| 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 | 40.7 | Very low | 51.8 | Low | 245 Ų | 245 | 133.8 Ų | 133.8 | 100% | 1.207 | 83% | 0.827 | S | S | * | * | 0 | 142.5 | 0 | -71.8 | -155.3 | 179.5 | 0 | 0 | 108.7 | |||||
| 2 | A | 47.7 | Very low | 51.3 | Low | 90 Ų | 90 | 137.2 Ų | 137.2 | 74% | 0.744 | 83% | 0.829 | S | S | * | * | trans | 68.5 | 93.6 | 172.4 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 3 | T | 59.1 | Low | 50.2 | Low | 137 Ų | 137 | 134.8 Ų | 134.8 | 84% | 0.84 | 83% | 0.834 | S | S | * | * | 71.9 | 125.3 | 86.1 | 55.8 | 0 | 0 | 0 | 0 | 116 | |||||
| 4 | P | 55.6 | Low | 49.9 | Very low | 135 Ų | 135 | 133 Ų | 133 | 88% | 0.877 | 83% | 0.828 | S | S | * | * | trans | -92 | 155.2 | 179.2 | 37.2 | -32.6 | 0 | 0 | 0 | 112.5 | ||||
| 5 | A | 55.8 | Low | 49.4 | Very low | 99 Ų | 99 | 135.3 Ų | 135.3 | 82% | 0.818 | 83% | 0.833 | S | S | * | * | trans | -130.1 | 126 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 6 | A | 51.6 | Low | 49.6 | Very low | 93 Ų | 93 | 137 Ų | 137 | 77% | 0.769 | 83% | 0.833 | S | S | * | * | trans | 39.6 | 121.4 | 149.6 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 7 | V | 50 | Low | 49.4 | Very low | 137 Ų | 137 | 136 Ų | 136 | 83% | 0.83 | 83% | 0.83 | S | S | * | * | cis | 55.5 | 84.7 | 44.2 | -148.2 | 0 | 0 | 0 | 0 | 115 | ||||
| 8 | N | 50.3 | Low | 48.7 | Very low | 153 Ų | 153 | 133.4 Ų | 133.4 | 82% | 0.818 | 84% | 0.835 | S | S | * | * | -172.4 | 146.3 | 125.2 | -131.2 | -111.2 | 0 | 0 | 0 | 113.1 | |||||
| 9 | P | 55.2 | Low | 48.4 | Very low | 85 Ų | 85 | 131.6 Ų | 131.6 | 55% | 0.552 | 83% | 0.827 | S | S | * | * | trans | -91.6 | 173.6 | -179.4 | 38.7 | -33.8 | 0 | 0 | 0 | 112.5 | E11 | P9-E11 HydrophobicContact CG-CG 4.46Š| ||
| 10 | P | 57.9 | Low | 48.1 | Very low | 136 Ų | 136 | 131 Ų | 131 | 88% | 0.883 | 82% | 0.822 | S | S | * | * | trans | -90.7 | 106.9 | 156.2 | 31.4 | -25.2 | 0 | 0 | 0 | 110.2 | ||||
| 11 | E | 45.4 | Very low | 47.5 | Very low | 162 Ų | 162 | 131.2 Ų | 131.2 | 76% | 0.757 | 82% | 0.822 | S | S | * | * | trans | -88.2 | 156.4 | 157.4 | -71 | -126.9 | 113.8 | 0 | 0 | 110.4 | P9 | P9-E11 HydrophobicContact CG-CG 4.46Š| ||
| 12 | M | 46.5 | Very low | 47.5 | Very low | 174 Ų | 174 | 127.4 Ų | 127.4 | 86% | 0.857 | 81% | 0.806 | S | S | * | * | trans | 69.9 | 100.6 | 149.4 | 81.9 | -150.4 | -166.9 | 0 | 0 | 120.8 | ||||
| 13 | A | 37 | Very low | 47.5 | Very low | 107 Ų | 107 | 129.5 Ų | 129.5 | 88% | 0.884 | 81% | 0.812 | S | S | * | * | trans | -140.7 | 88.4 | 134.6 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 14 | S | 46.5 | Very low | 46.3 | Very low | 109 Ų | 109 | 129.9 Ų | 129.9 | 76% | 0.762 | 81% | 0.814 | S | S | * | * | trans | -89.8 | 119.1 | 164.9 | -61.1 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 15 | D | 41.8 | Very low | 45.5 | Very low | 167 Ų | 167 | 127.3 Ų | 127.3 | 89% | 0.893 | 81% | 0.805 | S | S | * | * | trans | -152.3 | 100 | 156.4 | -88.6 | -59.1 | 0 | 0 | 0 | 110.2 | ||||
| 16 | I | 52.8 | Low | 45.3 | Very low | 163 Ų | 163 | 127.2 Ų | 127.2 | 84% | 0.836 | 80% | 0.796 | S | S | * | * | trans | -129.6 | 137.8 | 157.7 | -61.4 | -178.9 | 0 | 0 | 0 | 102.5 | ||||
| 17 | P | 45.5 | Very low | 44.7 | Very low | 120 Ų | 120 | 131 Ų | 131 | 78% | 0.779 | 80% | 0.799 | S | S | * | * | cis | -143.9 | 161.4 | 42.1 | 25.5 | -0.4 | 0 | 0 | 0 | 116.7 | ||||
| 18 | G | 37.2 | Very low | 44 | Very low | 89 Ų | 89 | 128.7 Ų | 128.7 | 92% | 0.918 | 80% | 0.795 | S | S | * | * | trans | -120.9 | 97.4 | 164 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 19 | S | 42.6 | Very low | 43.3 | Very low | 99 Ų | 99 | 125.5 Ų | 125.5 | 69% | 0.692 | 79% | 0.79 | S | S | * | * | trans | -111.3 | 125.6 | 176.4 | 160.9 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 20 | V | 42.8 | Very low | 42.6 | Very low | 120 Ų | 120 | 128.7 Ų | 128.7 | 73% | 0.727 | 81% | 0.808 | S | S | * | * | trans | 47.7 | 126.6 | 144.9 | 94.2 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 21 | T | 34.7 | Very low | 41.4 | Very low | 135 Ų | 135 | 125.1 Ų | 125.1 | 83% | 0.828 | 80% | 0.795 | S | S | * | * | 164.7 | 143.6 | 122.3 | 36.9 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 22 | L | 41.3 | Very low | 41.1 | Very low | 165 Ų | 165 | 126.3 Ų | 126.3 | 86% | 0.864 | 80% | 0.801 | S | S | * | * | trans | -71.2 | 167.2 | 173.8 | -66.6 | 161.4 | 0 | 0 | 0 | 112.5 | ||||
| 23 | P | 48 | Very low | 41 | Very low | 134 Ų | 134 | 124.5 Ų | 124.5 | 87% | 0.87 | 80% | 0.8 | S | S | * | * | -146.3 | -179.6 | 117.2 | 33.8 | -14.3 | 0 | 0 | 0 | 115.9 | |||||
| 24 | V | 34.3 | Very low | 41.1 | Very low | 145 Ų | 145 | 130.5 Ų | 130.5 | 88% | 0.879 | 80% | 0.799 | S | S | * | * | trans | -86.6 | 168.9 | -155.9 | 89.1 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 25 | A | 38.2 | Very low | 40.7 | Very low | 82 Ų | 82 | 134.5 Ų | 134.5 | 68% | 0.678 | 81% | 0.808 | S | S | * | * | trans | -59.6 | 178.3 | -177.7 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 26 | P | 51.2 | Low | 40.9 | Very low | 97 Ų | 97 | 131.6 Ų | 131.6 | 63% | 0.63 | 81% | 0.807 | S | S | * | * | -155.2 | 173.2 | 71.7 | 31.3 | -5.3 | 0 | 0 | 0 | 119.2 | |||||
| 27 | M | 39.7 | Very low | 40.2 | Very low | 172 Ų | 172 | 127.1 Ų | 127.1 | 85% | 0.847 | 80% | 0.802 | S | S | * | * | trans | 66.4 | 147.8 | 149.8 | 82.3 | -131 | 156.1 | 0 | 0 | 120.5 | ||||
| 28 | A | 34.8 | Very low | 40 | Very low | 89 Ų | 89 | 125.8 Ų | 125.8 | 74% | 0.736 | 80% | 0.801 | S | S | * | * | cis | -159.7 | 137.2 | 7.3 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 29 | A | 36.8 | Very low | 40.7 | Very low | 86 Ų | 86 | 129.5 Ų | 129.5 | 71% | 0.711 | 80% | 0.796 | S | S | * | * | 89.2 | 138.9 | 107.9 | 0 | 0 | 0 | 0 | 0 | 118 | |||||
