.3 | Very high | 88.6 | Confident | 76 Ų | 76 | 99.3 Ų | 99.3 | 39% | 0.39 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -68.1 | -35.7 | 179 | -55.8 | 173.9 | 0 | 0 | 0 | 110.2 | L55 S59 S64 L66 | L55-I62 HydrophobicContact CD2-CB 4.38Å; L55-I62 HydrophobicContact CD2-CG2 3.52Å; S59-I62 PolarHBondContact O-N 2.75Å; I62-S64 VanDerWaalsContact C-N 3.34Å; I62-L66 WeakPolarHBondContact O-CB 3.44Å; I62-L66 PolarHBondContact O-N 3.22Å |
| 63 | Q | 91.2 | Very high | 89.5 | Confident | 95 Ų | 95 | 93.1 Ų | 93.1 | 44% | 0.444 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -67.8 | -33.6 | 175.1 | -63.7 | -175.9 | 11.8 | 0 | 0 | 112.5 | A58 S59 P60 Q61 K67 | A58-Q63 HydrophobicContact CB-CG 4.04Å; S59-Q63 PolarHBondContact O-N 3.48Å; P60-Q63 PolarHBondContact O-N 3.2Å; Q61-Q63 VanDerWaalsContact C-N 3.28Å; Q61-Q63 PolarHBondContact O-N 3.43Å; Q63-K67 VanDerWaalsContact O-CG 3.29Å; Q63-K67 WeakPolarHBondContact O-CG 3.47Å; Q63-K67 PolarHBondContact O-N 3.03Å |
| 64 | S | 93.6 | Very high | 90.3 | Very high | 51 Ų | 51 | 91 Ų | 91 | 36% | 0.357 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -71.3 | -45.2 | 174.1 | 57.4 | 0 | 0 | 0 | 0 | 111.8 | P60 Q61 I62 L66 K67 E68 | P60-S64 PolarHBondContact O-N 2.77Å; P60-S64 PolarHBondContact O-OG 3.39Å; Q61-S64 WeakPolarHBondContact CA-OG 3.29Å; Q61-S64 PolarHBondContact O-N 2.96Å; Q61-S64 PolarHBondContact O-OG 2.96Å; I62-S64 VanDerWaalsContact C-N 3.34Å; S64-L66 VanDerWaalsContact C-N 3.32Å; S64-L66 PolarHBondContact O-N 2.88Å; S64-K67 WeakPolarHBondContact O-CB 3.47Å; S64-K67 PolarHBondContact O-N 3.46Å; S64-K67 VanDerWaalsContact O-N 3.1Å; S64-E68 WeakPolarHBondContact O-CG 3.32Å; S64-E68 PolarHBondContact O-N 3.1Å |
| 65 | E | 94.7 | Very high | 91 | Very high | 124 Ų | 124 | 95.5 Ų | 95.5 | 58% | 0.579 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -57.5 | -44.9 | 174.7 | -81.2 | -179.4 | 163.5 | 0 | 0 | 111.6 | Q61 K67 E68 E69 | Q61-E65 PolarHBondContact O-N 3.22Å; E65-K67 VanDerWaalsContact C-N 3.29Å; E65-K67 PolarHBondContact O-N 3.21Å; E65-E68 PolarHBondContact O-N 3.34Å; E65-E69 WeakPolarHBondContact O-CG 3.36Å; E65-E69 PolarHBondContact O-N 2.89Å |
| 66 | L | 93.4 | Very high | 91.5 | Very high | 96 Ų | 96 | 95.9 Ų | 95.9 | 50% | 0.503 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -58.7 | -41.7 | 176.5 | 179.4 | 62.9 | 0 | 0 | 0 | 111.7 | I62 S64 L70 | I62-L66 WeakPolarHBondContact O-CB 3.44Å; I62-L66 PolarHBondContact O-N 3.22Å; S64-L66 VanDerWaalsContact C-N 3.32Å; S64-L66 PolarHBondContact O-N 2.88Å; L66-L70 HydrophobicContact CD1-CD1 4.34Å; L66-L70 HydrophobicContact CD1-CG 4.41Å; L66-L70 HydrophobicContact CG-CD1 4.19Å; L66-L70 WeakPolarHBondContact O-CB 3.3Å; L66-L70 WeakPolarHBondContact O-CG 3.42Å; L66-L70 PolarHBondContact O-N 3.42Å |
| 67 | K | 92.5 | Very high | 91.9 | Very high | 131 Ų | 131 | 101.2 Ų | 101.2 | 57% | 0.57 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -67.3 | -42.1 | 177.3 | -74.6 | 172.8 | -178.1 | 177.2 | 0 | 111.9 | Q63 S64 E65 L70 Q71 | Q63-K67 VanDerWaalsContact O-CG 3.29Å; Q63-K67 WeakPolarHBondContact O-CG 3.47Å; Q63-K67 PolarHBondContact O-N 3.03Å; S64-K67 WeakPolarHBondContact O-CB 3.47Å; S64-K67 PolarHBondContact O-N 3.46Å; S64-K67 VanDerWaalsContact O-N 3.1Å; E65-K67 VanDerWaalsContact C-N 3.29Å; E65-K67 PolarHBondContact O-N 3.21Å; K67-L70 PolarHBondContact O-N 3.34Å; K67-Q71 WeakPolarHBondContact O-CB 3.42Å; K67-Q71 VanDerWaalsContact O-CG 3.3Å; K67-Q71 WeakPolarHBondContact O-CG 3.42Å; K67-Q71 PolarHBondContact O-N 2.99Å |
| 68 | E | 95.6 | Very high | 92.1 | Very high | 119 Ų | 119 | 97.7 Ų | 97.7 | 56% | 0.556 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -63.5 | -43.2 | 178.2 | -73.8 | 175.8 | -163.8 | 0 | 0 | 111.6 | S64 E65 Q71 R72 | S64-E68 WeakPolarHBondContact O-CG 3.32Å; S64-E68 PolarHBondContact O-N 3.1Å; E65-E68 PolarHBondContact O-N 3.34Å; E68-Q71 PolarHBondContact O-N 3.17Å; E68-R72 WeakPolarHBondContact O-CB 3.21Å; E68-R72 PolarHBondContact O-N 3.08Å |
| 69 | E | 94.8 | Very high | 92.2 | Very high | 100 Ų | 100 | 99.7 Ų | 99.7 | 47% | 0.467 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -66.4 | -41.8 | 175.8 | -71.9 | -60.2 | 158.2 | 0 | 0 | 111.8 | E65 Q71 R72 L73 | E65-E69 WeakPolarHBondContact O-CG 3.36Å; E65-E69 PolarHBondContact O-N 2.89Å; E69-Q71 VanDerWaalsContact C-N 3.33Å; E69-Q71 PolarHBondContact O-N 2.85Å; E69-R72 WeakPolarHBondContact O-CB 3.36Å; E69-R72 PolarHBondContact O-N 3.48Å; E69-R72 VanDerWaalsContact O-N 3.17Å; E69-L73 WeakPolarHBondContact O-CG 3.4Å; E69-L73 PolarHBondContact O-N 2.89Å |
| 70 | L | 92.8 | Very high | 91.9 | Very high | 101 Ų | 101 | 101.6 Ų | 101.6 | 53% | 0.529 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.8 | -40.1 | 173.9 | -73.8 | 173.8 | 0 | 0 | 0 | 112.2 | L66 K67 L73 S74 | L66-L70 HydrophobicContact CD1-CD1 4.34Å; L66-L70 HydrophobicContact CD1-CG 4.41Å; L66-L70 HydrophobicContact CG-CD1 4.19Å; L66-L70 WeakPolarHBondContact O-CB 3.3Å; L66-L70 WeakPolarHBondContact O-CG 3.42Å; L66-L70 PolarHBondContact O-N 3.42Å; K67-L70 PolarHBondContact O-N 3.34Å; L70-L73 PolarHBondContact O-N 3.19Å; L70-S74 PolarHBondContact O-N 2.92Å; L70-S74 PolarHBondContact O-OG 3.41Å |
| 71 | Q | 93.2 | Very high | 91.4 | Very high | 112 Ų | 112 | 104.6 Ų | 104.6 | 52% | 0.523 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -67.4 | -35.3 | 174.1 | -75.5 | -179.8 | -7 | 0 | 0 | 112.5 | K67 E68 E69 S74 R75 | K67-Q71 WeakPolarHBondContact O-CB 3.42Å; K67-Q71 VanDerWaalsContact O-CG 3.3Å; K67-Q71 WeakPolarHBondContact O-CG 3.42Å; K67-Q71 PolarHBondContact O-N 2.99Å; E68-Q71 PolarHBondContact O-N 3.17Å; E69-Q71 VanDerWaalsContact C-N 3.33Å; E69-Q71 PolarHBondContact O-N 2.85Å; Q71-S74 WeakPolarHBondContact CA-OG 3.45Å; Q71-S74 PolarHBondContact O-OG 3.41Å; Q71-R75 WeakPolarHBondContact O-CG 3.46Å; Q71-R75 PolarHBondContact O-N 3.33Å |
| 72 | R | 95.5 | Very high | 90.8 | Very high | 134 Ų | 134 | 105.1 Ų | 105.1 | 51% | 0.506 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -64.1 | -46.8 | 173.8 | -177.4 | -176.4 | -175.7 | 159.7 | 3.2 | 110.6 | E68 E69 R75 I76 | E68-R72 WeakPolarHBondContact O-CB 3.21Å; E68-R72 PolarHBondContact O-N 3.08Å; E69-R72 WeakPolarHBondContact O-CB 3.36Å; E69-R72 PolarHBondContact O-N 3.48Å; E69-R72 VanDerWaalsContact O-N 3.17Å; R72-R75 PolarHBondContact O-N 2.92Å; R72-I76 HydrophobicContact CG-CD1 3.9Å; R72-I76 WeakPolarHBondContact O-CG1 3.19Å; R72-I76 PolarHBondContact O-N 3.45Å; R72-I76 VanDerWaalsContact O-N 3.08Å |
| 73 | L | 93.3 | Very high | 90.3 | Very high | 77 Ų | 77 | 105.1 Ų | 105.1 | 40% | 0.403 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.8 | -41.2 | 178.2 | -69 | 174.1 | 0 | 0 | 0 | 112 | E69 L70 R75 I76 Y77 | E69-L73 WeakPolarHBondContact O-CG 3.4Å; E69-L73 PolarHBondContact O-N 2.89Å; L70-L73 PolarHBondContact O-N 3.19Å; L73-R75 VanDerWaalsContact C-N 3.29Å; L73-R75 PolarHBondContact O-N 3.15Å; L73-I76 PolarHBondContact O-N 2.97Å; L73-Y77 HydrophobicContact CD2-CD2 4.16Å; L73-Y77 HydrophobicContact CD2-CE2 3.92Å; L73-Y77 PolarHBondContact O-N 2.95Å |
| 74 | S | 91.6 | Very high | 90 | Very high | 44 Ų | 44 | 107.3 Ų | 107.3 | 31% | 0.308 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -62 | -37 | 177 | 69.2 | 0 | 0 | 0 | 0 | 112.7 | L70 Q71 G78 V79 | L70-S74 PolarHBondContact O-N 2.92Å; L70-S74 PolarHBondContact O-OG 3.41Å; Q71-S74 WeakPolarHBondContact CA-OG 3.45Å; Q71-S74 PolarHBondContact O-OG 3.41Å; S74-G78 CarbonylContact O-C 3.53Å; S74-G78 WeakPolarHBondContact O-CA 3.34Å; S74-G78 PolarHBondContact O-N 3.28Å; S74-V79 VanDerWaalsContact CB-O 3.29Å; S74-V79 WeakPolarHBondContact CB-O 3.29Å; S74-V79 PolarHBondContact O-N 3.38Å; S74-V79 VanDerWaalsContact O-N 3.15Å |
| 75 | R | 92 | Very high | 89.7 | Confident | 182 Ų | 182 | 114.9 Ų | 114.9 | 69% | 0.687 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -67.8 | -44.7 | 173.8 | -71.1 | -175.1 | -61.3 | -124.5 | 1 | 113.1 | Q71 R72 L73 | Q71-R75 WeakPolarHBondContact O-CG 3.46Å; Q71-R75 PolarHBondContact O-N 3.33Å; R72-R75 PolarHBondContact O-N 2.92Å; L73-R75 VanDerWaalsContact C-N 3.29Å; L73-R75 PolarHBondContact O-N 3.15Å |
| 76 | I | 95.1 | Very high | 89.5 | Confident | 105 Ų | 105 | 117.2 Ų | 117.2 | 54% | 0.538 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -69.4 | -44.3 | -175.4 | -68 | 169.5 | 0 | 0 | 0 | 111.3 | R72 L73 | R72-I76 HydrophobicContact CG-CD1 3.9Å; R72-I76 WeakPolarHBondContact O-CG1 3.19Å; R72-I76 PolarHBondContact O-N 3.45Å; R72-I76 VanDerWaalsContact O-N 3.08Å; L73-I76 PolarHBondContact O-N 2.97Å |
