| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 41.2 | Very low | 39.9 | Very low | 249 Ų | 249 | 148.1 Ų | 148.1 | 100% | 1.227 | 86% | 0.861 | S | S | * | * | 0 | 105.8 | 0 | -57.2 | 145.9 | -163.8 | 0 | 0 | 106.6 | |||||
| 2 | S | 39.2 | Very low | 40 | Very low | 92 Ų | 92 | 149.3 Ų | 149.3 | 64% | 0.643 | 86% | 0.862 | S | S | * | * | trans | -62.1 | 155.1 | 165.4 | 41.3 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 3 | F | 38.2 | Very low | 40.6 | Very low | 186 Ų | 186 | 157.4 Ų | 157.4 | 82% | 0.816 | 87% | 0.869 | S | S | * | * | cis | -167.2 | 128.4 | 38.7 | 3.1 | -100.5 | 0 | 0 | 0 | 105.7 | ||||
| 4 | R | 41.5 | Very low | 40.4 | Very low | 252 Ų | 252 | 152.1 Ų | 152.1 | 95% | 0.951 | 87% | 0.868 | S | S | * | * | 82.2 | 108 | 93.1 | -154.9 | -179.2 | -163.5 | -174.3 | 4.8 | 115.9 | |||||
| 5 | G | 37.9 | Very low | 40.1 | Very low | 78 Ų | 78 | 147.7 Ų | 147.7 | 80% | 0.804 | 87% | 0.87 | S | S | * | * | trans | 86.7 | 120.9 | 152.3 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 6 | G | 35 | Very low | 40.1 | Very low | 86 Ų | 86 | 143.6 Ų | 143.6 | 89% | 0.887 | 87% | 0.869 | S | S | * | * | cis | 88.2 | 92.6 | 21.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 7 | G | 37.7 | Very low | 39.9 | Very low | 76 Ų | 76 | 140 Ų | 140 | 78% | 0.784 | 87% | 0.867 | S | S | * | * | trans | 159.4 | 113.5 | 164 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 8 | R | 44.2 | Very low | 39.8 | Very low | 262 Ų | 262 | 136.8 Ų | 136.8 | 99% | 0.989 | 87% | 0.866 | S | S | * | * | trans | 80.3 | 107.5 | 149 | -70.2 | -176.3 | 166.8 | -176.3 | -2.9 | 120.1 | ||||
| 9 | G | 39.1 | Very low | 39.7 | Very low | 65 Ų | 65 | 132.3 Ų | 132.3 | 67% | 0.67 | 85% | 0.849 | S | S | * | * | trans | 177.4 | 22.9 | 155.8 | 0 | 0 | 0 | 0 | 0 | 115.8 | F11 | G9-F11 PolarHBondContact O-N 2.97Š| ||
| 10 | G | 39.3 | Very low | 40 | Very low | 78 Ų | 78 | 134.7 Ų | 134.7 | 80% | 0.804 | 85% | 0.846 | S | S | * | * | trans | -85.6 | 104.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 11 | F | 45.5 | Very low | 40.4 | Very low | 205 Ų | 205 | 133.3 Ų | 133.3 | 90% | 0.899 | 83% | 0.833 | S | S | * | * | trans | -105.8 | 78.1 | 161.7 | -57.9 | -74.3 | 0 | 0 | 0 | 108.9 | G9 | G9-F11 PolarHBondContact O-N 2.97Š| ||
| 12 | N | 41.3 | Very low | 40.6 | Very low | 162 Ų | 162 | 132.1 Ų | 132.1 | 87% | 0.866 | 81% | 0.814 | S | S | * | * | trans | -91.8 | 109.2 | 157.3 | -106.2 | 2.5 | 0 | 0 | 0 | 107.6 | ||||
| 13 | R | 48.3 | Very low | 40.6 | Very low | 255 Ų | 255 | 130.5 Ų | 130.5 | 96% | 0.962 | 81% | 0.812 | S | S | * | * | trans | -163.9 | 105.5 | 151.6 | -119.3 | -172.6 | -83.5 | -162.4 | -2.1 | 109.9 | ||||
| 14 | G | 37.9 | Very low | 40.6 | Very low | 83 Ų | 83 | 124.3 Ų | 124.3 | 86% | 0.856 | 80% | 0.801 | S | S | * | * | trans | 169.3 | 40.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 15 | G | 35.3 | Very low | 40.8 | Very low | 86 Ų | 86 | 117.4 Ų | 117.4 | 89% | 0.887 | 79% | 0.791 | S | S | * | * | trans | -86.4 | 134.4 | 165 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 16 | G | 39.4 | Very low | 41.1 | Very low | 83 Ų | 83 | 117.9 Ų | 117.9 | 86% | 0.856 | 78% | 0.782 | S | S | * | * | trans | 153 | 111.1 | 171.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 17 | G | 36.9 | Very low | 41.7 | Very low | 82 Ų | 82 | 120.5 Ų | 120.5 | 85% | 0.845 | 78% | 0.776 | S | S | * | * | cis | 133 | 118.3 | 16.4 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 18 | G | 37.9 | Very low | 41.7 | Very low | 82 Ų | 82 | 124 Ų | 124 | 85% | 0.845 | 77% | 0.771 | S | S | * | * | trans | 92.6 | 132.3 | 167.2 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 19 | G | 38.5 | Very low | 41.5 | Very low | 52 Ų | 52 | 120.1 Ų | 120.1 | 54% | 0.536 | 76% | 0.762 | S | S | . | * | cis | 143.1 | 112 | 9.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 20 | F | 45.1 | Very low | 42 | Very low | 179 Ų | 179 | 128.8 Ų | 128.8 | 79% | 0.785 | 77% | 0.774 | S | S | * | * | trans | 52.3 | 126 | 140 | 41.5 | -95 | 0 | 0 | 0 | 123.2 | ||||
| 21 | N | 48.2 | Very low | 42 | Very low | 107 Ų | 107 | 129.1 Ų | 129.1 | 57% | 0.572 | 78% | 0.778 | S | S | * | * | 156.1 | 111.5 | 118.5 | -78.9 | -31.4 | 0 | 0 | 0 | 113.1 | |||||
| 22 | R | 45.3 | Very low | 41.9 | Very low | 224 Ų | 224 | 123.6 Ų | 123.6 | 85% | 0.845 | 78% | 0.779 | S | S | * | * | 66.7 | 127.4 | 83 | -89.4 | -163.9 | -84.9 | -164.9 | -5.6 | 117 | R197 | R22-R197 PolarHBondContact O-NH2 3.3Š| |||
| 23 | G | 40.6 | Very low | 42 | Very low | 58 Ų | 58 | 119.6 Ų | 119.6 | 60% | 0.598 | 78% | 0.776 | S | S | * | * | trans | 102.3 | 128.7 | 163.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 24 | G | 38.9 | Very low | 41.9 | Very low | 56 Ų | 56 | 111.4 Ų | 111.4 | 58% | 0.577 | 77% | 0.771 | S | S | * | * | cis | 159.8 | 142.8 | 0.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 25 | S | 45 | Very low | 42 | Very low | 106 Ų | 106 | 111.7 Ų | 111.7 | 74% | 0.741 | 77% | 0.774 | S | S | * | * | trans | 64.2 | 107.5 | 154.7 | -154.2 | 0 | 0 | 0 | 0 | 123.9 | ||||
| 26 | S | 43.9 | Very low | 42.5 | Very low | 89 Ų | 89 | 111.3 Ų | 111.3 | 62% | 0.622 | 77% | 0.77 | S | S | * | * | -11 | 139.3 | 129.6 | 39.7 | 0 | 0 | 0 | 0 | 120.5 | |||||
| 27 | N | 47.7 | Very low | 42.9 | Very low | 141 Ų | 141 | 111.2 Ų | 111.2 | 75% | 0.754 | 77% | 0.769 | S | S | * | * | 164 | 114.3 | 128.7 | -82.2 | 11.8 | 0 | 0 | 0 | 109.2 | |||||
| 28 | H | 37.6 | Very low | 43.1 | Very low | 148 Ų | 148 | 111.4 Ų | 111.4 | 69% | 0.685 | 77% | 0.771 | S | S | * | * | 71.6 | 99.6 | 84.2 | -81.2 | 50.7 | 0 | 0 | 0 | 115.8 | |||||
| 29 | F | 40.2 | Very low | 43.2 | Very low | 181 Ų | 181 | 109.5 Ų | 109.5 | 79% | 0.794 | 75% | 0.752 | S | S | * | * | trans | 84.6 | 145.5 | 142.6 | -60.5 | -65.3 | 0 | 0 | 0 | 122.6 | ||||
| 30 | R | 48.9 | Very low | 43.7 | Very low | 247 Ų | 247 | 114.5 Ų | 114.5 | 93% | 0.932 | 77% | 0.766 | S | S | * | * | trans | 86.7 | 101.9 | 173.9 | -60.8 | -179.1 | 178.9 | -177.7 | -0.3 | 113.9 | ||||
| 31 | G | 39.4 | Very low | 43.9 | Very low | 86 Ų | 86 | 115.8 Ų | 115.8 | 89% | 0.887 | 77% | 0.771 | S | S | * | * | cis | 87.4 | 105.6 | 42.8 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 32 | G | 43 | Very low | 44.3 | Very low | 88 Ų | 88 | 122.5 Ų | 122.5 | 91% | 0.907 | 79% | 0.789 | S | S | * | * | trans | 157.9 | 95 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 33 | G | 44.9 | Very low | 44.2 | Very low | 79 Ų | 79 | 114.9 Ų | 114.9 | 81% | 0.814 | 78% | 0.78 | S | S | * | * | trans | 150.4 | 83.5 | 171.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 34 | G | 45.4 | Very low | 44.3 | Very low | 82 Ų | 82 | 116.1 Ų | 116.1 | 85% | 0.845 | 79% | 0.793 | S | S | * | * | trans | -60.7 | 146.7 | -163.2 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 35 | G | 40 | Very low | 44.5 | Very low | 89 Ų | 89 | 116.9 Ų | 116.9 | 92% | 0.918 | 80% | 0.801 | S | S | * | * | trans | -76.3 | 139.4 | 150.5 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 36 | G | 46.8 | Very low | 44.9 | Very low | 78 Ų | 78 | 124.2 Ų | 124.2 | 80% | 0.804 | 81% | 0.812 | S | S | * | * | trans | 179 | 105.1 | 171.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 37 | G | 46.4 | Very low | 45.1 | Very low | 81 Ų | 81 | 123.1 Ų | 123.1 | 84% | 0.835 | 81% | 0.814 | S | S | * | * | trans | 84 | 106.2 | 166.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 38 | G | 41.5 | Very low | 45.1 | Very low | 87 Ų | 87 | 119.9 Ų | 119.9 | 90% | 0.897 | 82% | 0.815 | S | S | * | * | cis | 80.8 | 95.7 | 46.6 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 39 | G | 40.5 | Very low | 46 | Very low | 42 Ų | 42 | 121.6 Ų | 121.6 | 43% | 0.433 | 82% | 0.82 | S | S | . | * | trans | 154.1 | 85.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 116.1 | F41 | G39-F41 PolarHBondContact O-N 3.18Š| ||
| 40 | N | 48.5 | Very low | 46.4 | Very low | 156 Ų | 156 | 117 Ų | 117 | 83% | 0.834 | 82% | 0.824 | S | S | * | * | trans | 52.1 | 47.5 | 132.3 | -57.2 | 78.3 | 0 | 0 | 0 | 120.7 | R42 | N40-R42 PolarHBondContact O-N 3.39Š| ||
| 41 | F | 48.6 | Very low | 46.8 | Very low | 206 Ų | 206 | 116 Ų | 116 | 90% | 0.904 | 82% | 0.82 | S | S | * | * | trans | -76.8 | 59.9 | 158.3 | -60.5 | -75.7 | 0 | 0 | 0 | 111.8 | G39 | G39-F41 PolarHBondContact O-N 3.18Š| ||
| 42 | R | 57 | Low | 47.1 | Very low | 248 Ų | 248 | 115.7 Ų | 115.7 | 94% | 0.936 | 82% | 0.817 | S | S | * | * | trans | -95.3 | 55.3 | 156.2 | -75.8 | -168.5 | -173.4 | -175.8 | 3.6 | 108.7 | N40 | N40-R42 PolarHBondContact O-N 3.39Š| ||
| 43 | G | 43.8 | Very low | 47.3 | Very low | 64 Ų | 64 | 115 Ų | 115 | 66% | 0.66 | 81% | 0.809 | S | S | * | * | trans | -153.9 | 106.6 | -178.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 44 | G | 41.6 | Very low | 47.7 | Very low | 85 Ų | 85 | 114.6 Ų | 114.6 | 88% | 0.876 | 81% | 0.806 | S | S | * | * | trans | 105.1 | 93.4 | 155.2 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 45 | G | 44.3 | Very low | 48.3 | Very low | 71 Ų | 71 | 123 Ų | 123 | 73% | 0.732 | 81% | 0.812 | S | S | * | * | 125.8 | 111.6 | 124 | 0 | 0 | 0 | 0 | 0 | 117 | |||||
| 46 | R | 53.2 | Low | 48.7 | Very low | 261 Ų | 261 | 120.9 Ų | 120.9 | 99% | 0.985 | 79% | 0.79 | S | S | * | * | trans | 87.2 | 107.2 | 144.9 | -61.2 | 173.8 | 176 | 172.3 | -1.3 | 117.3 | ||||
| 47 | G | 48.3 | Very low | 48.9 | Very low | 65 Ų | 65 | 121.2 Ų | 121.2 | 67% | 0.67 | 79% | 0.793 | S | S | * | * | trans | 150.2 | 69.3 | 150.8 | 0 | 0 | 0 | 0 | 0 | 113 | F49 | G47-F49 PolarHBondContact O-N 3.16Š| ||
| 48 | G | 46.7 | Very low | 49.4 | Very low | 74 Ų | 74 | 126.1 Ų | 126.1 | 76% | 0.763 | 79% | 0.792 | S | S | * | * | trans | -58.3 | 100.6 | 169.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 49 | F | 57.7 | Low | 50 | Low | 183 Ų | 183 | 127 Ų | 127 | 80% | 0.803 | 78% | 0.776 | S | S | * | * | trans | -127 | 62.2 | 149.8 | -68.7 | -80.3 | 0 | 0 | 0 | 108 | G47 R51 | G47-F49 PolarHBondContact O-N 3.16Å; F49-R51 PolarHBondContact O-N 3.28Å | ||
| 50 | G | 48.4 | Very low | 50.7 | Low | 84 Ų | 84 | 135.5 Ų | 135.5 | 87% | 0.866 | 80% | 0.801 | S | S | * | * | trans | -64.8 | 51 | 150.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | G52 | G50-G52 PolarHBondContact O-N 3.19Š| ||
| 51 | R | 56.7 | Low | 50.7 | Low | 227 Ų | 227 | 130.8 Ų | 130.8 | 86% | 0.857 | 79% | 0.789 | S | S | * | * | trans | -79.1 | 71 | 157.8 | -92.8 | -167.4 | -179.4 | -150.6 | 1.1 | 107.4 | F49 G53 | F49-R51 PolarHBondContact O-N 3.28Å; R51-G53 PolarHBondContact O-N 3.47Å | ||
| 52 | G | 46.9 | Very low | 51 | Low | 79 Ų | 79 | 127.1 Ų | 127.1 | 81% | 0.814 | 78% | 0.775 | S | S | * | * | trans | -52.9 | 123.5 | 143.7 | 0 | 0 | 0 | 0 | 0 | 107.1 | G50 | G50-G52 PolarHBondContact O-N 3.19Š| ||
| 53 | G | 46.2 | Very low | 50.6 | Low | 73 Ų | 73 | 122.8 Ų | 122.8 | 75% | 0.753 | 77% | 0.77 | S | S | * | * | trans | 169.7 | 77.7 | -175.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | R51 | R51-G53 PolarHBondContact O-N 3.47Š| ||