| 30 | T | 39.1 | Very low | 41.1 | Very low | 151 Ų | 151 | 131.4 Ų | 131.4 | 93% | 0.926 | 81% | 0.806 | S | S | * | * | trans | 76.9 | 130.1 | 172.8 | 74.8 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 31 | G | 34.5 | Very low | 41.2 | Very low | 61 Ų | 61 | 130 Ų | 130 | 63% | 0.629 | 81% | 0.807 | S | S | * | * | cis | 160.1 | 146.1 | 4.3 | 0 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 32 | Q | 39 | Very low | 41.7 | Very low | 188 Ų | 188 | 135.4 Ų | 135.4 | 88% | 0.879 | 81% | 0.812 | S | S | * | * | trans | 73.7 | 145.5 | 164.5 | -54.9 | -179.9 | -35.9 | 0 | 0 | 116.3 | ||||
| 33 | V | 42.5 | Very low | 41.9 | Very low | 136 Ų | 136 | 131.1 Ų | 131.1 | 82% | 0.824 | 81% | 0.808 | S | S | * | * | cis | -162.8 | 159.6 | -7.4 | -101.5 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 34 | R | 40.8 | Very low | 41.9 | Very low | 233 Ų | 233 | 128 Ų | 128 | 88% | 0.879 | 80% | 0.8 | S | S | * | * | trans | -54 | 141.4 | 179.6 | -59.3 | 162.9 | 173.1 | 173.5 | -4.6 | 113.9 | ||||
| 35 | M | 38.3 | Very low | 42.4 | Very low | 192 Ų | 192 | 131.1 Ų | 131.1 | 95% | 0.946 | 80% | 0.801 | S | S | * | * | trans | -147.1 | 125.2 | 137.6 | -86.2 | -54.7 | 177.8 | 0 | 0 | 110.3 | ||||
| 36 | A | 44.4 | Very low | 42.9 | Very low | 106 Ų | 106 | 138 Ų | 138 | 88% | 0.876 | 81% | 0.81 | S | S | * | * | trans | -90.2 | 130.1 | 167.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 37 | G | 39 | Very low | 43.1 | Very low | 70 Ų | 70 | 144.9 Ų | 144.9 | 72% | 0.722 | 82% | 0.823 | S | S | * | * | trans | -156.5 | 99.1 | 165.6 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 38 | A | 41.9 | Very low | 43.5 | Very low | 92 Ų | 92 | 141.3 Ų | 141.3 | 76% | 0.76 | 82% | 0.815 | S | S | * | * | 71.8 | 102.5 | 88.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 39 | M | 51.1 | Low | 44.5 | Very low | 167 Ų | 167 | 140 Ų | 140 | 82% | 0.823 | 81% | 0.81 | S | S | * | * | trans | 79.1 | 108.8 | 150.5 | -48 | -55 | 174.6 | 0 | 0 | 119.9 | A41 | M39-A41 PolarHBondContact O-N 3.23Š| ||
| 40 | P | 50.2 | Low | 45.5 | Very low | 138 Ų | 138 | 142.8 Ų | 142.8 | 90% | 0.896 | 81% | 0.81 | S | S | * | * | trans | -73.4 | 98.3 | 147 | 29.4 | -29 | 0 | 0 | 0 | 109 | R42 | P40-R42 PolarHBondContact O-N 3.2Š| ||
| 41 | A | 46.3 | Very low | 45.6 | Very low | 90 Ų | 90 | 142.9 Ų | 142.9 | 74% | 0.744 | 81% | 0.805 | S | S | * | * | trans | -71.8 | 107.5 | 169.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | M39 | M39-A41 PolarHBondContact O-N 3.23Š| ||
| 42 | R | 45.3 | Very low | 46.1 | Very low | 250 Ų | 250 | 149 Ų | 149 | 94% | 0.943 | 82% | 0.815 | S | S | * | * | 50.7 | 91.2 | 124.7 | -167.3 | 171.2 | 175.8 | 156.1 | -3.9 | 116 | P40 | P40-R42 PolarHBondContact O-N 3.2Š| |||
| 43 | G | 44.3 | Very low | 46.9 | Very low | 74 Ų | 74 | 146.2 Ų | 146.2 | 76% | 0.763 | 81% | 0.806 | S | S | * | * | trans | -155.5 | 20.6 | 163.9 | 0 | 0 | 0 | 0 | 0 | 114 | K45 | G43-K45 PolarHBondContact O-N 3.27Š| ||
| 44 | G | 49.2 | Very low | 47.5 | Very low | 68 Ų | 68 | 147.8 Ų | 147.8 | 70% | 0.701 | 81% | 0.81 | S | S | * | * | trans | -59.1 | 104.1 | 167.3 | 0 | 0 | 0 | 0 | 0 | 108.3 | R46 | G44-R46 PolarHBondContact O-N 3.36Š| ||
| 45 | K | 44.6 | Very low | 48.4 | Very low | 211 Ų | 211 | 144.4 Ų | 144.4 | 92% | 0.917 | 80% | 0.804 | S | S | * | * | trans | -68.2 | 79.9 | 162.7 | -154.9 | 88.2 | 156.3 | -171.1 | 0 | 105.3 | G43 R47 | G43-K45 PolarHBondContact O-N 3.27Å; K45-R47 PolarHBondContact O-N 3.15Å; K45-R47 VanDerWaalsContact O-N 3.17Å | ||
| 46 | R | 47.1 | Very low | 49.3 | Very low | 226 Ų | 226 | 143.1 Ų | 143.1 | 85% | 0.853 | 80% | 0.801 | S | S | * | * | trans | -45.5 | 122 | 167.9 | -66.5 | 167.9 | 70.2 | -171.5 | 2.1 | 105.5 | G44 S48 | G44-R46 PolarHBondContact O-N 3.36Å; R46-S48 PolarHBondContact O-N 3.44Å | ||
| 47 | R | 55.4 | Low | 49.6 | Very low | 243 Ų | 243 | 141 Ų | 141 | 92% | 0.917 | 79% | 0.79 | S | S | * | * | trans | -16.4 | 102.8 | 153 | -61.7 | 170.6 | 179.1 | 179.2 | -2.7 | 109.4 | K45 G49 | K45-R47 PolarHBondContact O-N 3.15Å; K45-R47 VanDerWaalsContact O-N 3.17Å; R47-G49 VanDerWaalsContact C-N 3.3Å; R47-G49 PolarHBondContact O-N 2.91Å | ||
| 48 | S | 48.2 | Very low | 50.2 | Low | 96 Ų | 96 | 147 Ų | 147 | 67% | 0.671 | 80% | 0.799 | S | S | * | * | trans | -61.9 | 105.5 | 146.1 | 51.2 | 0 | 0 | 0 | 0 | 103 | R46 M50 | R46-S48 PolarHBondContact O-N 3.44Å; S48-M50 VanDerWaalsContact C-N 3.28Å | ||
| 49 | G | 55.5 | Low | 50.7 | Low | 61 Ų | 61 | 145.1 Ų | 145.1 | 63% | 0.629 | 79% | 0.789 | S | S | * | * | 66.2 | 43.3 | 57.9 | 0 | 0 | 0 | 0 | 0 | 108.2 | R47 | R47-G49 VanDerWaalsContact C-N 3.3Å; R47-G49 PolarHBondContact O-N 2.91Å | |||
| 50 | M | 57.9 | Low | 50.8 | Low | 145 Ų | 145 | 141.6 Ų | 141.6 | 71% | 0.714 | 78% | 0.778 | S | S | * | * | trans | -91.2 | 103.9 | 146.5 | -78.2 | 76.8 | -174.8 | 0 | 0 | 103.8 | S48 F52 | S48-M50 VanDerWaalsContact C-N 3.28Å; M50-F52 PolarHBondContact O-N 2.95Å | ||
| 51 | D | 43 | Very low | 51.1 | Low | 154 Ų | 154 | 140 Ų | 140 | 82% | 0.824 | 77% | 0.77 | S | S | * | * | trans | -42.5 | 107.9 | 160 | -71.2 | -99.9 | 0 | 0 | 0 | 108.1 | D53 | D51-D53 VanDerWaalsContact C-N 3.29Å; D51-D53 PolarHBondContact O-N 2.96Å; D51-D53 VanDerWaalsContact O-N 3.17Å | ||
| 52 | F | 45.1 | Very low | 51.3 | Low | 189 Ų | 189 | 143.4 Ų | 143.4 | 83% | 0.829 | 77% | 0.768 | S | S | * | * | trans | -73.6 | 99.2 | 159.8 | -83 | -93.9 | 0 | 0 | 0 | 104.2 | M50 D54 | M50-F52 PolarHBondContact O-N 2.95Å; F52-D54 VanDerWaalsContact C-N 3.3Å; F52-D54 PolarHBondContact O-N 3.1Å | ||
| 53 | D | 55.1 | Low | 51.3 | Low | 129 Ų | 129 | 138.8 Ų | 138.8 | 69% | 0.69 | 76% | 0.755 | S | S | * | * | trans | -59.1 | 100.3 | 163.4 | -154.2 | -115.8 | 0 | 0 | 0 | 106.2 | D51 E55 | D51-D53 VanDerWaalsContact C-N 3.29Å; D51-D53 PolarHBondContact O-N 2.96Å; D51-D53 VanDerWaalsContact O-N 3.17Å; D53-E55 PolarHBondContact O-N 3.37Å; D53-E55 WeakPolarHBondContact OD1-CB 3.15Å | ||
