| 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 | Very low | 47.3 | Very low | 241 Ų | 241 | 119.1 Ų | 119.1 | 100% | 1.187 | 84% | 0.841 | S | S | * | * | 0 | 146.1 | 0 | 11.3 | -176.3 | 175.2 | 0 | 0 | 107.6 | |||||
| 2 | A | 41.8 | Very low | 46.6 | Very low | 108 Ų | 108 | 118.5 Ų | 118.5 | 89% | 0.893 | 84% | 0.836 | S | S | * | * | trans | 72.7 | 143.9 | -164.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 3 | S | 47.7 | Very low | 45.9 | Very low | 129 Ų | 129 | 119.7 Ų | 119.7 | 90% | 0.902 | 84% | 0.835 | S | S | * | * | trans | -118.7 | 173.7 | -153.9 | -58 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 4 | A | 44.5 | Very low | 45.7 | Very low | 105 Ų | 105 | 117.9 Ų | 117.9 | 87% | 0.868 | 83% | 0.831 | S | S | * | * | trans | -74.6 | 175.3 | -178.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 5 | A | 47.1 | Very low | 45.2 | Very low | 95 Ų | 95 | 119.8 Ų | 119.8 | 79% | 0.785 | 84% | 0.836 | S | S | * | * | trans | -90.6 | 173.5 | -167.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 6 | P | 65.4 | Low | 44.5 | Very low | 118 Ų | 118 | 122.3 Ų | 122.3 | 77% | 0.766 | 83% | 0.83 | S | S | * | * | trans | -104.4 | -155.1 | -170.9 | 45 | -37 | 0 | 0 | 0 | 112.2 | ||||
| 7 | P | 62.3 | Low | 44.4 | Very low | 115 Ų | 115 | 123.3 Ų | 123.3 | 75% | 0.747 | 83% | 0.825 | S | S | * | * | cis | -125.3 | -128.1 | -14.7 | 39 | -16.7 | 0 | 0 | 0 | 110.8 | ||||
| 8 | P | 54.5 | Low | 44.5 | Very low | 108 Ų | 108 | 122.5 Ų | 122.5 | 70% | 0.701 | 82% | 0.819 | S | S | * | * | cis | -134.2 | 156.9 | -37.5 | 36.7 | -18.5 | 0 | 0 | 0 | 118.2 | ||||
| 9 | A | 37.1 | Very low | 44.8 | Very low | 101 Ų | 101 | 124 Ų | 124 | 84% | 0.835 | 82% | 0.816 | S | S | * | * | trans | 59.2 | 156.7 | 138.5 | 0 | 0 | 0 | 0 | 0 | 126.4 | ||||
| 10 | A | 38.8 | Very low | 45.1 | Very low | 105 Ų | 105 | 124.3 Ų | 124.3 | 87% | 0.868 | 82% | 0.817 | S | S | * | * | trans | 78.5 | 146.7 | 163.6 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 11 | A | 38.3 | Very low | 45 | Very low | 85 Ų | 85 | 121.8 Ų | 121.8 | 70% | 0.702 | 81% | 0.814 | S | S | * | * | cis | -168.6 | 162.1 | -16.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 12 | S | 39.3 | Very low | 44.8 | Very low | 112 Ų | 112 | 116.5 Ų | 116.5 | 78% | 0.783 | 80% | 0.801 | S | S | * | * | trans | 62.6 | 157.6 | 156.9 | -51.9 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 13 | T | 37.3 | Very low | 44.9 | Very low | 134 Ų | 134 | 116 Ų | 116 | 82% | 0.822 | 79% | 0.791 | S | S | * | * | cis | -155.1 | 160.1 | 9 | -18.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 14 | A | 43.2 | Very low | 44.4 | Very low | 94 Ų | 94 | 114.7 Ų | 114.7 | 78% | 0.777 | 78% | 0.782 | S | S | * | * | trans | -108.7 | 139.5 | 169.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 15 | T | 38.3 | Very low | 44.1 | Very low | 147 Ų | 147 | 114.5 Ų | 114.5 | 90% | 0.902 | 77% | 0.774 | S | S | * | * | trans | -149.2 | 153 | 167.3 | -47.4 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 16 | E | 33.4 | Very low | 43.5 | Very low | 160 Ų | 160 | 116 Ų | 116 | 75% | 0.748 | 77% | 0.773 | S | S | * | * | trans | -120.7 | 133.1 | -162 | 174.9 | -168.7 | 131.1 | 0 | 0 | 112 | ||||
| 17 | N | 42.3 | Very low | 42.6 | Very low | 139 Ų | 139 | 115.6 Ų | 115.6 | 74% | 0.743 | 78% | 0.781 | S | S | * | * | trans | 53.1 | 176.8 | 157.9 | -64.9 | -31.1 | 0 | 0 | 0 | 119.2 | ||||
| 18 | P | 47.2 | Very low | 41.5 | Very low | 109 Ų | 109 | 113.4 Ų | 113.4 | 71% | 0.708 | 78% | 0.779 | S | S | * | * | cis | -125.5 | 171.4 | -16 | 32.3 | -12.8 | 0 | 0 | 0 | 115.9 | ||||
| 19 | I | 49.3 | Very low | 40.9 | Very low | 151 Ų | 151 | 117.5 Ų | 117.5 | 77% | 0.774 | 79% | 0.789 | S | S | * | * | trans | 2.6 | 137.6 | 147.2 | -54.3 | 165.7 | 0 | 0 | 0 | 119 | ||||
| 20 | P | 50.5 | Low | 41 | Very low | 129 Ų | 129 | 115.8 Ų | 115.8 | 84% | 0.838 | 78% | 0.781 | S | S | * | * | trans | -115 | 126.8 | 133.2 | 34.7 | -27.5 | 0 | 0 | 0 | 111.4 | ||||
| 21 | G | 42.9 | Very low | 41.2 | Very low | 73 Ų | 73 | 113.8 Ų | 113.8 | 75% | 0.753 | 77% | 0.77 | S | S | * | * | trans | -86.3 | 153.2 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 22 | S | 40.3 | Very low | 41.6 | Very low | 129 Ų | 129 | 115.3 Ų | 115.3 | 90% | 0.902 | 77% | 0.767 | S | S | * | * | trans | -125.1 | 150.7 | 156.1 | -168.4 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 23 | S | 42.8 | Very low | 42.1 | Very low | 99 Ų | 99 | 118.7 Ų | 118.7 | 69% | 0.692 | 77% | 0.77 | S | S | * | * | trans | -102.3 | 172.9 | -151.6 | 53.9 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 24 | S | 37.2 | Very low | 42.9 | Very low | 100 Ų | 100 | 117.5 Ų | 117.5 | 70% | 0.699 | 76% | 0.758 | S | S | * | * | trans | 85.2 | 115.6 | 140.7 | 68.5 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 25 | S | 38.1 | Very low | 43.6 | Very low | 102 Ų | 102 | 117.6 Ų | 117.6 | 71% | 0.713 | 75% | 0.753 | S | S | * | * | 99.9 | 109.4 | 127.6 | -61.4 | 0 | 0 | 0 | 0 | 120.3 | |||||
| 26 | T | 34.5 | Very low | 45.2 | Very low | 125 Ų | 125 | 114.3 Ų | 114.3 | 77% | 0.767 | 73% | 0.733 | S | S | * | * | trans | 61 | 113.3 | 133.8 | 53.9 | 0 | 0 | 0 | 0 | 119.8 | G28 | T26-G28 PolarHBondContact O-N 2.93Š| ||
| 27 | A | 46.4 | Very low | 47.4 | Very low | 111 Ų | 111 | 110.5 Ų | 110.5 | 92% | 0.917 | 72% | 0.715 | S | S | * | * | 36.2 | 74.2 | 119.7 | 0 | 0 | 0 | 0 | 0 | 115.5 | |||||
| 28 | G | 38.7 | Very low | 49.5 | Very low | 69 Ų | 69 | 109.1 Ų | 109.1 | 71% | 0.711 | 70% | 0.703 | S | S | * | * | trans | -121.1 | 49.1 | 167.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | T26 G30 | T26-G28 PolarHBondContact O-N 2.93Å; G28-G30 PolarHBondContact O-N 3.37Å | ||
| 29 | E | 43.4 | Very low | 51.5 | Low | 194 Ų | 194 | 103.9 Ų | 103.9 | 91% | 0.907 | 67% | 0.67 | S | S | * | * | trans | -71.2 | 43.8 | 164.9 | -157.9 | 84.1 | 100.1 | 0 | 0 | 110 | G31 | E29-G31 PolarHBondContact O-N 3.16Š| ||
| 30 | G | 39 | Very low | 53.5 | Low | 65 Ų | 65 | 100.4 Ų | 100.4 | 67% | 0.67 | 65% | 0.653 | S | S | * | * | trans | -76.8 | 80.5 | 164.2 | 0 | 0 | 0 | 0 | 0 | 106.1 | G28 N32 | G28-G30 PolarHBondContact O-N 3.37Å; G30-N32 PolarHBondContact O-N 3.3Å | ||
| 31 | G | 42 | Very low | 55.3 | Low | 62 Ų | 62 | 97.4 Ų | 97.4 | 64% | 0.639 | 63% | 0.629 | S | S | * | * | trans | -64.5 | 68 | 169.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | E29 Q33 | E29-G31 PolarHBondContact O-N 3.16Å; G31-Q33 PolarHBondContact O-N 2.95Å | ||
| 32 | N | 46.5 | Very low | 57.5 | Low | 118 Ų | 118 | 96.8 Ų | 96.8 | 63% | 0.631 | 61% | 0.612 | S | S | * | * | trans | -66.5 | 88.7 | 157.4 | -158.8 | 32.1 | 0 | 0 | 0 | 104.9 | G30 D34 | G30-N32 PolarHBondContact O-N 3.3Å; N32-D34 PolarHBondContact ND2-OD1 3.43Å; N32-D34 PolarHBondContact ND2-OD2 2.68Å; N32-D34 PolarHBondContact O-N 3.21Å | ||
| 33 | Q | 50.4 | Low | 59.8 | Low | 183 Ų | 183 | 96.7 Ų | 96.7 | 86% | 0.855 | 60% | 0.601 | S | S | * | * | trans | -66 | 66.3 | 156.4 | -66.8 | 176.2 | 65.9 | 0 | 0 | 106.5 | G31 S35 | G31-Q33 PolarHBondContact O-N 2.95Å; Q33-S35 VanDerWaalsContact C-N 3.27Å; Q33-S35 PolarHBondContact O-N 3.5Å | ||
| 34 | D | 53.5 | Low | 61.9 | Low | 108 Ų | 108 | 95.8 Ų | 95.8 | 58% | 0.578 | 59% | 0.588 | S | S | * | * | trans | -50.3 | 107.2 | 155.1 | -80.6 | -46.7 | 0 | 0 | 0 | 103.7 | N32 T36 | N32-D34 PolarHBondContact ND2-OD1 3.43Å; N32-D34 PolarHBondContact ND2-OD2 2.68Å; N32-D34 PolarHBondContact O-N 3.21Å; D34-T36 HydrophobicContact CB-CG2 4.42Å; D34-T36 PolarHBondContact O-N 3.01Å | ||
| 35 | S | 59.2 | Low | 64.2 | Low | 96 Ų | 96 | 93.1 Ų | 93.1 | 67% | 0.671 | 57% | 0.568 | S | S | * | * | trans | -73.1 | 71.1 | -178.6 | 45.6 | 0 | 0 | 0 | 0 | 107.7 | Q33 F37 | Q33-S35 VanDerWaalsContact C-N 3.27Å; Q33-S35 PolarHBondContact O-N 3.5Å; S35-F37 PolarHBondContact O-N 2.99Å; S35-F37 VanDerWaalsContact O-N 3.07Å | ||
| 36 | T | 71.7 | Confident | 66.2 | Low | 79 Ų | 79 | 88.6 Ų | 88.6 | 49% | 0.485 | 54% | 0.536 | S | S | . | . | trans | -57.7 | 115.5 | 177.2 | 44.6 | 0 | 0 | 0 | 0 | 106.6 | D34 E38 | D34-T36 HydrophobicContact CB-CG2 4.42Å; D34-T36 PolarHBondContact O-N 3.01Å; T36-E38 PolarHBondContact O-N 2.85Å | ||
| 37 | F | 79.6 | Confident | 68.4 | Low | 80 Ų | 80 | 89.3 Ų | 89.3 | 35% | 0.351 | 53% | 0.529 | S | S | . | . | trans | -64.9 | 105.7 | -176.2 | -65.6 | -71.3 | 0 | 0 | 0 | 108.5 | S35 S46 L57 L91 | S35-F37 PolarHBondContact O-N 2.99Å; S35-F37 VanDerWaalsContact O-N 3.07Å; F37-S46 VanDerWaalsContact CB-OG 3.25Å; F37-S46 WeakPolarHBondContact CB-OG 3.36Å; F37-S46 WeakPolarHBondContact O-CB 3.37Å; F37-S46 PolarHBondContact O-N 3.05Å; F37-S46 PolarHBondContact O-OG 3.16Å; F37-L57 HydrophobicContact CB-CD1 3.8Å; F37-L57 HydrophobicContact CB-CD2 4Å; F37-L57 HydrophobicContact CD1-CD1 3.61Å; F37-L57 HydrophobicContact CG-CD1 3.98Å; F37-L91 HydrophobicContact CE1-CD1 4.39Å | ||
| 38 | E | 87 | Confident | 70.1 | Confident | 109 Ų | 109 | 87.1 Ų | 87.1 | 51% | 0.509 | 50% | 0.502 | S | S | . | . | B | Isolated β-bridge | trans | -86.4 | 136.5 | -178.8 | -164.2 | -167.9 | 141.5 | 0 | 0 | 111.3 | T36 L43 L57 | T36-E38 PolarHBondContact O-N 2.85Å; E38-L43 WeakPolarHBondContact OE1-CA 3.37Å; E38-L57 WeakPolarHBondContact O-CD2 3.41Å |