| 54 | G | 53 | Low | 51.1 | Low | 71 Ų | 71 | 127.3 Ų | 127.3 | 73% | 0.732 | 78% | 0.775 | S | S | * | * | trans | 71.2 | 74.7 | 144.5 | 0 | 0 | 0 | 0 | 0 | 116.9 | G56 | G54-G56 VanDerWaalsContact C-N 3.25Š| ||
| 55 | R | 59.2 | Low | 51.5 | Low | 259 Ų | 259 | 125.5 Ų | 125.5 | 98% | 0.977 | 76% | 0.755 | S | S | * | * | -103.4 | 63 | 128.2 | -76.7 | -177.3 | -177.3 | 169.6 | 1.5 | 107.6 | G57 | R55-G57 PolarHBondContact O-N 2.9Š| |||
| 56 | G | 47.7 | Very low | 52.1 | Low | 45 Ų | 45 | 126.3 Ų | 126.3 | 46% | 0.464 | 75% | 0.748 | S | S | . | * | trans | -53.8 | 123.1 | 165.3 | 0 | 0 | 0 | 0 | 0 | 108.2 | G54 F58 | G54-G56 VanDerWaalsContact C-N 3.25Å; G56-F58 VanDerWaalsContact O-CD2 3.26Å; G56-F58 WeakPolarHBondContact O-CD2 3.26Å; G56-F58 PolarHBondContact O-N 2.92Å | ||
| 57 | G | 51.6 | Low | 52.4 | Low | 84 Ų | 84 | 114.5 Ų | 114.5 | 87% | 0.866 | 71% | 0.705 | S | S | * | * | 42.2 | 6 | 112.1 | 0 | 0 | 0 | 0 | 0 | 121.4 | R55 N59 | R55-G57 PolarHBondContact O-N 2.9Å; G57-N59 PolarHBondContact O-N 2.86Å | |||
| 58 | F | 56 | Low | 53.3 | Low | 185 Ų | 185 | 120.3 Ų | 120.3 | 81% | 0.811 | 72% | 0.715 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.3 | 105.5 | -176.2 | -74.3 | -77.5 | 0 | 0 | 0 | 110.2 | G56 | G56-F58 VanDerWaalsContact O-CD2 3.26Å; G56-F58 WeakPolarHBondContact O-CD2 3.26Å; G56-F58 PolarHBondContact O-N 2.92Å |
| 59 | N | 54.4 | Low | 54.7 | Low | 106 Ų | 106 | 125.4 Ų | 125.4 | 57% | 0.567 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 109.6 | 36 | 149.8 | -53 | 20.4 | 0 | 0 | 0 | 117.2 | G57 Q62 | G57-N59 PolarHBondContact O-N 2.86Å; N59-Q62 VanDerWaalsContact CG-NE2 3.34Å; N59-Q62 PolarHBondContact ND2-NE2 3Å; N59-Q62 VanDerWaalsContact ND2-NE2 3.15Å; N59-Q62 PolarHBondContact OD1-NE2 3.24Å |
| 60 | K | 54.6 | Low | 56 | Low | 220 Ų | 220 | 118 Ų | 118 | 96% | 0.957 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -103.2 | 6.8 | 163.3 | -109.7 | -178.7 | -177.6 | -177.1 | 0 | 115.3 | ||
| 61 | G | 49.3 | Very low | 58 | Low | 57 Ų | 57 | 114.7 Ų | 114.7 | 59% | 0.588 | 64% | 0.643 | S | S | * | * | trans | -163 | 40.3 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | D63 | G61-D63 PolarHBondContact O-N 3.45Š| ||
| 62 | Q | 54.1 | Low | 59.6 | Low | 128 Ų | 128 | 106.3 Ų | 106.3 | 60% | 0.598 | 62% | 0.615 | S | S | * | * | trans | -67.9 | 91.9 | 157 | -70.3 | -174.5 | 24.6 | 0 | 0 | 104.6 | N59 Q64 | N59-Q62 VanDerWaalsContact CG-NE2 3.34Å; N59-Q62 PolarHBondContact ND2-NE2 3Å; N59-Q62 VanDerWaalsContact ND2-NE2 3.15Å; N59-Q62 PolarHBondContact OD1-NE2 3.24Å; Q62-Q64 PolarHBondContact O-N 2.84Å | ||
| 63 | D | 50 | Low | 61.7 | Low | 157 Ų | 157 | 102.5 Ų | 102.5 | 84% | 0.84 | 58% | 0.577 | S | S | * | * | trans | -43.8 | 94.1 | 151 | -64.8 | -46.1 | 0 | 0 | 0 | 105 | G61 G65 | G61-D63 PolarHBondContact O-N 3.45Å; D63-G65 PolarHBondContact O-N 3.39Å | ||
| 64 | Q | 52.4 | Low | 63.8 | Low | 160 Ų | 160 | 99 Ų | 99 | 75% | 0.748 | 54% | 0.541 | S | S | * | . | trans | -66 | 94.6 | 177.6 | -73 | -117.8 | 13.9 | 0 | 0 | 103.7 | Q62 | Q62-Q64 PolarHBondContact O-N 2.84Š| ||
| 65 | G | 51.1 | Low | 65.7 | Low | 46 Ų | 46 | 98 Ų | 98 | 47% | 0.474 | 52% | 0.516 | S | S | . | . | trans | -48.3 | 161.8 | 163 | 0 | 0 | 0 | 0 | 0 | 109.4 | D63 | D63-G65 PolarHBondContact O-N 3.39Š| ||
| 66 | P | 57.4 | Low | 67.2 | Low | 89 Ų | 89 | 86.3 Ų | 86.3 | 58% | 0.578 | 47% | 0.473 | S | S | * | . | S | Bend | trans | -45.4 | 134 | -174 | -25 | 31.3 | 0 | 0 | 0 | 110.6 | E68 K107 | P66-E68 PolarHBondContact O-N 3.26Å; P66-K107 HydrophobicContact CB-CB 4.12Å; P66-K107 HydrophobicContact CB-CD 4.19Å |
| 67 | P | 59.1 | Low | 69.3 | Low | 12 Ų | 12 | 87.7 Ų | 87.7 | 8% | 0.078 | 47% | 0.469 | C | S | . | . | trans | -44.7 | 135.4 | -170.6 | -28.1 | 30.9 | 0 | 0 | 0 | 112.4 | R69 V70 Y103 K107 D147 | P67-R69 PolarHBondContact O-N 3.34Å; P67-R69 VanDerWaalsContact O-N 3.12Å; P67-V70 HydrophobicContact CB-CG1 3.97Å; P67-V70 HydrophobicContact CG-CG1 4.2Å; P67-Y103 HydrophobicContact CG-CE2 3.9Å; P67-K107 PolarHBondContact O-NZ 3.02Å; P67-D147 HydrophobicContact CB-CB 4.3Å; P67-D147 HydrophobicContact CG-CB 4.04Å | ||
| 68 | E | 66 | Low | 71.2 | Confident | 188 Ų | 188 | 88.7 Ų | 88.7 | 88% | 0.879 | 45% | 0.451 | S | S | * | . | S | Bend | trans | -52.4 | -38.4 | 179.2 | -169.5 | 177.9 | -173.1 | 0 | 0 | 110.3 | P66 K107 | P66-E68 PolarHBondContact O-N 3.26Å; E68-K107 PolarHBondContact O-NZ 3.1Å |
| 69 | R | 77.3 | Confident | 72.8 | Confident | 181 Ų | 181 | 82.5 Ų | 82.5 | 68% | 0.683 | 43% | 0.429 | S | S | * | . | trans | -136.3 | 135.6 | 173.9 | -174.7 | 174.5 | 178.4 | 179.3 | -1.3 | 110.4 | P67 P148 | P67-R69 PolarHBondContact O-N 3.34Å; P67-R69 VanDerWaalsContact O-N 3.12Å; R69-P148 WeakPolarHBondContact O-CD 3.38Å | ||
| 70 | V | 85.2 | Confident | 74.4 | Confident | 28 Ų | 28 | 79.9 Ų | 79.9 | 17% | 0.17 | 42% | 0.419 | C | S | . | . | trans | -110.7 | 144.9 | 167.6 | -60.8 | 0 | 0 | 0 | 0 | 108.8 | P67 Y103 Y145 I146 | P67-V70 HydrophobicContact CB-CG1 3.97Å; P67-V70 HydrophobicContact CG-CG1 4.2Å; V70-Y103 HydrophobicContact CG1-CD2 4.45Å; V70-Y145 HydrophobicContact CB-CD1 4.49Å; V70-Y145 HydrophobicContact CB-CG 4.5Å; V70-Y145 HydrophobicContact CG2-CD1 3.84Å; V70-Y145 HydrophobicContact CG2-CG 3.96Å; V70-I146 CarbonylContact C-O 3.52Å; V70-I146 WeakPolarHBondContact CA-O 3.4Å | ||
| 71 | V | 89.7 | Confident | 75.9 | Confident | 13 Ų | 13 | 78 Ų | 78 | 8% | 0.079 | 41% | 0.414 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.2 | 152.1 | 177.8 | -64.2 | 0 | 0 | 0 | 0 | 110 | L73 Y145 I146 P148 L151 | V71-L73 PolarHBondContact O-N 3.45Å; V71-Y145 CarbonylContact O-C 3.55Å; V71-Y145 WeakPolarHBondContact O-CA 3.35Å; V71-I146 HydrophobicContact CG2-CG2 3.78Å; V71-I146 WeakPolarHBondContact CG2-O 3.42Å; V71-I146 PolarHBondContact N-O 3.03Å; V71-I146 PolarHBondContact O-N 2.85Å; V71-P148 HydrophobicContact CG1-CB 4.03Å; V71-P148 HydrophobicContact CG1-CG 4.3Å; V71-P148 HydrophobicContact CG2-CB 4.13Å; V71-L151 HydrophobicContact CG2-CD1 3.74Å |
| 72 | L | 90.4 | Very high | 77.7 | Confident | 51 Ų | 51 | 81.4 Ų | 81.4 | 27% | 0.267 | 42% | 0.418 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -65.4 | 121.3 | 179.4 | -172.5 | 153.3 | 0 | 0 | 0 | 109.5 | T89 T90 K143 Y145 | L72-T89 WeakPolarHBondContact CD2-OG1 3.33Å; L72-T90 WeakPolarHBondContact O-CG2 3.43Å; L72-T90 PolarHBondContact O-OG1 3.07Å; L72-K143 HydrophobicContact CD1-CD 3.88Å; L72-K143 HydrophobicContact CD1-CG 4.36Å; L72-Y145 HydrophobicContact CB-CE1 4.45Å |
| 73 | L | 90.3 | Very high | 79.5 | Confident | 0 Ų | 0 | 77.3 Ų | 77.3 | 0% | 0 | 40% | 0.4 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.2 | -43.3 | 178.3 | 179.2 | 64.3 | 0 | 0 | 0 | 111.6 | V71 C88 T89 T90 P96 V102 V113 F125 F144 I146 L151 | V71-L73 PolarHBondContact O-N 3.45Å; L73-C88 PolarHBondContact O-SG 3.28Å; L73-T89 PolarHBondContact O-N 3.17Å; L73-T90 VanDerWaalsContact CA-OG1 3.31Å; L73-T90 WeakPolarHBondContact CA-OG1 3.48Å; L73-T90 PolarHBondContact O-OG1 2.72Å; L73-P96 HydrophobicContact CD1-CB 4.01Å; L73-P96 HydrophobicContact CD1-CG 3.87Å; L73-V102 HydrophobicContact CD2-CG2 4.21Å; L73-V113 HydrophobicContact CD2-CG2 4.34Å; L73-F125 HydrophobicContact CB-CZ 4.38Å; L73-F125 HydrophobicContact CD1-CE1 4.38Å; L73-F125 HydrophobicContact CD1-CZ 4.48Å; L73-F125 HydrophobicContact CD2-CD2 4.19Å; L73-F125 HydrophobicContact CD2-CE1 4.1Å; L73-F125 HydrophobicContact CD2-CE2 3.47Å; L73-F125 VanDerWaalsContact CD2-CE2 3.47Å; L73-F125 HydrophobicContact CD2-CZ 3.42Å; L73-F125 VanDerWaalsContact CD2-CZ 3.42Å; L73-F125 HydrophobicContact CG-CE1 3.76Å; L73-F125 HydrophobicContact CG-CE2 4.06Å; L73-F125 HydrophobicContact CG-CZ 3.45Å; L73-F125 VanDerWaalsContact CG-CZ 3.45Å; L73-F144 PolarHBondContact N-O 2.84Å; L73-I146 HydrophobicContact CB-CB 4.1Å; L73-I146 HydrophobicContact CB-CG2 3.92Å; L73-I146 HydrophobicContact CD1-CB 4.45Å; L73-I146 HydrophobicContact CD1-CD1 4.33Å; L73-I146 HydrophobicContact CD1-CG2 4.02Å; L73-I146 HydrophobicContact CD2-CB 4.18Å; L73-I146 HydrophobicContact CD2-CD1 4.23Å; L73-I146 HydrophobicContact CG-CB 4.46Å; L73-I146 HydrophobicContact CG-CG2 4.37Å; L73-L151 HydrophobicContact CD1-CD2 4.33Å |
| 74 | G | 92 | Very high | 81.5 | Confident | 0 Ų | 0 | 69.8 Ų | 69.8 | 0% | 0 | 36% | 0.36 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 172.6 | -174.7 | -174.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | K87 F144 | G74-K87 CarbonylContact C-O 3.49Å; G74-K87 WeakPolarHBondContact CA-O 3.42Å; G74-F144 PolarHBondContact N-O 2.99Å; G74-F144 PolarHBondContact O-N 3Å |
| 75 | E | 91.8 | Very high | 83.4 | Confident | 48 Ų | 48 | 63.2 Ų | 63.2 | 22% | 0.224 | 33% | 0.331 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.1 | 142.2 | -175.3 | -66.3 | 179 | -178.6 | 0 | 0 | 111.3 | L77 C86 K87 T89 L141 Q142 K143 | E75-L77 PolarHBondContact O-N 3.15Å; E75-C86 CarbonylContact O-C 3.53Å; E75-C86 WeakPolarHBondContact O-CA 3.42Å; E75-C86 WeakPolarHBondContact O-CB 3.22Å; E75-K87 PolarHBondContact N-O 3.1Å; E75-K87 PolarHBondContact O-N 3.33Å; E75-T89 HydrophobicContact CG-CG2 4.41Å; E75-L141 WeakPolarHBondContact OE2-CD2 3.49Å; E75-Q142 CarbonylContact C-O 3.52Å; E75-Q142 WeakPolarHBondContact CA-O 3.41Å; E75-K143 HydrophobicContact CG-CG 4.19Å |
| 76 | F | 91.8 | Very high | 85.4 | Confident | 14 Ų | 14 | 61 Ų | 61 | 6% | 0.061 | 31% | 0.309 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -59.1 | 127.2 | 174.4 | -178.7 | -109.7 | 0 | 0 | 0 | 111.7 | P79 I84 F138 K139 L141 Q142 F144 | F76-P79 HydrophobicContact CE2-CB 4.41Å; F76-P79 HydrophobicContact CZ-CB 3.85Å; F76-P79 HydrophobicContact CZ-CG 4.07Å; F76-I84 HydrophobicContact CD2-CB 3.93Å; F76-I84 HydrophobicContact CD2-CD1 4.26Å; F76-I84 HydrophobicContact CD2-CG2 4.14Å; F76-I84 HydrophobicContact CE2-CB 3.71Å; F76-I84 HydrophobicContact CE2-CG2 3.57Å; F76-F138 HydrophobicContact CD1-CB 4.22Å; F76-F138 HydrophobicContact CD2-CB 4.09Å; F76-F138 HydrophobicContact CE1-CB 4.3Å; F76-F138 HydrophobicContact CE2-CB 4.18Å; F76-F138 HydrophobicContact CG-CB 4.11Å; F76-F138 HydrophobicContact CZ-CB 4.26Å; F76-K139 VanDerWaalsContact CD1-O 3.28Å; F76-K139 WeakPolarHBondContact CD1-O 3.38Å; F76-L141 PolarHBondContact O-N 3.49Å; F76-Q142 HydrophobicContact CB-CB 4.16Å; F76-Q142 PolarHBondContact N-O 3.46Å; F76-F144 HydrophobicContact CB-CE2 3.64Å; F76-F144 HydrophobicContact CB-CZ 4.2Å; F76-F144 HydrophobicContact CD2-CE2 4.27Å; F76-F144 HydrophobicContact CD2-CZ 4.5Å; F76-F144 HydrophobicContact CG-CE2 4.41Å |
| 77 | L | 91.2 | Very high | 87.1 | Confident | 75 Ų | 75 | 60.6 Ų | 60.6 | 39% | 0.393 | 30% | 0.298 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.5 | -51.5 | -178.4 | -171.2 | 153.5 | 0 | 0 | 0 | 112.3 | E75 V85 K87 Y124 | E75-L77 PolarHBondContact O-N 3.15Å; L77-V85 WeakPolarHBondContact CA-O 3.15Å; L77-V85 WeakPolarHBondContact CB-O 3.16Å; L77-V85 PolarHBondContact N-O 3.03Å; L77-K87 HydrophobicContact CD1-CB 4.02Å; L77-Y124 HydrophobicContact CD1-CD1 4.06Å; L77-Y124 HydrophobicContact CD1-CE1 3.57Å |