| 54 | D | 55.8 | Low | 51.8 | Low | 169 Ų | 169 | 138.3 Ų | 138.3 | 90% | 0.904 | 74% | 0.74 | S | S | * | * | trans | -70.4 | 62.9 | 168.7 | -111.5 | -75.1 | 0 | 0 | 0 | 107.3 | F52 | F52-D54 VanDerWaalsContact C-N 3.3Å; F52-D54 PolarHBondContact O-N 3.1Å | ||
| 55 | E | 58.3 | Low | 52 | Low | 162 Ų | 162 | 144.8 Ų | 144.8 | 76% | 0.757 | 74% | 0.744 | S | S | * | * | trans | -98.2 | 104 | 166.3 | -148.8 | -167.8 | 122.2 | 0 | 0 | 108 | D53 G57 | D53-E55 PolarHBondContact O-N 3.37Å; D53-E55 WeakPolarHBondContact OD1-CB 3.15Å; E55-G57 PolarHBondContact O-N 3.31Å | ||
| 56 | D | 58.6 | Low | 52.2 | Low | 165 Ų | 165 | 140.9 Ų | 140.9 | 88% | 0.882 | 73% | 0.729 | S | S | * | * | trans | -12.9 | 107.2 | 164.4 | -165.1 | -164.2 | 0 | 0 | 0 | 115.3 | ||||
| 57 | G | 48.8 | Very low | 52.9 | Low | 63 Ų | 63 | 134.2 Ų | 134.2 | 65% | 0.649 | 71% | 0.71 | S | S | * | * | trans | -168.4 | 72.7 | -179.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | E55 G59 | E55-G57 PolarHBondContact O-N 3.31Å; G57-G59 PolarHBondContact O-N 3.49Å | ||
| 58 | E | 52 | Low | 53.6 | Low | 195 Ų | 195 | 128.8 Ų | 128.8 | 91% | 0.911 | 69% | 0.694 | S | S | * | * | trans | -16.1 | 102.2 | 160.1 | -173.8 | 101.7 | 95.6 | 0 | 0 | 112.8 | ||||
| 59 | G | 52.3 | Low | 54.8 | Low | 53 Ų | 53 | 126.9 Ų | 126.9 | 55% | 0.546 | 68% | 0.681 | S | S | . | * | trans | -81.4 | 146.5 | -166.9 | 0 | 0 | 0 | 0 | 0 | 115 | G57 | G57-G59 PolarHBondContact O-N 3.49Š| ||
| 60 | P | 53 | Low | 55.7 | Low | 92 Ų | 92 | 127.4 Ų | 127.4 | 60% | 0.597 | 67% | 0.667 | S | S | * | * | trans | -103.7 | 14.8 | 150.1 | 36.2 | -29.9 | 0 | 0 | 0 | 112.2 | S64 | P60-S64 WeakPolarHBondContact O-CB 3.5Å; P60-S64 PolarHBondContact O-N 3.32Å; P60-S64 PolarHBondContact O-OG 3.28Å | ||
| 61 | S | 58.3 | Low | 56.5 | Low | 104 Ų | 104 | 124 Ų | 124 | 73% | 0.727 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.5 | -33.4 | -165.7 | 177.4 | 0 | 0 | 0 | 0 | 115.6 | ||
| 62 | K | 49.8 | Very low | 58.4 | Low | 163 Ų | 163 | 118 Ų | 118 | 71% | 0.709 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.2 | -42.5 | -178.9 | 45 | -169.8 | 169.2 | -174.1 | 0 | 113.1 | R65 E66 | K62-R65 PolarHBondContact O-N 3.22Å; K62-E66 WeakPolarHBondContact O-CB 3.44Å; K62-E66 PolarHBondContact O-N 2.98Å; K62-E66 VanDerWaalsContact O-N 3.08Å |
| 63 | F | 45.6 | Very low | 60.1 | Low | 152 Ų | 152 | 115.5 Ų | 115.5 | 67% | 0.667 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -67.8 | -38.7 | 176.5 | -73.8 | -78.5 | 0 | 0 | 0 | 113.1 | R65 E66 N67 | F63-R65 VanDerWaalsContact C-N 3.33Å; F63-R65 PolarHBondContact O-N 2.98Å; F63-E66 PolarHBondContact O-N 3.42Å; F63-N67 WeakPolarHBondContact O-CB 3.44Å; F63-N67 PolarHBondContact O-N 3.21Å |
| 64 | S | 54.4 | Low | 61.5 | Low | 64 Ų | 64 | 116.8 Ų | 116.8 | 45% | 0.448 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -68.8 | -33 | 178 | -52.7 | 0 | 0 | 0 | 0 | 112.5 | P60 H68 | P60-S64 WeakPolarHBondContact O-CB 3.5Å; P60-S64 PolarHBondContact O-N 3.32Å; P60-S64 PolarHBondContact O-OG 3.28Å; S64-H68 WeakPolarHBondContact O-CB 3.35Å; S64-H68 PolarHBondContact O-N 3.5Å |
| 65 | R | 52.8 | Low | 62.8 | Low | 205 Ų | 205 | 115.3 Ų | 115.3 | 77% | 0.774 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -73.2 | -38.4 | 177.3 | -169.3 | 170 | 160.3 | -160.8 | -5.4 | 111.7 | K62 F63 S69 | K62-R65 PolarHBondContact O-N 3.22Å; F63-R65 VanDerWaalsContact C-N 3.33Å; F63-R65 PolarHBondContact O-N 2.98Å; R65-S69 PolarHBondContact O-N 3.35Å; R65-S69 VanDerWaalsContact O-N 3.09Å |
| 66 | E | 49.4 | Very low | 64.3 | Low | 129 Ų | 129 | 114.8 Ų | 114.8 | 60% | 0.603 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -70 | -42.4 | 173.7 | -170.8 | 156.3 | -149 | 0 | 0 | 111.9 | K62 F63 H68 S69 E70 | K62-E66 WeakPolarHBondContact O-CB 3.44Å; K62-E66 PolarHBondContact O-N 2.98Å; K62-E66 VanDerWaalsContact O-N 3.08Å; F63-E66 PolarHBondContact O-N 3.42Å; E66-H68 PolarHBondContact O-N 3.38Å; E66-S69 WeakPolarHBondContact O-CB 3.19Å; E66-S69 PolarHBondContact O-N 3.29Å; E66-S69 PolarHBondContact O-OG 3.07Å; E66-E70 PolarHBondContact O-N 3.32Å |
| 67 | N | 61.6 | Low | 65.7 | Low | 86 Ų | 86 | 111.9 Ų | 111.9 | 46% | 0.46 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -63.1 | -41.6 | 174.4 | -169.7 | -90.2 | 0 | 0 | 0 | 111.9 | F63 S69 E70 I71 | F63-N67 WeakPolarHBondContact O-CB 3.44Å; F63-N67 PolarHBondContact O-N 3.21Å; N67-S69 VanDerWaalsContact C-N 3.33Å; N67-S69 PolarHBondContact O-N 3.29Å; N67-E70 PolarHBondContact O-N 3.44Å; N67-E70 VanDerWaalsContact O-N 3.16Å; N67-I71 WeakPolarHBondContact O-CG1 3.09Å; N67-I71 PolarHBondContact O-N 3.46Å; N67-I71 WeakPolarHBondContact OD1-CD1 3.39Å |
| 68 | H | 70.9 | Confident | 67.6 | Low | 128 Ų | 128 | 114.2 Ų | 114.2 | 59% | 0.593 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -62.8 | -39.9 | 173.7 | -170.9 | 69.5 | 0 | 0 | 0 | 111.9 | S64 E66 E70 E72 | S64-H68 WeakPolarHBondContact O-CB 3.35Å; S64-H68 PolarHBondContact O-N 3.5Å; E66-H68 PolarHBondContact O-N 3.38Å; H68-E70 VanDerWaalsContact C-N 3.29Å; H68-E70 PolarHBondContact O-N 3.06Å; H68-E72 VanDerWaalsContact O-CB 3.23Å; H68-E72 WeakPolarHBondContact O-CB 3.31Å; H68-E72 PolarHBondContact O-N 2.84Å |
| 69 | S | 72.4 | Confident | 69.3 | Low | 57 Ų | 57 | 109.1 Ų | 109.1 | 40% | 0.399 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -65.2 | -32.8 | 174.8 | 82 | 0 | 0 | 0 | 0 | 112.9 | R65 E66 N67 R73 | R65-S69 PolarHBondContact O-N 3.35Å; R65-S69 VanDerWaalsContact O-N 3.09Å; E66-S69 WeakPolarHBondContact O-CB 3.19Å; E66-S69 PolarHBondContact O-N 3.29Å; E66-S69 PolarHBondContact O-OG 3.07Å; N67-S69 VanDerWaalsContact C-N 3.33Å; N67-S69 PolarHBondContact O-N 3.29Å; S69-R73 WeakPolarHBondContact O-CB 3.48Å; S69-R73 PolarHBondContact O-N 3.13Å |