| 39 | C | 89.5 | Confident | 72.4 | Confident | 0 Ų | 0 | 84.3 Ų | 84.3 | 0% | 0 | 47% | 0.471 | C | S | . | . | trans | -84.4 | 121.7 | 175.6 | 169.6 | 0 | 0 | 0 | 0 | 112.1 | I41 C42 L43 D44 F58 C59 | C39-I41 PolarHBondContact O-N 2.85Å; C39-I41 PolarHBondContact SG-N 3.34Å; C39-I41 VanDerWaalsContact SG-N 3.4Å; C39-C42 VanDerWaalsContact CB-SG 3.56Å; C39-C42 PolarHBondContact O-N 2.8Å; C39-L43 WeakPolarHBondContact O-CA 3.41Å; C39-L43 PolarHBondContact O-N 3.28Å; C39-D44 PolarHBondContact N-O 3.19Å; C39-F58 VanDerWaalsContact SG-CA 3.59Å; C39-C59 HydrophobicContact CB-CB 4.43Å; C39-C59 WeakPolarHBondContact CB-SG 3.46Å; C39-C59 PolarHBondContact SG-N 3.38Å | ||
| 40 | N | 89.3 | Confident | 74.6 | Confident | 78 Ų | 78 | 75.1 Ų | 75.1 | 42% | 0.417 | 43% | 0.429 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.8 | 16.6 | 177.2 | -68.2 | -96.4 | 0 | 0 | 0 | 115.5 | L57 F58 V78 | N40-L57 PolarHBondContact N-O 2.97Å; N40-L57 PolarHBondContact ND2-O 3.29Å; N40-F58 HydrophobicContact CB-CD1 3.97Å; N40-F58 HydrophobicContact CB-CE1 3.6Å; N40-F58 HydrophobicContact CB-CZ 4.48Å; N40-V78 HydrophobicContact CB-CG2 3.87Å |
| 41 | I | 89.1 | Confident | 77 | Confident | 66 Ų | 66 | 74.1 Ų | 74.1 | 34% | 0.338 | 41% | 0.407 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -125.2 | -45.5 | 175.3 | -65.2 | 161.6 | 0 | 0 | 0 | 110.8 | C39 F58 C62 P77 | C39-I41 PolarHBondContact O-N 2.85Å; C39-I41 PolarHBondContact SG-N 3.34Å; C39-I41 VanDerWaalsContact SG-N 3.4Å; I41-F58 HydrophobicContact CD1-CB 4.3Å; I41-F58 HydrophobicContact CD1-CD1 3.45Å; I41-F58 VanDerWaalsContact CD1-CD1 3.45Å; I41-F58 HydrophobicContact CD1-CE1 4.03Å; I41-F58 HydrophobicContact CD1-CG 4.08Å; I41-F58 HydrophobicContact CG1-CD1 3.61Å; I41-F58 HydrophobicContact CG1-CE1 3.95Å; I41-C62 HydrophobicContact CB-CB 3.95Å; I41-C62 HydrophobicContact CD1-CB 3.8Å; I41-C62 HydrophobicContact CG2-CB 3.89Å; I41-P77 HydrophobicContact CD1-CG 4.07Å; I41-P77 HydrophobicContact CG1-CG 4.19Å |
| 42 | C | 89.1 | Confident | 79.4 | Confident | 60 Ų | 60 | 71.2 Ų | 71.2 | 41% | 0.405 | 38% | 0.377 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -101.2 | -7.5 | 179.8 | 66.8 | 0 | 0 | 0 | 0 | 114.6 | C39 D44 | C39-C42 VanDerWaalsContact CB-SG 3.56Å; C39-C42 PolarHBondContact O-N 2.8Å; C42-D44 PolarHBondContact O-N 3.4Å |
| 43 | L | 88.9 | Confident | 81.4 | Confident | 126 Ų | 126 | 71.1 Ų | 71.1 | 66% | 0.66 | 38% | 0.376 | S | S | * | . | trans | 53.2 | 40.3 | 178.7 | -50.3 | 179.8 | 0 | 0 | 0 | 112.9 | E38 C39 | E38-L43 WeakPolarHBondContact OE1-CA 3.37Å; C39-L43 WeakPolarHBondContact O-CA 3.41Å; C39-L43 PolarHBondContact O-N 3.28Å | ||
| 44 | D | 87.2 | Confident | 83.4 | Confident | 81 Ų | 81 | 64.4 Ų | 64.4 | 43% | 0.433 | 35% | 0.349 | S | S | . | . | S | Bend | trans | -140.8 | 166.4 | -178.1 | -174.2 | 19 | 0 | 0 | 0 | 109.1 | C39 C42 S46 | C39-D44 PolarHBondContact N-O 3.19Å; C42-D44 PolarHBondContact O-N 3.4Å; D44-S46 PolarHBondContact O-N 3.07Å |
| 45 | T | 85.1 | Confident | 85.1 | Confident | 43 Ų | 43 | 61.8 Ų | 61.8 | 26% | 0.264 | 35% | 0.347 | S | S | . | . | B | Isolated β-bridge | trans | -52.8 | 120.1 | 178.3 | -55 | 0 | 0 | 0 | 0 | 110.5 | K47 | T45-K47 PolarHBondContact O-N 2.49Å |
| 46 | S | 80.3 | Confident | 86.7 | Confident | 7 Ų | 7 | 59.4 Ų | 59.4 | 5% | 0.049 | 33% | 0.325 | C | S | . | . | P | Polyproline II helix | trans | -70.6 | 121.5 | -169.7 | 57 | 0 | 0 | 0 | 0 | 113.1 | F37 D44 A49 L57 C59 | F37-S46 VanDerWaalsContact CB-OG 3.25Å; F37-S46 WeakPolarHBondContact CB-OG 3.36Å; F37-S46 WeakPolarHBondContact O-CB 3.37Å; F37-S46 PolarHBondContact O-N 3.05Å; F37-S46 PolarHBondContact O-OG 3.16Å; D44-S46 PolarHBondContact O-N 3.07Å; S46-A49 WeakPolarHBondContact OG-CB 3.03Å; S46-L57 WeakPolarHBondContact OG-CD2 3.23Å; S46-C59 VanDerWaalsContact CA-SG 3.57Å |
| 47 | K | 80 | Confident | 87.6 | Confident | 140 Ų | 140 | 56.4 Ų | 56.4 | 61% | 0.609 | 31% | 0.307 | S | S | * | . | S | Bend | trans | -96.9 | 127.7 | 173 | -62.9 | 167.9 | -164.9 | 166.5 | 0 | 107.7 | T45 C59 | T45-K47 PolarHBondContact O-N 2.49Å; K47-C59 PolarHBondContact N-SG 3.17Å; K47-C59 VanDerWaalsContact N-SG 3.45Å; K47-C59 WeakPolarHBondContact O-CA 3.41Å; K47-C59 WeakPolarHBondContact O-CB 3.4Å |
| 48 | D | 81.9 | Confident | 88.2 | Confident | 66 Ų | 66 | 52.6 Ų | 52.6 | 35% | 0.353 | 29% | 0.29 | S | S | . | . | S | Bend | trans | 48.2 | 64.1 | -166.3 | -82.3 | -72.4 | 0 | 0 | 0 | 112 | V50 W60 R109 | D48-V50 PolarHBondContact O-N 3.25Å; D48-W60 HydrophobicContact CB-CB 3.74Å; D48-W60 WeakPolarHBondContact O-CB 3.42Å; D48-W60 PolarHBondContact O-N 3.5Å; D48-R109 IonicContact OD1-CZ 3.93Å; D48-R109 IonicContact OD1-NH1 3.25Å; D48-R109 PolarHBondContact OD1-NH1 3.13Å; D48-R109 IonicContact OD1-NH2 2.49Å; D48-R109 PolarHBondContact OD1-NH2 2.84Å |
| 49 | A | 87.2 | Confident | 88.3 | Confident | 9 Ų | 9 | 47.8 Ų | 47.8 | 7% | 0.074 | 27% | 0.268 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -55 | 125.8 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | S46 L57 L91 | S46-A49 WeakPolarHBondContact OG-CB 3.03Å; A49-L57 HydrophobicContact CB-CD2 4.43Å; A49-L91 HydrophobicContact CB-CB 4.09Å; A49-L91 PolarHBondContact O-N 3.33Å |
| 50 | V | 89.4 | Confident | 88.3 | Confident | 2 Ų | 2 | 50.1 Ų | 50.1 | 1% | 0.012 | 28% | 0.277 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.4 | 134.1 | 173.3 | -69 | 0 | 0 | 0 | 0 | 110 | D48 F58 W60 L63 P90 | D48-V50 PolarHBondContact O-N 3.25Å; V50-F58 HydrophobicContact CG2-CB 4.34Å; V50-F58 WeakPolarHBondContact CG2-O 3.2Å; V50-F58 PolarHBondContact N-O 2.89Å; V50-F58 PolarHBondContact O-N 3.48Å; V50-W60 HydrophobicContact CG1-CB 4.17Å; V50-W60 HydrophobicContact CG1-CE3 4Å; V50-W60 HydrophobicContact CG2-CE3 4.4Å; V50-L63 HydrophobicContact CG2-CB 4.32Å; V50-L63 HydrophobicContact CG2-CD2 3.77Å; V50-P90 HydrophobicContact CG1-CB 4.45Å |
| 51 | I | 90.9 | Very high | 88.4 | Confident | 43 Ų | 43 | 49.8 Ų | 49.8 | 22% | 0.221 | 28% | 0.279 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.3 | 132.7 | 172.3 | -77.1 | -170.7 | 0 | 0 | 0 | 109.5 | L57 I89 L91 | I51-L57 HydrophobicContact CD1-CD1 4.24Å; I51-L57 HydrophobicContact CG1-CB 4.12Å; I51-L57 HydrophobicContact CG1-CD1 4.06Å; I51-L57 HydrophobicContact CG1-CG 4.16Å; I51-I89 PolarHBondContact N-O 2.54Å; I51-I89 PolarHBondContact O-N 3.17Å; I51-L91 HydrophobicContact CD1-CD1 3.44Å; I51-L91 VanDerWaalsContact CD1-CD1 3.44Å; I51-L91 HydrophobicContact CD1-CD2 4.42Å; I51-L91 HydrophobicContact CD1-CG 3.97Å; I51-L91 HydrophobicContact CG1-CD1 3.86Å; I51-L91 HydrophobicContact CG1-CG 4.07Å |
| 52 | S | 91.2 | Very high | 88.5 | Confident | 1 Ų | 1 | 48.2 Ų | 48.2 | 1% | 0.007 | 27% | 0.273 | C | S | . | . | trans | -76.7 | 154.3 | 167.3 | 57.9 | 0 | 0 | 0 | 0 | 111 | C54 G55 H56 I83 | S52-C54 PolarHBondContact O-N 3.48Å; S52-C54 PolarHBondContact OG-SG 3.47Å; S52-G55 PolarHBondContact O-N 3.28Å; S52-H56 PolarHBondContact N-O 2.84Å; S52-H56 PolarHBondContact OG-N 3.04Å; S52-H56 VanDerWaalsContact OG-N 3.13Å; S52-H56 PolarHBondContact OG-O 3.01Å; S52-I83 VanDerWaalsContact CB-CD1 3.42Å | ||
| 53 | L | 89.5 | Confident | 88.6 | Confident | 117 Ų | 117 | 45.3 Ų | 45.3 | 61% | 0.613 | 25% | 0.254 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.3 | -21.9 | 176.7 | -64.1 | -178.1 | 0 | 0 | 0 | 114.1 | G55 K87 I89 | L53-G55 VanDerWaalsContact C-N 3.31Å; L53-K87 HydrophobicContact CD1-CB 4.04Å; L53-K87 HydrophobicContact CD1-CD 4.23Å; L53-K87 HydrophobicContact CG-CB 4.36Å; L53-K87 WeakPolarHBondContact CG-O 3.34Å; L53-I89 HydrophobicContact CD2-CD1 4.35Å |
| 54 | C | 91.1 | Very high | 88.7 | Confident | 42 Ų | 42 | 41.9 Ų | 41.9 | 28% | 0.284 | 23% | 0.234 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -87.4 | 15.8 | 174 | 62.1 | 0 | 0 | 0 | 0 | 114.8 | S52 H56 C76 C79 A81 | S52-C54 PolarHBondContact O-N 3.48Å; S52-C54 PolarHBondContact OG-SG 3.47Å; C54-H56 VanDerWaalsContact C-N 3.32Å; C54-H56 PolarHBondContact O-CE1 3.36Å; C54-H56 PolarHBondContact O-N 2.73Å; C54-H56 PolarHBondContact O-ND1 3.22Å; C54-H56 PolarHBondContact SG-ND1 3.03Å; C54-H56 VanDerWaalsContact SG-ND1 3.45Å; C54-C76 VanDerWaalsContact SG-SG 3.63Å; C54-C79 PolarHBondContact SG-SG 2.79Å; C54-A81 HydrophobicContact CB-CB 3.77Å |
| 55 | G | 90.3 | Very high | 88.9 | Confident | 52 Ų | 52 | 43.4 Ų | 43.4 | 54% | 0.536 | 24% | 0.239 | S | C | . | . | S | Bend | trans | 81.1 | -5.5 | 173.3 | 0 | 0 | 0 | 0 | 0 | 116.6 | S52 L53 | S52-G55 PolarHBondContact O-N 3.28Å; L53-G55 VanDerWaalsContact C-N 3.31Å |
| 56 | H | 92.1 | Very high | 89.1 | Confident | 46 Ų | 46 | 44.3 Ų | 44.3 | 21% | 0.213 | 24% | 0.238 | C | C | . | . | trans | -82.6 | 136.5 | -177.8 | -62 | 81.5 | 0 | 0 | 0 | 111.6 | S52 C54 F58 V78 C79 | S52-H56 PolarHBondContact N-O 2.84Å; S52-H56 PolarHBondContact OG-N 3.04Å; S52-H56 VanDerWaalsContact OG-N 3.13Å; S52-H56 PolarHBondContact OG-O 3.01Å; C54-H56 VanDerWaalsContact C-N 3.32Å; C54-H56 PolarHBondContact O-CE1 3.36Å; C54-H56 PolarHBondContact O-N 2.73Å; C54-H56 PolarHBondContact O-ND1 3.22Å; C54-H56 PolarHBondContact SG-ND1 3.03Å; C54-H56 VanDerWaalsContact SG-ND1 3.45Å; H56-F58 HydrophobicContact CB-CE2 3.6Å; H56-F58 HydrophobicContact CB-CZ 3.59Å; H56-F58 WeakPolarHBondContact O-CE2 3.38Å; H56-V78 WeakPolarHBondContact CD2-CB 3.47Å; H56-V78 VanDerWaalsContact CD2-CG1 3.48Å; H56-V78 WeakPolarHBondContact CD2-CG1 3.25Å; H56-V78 WeakPolarHBondContact NE2-CG1 3.17Å; H56-C79 PolarHBondContact CE1-SG 2.7Å | ||
| 57 | L | 90.8 | Very high | 89.5 | Confident | 17 Ų | 17 | 44.7 Ų | 44.7 | 9% | 0.089 | 24% | 0.239 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -103.9 | 135.3 | -173.7 | -168.7 | 149.6 | 0 | 0 | 0 | 112.2 | F37 E38 N40 S46 A49 I51 L91 | F37-L57 HydrophobicContact CB-CD1 3.8Å; F37-L57 HydrophobicContact CB-CD2 4Å; F37-L57 HydrophobicContact CD1-CD1 3.61Å; F37-L57 HydrophobicContact CG-CD1 3.98Å; E38-L57 WeakPolarHBondContact O-CD2 3.41Å; N40-L57 PolarHBondContact N-O 2.97Å; N40-L57 PolarHBondContact ND2-O 3.29Å; S46-L57 WeakPolarHBondContact OG-CD2 3.23Å; A49-L57 HydrophobicContact CB-CD2 4.43Å; I51-L57 HydrophobicContact CD1-CD1 4.24Å; I51-L57 HydrophobicContact CG1-CB 4.12Å; I51-L57 HydrophobicContact CG1-CD1 4.06Å; I51-L57 HydrophobicContact CG1-CG 4.16Å; L57-L91 HydrophobicContact CD1-CD1 3.89Å |