| 78 | H | 90.6 | Very high | 88.4 | Confident | 105 Ų | 105 | 60.4 Ų | 60.4 | 49% | 0.486 | 30% | 0.296 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -143.2 | 134.8 | -176.1 | -162.9 | 64.5 | 0 | 0 | 0 | 112.4 | V85 | H78-V85 HydrophobicContact CB-CB 4.24Å; H78-V85 PolarHBondContact N-O 2.75Å; H78-V85 VanDerWaalsContact N-O 3.09Å; H78-V85 PolarHBondContact O-N 3.45Å |
| 79 | P | 90.9 | Very high | 89.3 | Confident | 54 Ų | 54 | 53.9 Ų | 53.9 | 35% | 0.351 | 27% | 0.269 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.7 | 134.8 | 167.4 | 29.7 | -28.3 | 0 | 0 | 0 | 110.9 | F76 A135 | F76-P79 HydrophobicContact CE2-CB 4.41Å; F76-P79 HydrophobicContact CZ-CB 3.85Å; F76-P79 HydrophobicContact CZ-CG 4.07Å; P79-A135 HydrophobicContact CB-CB 3.81Å |
| 80 | C | 88 | Confident | 89.2 | Confident | 51 Ų | 51 | 46.5 Ų | 46.5 | 35% | 0.345 | 24% | 0.244 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -129.6 | 75.7 | -179.6 | -68.1 | 0 | 0 | 0 | 0 | 110.8 | D82 D83 | C80-D82 PolarHBondContact O-N 3.24Å; C80-D83 CarbonylContact C-O 3.57Å; C80-D83 WeakPolarHBondContact CA-O 3.09Å; C80-D83 HydrophobicContact CB-CB 4.33Å; C80-D83 PolarHBondContact N-O 3.25Å; C80-D83 PolarHBondContact O-N 2.72Å |
| 81 | E | 85.5 | Confident | 88.6 | Confident | 182 Ų | 182 | 53 Ų | 53 | 85% | 0.85 | 28% | 0.278 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.6 | -96.3 | -178.8 | -60.7 | -179.3 | 175.1 | 0 | 0 | 112.9 | A135 | E81-A135 WeakPolarHBondContact O-CB 3.5Š|
| 82 | D | 87.2 | Confident | 87.6 | Confident | 127 Ų | 127 | 55.8 Ų | 55.8 | 68% | 0.679 | 29% | 0.291 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.9 | -13.3 | 179.1 | -64.6 | -31.8 | 0 | 0 | 0 | 113.7 | C80 L129 | C80-D82 PolarHBondContact O-N 3.24Å; D82-L129 WeakPolarHBondContact O-CB 3.43Å; D82-L129 PolarHBondContact O-N 2.9Å |
| 83 | D | 91.1 | Very high | 86.9 | Confident | 42 Ų | 42 | 59.1 Ų | 59.1 | 23% | 0.225 | 31% | 0.308 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.5 | 165.5 | -176.5 | -65.5 | -17.9 | 0 | 0 | 0 | 111.6 | C80 V127 K128 A135 | C80-D83 CarbonylContact C-O 3.57Å; C80-D83 WeakPolarHBondContact CA-O 3.09Å; C80-D83 HydrophobicContact CB-CB 4.33Å; C80-D83 PolarHBondContact N-O 3.25Å; C80-D83 PolarHBondContact O-N 2.72Å; D83-V127 WeakPolarHBondContact CA-O 3.37Å; D83-K128 VanDerWaalsContact OD1-CA 3.28Å; D83-K128 WeakPolarHBondContact OD1-CA 3.31Å; D83-A135 WeakPolarHBondContact O-CB 3.21Å |
| 84 | I | 92.4 | Very high | 86.6 | Confident | 0 Ų | 0 | 62.4 Ų | 62.4 | 0% | 0 | 32% | 0.323 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.9 | 142.4 | 169.8 | 59.9 | 171.3 | 0 | 0 | 0 | 110.5 | F76 I110 S126 V127 L129 A135 F138 F144 | F76-I84 HydrophobicContact CD2-CB 3.93Å; F76-I84 HydrophobicContact CD2-CD1 4.26Å; F76-I84 HydrophobicContact CD2-CG2 4.14Å; F76-I84 HydrophobicContact CE2-CB 3.71Å; F76-I84 HydrophobicContact CE2-CG2 3.57Å; I84-I110 HydrophobicContact CD1-CD1 4.33Å; I84-S126 CarbonylContact O-C 3.51Å; I84-S126 VanDerWaalsContact O-CA 3.26Å; I84-S126 WeakPolarHBondContact O-CA 3.2Å; I84-V127 HydrophobicContact CD1-CB 4.15Å; I84-V127 HydrophobicContact CD1-CG2 4.49Å; I84-V127 HydrophobicContact CG1-CB 3.67Å; I84-V127 HydrophobicContact CG1-CG2 4.25Å; I84-V127 PolarHBondContact N-O 2.85Å; I84-V127 PolarHBondContact O-N 3.06Å; I84-L129 HydrophobicContact CD1-CD2 4.04Å; I84-L129 HydrophobicContact CG1-CD2 4.14Å; I84-L129 HydrophobicContact CG2-CD1 3.84Å; I84-L129 HydrophobicContact CG2-CD2 4.38Å; I84-L129 HydrophobicContact CG2-CG 4.26Å; I84-A135 HydrophobicContact CG2-CB 3.72Å; I84-F138 HydrophobicContact CG2-CD2 4.07Å; I84-F138 HydrophobicContact CG2-CE2 4.44Å; I84-F144 HydrophobicContact CD1-CD2 4.46Å; I84-F144 HydrophobicContact CD1-CE1 4.05Å; I84-F144 HydrophobicContact CD1-CE2 3.57Å; I84-F144 HydrophobicContact CD1-CZ 3.32Å |
| 85 | V | 93.5 | Very high | 86.5 | Confident | 22 Ų | 22 | 62.8 Ų | 62.8 | 13% | 0.133 | 33% | 0.325 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.3 | 129.2 | 171.7 | 176.3 | 0 | 0 | 0 | 0 | 108.9 | L77 H78 F117 | L77-V85 WeakPolarHBondContact CA-O 3.15Å; L77-V85 WeakPolarHBondContact CB-O 3.16Å; L77-V85 PolarHBondContact N-O 3.03Å; H78-V85 HydrophobicContact CB-CB 4.24Å; H78-V85 PolarHBondContact N-O 2.75Å; H78-V85 VanDerWaalsContact N-O 3.09Å; H78-V85 PolarHBondContact O-N 3.45Å; V85-F117 HydrophobicContact CG1-CZ 3.83Å; V85-F117 HydrophobicContact CG2-CZ 4.42Å |
| 86 | C | 92.6 | Very high | 86.3 | Confident | 0 Ų | 0 | 60.6 Ų | 60.6 | 0% | 0 | 32% | 0.315 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.3 | 145 | 180 | -60.3 | 0 | 0 | 0 | 0 | 110.5 | E75 Y124 F125 F144 | E75-C86 CarbonylContact O-C 3.53Å; E75-C86 WeakPolarHBondContact O-CA 3.42Å; E75-C86 WeakPolarHBondContact O-CB 3.22Å; C86-Y124 VanDerWaalsContact O-CA 3.26Å; C86-Y124 WeakPolarHBondContact O-CA 3.08Å; C86-F125 HydrophobicContact CB-CD1 4.21Å; C86-F125 HydrophobicContact CB-CD2 3.97Å; C86-F125 HydrophobicContact CB-CE1 3.68Å; C86-F125 HydrophobicContact CB-CE2 3.4Å; C86-F125 VanDerWaalsContact CB-CE2 3.4Å; C86-F125 HydrophobicContact CB-CG 4.34Å; C86-F125 HydrophobicContact CB-CZ 3.23Å; C86-F125 PolarHBondContact N-O 2.9Å; C86-F125 PolarHBondContact O-N 2.84Å; C86-F144 HydrophobicContact CB-CD2 4.44Å; C86-F144 WeakPolarHBondContact SG-CD2 3.48Å; C86-F144 WeakPolarHBondContact SG-CE2 3.44Å |
| 87 | K | 91.5 | Very high | 86.3 | Confident | 80 Ų | 80 | 64.1 Ų | 64.1 | 35% | 0.348 | 33% | 0.328 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.4 | 128.2 | 169 | -174.5 | 179.2 | 178.3 | -174.6 | 0 | 108.9 | G74 E75 L77 T89 Y124 | G74-K87 CarbonylContact C-O 3.49Å; G74-K87 WeakPolarHBondContact CA-O 3.42Å; E75-K87 PolarHBondContact N-O 3.1Å; E75-K87 PolarHBondContact O-N 3.33Å; L77-K87 HydrophobicContact CD1-CB 4.02Å; K87-T89 PolarHBondContact O-N 2.74Å; K87-Y124 HydrophobicContact CB-CD1 4Å; K87-Y124 HydrophobicContact CB-CE1 3.88Å; K87-Y124 HydrophobicContact CD-CE1 4.23Å; K87-Y124 HydrophobicContact CG-CD1 4.2Å; K87-Y124 HydrophobicContact CG-CE1 3.79Å |
| 88 | C | 87.9 | Confident | 86.2 | Confident | 8 Ų | 8 | 66 Ų | 66 | 5% | 0.054 | 33% | 0.333 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -66.9 | 126.4 | 170.8 | -171.5 | 0 | 0 | 0 | 0 | 109.6 | L73 F123 F125 | L73-C88 PolarHBondContact O-SG 3.28Å; C88-F123 HydrophobicContact CB-CD1 4.4Å; C88-F123 HydrophobicContact CB-CD2 3.78Å; C88-F123 HydrophobicContact CB-CE1 4.2Å; C88-F123 HydrophobicContact CB-CE2 3.58Å; C88-F123 HydrophobicContact CB-CG 4.2Å; C88-F123 HydrophobicContact CB-CZ 3.8Å; C88-F123 WeakPolarHBondContact CB-O 3.26Å; C88-F123 PolarHBondContact N-O 3.31Å; C88-F123 WeakPolarHBondContact SG-CZ 3.26Å; C88-F125 HydrophobicContact CB-CD1 4.41Å; C88-F125 HydrophobicContact CB-CE1 4.35Å |
| 89 | T | 83.6 | Confident | 86.3 | Confident | 50 Ų | 50 | 66 Ų | 66 | 31% | 0.307 | 34% | 0.337 | S | S | . | . | trans | -124.5 | 14.6 | 174.6 | 51.3 | 0 | 0 | 0 | 0 | 111.4 | L72 L73 E75 K87 D91 | L72-T89 WeakPolarHBondContact CD2-OG1 3.33Å; L73-T89 PolarHBondContact O-N 3.17Å; E75-T89 HydrophobicContact CG-CG2 4.41Å; K87-T89 PolarHBondContact O-N 2.74Å; T89-D91 PolarHBondContact O-N 2.65Å | ||
| 90 | T | 77 | Confident | 86.3 | Confident | 26 Ų | 26 | 63.5 Ų | 63.5 | 16% | 0.16 | 32% | 0.321 | C | S | . | . | trans | -67.5 | 128.4 | 179 | -48.6 | 0 | 0 | 0 | 0 | 110.9 | L72 L73 E92 | L72-T90 WeakPolarHBondContact O-CG2 3.43Å; L72-T90 PolarHBondContact O-OG1 3.07Å; L73-T90 VanDerWaalsContact CA-OG1 3.31Å; L73-T90 WeakPolarHBondContact CA-OG1 3.48Å; L73-T90 PolarHBondContact O-OG1 2.72Å; T90-E92 HydrophobicContact CG2-CB 3.83Å; T90-E92 HydrophobicContact CG2-CG 4.08Å; T90-E92 PolarHBondContact O-N 3.35Å | ||
| 91 | D | 71.3 | Confident | 86.6 | Confident | 165 Ų | 165 | 62.2 Ų | 62.2 | 88% | 0.882 | 31% | 0.312 | S | S | * | . | S | Bend | trans | -72.3 | -16.3 | 175.2 | -61.6 | -51 | 0 | 0 | 0 | 113 | T89 | T89-D91 PolarHBondContact O-N 2.65Š|
| 92 | E | 69.5 | Low | 86.9 | Confident | 72 Ų | 72 | 53.6 Ų | 53.6 | 34% | 0.336 | 27% | 0.272 | S | S | . | . | S | Bend | trans | -79.7 | 123.2 | 176.2 | -50.1 | -171.9 | 179.5 | 0 | 0 | 108.9 | T90 K94 | T90-E92 HydrophobicContact CG2-CB 3.83Å; T90-E92 HydrophobicContact CG2-CG 4.08Å; T90-E92 PolarHBondContact O-N 3.35Å; E92-K94 HydrophobicContact CB-CD 4.23Å; E92-K94 HydrophobicContact CB-CG 4.17Å; E92-K94 PolarHBondContact O-N 2.7Å; E92-K94 WeakPolarHBondContact OE2-CD 3.19Å; E92-K94 WeakPolarHBondContact OE2-CE 3.39Å; E92-K94 IonicContact OE2-NZ 2.7Å; E92-K94 PolarHBondContact OE2-NZ 2.88Å |
| 93 | N | 75.6 | Confident | 87.2 | Confident | 120 Ų | 120 | 49 Ų | 49 | 64% | 0.642 | 25% | 0.245 | S | C | * | . | S | Bend | trans | -65.3 | 56.2 | 172.5 | -73.8 | -54.6 | 0 | 0 | 0 | 112.2 | L154 | N93-L154 WeakPolarHBondContact O-CB 3.11Å; N93-L154 PolarHBondContact O-N 2.84Å |
| 94 | K | 84.3 | Confident | 87.1 | Confident | 70 Ų | 70 | 48 Ų | 48 | 30% | 0.304 | 24% | 0.24 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -131.9 | 149.3 | -178 | -55.8 | 178.5 | -171.9 | 159.1 | 0 | 109.6 | E92 L151 L152 | E92-K94 HydrophobicContact CB-CD 4.23Å; E92-K94 HydrophobicContact CB-CG 4.17Å; E92-K94 PolarHBondContact O-N 2.7Å; E92-K94 WeakPolarHBondContact OE2-CD 3.19Å; E92-K94 WeakPolarHBondContact OE2-CE 3.39Å; E92-K94 IonicContact OE2-NZ 2.7Å; E92-K94 PolarHBondContact OE2-NZ 2.88Å; K94-L151 HydrophobicContact CB-CB 3.84Å; K94-L151 HydrophobicContact CB-CD1 4.37Å; K94-L151 HydrophobicContact CD-CB 3.75Å; K94-L151 HydrophobicContact CD-CD1 4.12Å; K94-L151 HydrophobicContact CG-CB 4.44Å; K94-L152 CarbonylContact C-O 3.41Å; K94-L152 WeakPolarHBondContact CA-O 3.43Å; K94-L152 WeakPolarHBondContact CB-O 3.4Å |
| 95 | V | 88.4 | Confident | 86.9 | Confident | 8 Ų | 8 | 55.4 Ų | 55.4 | 5% | 0.048 | 27% | 0.274 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.1 | 133.7 | -176.2 | -179.4 | 0 | 0 | 0 | 0 | 107.5 | I116 F123 L152 L154 F157 | V95-I116 HydrophobicContact CG1-CD1 3.6Å; V95-I116 HydrophobicContact CG1-CG2 4.15Å; V95-F123 HydrophobicContact CB-CZ 4.36Å; V95-F123 HydrophobicContact CG1-CZ 4.32Å; V95-F123 HydrophobicContact CG2-CE1 3.93Å; V95-F123 HydrophobicContact CG2-CZ 4.25Å; V95-L152 PolarHBondContact N-O 2.87Å; V95-L152 WeakPolarHBondContact O-CA 3.42Å; V95-L152 WeakPolarHBondContact O-CB 3.28Å; V95-L152 PolarHBondContact O-N 3.35Å; V95-L154 HydrophobicContact CG2-CD1 3.83Å; V95-F157 HydrophobicContact CB-CD2 4.41Å; V95-F157 HydrophobicContact CB-CE2 3.7Å; V95-F157 HydrophobicContact CB-CZ 4.34Å; V95-F157 HydrophobicContact CG1-CE2 3.88Å; V95-F157 HydrophobicContact CG1-CZ 4.03Å; V95-F157 HydrophobicContact CG2-CD2 4.08Å; V95-F157 HydrophobicContact CG2-CE2 3.87Å |