| 77 | Y | 92.3 | Very high | 89.3 | Confident | 171 Ų | 171 | 116.3 Ų | 116.3 | 67% | 0.671 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -102.9 | -0.7 | -171.6 | -67.9 | -71.6 | 0 | 0 | 0 | 113.6 | L73 V79 | L73-Y77 HydrophobicContact CD2-CD2 4.16Å; L73-Y77 HydrophobicContact CD2-CE2 3.92Å; L73-Y77 PolarHBondContact O-N 2.95Å; Y77-V79 PolarHBondContact O-N 3.39Å |
| 78 | G | 87.6 | Confident | 89.1 | Confident | 51 Ų | 51 | 115.4 Ų | 115.4 | 53% | 0.526 | 59% | 0.587 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 62.8 | 32 | -174.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | S74 T80 | S74-G78 CarbonylContact O-C 3.53Å; S74-G78 WeakPolarHBondContact O-CA 3.34Å; S74-G78 PolarHBondContact O-N 3.28Å; G78-T80 PolarHBondContact O-N 2.98Å |
| 79 | V | 84.8 | Confident | 88.9 | Confident | 68 Ų | 68 | 115 Ų | 115 | 41% | 0.412 | 59% | 0.588 | S | S | . | * | trans | -72.2 | 101.2 | -178.9 | 177.3 | 0 | 0 | 0 | 0 | 108.9 | S74 Y77 T83 | S74-V79 VanDerWaalsContact CB-O 3.29Å; S74-V79 WeakPolarHBondContact CB-O 3.29Å; S74-V79 PolarHBondContact O-N 3.38Å; S74-V79 VanDerWaalsContact O-N 3.15Å; Y77-V79 PolarHBondContact O-N 3.39Å; V79-T83 HydrophobicContact CB-CG2 3.99Å; V79-T83 HydrophobicContact CG1-CG2 3.74Å; V79-T83 WeakPolarHBondContact CG1-OG1 3.38Å; V79-T83 HydrophobicContact CG2-CG2 4.21Å | ||
| 80 | T | 81.2 | Confident | 88.8 | Confident | 83 Ų | 83 | 116.3 Ų | 116.3 | 51% | 0.509 | 60% | 0.603 | S | S | . | * | trans | -95.8 | 171.9 | 167.8 | 59.7 | 0 | 0 | 0 | 0 | 110.4 | G78 D82 T83 | G78-T80 PolarHBondContact O-N 2.98Å; T80-D82 PolarHBondContact O-N 2.7Å; T80-T83 WeakPolarHBondContact O-CB 3.37Å; T80-T83 WeakPolarHBondContact O-CG2 3.38Å; T80-T83 PolarHBondContact O-N 3.04Å; T80-T83 PolarHBondContact O-OG1 3.29Å | ||
| 81 | D | 79.3 | Confident | 88.8 | Confident | 158 Ų | 158 | 119.3 Ų | 119.3 | 85% | 0.845 | 61% | 0.612 | S | S | * | * | G | 310 helix | trans | -55.3 | -24.1 | 175.3 | -62.5 | -22.9 | 0 | 0 | 0 | 112.6 | T83 | D81-T83 VanDerWaalsContact C-N 3.26Å; D81-T83 PolarHBondContact O-N 2.99Å |
| 82 | D | 81.1 | Confident | 88.6 | Confident | 130 Ų | 130 | 119.8 Ų | 119.8 | 70% | 0.695 | 63% | 0.625 | S | S | * | * | G | 310 helix | trans | -73.6 | -11.8 | 178.4 | -68.8 | -21.5 | 0 | 0 | 0 | 113.9 | T80 V84 R85 | T80-D82 PolarHBondContact O-N 2.7Å; D82-V84 PolarHBondContact O-N 2.92Å; D82-V84 VanDerWaalsContact O-N 3.11Å; D82-R85 PolarHBondContact O-N 3.11Å; D82-R85 VanDerWaalsContact O-O 3.1Å |
| 83 | T | 80 | Confident | 88.2 | Confident | 76 Ų | 76 | 122.1 Ų | 122.1 | 47% | 0.466 | 64% | 0.642 | S | S | . | * | G | 310 helix | trans | -62.5 | -18.6 | -178.7 | 49.6 | 0 | 0 | 0 | 0 | 115 | V79 T80 D81 R85 | V79-T83 HydrophobicContact CB-CG2 3.99Å; V79-T83 HydrophobicContact CG1-CG2 3.74Å; V79-T83 WeakPolarHBondContact CG1-OG1 3.38Å; V79-T83 HydrophobicContact CG2-CG2 4.21Å; T80-T83 WeakPolarHBondContact O-CB 3.37Å; T80-T83 WeakPolarHBondContact O-CG2 3.38Å; T80-T83 PolarHBondContact O-N 3.04Å; T80-T83 PolarHBondContact O-OG1 3.29Å; D81-T83 VanDerWaalsContact C-N 3.26Å; D81-T83 PolarHBondContact O-N 2.99Å; T83-R85 PolarHBondContact O-N 3.33Å |
| 84 | V | 85.8 | Confident | 87.9 | Confident | 140 Ų | 140 | 121.8 Ų | 121.8 | 85% | 0.848 | 65% | 0.65 | S | S | * | * | G | 310 helix | trans | -63.3 | -25.7 | 172.3 | -175.1 | 0 | 0 | 0 | 0 | 110.9 | D82 | D82-V84 PolarHBondContact O-N 2.92Å; D82-V84 VanDerWaalsContact O-N 3.11Å |
| 85 | R | 87.7 | Confident | 87.6 | Confident | 210 Ų | 210 | 129.3 Ų | 129.3 | 79% | 0.792 | 68% | 0.677 | S | S | * | * | S | Bend | trans | -103.6 | 132.2 | 177.5 | -170.7 | 177.4 | 177.7 | -153.7 | -1.9 | 110.6 | D82 T83 | D82-R85 PolarHBondContact O-N 3.11Å; D82-R85 VanDerWaalsContact O-O 3.1Å; T83-R85 PolarHBondContact O-N 3.33Å |
| 86 | F | 89.4 | Confident | 87.2 | Confident | 173 Ų | 173 | 128.9 Ų | 128.9 | 76% | 0.759 | 68% | 0.68 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 135.4 | 172.4 | -173.6 | -94.4 | 0 | 0 | 0 | 111.1 | ||
| 87 | P | 89.5 | Confident | 86.5 | Confident | 78 Ų | 78 | 131 Ų | 131 | 51% | 0.506 | 69% | 0.693 | S | S | . | * | P | Polyproline II helix | trans | -68.9 | 142.6 | -176.9 | 27.8 | -35 | 0 | 0 | 0 | 112 | L89 | P87-L89 HydrophobicContact CB-CD2 4.36Å; P87-L89 HydrophobicContact CG-CD2 4.33Å; P87-L89 PolarHBondContact O-N 2.75Å |
| 88 | S | 89.5 | Confident | 85.6 | Confident | 112 Ų | 112 | 129.8 Ų | 129.8 | 78% | 0.783 | 70% | 0.696 | S | S | * | * | trans | -82.7 | 108.4 | 167.2 | -174.7 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 89 | L | 91.1 | Very high | 84.9 | Confident | 111 Ų | 111 | 133.1 Ų | 133.1 | 58% | 0.581 | 71% | 0.706 | S | S | * | * | trans | -85.8 | 120.2 | 179 | -58 | 177 | 0 | 0 | 0 | 109.9 | P87 F91 | P87-L89 HydrophobicContact CB-CD2 4.36Å; P87-L89 HydrophobicContact CG-CD2 4.33Å; P87-L89 PolarHBondContact O-N 2.75Å; L89-F91 HydrophobicContact CB-CE2 3.87Å; L89-F91 HydrophobicContact CB-CZ 3.99Å; L89-F91 HydrophobicContact CD1-CZ 4.13Å | ||
| 90 | T | 91.8 | Very high | 83.6 | Confident | 126 Ų | 126 | 133 Ų | 133 | 77% | 0.773 | 71% | 0.705 | S | S | * | * | trans | -114.7 | 119.7 | 169.9 | -53.7 | 0 | 0 | 0 | 0 | 108 | ||||
| 91 | F | 92.4 | Very high | 82.7 | Confident | 165 Ų | 165 | 135.9 Ų | 135.9 | 72% | 0.724 | 72% | 0.715 | S | S | * | * | P | Polyproline II helix | trans | -96 | 126.8 | 177.7 | -60.4 | -80.7 | 0 | 0 | 0 | 108.9 | L89 | L89-F91 HydrophobicContact CB-CE2 3.87Å; L89-F91 HydrophobicContact CB-CZ 3.99Å; L89-F91 HydrophobicContact CD1-CZ 4.13Å |
| 92 | P | 89.8 | Confident | 81.7 | Confident | 122 Ų | 122 | 133.9 Ų | 133.9 | 79% | 0.792 | 71% | 0.708 | S | S | * | * | P | Polyproline II helix | trans | -64 | 141.9 | 169.2 | 28.2 | -32.4 | 0 | 0 | 0 | 108.9 | A94 | P92-A94 PolarHBondContact O-N 3.02Š|
| 93 | E | 87.3 | Confident | 80.6 | Confident | 183 Ų | 183 | 132.8 Ų | 132.8 | 86% | 0.855 | 70% | 0.703 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 137 | 173.9 | -70 | -175.2 | 173.7 | 0 | 0 | 110.1 | K95 | E93-K95 PolarHBondContact O-N 3.41Š|
| 94 | A | 87.3 | Confident | 79.6 | Confident | 69 Ų | 69 | 133.5 Ų | 133.5 | 57% | 0.57 | 70% | 0.7 | S | S | * | * | P | Polyproline II helix | trans | -64 | 119.4 | 178.7 | 0 | 0 | 0 | 0 | 0 | 109.5 | P92 F96 | P92-A94 PolarHBondContact O-N 3.02Å; A94-F96 HydrophobicContact CB-CD2 4.27Å; A94-F96 HydrophobicContact CB-CE1 4.36Å; A94-F96 HydrophobicContact CB-CE2 3.57Å; A94-F96 HydrophobicContact CB-CZ 3.62Å; A94-F96 WeakPolarHBondContact O-CD2 3.26Å; A94-F96 PolarHBondContact O-N 3.35Å |
| 95 | K | 85.1 | Confident | 78.6 | Confident | 203 Ų | 203 | 129.3 Ų | 129.3 | 88% | 0.883 | 68% | 0.681 | S | S | * | * | trans | -79.7 | 102.6 | 173.8 | -66.1 | -179.9 | 177.1 | 178.1 | 0 | 108.6 | E93 | E93-K95 PolarHBondContact O-N 3.41Š| ||
| 96 | F | 82.7 | Confident | 77.6 | Confident | 172 Ų | 172 | 122 Ų | 122 | 75% | 0.754 | 67% | 0.665 | S | S | * | * | trans | -90.4 | 120.7 | 170.9 | -59.7 | -76.5 | 0 | 0 | 0 | 109.1 | A94 I98 | A94-F96 HydrophobicContact CB-CD2 4.27Å; A94-F96 HydrophobicContact CB-CE1 4.36Å; A94-F96 HydrophobicContact CB-CE2 3.57Å; A94-F96 HydrophobicContact CB-CZ 3.62Å; A94-F96 WeakPolarHBondContact O-CD2 3.26Å; A94-F96 PolarHBondContact O-N 3.35Å; F96-I98 PolarHBondContact O-N 3.21Å | ||
| 97 | N | 81.6 | Confident | 76.5 | Confident | 150 Ų | 150 | 116.3 Ų | 116.3 | 80% | 0.802 | 65% | 0.65 | S | S | * | * | trans | -85.7 | 108.5 | 165.3 | -65.8 | -37.4 | 0 | 0 | 0 | 107.1 | V99 | N97-V99 PolarHBondContact O-N 3.14Š| ||
| 98 | I | 73.8 | Confident | 75.6 | Confident | 145 Ų | 145 | 117.7 Ų | 117.7 | 74% | 0.744 | 65% | 0.65 | S | S | * | * | trans | -73.7 | 106.3 | 172.7 | -56.4 | 174.3 | 0 | 0 | 0 | 106.5 | F96 T100 | F96-I98 PolarHBondContact O-N 3.21Å; I98-T100 HydrophobicContact CG2-CG2 3.8Å; I98-T100 PolarHBondContact O-N 3.07Å | ||
| 99 | V | 70.9 | Confident | 74.9 | Confident | 121 Ų | 121 | 121.1 Ų | 121.1 | 73% | 0.733 | 65% | 0.646 | S | S | * | * | trans | -78.3 | 100.2 | 169 | -177.4 | 0 | 0 | 0 | 0 | 106.8 | N97 | N97-V99 PolarHBondContact O-N 3.14Š| ||
| 100 | T | 59.4 | Low | 74.1 | Confident | 65 Ų | 65 | 122 Ų | 122 | 40% | 0.399 | 65% | 0.647 | S | S | . | * | trans | -86.7 | 126.6 | 171.6 | 48.1 | 0 | 0 | 0 | 0 | 109.1 | I98 V102 | I98-T100 HydrophobicContact CG2-CG2 3.8Å; I98-T100 PolarHBondContact O-N 3.07Å; T100-V102 PolarHBondContact O-N 3.32Å | ||
| 101 | M | 60.6 | Low | 73.5 | Confident | 144 Ų | 144 | 124.4 Ų | 124.4 | 71% | 0.709 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.3 | 21.7 | 172.5 | -54.6 | -72.9 | -69.3 | 0 | 0 | 113 | ||