| 58 | F | 91.8 | Very high | 90 | Very high | 0 Ų | 0 | 42.8 Ų | 42.8 | 0% | 0 | 23% | 0.232 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -142.9 | 160.2 | -178.4 | -50.3 | -78.3 | 0 | 0 | 0 | 111.6 | C39 N40 I41 V50 H56 L63 P77 V78 | C39-F58 VanDerWaalsContact SG-CA 3.59Å; N40-F58 HydrophobicContact CB-CD1 3.97Å; N40-F58 HydrophobicContact CB-CE1 3.6Å; N40-F58 HydrophobicContact CB-CZ 4.48Å; I41-F58 HydrophobicContact CD1-CB 4.3Å; I41-F58 HydrophobicContact CD1-CD1 3.45Å; I41-F58 VanDerWaalsContact CD1-CD1 3.45Å; I41-F58 HydrophobicContact CD1-CE1 4.03Å; I41-F58 HydrophobicContact CD1-CG 4.08Å; I41-F58 HydrophobicContact CG1-CD1 3.61Å; I41-F58 HydrophobicContact CG1-CE1 3.95Å; V50-F58 HydrophobicContact CG2-CB 4.34Å; V50-F58 WeakPolarHBondContact CG2-O 3.2Å; V50-F58 PolarHBondContact N-O 2.89Å; V50-F58 PolarHBondContact O-N 3.48Å; H56-F58 HydrophobicContact CB-CE2 3.6Å; H56-F58 HydrophobicContact CB-CZ 3.59Å; H56-F58 WeakPolarHBondContact O-CE2 3.38Å; F58-L63 HydrophobicContact CB-CB 4.05Å; F58-L63 HydrophobicContact CD2-CD1 4.09Å; F58-L63 HydrophobicContact CD2-CD2 4.17Å; F58-L63 HydrophobicContact CE2-CD1 4.43Å; F58-L63 HydrophobicContact CG-CD1 4.42Å; F58-P77 HydrophobicContact CE1-CB 4.29Å; F58-P77 HydrophobicContact CE1-CG 3.87Å; F58-P77 HydrophobicContact CZ-CG 4.03Å; F58-V78 HydrophobicContact CE1-CG2 4.24Å; F58-V78 HydrophobicContact CZ-CG2 4.19Å |
| 59 | C | 90.3 | Very high | 90.3 | Very high | 7 Ų | 7 | 43.9 Ų | 43.9 | 5% | 0.047 | 24% | 0.241 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -69.2 | 139.4 | 159.6 | -58.8 | 0 | 0 | 0 | 0 | 109.4 | C39 S46 K47 P61 C62 L63 | C39-C59 HydrophobicContact CB-CB 4.43Å; C39-C59 WeakPolarHBondContact CB-SG 3.46Å; C39-C59 PolarHBondContact SG-N 3.38Å; S46-C59 VanDerWaalsContact CA-SG 3.57Å; K47-C59 PolarHBondContact N-SG 3.17Å; K47-C59 VanDerWaalsContact N-SG 3.45Å; K47-C59 WeakPolarHBondContact O-CA 3.41Å; K47-C59 WeakPolarHBondContact O-CB 3.4Å; C59-P61 HydrophobicContact CB-CG 4.17Å; C59-C62 HydrophobicContact CB-CB 4.07Å; C59-C62 PolarHBondContact O-N 3.36Å; C59-C62 VanDerWaalsContact O-N 3.17Å; C59-L63 PolarHBondContact O-N 3.2Å |
| 60 | W | 89.4 | Confident | 90.1 | Very high | 49 Ų | 49 | 49.1 Ų | 49.1 | 19% | 0.186 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -48.6 | -51.5 | 172.6 | 176.5 | -120.9 | 0 | 0 | 0 | 114.2 | D48 V50 C62 L63 H64 R85 V88 | D48-W60 HydrophobicContact CB-CB 3.74Å; D48-W60 WeakPolarHBondContact O-CB 3.42Å; D48-W60 PolarHBondContact O-N 3.5Å; V50-W60 HydrophobicContact CG1-CB 4.17Å; V50-W60 HydrophobicContact CG1-CE3 4Å; V50-W60 HydrophobicContact CG2-CE3 4.4Å; W60-C62 VanDerWaalsContact C-N 3.34Å; W60-C62 PolarHBondContact O-N 3.41Å; W60-L63 PolarHBondContact O-N 2.95Å; W60-H64 WeakPolarHBondContact O-CB 3.37Å; W60-H64 PolarHBondContact O-N 3.21Å; W60-R85 HydrophobicContact CH2-CG 3.92Å; W60-V88 HydrophobicContact CE3-CG2 4.44Å; W60-V88 HydrophobicContact CZ3-CG2 3.72Å |
| 61 | P | 90.6 | Very high | 89.7 | Confident | 72 Ų | 72 | 53.1 Ų | 53.1 | 47% | 0.468 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -62.4 | -37.1 | 179.2 | 23 | -34.8 | 0 | 0 | 0 | 113.4 | C59 H64 Q65 | C59-P61 HydrophobicContact CB-CG 4.17Å; P61-H64 PolarHBondContact O-N 3.02Å; P61-Q65 WeakPolarHBondContact O-CB 3.48Å; P61-Q65 PolarHBondContact O-N 3.24Å |
| 62 | C | 91.3 | Very high | 89.3 | Confident | 32 Ų | 32 | 58.7 Ų | 58.7 | 22% | 0.216 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -66.4 | -44.1 | 179 | -62.9 | 0 | 0 | 0 | 0 | 111.6 | I41 C59 W60 W66 | I41-C62 HydrophobicContact CB-CB 3.95Å; I41-C62 HydrophobicContact CD1-CB 3.8Å; I41-C62 HydrophobicContact CG2-CB 3.89Å; C59-C62 HydrophobicContact CB-CB 4.07Å; C59-C62 PolarHBondContact O-N 3.36Å; C59-C62 VanDerWaalsContact O-N 3.17Å; W60-C62 VanDerWaalsContact C-N 3.34Å; W60-C62 PolarHBondContact O-N 3.41Å; C62-W66 PolarHBondContact O-N 3.28Å |
| 63 | L | 91.4 | Very high | 88.9 | Confident | 0 Ų | 0 | 67.8 Ų | 67.8 | 0% | 0 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -69.8 | -38.9 | 177.3 | -174.6 | 61.1 | 0 | 0 | 0 | 111.9 | V50 F58 C59 W60 W66 L67 I83 V88 | V50-L63 HydrophobicContact CG2-CB 4.32Å; V50-L63 HydrophobicContact CG2-CD2 3.77Å; F58-L63 HydrophobicContact CB-CB 4.05Å; F58-L63 HydrophobicContact CD2-CD1 4.09Å; F58-L63 HydrophobicContact CD2-CD2 4.17Å; F58-L63 HydrophobicContact CE2-CD1 4.43Å; F58-L63 HydrophobicContact CG-CD1 4.42Å; C59-L63 PolarHBondContact O-N 3.2Å; W60-L63 PolarHBondContact O-N 2.95Å; L63-W66 WeakPolarHBondContact O-CB 3.44Å; L63-W66 PolarHBondContact O-N 2.93Å; L63-L67 HydrophobicContact CG-CD1 4.32Å; L63-L67 WeakPolarHBondContact O-CG 3.36Å; L63-L67 PolarHBondContact O-N 3.4Å; L63-I83 HydrophobicContact CD1-CD1 4.07Å; L63-I83 HydrophobicContact CD2-CD1 3.89Å; L63-I83 HydrophobicContact CG-CD1 4.5Å; L63-V88 HydrophobicContact CD2-CG1 3.76Å |
| 64 | H | 90.1 | Very high | 88.9 | Confident | 54 Ų | 54 | 66.1 Ų | 66.1 | 25% | 0.25 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -59.4 | -51.7 | 176.3 | -178.5 | -100.1 | 0 | 0 | 0 | 111.6 | W60 P61 W66 L67 E68 R85 | W60-H64 WeakPolarHBondContact O-CB 3.37Å; W60-H64 PolarHBondContact O-N 3.21Å; P61-H64 PolarHBondContact O-N 3.02Å; H64-W66 VanDerWaalsContact C-N 3.26Å; H64-W66 PolarHBondContact O-N 3.45Å; H64-L67 PolarHBondContact O-N 3.4Å; H64-L67 VanDerWaalsContact O-N 3.16Å; H64-E68 IonicContact CE1-OE2 3.63Å; H64-E68 PolarHBondContact CE1-OE2 2.84Å; H64-E68 VanDerWaalsContact CE1-OE2 3.25Å; H64-E68 IonicContact ND1-OE1 3.48Å; H64-E68 IonicContact ND1-OE2 2.96Å; H64-E68 PolarHBondContact ND1-OE2 2.98Å; H64-E68 IonicContact NE2-OE1 2.73Å; H64-E68 PolarHBondContact NE2-OE1 3.45Å; H64-E68 IonicContact NE2-OE2 3.3Å; H64-E68 PolarHBondContact NE2-OE2 3.09Å; H64-E68 PolarHBondContact O-N 3.03Å; H64-R85 VanDerWaalsContact CD2-CZ 3.45Å; H64-R85 PolarHBondContact CD2-NH1 3.02Å; H64-R85 PolarHBondContact CD2-NH2 2.8Å |
| 65 | Q | 91.4 | Very high | 88.9 | Confident | 113 Ų | 113 | 66.2 Ų | 66.2 | 53% | 0.528 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -57 | -39.2 | 176 | -175 | 65.5 | 49 | 0 | 0 | 112.3 | P61 T69 | P61-Q65 WeakPolarHBondContact O-CB 3.48Å; P61-Q65 PolarHBondContact O-N 3.24Å; Q65-T69 WeakPolarHBondContact O-CB 3.47Å; Q65-T69 PolarHBondContact O-N 3.3Å; Q65-T69 PolarHBondContact O-OG1 2.88Å |
| 66 | W | 90.7 | Very high | 89 | Confident | 62 Ų | 62 | 63.7 Ų | 63.7 | 24% | 0.235 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -63.7 | -43.9 | 177.9 | 176.6 | -98.2 | 0 | 0 | 0 | 112.5 | C62 L63 H64 T69 R70 V75 P77 | C62-W66 PolarHBondContact O-N 3.28Å; L63-W66 WeakPolarHBondContact O-CB 3.44Å; L63-W66 PolarHBondContact O-N 2.93Å; H64-W66 VanDerWaalsContact C-N 3.26Å; H64-W66 PolarHBondContact O-N 3.45Å; W66-T69 PolarHBondContact O-N 2.95Å; W66-R70 VanDerWaalsContact CH2-CZ 3.5Å; W66-R70 PolarHBondContact O-N 3Å; W66-V75 PolarHBondContact NE1-O 3.39Å; W66-P77 HydrophobicContact CD2-CG 4.01Å; W66-P77 HydrophobicContact CG-CG 4.14Å; W66-P77 HydrophobicContact CH2-CB 4.41Å; W66-P77 HydrophobicContact CZ2-CB 4.1Å; W66-P77 HydrophobicContact CZ2-CG 4.15Å |
| 67 | L | 88.9 | Confident | 88.9 | Confident | 15 Ų | 15 | 63.3 Ų | 63.3 | 8% | 0.079 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -68.5 | -40.3 | 178.5 | -65.2 | 174.1 | 0 | 0 | 0 | 112 | L63 H64 R70 Q74 I83 R85 | L63-L67 HydrophobicContact CG-CD1 4.32Å; L63-L67 WeakPolarHBondContact O-CG 3.36Å; L63-L67 PolarHBondContact O-N 3.4Å; H64-L67 PolarHBondContact O-N 3.4Å; H64-L67 VanDerWaalsContact O-N 3.16Å; L67-R70 CarbonylContact O-C 3.56Å; L67-R70 VanDerWaalsContact O-C 3.3Å; L67-R70 PolarHBondContact O-N 3.13Å; L67-Q74 HydrophobicContact CD2-CB 3.93Å; L67-Q74 HydrophobicContact CD2-CG 4.25Å; L67-I83 HydrophobicContact CD2-CG2 3.89Å; L67-R85 HydrophobicContact CD1-CB 4.43Å |
| 68 | E | 89.1 | Confident | 88.9 | Confident | 99 Ų | 99 | 65.9 Ų | 65.9 | 46% | 0.463 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -67.5 | -34.2 | 176.5 | -70.7 | -171.8 | 149.9 | 0 | 0 | 112.9 | H64 R70 | H64-E68 IonicContact CE1-OE2 3.63Å; H64-E68 PolarHBondContact CE1-OE2 2.84Å; H64-E68 VanDerWaalsContact CE1-OE2 3.25Å; H64-E68 IonicContact ND1-OE1 3.48Å; H64-E68 IonicContact ND1-OE2 2.96Å; H64-E68 PolarHBondContact ND1-OE2 2.98Å; H64-E68 IonicContact NE2-OE1 2.73Å; H64-E68 PolarHBondContact NE2-OE1 3.45Å; H64-E68 IonicContact NE2-OE2 3.3Å; H64-E68 PolarHBondContact NE2-OE2 3.09Å; H64-E68 PolarHBondContact O-N 3.03Å; E68-R70 PolarHBondContact O-N 3.22Å |
| 69 | T | 88.1 | Confident | 88.8 | Confident | 89 Ų | 89 | 68.7 Ų | 68.7 | 55% | 0.546 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -67.2 | -21.6 | 175.1 | -53.1 | 0 | 0 | 0 | 0 | 112.2 | Q65 W66 | Q65-T69 WeakPolarHBondContact O-CB 3.47Å; Q65-T69 PolarHBondContact O-N 3.3Å; Q65-T69 PolarHBondContact O-OG1 2.88Å; W66-T69 PolarHBondContact O-N 2.95Å |
| 70 | R | 84.3 | Confident | 88.9 | Confident | 119 Ų | 119 | 76.3 Ų | 76.3 | 45% | 0.449 | 38% | 0.381 | S | S | . | . | trans | -139.2 | 60.9 | -171.6 | -59.5 | -178.6 | -174.3 | -174.7 | 2.9 | 112.4 | W66 L67 E68 N72 R73 | W66-R70 VanDerWaalsContact CH2-CZ 3.5Å; W66-R70 PolarHBondContact O-N 3Å; L67-R70 CarbonylContact O-C 3.56Å; L67-R70 VanDerWaalsContact O-C 3.3Å; L67-R70 PolarHBondContact O-N 3.13Å; E68-R70 PolarHBondContact O-N 3.22Å; R70-N72 PolarHBondContact O-N 2.83Å; R70-N72 VanDerWaalsContact O-N 3.16Å; R70-R73 CarbonylContact O-C 3.29Å; R70-R73 VanDerWaalsContact O-C 3.29Å; R70-R73 PolarHBondContact O-N 2.95Å | ||