| 96 | P | 89.4 | Confident | 86.6 | Confident | 1 Ų | 1 | 58.6 Ų | 58.6 | 1% | 0.006 | 29% | 0.291 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -60.4 | 153.7 | 177.2 | 26.2 | -33.8 | 0 | 0 | 0 | 111.9 | L73 V113 I116 F123 I146 L151 | L73-P96 HydrophobicContact CD1-CB 4.01Å; L73-P96 HydrophobicContact CD1-CG 3.87Å; P96-V113 HydrophobicContact CB-CG2 4.29Å; P96-V113 HydrophobicContact CG-CG1 4.41Å; P96-I116 HydrophobicContact CG-CD1 3.67Å; P96-I116 HydrophobicContact CG-CG1 4.29Å; P96-I116 WeakPolarHBondContact O-CD1 3.47Å; P96-F123 HydrophobicContact CG-CE2 4.31Å; P96-I146 HydrophobicContact CB-CD1 3.56Å; P96-L151 HydrophobicContact CB-CD2 4.21Å |
| 97 | Y | 90 | Very high | 86.3 | Confident | 88 Ų | 88 | 62.4 Ų | 62.4 | 35% | 0.345 | 31% | 0.308 | S | S | . | . | P | Polyproline II helix | trans | -67.2 | 145.2 | 166 | -71.9 | -95.2 | 0 | 0 | 0 | 109.7 | A100 K150 L152 | Y97-A100 WeakPolarHBondContact O-CB 3.44Å; Y97-A100 PolarHBondContact O-N 3.18Å; Y97-A100 VanDerWaalsContact O-N 3.17Å; Y97-K150 VanDerWaalsContact CD2-CA 3.49Å; Y97-K150 HydrophobicContact CD2-CB 4.17Å; Y97-K150 WeakPolarHBondContact CD2-O 3.39Å; Y97-K150 PolarHBondContact N-O 2.9Å; Y97-L152 HydrophobicContact CD1-CD1 3.78Å; Y97-L152 HydrophobicContact CD1-CD2 4.17Å; Y97-L152 HydrophobicContact CD1-CG 3.89Å; Y97-L152 HydrophobicContact CD2-CG 4.14Å; Y97-L152 HydrophobicContact CE1-CD1 3.84Å; Y97-L152 HydrophobicContact CE1-CD2 3.39Å; Y97-L152 HydrophobicContact CE1-CG 3.63Å; Y97-L152 HydrophobicContact CE2-CD2 3.94Å; Y97-L152 HydrophobicContact CE2-CG 3.87Å; Y97-L152 HydrophobicContact CG-CD1 4.25Å; Y97-L152 HydrophobicContact CG-CG 4.14Å; Y97-L152 VanDerWaalsContact OH-CD2 3.22Å; Y97-L152 WeakPolarHBondContact OH-CD2 3.48Å |
| 98 | F | 90.6 | Very high | 86.2 | Confident | 114 Ų | 114 | 63.7 Ų | 63.7 | 50% | 0.5 | 32% | 0.315 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.5 | 140.2 | 160.9 | -66.2 | -74.3 | 0 | 0 | 0 | 110.1 | A100 D114 I116 | F98-A100 PolarHBondContact O-N 2.76Å; F98-D114 VanDerWaalsContact CD1-O 3.31Å; F98-D114 WeakPolarHBondContact CD1-O 3.47Å; F98-I116 HydrophobicContact CE1-CB 4.3Å; F98-I116 HydrophobicContact CE1-CD1 4.3Å; F98-I116 HydrophobicContact CE1-CG1 4.16Å; F98-I116 HydrophobicContact CZ-CD1 4.45Å |
| 99 | N | 91.4 | Very high | 86.3 | Confident | 105 Ų | 105 | 67.7 Ų | 67.7 | 56% | 0.561 | 33% | 0.333 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 61 | 20 | -175.7 | -62.1 | -74.1 | 0 | 0 | 0 | 115.2 | V113 | N99-V113 WeakPolarHBondContact CA-O 3.22Å; N99-V113 PolarHBondContact N-O 2.79Å |
| 100 | A | 92.2 | Very high | 86.6 | Confident | 2 Ų | 2 | 65.3 Ų | 65.3 | 2% | 0.017 | 32% | 0.318 | C | S | . | . | trans | -71.5 | 139.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | Y97 F98 K112 V113 I146 K150 | Y97-A100 WeakPolarHBondContact O-CB 3.44Å; Y97-A100 PolarHBondContact O-N 3.18Å; Y97-A100 VanDerWaalsContact O-N 3.17Å; F98-A100 PolarHBondContact O-N 2.76Å; A100-K112 CarbonylContact O-C 3.51Å; A100-K112 VanDerWaalsContact O-CA 3.22Å; A100-K112 WeakPolarHBondContact O-CA 3.34Å; A100-V113 HydrophobicContact CB-CG2 4.39Å; A100-V113 PolarHBondContact O-N 2.76Å; A100-I146 HydrophobicContact CB-CD1 3.83Å; A100-K150 HydrophobicContact CB-CB 4.08Å | ||
| 101 | P | 93.1 | Very high | 87.4 | Confident | 25 Ų | 25 | 64.1 Ų | 64.1 | 16% | 0.162 | 31% | 0.311 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.4 | 136.4 | 175.3 | 29 | -34.2 | 0 | 0 | 0 | 110.9 | Y103 Q109 G111 | P101-Y103 HydrophobicContact CB-CE2 3.99Å; P101-Y103 HydrophobicContact CG-CE2 3.93Å; P101-Y103 WeakPolarHBondContact CG-OH 3.32Å; P101-Q109 HydrophobicContact CB-CG 4.24Å; P101-G111 WeakPolarHBondContact CA-O 3.31Å |
| 102 | V | 93 | Very high | 88.5 | Confident | 0 Ų | 0 | 61.5 Ų | 61.5 | 0% | 0 | 29% | 0.292 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.7 | 139.3 | 175.7 | -176.4 | 0 | 0 | 0 | 0 | 109 | L73 Q109 I110 G111 V113 V127 F144 | L73-V102 HydrophobicContact CD2-CG2 4.21Å; V102-Q109 WeakPolarHBondContact O-CA 3.39Å; V102-I110 HydrophobicContact CB-CD1 4.34Å; V102-I110 HydrophobicContact CB-CG1 4.09Å; V102-I110 HydrophobicContact CG1-CD1 3.86Å; V102-I110 HydrophobicContact CG1-CG1 4.1Å; V102-I110 WeakPolarHBondContact O-CG1 3.45Å; V102-I110 PolarHBondContact O-N 2.88Å; V102-G111 PolarHBondContact N-O 2.84Å; V102-V113 HydrophobicContact CG2-CG2 3.46Å; V102-V113 VanDerWaalsContact CG2-CG2 3.46Å; V102-V127 HydrophobicContact CB-CG1 4.04Å; V102-V127 HydrophobicContact CG2-CG1 3.9Å; V102-V127 HydrophobicContact CG2-CG2 3.92Å; V102-F144 HydrophobicContact CG1-CB 3.76Å; V102-F144 HydrophobicContact CG1-CD1 4.18Å; V102-F144 HydrophobicContact CG1-CG 4.16Å |
| 103 | Y | 92.5 | Very high | 89.6 | Confident | 30 Ų | 30 | 58.1 Ų | 58.1 | 12% | 0.118 | 28% | 0.276 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.7 | 155 | -175.1 | -56.6 | -85.4 | 0 | 0 | 0 | 111.9 | P67 V70 P101 K107 E108 Q109 Y145 | P67-Y103 HydrophobicContact CG-CE2 3.9Å; V70-Y103 HydrophobicContact CG1-CD2 4.45Å; P101-Y103 HydrophobicContact CB-CE2 3.99Å; P101-Y103 HydrophobicContact CG-CE2 3.93Å; P101-Y103 WeakPolarHBondContact CG-OH 3.32Å; Y103-K107 WeakPolarHBondContact CD1-O 3.44Å; Y103-E108 CarbonylContact C-O 3.38Å; Y103-E108 VanDerWaalsContact CA-O 3.23Å; Y103-E108 WeakPolarHBondContact CA-O 3.14Å; Y103-Q109 HydrophobicContact CD1-CB 4.05Å; Y103-Q109 HydrophobicContact CE1-CB 3.92Å; Y103-Q109 HydrophobicContact CE1-CG 4.44Å; Y103-Y145 PolarHBondContact N-O 3.22Å; Y103-Y145 PolarHBondContact O-N 2.72Å |
| 104 | L | 90.1 | Very high | 90.5 | Very high | 21 Ų | 21 | 55.9 Ų | 55.9 | 11% | 0.11 | 26% | 0.264 | C | S | . | . | trans | -86.9 | 174.7 | 165.4 | -75.2 | 172 | 0 | 0 | 0 | 111.2 | N106 K107 E108 I110 F138 Q142 F144 | L104-N106 WeakPolarHBondContact CB-OD1 3.08Å; L104-N106 PolarHBondContact O-N 3.31Å; L104-K107 WeakPolarHBondContact O-CA 3.11Å; L104-K107 PolarHBondContact O-N 3.1Å; L104-E108 PolarHBondContact N-O 3.32Å; L104-I110 HydrophobicContact CD1-CG2 3.5Å; L104-I110 HydrophobicContact CD2-CG2 4.27Å; L104-I110 HydrophobicContact CG-CG2 3.47Å; L104-I110 VanDerWaalsContact CG-CG2 3.47Å; L104-F138 HydrophobicContact CD2-CE1 4.34Å; L104-Q142 HydrophobicContact CD2-CG 4.5Å; L104-F144 HydrophobicContact CD2-CD1 4.04Å; L104-F144 HydrophobicContact CD2-CE1 3.83Å | ||
| 105 | E | 86.8 | Confident | 90.9 | Very high | 156 Ų | 156 | 57.9 Ų | 57.9 | 73% | 0.729 | 27% | 0.274 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.4 | -33.7 | 176.1 | -173.2 | 175.4 | -167.4 | 0 | 0 | 112.4 | K107 Y145 | E105-K107 PolarHBondContact O-N 2.84Å; E105-Y145 HydrophobicContact CB-CD2 4.5Å; E105-Y145 HydrophobicContact CB-CE2 3.82Å; E105-Y145 HydrophobicContact CG-CE2 4.39Å |
| 106 | N | 87.5 | Confident | 91.1 | Very high | 90 Ų | 90 | 59 Ų | 59 | 48% | 0.481 | 28% | 0.28 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.3 | 5.9 | 174.1 | 66.9 | -6 | 0 | 0 | 0 | 113.8 | L104 E108 | L104-N106 WeakPolarHBondContact CB-OD1 3.08Å; L104-N106 PolarHBondContact O-N 3.31Å; N106-E108 WeakPolarHBondContact ND2-CG 3.42Å; N106-E108 PolarHBondContact ND2-OE1 2.95Å; N106-E108 PolarHBondContact ND2-OE2 2.83Å; N106-E108 PolarHBondContact O-N 3.02Å; N106-E108 WeakPolarHBondContact OD1-CB 3.49Å; N106-E108 PolarHBondContact OD1-N 2.9Å |
| 107 | K | 85.9 | Confident | 91.1 | Very high | 80 Ų | 80 | 63 Ų | 63 | 35% | 0.348 | 30% | 0.297 | S | S | . | . | trans | 62.2 | 17 | -175.3 | -51.2 | -176.3 | 176.6 | -164.7 | 0 | 114.8 | P66 P67 E68 Y103 L104 E105 | P66-K107 HydrophobicContact CB-CB 4.12Å; P66-K107 HydrophobicContact CB-CD 4.19Å; P67-K107 PolarHBondContact O-NZ 3.02Å; E68-K107 PolarHBondContact O-NZ 3.1Å; Y103-K107 WeakPolarHBondContact CD1-O 3.44Å; L104-K107 WeakPolarHBondContact O-CA 3.11Å; L104-K107 PolarHBondContact O-N 3.1Å; E105-K107 PolarHBondContact O-N 2.84Å | ||
| 108 | E | 89 | Confident | 91.1 | Very high | 106 Ų | 106 | 61.6 Ų | 61.6 | 50% | 0.495 | 31% | 0.31 | S | S | . | . | trans | -75.9 | 134.3 | 170.5 | -71.5 | 178 | 170.5 | 0 | 0 | 110.4 | Y103 L104 N106 I110 | Y103-E108 CarbonylContact C-O 3.38Å; Y103-E108 VanDerWaalsContact CA-O 3.23Å; Y103-E108 WeakPolarHBondContact CA-O 3.14Å; L104-E108 PolarHBondContact N-O 3.32Å; N106-E108 WeakPolarHBondContact ND2-CG 3.42Å; N106-E108 PolarHBondContact ND2-OE1 2.95Å; N106-E108 PolarHBondContact ND2-OE2 2.83Å; N106-E108 PolarHBondContact O-N 3.02Å; N106-E108 WeakPolarHBondContact OD1-CB 3.49Å; N106-E108 PolarHBondContact OD1-N 2.9Å; E108-I110 PolarHBondContact O-N 2.79Å | ||
| 109 | Q | 90.5 | Very high | 90.8 | Very high | 93 Ų | 93 | 62.8 Ų | 62.8 | 44% | 0.435 | 32% | 0.317 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.5 | 121.4 | 175.1 | -176.7 | -178.2 | -4 | 0 | 0 | 109.7 | P101 V102 Y103 | P101-Q109 HydrophobicContact CB-CG 4.24Å; V102-Q109 WeakPolarHBondContact O-CA 3.39Å; Y103-Q109 HydrophobicContact CD1-CB 4.05Å; Y103-Q109 HydrophobicContact CE1-CB 3.92Å; Y103-Q109 HydrophobicContact CE1-CG 4.44Å |
| 110 | I | 90.8 | Very high | 90.1 | Very high | 0 Ų | 0 | 62.1 Ų | 62.1 | 0% | 0 | 31% | 0.313 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93 | -30.2 | 177.3 | 57.3 | 174.3 | 0 | 0 | 0 | 112.6 | I84 V102 L104 E108 L129 S130 M133 F138 F144 | I84-I110 HydrophobicContact CD1-CD1 4.33Å; V102-I110 HydrophobicContact CB-CD1 4.34Å; V102-I110 HydrophobicContact CB-CG1 4.09Å; V102-I110 HydrophobicContact CG1-CD1 3.86Å; V102-I110 HydrophobicContact CG1-CG1 4.1Å; V102-I110 WeakPolarHBondContact O-CG1 3.45Å; V102-I110 PolarHBondContact O-N 2.88Å; L104-I110 HydrophobicContact CD1-CG2 3.5Å; L104-I110 HydrophobicContact CD2-CG2 4.27Å; L104-I110 HydrophobicContact CG-CG2 3.47Å; L104-I110 VanDerWaalsContact CG-CG2 3.47Å; E108-I110 PolarHBondContact O-N 2.79Å; I110-L129 HydrophobicContact CB-CD2 4.48Å; I110-S130 PolarHBondContact O-N 3.35Å; I110-S130 PolarHBondContact O-OG 2.97Å; I110-S130 VanDerWaalsContact O-OG 3.09Å; I110-M133 HydrophobicContact CB-CG 4.49Å; I110-M133 HydrophobicContact CG2-CE 3.92Å; I110-M133 HydrophobicContact CG2-SD 4.33Å; I110-F138 HydrophobicContact CB-CZ 4.46Å; I110-F138 HydrophobicContact CD1-CZ 4.49Å; I110-F138 HydrophobicContact CG2-CE1 4.31Å; I110-F138 HydrophobicContact CG2-CZ 4.25Å; I110-F144 HydrophobicContact CD1-CD1 3.3Å; I110-F144 HydrophobicContact CD1-CE1 3.17Å; I110-F144 HydrophobicContact CD1-CG 4.33Å; I110-F144 HydrophobicContact CD1-CZ 4.09Å |
| 111 | G | 93.2 | Very high | 89.4 | Confident | 1 Ų | 1 | 71.8 Ų | 71.8 | 1% | 0.01 | 35% | 0.349 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 175.9 | -165.9 | -163.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | P101 V102 K128 | P101-G111 WeakPolarHBondContact CA-O 3.31Å; V102-G111 PolarHBondContact N-O 2.84Å; G111-K128 CarbonylContact C-O 3.59Å; G111-K128 WeakPolarHBondContact CA-O 3.19Å |