| 102 | V | 59.8 | Low | 72.5 | Confident | 116 Ų | 116 | 121.2 Ų | 121.2 | 70% | 0.703 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.2 | -24.5 | -170.2 | -178.1 | 0 | 0 | 0 | 0 | 112 | T100 E104 | T100-V102 PolarHBondContact O-N 3.32Å; V102-E104 VanDerWaalsContact C-N 3.29Å |
| 103 | D | 57 | Low | 71.8 | Confident | 108 Ų | 108 | 121 Ų | 121 | 58% | 0.578 | 62% | 0.62 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84 | -8.8 | 171.4 | -69.2 | -26.7 | 0 | 0 | 0 | 112.6 | A105 A106 A107 | D103-A105 PolarHBondContact O-N 3.41Å; D103-A106 PolarHBondContact O-N 2.92Å; D103-A107 VanDerWaalsContact O-CB 3.27Å; D103-A107 WeakPolarHBondContact O-CB 3.23Å; D103-A107 PolarHBondContact O-N 3.24Å |
| 104 | E | 59 | Low | 70.8 | Confident | 90 Ų | 90 | 118.4 Ų | 118.4 | 42% | 0.421 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -59.1 | -33.7 | 173.5 | -71.7 | 178.3 | 170.5 | 0 | 0 | 111.4 | V102 E108 | V102-E104 VanDerWaalsContact C-N 3.29Å; E104-E108 WeakPolarHBondContact O-CA 3.39Å; E104-E108 WeakPolarHBondContact O-CB 3.46Å; E104-E108 VanDerWaalsContact O-CG 3.23Å; E104-E108 WeakPolarHBondContact O-CG 3.47Å; E104-E108 PolarHBondContact O-N 3.12Å |
| 105 | A | 64.6 | Low | 69.6 | Low | 53 Ų | 53 | 118.6 Ų | 118.6 | 44% | 0.438 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -72.5 | -32.3 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | D103 R109 | D103-A105 PolarHBondContact O-N 3.41Å; A105-R109 WeakPolarHBondContact O-CB 3.4Å; A105-R109 WeakPolarHBondContact O-CD 3.2Å; A105-R109 WeakPolarHBondContact O-CG 3.38Å; A105-R109 PolarHBondContact O-N 3.11Å; A105-R109 VanDerWaalsContact O-N 3.11Å |
| 106 | A | 67.6 | Low | 68.6 | Low | 55 Ų | 55 | 113.4 Ų | 113.4 | 46% | 0.455 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -82.6 | -39.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | D103 R109 Q110 | D103-A106 PolarHBondContact O-N 2.92Å; A106-R109 PolarHBondContact O-N 3.4Å; A106-Q110 WeakPolarHBondContact O-CG 3.3Å; A106-Q110 PolarHBondContact O-N 3.2Å |
| 107 | A | 66.3 | Low | 67.7 | Low | 55 Ų | 55 | 110.9 Ų | 110.9 | 46% | 0.455 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -68.1 | -35.4 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | D103 R111 | D103-A107 VanDerWaalsContact O-CB 3.27Å; D103-A107 WeakPolarHBondContact O-CB 3.23Å; D103-A107 PolarHBondContact O-N 3.24Å; A107-R111 WeakPolarHBondContact O-CB 3.12Å; A107-R111 PolarHBondContact O-N 2.81Å |
| 108 | E | 70.2 | Confident | 66.5 | Low | 107 Ų | 107 | 105.9 Ų | 105.9 | 50% | 0.5 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -69.6 | -37.4 | 171.6 | -87 | -176.1 | 132.1 | 0 | 0 | 111.4 | E104 R111 L112 | E104-E108 WeakPolarHBondContact O-CA 3.39Å; E104-E108 WeakPolarHBondContact O-CB 3.46Å; E104-E108 VanDerWaalsContact O-CG 3.23Å; E104-E108 WeakPolarHBondContact O-CG 3.47Å; E104-E108 PolarHBondContact O-N 3.12Å; E108-R111 CarbonylContact O-C 3.4Å; E108-R111 PolarHBondContact O-N 3.31Å; E108-L112 WeakPolarHBondContact O-CA 3.23Å; E108-L112 WeakPolarHBondContact O-CB 3.31Å; E108-L112 WeakPolarHBondContact O-CG 3.26Å; E108-L112 PolarHBondContact O-N 3.19Å |
| 109 | R | 74.9 | Confident | 65.6 | Low | 184 Ų | 184 | 100.9 Ų | 100.9 | 69% | 0.694 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -63.9 | -45.6 | 173.6 | -80.7 | 172 | -173 | 175.4 | 3.7 | 111.5 | A105 A106 R111 L112 E113 | A105-R109 WeakPolarHBondContact O-CB 3.4Å; A105-R109 WeakPolarHBondContact O-CD 3.2Å; A105-R109 WeakPolarHBondContact O-CG 3.38Å; A105-R109 PolarHBondContact O-N 3.11Å; A105-R109 VanDerWaalsContact O-N 3.11Å; A106-R109 PolarHBondContact O-N 3.4Å; R109-R111 VanDerWaalsContact C-N 3.31Å; R109-R111 PolarHBondContact O-N 2.9Å; R109-L112 PolarHBondContact O-N 3.24Å; R109-E113 WeakPolarHBondContact O-CB 3.04Å; R109-E113 PolarHBondContact O-N 3.42Å |
| 110 | Q | 74.8 | Confident | 64.7 | Low | 130 Ų | 130 | 101.8 Ų | 101.8 | 61% | 0.607 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -65.9 | -35.8 | 175 | -72.7 | 177.7 | -6 | 0 | 0 | 111.9 | A106 Q114 | A106-Q110 WeakPolarHBondContact O-CG 3.3Å; A106-Q110 PolarHBondContact O-N 3.2Å; Q110-Q114 WeakPolarHBondContact O-CB 3.2Å; Q110-Q114 VanDerWaalsContact O-CG 3.22Å; Q110-Q114 WeakPolarHBondContact O-CG 3.31Å; Q110-Q114 PolarHBondContact O-N 3.05Å |
| 111 | R | 78.2 | Confident | 64.4 | Low | 176 Ų | 176 | 106.6 Ų | 106.6 | 66% | 0.664 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -71.6 | -38 | 175.1 | -172.4 | -179.3 | 175.4 | -154.5 | -2.1 | 112.1 | A107 E108 R109 V115 | A107-R111 WeakPolarHBondContact O-CB 3.12Å; A107-R111 PolarHBondContact O-N 2.81Å; E108-R111 CarbonylContact O-C 3.4Å; E108-R111 PolarHBondContact O-N 3.31Å; R109-R111 VanDerWaalsContact C-N 3.31Å; R109-R111 PolarHBondContact O-N 2.9Å; R111-V115 HydrophobicContact CG-CG2 4.49Å; R111-V115 WeakPolarHBondContact O-CB 3.04Å; R111-V115 WeakPolarHBondContact O-CG2 3.49Å; R111-V115 PolarHBondContact O-N 3.06Å |
| 112 | L | 72.3 | Confident | 63.8 | Low | 98 Ų | 98 | 104.2 Ų | 104.2 | 51% | 0.513 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -70 | -39.6 | 174.5 | -86.4 | 159 | 0 | 0 | 0 | 110.8 | E108 R109 V115 D116 | E108-L112 WeakPolarHBondContact O-CA 3.23Å; E108-L112 WeakPolarHBondContact O-CB 3.31Å; E108-L112 WeakPolarHBondContact O-CG 3.26Å; E108-L112 PolarHBondContact O-N 3.19Å; R109-L112 PolarHBondContact O-N 3.24Å; L112-V115 CarbonylContact O-C 3.45Å; L112-V115 PolarHBondContact O-N 3.2Å; L112-D116 VanDerWaalsContact O-CB 3.27Å; L112-D116 WeakPolarHBondContact O-CB 3.17Å; L112-D116 VanDerWaalsContact O-CG 3.22Å; L112-D116 PolarHBondContact O-N 3.1Å |
| 113 | E | 75.1 | Confident | 63 | Low | 117 Ų | 117 | 102.4 Ų | 102.4 | 55% | 0.547 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -69.5 | -40.6 | 174.7 | -169.4 | 168 | -149.1 | 0 | 0 | 110.5 | R109 V115 D116 E117 | R109-E113 WeakPolarHBondContact O-CB 3.04Å; R109-E113 PolarHBondContact O-N 3.42Å; E113-V115 VanDerWaalsContact C-N 3.34Å; E113-D116 PolarHBondContact O-N 3.02Å; E113-E117 VanDerWaalsContact O-CB 3.26Å; E113-E117 WeakPolarHBondContact O-CB 3.47Å; E113-E117 VanDerWaalsContact O-CG 3.28Å; E113-E117 WeakPolarHBondContact O-CG 3.48Å; E113-E117 PolarHBondContact O-N 2.71Å |
| 114 | Q | 66.4 | Low | 62.4 | Low | 129 Ų | 129 | 101.8 Ų | 101.8 | 60% | 0.603 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -66.1 | -34.3 | 169 | -79 | -178 | -19.2 | 0 | 0 | 112.3 | Q110 S118 | Q110-Q114 WeakPolarHBondContact O-CB 3.2Å; Q110-Q114 VanDerWaalsContact O-CG 3.22Å; Q110-Q114 WeakPolarHBondContact O-CG 3.31Å; Q110-Q114 PolarHBondContact O-N 3.05Å; Q114-S118 WeakPolarHBondContact O-CA 3.43Å; Q114-S118 WeakPolarHBondContact O-CB 3.21Å; Q114-S118 PolarHBondContact O-N 3.01Å; Q114-S118 PolarHBondContact O-OG 3.13Å |
| 115 | V | 61.8 | Low | 61.9 | Low | 72 Ų | 72 | 100.6 Ų | 100.6 | 44% | 0.436 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -73.1 | -30.5 | 174 | 165 | 0 | 0 | 0 | 0 | 111 | R111 L112 E113 S118 S119 | R111-V115 HydrophobicContact CG-CG2 4.49Å; R111-V115 WeakPolarHBondContact O-CB 3.04Å; R111-V115 WeakPolarHBondContact O-CG2 3.49Å; R111-V115 PolarHBondContact O-N 3.06Å; L112-V115 CarbonylContact O-C 3.45Å; L112-V115 PolarHBondContact O-N 3.2Å; E113-V115 VanDerWaalsContact C-N 3.34Å; V115-S118 VanDerWaalsContact CA-OG 3.31Å; V115-S118 WeakPolarHBondContact CA-OG 3.4Å; V115-S118 PolarHBondContact O-OG 3.5Å; V115-S119 WeakPolarHBondContact O-CA 3.18Å; V115-S119 WeakPolarHBondContact O-CB 3.16Å; V115-S119 PolarHBondContact O-N 2.79Å; V115-S119 PolarHBondContact O-OG 3.43Å |
| 116 | D | 63.4 | Low | 61.2 | Low | 94 Ų | 94 | 100.8 Ų | 100.8 | 50% | 0.503 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -77.4 | -42.7 | 174.7 | -77.1 | -17.6 | 0 | 0 | 0 | 110 | L112 E113 S119 M120 | L112-D116 VanDerWaalsContact O-CB 3.27Å; L112-D116 WeakPolarHBondContact O-CB 3.17Å; L112-D116 VanDerWaalsContact O-CG 3.22Å; L112-D116 PolarHBondContact O-N 3.1Å; E113-D116 PolarHBondContact O-N 3.02Å; D116-S119 VanDerWaalsContact CA-OG 3.32Å; D116-S119 WeakPolarHBondContact CA-OG 3.43Å; D116-S119 CarbonylContact O-C 3.32Å; D116-S119 PolarHBondContact O-N 3.03Å; D116-S119 PolarHBondContact O-OG 2.8Å; D116-M120 WeakPolarHBondContact O-CB 3.17Å; D116-M120 WeakPolarHBondContact O-CG 3.29Å; D116-M120 PolarHBondContact O-N 3.36Å |
| 117 | E | 64.5 | Low | 60.3 | Low | 120 Ų | 120 | 108.1 Ų | 108.1 | 56% | 0.561 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -69.4 | -45.3 | 175.6 | -74.8 | -178.3 | 164 | 0 | 0 | 112.1 | E113 M120 E121 | E113-E117 VanDerWaalsContact O-CB 3.26Å; E113-E117 WeakPolarHBondContact O-CB 3.47Å; E113-E117 VanDerWaalsContact O-CG 3.28Å; E113-E117 WeakPolarHBondContact O-CG 3.48Å; E113-E117 PolarHBondContact O-N 2.71Å; E117-M120 PolarHBondContact O-N 3.45Å; E117-E121 PolarHBondContact O-N 2.71Å |