| 71 | P | 81.3 | Confident | 88.9 | Confident | 86 Ų | 86 | 75.7 Ų | 75.7 | 56% | 0.558 | 39% | 0.387 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.3 | -35 | -174.1 | 24.3 | -34.6 | 0 | 0 | 0 | 112.9 | R73 | P71-R73 VanDerWaalsContact C-N 3.27Å; P71-R73 PolarHBondContact O-N 3.27Å |
| 72 | N | 82.8 | Confident | 88.8 | Confident | 161 Ų | 161 | 75.5 Ų | 75.5 | 86% | 0.861 | 40% | 0.397 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.2 | -9 | 178.6 | -63.5 | -26.3 | 0 | 0 | 0 | 114.2 | R70 | R70-N72 PolarHBondContact O-N 2.83Å; R70-N72 VanDerWaalsContact O-N 3.16Å |
| 73 | R | 82.7 | Confident | 88.7 | Confident | 192 Ų | 192 | 74.4 Ų | 74.4 | 73% | 0.725 | 39% | 0.39 | S | S | * | . | trans | -145.1 | 74 | -176.1 | -69.1 | -170.7 | -179.8 | 174.9 | 1.1 | 110.9 | R70 P71 V75 | R70-R73 CarbonylContact O-C 3.29Å; R70-R73 VanDerWaalsContact O-C 3.29Å; R70-R73 PolarHBondContact O-N 2.95Å; P71-R73 VanDerWaalsContact C-N 3.27Å; P71-R73 PolarHBondContact O-N 3.27Å; R73-V75 VanDerWaalsContact C-N 3.32Å; R73-V75 PolarHBondContact O-N 2.93Å | ||
| 74 | Q | 88.4 | Confident | 88.4 | Confident | 81 Ų | 81 | 75 Ų | 75 | 38% | 0.379 | 39% | 0.394 | S | S | . | . | trans | -74.2 | 85.1 | 173.1 | -53.5 | -172.6 | 3.1 | 0 | 0 | 110 | L67 I83 | L67-Q74 HydrophobicContact CD2-CB 3.93Å; L67-Q74 HydrophobicContact CD2-CG 4.25Å; Q74-I83 WeakPolarHBondContact CB-O 3.38Å; Q74-I83 PolarHBondContact O-N 2.65Å; Q74-I83 PolarHBondContact OE1-O 2.86Å | ||
| 75 | V | 91.8 | Very high | 88.1 | Confident | 44 Ų | 44 | 77.1 Ų | 77.1 | 27% | 0.267 | 40% | 0.399 | S | S | . | . | B | Isolated β-bridge | trans | -127.1 | 145.7 | -178.2 | -63.2 | 0 | 0 | 0 | 0 | 111.7 | W66 R73 A81 | W66-V75 PolarHBondContact NE1-O 3.39Å; R73-V75 VanDerWaalsContact C-N 3.32Å; R73-V75 PolarHBondContact O-N 2.93Å; V75-A81 CarbonylContact C-O 3.3Å; V75-A81 WeakPolarHBondContact CA-O 3.47Å |
| 76 | C | 92.1 | Very high | 87.5 | Confident | 0 Ų | 0 | 77.5 Ų | 77.5 | 0% | 0 | 40% | 0.401 | C | S | . | . | trans | -58.7 | 131.1 | 174.2 | 178.3 | 0 | 0 | 0 | 0 | 111.1 | C54 V78 C79 K80 A81 | C54-C76 VanDerWaalsContact SG-SG 3.63Å; C76-V78 PolarHBondContact O-N 3.07Å; C76-C79 VanDerWaalsContact SG-SG 3.68Å; C76-K80 VanDerWaalsContact O-CA 3.23Å; C76-K80 WeakPolarHBondContact O-CA 3.13Å; C76-K80 PolarHBondContact O-N 2.89Å; C76-A81 PolarHBondContact N-O 2.77Å | ||
| 77 | P | 89.6 | Confident | 87.1 | Confident | 38 Ų | 38 | 80.2 Ų | 80.2 | 25% | 0.247 | 42% | 0.415 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -54.7 | -34.3 | 176.3 | -25 | 30.4 | 0 | 0 | 0 | 114.5 | I41 F58 W66 | I41-P77 HydrophobicContact CD1-CG 4.07Å; I41-P77 HydrophobicContact CG1-CG 4.19Å; F58-P77 HydrophobicContact CE1-CB 4.29Å; F58-P77 HydrophobicContact CE1-CG 3.87Å; F58-P77 HydrophobicContact CZ-CG 4.03Å; W66-P77 HydrophobicContact CD2-CG 4.01Å; W66-P77 HydrophobicContact CG-CG 4.14Å; W66-P77 HydrophobicContact CH2-CB 4.41Å; W66-P77 HydrophobicContact CZ2-CB 4.1Å; W66-P77 HydrophobicContact CZ2-CG 4.15Å |
| 78 | V | 91.1 | Very high | 87 | Confident | 70 Ų | 70 | 80.2 Ų | 80.2 | 42% | 0.424 | 42% | 0.415 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89 | -64.5 | -173 | -172.5 | 0 | 0 | 0 | 0 | 111.3 | N40 H56 F58 C76 | N40-V78 HydrophobicContact CB-CG2 3.87Å; H56-V78 WeakPolarHBondContact CD2-CB 3.47Å; H56-V78 VanDerWaalsContact CD2-CG1 3.48Å; H56-V78 WeakPolarHBondContact CD2-CG1 3.25Å; H56-V78 WeakPolarHBondContact NE2-CG1 3.17Å; F58-V78 HydrophobicContact CE1-CG2 4.24Å; F58-V78 HydrophobicContact CZ-CG2 4.19Å; C76-V78 PolarHBondContact O-N 3.07Å |
| 79 | C | 90.6 | Very high | 86.9 | Confident | 59 Ų | 59 | 79.9 Ų | 79.9 | 40% | 0.399 | 42% | 0.416 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.3 | 0.1 | -173.2 | 69.1 | 0 | 0 | 0 | 0 | 115.1 | C54 H56 C76 A81 | C54-C79 PolarHBondContact SG-SG 2.79Å; H56-C79 PolarHBondContact CE1-SG 2.7Å; C76-C79 VanDerWaalsContact SG-SG 3.68Å; C79-A81 PolarHBondContact O-N 3.16Å; C79-A81 VanDerWaalsContact SG-CB 3.59Å |
| 80 | K | 91.5 | Very high | 86.8 | Confident | 167 Ų | 167 | 77.1 Ų | 77.1 | 73% | 0.726 | 40% | 0.399 | S | S | * | . | trans | 61.4 | 8.2 | -179.3 | -51.1 | 173.5 | -174.4 | 172.9 | 0 | 115.8 | C76 | C76-K80 VanDerWaalsContact O-CA 3.23Å; C76-K80 WeakPolarHBondContact O-CA 3.13Å; C76-K80 PolarHBondContact O-N 2.89Å | ||
| 81 | A | 89 | Confident | 86.7 | Confident | 37 Ų | 37 | 74.3 Ų | 74.3 | 31% | 0.306 | 39% | 0.393 | S | S | . | . | trans | -59 | 147 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | C54 V75 C76 C79 I83 | C54-A81 HydrophobicContact CB-CB 3.77Å; V75-A81 CarbonylContact C-O 3.3Å; V75-A81 WeakPolarHBondContact CA-O 3.47Å; C76-A81 PolarHBondContact N-O 2.77Å; C79-A81 PolarHBondContact O-N 3.16Å; C79-A81 VanDerWaalsContact SG-CB 3.59Å; A81-I83 PolarHBondContact O-N 2.84Å | ||
| 82 | G | 88.6 | Confident | 86.4 | Confident | 67 Ų | 67 | 77.8 Ų | 77.8 | 69% | 0.691 | 40% | 0.396 | S | S | * | . | B | Isolated β-bridge | trans | -61.3 | 129.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||
| 83 | I | 89.6 | Confident | 85.6 | Confident | 10 Ų | 10 | 71.6 Ų | 71.6 | 5% | 0.051 | 37% | 0.37 | C | S | . | . | trans | -131.3 | 153 | 178.8 | -170.4 | 177 | 0 | 0 | 0 | 107.8 | S52 L63 L67 Q74 A81 V88 | S52-I83 VanDerWaalsContact CB-CD1 3.42Å; L63-I83 HydrophobicContact CD1-CD1 4.07Å; L63-I83 HydrophobicContact CD2-CD1 3.89Å; L63-I83 HydrophobicContact CG-CD1 4.5Å; L67-I83 HydrophobicContact CD2-CG2 3.89Å; Q74-I83 WeakPolarHBondContact CB-O 3.38Å; Q74-I83 PolarHBondContact O-N 2.65Å; Q74-I83 PolarHBondContact OE1-O 2.86Å; A81-I83 PolarHBondContact O-N 2.84Å; I83-V88 HydrophobicContact CD1-CG1 3.9Å; I83-V88 HydrophobicContact CG1-CG1 4.13Å | ||
| 84 | S | 85.4 | Confident | 84.6 | Confident | 12 Ų | 12 | 75.3 Ų | 75.3 | 8% | 0.084 | 38% | 0.384 | C | S | . | . | trans | -141.4 | 156.5 | 169.3 | 64 | 0 | 0 | 0 | 0 | 111.3 | E86 K87 | S84-E86 WeakPolarHBondContact CB-OE1 3.3Å; S84-E86 PolarHBondContact O-N 2.75Å; S84-E86 PolarHBondContact OG-OE1 2.8Å; S84-K87 PolarHBondContact O-N 2.7Å; S84-K87 VanDerWaalsContact OG-CD 3.29Å; S84-K87 WeakPolarHBondContact OG-CD 3.47Å; S84-K87 VanDerWaalsContact OG-CG 3.3Å; S84-K87 WeakPolarHBondContact OG-CG 3.3Å | ||
| 85 | R | 83.1 | Confident | 83 | Confident | 99 Ų | 99 | 73.1 Ų | 73.1 | 37% | 0.374 | 38% | 0.382 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.3 | -30.7 | -169.6 | -177.1 | -179.4 | 176.4 | 144.5 | 6.8 | 112.8 | W60 H64 L67 V88 | W60-R85 HydrophobicContact CH2-CG 3.92Å; H64-R85 VanDerWaalsContact CD2-CZ 3.45Å; H64-R85 PolarHBondContact CD2-NH1 3.02Å; H64-R85 PolarHBondContact CD2-NH2 2.8Å; L67-R85 HydrophobicContact CD1-CB 4.43Å; R85-V88 VanDerWaalsContact O-CG2 3.3Å; R85-V88 WeakPolarHBondContact O-CG2 3.29Å |
| 86 | E | 79.9 | Confident | 81.3 | Confident | 121 Ų | 121 | 74.3 Ų | 74.3 | 57% | 0.565 | 39% | 0.393 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.6 | -8.2 | 179.5 | 70.8 | -66.1 | 157.8 | 0 | 0 | 113.9 | S84 | S84-E86 WeakPolarHBondContact CB-OE1 3.3Å; S84-E86 PolarHBondContact O-N 2.75Å; S84-E86 PolarHBondContact OG-OE1 2.8Å |
| 87 | K | 81.5 | Confident | 79.5 | Confident | 119 Ų | 119 | 80.6 Ų | 80.6 | 52% | 0.517 | 43% | 0.432 | S | S | . | . | S | Bend | trans | -108.1 | 16.2 | 179.9 | -64.2 | -178.7 | -168 | 172 | 0 | 113.7 | L53 S84 | L53-K87 HydrophobicContact CD1-CB 4.04Å; L53-K87 HydrophobicContact CD1-CD 4.23Å; L53-K87 HydrophobicContact CG-CB 4.36Å; L53-K87 WeakPolarHBondContact CG-O 3.34Å; S84-K87 PolarHBondContact O-N 2.7Å; S84-K87 VanDerWaalsContact OG-CD 3.29Å; S84-K87 WeakPolarHBondContact OG-CD 3.47Å; S84-K87 VanDerWaalsContact OG-CG 3.3Å; S84-K87 WeakPolarHBondContact OG-CG 3.3Å |
| 88 | V | 87.4 | Confident | 78 | Confident | 14 Ų | 14 | 81.4 Ų | 81.4 | 9% | 0.085 | 45% | 0.447 | C | S | . | . | trans | -90.6 | 137.8 | 173.6 | -67.2 | 0 | 0 | 0 | 0 | 111.3 | W60 L63 I83 R85 | W60-V88 HydrophobicContact CE3-CG2 4.44Å; W60-V88 HydrophobicContact CZ3-CG2 3.72Å; L63-V88 HydrophobicContact CD2-CG1 3.76Å; I83-V88 HydrophobicContact CD1-CG1 3.9Å; I83-V88 HydrophobicContact CG1-CG1 4.13Å; R85-V88 VanDerWaalsContact O-CG2 3.3Å; R85-V88 WeakPolarHBondContact O-CG2 3.29Å | ||
| 89 | I | 86.4 | Confident | 76.4 | Confident | 93 Ų | 93 | 87.5 Ų | 87.5 | 48% | 0.477 | 47% | 0.471 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.8 | 114.8 | -178.7 | -58.5 | 172.7 | 0 | 0 | 0 | 107.7 | I51 L53 | I51-I89 PolarHBondContact N-O 2.54Å; I51-I89 PolarHBondContact O-N 3.17Å; L53-I89 HydrophobicContact CD2-CD1 4.35Å |
| 90 | P | 85.6 | Confident | 74.6 | Confident | 31 Ų | 31 | 92.9 Ų | 92.9 | 20% | 0.201 | 49% | 0.49 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.3 | 134.9 | 175 | 30.2 | -33.6 | 0 | 0 | 0 | 110.7 | V50 Y92 | V50-P90 HydrophobicContact CG1-CB 4.45Å; P90-Y92 HydrophobicContact CB-CE2 4.12Å; P90-Y92 HydrophobicContact CG-CE2 4.02Å |
| 91 | L | 83.5 | Confident | 72.9 | Confident | 59 Ų | 59 | 88.9 Ų | 88.9 | 31% | 0.309 | 48% | 0.477 | S | S | . | . | trans | -98.4 | 131.5 | 171 | -75 | -168.6 | 0 | 0 | 0 | 110.7 | F37 A49 I51 L57 | F37-L91 HydrophobicContact CE1-CD1 4.39Å; A49-L91 HydrophobicContact CB-CB 4.09Å; A49-L91 PolarHBondContact O-N 3.33Å; I51-L91 HydrophobicContact CD1-CD1 3.44Å; I51-L91 VanDerWaalsContact CD1-CD1 3.44Å; I51-L91 HydrophobicContact CD1-CD2 4.42Å; I51-L91 HydrophobicContact CD1-CG 3.97Å; I51-L91 HydrophobicContact CG1-CD1 3.86Å; I51-L91 HydrophobicContact CG1-CG 4.07Å; L57-L91 HydrophobicContact CD1-CD1 3.89Å | ||