| 112 | K | 94.1 | Very high | 89 | Confident | 110 Ų | 110 | 74.5 Ų | 74.5 | 48% | 0.478 | 36% | 0.362 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.9 | 143.5 | 179.5 | -62.3 | 175.2 | -173.6 | 169.8 | 0 | 110 | A100 D114 V127 K128 | A100-K112 CarbonylContact O-C 3.51Å; A100-K112 VanDerWaalsContact O-CA 3.22Å; A100-K112 WeakPolarHBondContact O-CA 3.34Å; K112-D114 PolarHBondContact O-N 3.45Å; K112-V127 CarbonylContact O-C 3.48Å; K112-V127 WeakPolarHBondContact O-CA 3.31Å; K112-V127 WeakPolarHBondContact O-CG1 3.33Å; K112-K128 PolarHBondContact N-O 3.38Å; K112-K128 PolarHBondContact O-N 2.91Å |
| 113 | V | 94.1 | Very high | 88.8 | Confident | 0 Ų | 0 | 75.1 Ų | 75.1 | 0% | 0 | 37% | 0.365 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -62.8 | 123.4 | 171 | -179.8 | 0 | 0 | 0 | 0 | 108.6 | L73 P96 N99 A100 V102 I116 F125 S126 | L73-V113 HydrophobicContact CD2-CG2 4.34Å; P96-V113 HydrophobicContact CB-CG2 4.29Å; P96-V113 HydrophobicContact CG-CG1 4.41Å; N99-V113 WeakPolarHBondContact CA-O 3.22Å; N99-V113 PolarHBondContact N-O 2.79Å; A100-V113 HydrophobicContact CB-CG2 4.39Å; A100-V113 PolarHBondContact O-N 2.76Å; V102-V113 HydrophobicContact CG2-CG2 3.46Å; V102-V113 VanDerWaalsContact CG2-CG2 3.46Å; V113-I116 HydrophobicContact CG1-CD1 4.35Å; V113-I116 HydrophobicContact CG1-CG1 3.96Å; V113-F125 HydrophobicContact CG1-CB 4.29Å; V113-F125 HydrophobicContact CG2-CD2 4.44Å; V113-S126 WeakPolarHBondContact CA-O 3.43Å |
| 114 | D | 93.8 | Very high | 88.8 | Confident | 73 Ų | 73 | 77.3 Ų | 77.3 | 39% | 0.39 | 37% | 0.374 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.9 | -60.1 | 178.3 | -170.8 | 36.5 | 0 | 0 | 0 | 110.6 | F98 K112 S126 K128 | F98-D114 VanDerWaalsContact CD1-O 3.31Å; F98-D114 WeakPolarHBondContact CD1-O 3.47Å; K112-D114 PolarHBondContact O-N 3.45Å; D114-S126 PolarHBondContact N-O 2.99Å; D114-K128 HydrophobicContact CB-CB 4.36Å |
| 115 | E | 92.4 | Very high | 89 | Confident | 112 Ų | 112 | 76.3 Ų | 76.3 | 52% | 0.523 | 37% | 0.368 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -127 | 149 | -176.8 | -170.2 | 170.5 | -157.5 | 0 | 0 | 112 | F117 F125 S126 | E115-F117 HydrophobicContact CG-CD1 4.45Å; E115-F125 CarbonylContact O-C 3.26Å; E115-F125 WeakPolarHBondContact O-CA 3.04Å; E115-F125 WeakPolarHBondContact O-CB 3.22Å; E115-S126 WeakPolarHBondContact CB-OG 3.43Å; E115-S126 PolarHBondContact N-OG 2.9Å; E115-S126 PolarHBondContact O-N 3.37Å |
| 116 | I | 91.8 | Very high | 89.3 | Confident | 32 Ų | 32 | 69.4 Ų | 69.4 | 16% | 0.164 | 34% | 0.337 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.3 | 122.1 | 175.9 | -55.5 | 169.5 | 0 | 0 | 0 | 107.2 | V95 P96 F98 V113 F123 Y124 F125 | V95-I116 HydrophobicContact CG1-CD1 3.6Å; V95-I116 HydrophobicContact CG1-CG2 4.15Å; P96-I116 HydrophobicContact CG-CD1 3.67Å; P96-I116 HydrophobicContact CG-CG1 4.29Å; P96-I116 WeakPolarHBondContact O-CD1 3.47Å; F98-I116 HydrophobicContact CE1-CB 4.3Å; F98-I116 HydrophobicContact CE1-CD1 4.3Å; F98-I116 HydrophobicContact CE1-CG1 4.16Å; F98-I116 HydrophobicContact CZ-CD1 4.45Å; V113-I116 HydrophobicContact CG1-CD1 4.35Å; V113-I116 HydrophobicContact CG1-CG1 3.96Å; I116-F123 HydrophobicContact CG2-CB 4.16Å; I116-F123 HydrophobicContact CG2-CD2 3.43Å; I116-F123 VanDerWaalsContact CG2-CD2 3.43Å; I116-F123 HydrophobicContact CG2-CE2 3.99Å; I116-F123 HydrophobicContact CG2-CG 3.94Å; I116-Y124 WeakPolarHBondContact CA-O 3.17Å; I116-F125 HydrophobicContact CG1-CB 4.19Å |
| 117 | F | 90.6 | Very high | 89.6 | Confident | 84 Ų | 84 | 65.1 Ų | 65.1 | 37% | 0.368 | 31% | 0.314 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -141 | 163.2 | -174.1 | 61.2 | -88 | 0 | 0 | 0 | 111.4 | V85 E115 F123 Y124 | V85-F117 HydrophobicContact CG1-CZ 3.83Å; V85-F117 HydrophobicContact CG2-CZ 4.42Å; E115-F117 HydrophobicContact CG-CD1 4.45Å; F117-F123 CarbonylContact O-C 3.55Å; F117-F123 WeakPolarHBondContact O-CA 3.17Å; F117-F123 WeakPolarHBondContact O-CB 3.4Å; F117-Y124 HydrophobicContact CD2-CD2 4.4Å; F117-Y124 VanDerWaalsContact CE2-CB 3.45Å; F117-Y124 HydrophobicContact CE2-CD2 4.19Å; F117-Y124 HydrophobicContact CE2-CG 4.02Å; F117-Y124 HydrophobicContact CZ-CG 4.42Å; F117-Y124 PolarHBondContact N-O 3.46Å; F117-Y124 PolarHBondContact O-N 2.95Å |
| 118 | G | 88.7 | Confident | 90 | Very high | 60 Ų | 60 | 67.2 Ų | 67.2 | 62% | 0.619 | 32% | 0.323 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | 104 | -156 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||
| 119 | Q | 85.4 | Confident | 90.1 | Very high | 138 Ų | 138 | 63 Ų | 63 | 65% | 0.645 | 30% | 0.304 | S | S | * | . | trans | -84.2 | 154.9 | -173.5 | -63.2 | -174.1 | 1.6 | 0 | 0 | 111.6 | R121 D122 F123 | Q119-R121 PolarHBondContact O-N 3.36Å; Q119-R121 VanDerWaalsContact O-N 3.1Å; Q119-D122 PolarHBondContact N-O 2.84Å; Q119-D122 CarbonylContact O-C 3.49Å; Q119-D122 VanDerWaalsContact O-C 3.26Å; Q119-D122 PolarHBondContact O-N 2.98Å; Q119-F123 WeakPolarHBondContact O-CA 3.28Å; Q119-F123 VanDerWaalsContact O-CB 3.31Å; Q119-F123 WeakPolarHBondContact O-CB 3.41Å; Q119-F123 PolarHBondContact O-N 3.12Å; Q119-F123 VanDerWaalsContact O-N 3.1Å | ||
| 120 | L | 76.4 | Confident | 90 | Very high | 92 Ų | 92 | 61.1 Ų | 61.1 | 48% | 0.482 | 30% | 0.301 | S | S | . | . | S | Bend | trans | -54.9 | -32.2 | -179.7 | -80.9 | 155.8 | 0 | 0 | 0 | 114.2 | L154 F157 L158 | L120-L154 HydrophobicContact CB-CD1 4.27Å; L120-L154 HydrophobicContact CD2-CD1 3.76Å; L120-L154 HydrophobicContact CD2-CG 4.23Å; L120-L154 WeakPolarHBondContact O-CD1 3.4Å; L120-F157 HydrophobicContact CD2-CB 4.25Å; L120-L158 HydrophobicContact CD1-CD2 3.95Å; L120-L158 HydrophobicContact CD2-CD2 4.36Å |
| 121 | R | 77 | Confident | 89.7 | Confident | 205 Ų | 205 | 70.7 Ų | 70.7 | 77% | 0.774 | 35% | 0.346 | S | S | * | . | S | Bend | trans | -99.6 | -31.9 | -179.6 | -66.2 | -178.2 | 179.8 | 173.5 | -0.2 | 113.1 | Q119 | Q119-R121 PolarHBondContact O-N 3.36Å; Q119-R121 VanDerWaalsContact O-N 3.1Å |
| 122 | D | 84.5 | Confident | 89.2 | Confident | 82 Ų | 82 | 78.2 Ų | 78.2 | 44% | 0.439 | 39% | 0.386 | S | S | . | . | S | Bend | trans | -124.3 | 71.9 | -178.7 | -66.2 | -61.8 | 0 | 0 | 0 | 108.7 | Q119 | Q119-D122 PolarHBondContact N-O 2.84Å; Q119-D122 CarbonylContact O-C 3.49Å; Q119-D122 VanDerWaalsContact O-C 3.26Å; Q119-D122 PolarHBondContact O-N 2.98Å |
| 123 | F | 89.5 | Confident | 88.7 | Confident | 13 Ų | 13 | 75.6 Ų | 75.6 | 6% | 0.057 | 38% | 0.376 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.2 | 155.7 | 175.7 | 62 | -91.9 | 0 | 0 | 0 | 111 | C88 V95 P96 I116 F117 Q119 F125 | C88-F123 HydrophobicContact CB-CD1 4.4Å; C88-F123 HydrophobicContact CB-CD2 3.78Å; C88-F123 HydrophobicContact CB-CE1 4.2Å; C88-F123 HydrophobicContact CB-CE2 3.58Å; C88-F123 HydrophobicContact CB-CG 4.2Å; C88-F123 HydrophobicContact CB-CZ 3.8Å; C88-F123 WeakPolarHBondContact CB-O 3.26Å; C88-F123 PolarHBondContact N-O 3.31Å; C88-F123 WeakPolarHBondContact SG-CZ 3.26Å; V95-F123 HydrophobicContact CB-CZ 4.36Å; V95-F123 HydrophobicContact CG1-CZ 4.32Å; V95-F123 HydrophobicContact CG2-CE1 3.93Å; V95-F123 HydrophobicContact CG2-CZ 4.25Å; P96-F123 HydrophobicContact CG-CE2 4.31Å; I116-F123 HydrophobicContact CG2-CB 4.16Å; I116-F123 HydrophobicContact CG2-CD2 3.43Å; I116-F123 VanDerWaalsContact CG2-CD2 3.43Å; I116-F123 HydrophobicContact CG2-CE2 3.99Å; I116-F123 HydrophobicContact CG2-CG 3.94Å; F117-F123 CarbonylContact O-C 3.55Å; F117-F123 WeakPolarHBondContact O-CA 3.17Å; F117-F123 WeakPolarHBondContact O-CB 3.4Å; Q119-F123 WeakPolarHBondContact O-CA 3.28Å; Q119-F123 VanDerWaalsContact O-CB 3.31Å; Q119-F123 WeakPolarHBondContact O-CB 3.41Å; Q119-F123 PolarHBondContact O-N 3.12Å; Q119-F123 VanDerWaalsContact O-N 3.1Å; F123-F125 HydrophobicContact CE2-CD1 4.37Å |
| 124 | Y | 93.4 | Very high | 88.2 | Confident | 76 Ų | 76 | 82.8 Ų | 82.8 | 30% | 0.298 | 41% | 0.407 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.7 | 156.1 | 169.5 | -58.4 | -86.4 | 0 | 0 | 0 | 108.4 | L77 C86 K87 I116 F117 | L77-Y124 HydrophobicContact CD1-CD1 4.06Å; L77-Y124 HydrophobicContact CD1-CE1 3.57Å; C86-Y124 VanDerWaalsContact O-CA 3.26Å; C86-Y124 WeakPolarHBondContact O-CA 3.08Å; K87-Y124 HydrophobicContact CB-CD1 4Å; K87-Y124 HydrophobicContact CB-CE1 3.88Å; K87-Y124 HydrophobicContact CD-CE1 4.23Å; K87-Y124 HydrophobicContact CG-CD1 4.2Å; K87-Y124 HydrophobicContact CG-CE1 3.79Å; I116-Y124 WeakPolarHBondContact CA-O 3.17Å; F117-Y124 HydrophobicContact CD2-CD2 4.4Å; F117-Y124 VanDerWaalsContact CE2-CB 3.45Å; F117-Y124 HydrophobicContact CE2-CD2 4.19Å; F117-Y124 HydrophobicContact CE2-CG 4.02Å; F117-Y124 HydrophobicContact CZ-CG 4.42Å; F117-Y124 PolarHBondContact N-O 3.46Å; F117-Y124 PolarHBondContact O-N 2.95Å |
| 125 | F | 93.4 | Very high | 87.7 | Confident | 0 Ų | 0 | 79.6 Ų | 79.6 | 0% | 0 | 39% | 0.391 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.8 | 144 | 173.1 | 59.9 | -86.8 | 0 | 0 | 0 | 110.2 | L73 C86 C88 V113 E115 I116 F123 V127 | L73-F125 HydrophobicContact CB-CZ 4.38Å; L73-F125 HydrophobicContact CD1-CE1 4.38Å; L73-F125 HydrophobicContact CD1-CZ 4.48Å; L73-F125 HydrophobicContact CD2-CD2 4.19Å; L73-F125 HydrophobicContact CD2-CE1 4.1Å; L73-F125 HydrophobicContact CD2-CE2 3.47Å; L73-F125 VanDerWaalsContact CD2-CE2 3.47Å; L73-F125 HydrophobicContact CD2-CZ 3.42Å; L73-F125 VanDerWaalsContact CD2-CZ 3.42Å; L73-F125 HydrophobicContact CG-CE1 3.76Å; L73-F125 HydrophobicContact CG-CE2 4.06Å; L73-F125 HydrophobicContact CG-CZ 3.45Å; L73-F125 VanDerWaalsContact CG-CZ 3.45Å; C86-F125 HydrophobicContact CB-CD1 4.21Å; C86-F125 HydrophobicContact CB-CD2 3.97Å; C86-F125 HydrophobicContact CB-CE1 3.68Å; C86-F125 HydrophobicContact CB-CE2 3.4Å; C86-F125 VanDerWaalsContact CB-CE2 3.4Å; C86-F125 HydrophobicContact CB-CG 4.34Å; C86-F125 HydrophobicContact CB-CZ 3.23Å; C86-F125 PolarHBondContact N-O 2.9Å; C86-F125 PolarHBondContact O-N 2.84Å; C88-F125 HydrophobicContact CB-CD1 4.41Å; C88-F125 HydrophobicContact CB-CE1 4.35Å; V113-F125 HydrophobicContact CG1-CB 4.29Å; V113-F125 HydrophobicContact CG2-CD2 4.44Å; E115-F125 CarbonylContact O-C 3.26Å; E115-F125 WeakPolarHBondContact O-CA 3.04Å; E115-F125 WeakPolarHBondContact O-CB 3.22Å; I116-F125 HydrophobicContact CG1-CB 4.19Å; F123-F125 HydrophobicContact CE2-CD1 4.37Å; F125-V127 HydrophobicContact CD2-CG2 3.61Å; F125-V127 HydrophobicContact CE2-CG2 3.53Å |
| 126 | S | 93.9 | Very high | 87.2 | Confident | 10 Ų | 10 | 79 Ų | 79 | 7% | 0.07 | 40% | 0.399 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.6 | 141.4 | 168.4 | 60.7 | 0 | 0 | 0 | 0 | 109.8 | I84 V113 D114 E115 | I84-S126 CarbonylContact O-C 3.51Å; I84-S126 VanDerWaalsContact O-CA 3.26Å; I84-S126 WeakPolarHBondContact O-CA 3.2Å; V113-S126 WeakPolarHBondContact CA-O 3.43Å; D114-S126 PolarHBondContact N-O 2.99Å; E115-S126 WeakPolarHBondContact CB-OG 3.43Å; E115-S126 PolarHBondContact N-OG 2.9Å; E115-S126 PolarHBondContact O-N 3.37Å |