| 70 | E | 74.8 | Confident | 71 | Confident | 71 Ų | 71 | 109.1 Ų | 109.1 | 33% | 0.332 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -74.9 | -44.3 | 177.5 | -172.6 | 177.6 | -175 | 0 | 0 | 112.4 | E66 N67 H68 E72 R73 R74 | E66-E70 PolarHBondContact O-N 3.32Å; N67-E70 PolarHBondContact O-N 3.44Å; N67-E70 VanDerWaalsContact O-N 3.16Å; H68-E70 VanDerWaalsContact C-N 3.29Å; H68-E70 PolarHBondContact O-N 3.06Å; E70-E72 VanDerWaalsContact C-N 3.31Å; E70-E72 PolarHBondContact O-N 3.3Å; E70-R73 WeakPolarHBondContact O-CB 3.29Å; E70-R73 PolarHBondContact O-N 3.4Å; E70-R74 WeakPolarHBondContact O-CG 3.4Å; E70-R74 PolarHBondContact O-N 2.86Å; E70-R74 IonicContact OE1-CZ 3.45Å; E70-R74 IonicContact OE1-NE 3.54Å; E70-R74 IonicContact OE1-NH2 2.97Å; E70-R74 PolarHBondContact OE1-NH2 2.89Å; E70-R74 IonicContact OE2-NH2 2.68Å |
| 71 | I | 75.2 | Confident | 72.9 | Confident | 73 Ų | 73 | 109.7 Ų | 109.7 | 37% | 0.374 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -59.9 | -45.5 | 174.9 | -69.4 | 168.6 | 0 | 0 | 0 | 110.1 | N67 R73 R74 R75 | N67-I71 WeakPolarHBondContact O-CG1 3.09Å; N67-I71 PolarHBondContact O-N 3.46Å; N67-I71 WeakPolarHBondContact OD1-CD1 3.39Å; I71-R73 PolarHBondContact O-N 3.23Å; I71-R74 PolarHBondContact O-N 3.5Å; I71-R75 PolarHBondContact O-N 3.47Å |
| 72 | E | 81.4 | Confident | 74.5 | Confident | 29 Ų | 29 | 110.8 Ų | 110.8 | 14% | 0.136 | 50% | 0.499 | C | S | . | . | H | α-helix | trans | -62.2 | -42.3 | 176.4 | 178.5 | 56.8 | -152.6 | 0 | 0 | 111.8 | H68 E70 R74 R75 R76 | H68-E72 VanDerWaalsContact O-CB 3.23Å; H68-E72 WeakPolarHBondContact O-CB 3.31Å; H68-E72 PolarHBondContact O-N 2.84Å; E70-E72 VanDerWaalsContact C-N 3.31Å; E70-E72 PolarHBondContact O-N 3.3Å; E72-R74 PolarHBondContact O-N 3.33Å; E72-R75 VanDerWaalsContact CD-CZ 3.47Å; E72-R75 WeakPolarHBondContact O-CB 3.46Å; E72-R75 PolarHBondContact O-N 3.18Å; E72-R75 IonicContact OE1-CZ 3.38Å; E72-R75 IonicContact OE1-NE 3.74Å; E72-R75 IonicContact OE1-NH2 2.74Å; E72-R75 PolarHBondContact OE1-NH2 3.26Å; E72-R75 IonicContact OE2-CZ 2.8Å; E72-R75 IonicContact OE2-NE 3.4Å; E72-R75 PolarHBondContact OE2-NE 3.47Å; E72-R75 IonicContact OE2-NH1 3.99Å; E72-R75 PolarHBondContact OE2-NH1 2.92Å; E72-R75 IonicContact OE2-NH2 2.87Å; E72-R75 PolarHBondContact OE2-NH2 2.88Å; E72-R76 VanDerWaalsContact CG-NH2 3.29Å; E72-R76 WeakPolarHBondContact O-CG 3.45Å; E72-R76 PolarHBondContact O-N 2.75Å; E72-R76 IonicContact OE1-CZ 3.5Å; E72-R76 IonicContact OE1-NE 2.88Å; E72-R76 PolarHBondContact OE1-NE 3.29Å; E72-R76 IonicContact OE1-NH2 3.33Å; E72-R76 PolarHBondContact OE1-NH2 3.41Å |
| 73 | R | 81.4 | Confident | 76.4 | Confident | 137 Ų | 137 | 103.7 Ų | 103.7 | 52% | 0.517 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -59.2 | -46.1 | 174.3 | -173.6 | -170.2 | -60.3 | 136 | 2 | 111.2 | S69 E70 I71 R75 R76 N77 | S69-R73 WeakPolarHBondContact O-CB 3.48Å; S69-R73 PolarHBondContact O-N 3.13Å; E70-R73 WeakPolarHBondContact O-CB 3.29Å; E70-R73 PolarHBondContact O-N 3.4Å; I71-R73 PolarHBondContact O-N 3.23Å; R73-R75 VanDerWaalsContact C-N 3.32Å; R73-R75 PolarHBondContact O-N 3.14Å; R73-R76 PolarHBondContact O-N 3.07Å; R73-N77 VanDerWaalsContact O-CG 3.29Å; R73-N77 PolarHBondContact O-N 3.43Å; R73-N77 PolarHBondContact O-OD1 3.45Å |
| 74 | R | 84.2 | Confident | 78.5 | Confident | 156 Ų | 156 | 99 Ų | 99 | 59% | 0.589 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -60.7 | -40.6 | 176.9 | -69.6 | 175.9 | -171.3 | 179.3 | 2.6 | 111.4 | E70 I71 E72 N77 K78 | E70-R74 WeakPolarHBondContact O-CG 3.4Å; E70-R74 PolarHBondContact O-N 2.86Å; E70-R74 IonicContact OE1-CZ 3.45Å; E70-R74 IonicContact OE1-NE 3.54Å; E70-R74 IonicContact OE1-NH2 2.97Å; E70-R74 PolarHBondContact OE1-NH2 2.89Å; E70-R74 IonicContact OE2-NH2 2.68Å; I71-R74 PolarHBondContact O-N 3.5Å; E72-R74 PolarHBondContact O-N 3.33Å; R74-N77 PolarHBondContact O-N 2.96Å; R74-K78 VanDerWaalsContact O-CB 3.32Å; R74-K78 WeakPolarHBondContact O-CB 3.47Å; R74-K78 PolarHBondContact O-N 3.32Å |
| 75 | R | 84.4 | Confident | 80.3 | Confident | 138 Ų | 138 | 100.1 Ų | 100.1 | 52% | 0.521 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -61 | -45.1 | 174.4 | -166.2 | -175 | 76.9 | -162.2 | 1.6 | 112 | I71 E72 R73 K78 M79 | I71-R75 PolarHBondContact O-N 3.47Å; E72-R75 VanDerWaalsContact CD-CZ 3.47Å; E72-R75 WeakPolarHBondContact O-CB 3.46Å; E72-R75 PolarHBondContact O-N 3.18Å; E72-R75 IonicContact OE1-CZ 3.38Å; E72-R75 IonicContact OE1-NE 3.74Å; E72-R75 IonicContact OE1-NH2 2.74Å; E72-R75 PolarHBondContact OE1-NH2 3.26Å; E72-R75 IonicContact OE2-CZ 2.8Å; E72-R75 IonicContact OE2-NE 3.4Å; E72-R75 PolarHBondContact OE2-NE 3.47Å; E72-R75 IonicContact OE2-NH1 3.99Å; E72-R75 PolarHBondContact OE2-NH1 2.92Å; E72-R75 IonicContact OE2-NH2 2.87Å; E72-R75 PolarHBondContact OE2-NH2 2.88Å; R73-R75 VanDerWaalsContact C-N 3.32Å; R73-R75 PolarHBondContact O-N 3.14Å; R75-K78 PolarHBondContact O-N 2.83Å; R75-M79 WeakPolarHBondContact O-CB 3.47Å; R75-M79 PolarHBondContact O-N 3.28Å |
| 76 | R | 89.9 | Confident | 82.1 | Confident | 151 Ų | 151 | 92.3 Ų | 92.3 | 57% | 0.57 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -64.5 | -40.8 | 177.7 | -69.2 | 174.4 | -167.9 | 168.7 | 1 | 112.5 | E72 R73 T80 | E72-R76 VanDerWaalsContact CG-NH2 3.29Å; E72-R76 WeakPolarHBondContact O-CG 3.45Å; E72-R76 PolarHBondContact O-N 2.75Å; E72-R76 IonicContact OE1-CZ 3.5Å; E72-R76 IonicContact OE1-NE 2.88Å; E72-R76 PolarHBondContact OE1-NE 3.29Å; E72-R76 IonicContact OE1-NH2 3.33Å; E72-R76 PolarHBondContact OE1-NH2 3.41Å; R73-R76 PolarHBondContact O-N 3.07Å; R76-T80 WeakPolarHBondContact O-CB 3.48Å; R76-T80 PolarHBondContact O-N 3.5Å; R76-T80 PolarHBondContact O-OG1 3.33Å |
| 77 | N | 87.8 | Confident | 84 | Confident | 103 Ų | 103 | 86.9 Ų | 86.9 | 55% | 0.551 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -64.6 | -45.4 | 176.9 | -71 | -2.6 | 0 | 0 | 0 | 110.6 | R73 R74 T80 Q81 | R73-N77 VanDerWaalsContact O-CG 3.29Å; R73-N77 PolarHBondContact O-N 3.43Å; R73-N77 PolarHBondContact O-OD1 3.45Å; R74-N77 PolarHBondContact O-N 2.96Å; N77-T80 PolarHBondContact O-N 3.36Å; N77-T80 VanDerWaalsContact O-N 3.17Å; N77-Q81 PolarHBondContact O-N 2.91Å |