| 92 | Y | 73.3 | Confident | 71.3 | Confident | 160 Ų | 160 | 90.1 Ų | 90.1 | 63% | 0.627 | 48% | 0.481 | S | S | * | . | trans | -115.4 | 88.6 | 171 | -52.5 | -76.7 | 0 | 0 | 0 | 108.1 | P90 R109 | P90-Y92 HydrophobicContact CB-CE2 4.12Å; P90-Y92 HydrophobicContact CG-CE2 4.02Å; Y92-R109 VanDerWaalsContact OH-CD 3.25Å; Y92-R109 WeakPolarHBondContact OH-CD 3.25Å; Y92-R109 PolarHBondContact OH-NE 2.83Å; Y92-R109 PolarHBondContact OH-NH1 2.92Å | ||
| 93 | G | 66.8 | Low | 69.8 | Low | 30 Ų | 30 | 97.1 Ų | 97.1 | 31% | 0.309 | 49% | 0.487 | S | S | . | . | trans | -104.4 | 150.7 | -177.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | G95 | G93-G95 PolarHBondContact O-N 2.89Š| ||
| 94 | R | 61.8 | Low | 68.4 | Low | 271 Ų | 271 | 104.8 Ų | 104.8 | 100% | 1.023 | 52% | 0.523 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.1 | 18.6 | -178.9 | -61.9 | 175.8 | 88.5 | 131.7 | -1.7 | 114.7 | ||
| 95 | G | 54.1 | Low | 67.2 | Low | 34 Ų | 34 | 114.9 Ų | 114.9 | 35% | 0.351 | 56% | 0.559 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -121.8 | 0.4 | -175.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | G93 T97 | G93-G95 PolarHBondContact O-N 2.89Å; G95-T97 PolarHBondContact O-N 3.34Å; G95-T97 VanDerWaalsContact O-N 3.16Å |
| 96 | S | 56.4 | Low | 65.8 | Low | 69 Ų | 69 | 115.9 Ų | 115.9 | 48% | 0.483 | 58% | 0.576 | S | S | . | * | trans | -77.9 | 99.9 | 173.9 | 58 | 0 | 0 | 0 | 0 | 110.2 | G98 | S96-G98 PolarHBondContact O-N 3.11Š| ||
| 97 | T | 53.9 | Low | 64.8 | Low | 133 Ų | 133 | 114 Ų | 114 | 82% | 0.816 | 58% | 0.575 | S | S | * | * | S | Bend | trans | -67.8 | 77.4 | 173.7 | 49.6 | 0 | 0 | 0 | 0 | 110.7 | G95 | G95-T97 PolarHBondContact O-N 3.34Å; G95-T97 VanDerWaalsContact O-N 3.16Å |
| 98 | G | 57.8 | Low | 63.8 | Low | 55 Ų | 55 | 114.1 Ų | 114.1 | 57% | 0.567 | 59% | 0.587 | S | S | * | * | trans | 163.5 | 60.8 | -170.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | S96 Q100 | S96-G98 PolarHBondContact O-N 3.11Å; G98-Q100 PolarHBondContact O-N 2.86Å | ||
| 99 | Q | 57.6 | Low | 62.2 | Low | 197 Ų | 197 | 117 Ų | 117 | 92% | 0.921 | 60% | 0.596 | S | S | * | * | trans | -72.5 | 71.3 | 171.2 | -168.7 | -160.3 | 13.1 | 0 | 0 | 110.4 | ||||
| 100 | Q | 53.7 | Low | 61 | Low | 172 Ų | 172 | 115 Ų | 115 | 80% | 0.804 | 59% | 0.59 | S | S | * | * | trans | -97 | 127.3 | 153.3 | -73.2 | 176.8 | 24 | 0 | 0 | 106.5 | G98 P102 | G98-Q100 PolarHBondContact O-N 2.86Å; Q100-P102 WeakPolarHBondContact O-CD 3.25Å | ||
| 101 | D | 54.8 | Low | 59.8 | Low | 84 Ų | 84 | 122.3 Ų | 122.3 | 45% | 0.449 | 62% | 0.621 | S | S | . | * | trans | -62.8 | 118.1 | -175.6 | -169.6 | -23.6 | 0 | 0 | 0 | 109.4 | R103 E104 | D101-R103 PolarHBondContact O-N 2.84Å; D101-R103 WeakPolarHBondContact OD1-CB 3.22Å; D101-R103 VanDerWaalsContact OD1-CD 3.25Å; D101-R103 WeakPolarHBondContact OD1-CD 3.35Å; D101-R103 WeakPolarHBondContact OD1-CG 3.09Å; D101-R103 PolarHBondContact OD1-N 2.96Å; D101-R103 VanDerWaalsContact OD1-N 3.13Å; D101-R103 WeakPolarHBondContact OD2-CD 3.45Å; D101-E104 PolarHBondContact O-N 3.3Å; D101-E104 VanDerWaalsContact O-N 3.11Å | ||
| 102 | P | 55.8 | Low | 59 | Low | 62 Ų | 62 | 122.5 Ų | 122.5 | 40% | 0.403 | 64% | 0.637 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -61.9 | -0.5 | -179.1 | -24 | 35.7 | 0 | 0 | 0 | 114.6 | Q100 | Q100-P102 WeakPolarHBondContact O-CD 3.25Š|
| 103 | R | 58.5 | Low | 58.3 | Low | 215 Ų | 215 | 124 Ų | 124 | 81% | 0.811 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.4 | -18.7 | 172.4 | -64.3 | 169.6 | 79.3 | 168.9 | 5 | 113.9 | D101 | D101-R103 PolarHBondContact O-N 2.84Å; D101-R103 WeakPolarHBondContact OD1-CB 3.22Å; D101-R103 VanDerWaalsContact OD1-CD 3.25Å; D101-R103 WeakPolarHBondContact OD1-CD 3.35Å; D101-R103 WeakPolarHBondContact OD1-CG 3.09Å; D101-R103 PolarHBondContact OD1-N 2.96Å; D101-R103 VanDerWaalsContact OD1-N 3.13Å; D101-R103 WeakPolarHBondContact OD2-CD 3.45Å |
| 104 | E | 60.2 | Low | 58.1 | Low | 171 Ų | 171 | 132.5 Ų | 132.5 | 80% | 0.799 | 67% | 0.673 | S | S | * | * | S | Bend | trans | -91.5 | -7.8 | -174 | -62.7 | -165.7 | 159.5 | 0 | 0 | 115 | D101 | D101-E104 PolarHBondContact O-N 3.3Å; D101-E104 VanDerWaalsContact O-N 3.11Å |
| 105 | R | 59.7 | Low | 58.2 | Low | 223 Ų | 223 | 125 Ų | 125 | 84% | 0.842 | 66% | 0.659 | S | S | * | * | S | Bend | trans | -119.2 | 80.1 | 179.7 | -161.2 | 73.7 | 178 | -176 | 0.3 | 112.7 | ||
| 106 | T | 53.1 | Low | 59 | Low | 121 Ų | 121 | 131.6 Ų | 131.6 | 74% | 0.742 | 68% | 0.681 | S | S | * | * | trans | -38.1 | 131.8 | 163 | -32.8 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 107 | P | 59.9 | Low | 59.4 | Low | 82 Ų | 82 | 132.5 Ų | 132.5 | 53% | 0.532 | 69% | 0.685 | S | S | . | * | S | Bend | cis | -104.4 | 164.5 | 38.1 | 38 | -35.5 | 0 | 0 | 0 | 116.2 | R109 | P107-R109 PolarHBondContact O-N 3.34Š|
| 108 | P | 59.4 | Low | 59.9 | Low | 121 Ų | 121 | 134.1 Ų | 134.1 | 79% | 0.786 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 125.8 | -173.6 | 23.9 | -34.9 | 0 | 0 | 0 | 113.5 | ||
| 109 | R | 53.2 | Low | 60.1 | Low | 73 Ų | 73 | 138 Ų | 138 | 28% | 0.275 | 69% | 0.691 | S | S | . | * | P | Polyproline II helix | trans | -66.3 | 134 | 171.1 | -167.6 | 177 | -126.3 | 129.2 | 2.1 | 109.1 | D48 Y92 P107 Q111 | D48-R109 IonicContact OD1-CZ 3.93Å; D48-R109 IonicContact OD1-NH1 3.25Å; D48-R109 PolarHBondContact OD1-NH1 3.13Å; D48-R109 IonicContact OD1-NH2 2.49Å; D48-R109 PolarHBondContact OD1-NH2 2.84Å; Y92-R109 VanDerWaalsContact OH-CD 3.25Å; Y92-R109 WeakPolarHBondContact OH-CD 3.25Å; Y92-R109 PolarHBondContact OH-NE 2.83Å; Y92-R109 PolarHBondContact OH-NH1 2.92Å; P107-R109 PolarHBondContact O-N 3.34Å; R109-Q111 PolarHBondContact O-N 3.26Å |
| 110 | P | 61.8 | Low | 60.2 | Low | 51 Ų | 51 | 138.3 Ų | 138.3 | 33% | 0.331 | 68% | 0.684 | S | S | . | * | P | Polyproline II helix | trans | -57.1 | 129.5 | 171 | 24.3 | -32.6 | 0 | 0 | 0 | 108.7 | G112 | P110-G112 PolarHBondContact O-N 3.24Š|
| 111 | Q | 60.2 | Low | 60 | Low | 186 Ų | 186 | 133.2 Ų | 133.2 | 87% | 0.869 | 68% | 0.677 | S | S | * | * | P | Polyproline II helix | trans | -63.1 | 126.2 | 178.7 | -67.6 | -179.6 | -5.4 | 0 | 0 | 108.3 | R109 Q113 | R109-Q111 PolarHBondContact O-N 3.26Å; Q111-Q113 PolarHBondContact O-N 3.27Å |
| 112 | G | 67.6 | Low | 59.7 | Low | 62 Ų | 62 | 132 Ų | 132 | 64% | 0.639 | 69% | 0.685 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 128 | 170.6 | 0 | 0 | 0 | 0 | 0 | 108.3 | P110 R114 | P110-G112 PolarHBondContact O-N 3.24Å; G112-R114 PolarHBondContact O-N 2.73Å |
| 113 | Q | 57.4 | Low | 59.4 | Low | 193 Ų | 193 | 137.9 Ų | 137.9 | 90% | 0.902 | 70% | 0.704 | S | S | * | * | trans | -67.6 | 79 | 169.5 | -72.8 | -177 | -16.9 | 0 | 0 | 108.4 | Q111 P115 | Q111-Q113 PolarHBondContact O-N 3.27Å; Q113-P115 WeakPolarHBondContact O-CD 3.04Å | ||
| 114 | R | 62.6 | Low | 59.4 | Low | 207 Ų | 207 | 137.2 Ų | 137.2 | 78% | 0.781 | 71% | 0.71 | S | S | * | * | trans | -77.8 | 102.7 | 160 | -179.8 | 171.3 | -171.8 | 161.1 | 3.3 | 105.1 | G112 E116 | G112-R114 PolarHBondContact O-N 2.73Å; R114-E116 PolarHBondContact O-N 3.22Å | ||
| 115 | P | 64.8 | Low | 58.6 | Low | 114 Ų | 114 | 129.9 Ų | 129.9 | 74% | 0.74 | 68% | 0.681 | S | S | * | * | trans | -51.9 | 131.2 | 160 | 24.8 | -33.4 | 0 | 0 | 0 | 106.6 | Q113 | Q113-P115 WeakPolarHBondContact O-CD 3.04Š| ||
| 116 | E | 71.6 | Confident | 57.4 | Low | 173 Ų | 173 | 126.1 Ų | 126.1 | 81% | 0.808 | 67% | 0.671 | S | S | * | * | trans | -53.3 | 132.6 | 177.1 | -163.7 | 151.1 | 88.2 | 0 | 0 | 107.4 | R114 E118 | R114-E116 PolarHBondContact O-N 3.22Å; E116-E118 PolarHBondContact O-N 2.85Å | ||
| 117 | P | 64.3 | Low | 56.9 | Low | 88 Ų | 88 | 124.3 Ų | 124.3 | 57% | 0.571 | 68% | 0.676 | S | S | * | * | trans | -56.7 | 112.5 | 174.1 | 24.1 | -32.9 | 0 | 0 | 0 | 106.6 | N119 | P117-N119 PolarHBondContact O-N 2.87Š| ||
| 118 | E | 64.9 | Low | 55.9 | Low | 166 Ų | 166 | 127.6 Ų | 127.6 | 78% | 0.776 | 68% | 0.682 | S | S | * | * | trans | -43.7 | 108.6 | -177.7 | -178.7 | 88.9 | 86.1 | 0 | 0 | 107.6 | E116 R120 | E116-E118 PolarHBondContact O-N 2.85Å; E118-R120 HydrophobicContact CG-CB 4.41Å; E118-R120 PolarHBondContact O-N 3.18Å | ||
| 119 | N | 61.3 | Low | 55 | Low | 136 Ų | 136 | 125.3 Ų | 125.3 | 73% | 0.727 | 68% | 0.68 | S | S | * | * | trans | -76 | 69.8 | 176.5 | -169.8 | -19.2 | 0 | 0 | 0 | 106.6 | P117 G121 | P117-N119 PolarHBondContact O-N 2.87Å; N119-G121 VanDerWaalsContact C-N 3.35Å; N119-G121 WeakPolarHBondContact O-CA 2.94Å; N119-G121 PolarHBondContact O-N 2.96Å | ||
| 120 | R | 59.1 | Low | 54.5 | Low | 205 Ų | 205 | 129.6 Ų | 129.6 | 77% | 0.774 | 71% | 0.709 | S | S | * | * | trans | -59.4 | 103.7 | 174.6 | -169 | 176.3 | -176.9 | 118.5 | -1.7 | 104.7 | E118 | E118-R120 HydrophobicContact CG-CB 4.41Å; E118-R120 PolarHBondContact O-N 3.18Å | ||
| 121 | G | 50.5 | Low | 53.9 | Low | 64 Ų | 64 | 130.6 Ų | 130.6 | 66% | 0.66 | 73% | 0.728 | S | S | * | * | trans | -49.2 | 149.5 | -148.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | N119 | N119-G121 VanDerWaalsContact C-N 3.35Å; N119-G121 WeakPolarHBondContact O-CA 2.94Å; N119-G121 PolarHBondContact O-N 2.96Å | ||
| 122 | G | 48.8 | Very low | 53 | Low | 59 Ų | 59 | 124.7 Ų | 124.7 | 61% | 0.608 | 72% | 0.717 | S | S | * | * | trans | -41.2 | 137.3 | -170.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | Q124 | G122-Q124 PolarHBondContact O-N 3.23Š| ||