| 118 | S | 55.5 | Low | 59.3 | Low | 44 Ų | 44 | 113.3 Ų | 113.3 | 31% | 0.308 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -60.7 | -56.1 | 166.3 | 55.4 | 0 | 0 | 0 | 0 | 107.6 | Q114 V115 M120 E121 E122 | Q114-S118 WeakPolarHBondContact O-CA 3.43Å; Q114-S118 WeakPolarHBondContact O-CB 3.21Å; Q114-S118 PolarHBondContact O-N 3.01Å; Q114-S118 PolarHBondContact O-OG 3.13Å; V115-S118 VanDerWaalsContact CA-OG 3.31Å; V115-S118 WeakPolarHBondContact CA-OG 3.4Å; V115-S118 PolarHBondContact O-OG 3.5Å; S118-M120 PolarHBondContact O-N 3.11Å; S118-E121 CarbonylContact O-C 3.56Å; S118-E121 PolarHBondContact O-N 3.43Å; S118-E122 VanDerWaalsContact O-CA 3.25Å; S118-E122 WeakPolarHBondContact O-CA 3.35Å; S118-E122 WeakPolarHBondContact O-CB 3.47Å; S118-E122 PolarHBondContact O-N 3.23Å |
| 119 | S | 56.4 | Low | 58.6 | Low | 40 Ų | 40 | 114.1 Ų | 114.1 | 28% | 0.28 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -58.9 | -10.4 | 175.8 | 80.5 | 0 | 0 | 0 | 0 | 115.6 | V115 D116 T123 | V115-S119 WeakPolarHBondContact O-CA 3.18Å; V115-S119 WeakPolarHBondContact O-CB 3.16Å; V115-S119 PolarHBondContact O-N 2.79Å; V115-S119 PolarHBondContact O-OG 3.43Å; D116-S119 VanDerWaalsContact CA-OG 3.32Å; D116-S119 WeakPolarHBondContact CA-OG 3.43Å; D116-S119 CarbonylContact O-C 3.32Å; D116-S119 PolarHBondContact O-N 3.03Å; D116-S119 PolarHBondContact O-OG 2.8Å; S119-T123 VanDerWaalsContact O-CA 3.31Å; S119-T123 WeakPolarHBondContact O-CA 3.37Å; S119-T123 WeakPolarHBondContact O-CB 2.99Å; S119-T123 WeakPolarHBondContact O-CG2 2.93Å; S119-T123 PolarHBondContact O-N 2.56Å; S119-T123 PolarHBondContact O-OG1 2.87Å |
| 120 | M | 50.7 | Low | 58.2 | Low | 140 Ų | 140 | 108.7 Ų | 108.7 | 69% | 0.69 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -89.6 | -34.9 | 168.8 | -65.5 | -126.9 | 81.2 | 0 | 0 | 112.4 | D116 E117 S118 T123 | D116-M120 WeakPolarHBondContact O-CB 3.17Å; D116-M120 WeakPolarHBondContact O-CG 3.29Å; D116-M120 PolarHBondContact O-N 3.36Å; E117-M120 PolarHBondContact O-N 3.45Å; S118-M120 PolarHBondContact O-N 3.11Å; M120-T123 VanDerWaalsContact CA-OG1 3.32Å; M120-T123 WeakPolarHBondContact CA-OG1 3.42Å; M120-T123 PolarHBondContact O-OG1 3.23Å |
| 121 | E | 53.1 | Low | 57.6 | Low | 167 Ų | 167 | 110.7 Ų | 110.7 | 78% | 0.78 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -81.7 | -25.2 | 172 | -67.7 | -165.5 | 156.4 | 0 | 0 | 112.8 | E117 S118 | E117-E121 PolarHBondContact O-N 2.71Å; S118-E121 CarbonylContact O-C 3.56Å; S118-E121 PolarHBondContact O-N 3.43Å |
| 122 | E | 47.7 | Very low | 57.2 | Low | 93 Ų | 93 | 104.7 Ų | 104.7 | 44% | 0.435 | 55% | 0.548 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -101 | -20.9 | -177.7 | -119.6 | -162.5 | -147.1 | 0 | 0 | 107.1 | S118 A124 G125 T126 R127 | S118-E122 VanDerWaalsContact O-CA 3.25Å; S118-E122 WeakPolarHBondContact O-CA 3.35Å; S118-E122 WeakPolarHBondContact O-CB 3.47Å; S118-E122 PolarHBondContact O-N 3.23Å; E122-A124 PolarHBondContact O-N 3.38Å; E122-G125 CarbonylContact O-C 2.84Å; E122-G125 WeakPolarHBondContact O-CA 3.34Å; E122-G125 PolarHBondContact O-N 3.44Å; E122-T126 WeakPolarHBondContact CA-OG1 2.99Å; E122-T126 HydrophobicContact CB-CG2 4.39Å; E122-T126 WeakPolarHBondContact CB-OG1 3.33Å; E122-T126 HydrophobicContact CG-CG2 3.5Å; E122-T126 WeakPolarHBondContact CG-OG1 3.44Å; E122-T126 CarbonylContact O-C 3.51Å; E122-T126 WeakPolarHBondContact O-CA 3.45Å; E122-T126 PolarHBondContact O-N 2.58Å; E122-T126 PolarHBondContact O-OG1 3.18Å; E122-T126 WeakPolarHBondContact OE2-CB 3.27Å; E122-T126 WeakPolarHBondContact OE2-CG2 3.23Å; E122-T126 PolarHBondContact OE2-OG1 3.49Å; E122-R127 PolarHBondContact O-N 2.77Å |
| 123 | T | 43.2 | Very low | 57.2 | Low | 78 Ų | 78 | 106.2 Ų | 106.2 | 48% | 0.479 | 55% | 0.552 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -64.5 | -12.5 | 159.9 | 42.1 | 0 | 0 | 0 | 0 | 113.3 | S119 M120 | S119-T123 VanDerWaalsContact O-CA 3.31Å; S119-T123 WeakPolarHBondContact O-CA 3.37Å; S119-T123 WeakPolarHBondContact O-CB 2.99Å; S119-T123 WeakPolarHBondContact O-CG2 2.93Å; S119-T123 PolarHBondContact O-N 2.56Å; S119-T123 PolarHBondContact O-OG1 2.87Å; M120-T123 VanDerWaalsContact CA-OG1 3.32Å; M120-T123 WeakPolarHBondContact CA-OG1 3.42Å; M120-T123 PolarHBondContact O-OG1 3.23Å |
| 124 | A | 44.5 | Very low | 57.1 | Low | 95 Ų | 95 | 105 Ų | 105 | 79% | 0.785 | 55% | 0.545 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.4 | -14.8 | 164 | 0 | 0 | 0 | 0 | 0 | 114.4 | E122 | E122-A124 PolarHBondContact O-N 3.38Š|
| 125 | G | 48.7 | Very low | 57.3 | Low | 66 Ų | 66 | 102 Ų | 102 | 68% | 0.68 | 54% | 0.537 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -136.3 | -29.5 | -172.8 | 0 | 0 | 0 | 0 | 0 | 118.2 | E122 | E122-G125 CarbonylContact O-C 2.84Å; E122-G125 WeakPolarHBondContact O-CA 3.34Å; E122-G125 PolarHBondContact O-N 3.44Å |
| 126 | T | 49.9 | Very low | 57.7 | Low | 57 Ų | 57 | 100 Ų | 100 | 35% | 0.35 | 52% | 0.524 | S | S | . | . | trans | -117.7 | 79.8 | 158.9 | 60.2 | 0 | 0 | 0 | 0 | 110.6 | E122 L128 | E122-T126 WeakPolarHBondContact CA-OG1 2.99Å; E122-T126 HydrophobicContact CB-CG2 4.39Å; E122-T126 WeakPolarHBondContact CB-OG1 3.33Å; E122-T126 HydrophobicContact CG-CG2 3.5Å; E122-T126 WeakPolarHBondContact CG-OG1 3.44Å; E122-T126 CarbonylContact O-C 3.51Å; E122-T126 WeakPolarHBondContact O-CA 3.45Å; E122-T126 PolarHBondContact O-N 2.58Å; E122-T126 PolarHBondContact O-OG1 3.18Å; E122-T126 WeakPolarHBondContact OE2-CB 3.27Å; E122-T126 WeakPolarHBondContact OE2-CG2 3.23Å; E122-T126 PolarHBondContact OE2-OG1 3.49Å; T126-L128 VanDerWaalsContact C-N 3.31Å; T126-L128 PolarHBondContact O-N 3.25Å | ||
| 127 | R | 49.1 | Very low | 57.9 | Low | 208 Ų | 208 | 102.1 Ų | 102.1 | 79% | 0.785 | 53% | 0.531 | S | S | * | . | trans | -58 | 116.8 | 138.9 | -71.2 | -179.8 | -167.6 | 151.4 | 5 | 103.4 | E122 I129 | E122-R127 PolarHBondContact O-N 2.77Å; R127-I129 PolarHBondContact O-N 3.44Å | ||
| 128 | L | 45.1 | Very low | 57.7 | Low | 164 Ų | 164 | 97.8 Ų | 97.8 | 86% | 0.859 | 51% | 0.512 | S | S | * | . | trans | -38.4 | 104.7 | 161.5 | -127.2 | 166.3 | 0 | 0 | 0 | 103.5 | T126 D130 | T126-L128 VanDerWaalsContact C-N 3.31Å; T126-L128 PolarHBondContact O-N 3.25Å; L128-D130 VanDerWaalsContact C-N 3.25Å; L128-D130 PolarHBondContact O-N 3.05Å | ||
| 129 | I | 55.6 | Low | 58 | Low | 124 Ų | 124 | 101.9 Ų | 101.9 | 64% | 0.636 | 53% | 0.527 | S | S | * | . | trans | -56.5 | 109.1 | -179.3 | -64.8 | 164.9 | 0 | 0 | 0 | 101 | R127 W131 K134 | R127-I129 PolarHBondContact O-N 3.44Å; I129-W131 PolarHBondContact O-N 2.77Å; I129-K134 HydrophobicContact CG2-CB 4.24Å | ||
| 130 | D | 65.5 | Low | 58 | Low | 71 Ų | 71 | 100.9 Ų | 100.9 | 38% | 0.38 | 52% | 0.523 | S | S | . | . | trans | -55.4 | 118.5 | 178.8 | -166.2 | 8 | 0 | 0 | 0 | 102.5 | L128 M132 E133 K134 | L128-D130 VanDerWaalsContact C-N 3.25Å; L128-D130 PolarHBondContact O-N 3.05Å; D130-M132 PolarHBondContact O-N 2.92Å; D130-E133 HydrophobicContact CB-CB 4.23Å; D130-E133 HydrophobicContact CB-CG 4.11Å; D130-E133 WeakPolarHBondContact O-CA 3.43Å; D130-E133 PolarHBondContact O-N 2.95Å; D130-K134 PolarHBondContact O-N 3.03Å | ||
| 131 | W | 62.6 | Low | 58.3 | Low | 171 Ų | 171 | 99.4 Ų | 99.4 | 65% | 0.648 | 51% | 0.51 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.6 | -18.1 | -172.5 | 54.8 | -88.4 | 0 | 0 | 0 | 109.8 | I129 Y157 | I129-W131 PolarHBondContact O-N 2.77Å; W131-Y157 WeakPolarHBondContact O-CD2 3.4Å |
| 132 | M | 70.6 | Confident | 58.5 | Low | 50 Ų | 50 | 95.3 Ų | 95.3 | 25% | 0.246 | 51% | 0.505 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -71.6 | -24.1 | 169.9 | -64.7 | -178.6 | 62.2 | 0 | 0 | 115.6 | D130 T156 Y157 K158 | D130-M132 PolarHBondContact O-N 2.92Å; M132-T156 WeakPolarHBondContact O-CG2 3.14Å; M132-Y157 PolarHBondContact O-N 3.03Å; M132-K158 HydrophobicContact CB-CB 4.37Å; M132-K158 HydrophobicContact CE-CB 4.27Å; M132-K158 HydrophobicContact CE-CD 4.48Å; M132-K158 HydrophobicContact CE-CG 4.14Å; M132-K158 PolarHBondContact O-N 3.45Å |
| 133 | E | 72 | Confident | 59.1 | Low | 130 Ų | 130 | 92.7 Ų | 92.7 | 61% | 0.607 | 49% | 0.494 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94.8 | -7.4 | 178.6 | -74.2 | -172.9 | 175.5 | 0 | 0 | 113.9 | D130 T156 | D130-E133 HydrophobicContact CB-CB 4.23Å; D130-E133 HydrophobicContact CB-CG 4.11Å; D130-E133 WeakPolarHBondContact O-CA 3.43Å; D130-E133 PolarHBondContact O-N 2.95Å; E133-T156 WeakPolarHBondContact O-CG2 3.46Å |