| 78 | K | 87.8 | Confident | 85.3 | Confident | 113 Ų | 113 | 88 Ų | 88 | 49% | 0.491 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -64.4 | -41.5 | 178.1 | -168.8 | 153.5 | -177.8 | 168.4 | 0 | 112.7 | R74 R75 T80 Q81 Y82 | R74-K78 VanDerWaalsContact O-CB 3.32Å; R74-K78 WeakPolarHBondContact O-CB 3.47Å; R74-K78 PolarHBondContact O-N 3.32Å; R75-K78 PolarHBondContact O-N 2.83Å; K78-T80 VanDerWaalsContact C-N 3.34Å; K78-T80 PolarHBondContact O-N 3.29Å; K78-Q81 WeakPolarHBondContact O-CB 3.41Å; K78-Q81 PolarHBondContact O-N 3.11Å; K78-Y82 HydrophobicContact CD-CE2 4.35Å; K78-Y82 WeakPolarHBondContact CE-OH 3.38Å; K78-Y82 HydrophobicContact CG-CD2 4.19Å; K78-Y82 HydrophobicContact CG-CE2 3.57Å; K78-Y82 VanDerWaalsContact O-CD2 3.24Å; K78-Y82 WeakPolarHBondContact O-CD2 3.3Å; K78-Y82 PolarHBondContact O-N 3.31Å |
| 79 | M | 87.3 | Confident | 86.2 | Confident | 87 Ų | 87 | 88 Ų | 88 | 43% | 0.429 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -61.6 | -43.2 | 171.9 | -174.9 | -173.2 | -174.8 | 0 | 0 | 111.6 | R75 Q81 Y82 I83 | R75-M79 WeakPolarHBondContact O-CB 3.47Å; R75-M79 PolarHBondContact O-N 3.28Å; M79-Q81 VanDerWaalsContact C-N 3.31Å; M79-Q81 PolarHBondContact O-N 2.87Å; M79-Y82 PolarHBondContact O-N 3.46Å; M79-I83 VanDerWaalsContact O-CG1 3.29Å; M79-I83 WeakPolarHBondContact O-CG1 3.49Å; M79-I83 PolarHBondContact O-N 3.23Å |
| 80 | T | 89.4 | Confident | 87 | Confident | 54 Ų | 54 | 85.5 Ų | 85.5 | 33% | 0.331 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -65.7 | -37 | 179.9 | -55.5 | 0 | 0 | 0 | 0 | 111.6 | R76 N77 K78 I83 T84 K102 | R76-T80 WeakPolarHBondContact O-CB 3.48Å; R76-T80 PolarHBondContact O-N 3.5Å; R76-T80 PolarHBondContact O-OG1 3.33Å; N77-T80 PolarHBondContact O-N 3.36Å; N77-T80 VanDerWaalsContact O-N 3.17Å; K78-T80 VanDerWaalsContact C-N 3.34Å; K78-T80 PolarHBondContact O-N 3.29Å; T80-I83 PolarHBondContact O-N 2.97Å; T80-T84 PolarHBondContact O-N 3.26Å; T80-T84 VanDerWaalsContact O-N 3.1Å; T80-T84 PolarHBondContact O-OG1 3.12Å; T80-K102 PolarHBondContact OG1-NZ 2.99Å |
| 81 | Q | 91.5 | Very high | 87.5 | Confident | 103 Ų | 103 | 85.9 Ų | 85.9 | 48% | 0.481 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -59 | -53.2 | 170.7 | 178.4 | 179.3 | 16.7 | 0 | 0 | 110.9 | N77 K78 M79 I83 T84 E85 | N77-Q81 PolarHBondContact O-N 2.91Å; K78-Q81 WeakPolarHBondContact O-CB 3.41Å; K78-Q81 PolarHBondContact O-N 3.11Å; M79-Q81 VanDerWaalsContact C-N 3.31Å; M79-Q81 PolarHBondContact O-N 2.87Å; Q81-I83 VanDerWaalsContact C-N 3.28Å; Q81-I83 PolarHBondContact O-N 3.42Å; Q81-T84 WeakPolarHBondContact O-CB 3.46Å; Q81-T84 PolarHBondContact O-N 3.44Å; Q81-E85 HydrophobicContact CG-CG 4.46Å; Q81-E85 VanDerWaalsContact CG-OE1 3.22Å; Q81-E85 WeakPolarHBondContact CG-OE1 3.3Å; Q81-E85 PolarHBondContact NE2-OE1 3.25Å; Q81-E85 PolarHBondContact O-N 3.13Å |
| 82 | Y | 92.1 | Very high | 88 | Confident | 128 Ų | 128 | 86 Ų | 86 | 50% | 0.502 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -59.1 | -37.3 | 178.8 | -67.1 | -38.5 | 0 | 0 | 0 | 113.3 | K78 M79 T84 L86 | K78-Y82 HydrophobicContact CD-CE2 4.35Å; K78-Y82 WeakPolarHBondContact CE-OH 3.38Å; K78-Y82 HydrophobicContact CG-CD2 4.19Å; K78-Y82 HydrophobicContact CG-CE2 3.57Å; K78-Y82 VanDerWaalsContact O-CD2 3.24Å; K78-Y82 WeakPolarHBondContact O-CD2 3.3Å; K78-Y82 PolarHBondContact O-N 3.31Å; M79-Y82 PolarHBondContact O-N 3.46Å; Y82-T84 VanDerWaalsContact C-N 3.32Å; Y82-T84 PolarHBondContact O-N 3.18Å; Y82-L86 WeakPolarHBondContact O-CB 3.38Å; Y82-L86 PolarHBondContact O-N 3.1Å |
| 83 | I | 89.4 | Confident | 88.1 | Confident | 14 Ų | 14 | 84.9 Ų | 84.9 | 7% | 0.072 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -64.4 | -38.2 | 174.9 | -67.8 | -70.2 | 0 | 0 | 0 | 111.5 | M79 T80 Q81 S87 K102 I105 L106 | M79-I83 VanDerWaalsContact O-CG1 3.29Å; M79-I83 WeakPolarHBondContact O-CG1 3.49Å; M79-I83 PolarHBondContact O-N 3.23Å; T80-I83 PolarHBondContact O-N 2.97Å; Q81-I83 VanDerWaalsContact C-N 3.28Å; Q81-I83 PolarHBondContact O-N 3.42Å; I83-S87 PolarHBondContact O-N 2.94Å; I83-S87 PolarHBondContact O-OG 2.96Å; I83-K102 HydrophobicContact CD1-CB 4.4Å; I83-K102 HydrophobicContact CG1-CB 4.48Å; I83-K102 HydrophobicContact CG1-CD 4.45Å; I83-K102 HydrophobicContact CG2-CB 4.28Å; I83-K102 HydrophobicContact CG2-CG 4.11Å; I83-I105 HydrophobicContact CG2-CB 4.37Å; I83-I105 HydrophobicContact CG2-CD1 3.51Å; I83-I105 HydrophobicContact CG2-CG2 4.29Å; I83-L106 HydrophobicContact CD1-CD1 4.16Å; I83-L106 HydrophobicContact CD1-CD2 3.86Å; I83-L106 HydrophobicContact CD1-CG 3.82Å |
| 84 | T | 90 | Very high | 88.3 | Confident | 52 Ų | 52 | 82 Ų | 82 | 32% | 0.319 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -70.3 | -48.7 | -180 | -52.3 | 0 | 0 | 0 | 0 | 110.9 | T80 Q81 Y82 L86 S87 D88 | T80-T84 PolarHBondContact O-N 3.26Å; T80-T84 VanDerWaalsContact O-N 3.1Å; T80-T84 PolarHBondContact O-OG1 3.12Å; Q81-T84 WeakPolarHBondContact O-CB 3.46Å; Q81-T84 PolarHBondContact O-N 3.44Å; Y82-T84 VanDerWaalsContact C-N 3.32Å; Y82-T84 PolarHBondContact O-N 3.18Å; T84-L86 PolarHBondContact O-N 3.48Å; T84-S87 WeakPolarHBondContact CA-OG 3.39Å; T84-S87 PolarHBondContact O-N 3.46Å; T84-S87 PolarHBondContact O-OG 2.71Å; T84-D88 PolarHBondContact O-N 2.79Å; T84-D88 VanDerWaalsContact O-N 3.14Å |
| 85 | E | 91.8 | Very high | 88.1 | Confident | 88 Ų | 88 | 78.8 Ų | 78.8 | 41% | 0.411 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -59.7 | -37.2 | 176 | -68.8 | 174.3 | -166.4 | 0 | 0 | 111.3 | Q81 D88 M89 | Q81-E85 HydrophobicContact CG-CG 4.46Å; Q81-E85 VanDerWaalsContact CG-OE1 3.22Å; Q81-E85 WeakPolarHBondContact CG-OE1 3.3Å; Q81-E85 PolarHBondContact NE2-OE1 3.25Å; Q81-E85 PolarHBondContact O-N 3.13Å; E85-D88 PolarHBondContact O-N 3.43Å; E85-M89 PolarHBondContact O-N 3.14Å |