| 123 | F | 48 | Very low | 51.9 | Low | 185 Ų | 185 | 130.1 Ų | 130.1 | 81% | 0.811 | 72% | 0.724 | S | S | * | * | trans | -21.7 | 85.9 | 170.2 | -178.8 | -108.1 | 0 | 0 | 0 | 114.8 | G125 | F123-G125 WeakPolarHBondContact CE1-O 3.47Å; F123-G125 WeakPolarHBondContact CZ-O 3.37Å; F123-G125 PolarHBondContact O-N 3.38Å | ||
| 124 | Q | 58.6 | Low | 51.5 | Low | 202 Ų | 202 | 127.6 Ų | 127.6 | 94% | 0.944 | 71% | 0.712 | S | S | * | * | trans | -81.3 | 60.7 | 163.4 | -68.3 | -159.5 | -26.9 | 0 | 0 | 108.9 | G122 | G122-Q124 PolarHBondContact O-N 3.23Š| ||
| 125 | G | 43 | Very low | 50.9 | Low | 17 Ų | 17 | 124.3 Ų | 124.3 | 18% | 0.175 | 71% | 0.707 | C | S | . | * | S | Bend | trans | -126.6 | 70 | -174 | 0 | 0 | 0 | 0 | 0 | 111.8 | F123 | F123-G125 WeakPolarHBondContact CE1-O 3.47Å; F123-G125 WeakPolarHBondContact CZ-O 3.37Å; F123-G125 PolarHBondContact O-N 3.38Å |
| 126 | F | 35.9 | Very low | 50.4 | Low | 144 Ų | 144 | 124.8 Ų | 124.8 | 63% | 0.632 | 71% | 0.713 | S | S | * | * | trans | 50.9 | 78.3 | 166 | -97.1 | -108.9 | 0 | 0 | 0 | 115.7 | F128 | F126-F128 VanDerWaalsContact C-N 3.27Å; F126-F128 AromaticContact CD1-CD2 3.33Å; F126-F128 HydrophobicContact CD1-CD2 3.33Å; F126-F128 AromaticContact CD1-CE2 3.84Å; F126-F128 HydrophobicContact CD1-CE2 3.84Å; F126-F128 HydrophobicContact CD1-CG 4.22Å; F126-F128 AromaticContact CE1-CD2 3.59Å; F126-F128 HydrophobicContact CE1-CD2 3.59Å; F126-F128 AromaticContact CE1-CE2 3.63Å; F126-F128 HydrophobicContact CE1-CE2 3.63Å; F126-F128 HydrophobicContact CG-CD2 4.2Å; F126-F128 HydrophobicContact CZ-CE2 4.36Å; F126-F128 PolarHBondContact O-N 3.26Å | ||
| 127 | G | 42.3 | Very low | 49.6 | Very low | 82 Ų | 82 | 126.3 Ų | 126.3 | 85% | 0.845 | 72% | 0.718 | S | S | * | * | trans | -67.8 | 89.2 | 152.4 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 128 | F | 38.6 | Very low | 48.9 | Very low | 152 Ų | 152 | 125.3 Ų | 125.3 | 67% | 0.667 | 72% | 0.723 | S | S | * | * | trans | -127 | 110.3 | 162.3 | -87.6 | -93.6 | 0 | 0 | 0 | 109.3 | F126 | F126-F128 VanDerWaalsContact C-N 3.27Å; F126-F128 AromaticContact CD1-CD2 3.33Å; F126-F128 HydrophobicContact CD1-CD2 3.33Å; F126-F128 AromaticContact CD1-CE2 3.84Å; F126-F128 HydrophobicContact CD1-CE2 3.84Å; F126-F128 HydrophobicContact CD1-CG 4.22Å; F126-F128 AromaticContact CE1-CD2 3.59Å; F126-F128 HydrophobicContact CE1-CD2 3.59Å; F126-F128 AromaticContact CE1-CE2 3.63Å; F126-F128 HydrophobicContact CE1-CE2 3.63Å; F126-F128 HydrophobicContact CG-CD2 4.2Å; F126-F128 HydrophobicContact CZ-CE2 4.36Å; F126-F128 PolarHBondContact O-N 3.26Å | ||
| 129 | G | 41.3 | Very low | 48.2 | Very low | 73 Ų | 73 | 126.1 Ų | 126.1 | 75% | 0.753 | 73% | 0.73 | S | S | * | * | S | Bend | trans | -58.9 | 146.2 | 148.7 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||
| 130 | D | 43 | Very low | 47.4 | Very low | 163 Ų | 163 | 122.5 Ų | 122.5 | 87% | 0.872 | 73% | 0.725 | S | S | * | * | S | Bend | trans | 65.7 | 88.8 | -173.2 | -94 | -34.7 | 0 | 0 | 0 | 117.3 | G132 | D130-G132 PolarHBondContact O-N 3.3Š|
| 131 | G | 48.1 | Very low | 47.3 | Very low | 71 Ų | 71 | 117.7 Ų | 117.7 | 73% | 0.732 | 73% | 0.73 | S | S | * | * | 72.7 | 12.7 | 126 | 0 | 0 | 0 | 0 | 0 | 119.8 | |||||
| 132 | G | 41.3 | Very low | 47 | Very low | 63 Ų | 63 | 122.5 Ų | 122.5 | 65% | 0.649 | 73% | 0.733 | S | S | * | * | trans | -97.3 | 122.8 | -175.7 | 0 | 0 | 0 | 0 | 0 | 115.8 | D130 | D130-G132 PolarHBondContact O-N 3.3Š| ||
| 133 | F | 44.1 | Very low | 47.3 | Very low | 175 Ų | 175 | 124.6 Ų | 124.6 | 77% | 0.768 | 74% | 0.736 | S | S | * | * | trans | -67.6 | 131.4 | 171.8 | -15 | -91.5 | 0 | 0 | 0 | 111.4 | M135 | F133-M135 HydrophobicContact CB-CE 3.85Å; F133-M135 HydrophobicContact CB-SD 4.27Å; F133-M135 HydrophobicContact CD2-CE 4.36Å; F133-M135 HydrophobicContact CG-CE 4.29Å | ||
| 134 | Q | 49.8 | Very low | 47.6 | Very low | 141 Ų | 141 | 122.7 Ų | 122.7 | 66% | 0.659 | 73% | 0.727 | S | S | * | * | trans | -94.9 | 105.9 | 178.8 | 57.5 | -170.7 | -14.1 | 0 | 0 | 112.1 | ||||
| 135 | M | 48.8 | Very low | 47.2 | Very low | 138 Ų | 138 | 115 Ų | 115 | 68% | 0.68 | 70% | 0.702 | S | S | * | * | trans | -102.4 | 100.1 | 172.3 | -63.4 | 103.8 | 176 | 0 | 0 | 111.1 | F133 F137 | F133-M135 HydrophobicContact CB-CE 3.85Å; F133-M135 HydrophobicContact CB-SD 4.27Å; F133-M135 HydrophobicContact CD2-CE 4.36Å; F133-M135 HydrophobicContact CG-CE 4.29Å; M135-F137 HydrophobicContact CB-CD2 4.41Å; M135-F137 HydrophobicContact CB-CE2 4.38Å; M135-F137 PolarHBondContact O-N 3.09Å; M135-F137 VanDerWaalsContact O-N 3.16Å | ||
| 136 | S | 55.1 | Low | 47.8 | Very low | 124 Ų | 124 | 120.7 Ų | 120.7 | 87% | 0.867 | 73% | 0.727 | S | S | * | * | trans | -76.9 | 97.4 | 176 | -59.8 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 137 | F | 55 | Low | 48.3 | Very low | 205 Ų | 205 | 120.5 Ų | 120.5 | 90% | 0.899 | 73% | 0.726 | S | S | * | * | trans | -79.3 | 113.6 | 171.6 | -90.4 | -99.5 | 0 | 0 | 0 | 111.1 | M135 | M135-F137 HydrophobicContact CB-CD2 4.41Å; M135-F137 HydrophobicContact CB-CE2 4.38Å; M135-F137 PolarHBondContact O-N 3.09Å; M135-F137 VanDerWaalsContact O-N 3.16Å | ||
| 138 | G | 49.9 | Very low | 48.5 | Very low | 66 Ų | 66 | 120.6 Ų | 120.6 | 68% | 0.68 | 72% | 0.719 | S | S | * | * | trans | -179.3 | 93.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 139 | I | 49.8 | Very low | 49.1 | Very low | 183 Ų | 183 | 118.1 Ų | 118.1 | 94% | 0.938 | 72% | 0.717 | S | S | * | * | S | Bend | trans | 99.1 | 104.7 | 168.7 | -54.4 | 160.7 | 0 | 0 | 0 | 115.1 | ||
| 140 | G | 44.1 | Very low | 49.6 | Very low | 60 Ų | 60 | 117.2 Ų | 117.2 | 62% | 0.619 | 70% | 0.702 | S | S | * | * | trans | 111.2 | 83.6 | 162.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | F142 | G140-F142 PolarHBondContact O-N 3.27Å; G140-F142 VanDerWaalsContact O-N 3.08Å | ||
| 141 | A | 58 | Low | 49.8 | Very low | 105 Ų | 105 | 118 Ų | 118 | 87% | 0.868 | 70% | 0.698 | S | S | * | * | trans | -79.2 | 81.5 | 169 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 142 | F | 44.1 | Very low | 49.9 | Very low | 165 Ų | 165 | 119.8 Ų | 119.8 | 72% | 0.724 | 69% | 0.691 | S | S | * | * | S | Bend | trans | -167.3 | 146.2 | 160.9 | -126.9 | -100.5 | 0 | 0 | 0 | 108.9 | G140 F144 G145 | G140-F142 PolarHBondContact O-N 3.27Å; G140-F142 VanDerWaalsContact O-N 3.08Å; F142-F144 HydrophobicContact CD1-CD2 4.19Å; F142-F144 PolarHBondContact O-N 3.13Å; F142-G145 PolarHBondContact O-N 2.86Å |
| 143 | P | 55.3 | Low | 50.3 | Low | 103 Ų | 103 | 123.4 Ų | 123.4 | 67% | 0.669 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.2 | 0.3 | -172.3 | 23.1 | -35.6 | 0 | 0 | 0 | 117.1 | ||
| 144 | F | 53.4 | Low | 50.3 | Low | 145 Ų | 145 | 122.1 Ų | 122.1 | 64% | 0.636 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106 | 0.9 | 179.7 | -57.2 | -71.4 | 0 | 0 | 0 | 114.4 | F142 I146 F147 | F142-F144 HydrophobicContact CD1-CD2 4.19Å; F142-F144 PolarHBondContact O-N 3.13Å; F144-I146 PolarHBondContact O-N 3.15Å; F144-F147 PolarHBondContact O-N 3.41Å |
| 145 | G | 50.8 | Low | 50.2 | Low | 40 Ų | 40 | 120.7 Ų | 120.7 | 41% | 0.412 | 69% | 0.692 | S | S | . | * | H | α-helix | trans | -59.9 | -12 | -178.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | F142 T149 | F142-G145 PolarHBondContact O-N 2.86Å; G145-T149 PolarHBondContact O-OG1 2.98Å |
| 146 | I | 55.6 | Low | 50.1 | Low | 137 Ų | 137 | 117.6 Ų | 117.6 | 70% | 0.703 | 70% | 0.695 | S | S | * | * | H | α-helix | trans | -76.3 | -24 | 179.9 | -37.7 | -177.8 | 0 | 0 | 0 | 112 | F144 | F144-I146 PolarHBondContact O-N 3.15Å |
| 147 | F | 46.4 | Very low | 50 | Low | 139 Ų | 139 | 122.6 Ų | 122.6 | 61% | 0.61 | 70% | 0.695 | S | S | * | * | H | α-helix | trans | -84.6 | -29.8 | -176.2 | -74.4 | -81.9 | 0 | 0 | 0 | 114 | F144 T149 A150 | F144-F147 PolarHBondContact O-N 3.41Å; F147-T149 VanDerWaalsContact C-N 3.32Å; F147-T149 PolarHBondContact O-N 2.82Å; F147-A150 PolarHBondContact O-N 3.42Å |
| 148 | A | 45.5 | Very low | 50.1 | Low | 84 Ų | 84 | 117.6 Ų | 117.6 | 69% | 0.694 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -67.1 | -33.7 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | A150 | A148-A150 VanDerWaalsContact C-N 3.34Å |
| 149 | T | 51 | Low | 50.4 | Low | 101 Ų | 101 | 118.5 Ų | 118.5 | 62% | 0.62 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.6 | -20.5 | 179.5 | -13.1 | 0 | 0 | 0 | 0 | 113.2 | G145 F147 I153 | G145-T149 PolarHBondContact O-OG1 2.98Å; F147-T149 VanDerWaalsContact C-N 3.32Å; F147-T149 PolarHBondContact O-N 2.82Å; T149-I153 WeakPolarHBondContact O-CD1 3.5Å; T149-I153 WeakPolarHBondContact O-CG1 3.41Å |
| 150 | A | 53.6 | Low | 50.7 | Low | 54 Ų | 54 | 115.6 Ų | 115.6 | 45% | 0.446 | 67% | 0.67 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -81.8 | -25 | -173.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | F147 A148 | F147-A150 PolarHBondContact O-N 3.42Å; A148-A150 VanDerWaalsContact C-N 3.34Å |
| 151 | F | 47.1 | Very low | 51.3 | Low | 180 Ų | 180 | 113.7 Ų | 113.7 | 79% | 0.789 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -101.4 | 6.1 | -174.2 | -69.6 | -72.9 | 0 | 0 | 0 | 114.9 | ||
| 152 | N | 48.6 | Very low | 51.4 | Low | 108 Ų | 108 | 111.7 Ų | 111.7 | 58% | 0.578 | 63% | 0.632 | S | S | * | * | trans | -134.6 | 49.1 | 172.8 | -155.7 | -107.6 | 0 | 0 | 0 | 112.2 | ||||
| 153 | I | 50.4 | Low | 51.8 | Low | 138 Ų | 138 | 109.6 Ų | 109.6 | 71% | 0.708 | 64% | 0.635 | S | S | * | * | trans | -91.1 | -10.4 | 177.7 | -72 | 173.7 | 0 | 0 | 0 | 112.6 | T149 | T149-I153 WeakPolarHBondContact O-CD1 3.5Å; T149-I153 WeakPolarHBondContact O-CG1 3.41Å | ||