| 127 | V | 94.4 | Very high | 86.7 | Confident | 0 Ų | 0 | 81.1 Ų | 81.1 | 0% | 0 | 42% | 0.417 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.6 | 119.2 | 171.4 | -175.2 | 0 | 0 | 0 | 0 | 107.7 | D83 I84 V102 K112 F125 L129 | D83-V127 WeakPolarHBondContact CA-O 3.37Å; I84-V127 HydrophobicContact CD1-CB 4.15Å; I84-V127 HydrophobicContact CD1-CG2 4.49Å; I84-V127 HydrophobicContact CG1-CB 3.67Å; I84-V127 HydrophobicContact CG1-CG2 4.25Å; I84-V127 PolarHBondContact N-O 2.85Å; I84-V127 PolarHBondContact O-N 3.06Å; V102-V127 HydrophobicContact CB-CG1 4.04Å; V102-V127 HydrophobicContact CG2-CG1 3.9Å; V102-V127 HydrophobicContact CG2-CG2 3.92Å; K112-V127 CarbonylContact O-C 3.48Å; K112-V127 WeakPolarHBondContact O-CA 3.31Å; K112-V127 WeakPolarHBondContact O-CG1 3.33Å; F125-V127 HydrophobicContact CD2-CG2 3.61Å; F125-V127 HydrophobicContact CE2-CG2 3.53Å; V127-L129 PolarHBondContact O-N 3.41Å |
| 128 | K | 93.2 | Very high | 86.3 | Confident | 125 Ų | 125 | 77.9 Ų | 77.9 | 54% | 0.543 | 40% | 0.403 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.1 | 114.7 | 169.4 | -174.4 | 167 | -172.9 | 164.2 | 0 | 109.4 | D83 G111 K112 D114 | D83-K128 VanDerWaalsContact OD1-CA 3.28Å; D83-K128 WeakPolarHBondContact OD1-CA 3.31Å; G111-K128 CarbonylContact C-O 3.59Å; G111-K128 WeakPolarHBondContact CA-O 3.19Å; K112-K128 PolarHBondContact N-O 3.38Å; K112-K128 PolarHBondContact O-N 2.91Å; D114-K128 HydrophobicContact CB-CB 4.36Å |
| 129 | L | 92.1 | Very high | 86.1 | Confident | 18 Ų | 18 | 82.9 Ų | 82.9 | 9% | 0.094 | 41% | 0.407 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.1 | 152.1 | 179.4 | -62.2 | 177.6 | 0 | 0 | 0 | 110.6 | D82 I84 I110 V127 M133 A135 F138 | D82-L129 WeakPolarHBondContact O-CB 3.43Å; D82-L129 PolarHBondContact O-N 2.9Å; I84-L129 HydrophobicContact CD1-CD2 4.04Å; I84-L129 HydrophobicContact CG1-CD2 4.14Å; I84-L129 HydrophobicContact CG2-CD1 3.84Å; I84-L129 HydrophobicContact CG2-CD2 4.38Å; I84-L129 HydrophobicContact CG2-CG 4.26Å; I110-L129 HydrophobicContact CB-CD2 4.48Å; V127-L129 PolarHBondContact O-N 3.41Å; L129-M133 HydrophobicContact CB-CB 4.14Å; L129-M133 HydrophobicContact CD1-CB 4.45Å; L129-M133 HydrophobicContact CD2-CB 4.36Å; L129-A135 HydrophobicContact CD1-CB 3.95Å; L129-A135 VanDerWaalsContact CD1-N 3.32Å; L129-F138 HydrophobicContact CD1-CD2 4.47Å; L129-F138 HydrophobicContact CD1-CE2 3.76Å; L129-F138 HydrophobicContact CD2-CE2 3.69Å; L129-F138 HydrophobicContact CD2-CZ 4Å; L129-F138 HydrophobicContact CG-CE2 4.4Å |
| 130 | S | 88.3 | Confident | 86 | Confident | 53 Ų | 53 | 84.2 Ų | 84.2 | 37% | 0.371 | 41% | 0.411 | S | S | . | . | trans | -76.3 | 155 | 168.6 | -50.9 | 0 | 0 | 0 | 0 | 109.5 | I110 N132 M133 | I110-S130 PolarHBondContact O-N 3.35Å; I110-S130 PolarHBondContact O-OG 2.97Å; I110-S130 VanDerWaalsContact O-OG 3.09Å; S130-N132 PolarHBondContact O-N 3.44Å; S130-M133 PolarHBondContact O-N 3.5Å | ||
| 131 | E | 82.9 | Confident | 86.5 | Confident | 201 Ų | 201 | 85.3 Ų | 85.3 | 94% | 0.939 | 42% | 0.417 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54 | -23.1 | -175.3 | -63.4 | 173.3 | -171.9 | 0 | 0 | 114.6 | ||
| 132 | N | 83.3 | Confident | 87.1 | Confident | 158 Ų | 158 | 78.1 Ų | 78.1 | 85% | 0.845 | 39% | 0.392 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.1 | -3.5 | 178.6 | -61.9 | -32.4 | 0 | 0 | 0 | 114.2 | S130 | S130-N132 PolarHBondContact O-N 3.44Š|
| 133 | M | 83.1 | Confident | 87.4 | Confident | 55 Ų | 55 | 79 Ų | 79 | 27% | 0.271 | 39% | 0.392 | S | S | . | . | trans | -116.2 | 136.2 | -175.4 | -72.7 | -72 | -177.7 | 0 | 0 | 110.5 | I110 L129 S130 F138 | I110-M133 HydrophobicContact CB-CG 4.49Å; I110-M133 HydrophobicContact CG2-CE 3.92Å; I110-M133 HydrophobicContact CG2-SD 4.33Å; L129-M133 HydrophobicContact CB-CB 4.14Å; L129-M133 HydrophobicContact CD1-CB 4.45Å; L129-M133 HydrophobicContact CD2-CB 4.36Å; S130-M133 PolarHBondContact O-N 3.5Å; M133-F138 HydrophobicContact CB-CZ 4.5Å; M133-F138 HydrophobicContact SD-CZ 4.13Å | ||
| 134 | K | 84.3 | Confident | 87.5 | Confident | 152 Ų | 152 | 78.3 Ų | 78.3 | 66% | 0.661 | 39% | 0.389 | S | S | * | . | trans | -109.1 | 132.1 | 178.5 | -67.2 | -173.1 | 178.3 | -176.6 | 0 | 111 | S136 S137 F138 | K134-S136 PolarHBondContact O-N 2.95Å; K134-S136 VanDerWaalsContact O-N 3.15Å; K134-S137 WeakPolarHBondContact O-CB 3.23Å; K134-S137 PolarHBondContact O-N 2.82Å; K134-S137 PolarHBondContact O-OG 3.09Å; K134-F138 WeakPolarHBondContact O-CD2 3.39Å; K134-F138 WeakPolarHBondContact O-CE2 3.39Å | ||
| 135 | A | 83.4 | Confident | 87.5 | Confident | 5 Ų | 5 | 76.6 Ų | 76.6 | 4% | 0.041 | 38% | 0.382 | C | S | . | . | G | 310 helix | trans | -55.6 | -34.9 | 177 | 0 | 0 | 0 | 0 | 0 | 112.5 | P79 E81 D83 I84 L129 S137 | P79-A135 HydrophobicContact CB-CB 3.81Å; E81-A135 WeakPolarHBondContact O-CB 3.5Å; D83-A135 WeakPolarHBondContact O-CB 3.21Å; I84-A135 HydrophobicContact CG2-CB 3.72Å; L129-A135 HydrophobicContact CD1-CB 3.95Å; L129-A135 VanDerWaalsContact CD1-N 3.32Å; A135-S137 VanDerWaalsContact C-N 3.32Å; A135-S137 PolarHBondContact O-N 2.8Å |
| 136 | S | 82.9 | Confident | 87.4 | Confident | 100 Ų | 100 | 76.6 Ų | 76.6 | 70% | 0.699 | 38% | 0.382 | S | S | * | . | G | 310 helix | trans | -75.2 | -11.5 | 178.8 | 57.2 | 0 | 0 | 0 | 0 | 115.5 | K134 F138 | K134-S136 PolarHBondContact O-N 2.95Å; K134-S136 VanDerWaalsContact O-N 3.15Å; S136-F138 VanDerWaalsContact C-N 3.34Å |
| 137 | S | 81 | Confident | 87.3 | Confident | 77 Ų | 77 | 76.9 Ų | 76.9 | 54% | 0.538 | 38% | 0.383 | S | S | . | . | G | 310 helix | trans | -80.3 | -16.4 | 176.8 | 66.1 | 0 | 0 | 0 | 0 | 113.7 | K134 A135 | K134-S137 WeakPolarHBondContact O-CB 3.23Å; K134-S137 PolarHBondContact O-N 2.82Å; K134-S137 PolarHBondContact O-OG 3.09Å; A135-S137 VanDerWaalsContact C-N 3.32Å; A135-S137 PolarHBondContact O-N 2.8Å |
| 138 | F | 82.2 | Confident | 86.9 | Confident | 16 Ų | 16 | 78.4 Ų | 78.4 | 7% | 0.07 | 39% | 0.393 | C | S | . | . | S | Bend | trans | -82.2 | 136.5 | -179 | -60.9 | -74.7 | 0 | 0 | 0 | 111 | F76 I84 L104 I110 L129 M133 K134 S136 F144 | F76-F138 HydrophobicContact CD1-CB 4.22Å; F76-F138 HydrophobicContact CD2-CB 4.09Å; F76-F138 HydrophobicContact CE1-CB 4.3Å; F76-F138 HydrophobicContact CE2-CB 4.18Å; F76-F138 HydrophobicContact CG-CB 4.11Å; F76-F138 HydrophobicContact CZ-CB 4.26Å; I84-F138 HydrophobicContact CG2-CD2 4.07Å; I84-F138 HydrophobicContact CG2-CE2 4.44Å; L104-F138 HydrophobicContact CD2-CE1 4.34Å; I110-F138 HydrophobicContact CB-CZ 4.46Å; I110-F138 HydrophobicContact CD1-CZ 4.49Å; I110-F138 HydrophobicContact CG2-CE1 4.31Å; I110-F138 HydrophobicContact CG2-CZ 4.25Å; L129-F138 HydrophobicContact CD1-CD2 4.47Å; L129-F138 HydrophobicContact CD1-CE2 3.76Å; L129-F138 HydrophobicContact CD2-CE2 3.69Å; L129-F138 HydrophobicContact CD2-CZ 4Å; L129-F138 HydrophobicContact CG-CE2 4.4Å; M133-F138 HydrophobicContact CB-CZ 4.5Å; M133-F138 HydrophobicContact SD-CZ 4.13Å; K134-F138 WeakPolarHBondContact O-CD2 3.39Å; K134-F138 WeakPolarHBondContact O-CE2 3.39Å; S136-F138 VanDerWaalsContact C-N 3.34Å; F138-F144 HydrophobicContact CD1-CE1 4.04Å; F138-F144 AromaticContact CD1-CZ 3.91Å; F138-F144 HydrophobicContact CD1-CZ 3.91Å; F138-F144 HydrophobicContact CE1-CE1 4.01Å; F138-F144 HydrophobicContact CE1-CZ 4.27Å; F138-F144 HydrophobicContact CG-CZ 4.24Å |
| 139 | K | 83.1 | Confident | 86.5 | Confident | 165 Ų | 165 | 81.3 Ų | 81.3 | 72% | 0.717 | 40% | 0.402 | S | S | * | . | P | Polyproline II helix | trans | -83.7 | 146.8 | 176.3 | -67.1 | -179.1 | -179.7 | 176.3 | 0 | 110 | F76 L141 Q142 | F76-K139 VanDerWaalsContact CD1-O 3.28Å; F76-K139 WeakPolarHBondContact CD1-O 3.38Å; K139-L141 PolarHBondContact O-N 3.01Å; K139-Q142 VanDerWaalsContact N-OE1 3.09Å; K139-Q142 WeakPolarHBondContact O-CB 3.43Å; K139-Q142 PolarHBondContact O-N 2.84Å |
| 140 | K | 84.8 | Confident | 86.3 | Confident | 165 Ų | 165 | 84.8 Ų | 84.8 | 72% | 0.717 | 42% | 0.416 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.4 | 137.7 | 169.7 | -160.7 | 175.6 | -178.7 | 177.1 | 0 | 109.9 | Q142 | K140-Q142 PolarHBondContact O-N 3.28Š|
| 141 | L | 85.7 | Confident | 86.3 | Confident | 115 Ų | 115 | 82.9 Ų | 82.9 | 60% | 0.602 | 40% | 0.401 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68.9 | 13.8 | -175.6 | -50.2 | 171.2 | 0 | 0 | 0 | 115.1 | E75 F76 K139 K143 | E75-L141 WeakPolarHBondContact OE2-CD2 3.49Å; F76-L141 PolarHBondContact O-N 3.49Å; K139-L141 PolarHBondContact O-N 3.01Å; L141-K143 PolarHBondContact O-N 2.9Å |
| 142 | Q | 89 | Confident | 86.4 | Confident | 55 Ų | 55 | 74.2 Ų | 74.2 | 26% | 0.257 | 36% | 0.361 | S | S | . | . | trans | -64.9 | 129.8 | 170.9 | -177.6 | 162.8 | -3.7 | 0 | 0 | 110.4 | E75 F76 L104 K139 K140 | E75-Q142 CarbonylContact C-O 3.52Å; E75-Q142 WeakPolarHBondContact CA-O 3.41Å; F76-Q142 HydrophobicContact CB-CB 4.16Å; F76-Q142 PolarHBondContact N-O 3.46Å; L104-Q142 HydrophobicContact CD2-CG 4.5Å; K139-Q142 VanDerWaalsContact N-OE1 3.09Å; K139-Q142 WeakPolarHBondContact O-CB 3.43Å; K139-Q142 PolarHBondContact O-N 2.84Å; K140-Q142 PolarHBondContact O-N 3.28Å | ||
| 143 | K | 92 | Very high | 86.4 | Confident | 99 Ų | 99 | 69.5 Ų | 69.5 | 43% | 0.43 | 34% | 0.34 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.1 | 134.8 | -177.1 | -66.3 | 177.5 | 177.5 | -176.3 | 0 | 110.7 | L72 E75 L141 Y145 | L72-K143 HydrophobicContact CD1-CD 3.88Å; L72-K143 HydrophobicContact CD1-CG 4.36Å; E75-K143 HydrophobicContact CG-CG 4.19Å; L141-K143 PolarHBondContact O-N 2.9Å; K143-Y145 HydrophobicContact CB-CE2 3.99Å |
| 144 | F | 92.3 | Very high | 85.8 | Confident | 0 Ų | 0 | 68.1 Ų | 68.1 | 0% | 0 | 33% | 0.333 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.8 | 149.3 | 173 | -64.4 | -64 | 0 | 0 | 0 | 110.7 | L73 G74 F76 I84 C86 V102 L104 I110 F138 | L73-F144 PolarHBondContact N-O 2.84Å; G74-F144 PolarHBondContact N-O 2.99Å; G74-F144 PolarHBondContact O-N 3Å; F76-F144 HydrophobicContact CB-CE2 3.64Å; F76-F144 HydrophobicContact CB-CZ 4.2Å; F76-F144 HydrophobicContact CD2-CE2 4.27Å; F76-F144 HydrophobicContact CD2-CZ 4.5Å; F76-F144 HydrophobicContact CG-CE2 4.41Å; I84-F144 HydrophobicContact CD1-CD2 4.46Å; I84-F144 HydrophobicContact CD1-CE1 4.05Å; I84-F144 HydrophobicContact CD1-CE2 3.57Å; I84-F144 HydrophobicContact CD1-CZ 3.32Å; C86-F144 HydrophobicContact CB-CD2 4.44Å; C86-F144 WeakPolarHBondContact SG-CD2 3.48Å; C86-F144 WeakPolarHBondContact SG-CE2 3.44Å; V102-F144 HydrophobicContact CG1-CB 3.76Å; V102-F144 HydrophobicContact CG1-CD1 4.18Å; V102-F144 HydrophobicContact CG1-CG 4.16Å; L104-F144 HydrophobicContact CD2-CD1 4.04Å; L104-F144 HydrophobicContact CD2-CE1 3.83Å; I110-F144 HydrophobicContact CD1-CD1 3.3Å; I110-F144 HydrophobicContact CD1-CE1 3.17Å; I110-F144 HydrophobicContact CD1-CG 4.33Å; I110-F144 HydrophobicContact CD1-CZ 4.09Å; F138-F144 HydrophobicContact CD1-CE1 4.04Å; F138-F144 AromaticContact CD1-CZ 3.91Å; F138-F144 HydrophobicContact CD1-CZ 3.91Å; F138-F144 HydrophobicContact CE1-CE1 4.01Å; F138-F144 HydrophobicContact CE1-CZ 4.27Å; F138-F144 HydrophobicContact CG-CZ 4.24Å |