| 134 | K | 72.7 | Confident | 59.9 | Low | 91 Ų | 91 | 92.3 Ų | 92.3 | 40% | 0.396 | 49% | 0.487 | S | S | . | . | S | Bend | trans | -69.7 | 128.5 | 175.1 | -166.1 | -178.7 | 176 | -162.6 | 0 | 109.1 | I129 D130 L136 E137 Y157 | I129-K134 HydrophobicContact CG2-CB 4.24Å; D130-K134 PolarHBondContact O-N 3.03Å; K134-L136 PolarHBondContact O-N 3.5Å; K134-E137 VanDerWaalsContact CE-OE1 3.29Å; K134-E137 WeakPolarHBondContact CE-OE1 3.44Å; K134-E137 IonicContact NZ-OE1 3.87Å; K134-E137 PolarHBondContact NZ-OE1 3.33Å; K134-Y157 HydrophobicContact CB-CD2 4.4Å; K134-Y157 HydrophobicContact CB-CE2 4.26Å; K134-Y157 WeakPolarHBondContact O-CD2 3.45Å |
| 135 | P | 70.7 | Confident | 60.7 | Low | 67 Ų | 67 | 90.8 Ų | 90.8 | 44% | 0.435 | 47% | 0.465 | S | S | . | . | B | Isolated β-bridge | trans | -58.4 | 138.7 | 172.1 | 25.3 | -33 | 0 | 0 | 0 | 108.8 | E137 | P135-E137 PolarHBondContact O-N 3.04Å |
| 136 | L | 69.8 | Low | 61.2 | Low | 31 Ų | 31 | 93.9 Ų | 93.9 | 16% | 0.162 | 46% | 0.46 | C | S | . | . | P | Polyproline II helix | trans | -67.3 | 121.9 | 172.1 | -75.3 | 104.1 | 0 | 0 | 0 | 108 | K134 T138 P155 T156 Y157 V160 | K134-L136 PolarHBondContact O-N 3.5Å; L136-T138 HydrophobicContact CB-CG2 4.1Å; L136-T138 PolarHBondContact O-N 2.85Å; L136-P155 WeakPolarHBondContact CD1-O 3.41Å; L136-P155 PolarHBondContact N-O 3.11Å; L136-T156 VanDerWaalsContact CD1-C 3.41Å; L136-Y157 HydrophobicContact CD1-CD1 4.16Å; L136-Y157 HydrophobicContact CD1-CD2 4.44Å; L136-Y157 HydrophobicContact CD1-CG 4.13Å; L136-Y157 HydrophobicContact CD2-CD1 3.94Å; L136-Y157 HydrophobicContact CD2-CE1 3.64Å; L136-Y157 HydrophobicContact CG-CD1 3.92Å; L136-Y157 HydrophobicContact CG-CD2 4.25Å; L136-Y157 HydrophobicContact CG-CE1 3.77Å; L136-Y157 HydrophobicContact CG-CE2 4.09Å; L136-Y157 HydrophobicContact CG-CG 4.16Å; L136-V160 HydrophobicContact CD1-CB 4.47Å; L136-V160 HydrophobicContact CD1-CG2 3.56Å |
| 137 | E | 67.7 | Low | 61.9 | Low | 138 Ų | 138 | 93.8 Ų | 93.8 | 65% | 0.645 | 46% | 0.461 | S | S | * | . | trans | -72.2 | 60.2 | 169.5 | -66.2 | 167.5 | -148.7 | 0 | 0 | 108.9 | K134 P135 E139 | K134-E137 VanDerWaalsContact CE-OE1 3.29Å; K134-E137 WeakPolarHBondContact CE-OE1 3.44Å; K134-E137 IonicContact NZ-OE1 3.87Å; K134-E137 PolarHBondContact NZ-OE1 3.33Å; P135-E137 PolarHBondContact O-N 3.04Å; E137-E139 PolarHBondContact O-N 3.23Å | ||
| 138 | T | 61.6 | Low | 63 | Low | 29 Ų | 29 | 92 Ų | 92 | 18% | 0.178 | 47% | 0.467 | C | S | . | . | trans | -76.8 | 99.5 | 163.8 | 52.1 | 0 | 0 | 0 | 0 | 104.3 | L136 G140 | L136-T138 HydrophobicContact CB-CG2 4.1Å; L136-T138 PolarHBondContact O-N 2.85Å; T138-G140 PolarHBondContact O-N 3.4Å | ||
| 139 | E | 61.8 | Low | 64.3 | Low | 129 Ų | 129 | 91.2 Ų | 91.2 | 60% | 0.603 | 46% | 0.464 | S | S | * | . | trans | -60.2 | 56.2 | 179.8 | -60.6 | 179.4 | 160.9 | 0 | 0 | 112 | E137 Y141 H186 | E137-E139 PolarHBondContact O-N 3.23Å; E139-Y141 VanDerWaalsContact C-N 3.33Å; E139-Y141 HydrophobicContact CB-CD2 3.76Å; E139-Y141 HydrophobicContact CB-CE2 3.73Å; E139-Y141 WeakPolarHBondContact O-CD2 3.03Å; E139-Y141 WeakPolarHBondContact O-CE2 3.16Å; E139-Y141 PolarHBondContact O-N 3.5Å; E139-H186 PolarHBondContact O-CD2 3.47Å; E139-H186 PolarHBondContact O-NE2 2.98Å | ||
| 140 | G | 56.4 | Low | 65 | Low | 20 Ų | 20 | 87.9 Ų | 87.9 | 21% | 0.206 | 46% | 0.461 | C | S | . | . | S | Bend | trans | 70.6 | 6.8 | -171.1 | 0 | 0 | 0 | 0 | 0 | 116.6 | T138 H186 | T138-G140 PolarHBondContact O-N 3.4Å; G140-H186 VanDerWaalsContact C-CE1 3.47Å; G140-H186 VanDerWaalsContact CA-NE2 3.26Å; G140-H186 WeakPolarHBondContact CA-NE2 3.15Å; G140-H186 PolarHBondContact O-CE1 2.75Å; G140-H186 PolarHBondContact O-NE2 3.19Å; G140-H186 VanDerWaalsContact O-NE2 3.13Å |
| 141 | Y | 57.2 | Low | 65.2 | Low | 108 Ų | 108 | 90 Ų | 90 | 42% | 0.424 | 47% | 0.472 | S | S | . | . | S | Bend | trans | -85.1 | -17.8 | -162 | -77.5 | -75.7 | 0 | 0 | 0 | 118.2 | E139 H186 L187 P188 | E139-Y141 VanDerWaalsContact C-N 3.33Å; E139-Y141 HydrophobicContact CB-CD2 3.76Å; E139-Y141 HydrophobicContact CB-CE2 3.73Å; E139-Y141 WeakPolarHBondContact O-CD2 3.03Å; E139-Y141 WeakPolarHBondContact O-CE2 3.16Å; E139-Y141 PolarHBondContact O-N 3.5Å; Y141-H186 AromaticContact CD1-NE2 3.92Å; Y141-H186 AromaticContact CD2-NE2 3.99Å; Y141-H186 AromaticContact CE1-NE2 3.98Å; Y141-H186 AromaticContact CE2-CD2 3.84Å; Y141-H186 AromaticContact CG-NE2 3.93Å; Y141-H186 AromaticContact CZ-CD2 3.73Å; Y141-H186 VanDerWaalsContact OH-C 3.29Å; Y141-H186 PolarHBondContact OH-O 2.75Å; Y141-L187 WeakPolarHBondContact OH-CA 3.46Å; Y141-L187 PolarHBondContact OH-N 2.61Å; Y141-P188 VanDerWaalsContact OH-CD 3.23Å; Y141-P188 WeakPolarHBondContact OH-CD 2.95Å |
| 142 | A | 55.8 | Low | 65.3 | Low | 82 Ų | 82 | 88.8 Ų | 88.8 | 68% | 0.678 | 47% | 0.468 | S | S | * | . | S | Bend | trans | -165.4 | -12.7 | -176.4 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||
| 143 | L | 61.6 | Low | 65.3 | Low | 37 Ų | 37 | 91.9 Ų | 91.9 | 19% | 0.194 | 48% | 0.48 | C | S | . | . | trans | -138.5 | 102.8 | -175.6 | -85.7 | 90.6 | 0 | 0 | 0 | 111 | P155 V160 L166 | L143-P155 HydrophobicContact CB-CG 3.7Å; L143-P155 HydrophobicContact CD2-CG 3.81Å; L143-P155 HydrophobicContact CG-CG 4.44Å; L143-P155 WeakPolarHBondContact O-CD 3.31Å; L143-V160 HydrophobicContact CD2-CG1 4.33Å; L143-V160 HydrophobicContact CD2-CG2 3.74Å; L143-L166 HydrophobicContact CD2-CB 3.76Å; L143-L166 HydrophobicContact CD2-CD2 4.11Å; L143-L166 HydrophobicContact CD2-CG 4.33Å | ||
| 144 | E | 60.1 | Low | 65.3 | Low | 71 Ų | 71 | 89.5 Ų | 89.5 | 33% | 0.332 | 47% | 0.469 | S | S | . | . | trans | -122 | 124.6 | 172.2 | -65.9 | -178.5 | 173.6 | 0 | 0 | 108.6 | Y184 | E144-Y184 WeakPolarHBondContact OE1-CE2 3.2Å; E144-Y184 PolarHBondContact OE1-OH 2.87Å; E144-Y184 PolarHBondContact OE2-OH 2.53Å | ||
| 145 | I | 61.2 | Low | 65.4 | Low | 62 Ų | 62 | 85.2 Ų | 85.2 | 32% | 0.318 | 45% | 0.451 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.5 | 127 | 171 | -42.9 | 175.8 | 0 | 0 | 0 | 108 | S147 K153 P155 L166 | I145-S147 PolarHBondContact O-N 2.88Å; I145-K153 PolarHBondContact N-O 2.9Å; I145-P155 HydrophobicContact CD1-CB 3.69Å; I145-P155 HydrophobicContact CD1-CG 4.41Å; I145-P155 HydrophobicContact CG1-CB 4.19Å; I145-P155 HydrophobicContact CG1-CG 4.41Å; I145-L166 HydrophobicContact CD1-CD1 3.9Å; I145-L166 HydrophobicContact CG1-CD2 4.42Å |
| 146 | F | 59.3 | Low | 65.7 | Low | 132 Ų | 132 | 82.9 Ų | 82.9 | 58% | 0.579 | 44% | 0.435 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -76.1 | 115.9 | 169.3 | -67.7 | -86.1 | 0 | 0 | 0 | 109.3 | Y152 | F146-Y152 HydrophobicContact CD1-CD1 4.39Å; F146-Y152 HydrophobicContact CD1-CE1 4.03Å; F146-Y152 AromaticContact CE1-CD1 3.99Å; F146-Y152 HydrophobicContact CE1-CD1 3.99Å; F146-Y152 AromaticContact CE1-CE1 3.25Å; F146-Y152 HydrophobicContact CE1-CE1 3.25Å; F146-Y152 AromaticContact CE1-CZ 3.78Å; F146-Y152 AromaticContact CZ-CE1 3.8Å; F146-Y152 HydrophobicContact CZ-CE1 3.8Å |
| 147 | S | 63.8 | Low | 66.1 | Low | 54 Ų | 54 | 85.7 Ų | 85.7 | 38% | 0.378 | 44% | 0.444 | S | S | . | . | trans | -64.9 | 153.7 | 167.2 | -177 | 0 | 0 | 0 | 0 | 110.1 | I145 D149 G150 N151 | I145-S147 PolarHBondContact O-N 2.88Å; S147-D149 PolarHBondContact O-N 2.8Å; S147-G150 PolarHBondContact O-N 3.34Å; S147-N151 WeakPolarHBondContact CB-O 3.35Å; S147-N151 PolarHBondContact N-O 3Å | ||
| 148 | N | 71.4 | Confident | 66.7 | Low | 171 Ų | 171 | 83.4 Ų | 83.4 | 91% | 0.914 | 43% | 0.432 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.9 | -22.5 | 173.5 | -74.9 | -21.1 | 0 | 0 | 0 | 113 | G150 | N148-G150 VanDerWaalsContact C-N 3.29Š|
| 149 | D | 73.1 | Confident | 67.5 | Low | 147 Ų | 147 | 85 Ų | 85 | 79% | 0.786 | 44% | 0.437 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.5 | 2.4 | 179.3 | -56.1 | -26.9 | 0 | 0 | 0 | 113.2 | S147 N151 | S147-D149 PolarHBondContact O-N 2.8Å; D149-N151 PolarHBondContact O-N 3.42Å |
| 150 | G | 69.6 | Low | 68.3 | Low | 55 Ų | 55 | 79.5 Ų | 79.5 | 57% | 0.567 | 41% | 0.413 | S | S | * | . | S | Bend | trans | 72.4 | 12.1 | -178.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | S147 N148 | S147-G150 PolarHBondContact O-N 3.34Å; N148-G150 VanDerWaalsContact C-N 3.29Å |
| 151 | N | 70.5 | Confident | 69.4 | Low | 115 Ų | 115 | 83.3 Ų | 83.3 | 62% | 0.615 | 43% | 0.427 | S | S | * | . | trans | -94.4 | 139.7 | 177.5 | -157 | 10.5 | 0 | 0 | 0 | 110.6 | S147 D149 | S147-N151 WeakPolarHBondContact CB-O 3.35Å; S147-N151 PolarHBondContact N-O 3Å; D149-N151 PolarHBondContact O-N 3.42Å | ||