| 154 | N | 44.7 | Very low | 52.2 | Low | 149 Ų | 149 | 108.4 Ų | 108.4 | 80% | 0.797 | 64% | 0.642 | S | S | * | * | S | Bend | trans | -90.8 | -25.8 | -176.8 | -167.7 | 78.5 | 0 | 0 | 0 | 114.9 | G156 | N154-G156 PolarHBondContact O-N 3.21Š|
| 155 | D | 47.3 | Very low | 53.1 | Low | 111 Ų | 111 | 103.8 Ų | 103.8 | 59% | 0.594 | 63% | 0.626 | S | S | * | * | S | Bend | trans | -86.8 | 94.1 | 178.7 | -70.8 | -58.2 | 0 | 0 | 0 | 110.1 | R157 | D155-R157 PolarHBondContact O-N 3.43Š|
| 156 | G | 47.2 | Very low | 53.9 | Low | 73 Ų | 73 | 106.1 Ų | 106.1 | 75% | 0.753 | 63% | 0.634 | S | S | * | * | trans | -59 | 93.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | N154 P158 | N154-G156 PolarHBondContact O-N 3.21Å; G156-P158 WeakPolarHBondContact O-CD 3.19Å; G156-P158 VanDerWaalsContact O-N 3.15Å | ||
| 157 | R | 51.6 | Low | 54.2 | Low | 228 Ų | 228 | 106 Ų | 106 | 86% | 0.86 | 63% | 0.63 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 116.9 | 178.9 | -172.6 | 174.9 | -173.5 | 135.9 | 5.3 | 109.4 | D155 | D155-R157 PolarHBondContact O-N 3.43Š|
| 158 | P | 56.9 | Low | 55.2 | Low | 101 Ų | 101 | 102.2 Ų | 102.2 | 66% | 0.656 | 61% | 0.614 | S | S | * | * | P | Polyproline II helix | trans | -60 | 149.5 | 175.3 | 24.6 | -32.3 | 0 | 0 | 0 | 109.7 | G156 | G156-P158 WeakPolarHBondContact O-CD 3.19Å; G156-P158 VanDerWaalsContact O-N 3.15Å |
| 159 | P | 56.8 | Low | 56.5 | Low | 85 Ų | 85 | 104.1 Ų | 104.1 | 55% | 0.552 | 61% | 0.61 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 148.3 | 174.4 | 26.3 | -34.1 | 0 | 0 | 0 | 109.9 | A161 | P159-A161 PolarHBondContact O-N 2.72Š|
| 160 | P | 57.3 | Low | 57.6 | Low | 121 Ų | 121 | 103.8 Ų | 103.8 | 79% | 0.786 | 61% | 0.605 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 128.3 | 178.1 | 23.5 | -33.6 | 0 | 0 | 0 | 109.6 | A162 | P160-A162 PolarHBondContact O-N 2.91Š|
| 161 | A | 56.6 | Low | 58.6 | Low | 21 Ų | 21 | 106.7 Ų | 106.7 | 17% | 0.174 | 61% | 0.609 | C | S | . | * | P | Polyproline II helix | trans | -56.8 | 135.3 | -170.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | P159 Q167 H168 | P159-A161 PolarHBondContact O-N 2.72Å; A161-Q167 HydrophobicContact CB-CB 4.13Å; A161-H168 HydrophobicContact CB-CB 4.14Å; A161-H168 PolarHBondContact O-CD2 3.46Å; A161-H168 VanDerWaalsContact O-CD2 3.27Å |
| 162 | A | 59.9 | Low | 60.1 | Low | 63 Ų | 63 | 102.5 Ų | 102.5 | 52% | 0.521 | 59% | 0.592 | S | S | . | * | P | Polyproline II helix | trans | -59.3 | 136.4 | -177.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | P160 G164 T165 | P160-A162 PolarHBondContact O-N 2.91Å; A162-G164 PolarHBondContact O-N 2.81Å; A162-T165 HydrophobicContact CB-CG2 4.36Å; A162-T165 PolarHBondContact O-N 3.22Å; A162-T165 VanDerWaalsContact O-N 3.13Å; A162-T165 PolarHBondContact O-OG1 2.99Å |
| 163 | P | 52.6 | Low | 61.8 | Low | 120 Ų | 120 | 104 Ų | 104 | 78% | 0.779 | 59% | 0.594 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.8 | 124.7 | -179.9 | -27.1 | 35 | 0 | 0 | 0 | 111.8 | ||
| 164 | G | 63.6 | Low | 63.5 | Low | 79 Ų | 79 | 102.4 Ų | 102.4 | 81% | 0.814 | 59% | 0.586 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 103.7 | -5.3 | -177.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | A162 | A162-G164 PolarHBondContact O-N 2.81Š|
| 165 | T | 71.1 | Confident | 65.3 | Low | 48 Ų | 48 | 98.1 Ų | 98.1 | 29% | 0.294 | 57% | 0.568 | S | S | . | * | S | Bend | trans | -79.7 | 149.9 | 169.9 | 56.1 | 0 | 0 | 0 | 0 | 112 | A162 Q167 H168 | A162-T165 HydrophobicContact CB-CG2 4.36Å; A162-T165 PolarHBondContact O-N 3.22Å; A162-T165 VanDerWaalsContact O-N 3.13Å; A162-T165 PolarHBondContact O-OG1 2.99Å; T165-Q167 PolarHBondContact O-N 2.89Å; T165-H168 WeakPolarHBondContact O-CB 3.36Å; T165-H168 PolarHBondContact O-N 3.38Å; T165-H168 VanDerWaalsContact O-N 3.09Å |
| 166 | P | 68.4 | Low | 67.1 | Low | 89 Ų | 89 | 101.7 Ų | 101.7 | 58% | 0.578 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -61.5 | -29.3 | 177 | 23.8 | -33.4 | 0 | 0 | 0 | 112.9 | H168 M169 D170 | P166-H168 PolarHBondContact O-N 3.31Å; P166-M169 WeakPolarHBondContact O-CG 3.38Å; P166-M169 PolarHBondContact O-N 2.74Å; P166-D170 PolarHBondContact O-N 3.31Å |
| 167 | Q | 62.3 | Low | 69.2 | Low | 135 Ų | 135 | 102.1 Ų | 102.1 | 63% | 0.631 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -62.8 | -31.1 | 175.8 | -61 | -174.1 | -76 | 0 | 0 | 112.5 | A161 T165 D170 E171 | A161-Q167 HydrophobicContact CB-CB 4.13Å; T165-Q167 PolarHBondContact O-N 2.89Å; Q167-D170 PolarHBondContact O-N 3.23Å; Q167-E171 WeakPolarHBondContact O-CB 3.37Å; Q167-E171 WeakPolarHBondContact O-CG 3.37Å; Q167-E171 PolarHBondContact O-N 3.28Å |
| 168 | H | 66.8 | Low | 71.2 | Confident | 59 Ų | 59 | 98.6 Ų | 98.6 | 27% | 0.273 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -72.9 | -28.4 | 179.6 | -169 | -87.2 | 0 | 0 | 0 | 113 | A161 T165 P166 Q172 | A161-H168 HydrophobicContact CB-CB 4.14Å; A161-H168 PolarHBondContact O-CD2 3.46Å; A161-H168 VanDerWaalsContact O-CD2 3.27Å; T165-H168 WeakPolarHBondContact O-CB 3.36Å; T165-H168 PolarHBondContact O-N 3.38Å; T165-H168 VanDerWaalsContact O-N 3.09Å; P166-H168 PolarHBondContact O-N 3.31Å; H168-Q172 PolarHBondContact CE1-NE2 3.21Å; H168-Q172 WeakPolarHBondContact O-CB 3.46Å; H168-Q172 VanDerWaalsContact O-CG 3.27Å; H168-Q172 WeakPolarHBondContact O-CG 3.23Å; H168-Q172 PolarHBondContact O-N 3.37Å |
| 169 | M | 71.6 | Confident | 72.7 | Confident | 123 Ų | 123 | 99.1 Ų | 99.1 | 61% | 0.606 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -74.5 | -36.9 | 172.6 | 55.8 | 176.7 | 76.7 | 0 | 0 | 111.5 | P166 Q172 F173 | P166-M169 WeakPolarHBondContact O-CG 3.38Å; P166-M169 PolarHBondContact O-N 2.74Å; M169-Q172 PolarHBondContact O-N 3.2Å; M169-F173 PolarHBondContact O-N 2.96Å |
| 170 | D | 75.9 | Confident | 74.4 | Confident | 95 Ų | 95 | 101.5 Ų | 101.5 | 51% | 0.508 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -65.8 | -44.7 | 175.3 | -64.2 | -32.4 | 0 | 0 | 0 | 111.7 | P166 Q167 Q172 F173 L174 | P166-D170 PolarHBondContact O-N 3.31Å; Q167-D170 PolarHBondContact O-N 3.23Å; D170-Q172 VanDerWaalsContact C-N 3.32Å; D170-Q172 PolarHBondContact O-N 3.27Å; D170-F173 PolarHBondContact O-N 2.97Å; D170-F173 VanDerWaalsContact O-N 3.15Å; D170-L174 WeakPolarHBondContact O-CB 3.21Å; D170-L174 WeakPolarHBondContact O-CG 3.43Å; D170-L174 PolarHBondContact O-N 2.88Å |
| 171 | E | 73.3 | Confident | 76.2 | Confident | 114 Ų | 114 | 99 Ų | 99 | 53% | 0.533 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -60.9 | -38.6 | 174.6 | -68.4 | -111.8 | 118.9 | 0 | 0 | 112.3 | Q167 S175 | Q167-E171 WeakPolarHBondContact O-CB 3.37Å; Q167-E171 WeakPolarHBondContact O-CG 3.37Å; Q167-E171 PolarHBondContact O-N 3.28Å; E171-S175 WeakPolarHBondContact O-CB 3.42Å; E171-S175 PolarHBondContact O-N 3.48Å; E171-S175 PolarHBondContact O-OG 3.04Å |
| 172 | Q | 79.1 | Confident | 77.8 | Confident | 93 Ų | 93 | 99.7 Ų | 99.7 | 44% | 0.435 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -69.1 | -32.4 | 174.8 | -78.2 | -173.8 | -18.6 | 0 | 0 | 112.9 | H168 M169 D170 S175 R176 | H168-Q172 PolarHBondContact CE1-NE2 3.21Å; H168-Q172 WeakPolarHBondContact O-CB 3.46Å; H168-Q172 VanDerWaalsContact O-CG 3.27Å; H168-Q172 WeakPolarHBondContact O-CG 3.23Å; H168-Q172 PolarHBondContact O-N 3.37Å; M169-Q172 PolarHBondContact O-N 3.2Å; D170-Q172 VanDerWaalsContact C-N 3.32Å; D170-Q172 PolarHBondContact O-N 3.27Å; Q172-S175 WeakPolarHBondContact CA-OG 3.35Å; Q172-S175 PolarHBondContact O-OG 3.44Å; Q172-R176 WeakPolarHBondContact O-CB 3.38Å; Q172-R176 WeakPolarHBondContact O-CD 3.33Å; Q172-R176 VanDerWaalsContact O-CG 3.23Å; Q172-R176 WeakPolarHBondContact O-CG 3.42Å; Q172-R176 PolarHBondContact O-N 3.35Å |
| 173 | F | 84.8 | Confident | 79.5 | Confident | 140 Ų | 140 | 102.5 Ų | 102.5 | 61% | 0.614 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -71.4 | -48.8 | 173.8 | -175.8 | -96.7 | 0 | 0 | 0 | 111.3 | M169 D170 S175 R176 L177 | M169-F173 PolarHBondContact O-N 2.96Å; D170-F173 PolarHBondContact O-N 2.97Å; D170-F173 VanDerWaalsContact O-N 3.15Å; F173-S175 PolarHBondContact O-N 2.94Å; F173-R176 PolarHBondContact O-N 3.47Å; F173-L177 HydrophobicContact CE1-CD2 4.32Å; F173-L177 WeakPolarHBondContact O-CB 3.34Å; F173-L177 PolarHBondContact O-N 2.95Å |
| 174 | L | 85.8 | Confident | 81.5 | Confident | 103 Ų | 103 | 100.4 Ų | 100.4 | 54% | 0.539 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -59.2 | -44.9 | 178.2 | -76.4 | 162.7 | 0 | 0 | 0 | 112.4 | D170 L177 F178 | D170-L174 WeakPolarHBondContact O-CB 3.21Å; D170-L174 WeakPolarHBondContact O-CG 3.43Å; D170-L174 PolarHBondContact O-N 2.88Å; L174-L177 PolarHBondContact O-N 3.33Å; L174-F178 WeakPolarHBondContact O-CB 3.48Å; L174-F178 PolarHBondContact O-N 3.46Å |
| 175 | S | 81.7 | Confident | 82.9 | Confident | 60 Ų | 60 | 101 Ų | 101 | 42% | 0.42 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.4 | -40.6 | 177.5 | 52.3 | 0 | 0 | 0 | 0 | 112.9 | E171 Q172 F173 L179 | E171-S175 WeakPolarHBondContact O-CB 3.42Å; E171-S175 PolarHBondContact O-N 3.48Å; E171-S175 PolarHBondContact O-OG 3.04Å; Q172-S175 WeakPolarHBondContact CA-OG 3.35Å; Q172-S175 PolarHBondContact O-OG 3.44Å; F173-S175 PolarHBondContact O-N 2.94Å; S175-L179 WeakPolarHBondContact O-CB 3.33Å; S175-L179 WeakPolarHBondContact O-CG 3.27Å; S175-L179 PolarHBondContact O-N 2.87Å |