| 145 | Y | 92.8 | Very high | 85.2 | Confident | 40 Ų | 40 | 66.9 Ų | 66.9 | 16% | 0.157 | 33% | 0.329 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.4 | 153.8 | -174 | -61.1 | -97.1 | 0 | 0 | 0 | 110.9 | V70 V71 L72 Y103 E105 K143 | V70-Y145 HydrophobicContact CB-CD1 4.49Å; V70-Y145 HydrophobicContact CB-CG 4.5Å; V70-Y145 HydrophobicContact CG2-CD1 3.84Å; V70-Y145 HydrophobicContact CG2-CG 3.96Å; V71-Y145 CarbonylContact O-C 3.55Å; V71-Y145 WeakPolarHBondContact O-CA 3.35Å; L72-Y145 HydrophobicContact CB-CE1 4.45Å; Y103-Y145 PolarHBondContact N-O 3.22Å; Y103-Y145 PolarHBondContact O-N 2.72Å; E105-Y145 HydrophobicContact CB-CD2 4.5Å; E105-Y145 HydrophobicContact CB-CE2 3.82Å; E105-Y145 HydrophobicContact CG-CE2 4.39Å; K143-Y145 HydrophobicContact CB-CE2 3.99Å |
| 146 | I | 92 | Very high | 84.7 | Confident | 0 Ų | 0 | 74.6 Ų | 74.6 | 0% | 0 | 36% | 0.358 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -137 | 156.3 | 178.4 | -164.8 | 169 | 0 | 0 | 0 | 110 | V70 V71 L73 P96 A100 K150 L151 | V70-I146 CarbonylContact C-O 3.52Å; V70-I146 WeakPolarHBondContact CA-O 3.4Å; V71-I146 HydrophobicContact CG2-CG2 3.78Å; V71-I146 WeakPolarHBondContact CG2-O 3.42Å; V71-I146 PolarHBondContact N-O 3.03Å; V71-I146 PolarHBondContact O-N 2.85Å; L73-I146 HydrophobicContact CB-CB 4.1Å; L73-I146 HydrophobicContact CB-CG2 3.92Å; L73-I146 HydrophobicContact CD1-CB 4.45Å; L73-I146 HydrophobicContact CD1-CD1 4.33Å; L73-I146 HydrophobicContact CD1-CG2 4.02Å; L73-I146 HydrophobicContact CD2-CB 4.18Å; L73-I146 HydrophobicContact CD2-CD1 4.23Å; L73-I146 HydrophobicContact CG-CB 4.46Å; L73-I146 HydrophobicContact CG-CG2 4.37Å; P96-I146 HydrophobicContact CB-CD1 3.56Å; A100-I146 HydrophobicContact CB-CD1 3.83Å; I146-K150 HydrophobicContact CD1-CB 4.2Å; I146-K150 HydrophobicContact CG1-CB 4.2Å; I146-L151 HydrophobicContact CD1-CD2 4.23Å; I146-L151 HydrophobicContact CG2-CD1 4.25Å; I146-L151 HydrophobicContact CG2-CD2 3.86Å; I146-L151 HydrophobicContact CG2-CG 4.08Å |
| 147 | D | 90.2 | Very high | 84.2 | Confident | 15 Ų | 15 | 74.3 Ų | 74.3 | 8% | 0.08 | 34% | 0.344 | C | S | . | . | trans | -65 | 125.4 | 166.2 | 174.8 | 6.5 | 0 | 0 | 0 | 110.1 | P67 Y149 K150 | P67-D147 HydrophobicContact CB-CB 4.3Å; P67-D147 HydrophobicContact CG-CB 4.04Å; D147-Y149 PolarHBondContact O-N 2.81Å; D147-Y149 WeakPolarHBondContact OD1-CB 3.32Å; D147-Y149 WeakPolarHBondContact OD1-CD2 3.35Å; D147-Y149 PolarHBondContact OD1-N 3.09Å; D147-K150 HydrophobicContact CB-CB 4.35Å; D147-K150 HydrophobicContact CB-CG 3.87Å; D147-K150 WeakPolarHBondContact O-CA 3.32Å; D147-K150 WeakPolarHBondContact O-CB 3.07Å; D147-K150 PolarHBondContact O-N 2.9Å | ||
| 148 | P | 85.6 | Confident | 83.6 | Confident | 32 Ų | 32 | 74.5 Ų | 74.5 | 21% | 0.208 | 34% | 0.339 | C | S | . | . | G | 310 helix | trans | -59.2 | -24.9 | 176.3 | 25.3 | -35.8 | 0 | 0 | 0 | 113.8 | R69 V71 K150 L151 | R69-P148 WeakPolarHBondContact O-CD 3.38Å; V71-P148 HydrophobicContact CG1-CB 4.03Å; V71-P148 HydrophobicContact CG1-CG 4.3Å; V71-P148 HydrophobicContact CG2-CB 4.13Å; P148-K150 PolarHBondContact O-N 2.83Å; P148-L151 PolarHBondContact O-N 3.39Å |
| 149 | Y | 85.6 | Confident | 83.1 | Confident | 187 Ų | 187 | 79.4 Ų | 79.4 | 73% | 0.733 | 37% | 0.372 | S | S | * | . | G | 310 helix | trans | -72.1 | -13.7 | 173.9 | -62.1 | -69.8 | 0 | 0 | 0 | 112.8 | D147 | D147-Y149 PolarHBondContact O-N 2.81Å; D147-Y149 WeakPolarHBondContact OD1-CB 3.32Å; D147-Y149 WeakPolarHBondContact OD1-CD2 3.35Å; D147-Y149 PolarHBondContact OD1-N 3.09Å |
| 150 | K | 88.7 | Confident | 82.1 | Confident | 91 Ų | 91 | 79.5 Ų | 79.5 | 40% | 0.396 | 37% | 0.368 | S | S | . | . | G | 310 helix | trans | -98.9 | 26.4 | 174.3 | -53.9 | -63.1 | -178.6 | 178.6 | 0 | 112.7 | Y97 A100 I146 D147 P148 | Y97-K150 VanDerWaalsContact CD2-CA 3.49Å; Y97-K150 HydrophobicContact CD2-CB 4.17Å; Y97-K150 WeakPolarHBondContact CD2-O 3.39Å; Y97-K150 PolarHBondContact N-O 2.9Å; A100-K150 HydrophobicContact CB-CB 4.08Å; I146-K150 HydrophobicContact CD1-CB 4.2Å; I146-K150 HydrophobicContact CG1-CB 4.2Å; D147-K150 HydrophobicContact CB-CB 4.35Å; D147-K150 HydrophobicContact CB-CG 3.87Å; D147-K150 WeakPolarHBondContact O-CA 3.32Å; D147-K150 WeakPolarHBondContact O-CB 3.07Å; D147-K150 PolarHBondContact O-N 2.9Å; P148-K150 PolarHBondContact O-N 2.83Å |
| 151 | L | 87.2 | Confident | 81 | Confident | 13 Ų | 13 | 75.4 Ų | 75.4 | 7% | 0.068 | 36% | 0.358 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.2 | 136.5 | 171.8 | -67.3 | 179 | 0 | 0 | 0 | 111.6 | V71 L73 K94 P96 I146 P148 | V71-L151 HydrophobicContact CG2-CD1 3.74Å; L73-L151 HydrophobicContact CD1-CD2 4.33Å; K94-L151 HydrophobicContact CB-CB 3.84Å; K94-L151 HydrophobicContact CB-CD1 4.37Å; K94-L151 HydrophobicContact CD-CB 3.75Å; K94-L151 HydrophobicContact CD-CD1 4.12Å; K94-L151 HydrophobicContact CG-CB 4.44Å; P96-L151 HydrophobicContact CB-CD2 4.21Å; I146-L151 HydrophobicContact CD1-CD2 4.23Å; I146-L151 HydrophobicContact CG2-CD1 4.25Å; I146-L151 HydrophobicContact CG2-CD2 3.86Å; I146-L151 HydrophobicContact CG2-CG 4.08Å; P148-L151 PolarHBondContact O-N 3.39Å |
| 152 | L | 86.2 | Confident | 80 | Confident | 18 Ų | 18 | 76.7 Ų | 76.7 | 9% | 0.094 | 37% | 0.374 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.2 | 133 | 176.8 | -74.1 | 176 | 0 | 0 | 0 | 111 | K94 V95 Y97 L154 F157 | K94-L152 CarbonylContact C-O 3.41Å; K94-L152 WeakPolarHBondContact CA-O 3.43Å; K94-L152 WeakPolarHBondContact CB-O 3.4Å; V95-L152 PolarHBondContact N-O 2.87Å; V95-L152 WeakPolarHBondContact O-CA 3.42Å; V95-L152 WeakPolarHBondContact O-CB 3.28Å; V95-L152 PolarHBondContact O-N 3.35Å; Y97-L152 HydrophobicContact CD1-CD1 3.78Å; Y97-L152 HydrophobicContact CD1-CD2 4.17Å; Y97-L152 HydrophobicContact CD1-CG 3.89Å; Y97-L152 HydrophobicContact CD2-CG 4.14Å; Y97-L152 HydrophobicContact CE1-CD1 3.84Å; Y97-L152 HydrophobicContact CE1-CD2 3.39Å; Y97-L152 HydrophobicContact CE1-CG 3.63Å; Y97-L152 HydrophobicContact CE2-CD2 3.94Å; Y97-L152 HydrophobicContact CE2-CG 3.87Å; Y97-L152 HydrophobicContact CG-CD1 4.25Å; Y97-L152 HydrophobicContact CG-CG 4.14Å; Y97-L152 VanDerWaalsContact OH-CD2 3.22Å; Y97-L152 WeakPolarHBondContact OH-CD2 3.48Å; L152-L154 PolarHBondContact O-N 2.85Å; L152-F157 HydrophobicContact CB-CE2 4.42Å; L152-F157 HydrophobicContact CD1-CE2 4.48Å; L152-F157 HydrophobicContact CD1-CZ 4.35Å |
| 153 | P | 81.7 | Confident | 78.8 | Confident | 60 Ų | 60 | 77.9 Ų | 77.9 | 39% | 0.39 | 40% | 0.4 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -60.1 | 136.3 | 172 | -22 | 32.5 | 0 | 0 | 0 | 112.1 | Q155 R156 | P153-Q155 PolarHBondContact O-N 2.91Å; P153-R156 PolarHBondContact O-N 3.04Å |
| 154 | L | 72.1 | Confident | 77.4 | Confident | 25 Ų | 25 | 79.2 Ų | 79.2 | 13% | 0.131 | 41% | 0.408 | C | S | . | . | G | 310 helix | trans | -52.6 | -31.6 | 178.5 | -169.9 | 80.2 | 0 | 0 | 0 | 113 | N93 V95 L120 L152 R156 F157 L158 | N93-L154 WeakPolarHBondContact O-CB 3.11Å; N93-L154 PolarHBondContact O-N 2.84Å; V95-L154 HydrophobicContact CG2-CD1 3.83Å; L120-L154 HydrophobicContact CB-CD1 4.27Å; L120-L154 HydrophobicContact CD2-CD1 3.76Å; L120-L154 HydrophobicContact CD2-CG 4.23Å; L120-L154 WeakPolarHBondContact O-CD1 3.4Å; L152-L154 PolarHBondContact O-N 2.85Å; L154-R156 PolarHBondContact O-N 3.27Å; L154-F157 PolarHBondContact O-N 3.26Å; L154-L158 PolarHBondContact O-N 2.89Å |
| 155 | Q | 71.3 | Confident | 75.7 | Confident | 126 Ų | 126 | 89 Ų | 89 | 59% | 0.589 | 45% | 0.451 | S | S | * | . | G | 310 helix | trans | -57.2 | -18.8 | 178.2 | -167.3 | -179.1 | 1.1 | 0 | 0 | 113.5 | P153 F157 | P153-Q155 PolarHBondContact O-N 2.91Å; Q155-F157 VanDerWaalsContact C-N 3.28Å; Q155-F157 PolarHBondContact O-N 2.95Å |
| 156 | R | 72.3 | Confident | 73.7 | Confident | 167 Ų | 167 | 88.5 Ų | 88.5 | 63% | 0.63 | 46% | 0.458 | S | S | * | . | G | 310 helix | trans | -69.8 | -24.6 | 171.7 | -65.8 | -157.2 | -156.6 | -165.9 | 13 | 113.7 | P153 L154 | P153-R156 PolarHBondContact O-N 3.04Å; L154-R156 PolarHBondContact O-N 3.27Å |
| 157 | F | 71.8 | Confident | 72.3 | Confident | 95 Ų | 95 | 94.1 Ų | 94.1 | 42% | 0.417 | 49% | 0.494 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.1 | -16.8 | 179.5 | -62.1 | -83.4 | 0 | 0 | 0 | 112.7 | V95 L120 L152 L154 Q155 | V95-F157 HydrophobicContact CB-CD2 4.41Å; V95-F157 HydrophobicContact CB-CE2 3.7Å; V95-F157 HydrophobicContact CB-CZ 4.34Å; V95-F157 HydrophobicContact CG1-CE2 3.88Å; V95-F157 HydrophobicContact CG1-CZ 4.03Å; V95-F157 HydrophobicContact CG2-CD2 4.08Å; V95-F157 HydrophobicContact CG2-CE2 3.87Å; L120-F157 HydrophobicContact CD2-CB 4.25Å; L152-F157 HydrophobicContact CB-CE2 4.42Å; L152-F157 HydrophobicContact CD1-CE2 4.48Å; L152-F157 HydrophobicContact CD1-CZ 4.35Å; L154-F157 PolarHBondContact O-N 3.26Å; Q155-F157 VanDerWaalsContact C-N 3.28Å; Q155-F157 PolarHBondContact O-N 2.95Å |
| 158 | L | 70.2 | Confident | 70.8 | Confident | 81 Ų | 81 | 99.6 Ų | 99.6 | 42% | 0.424 | 53% | 0.53 | S | S | . | . | S | Bend | trans | -80.7 | 139.3 | 174.6 | -64.6 | 177.1 | 0 | 0 | 0 | 110.9 | L120 L154 R160 | L120-L158 HydrophobicContact CD1-CD2 3.95Å; L120-L158 HydrophobicContact CD2-CD2 4.36Å; L154-L158 PolarHBondContact O-N 2.89Å; L158-R160 PolarHBondContact O-N 3.2Å |
| 159 | P | 70.2 | Confident | 69.5 | Low | 119 Ų | 119 | 109.7 Ų | 109.7 | 77% | 0.773 | 56% | 0.564 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 128.6 | 169.4 | 24.1 | -31.2 | 0 | 0 | 0 | 108.7 | ||
| 160 | R | 61.8 | Low | 67.6 | Low | 166 Ų | 166 | 104.6 Ų | 104.6 | 63% | 0.626 | 57% | 0.569 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 135.2 | -179 | -65.6 | -175.9 | -178.7 | -179.9 | 1.6 | 109.1 | L158 | L158-R160 PolarHBondContact O-N 3.2Š|
| 161 | P | 62.2 | Low | 65.6 | Low | 80 Ų | 80 | 104.1 Ų | 104.1 | 52% | 0.519 | 59% | 0.59 | S | S | . | * | P | Polyproline II helix | trans | -52.5 | 137.8 | 163.1 | -20.7 | 31 | 0 | 0 | 0 | 109.1 | G163 | P161-G163 PolarHBondContact O-N 3.26Š|
| 162 | P | 64.4 | Low | 63.4 | Low | 142 Ų | 142 | 106.8 Ų | 106.8 | 92% | 0.922 | 62% | 0.62 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.5 | 114.1 | 177.8 | -23.3 | 32.1 | 0 | 0 | 0 | 110.4 | ||
| 163 | G | 64.3 | Low | 61.7 | Low | 79 Ų | 79 | 118.2 Ų | 118.2 | 81% | 0.814 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 124.1 | -16.8 | 170.4 | 0 | 0 | 0 | 0 | 0 | 117.8 | P161 K165 | P161-G163 PolarHBondContact O-N 3.26Å; G163-K165 PolarHBondContact O-N 3.42Å |
| 164 | E | 61.9 | Low | 59.9 | Low | 128 Ų | 128 | 119.4 Ų | 119.4 | 60% | 0.598 | 69% | 0.686 | S | S | * | * | trans | -86.9 | 114.1 | -179.8 | -81.6 | -167.4 | 149.2 | 0 | 0 | 113.4 | G166 | E164-G166 PolarHBondContact O-N 2.98Š| ||
| 165 | K | 56.5 | Low | 58.6 | Low | 205 Ų | 205 | 121.6 Ų | 121.6 | 89% | 0.891 | 71% | 0.714 | S | S | * | * | trans | -70.9 | 108.7 | 169.5 | -72.4 | 179.3 | -179.4 | 175.2 | 0 | 108.6 | G163 | G163-K165 PolarHBondContact O-N 3.42Š| ||
| 166 | G | 52.6 | Low | 57.6 | Low | 30 Ų | 30 | 128 Ų | 128 | 31% | 0.309 | 73% | 0.733 | S | S | . | * | trans | -57.5 | 169.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | E164 | E164-G166 PolarHBondContact O-N 2.98Š| ||