| 86 | L | 91.7 | Very high | 88 | Confident | 42 Ų | 42 | 76.4 Ų | 76.4 | 22% | 0.22 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -67.1 | -39.4 | 174.2 | -174.3 | 63.6 | 0 | 0 | 0 | 112.5 | Y82 T84 D88 M89 V90 I105 L106 A109 | Y82-L86 WeakPolarHBondContact O-CB 3.38Å; Y82-L86 PolarHBondContact O-N 3.1Å; T84-L86 PolarHBondContact O-N 3.48Å; L86-D88 PolarHBondContact O-N 2.89Å; L86-M89 HydrophobicContact CD1-CE 4.25Å; L86-M89 PolarHBondContact O-N 3.05Å; L86-V90 HydrophobicContact CD1-CG2 4.36Å; L86-V90 HydrophobicContact CG-CG2 4.46Å; L86-V90 VanDerWaalsContact O-CG2 3.24Å; L86-V90 WeakPolarHBondContact O-CG2 3.16Å; L86-V90 PolarHBondContact O-N 3.29Å; L86-I105 HydrophobicContact CD2-CG2 4.45Å; L86-I105 HydrophobicContact CG-CG2 4.43Å; L86-L106 HydrophobicContact CD2-CD2 3.86Å; L86-A109 HydrophobicContact CD1-CB 4.05Å; L86-A109 HydrophobicContact CD2-CB 3.83Å; L86-A109 HydrophobicContact CG-CB 3.97Å |
| 87 | S | 89.3 | Confident | 87.2 | Confident | 15 Ų | 15 | 74.7 Ų | 74.7 | 11% | 0.105 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -64.7 | -31.2 | 177.6 | 55.7 | 0 | 0 | 0 | 0 | 113 | I83 T84 M89 V90 | I83-S87 PolarHBondContact O-N 2.94Å; I83-S87 PolarHBondContact O-OG 2.96Å; T84-S87 WeakPolarHBondContact CA-OG 3.39Å; T84-S87 PolarHBondContact O-N 3.46Å; T84-S87 PolarHBondContact O-OG 2.71Å; S87-M89 VanDerWaalsContact C-N 3.35Å; S87-V90 PolarHBondContact O-N 3.17Å |
| 88 | D | 89 | Confident | 87 | Confident | 108 Ų | 108 | 80.3 Ų | 80.3 | 58% | 0.578 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -72.3 | -31.7 | 177.7 | -61.9 | -23.4 | 0 | 0 | 0 | 111.5 | T84 E85 L86 | T84-D88 PolarHBondContact O-N 2.79Å; T84-D88 VanDerWaalsContact O-N 3.14Å; E85-D88 PolarHBondContact O-N 3.43Å; L86-D88 PolarHBondContact O-N 2.89Å |
| 89 | M | 90.5 | Very high | 86.7 | Confident | 130 Ų | 130 | 83.6 Ų | 83.6 | 64% | 0.64 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -79.7 | -12.8 | 175.3 | -68.4 | -172.1 | -71 | 0 | 0 | 114.2 | E85 L86 S87 P91 | E85-M89 PolarHBondContact O-N 3.14Å; L86-M89 HydrophobicContact CD1-CE 4.25Å; L86-M89 PolarHBondContact O-N 3.05Å; S87-M89 VanDerWaalsContact C-N 3.35Å; M89-P91 WeakPolarHBondContact O-CD 3.4Å |
| 90 | V | 88.6 | Confident | 86.5 | Confident | 3 Ų | 3 | 80.8 Ų | 80.8 | 2% | 0.018 | 44% | 0.437 | C | S | . | . | trans | -103.2 | 108.9 | -177.1 | 177.6 | 0 | 0 | 0 | 0 | 109.6 | L86 S87 T92 C93 S94 M108 A109 H112 | L86-V90 HydrophobicContact CD1-CG2 4.36Å; L86-V90 HydrophobicContact CG-CG2 4.46Å; L86-V90 VanDerWaalsContact O-CG2 3.24Å; L86-V90 WeakPolarHBondContact O-CG2 3.16Å; L86-V90 PolarHBondContact O-N 3.29Å; S87-V90 PolarHBondContact O-N 3.17Å; V90-T92 WeakPolarHBondContact CG1-OG1 3.48Å; V90-T92 PolarHBondContact O-N 3.33Å; V90-T92 VanDerWaalsContact O-N 3.1Å; V90-C93 HydrophobicContact CB-CB 4.11Å; V90-C93 HydrophobicContact CG1-CB 4.13Å; V90-C93 VanDerWaalsContact CG1-SG 3.54Å; V90-C93 PolarHBondContact O-N 2.88Å; V90-S94 PolarHBondContact O-N 2.75Å; V90-S94 VanDerWaalsContact O-N 3.13Å; V90-M108 HydrophobicContact CG1-CB 4.23Å; V90-A109 HydrophobicContact CG2-CB 3.59Å; V90-H112 HydrophobicContact CG1-CB 4.24Å | ||
| 91 | P | 84.8 | Confident | 86.5 | Confident | 80 Ų | 80 | 84 Ų | 84 | 52% | 0.519 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -59.5 | -31.9 | -171.3 | -25.3 | 33.7 | 0 | 0 | 0 | 114 | M89 C93 | M89-P91 WeakPolarHBondContact O-CD 3.4Å; P91-C93 VanDerWaalsContact C-N 3.34Å |
| 92 | T | 86.9 | Confident | 86.3 | Confident | 76 Ų | 76 | 83.6 Ų | 83.6 | 47% | 0.466 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -74.5 | -24.5 | 179.7 | 54.7 | 0 | 0 | 0 | 0 | 112.8 | V90 L96 M108 | V90-T92 WeakPolarHBondContact CG1-OG1 3.48Å; V90-T92 PolarHBondContact O-N 3.33Å; V90-T92 VanDerWaalsContact O-N 3.1Å; T92-L96 WeakPolarHBondContact O-CG 3.44Å; T92-M108 WeakPolarHBondContact O-CE 3.44Å; T92-M108 WeakPolarHBondContact OG1-CE 3.32Å |
| 93 | C | 82.9 | Confident | 86.1 | Confident | 4 Ų | 4 | 79.8 Ų | 79.8 | 3% | 0.027 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -86 | -39.6 | 177.8 | -65.4 | 0 | 0 | 0 | 0 | 111.9 | V90 P91 A95 L96 M108 | V90-C93 HydrophobicContact CB-CB 4.11Å; V90-C93 HydrophobicContact CG1-CB 4.13Å; V90-C93 VanDerWaalsContact CG1-SG 3.54Å; V90-C93 PolarHBondContact O-N 2.88Å; P91-C93 VanDerWaalsContact C-N 3.34Å; C93-A95 VanDerWaalsContact C-N 3.33Å; C93-A95 PolarHBondContact O-N 2.84Å; C93-L96 PolarHBondContact O-N 3.1Å; C93-M108 WeakPolarHBondContact SG-CB 3.41Å |
| 94 | S | 84.7 | Confident | 86.1 | Confident | 76 Ų | 76 | 81.5 Ų | 81.5 | 53% | 0.531 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -65.5 | -33.4 | -175.8 | -176.5 | 0 | 0 | 0 | 0 | 113 | V90 L96 | V90-S94 PolarHBondContact O-N 2.75Å; V90-S94 VanDerWaalsContact O-N 3.13Å; S94-L96 PolarHBondContact O-N 3.43Å |
| 95 | A | 79.7 | Confident | 86.1 | Confident | 90 Ų | 90 | 79.4 Ų | 79.4 | 74% | 0.744 | 44% | 0.435 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.2 | -1.1 | -179.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | C93 | C93-A95 VanDerWaalsContact C-N 3.33Å; C93-A95 PolarHBondContact O-N 2.84Å |
| 96 | L | 82.6 | Confident | 86 | Confident | 87 Ų | 87 | 76.4 Ų | 76.4 | 46% | 0.455 | 42% | 0.422 | S | S | . | . | trans | -87.3 | 124.1 | -176.1 | -63.9 | 174.8 | 0 | 0 | 0 | 111.6 | T92 C93 S94 R98 P100 M108 | T92-L96 WeakPolarHBondContact O-CG 3.44Å; C93-L96 PolarHBondContact O-N 3.1Å; S94-L96 PolarHBondContact O-N 3.43Å; L96-R98 PolarHBondContact O-N 3.28Å; L96-P100 HydrophobicContact CD1-CB 4.17Å; L96-P100 HydrophobicContact CD1-CG 4.12Å; L96-M108 HydrophobicContact CD1-CE 4.2Å | ||
| 97 | A | 73.9 | Confident | 85.8 | Confident | 115 Ų | 115 | 80.8 Ų | 80.8 | 95% | 0.95 | 44% | 0.435 | S | S | * | . | S | Bend | trans | -69.8 | -12 | 178.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||
| 98 | R | 82.6 | Confident | 85.8 | Confident | 222 Ų | 222 | 82.1 Ų | 82.1 | 84% | 0.838 | 44% | 0.44 | S | S | * | . | S | Bend | trans | -116.1 | 132.3 | 170.8 | -78.9 | -176 | 167.9 | -177.4 | -3 | 109 | L96 P100 | L96-R98 PolarHBondContact O-N 3.28Å; R98-P100 WeakPolarHBondContact O-CD 3.47Å; R98-P100 VanDerWaalsContact O-N 3.09Å |