| 176 | R | 85.8 | Confident | 83.9 | Confident | 186 Ų | 186 | 103.9 Ų | 103.9 | 70% | 0.702 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -64.6 | -42.9 | 173.5 | -74.1 | 175.5 | -178.3 | -160.7 | 2 | 112.1 | Q172 F173 F180 | Q172-R176 WeakPolarHBondContact O-CB 3.38Å; Q172-R176 WeakPolarHBondContact O-CD 3.33Å; Q172-R176 VanDerWaalsContact O-CG 3.23Å; Q172-R176 WeakPolarHBondContact O-CG 3.42Å; Q172-R176 PolarHBondContact O-N 3.35Å; F173-R176 PolarHBondContact O-N 3.47Å; R176-F180 WeakPolarHBondContact O-CB 3.31Å; R176-F180 PolarHBondContact O-N 3.28Å |
| 177 | L | 91.9 | Very high | 85.2 | Confident | 82 Ų | 82 | 106.4 Ų | 106.4 | 43% | 0.429 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.5 | -45.3 | 177.5 | -178.1 | 64.8 | 0 | 0 | 0 | 111.4 | F173 L174 F180 V181 | F173-L177 HydrophobicContact CE1-CD2 4.32Å; F173-L177 WeakPolarHBondContact O-CB 3.34Å; F173-L177 PolarHBondContact O-N 2.95Å; L174-L177 PolarHBondContact O-N 3.33Å; L177-F180 PolarHBondContact O-N 3.01Å; L177-V181 WeakPolarHBondContact O-CG2 3.27Å; L177-V181 PolarHBondContact O-N 3.29Å |
| 178 | F | 91.9 | Very high | 86.7 | Confident | 154 Ų | 154 | 108.2 Ų | 108.2 | 68% | 0.675 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -63 | -44.7 | 178.5 | -176 | -98.6 | 0 | 0 | 0 | 112.1 | L174 F180 V181 A182 | L174-F178 WeakPolarHBondContact O-CB 3.48Å; L174-F178 PolarHBondContact O-N 3.46Å; F178-F180 VanDerWaalsContact C-N 3.34Å; F178-F180 PolarHBondContact O-N 3.43Å; F178-V181 PolarHBondContact O-N 2.96Å; F178-A182 VanDerWaalsContact O-CB 3.31Å; F178-A182 WeakPolarHBondContact O-CB 3.46Å; F178-A182 PolarHBondContact O-N 3.38Å |
| 179 | L | 89.1 | Confident | 87.9 | Confident | 111 Ų | 111 | 110 Ų | 110 | 58% | 0.581 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -61.7 | -40.9 | 174.6 | -73.6 | 173.4 | 0 | 0 | 0 | 112 | S175 A182 L183 | S175-L179 WeakPolarHBondContact O-CB 3.33Å; S175-L179 WeakPolarHBondContact O-CG 3.27Å; S175-L179 PolarHBondContact O-N 2.87Å; L179-A182 PolarHBondContact O-N 3.21Å; L179-L183 WeakPolarHBondContact O-CB 3.5Å; L179-L183 VanDerWaalsContact O-CG 3.29Å; L179-L183 WeakPolarHBondContact O-CG 3.4Å; L179-L183 PolarHBondContact O-N 3.27Å |
| 180 | F | 93.9 | Very high | 88.6 | Confident | 135 Ų | 135 | 111 Ų | 111 | 59% | 0.592 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -62.4 | -47.9 | 176.2 | -178.9 | -97.5 | 0 | 0 | 0 | 111.9 | R176 L177 F178 A182 L183 V184 | R176-F180 WeakPolarHBondContact O-CB 3.31Å; R176-F180 PolarHBondContact O-N 3.28Å; L177-F180 PolarHBondContact O-N 3.01Å; F178-F180 VanDerWaalsContact C-N 3.34Å; F178-F180 PolarHBondContact O-N 3.43Å; F180-A182 PolarHBondContact O-N 2.89Å; F180-L183 PolarHBondContact O-N 2.96Å; F180-V184 HydrophobicContact CD1-CG2 4.39Å; F180-V184 HydrophobicContact CE1-CG2 4.02Å; F180-V184 HydrophobicContact CZ-CG2 4.13Å; F180-V184 WeakPolarHBondContact O-CG2 3.48Å; F180-V184 PolarHBondContact O-N 3.01Å |
| 181 | V | 93.8 | Very high | 89.2 | Confident | 68 Ų | 68 | 112.2 Ų | 112.2 | 41% | 0.412 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -62.3 | -42.1 | 177 | 171.9 | 0 | 0 | 0 | 0 | 111.3 | L177 F178 L183 V184 I185 | L177-V181 WeakPolarHBondContact O-CG2 3.27Å; L177-V181 PolarHBondContact O-N 3.29Å; F178-V181 PolarHBondContact O-N 2.96Å; V181-L183 PolarHBondContact O-N 3.47Å; V181-V184 PolarHBondContact O-N 3.43Å; V181-I185 HydrophobicContact CG1-CD1 3.81Å; V181-I185 HydrophobicContact CG1-CG1 4.49Å; V181-I185 WeakPolarHBondContact O-CG1 3.35Å; V181-I185 PolarHBondContact O-N 3.07Å |
| 182 | A | 91.6 | Very high | 89.2 | Confident | 36 Ų | 36 | 112.5 Ų | 112.5 | 30% | 0.298 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -61.8 | -42.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | F178 L179 F180 I185 M186 | F178-A182 VanDerWaalsContact O-CB 3.31Å; F178-A182 WeakPolarHBondContact O-CB 3.46Å; F178-A182 PolarHBondContact O-N 3.38Å; L179-A182 PolarHBondContact O-N 3.21Å; F180-A182 PolarHBondContact O-N 2.89Å; A182-I185 PolarHBondContact O-N 2.96Å; A182-M186 WeakPolarHBondContact O-CB 3.49Å; A182-M186 WeakPolarHBondContact O-CG 3.29Å; A182-M186 PolarHBondContact O-N 3.4Å |
| 183 | L | 93.6 | Very high | 89.7 | Confident | 123 Ų | 123 | 113.5 Ų | 113.5 | 64% | 0.644 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -64.8 | -39.8 | 175.5 | -72.5 | 172.3 | 0 | 0 | 0 | 112.3 | L179 F180 V181 M186 F187 | L179-L183 WeakPolarHBondContact O-CB 3.5Å; L179-L183 VanDerWaalsContact O-CG 3.29Å; L179-L183 WeakPolarHBondContact O-CG 3.4Å; L179-L183 PolarHBondContact O-N 3.27Å; F180-L183 PolarHBondContact O-N 2.96Å; V181-L183 PolarHBondContact O-N 3.47Å; L183-M186 PolarHBondContact O-N 2.91Å; L183-F187 VanDerWaalsContact O-CB 3.27Å; L183-F187 WeakPolarHBondContact O-CB 3.38Å; L183-F187 PolarHBondContact O-N 2.81Å |
| 184 | V | 94.9 | Very high | 90 | Very high | 76 Ų | 76 | 112.1 Ų | 112.1 | 46% | 0.461 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -63 | -43.8 | 175 | 170.9 | 0 | 0 | 0 | 0 | 111.2 | F180 V181 F187 W188 | F180-V184 HydrophobicContact CD1-CG2 4.39Å; F180-V184 HydrophobicContact CE1-CG2 4.02Å; F180-V184 HydrophobicContact CZ-CG2 4.13Å; F180-V184 WeakPolarHBondContact O-CG2 3.48Å; F180-V184 PolarHBondContact O-N 3.01Å; V181-V184 PolarHBondContact O-N 3.43Å; V184-F187 PolarHBondContact O-N 3.17Å; V184-W188 WeakPolarHBondContact O-CB 3.19Å; V184-W188 PolarHBondContact O-N 3.14Å |
| 185 | I | 94.1 | Very high | 90.2 | Very high | 90 Ų | 90 | 112.6 Ų | 112.6 | 46% | 0.462 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -65 | -43.5 | 177.2 | -67.7 | 166.8 | 0 | 0 | 0 | 111.1 | V181 A182 W188 L189 | V181-I185 HydrophobicContact CG1-CD1 3.81Å; V181-I185 HydrophobicContact CG1-CG1 4.49Å; V181-I185 WeakPolarHBondContact O-CG1 3.35Å; V181-I185 PolarHBondContact O-N 3.07Å; A182-I185 PolarHBondContact O-N 2.96Å; I185-W188 PolarHBondContact O-N 2.97Å; I185-L189 HydrophobicContact CG2-CD1 3.98Å; I185-L189 WeakPolarHBondContact O-CB 3.43Å; I185-L189 WeakPolarHBondContact O-CG 2.95Å; I185-L189 PolarHBondContact O-N 3.16Å |
| 186 | M | 92.4 | Very high | 90.7 | Very high | 110 Ų | 110 | 115.6 Ų | 115.6 | 54% | 0.542 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -65.7 | -39 | 178.1 | -68.8 | -82.4 | 80.8 | 0 | 0 | 112.5 | A182 L183 L189 L190 | A182-M186 WeakPolarHBondContact O-CB 3.49Å; A182-M186 WeakPolarHBondContact O-CG 3.29Å; A182-M186 PolarHBondContact O-N 3.4Å; L183-M186 PolarHBondContact O-N 2.91Å; M186-L189 HydrophobicContact CE-CD1 3.75Å; M186-L190 WeakPolarHBondContact O-CB 2.94Å; M186-L190 PolarHBondContact O-N 3.05Å; M186-L190 VanDerWaalsContact O-N 3.14Å |
| 187 | F | 95.5 | Very high | 91 | Very high | 141 Ų | 141 | 111.3 Ų | 111.3 | 62% | 0.618 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -65.8 | -40.5 | 174.5 | -177.9 | -104.2 | 0 | 0 | 0 | 111.8 | L183 V184 L190 I191 | L183-F187 VanDerWaalsContact O-CB 3.27Å; L183-F187 WeakPolarHBondContact O-CB 3.38Å; L183-F187 PolarHBondContact O-N 2.81Å; V184-F187 PolarHBondContact O-N 3.17Å; F187-L190 PolarHBondContact O-N 3.23Å; F187-I191 HydrophobicContact CD1-CD1 3.93Å; F187-I191 HydrophobicContact CD2-CD1 4.1Å; F187-I191 HydrophobicContact CE1-CD1 3.45Å; F187-I191 VanDerWaalsContact CE1-CD1 3.45Å; F187-I191 HydrophobicContact CE2-CD1 3.64Å; F187-I191 HydrophobicContact CG-CD1 4.24Å; F187-I191 HydrophobicContact CZ-CD1 3.29Å; F187-I191 PolarHBondContact O-N 3.44Å |
| 188 | W | 93.9 | Very high | 91 | Very high | 173 Ų | 173 | 113.2 Ų | 113.2 | 66% | 0.655 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -63.4 | -44.8 | 175.9 | -172.1 | 76.2 | 0 | 0 | 0 | 112 | V184 I185 L190 I191 A192 | V184-W188 WeakPolarHBondContact O-CB 3.19Å; V184-W188 PolarHBondContact O-N 3.14Å; I185-W188 PolarHBondContact O-N 2.97Å; W188-L190 PolarHBondContact O-N 3.21Å; W188-I191 PolarHBondContact O-N 2.85Å; W188-A192 WeakPolarHBondContact O-CB 3.46Å; W188-A192 PolarHBondContact O-N 3.08Å; W188-A192 VanDerWaalsContact O-N 3.07Å |
| 189 | L | 90.4 | Very high | 90.9 | Very high | 97 Ų | 97 | 110.3 Ų | 110.3 | 51% | 0.508 | 58% | 0.581 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -70.2 | -9.4 | 175.3 | -70.1 | 173.7 | 0 | 0 | 0 | 114.7 | I185 M186 | I185-L189 HydrophobicContact CG2-CD1 3.98Å; I185-L189 WeakPolarHBondContact O-CB 3.43Å; I185-L189 WeakPolarHBondContact O-CG 2.95Å; I185-L189 PolarHBondContact O-N 3.16Å; M186-L189 HydrophobicContact CE-CD1 3.75Å |
| 190 | L | 87.6 | Confident | 91 | Very high | 143 Ų | 143 | 110.2 Ų | 110.2 | 75% | 0.749 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.8 | -9.8 | 174.1 | -103.8 | 164.9 | 0 | 0 | 0 | 113.2 | M186 F187 W188 | M186-L190 WeakPolarHBondContact O-CB 2.94Å; M186-L190 PolarHBondContact O-N 3.05Å; M186-L190 VanDerWaalsContact O-N 3.14Å; F187-L190 PolarHBondContact O-N 3.23Å; W188-L190 PolarHBondContact O-N 3.21Å |
| 191 | I | 87.3 | Confident | 90.8 | Very high | 121 Ų | 121 | 108.2 Ų | 108.2 | 62% | 0.621 | 58% | 0.58 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.8 | -21.4 | -174.6 | -68.9 | 173.4 | 0 | 0 | 0 | 111.8 | F187 W188 | F187-I191 HydrophobicContact CD1-CD1 3.93Å; F187-I191 HydrophobicContact CD2-CD1 4.1Å; F187-I191 HydrophobicContact CE1-CD1 3.45Å; F187-I191 VanDerWaalsContact CE1-CD1 3.45Å; F187-I191 HydrophobicContact CE2-CD1 3.64Å; F187-I191 HydrophobicContact CG-CD1 4.24Å; F187-I191 HydrophobicContact CZ-CD1 3.29Å; F187-I191 PolarHBondContact O-N 3.44Å; W188-I191 PolarHBondContact O-N 2.85Å |
| 192 | A | 74.4 | Confident | 90.5 | Very high | 120 Ų | 120 | 111.8 Ų | 111.8 | 99% | 0.992 | 60% | 0.595 | S | S | * | * | trans | -86.2 | 0 | 170.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | W188 | W188-A192 WeakPolarHBondContact O-CB 3.46Å; W188-A192 PolarHBondContact O-N 3.08Å; W188-A192 VanDerWaalsContact O-N 3.07Å |
Retrieved 192 of 192 residues in 438.5 ms
(Link to these results)