| 152 | Y | 63.5 | Low | 70.5 | Confident | 145 Ų | 145 | 84.1 Ų | 84.1 | 57% | 0.569 | 44% | 0.435 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -79.5 | 133.4 | -179.5 | -61.2 | -89.4 | 0 | 0 | 0 | 110.3 | F146 | F146-Y152 HydrophobicContact CD1-CD1 4.39Å; F146-Y152 HydrophobicContact CD1-CE1 4.03Å; F146-Y152 AromaticContact CE1-CD1 3.99Å; F146-Y152 HydrophobicContact CE1-CD1 3.99Å; F146-Y152 AromaticContact CE1-CE1 3.25Å; F146-Y152 HydrophobicContact CE1-CE1 3.25Å; F146-Y152 AromaticContact CE1-CZ 3.78Å; F146-Y152 AromaticContact CZ-CE1 3.8Å; F146-Y152 HydrophobicContact CZ-CE1 3.8Å |
| 153 | K | 70.6 | Confident | 71.4 | Confident | 116 Ų | 116 | 84.4 Ų | 84.4 | 50% | 0.504 | 43% | 0.425 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -140.7 | 128.9 | 174.9 | -167.7 | -167 | 167.3 | -149 | 0 | 109.5 | I145 E159 | I145-K153 PolarHBondContact N-O 2.9Å; K153-E159 IonicContact NZ-OE1 2.77Å; K153-E159 PolarHBondContact NZ-OE1 3.09Å; K153-E159 IonicContact NZ-OE2 3.25Å |
| 154 | E | 72.4 | Confident | 72 | Confident | 80 Ų | 80 | 88.9 Ų | 88.9 | 37% | 0.374 | 45% | 0.449 | S | S | . | . | P | Polyproline II helix | trans | -65.1 | 133.5 | 168.5 | -70.7 | 172.6 | 173.2 | 0 | 0 | 109.1 | ||
| 155 | P | 74.6 | Confident | 72.5 | Confident | 1 Ų | 1 | 93.3 Ų | 93.3 | 1% | 0.006 | 46% | 0.464 | C | S | . | . | P | Polyproline II helix | trans | -66.7 | 157.6 | 177.7 | 23.4 | -27.8 | 0 | 0 | 0 | 111.8 | L136 L143 I145 E159 V160 L166 | L136-P155 WeakPolarHBondContact CD1-O 3.41Å; L136-P155 PolarHBondContact N-O 3.11Å; L143-P155 HydrophobicContact CB-CG 3.7Å; L143-P155 HydrophobicContact CD2-CG 3.81Å; L143-P155 HydrophobicContact CG-CG 4.44Å; L143-P155 WeakPolarHBondContact O-CD 3.31Å; I145-P155 HydrophobicContact CD1-CB 3.69Å; I145-P155 HydrophobicContact CD1-CG 4.41Å; I145-P155 HydrophobicContact CG1-CB 4.19Å; I145-P155 HydrophobicContact CG1-CG 4.41Å; P155-E159 WeakPolarHBondContact CA-OE2 3.5Å; P155-E159 HydrophobicContact CB-CB 4.42Å; P155-V160 HydrophobicContact CB-CG2 3.85Å; P155-V160 HydrophobicContact CG-CG2 3.99Å; P155-L166 HydrophobicContact CB-CD1 4.34Å |
| 156 | T | 78.3 | Confident | 72.9 | Confident | 17 Ų | 17 | 92.2 Ų | 92.2 | 10% | 0.104 | 46% | 0.459 | C | S | . | . | B | Isolated β-bridge | trans | -93.7 | 152.2 | 177.1 | -39.8 | 0 | 0 | 0 | 0 | 109.4 | M132 E133 L136 K158 E159 V160 | M132-T156 WeakPolarHBondContact O-CG2 3.14Å; E133-T156 WeakPolarHBondContact O-CG2 3.46Å; L136-T156 VanDerWaalsContact CD1-C 3.41Å; T156-K158 PolarHBondContact O-N 2.71Å; T156-K158 VanDerWaalsContact O-N 3.09Å; T156-E159 WeakPolarHBondContact CB-OE2 3.31Å; T156-E159 PolarHBondContact N-OE2 2.93Å; T156-E159 WeakPolarHBondContact O-CB 3.13Å; T156-E159 PolarHBondContact O-N 2.89Å; T156-E159 PolarHBondContact OG1-OE2 3.28Å; T156-V160 PolarHBondContact O-N 3.26Å |
| 157 | Y | 77 | Confident | 73.4 | Confident | 91 Ų | 91 | 91 Ų | 91 | 36% | 0.357 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -52.1 | -37.7 | 178.3 | -72.1 | -81.8 | 0 | 0 | 0 | 112.8 | W131 M132 K134 L136 V160 I161 | W131-Y157 WeakPolarHBondContact O-CD2 3.4Å; M132-Y157 PolarHBondContact O-N 3.03Å; K134-Y157 HydrophobicContact CB-CD2 4.4Å; K134-Y157 HydrophobicContact CB-CE2 4.26Å; K134-Y157 WeakPolarHBondContact O-CD2 3.45Å; L136-Y157 HydrophobicContact CD1-CD1 4.16Å; L136-Y157 HydrophobicContact CD1-CD2 4.44Å; L136-Y157 HydrophobicContact CD1-CG 4.13Å; L136-Y157 HydrophobicContact CD2-CD1 3.94Å; L136-Y157 HydrophobicContact CD2-CE1 3.64Å; L136-Y157 HydrophobicContact CG-CD1 3.92Å; L136-Y157 HydrophobicContact CG-CD2 4.25Å; L136-Y157 HydrophobicContact CG-CE1 3.77Å; L136-Y157 HydrophobicContact CG-CE2 4.09Å; L136-Y157 HydrophobicContact CG-CG 4.16Å; Y157-V160 PolarHBondContact O-N 3.35Å; Y157-I161 WeakPolarHBondContact O-CD1 3.16Å; Y157-I161 WeakPolarHBondContact O-CG1 3.09Å; Y157-I161 PolarHBondContact O-N 3.48Å; Y157-I161 VanDerWaalsContact O-N 3.11Å |
| 158 | K | 81 | Confident | 73.4 | Confident | 90 Ų | 90 | 91.4 Ų | 91.4 | 39% | 0.391 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -62.2 | -44.4 | 174.4 | -173.3 | 174.6 | 177.1 | -177.7 | 0 | 113.3 | M132 T156 I161 E162 | M132-K158 HydrophobicContact CB-CB 4.37Å; M132-K158 HydrophobicContact CE-CB 4.27Å; M132-K158 HydrophobicContact CE-CD 4.48Å; M132-K158 HydrophobicContact CE-CG 4.14Å; M132-K158 PolarHBondContact O-N 3.45Å; T156-K158 PolarHBondContact O-N 2.71Å; T156-K158 VanDerWaalsContact O-N 3.09Å; K158-I161 PolarHBondContact O-N 2.97Å; K158-E162 WeakPolarHBondContact CE-OE1 2.88Å; K158-E162 WeakPolarHBondContact CG-OE1 3.39Å; K158-E162 WeakPolarHBondContact O-CB 2.84Å; K158-E162 WeakPolarHBondContact O-CG 2.83Å; K158-E162 PolarHBondContact O-N 3.25Å |
| 159 | E | 79.1 | Confident | 73.1 | Confident | 61 Ų | 61 | 89.4 Ų | 89.4 | 29% | 0.285 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -64.8 | -41.7 | 179.6 | -66 | 166.4 | 163.2 | 0 | 0 | 110.2 | K153 P155 T156 I161 E162 D163 | K153-E159 IonicContact NZ-OE1 2.77Å; K153-E159 PolarHBondContact NZ-OE1 3.09Å; K153-E159 IonicContact NZ-OE2 3.25Å; P155-E159 WeakPolarHBondContact CA-OE2 3.5Å; P155-E159 HydrophobicContact CB-CB 4.42Å; T156-E159 WeakPolarHBondContact CB-OE2 3.31Å; T156-E159 PolarHBondContact N-OE2 2.93Å; T156-E159 WeakPolarHBondContact O-CB 3.13Å; T156-E159 PolarHBondContact O-N 2.89Å; T156-E159 PolarHBondContact OG1-OE2 3.28Å; E159-I161 VanDerWaalsContact C-N 3.34Å; E159-I161 PolarHBondContact O-N 2.9Å; E159-E162 PolarHBondContact O-N 2.67Å; E159-D163 WeakPolarHBondContact O-CB 3.25Å; E159-D163 PolarHBondContact O-N 3.29Å |
| 160 | V | 77.1 | Confident | 72.6 | Confident | 14 Ų | 14 | 86.9 Ų | 86.9 | 9% | 0.085 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -64.5 | -35.6 | 176.6 | 179.9 | 0 | 0 | 0 | 0 | 112.9 | L136 L143 P155 T156 Y157 L166 L167 | L136-V160 HydrophobicContact CD1-CB 4.47Å; L136-V160 HydrophobicContact CD1-CG2 3.56Å; L143-V160 HydrophobicContact CD2-CG1 4.33Å; L143-V160 HydrophobicContact CD2-CG2 3.74Å; P155-V160 HydrophobicContact CB-CG2 3.85Å; P155-V160 HydrophobicContact CG-CG2 3.99Å; T156-V160 PolarHBondContact O-N 3.26Å; Y157-V160 PolarHBondContact O-N 3.35Å; V160-L166 HydrophobicContact CG1-CB 4.24Å; V160-L166 HydrophobicContact CG2-CD1 4.28Å; V160-L167 HydrophobicContact CG1-CD2 3.72Å; V160-L167 HydrophobicContact CG1-CG 4.15Å |
| 161 | I | 79.3 | Confident | 72.3 | Confident | 100 Ų | 100 | 93 Ų | 93 | 51% | 0.513 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -77 | -31.1 | 179.4 | -67.6 | 167.3 | 0 | 0 | 0 | 111.8 | Y157 K158 E159 | Y157-I161 WeakPolarHBondContact O-CD1 3.16Å; Y157-I161 WeakPolarHBondContact O-CG1 3.09Å; Y157-I161 PolarHBondContact O-N 3.48Å; Y157-I161 VanDerWaalsContact O-N 3.11Å; K158-I161 PolarHBondContact O-N 2.97Å; E159-I161 VanDerWaalsContact C-N 3.34Å; E159-I161 PolarHBondContact O-N 2.9Å |
| 162 | E | 82.2 | Confident | 72 | Confident | 125 Ų | 125 | 94.1 Ų | 94.1 | 58% | 0.584 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -81.9 | -32.1 | -178.9 | -72.9 | 175 | -178.6 | 0 | 0 | 112.5 | K158 E159 | K158-E162 WeakPolarHBondContact CE-OE1 2.88Å; K158-E162 WeakPolarHBondContact CG-OE1 3.39Å; K158-E162 WeakPolarHBondContact O-CB 2.84Å; K158-E162 WeakPolarHBondContact O-CG 2.83Å; K158-E162 PolarHBondContact O-N 3.25Å; E159-E162 PolarHBondContact O-N 2.67Å |
| 163 | D | 73.8 | Confident | 72.1 | Confident | 88 Ų | 88 | 91.5 Ų | 91.5 | 47% | 0.471 | 45% | 0.453 | S | S | . | . | trans | -100 | 98.8 | 179.2 | -69.7 | -28.3 | 0 | 0 | 0 | 111.3 | E159 Y165 L166 | E159-D163 WeakPolarHBondContact O-CB 3.25Å; E159-D163 PolarHBondContact O-N 3.29Å; D163-Y165 PolarHBondContact O-N 2.72Å; D163-L166 HydrophobicContact CB-CD1 3.91Å; D163-L166 HydrophobicContact CB-CG 3.96Å; D163-L166 WeakPolarHBondContact O-CB 3.14Å; D163-L166 PolarHBondContact O-N 3.01Å | ||
| 164 | D | 74 | Confident | 71.8 | Confident | 131 Ų | 131 | 93.5 Ų | 93.5 | 70% | 0.701 | 46% | 0.464 | S | S | * | . | G | 310 helix | trans | -49.8 | -29.1 | 176.6 | -80 | -13 | 0 | 0 | 0 | 113.2 | L166 L167 | D164-L166 VanDerWaalsContact C-N 3.27Å; D164-L166 PolarHBondContact O-N 2.75Å; D164-L167 PolarHBondContact O-N 2.6Å |
| 165 | Y | 70 | Confident | 71.6 | Confident | 164 Ų | 164 | 94.2 Ų | 94.2 | 64% | 0.643 | 47% | 0.47 | S | S | * | . | G | 310 helix | trans | -66.2 | -27.2 | -180 | -141.3 | -86.6 | 0 | 0 | 0 | 113.1 | D163 L167 E173 | D163-Y165 PolarHBondContact O-N 2.72Å; Y165-L167 VanDerWaalsContact C-N 3.29Å; Y165-E173 WeakPolarHBondContact CE1-OE1 2.85Å; Y165-E173 VanDerWaalsContact CZ-OE1 3.23Å; Y165-E173 PolarHBondContact OH-OE1 3.36Å |