| 99 | K | 81.6 | Confident | 86 | Confident | 182 Ų | 182 | 77 Ų | 77 | 79% | 0.791 | 41% | 0.414 | S | S | * | . | trans | -60.7 | 109.9 | -179.3 | -147.3 | 128.1 | 175.4 | 169.9 | 0 | 108.8 | ||||
| 100 | P | 83.9 | Confident | 85.9 | Confident | 27 Ų | 27 | 72.9 Ų | 72.9 | 18% | 0.175 | 40% | 0.395 | C | S | . | . | trans | -68.3 | 150.6 | -177.6 | 25.7 | -31.7 | 0 | 0 | 0 | 111 | L96 R98 T104 I105 | L96-P100 HydrophobicContact CD1-CB 4.17Å; L96-P100 HydrophobicContact CD1-CG 4.12Å; R98-P100 WeakPolarHBondContact O-CD 3.47Å; R98-P100 VanDerWaalsContact O-N 3.09Å; P100-T104 HydrophobicContact CB-CG2 4.03Å; P100-I105 HydrophobicContact CB-CG1 4.16Å; P100-I105 HydrophobicContact CG-CD1 4.11Å; P100-I105 HydrophobicContact CG-CG1 3.61Å; P100-I105 WeakPolarHBondContact O-CD1 3.48Å | ||
| 101 | D | 89.1 | Confident | 85.9 | Confident | 123 Ų | 123 | 76.5 Ų | 76.5 | 66% | 0.658 | 42% | 0.421 | S | S | * | . | trans | -58.3 | 153.1 | 176.5 | -66.4 | -48.6 | 0 | 0 | 0 | 111.8 | L103 T104 I105 | D101-L103 PolarHBondContact O-N 3.47Å; D101-L103 VanDerWaalsContact O-N 3.15Å; D101-T104 WeakPolarHBondContact O-CA 3.29Å; D101-T104 WeakPolarHBondContact O-CB 3.39Å; D101-T104 PolarHBondContact O-N 2.94Å; D101-I105 PolarHBondContact O-N 2.95Å | ||
| 102 | K | 86.8 | Confident | 85.9 | Confident | 94 Ų | 94 | 75.2 Ų | 75.2 | 41% | 0.409 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -53.5 | -40.3 | -179.4 | -59.8 | -171.3 | 169.9 | -178.4 | 0 | 112.4 | T80 I83 L106 | T80-K102 PolarHBondContact OG1-NZ 2.99Å; I83-K102 HydrophobicContact CD1-CB 4.4Å; I83-K102 HydrophobicContact CG1-CB 4.48Å; I83-K102 HydrophobicContact CG1-CD 4.45Å; I83-K102 HydrophobicContact CG2-CB 4.28Å; I83-K102 HydrophobicContact CG2-CG 4.11Å; K102-L106 WeakPolarHBondContact O-CB 3.18Å; K102-L106 VanDerWaalsContact O-CG 3.3Å; K102-L106 WeakPolarHBondContact O-CG 3.24Å; K102-L106 PolarHBondContact O-N 3.49Å; K102-L106 VanDerWaalsContact O-N 3.14Å |
| 103 | L | 88.9 | Confident | 85.9 | Confident | 47 Ų | 47 | 76.2 Ų | 76.2 | 25% | 0.246 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -67.4 | -37 | 178.1 | -172.7 | 65.4 | 0 | 0 | 0 | 112.2 | D101 L106 R107 L210 | D101-L103 PolarHBondContact O-N 3.47Å; D101-L103 VanDerWaalsContact O-N 3.15Å; L103-L106 WeakPolarHBondContact O-CB 3.42Å; L103-L106 PolarHBondContact O-N 2.97Å; L103-R107 VanDerWaalsContact O-CG 3.29Å; L103-R107 WeakPolarHBondContact O-CG 3.07Å; L103-R107 PolarHBondContact O-N 3.44Å; L103-L210 HydrophobicContact CD1-CD1 3.22Å; L103-L210 HydrophobicContact CD1-CG 4.21Å |
| 104 | T | 89.4 | Confident | 85.7 | Confident | 50 Ų | 50 | 83 Ų | 83 | 31% | 0.307 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -68.2 | -45.4 | 178.7 | -58.7 | 0 | 0 | 0 | 0 | 110.6 | P100 D101 L106 R107 M108 | P100-T104 HydrophobicContact CB-CG2 4.03Å; D101-T104 WeakPolarHBondContact O-CA 3.29Å; D101-T104 WeakPolarHBondContact O-CB 3.39Å; D101-T104 PolarHBondContact O-N 2.94Å; T104-L106 VanDerWaalsContact C-N 3.28Å; T104-L106 PolarHBondContact O-N 3.28Å; T104-R107 PolarHBondContact O-N 3.21Å; T104-M108 HydrophobicContact CG2-SD 3.67Å; T104-M108 WeakPolarHBondContact O-CB 3.4Å; T104-M108 VanDerWaalsContact O-CG 3.31Å; T104-M108 WeakPolarHBondContact O-CG 3.35Å; T104-M108 PolarHBondContact O-N 2.96Å |
| 105 | I | 89.4 | Confident | 85.3 | Confident | 8 Ų | 8 | 82.7 Ų | 82.7 | 4% | 0.041 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -54.4 | -48 | 173.1 | -65.9 | 166.2 | 0 | 0 | 0 | 110.3 | I83 L86 P100 D101 R107 M108 A109 | I83-I105 HydrophobicContact CG2-CB 4.37Å; I83-I105 HydrophobicContact CG2-CD1 3.51Å; I83-I105 HydrophobicContact CG2-CG2 4.29Å; L86-I105 HydrophobicContact CD2-CG2 4.45Å; L86-I105 HydrophobicContact CG-CG2 4.43Å; P100-I105 HydrophobicContact CB-CG1 4.16Å; P100-I105 HydrophobicContact CG-CD1 4.11Å; P100-I105 HydrophobicContact CG-CG1 3.61Å; P100-I105 WeakPolarHBondContact O-CD1 3.48Å; D101-I105 PolarHBondContact O-N 2.95Å; I105-R107 PolarHBondContact O-N 3.38Å; I105-M108 PolarHBondContact O-N 2.86Å; I105-A109 VanDerWaalsContact O-CB 3.3Å; I105-A109 WeakPolarHBondContact O-CB 3.46Å; I105-A109 PolarHBondContact O-N 3.25Å |
| 106 | L | 90.6 | Very high | 85 | Confident | 26 Ų | 26 | 83.8 Ų | 83.8 | 14% | 0.136 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -60.3 | -45.7 | 178.9 | -79.4 | -178.4 | 0 | 0 | 0 | 113.1 | I83 L86 K102 L103 T104 A109 V110 W206 | I83-L106 HydrophobicContact CD1-CD1 4.16Å; I83-L106 HydrophobicContact CD1-CD2 3.86Å; I83-L106 HydrophobicContact CD1-CG 3.82Å; L86-L106 HydrophobicContact CD2-CD2 3.86Å; K102-L106 WeakPolarHBondContact O-CB 3.18Å; K102-L106 VanDerWaalsContact O-CG 3.3Å; K102-L106 WeakPolarHBondContact O-CG 3.24Å; K102-L106 PolarHBondContact O-N 3.49Å; K102-L106 VanDerWaalsContact O-N 3.14Å; L103-L106 WeakPolarHBondContact O-CB 3.42Å; L103-L106 PolarHBondContact O-N 2.97Å; T104-L106 VanDerWaalsContact C-N 3.28Å; T104-L106 PolarHBondContact O-N 3.28Å; L106-A109 PolarHBondContact O-N 3.33Å; L106-V110 WeakPolarHBondContact O-CG2 3.22Å; L106-V110 PolarHBondContact O-N 3.39Å; L106-V110 VanDerWaalsContact O-N 3.07Å; L106-W206 HydrophobicContact CB-CZ2 3.84Å; L106-W206 HydrophobicContact CD1-CZ2 4.36Å; L106-W206 HydrophobicContact CD2-CZ2 4.08Å; L106-W206 HydrophobicContact CG-CZ2 4.3Å |
| 107 | R | 85.9 | Confident | 84.3 | Confident | 133 Ų | 133 | 88 Ų | 88 | 50% | 0.502 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -64.1 | -41.4 | 178.4 | -73.7 | 171 | 176.4 | -177.1 | -1.4 | 112.3 | L103 T104 I105 V110 S111 | L103-R107 VanDerWaalsContact O-CG 3.29Å; L103-R107 WeakPolarHBondContact O-CG 3.07Å; L103-R107 PolarHBondContact O-N 3.44Å; T104-R107 PolarHBondContact O-N 3.21Å; I105-R107 PolarHBondContact O-N 3.38Å; R107-V110 PolarHBondContact O-N 3.16Å; R107-S111 PolarHBondContact O-N 3.34Å |