| 167 | P | 61.7 | Low | 56.2 | Low | 118 Ų | 118 | 124.1 Ų | 124.1 | 77% | 0.766 | 74% | 0.744 | S | S | * | * | S | Bend | trans | -57.1 | 144 | -175.6 | 21.6 | -31.4 | 0 | 0 | 0 | 111.2 | R169 | P167-R169 PolarHBondContact O-N 2.67Š|
| 168 | P | 58.7 | Low | 54.8 | Low | 129 Ų | 129 | 123.5 Ų | 123.5 | 84% | 0.838 | 77% | 0.765 | S | S | * | * | trans | -62.6 | 100.9 | -165.5 | 24.8 | -33.6 | 0 | 0 | 0 | 110 | G170 | P168-G170 PolarHBondContact O-N 3.15Å; P168-G170 VanDerWaalsContact O-N 3.1Å | ||
| 169 | R | 58.9 | Low | 53.7 | Low | 244 Ų | 244 | 123.5 Ų | 123.5 | 92% | 0.921 | 79% | 0.785 | S | S | * | * | trans | -62.2 | 114.1 | 164.9 | -140.8 | 175.6 | -176.7 | 173.8 | 0.2 | 105.2 | P167 G171 | P167-R169 PolarHBondContact O-N 2.67Å; R169-G171 PolarHBondContact O-N 3.42Å | ||
| 170 | G | 46.1 | Very low | 52.6 | Low | 80 Ų | 80 | 130 Ų | 130 | 83% | 0.825 | 79% | 0.794 | S | S | * | * | S | Bend | trans | -49.7 | 131.3 | -169.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | P168 | P168-G170 PolarHBondContact O-N 3.15Å; P168-G170 VanDerWaalsContact O-N 3.1Å |
| 171 | G | 45.7 | Very low | 51.6 | Low | 81 Ų | 81 | 126 Ų | 126 | 84% | 0.835 | 80% | 0.804 | S | S | * | * | trans | 88 | 110.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | R169 | R169-G171 PolarHBondContact O-N 3.42Š| ||
| 172 | G | 42.1 | Very low | 50.6 | Low | 69 Ų | 69 | 126 Ų | 126 | 71% | 0.711 | 82% | 0.819 | S | S | * | * | cis | 167.8 | 170.3 | 7.3 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 173 | R | 49.6 | Very low | 49.4 | Very low | 258 Ų | 258 | 123 Ų | 123 | 97% | 0.974 | 81% | 0.813 | S | S | * | * | trans | 71.5 | 101.3 | 156.3 | -66.9 | 178.8 | 174.2 | 175.1 | -1.4 | 118.3 | ||||
| 174 | G | 44.5 | Very low | 48.1 | Very low | 86 Ų | 86 | 122.9 Ų | 122.9 | 89% | 0.887 | 81% | 0.812 | S | S | * | * | trans | 108.4 | 118.7 | 130.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 175 | G | 43.9 | Very low | 47.4 | Very low | 70 Ų | 70 | 129 Ų | 129 | 72% | 0.722 | 83% | 0.829 | S | S | * | * | cis | 173.6 | 159.7 | 1.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 176 | R | 49.6 | Very low | 46.6 | Very low | 262 Ų | 262 | 123 Ų | 123 | 99% | 0.989 | 83% | 0.826 | S | S | * | * | trans | 63.3 | 83.3 | 147.7 | -64 | 179.1 | 178.1 | 176.6 | -0.7 | 117.6 | ||||
| 177 | G | 43.2 | Very low | 46 | Very low | 84 Ų | 84 | 125.6 Ų | 125.6 | 87% | 0.866 | 85% | 0.852 | S | S | * | * | trans | 172.8 | 123.1 | 151.6 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 178 | G | 43 | Very low | 44.8 | Very low | 83 Ų | 83 | 123.2 Ų | 123.2 | 86% | 0.856 | 85% | 0.85 | S | S | * | * | cis | -161 | 145.1 | -3.3 | 0 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 179 | G | 46.3 | Very low | 44.2 | Very low | 81 Ų | 81 | 129.7 Ų | 129.7 | 84% | 0.835 | 86% | 0.857 | S | S | * | * | trans | -160 | 56.4 | 179.1 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 180 | R | 46.9 | Very low | 43.5 | Very low | 256 Ų | 256 | 121.9 Ų | 121.9 | 97% | 0.966 | 85% | 0.853 | S | S | * | * | trans | -67.8 | 134.6 | 166.6 | -84.6 | 177.8 | 172.7 | 170.7 | -2.8 | 108.3 | ||||
| 181 | G | 42.3 | Very low | 43.2 | Very low | 81 Ų | 81 | 122 Ų | 122 | 84% | 0.835 | 85% | 0.854 | S | S | * | * | trans | 88.1 | 133.2 | 163 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 182 | G | 40.6 | Very low | 42.8 | Very low | 81 Ų | 81 | 121 Ų | 121 | 84% | 0.835 | 84% | 0.844 | S | S | * | * | cis | 173.7 | 148.8 | 9.9 | 0 | 0 | 0 | 0 | 0 | 102.5 | ||||
| 183 | G | 38.2 | Very low | 42.7 | Very low | 77 Ų | 77 | 127.1 Ų | 127.1 | 79% | 0.794 | 85% | 0.851 | S | S | * | * | cis | 157.3 | 156.5 | 27.7 | 0 | 0 | 0 | 0 | 0 | 105 | ||||
| 184 | G | 38.2 | Very low | 42.7 | Very low | 77 Ų | 77 | 126.8 Ų | 126.8 | 79% | 0.794 | 85% | 0.85 | S | S | * | * | trans | 72.1 | 83.3 | 149.1 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 185 | R | 47.6 | Very low | 42.5 | Very low | 257 Ų | 257 | 126.5 Ų | 126.5 | 97% | 0.97 | 85% | 0.848 | S | S | * | * | -151.3 | 99.3 | 129.1 | -63.7 | -167.8 | -178.3 | 170.1 | -1.5 | 105.3 | |||||
| 186 | G | 39.7 | Very low | 42.3 | Very low | 80 Ų | 80 | 126.8 Ų | 126.8 | 83% | 0.825 | 85% | 0.851 | S | S | * | * | cis | 90.1 | 98.9 | 48.3 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 187 | G | 38.7 | Very low | 42.2 | Very low | 83 Ų | 83 | 124 Ų | 124 | 86% | 0.856 | 84% | 0.84 | S | S | * | * | trans | 92.1 | 123 | 172 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 188 | G | 37.4 | Very low | 42.2 | Very low | 69 Ų | 69 | 123 Ų | 123 | 71% | 0.711 | 83% | 0.829 | S | S | * | * | cis | 141.7 | 155.1 | 17.9 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 189 | R | 46.4 | Very low | 42.2 | Very low | 264 Ų | 264 | 122 Ų | 122 | 100% | 0.996 | 82% | 0.819 | S | S | * | * | trans | 89.4 | 121.2 | 167.3 | -53.2 | 174.4 | 178.2 | -178.7 | -1.3 | 116.5 | ||||
| 190 | G | 43.4 | Very low | 42 | Very low | 81 Ų | 81 | 122.1 Ų | 122.1 | 84% | 0.835 | 82% | 0.82 | S | S | * | * | trans | 111.2 | 75.2 | 173.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 191 | G | 40.9 | Very low | 41.8 | Very low | 82 Ų | 82 | 113.8 Ų | 113.8 | 85% | 0.845 | 81% | 0.814 | S | S | * | * | cis | 95 | 130.3 | 44.3 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 192 | G | 36.9 | Very low | 41.7 | Very low | 61 Ų | 61 | 114.1 Ų | 114.1 | 63% | 0.629 | 82% | 0.818 | S | S | * | * | trans | 109.7 | 65.7 | 160.2 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 193 | F | 40 | Very low | 41.6 | Very low | 196 Ų | 196 | 113.9 Ų | 113.9 | 86% | 0.86 | 82% | 0.815 | S | S | * | * | 34.6 | 142.3 | 125 | -54.2 | -78.2 | 0 | 0 | 0 | 121.2 | |||||
| 194 | R | 49.3 | Very low | 42 | Very low | 251 Ų | 251 | 120.6 Ų | 120.6 | 95% | 0.947 | 82% | 0.823 | S | S | * | * | trans | 94.3 | 103.4 | 169.6 | -56 | 176.1 | -162.2 | -165.1 | 4.6 | 112.1 | ||||
| 195 | G | 39.2 | Very low | 42.6 | Very low | 81 Ų | 81 | 128.9 Ų | 128.9 | 84% | 0.835 | 83% | 0.83 | S | S | * | * | cis | 107.6 | 122 | 32.9 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 196 | G | 40.8 | Very low | 42.2 | Very low | 76 Ų | 76 | 120.4 Ų | 120.4 | 78% | 0.784 | 82% | 0.823 | S | S | * | * | trans | 98.1 | 99 | 173 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 197 | R | 47.2 | Very low | 42.3 | Very low | 204 Ų | 204 | 120.1 Ų | 120.1 | 77% | 0.77 | 82% | 0.819 | S | S | * | * | 70.7 | 113.2 | 56.2 | -157.9 | 178.8 | -171 | 170.2 | 2.2 | 113.1 | R22 | R22-R197 PolarHBondContact O-NH2 3.3Š| |||
| 198 | G | 44.1 | Very low | 42.4 | Very low | 61 Ų | 61 | 128.5 Ų | 128.5 | 63% | 0.629 | 83% | 0.825 | S | S | * | * | trans | 141 | 99.9 | 168.6 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 199 | G | 41.7 | Very low | 42.6 | Very low | 62 Ų | 62 | 129.1 Ų | 129.1 | 64% | 0.639 | 83% | 0.831 | S | S | * | * | 95.5 | 121.4 | 62.3 | 0 | 0 | 0 | 0 | 0 | 107 | |||||
| 200 | G | 42.6 | Very low | 42.3 | Very low | 85 Ų | 85 | 119.2 Ų | 119.2 | 88% | 0.876 | 81% | 0.811 | S | S | * | * | cis | 120 | 105.4 | 35.6 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 201 | G | 42.5 | Very low | 42.2 | Very low | 81 Ų | 81 | 119.2 Ų | 119.2 | 84% | 0.835 | 81% | 0.812 | S | S | * | * | trans | 179.1 | 119.1 | 169.2 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 202 | G | 40.1 | Very low | 42.6 | Very low | 88 Ų | 88 | 125.3 Ų | 125.3 | 91% | 0.907 | 82% | 0.815 | S | S | * | * | cis | 118 | 105.8 | 26.3 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 203 | G | 38.9 | Very low | 43.3 | Very low | 75 Ų | 75 | 134 Ų | 134 | 77% | 0.773 | 83% | 0.829 | S | S | * | * | trans | 167.1 | 69.7 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | R205 | G203-R205 PolarHBondContact O-N 3.04Š| ||
| 204 | F | 46.1 | Very low | 44 | Very low | 219 Ų | 219 | 128.5 Ų | 128.5 | 96% | 0.961 | 83% | 0.828 | S | S | * | * | trans | -65.4 | 112.5 | 160.7 | -66 | -95.7 | 0 | 0 | 0 | 109 | ||||
| 205 | R | 50.9 | Low | 43.9 | Very low | 250 Ų | 250 | 128.6 Ų | 128.6 | 94% | 0.943 | 83% | 0.828 | S | S | * | * | trans | -111.9 | 99.5 | 149.7 | -82.2 | -168.2 | -167.4 | -175.8 | 5.1 | 107.7 | G203 | G203-R205 PolarHBondContact O-N 3.04Š| ||
| 206 | G | 39.3 | Very low | 44 | Very low | 80 Ų | 80 | 127.4 Ų | 127.4 | 83% | 0.825 | 82% | 0.816 | S | S | * | * | trans | -64.8 | 163.2 | 158.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 207 | G | 41.1 | Very low | 44 | Very low | 73 Ų | 73 | 137 Ų | 137 | 75% | 0.753 | 84% | 0.84 | S | S | * | * | trans | 143 | 79 | 176.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 208 | R | 41.5 | Very low | 43.8 | Very low | 260 Ų | 260 | 133.6 Ų | 133.6 | 98% | 0.981 | 84% | 0.843 | S | S | * | * | 65.5 | 100.6 | 89.3 | -165.2 | 179.3 | -173 | 170.6 | 1.6 | 112 | |||||
| 209 | G | 42 | Very low | 43.8 | Very low | 81 Ų | 81 | 137.4 Ų | 137.4 | 84% | 0.835 | 86% | 0.855 | S | S | * | * | trans | 167.6 | 109.7 | 163.4 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 210 | G | 40.4 | Very low | 43.9 | Very low | 56 Ų | 56 | 141.6 Ų | 141.6 | 58% | 0.577 | 87% | 0.867 | S | S | * | * | cis | 157.2 | 111.1 | 14.2 | 0 | 0 | 0 | 0 | 0 | 102.7 | F212 | G210-F212 PolarHBondContact O-N 3.38Š| ||
| 211 | G | 41 | Very low | 44 | Very low | 82 Ų | 82 | 144.9 Ų | 144.9 | 85% | 0.845 | 87% | 0.866 | S | S | * | * | trans | -62 | 117.6 | 179.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | R213 | G211-R213 PolarHBondContact O-N 3.43Š| ||
| 212 | F | 49.1 | Very low | 44.1 | Very low | 209 Ų | 209 | 148.9 Ų | 148.9 | 92% | 0.917 | 87% | 0.868 | S | S | * | * | trans | -88 | 93.7 | 160.2 | -75.8 | -86.6 | 0 | 0 | 0 | 107.6 | G210 G214 | G210-F212 PolarHBondContact O-N 3.38Å; F212-G214 PolarHBondContact O-N 2.81Å | ||
| 213 | R | 51.3 | Low | 44.4 | Very low | 244 Ų | 244 | 153 Ų | 153 | 92% | 0.921 | 87% | 0.865 | S | S | * | * | trans | -60.8 | 111.7 | 159.9 | -81 | 178.8 | 175.1 | 170.6 | -2.5 | 107.8 | G211 R215 | G211-R213 PolarHBondContact O-N 3.43Å; R213-R215 PolarHBondContact O-N 3.48Å; R213-R215 VanDerWaalsContact O-N 3.16Å | ||
| 214 | G | 55.5 | Low | 44.8 | Very low | 81 Ų | 81 | 158.6 Ų | 158.6 | 84% | 0.835 | 87% | 0.872 | S | S | * | * | trans | -70.2 | 100.2 | 162.7 | 0 | 0 | 0 | 0 | 0 | 110 | F212 | F212-G214 PolarHBondContact O-N 2.81Š| ||
| 215 | R | 47.1 | Very low | 44.7 | Very low | 252 Ų | 252 | 153.9 Ų | 153.9 | 95% | 0.951 | 87% | 0.865 | S | S | * | * | trans | -62.1 | 142.1 | 151.8 | -147.9 | -174.8 | -169.7 | -168.1 | 1.9 | 106.3 | R213 | R213-R215 PolarHBondContact O-N 3.48Å; R213-R215 VanDerWaalsContact O-N 3.16Å | ||
| 216 | G | 40.1 | Very low | 44.2 | Very low | 57 Ų | 57 | 145.9 Ų | 145.9 | 59% | 0.588 | 86% | 0.859 | S | S | * | * | cis | 158.8 | 132.2 | 7 | 0 | 0 | 0 | 0 | 0 | 105.1 | ||||
| 217 | H | 41.6 | Very low | 44.6 | Very low | 276 Ų | 276 | 151.9 Ų | 151.9 | 100% | 1.278 | 86% | 0.862 | S | S | * | * | trans | -159.3 | 0 | 149.7 | -90.9 | -44 | 0 | 0 | 0 | 107.1 |
Retrieved 217 of 217 residues in 222.8 ms
(Link to these results)