| 166 | L | 70.3 | Confident | 71.4 | Confident | 39 Ų | 39 | 101.4 Ų | 101.4 | 20% | 0.204 | 50% | 0.498 | C | S | . | . | G | 310 helix | trans | -81.6 | -9.8 | 178.9 | -63.9 | -178.9 | 0 | 0 | 0 | 112.8 | L143 I145 P155 V160 D163 D164 | L143-L166 HydrophobicContact CD2-CB 3.76Å; L143-L166 HydrophobicContact CD2-CD2 4.11Å; L143-L166 HydrophobicContact CD2-CG 4.33Å; I145-L166 HydrophobicContact CD1-CD1 3.9Å; I145-L166 HydrophobicContact CG1-CD2 4.42Å; P155-L166 HydrophobicContact CB-CD1 4.34Å; V160-L166 HydrophobicContact CG1-CB 4.24Å; V160-L166 HydrophobicContact CG2-CD1 4.28Å; D163-L166 HydrophobicContact CB-CD1 3.91Å; D163-L166 HydrophobicContact CB-CG 3.96Å; D163-L166 WeakPolarHBondContact O-CB 3.14Å; D163-L166 PolarHBondContact O-N 3.01Å; D164-L166 VanDerWaalsContact C-N 3.27Å; D164-L166 PolarHBondContact O-N 2.75Å |
| 167 | L | 69.6 | Low | 71.3 | Confident | 107 Ų | 107 | 109.3 Ų | 109.3 | 56% | 0.56 | 54% | 0.539 | S | S | * | . | G | 310 helix | trans | -100.1 | -3 | 177.6 | -69.7 | 170.8 | 0 | 0 | 0 | 113.2 | V160 D164 Y165 | V160-L167 HydrophobicContact CG1-CD2 3.72Å; V160-L167 HydrophobicContact CG1-CG 4.15Å; D164-L167 PolarHBondContact O-N 2.6Å; Y165-L167 VanDerWaalsContact C-N 3.29Å |
| 168 | C | 64.3 | Low | 71.4 | Confident | 62 Ų | 62 | 111.1 Ų | 111.1 | 42% | 0.419 | 56% | 0.555 | S | S | . | * | trans | -71.8 | 130.1 | 179.5 | -67.6 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 169 | E | 64.7 | Low | 71 | Confident | 130 Ų | 130 | 110.2 Ų | 110.2 | 61% | 0.607 | 56% | 0.555 | S | S | * | * | trans | -72.4 | 144.4 | 167.4 | -62.4 | -142.9 | 169.4 | 0 | 0 | 109.4 | E171 Q172 | E169-E171 PolarHBondContact O-N 2.67Å; E169-Q172 HydrophobicContact CB-CG 4.39Å; E169-Q172 WeakPolarHBondContact O-CB 3.43Å; E169-Q172 PolarHBondContact O-N 3.38Å | ||
| 170 | A | 63.1 | Low | 70.4 | Confident | 93 Ų | 93 | 116.5 Ų | 116.5 | 77% | 0.769 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.1 | -19.9 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | Q172 | A170-Q172 VanDerWaalsContact C-N 3.32Š|
| 171 | E | 63.7 | Low | 69.4 | Low | 185 Ų | 185 | 122.2 Ų | 122.2 | 86% | 0.864 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79 | -11.5 | 176 | -58.4 | -172.1 | 175.1 | 0 | 0 | 113.9 | E169 | E169-E171 PolarHBondContact O-N 2.67Š|
| 172 | Q | 64.3 | Low | 68.5 | Low | 138 Ų | 138 | 122.2 Ų | 122.2 | 65% | 0.645 | 61% | 0.609 | S | S | * | * | S | Bend | trans | -102.3 | -8.3 | -175.8 | -62.1 | 170.3 | -13.3 | 0 | 0 | 113.2 | E169 A170 | E169-Q172 HydrophobicContact CB-CG 4.39Å; E169-Q172 WeakPolarHBondContact O-CB 3.43Å; E169-Q172 PolarHBondContact O-N 3.38Å; A170-Q172 VanDerWaalsContact C-N 3.32Å |
| 173 | E | 63.7 | Low | 67.1 | Low | 89 Ų | 89 | 124.7 Ų | 124.7 | 42% | 0.416 | 62% | 0.619 | S | S | . | * | S | Bend | trans | -85.5 | 121 | -179.9 | -134.8 | -179.1 | 173.5 | 0 | 0 | 110.8 | Y165 L175 | Y165-E173 WeakPolarHBondContact CE1-OE1 2.85Å; Y165-E173 VanDerWaalsContact CZ-OE1 3.23Å; Y165-E173 PolarHBondContact OH-OE1 3.36Å; E173-L175 PolarHBondContact O-N 2.81Å |
| 174 | E | 66.3 | Low | 65.9 | Low | 159 Ų | 159 | 125.6 Ų | 125.6 | 74% | 0.743 | 62% | 0.616 | S | S | * | * | trans | -71.5 | 97.9 | 170 | -73.2 | -172.7 | 169.2 | 0 | 0 | 108.8 | Y176 | E174-Y176 WeakPolarHBondContact O-CD2 3.32Å; E174-Y176 WeakPolarHBondContact O-CE2 3.32Å; E174-Y176 PolarHBondContact O-N 3.49Å | ||
| 175 | L | 67.1 | Low | 65 | Low | 95 Ų | 95 | 128.9 Ų | 128.9 | 50% | 0.497 | 63% | 0.627 | S | S | . | * | trans | -65.5 | 126.5 | -179.8 | -156.8 | 84 | 0 | 0 | 0 | 111.5 | E173 D179 F181 | E173-L175 PolarHBondContact O-N 2.81Å; L175-D179 WeakPolarHBondContact CA-OD2 2.93Å; L175-D179 HydrophobicContact CD1-CB 3.6Å; L175-D179 HydrophobicContact CG-CB 3.84Å; L175-F181 HydrophobicContact CD1-CE1 4.1Å; L175-F181 HydrophobicContact CD1-CE2 3.88Å; L175-F181 HydrophobicContact CD1-CZ 3.43Å; L175-F181 VanDerWaalsContact CD1-CZ 3.43Å; L175-F181 HydrophobicContact CD2-CE2 3.46Å; L175-F181 VanDerWaalsContact CD2-CE2 3.46Å; L175-F181 HydrophobicContact CD2-CZ 3.68Å; L175-F181 HydrophobicContact CG-CE2 4.33Å; L175-F181 HydrophobicContact CG-CZ 4.2Å | ||
| 176 | Y | 70.1 | Confident | 64.3 | Low | 151 Ų | 151 | 124.2 Ų | 124.2 | 59% | 0.592 | 61% | 0.611 | S | S | * | * | trans | -91.1 | 159.4 | 171.8 | -66.6 | -85.4 | 0 | 0 | 0 | 111.1 | E174 D178 D179 | E174-Y176 WeakPolarHBondContact O-CD2 3.32Å; E174-Y176 WeakPolarHBondContact O-CE2 3.32Å; E174-Y176 PolarHBondContact O-N 3.49Å; Y176-D178 VanDerWaalsContact CB-OD1 3.31Å; Y176-D178 WeakPolarHBondContact CB-OD1 2.98Å; Y176-D178 PolarHBondContact O-N 2.82Å; Y176-D179 PolarHBondContact N-OD2 3.37Å; Y176-D179 PolarHBondContact O-N 2.98Å; Y176-D179 VanDerWaalsContact O-N 3.11Å | ||
| 177 | D | 76.8 | Confident | 63.7 | Low | 183 Ų | 183 | 129.4 Ų | 129.4 | 98% | 0.979 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.4 | -15.2 | -175.6 | -76.5 | -25.3 | 0 | 0 | 0 | 114.1 | ||
| 178 | D | 80 | Confident | 63.2 | Low | 130 Ų | 130 | 128.4 Ų | 128.4 | 70% | 0.695 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.8 | -4.9 | 179.6 | 56.1 | -34.4 | 0 | 0 | 0 | 115.1 | Y176 | Y176-D178 VanDerWaalsContact CB-OD1 3.31Å; Y176-D178 WeakPolarHBondContact CB-OD1 2.98Å; Y176-D178 PolarHBondContact O-N 2.82Å |
| 179 | D | 71.7 | Confident | 63.2 | Low | 71 Ų | 71 | 133.9 Ų | 133.9 | 38% | 0.38 | 66% | 0.658 | S | S | . | * | trans | -71.6 | 132.8 | -178.9 | -64.9 | -29.5 | 0 | 0 | 0 | 112 | L175 Y176 | L175-D179 WeakPolarHBondContact CA-OD2 2.93Å; L175-D179 HydrophobicContact CD1-CB 3.6Å; L175-D179 HydrophobicContact CG-CB 3.84Å; Y176-D179 PolarHBondContact N-OD2 3.37Å; Y176-D179 PolarHBondContact O-N 2.98Å; Y176-D179 VanDerWaalsContact O-N 3.11Å | ||
| 180 | K | 67.2 | Low | 63.1 | Low | 193 Ų | 193 | 133.4 Ų | 133.4 | 84% | 0.839 | 67% | 0.666 | S | S | * | * | trans | -111.9 | 113.3 | 177.8 | -66.6 | -178.4 | -175.3 | -179.2 | 0 | 110 | V182 | K180-V182 PolarHBondContact O-N 3.11Š| ||
| 181 | F | 56.1 | Low | 62.9 | Low | 133 Ų | 133 | 138.1 Ų | 138.1 | 58% | 0.583 | 67% | 0.672 | S | S | * | * | trans | -67.9 | 126.5 | 168.4 | -65.9 | -80.2 | 0 | 0 | 0 | 110.8 | L175 F183 | L175-F181 HydrophobicContact CD1-CE1 4.1Å; L175-F181 HydrophobicContact CD1-CE2 3.88Å; L175-F181 HydrophobicContact CD1-CZ 3.43Å; L175-F181 VanDerWaalsContact CD1-CZ 3.43Å; L175-F181 HydrophobicContact CD2-CE2 3.46Å; L175-F181 VanDerWaalsContact CD2-CE2 3.46Å; L175-F181 HydrophobicContact CD2-CZ 3.68Å; L175-F181 HydrophobicContact CG-CE2 4.33Å; L175-F181 HydrophobicContact CG-CZ 4.2Å; F181-F183 HydrophobicContact CB-CD2 4.23Å; F181-F183 HydrophobicContact CB-CE2 3.69Å; F181-F183 HydrophobicContact CB-CZ 3.99Å; F181-F183 HydrophobicContact CG-CE2 4.42Å; F181-F183 HydrophobicContact CG-CZ 4.31Å | ||
| 182 | V | 59.7 | Low | 63.3 | Low | 100 Ų | 100 | 135.7 Ų | 135.7 | 61% | 0.606 | 67% | 0.67 | S | S | * | * | trans | -101.9 | 103.9 | 164.2 | -176.9 | 0 | 0 | 0 | 0 | 106.9 | K180 Y184 | K180-V182 PolarHBondContact O-N 3.11Å; V182-Y184 HydrophobicContact CG1-CD1 4.14Å; V182-Y184 HydrophobicContact CG1-CD2 4.37Å; V182-Y184 HydrophobicContact CG1-CE1 3.72Å; V182-Y184 HydrophobicContact CG1-CE2 3.99Å; V182-Y184 HydrophobicContact CG1-CG 4.43Å | ||
| 183 | F | 51.9 | Low | 63.7 | Low | 177 Ų | 177 | 136.2 Ų | 136.2 | 78% | 0.776 | 68% | 0.676 | S | S | * | * | trans | -82.1 | 121.7 | 170.9 | -63.6 | -81.7 | 0 | 0 | 0 | 108.4 | F181 | F181-F183 HydrophobicContact CB-CD2 4.23Å; F181-F183 HydrophobicContact CB-CE2 3.69Å; F181-F183 HydrophobicContact CB-CZ 3.99Å; F181-F183 HydrophobicContact CG-CE2 4.42Å; F181-F183 HydrophobicContact CG-CZ 4.31Å | ||
| 184 | Y | 49.9 | Very low | 63.9 | Low | 108 Ų | 108 | 137.2 Ų | 137.2 | 42% | 0.424 | 69% | 0.69 | S | S | . | * | trans | -97.9 | 133.1 | 172.6 | -64.3 | -71.3 | 0 | 0 | 0 | 111.1 | E144 V182 H186 | E144-Y184 WeakPolarHBondContact OE1-CE2 3.2Å; E144-Y184 PolarHBondContact OE1-OH 2.87Å; E144-Y184 PolarHBondContact OE2-OH 2.53Å; V182-Y184 HydrophobicContact CG1-CD1 4.14Å; V182-Y184 HydrophobicContact CG1-CD2 4.37Å; V182-Y184 HydrophobicContact CG1-CE1 3.72Å; V182-Y184 HydrophobicContact CG1-CE2 3.99Å; V182-Y184 HydrophobicContact CG1-CG 4.43Å; Y184-H186 WeakPolarHBondContact CB-CE1 3.22Å; Y184-H186 WeakPolarHBondContact CB-ND1 3.38Å; Y184-H186 AromaticContact CG-CE1 3.9Å | ||
| 185 | E | 54.7 | Low | 64.2 | Low | 200 Ų | 200 | 138.7 Ų | 138.7 | 94% | 0.935 | 70% | 0.697 | S | S | * | * | trans | -100.2 | 37.5 | -172.8 | -68.7 | -170.1 | 153.2 | 0 | 0 | 114.5 | ||||
| 186 | H | 54.4 | Low | 64.5 | Low | 65 Ų | 65 | 140.3 Ų | 140.3 | 30% | 0.301 | 71% | 0.71 | S | S | . | * | trans | -107.7 | 52.6 | -168 | 53.8 | -89.5 | 0 | 0 | 0 | 115.3 | E139 G140 Y141 Y184 P188 | E139-H186 PolarHBondContact O-CD2 3.47Å; E139-H186 PolarHBondContact O-NE2 2.98Å; G140-H186 VanDerWaalsContact C-CE1 3.47Å; G140-H186 VanDerWaalsContact CA-NE2 3.26Å; G140-H186 WeakPolarHBondContact CA-NE2 3.15Å; G140-H186 PolarHBondContact O-CE1 2.75Å; G140-H186 PolarHBondContact O-NE2 3.19Å; G140-H186 VanDerWaalsContact O-NE2 3.13Å; Y141-H186 AromaticContact CD1-NE2 3.92Å; Y141-H186 AromaticContact CD2-NE2 3.99Å; Y141-H186 AromaticContact CE1-NE2 3.98Å; Y141-H186 AromaticContact CE2-CD2 3.84Å; Y141-H186 AromaticContact CG-NE2 3.93Å; Y141-H186 AromaticContact CZ-CD2 3.73Å; Y141-H186 VanDerWaalsContact OH-C 3.29Å; Y141-H186 PolarHBondContact OH-O 2.75Å; Y184-H186 WeakPolarHBondContact CB-CE1 3.22Å; Y184-H186 WeakPolarHBondContact CB-ND1 3.38Å; Y184-H186 AromaticContact CG-CE1 3.9Å; H186-P188 VanDerWaalsContact O-CD 3.31Å; H186-P188 WeakPolarHBondContact O-CD 3.27Å | ||
| 187 | L | 57.7 | Low | 64.3 | Low | 148 Ų | 148 | 141.5 Ų | 141.5 | 78% | 0.775 | 72% | 0.722 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 117.5 | 158.5 | -88 | 153.6 | 0 | 0 | 0 | 109.5 | Y141 Q189 | Y141-L187 WeakPolarHBondContact OH-CA 3.46Å; Y141-L187 PolarHBondContact OH-N 2.61Å; L187-Q189 PolarHBondContact O-N 2.91Å; L187-Q189 VanDerWaalsContact O-N 3.11Å |
| 188 | P | 60 | Low | 63.9 | Low | 87 Ų | 87 | 139.8 Ų | 139.8 | 57% | 0.565 | 71% | 0.712 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 120.2 | 178.4 | 24.4 | -31.7 | 0 | 0 | 0 | 108.4 | Y141 H186 | Y141-P188 VanDerWaalsContact OH-CD 3.23Å; Y141-P188 WeakPolarHBondContact OH-CD 2.95Å; H186-P188 VanDerWaalsContact O-CD 3.31Å; H186-P188 WeakPolarHBondContact O-CD 3.27Å |
| 189 | Q | 64.8 | Low | 63.2 | Low | 177 Ų | 177 | 141 Ų | 141 | 83% | 0.827 | 72% | 0.717 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 137.8 | 171.6 | -66 | -175.2 | 5.7 | 0 | 0 | 108.6 | L187 Q191 | L187-Q189 PolarHBondContact O-N 2.91Å; L187-Q189 VanDerWaalsContact O-N 3.11Å; Q189-Q191 PolarHBondContact O-N 2.83Å |
| 190 | P | 61.4 | Low | 62.9 | Low | 120 Ų | 120 | 143.5 Ų | 143.5 | 78% | 0.779 | 74% | 0.735 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 126.4 | -178 | 22.4 | -32.2 | 0 | 0 | 0 | 109.9 | T192 | P190-T192 PolarHBondContact O-N 3.03Å; P190-T192 VanDerWaalsContact O-N 3.12Å |
| 191 | Q | 59.3 | Low | 63.1 | Low | 192 Ų | 192 | 138.6 Ų | 138.6 | 90% | 0.897 | 72% | 0.722 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 117.7 | -177.8 | -65.7 | -173.9 | 0.2 | 0 | 0 | 110.6 | Q189 I193 | Q189-Q191 PolarHBondContact O-N 2.83Å; Q191-I193 PolarHBondContact O-N 2.93Å |
| 192 | T | 71.6 | Confident | 64 | Low | 134 Ų | 134 | 141.7 Ų | 141.7 | 82% | 0.822 | 74% | 0.735 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 118.9 | 174.4 | -54 | 0 | 0 | 0 | 0 | 109.7 | P190 | P190-T192 PolarHBondContact O-N 3.03Å; P190-T192 VanDerWaalsContact O-N 3.12Å |
| 193 | I | 72.2 | Confident | 64.4 | Low | 148 Ų | 148 | 142.6 Ų | 142.6 | 76% | 0.759 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -62.5 | 126.9 | 174.6 | -54.9 | 172.6 | 0 | 0 | 0 | 108.2 | Q191 E195 | Q191-I193 PolarHBondContact O-N 2.93Å; I193-E195 PolarHBondContact O-N 2.55Å |
| 194 | P | 68.6 | Low | 65 | Low | 110 Ų | 110 | 136.2 Ų | 136.2 | 71% | 0.714 | 72% | 0.716 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 137.5 | 176.5 | 25.8 | -32.8 | 0 | 0 | 0 | 110.6 | V196 | P194-V196 PolarHBondContact O-N 2.7Š|
| 195 | E | 72.7 | Confident | 65.6 | Low | 190 Ų | 190 | 139.7 Ų | 139.7 | 89% | 0.888 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 131.2 | 177.3 | -70.6 | -177 | 171.2 | 0 | 0 | 110.6 | I193 E197 | I193-E195 PolarHBondContact O-N 2.55Å; E195-E197 PolarHBondContact O-N 3.38Å |
| 196 | V | 73.3 | Confident | 66.2 | Low | 129 Ų | 129 | 138.8 Ų | 138.8 | 78% | 0.782 | 73% | 0.726 | S | S | * | * | trans | -69.9 | 111.8 | 178 | 179.8 | 0 | 0 | 0 | 0 | 108.9 | P194 N198 | P194-V196 PolarHBondContact O-N 2.7Å; V196-N198 PolarHBondContact O-N 2.72Å | ||
| 197 | E | 67.2 | Low | 66.7 | Low | 177 Ų | 177 | 142.9 Ų | 142.9 | 83% | 0.827 | 74% | 0.744 | S | S | * | * | trans | -62.6 | 120 | 170.6 | -67.6 | -174.1 | 173.3 | 0 | 0 | 110 | E195 I199 | E195-E197 PolarHBondContact O-N 3.38Å; E197-I199 PolarHBondContact O-N 2.68Å; E197-I199 VanDerWaalsContact O-N 3.1Å | ||
| 198 | N | 66.4 | Low | 67 | Low | 146 Ų | 146 | 142.4 Ų | 142.4 | 78% | 0.781 | 74% | 0.742 | S | S | * | * | trans | -65.2 | 109.3 | 174.8 | -78.5 | -29.6 | 0 | 0 | 0 | 110.1 | V196 T200 | V196-N198 PolarHBondContact O-N 2.72Å; N198-T200 PolarHBondContact O-N 3.29Å | ||
| 199 | I | 65.5 | Low | 67.2 | Low | 155 Ų | 155 | 145.2 Ų | 145.2 | 80% | 0.795 | 75% | 0.752 | S | S | * | * | trans | -66.3 | 104.1 | 175.5 | -53.8 | 169.8 | 0 | 0 | 0 | 108.9 | E197 T201 | E197-I199 PolarHBondContact O-N 2.68Å; E197-I199 VanDerWaalsContact O-N 3.1Å; I199-T201 PolarHBondContact O-N 3.47Å | ||
| 200 | T | 66.9 | Low | 67.4 | Low | 125 Ų | 125 | 144.7 Ų | 144.7 | 77% | 0.767 | 75% | 0.753 | S | S | * | * | trans | -87.3 | 96.6 | 174.9 | 62.8 | 0 | 0 | 0 | 0 | 110.8 | N198 | N198-T200 PolarHBondContact O-N 3.29Š| ||
| 201 | T | 71.7 | Confident | 67.1 | Low | 90 Ų | 90 | 151.5 Ų | 151.5 | 55% | 0.552 | 77% | 0.77 | S | S | * | * | trans | -78.2 | 155.2 | 166.3 | 8.4 | 0 | 0 | 0 | 0 | 110.8 | I199 D203 A204 | I199-T201 PolarHBondContact O-N 3.47Å; T201-D203 PolarHBondContact O-N 2.52Å; T201-A204 VanDerWaalsContact O-CB 3.3Å; T201-A204 WeakPolarHBondContact O-CB 3.32Å; T201-A204 PolarHBondContact O-N 2.77Å | ||
| 202 | K | 73.9 | Confident | 67.5 | Low | 198 Ų | 198 | 149.5 Ų | 149.5 | 86% | 0.861 | 76% | 0.764 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.7 | -29.3 | 178.9 | -68.2 | -177.9 | -178.3 | 176.1 | 0 | 112.9 | ||
| 203 | D | 67.6 | Low | 67.3 | Low | 118 Ų | 118 | 150.3 Ų | 150.3 | 63% | 0.631 | 76% | 0.761 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.7 | -25.1 | 178.2 | -62.6 | -30.9 | 0 | 0 | 0 | 113.2 | T201 K205 K206 F207 | T201-D203 PolarHBondContact O-N 2.52Å; D203-K205 VanDerWaalsContact C-N 3.28Å; D203-K205 PolarHBondContact O-N 2.75Å; D203-K206 WeakPolarHBondContact O-CB 3.28Å; D203-K206 PolarHBondContact O-N 3.27Å; D203-F207 VanDerWaalsContact O-CD2 3.26Å; D203-F207 WeakPolarHBondContact O-CD2 3.26Å |
| 204 | A | 64.8 | Low | 67 | Low | 44 Ų | 44 | 150.4 Ų | 150.4 | 36% | 0.364 | 76% | 0.761 | S | S | . | * | G | 310 helix | trans | -63.8 | -32.5 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | T201 K206 F207 | T201-A204 VanDerWaalsContact O-CB 3.3Å; T201-A204 WeakPolarHBondContact O-CB 3.32Å; T201-A204 PolarHBondContact O-N 2.77Å; A204-K206 PolarHBondContact O-N 2.75Å; A204-K206 VanDerWaalsContact O-N 3.14Å; A204-F207 PolarHBondContact O-N 2.78Å |
| 205 | K | 62.9 | Low | 66.9 | Low | 181 Ų | 181 | 152.8 Ų | 152.8 | 79% | 0.787 | 76% | 0.764 | S | S | * | * | G | 310 helix | trans | -64.4 | -14.5 | 174.7 | -85.8 | -175.6 | 175.3 | 179.7 | 0 | 114.4 | D203 F207 | D203-K205 VanDerWaalsContact C-N 3.28Å; D203-K205 PolarHBondContact O-N 2.75Å; K205-F207 VanDerWaalsContact C-N 3.35Å |
| 206 | K | 67.9 | Low | 66.6 | Low | 180 Ų | 180 | 150.4 Ų | 150.4 | 78% | 0.783 | 76% | 0.756 | S | S | * | * | G | 310 helix | trans | -84.8 | -12 | 179.5 | -164.4 | 170.4 | 178.6 | -179.6 | 0 | 112.7 | D203 A204 | D203-K206 WeakPolarHBondContact O-CB 3.28Å; D203-K206 PolarHBondContact O-N 3.27Å; A204-K206 PolarHBondContact O-N 2.75Å; A204-K206 VanDerWaalsContact O-N 3.14Å |
| 207 | F | 63.5 | Low | 66.1 | Low | 151 Ų | 151 | 151.9 Ų | 151.9 | 66% | 0.662 | 75% | 0.754 | S | S | * | * | trans | -112 | 22.3 | -172.4 | -63.1 | -76.4 | 0 | 0 | 0 | 114.3 | D203 A204 K205 L209 | D203-F207 VanDerWaalsContact O-CD2 3.26Å; D203-F207 WeakPolarHBondContact O-CD2 3.26Å; A204-F207 PolarHBondContact O-N 2.78Å; K205-F207 VanDerWaalsContact C-N 3.35Å; F207-L209 PolarHBondContact O-N 2.97Å | ||
| 208 | D | 65.8 | Low | 66 | Low | 139 Ų | 139 | 150.1 Ų | 150.1 | 74% | 0.743 | 75% | 0.749 | S | S | * | * | trans | -66.1 | 87.3 | 169 | -76.2 | -13.5 | 0 | 0 | 0 | 109.6 | I210 | D208-I210 PolarHBondContact O-N 3.24Š| ||
| 209 | L | 62.8 | Low | 66 | Low | 146 Ų | 146 | 150.4 Ų | 150.4 | 76% | 0.764 | 75% | 0.747 | S | S | * | * | trans | -70.4 | 108.3 | 166.5 | -82.2 | 151.8 | 0 | 0 | 0 | 107.6 | F207 F211 | F207-L209 PolarHBondContact O-N 2.97Å; L209-F211 PolarHBondContact O-N 3.19Å | ||
| 210 | I | 69.1 | Low | 66.1 | Low | 166 Ų | 166 | 150 Ų | 150 | 85% | 0.851 | 74% | 0.743 | S | S | * | * | trans | -74.9 | 116 | 165.7 | -56.3 | 172.8 | 0 | 0 | 0 | 106.5 | D208 | D208-I210 PolarHBondContact O-N 3.24Š| ||
| 211 | F | 56 | Low | 66 | Low | 262 Ų | 262 | 152.3 Ų | 152.3 | 100% | 1.149 | 74% | 0.741 | S | S | * | * | trans | -74.7 | 0 | 166.1 | -72.7 | -79.2 | 0 | 0 | 0 | 111.1 | L209 | L209-F211 PolarHBondContact O-N 3.19Š|
Retrieved 211 of 211 residues in 75.3 ms
(Link to these results)