| 108 | M | 90.7 | Very high | 83.5 | Confident | 43 Ų | 43 | 85.5 Ų | 85.5 | 21% | 0.212 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -71 | -38.3 | 179.1 | -69 | 171.7 | 68.8 | 0 | 0 | 111.6 | V90 T92 C93 L96 T104 I105 V110 S111 H112 | V90-M108 HydrophobicContact CG1-CB 4.23Å; T92-M108 WeakPolarHBondContact O-CE 3.44Å; T92-M108 WeakPolarHBondContact OG1-CE 3.32Å; C93-M108 WeakPolarHBondContact SG-CB 3.41Å; L96-M108 HydrophobicContact CD1-CE 4.2Å; T104-M108 HydrophobicContact CG2-SD 3.67Å; T104-M108 WeakPolarHBondContact O-CB 3.4Å; T104-M108 VanDerWaalsContact O-CG 3.31Å; T104-M108 WeakPolarHBondContact O-CG 3.35Å; T104-M108 PolarHBondContact O-N 2.96Å; I105-M108 PolarHBondContact O-N 2.86Å; M108-V110 VanDerWaalsContact C-N 3.35Å; M108-V110 PolarHBondContact O-N 3.5Å; M108-S111 WeakPolarHBondContact O-CB 3.5Å; M108-S111 PolarHBondContact O-N 3.44Å; M108-H112 WeakPolarHBondContact O-CB 3.37Å; M108-H112 PolarHBondContact O-N 2.96Å |
| 109 | A | 91.9 | Very high | 82 | Confident | 2 Ų | 2 | 80.8 Ų | 80.8 | 2% | 0.017 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -58.9 | -45.6 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | L86 V90 I105 L106 S111 H112 M113 | L86-A109 HydrophobicContact CD1-CB 4.05Å; L86-A109 HydrophobicContact CD2-CB 3.83Å; L86-A109 HydrophobicContact CG-CB 3.97Å; V90-A109 HydrophobicContact CG2-CB 3.59Å; I105-A109 VanDerWaalsContact O-CB 3.3Å; I105-A109 WeakPolarHBondContact O-CB 3.46Å; I105-A109 PolarHBondContact O-N 3.25Å; L106-A109 PolarHBondContact O-N 3.33Å; A109-S111 PolarHBondContact O-N 3.48Å; A109-H112 PolarHBondContact O-N 2.95Å; A109-M113 WeakPolarHBondContact O-CG 3.45Å; A109-M113 PolarHBondContact O-N 2.93Å |
| 110 | V | 88.5 | Confident | 80.9 | Confident | 43 Ų | 43 | 74.4 Ų | 74.4 | 26% | 0.261 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -63.9 | -42.2 | 177 | 170.9 | 0 | 0 | 0 | 0 | 111.5 | L106 R107 M108 H112 M113 K114 W206 | L106-V110 WeakPolarHBondContact O-CG2 3.22Å; L106-V110 PolarHBondContact O-N 3.39Å; L106-V110 VanDerWaalsContact O-N 3.07Å; R107-V110 PolarHBondContact O-N 3.16Å; M108-V110 VanDerWaalsContact C-N 3.35Å; M108-V110 PolarHBondContact O-N 3.5Å; V110-H112 PolarHBondContact O-N 3.43Å; V110-M113 HydrophobicContact CG2-CE 4.23Å; V110-M113 PolarHBondContact O-N 3.48Å; V110-K114 WeakPolarHBondContact O-CB 3.46Å; V110-K114 PolarHBondContact O-N 3.04Å; V110-W206 HydrophobicContact CB-CH2 4.4Å; V110-W206 HydrophobicContact CG2-CH2 3.35Å; V110-W206 HydrophobicContact CG2-CZ2 3.75Å; V110-W206 HydrophobicContact CG2-CZ3 3.83Å |
| 111 | S | 88.1 | Confident | 79.2 | Confident | 79 Ų | 79 | 79.9 Ų | 79.9 | 55% | 0.552 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -59.9 | -45.3 | 174.6 | -176.1 | 0 | 0 | 0 | 0 | 111.6 | R107 M108 A109 K114 S115 | R107-S111 PolarHBondContact O-N 3.34Å; M108-S111 WeakPolarHBondContact O-CB 3.5Å; M108-S111 PolarHBondContact O-N 3.44Å; A109-S111 PolarHBondContact O-N 3.48Å; S111-K114 PolarHBondContact O-N 3.43Å; S111-S115 WeakPolarHBondContact O-CB 3.45Å; S111-S115 PolarHBondContact O-N 3.19Å |
| 112 | H | 86.6 | Confident | 77.1 | Confident | 53 Ų | 53 | 84.1 Ų | 84.1 | 25% | 0.245 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -61.2 | -49.9 | 177 | 177.7 | 53.9 | 0 | 0 | 0 | 112 | V90 M108 A109 V110 K114 S115 M116 | V90-H112 HydrophobicContact CG1-CB 4.24Å; M108-H112 WeakPolarHBondContact O-CB 3.37Å; M108-H112 PolarHBondContact O-N 2.96Å; A109-H112 PolarHBondContact O-N 2.95Å; V110-H112 PolarHBondContact O-N 3.43Å; H112-K114 VanDerWaalsContact C-N 3.3Å; H112-K114 PolarHBondContact O-N 3.47Å; H112-S115 PolarHBondContact O-N 3Å; H112-M116 WeakPolarHBondContact O-CG 3.24Å; H112-M116 PolarHBondContact O-N 2.91Å |
| 113 | M | 84.9 | Confident | 74.9 | Confident | 97 Ų | 97 | 84.2 Ų | 84.2 | 48% | 0.478 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -62.3 | -35.8 | 176.5 | -69.5 | -173 | -69.5 | 0 | 0 | 112.8 | A109 V110 M116 R117 | A109-M113 WeakPolarHBondContact O-CG 3.45Å; A109-M113 PolarHBondContact O-N 2.93Å; V110-M113 HydrophobicContact CG2-CE 4.23Å; V110-M113 PolarHBondContact O-N 3.48Å; M113-M116 HydrophobicContact CG-CE 4.18Å; M113-R117 WeakPolarHBondContact O-CG 3.23Å; M113-R117 PolarHBondContact O-N 3.22Å |
| 114 | K | 80.3 | Confident | 72.7 | Confident | 147 Ų | 147 | 88.2 Ų | 88.2 | 64% | 0.639 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -72.4 | -35.8 | 177.3 | -172.5 | 166.8 | 176.7 | 168.1 | 0 | 112.1 | V110 S111 H112 R117 G118 | V110-K114 WeakPolarHBondContact O-CB 3.46Å; V110-K114 PolarHBondContact O-N 3.04Å; S111-K114 PolarHBondContact O-N 3.43Å; H112-K114 VanDerWaalsContact C-N 3.3Å; H112-K114 PolarHBondContact O-N 3.47Å; K114-R117 PolarHBondContact O-N 2.97Å; K114-G118 PolarHBondContact O-N 3.22Å; K114-G118 VanDerWaalsContact O-N 3.13Å |
| 115 | S | 76.6 | Confident | 70.1 | Confident | 69 Ų | 69 | 93.4 Ų | 93.4 | 48% | 0.483 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -68.1 | -41.2 | 174.6 | -168.1 | 0 | 0 | 0 | 0 | 111.7 | S111 H112 R117 G118 T119 | S111-S115 WeakPolarHBondContact O-CB 3.45Å; S111-S115 PolarHBondContact O-N 3.19Å; H112-S115 PolarHBondContact O-N 3Å; S115-R117 PolarHBondContact O-N 3.39Å; S115-G118 WeakPolarHBondContact O-CA 3.32Å; S115-G118 PolarHBondContact O-N 3.47Å; S115-T119 PolarHBondContact O-N 3.24Å; S115-T119 VanDerWaalsContact O-N 3.11Å |
| 116 | M | 73.2 | Confident | 68.3 | Low | 113 Ų | 113 | 96.9 Ų | 96.9 | 56% | 0.557 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -61.1 | -29.5 | 174.4 | -70 | -169.2 | -64.3 | 0 | 0 | 112.4 | H112 M113 | H112-M116 WeakPolarHBondContact O-CG 3.24Å; H112-M116 PolarHBondContact O-N 2.91Å; M113-M116 HydrophobicContact CG-CE 4.18Å |
| 117 | R | 67.9 | Low | 65.9 | Low | 174 Ų | 174 | 99.8 Ų | 99.8 | 66% | 0.657 | 58% | 0.575 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.7 | -13.3 | 172.2 | -67.3 | 173.6 | 65.3 | -112.6 | -1.8 | 114 | M113 K114 S115 | M113-R117 WeakPolarHBondContact O-CG 3.23Å; M113-R117 PolarHBondContact O-N 3.22Å; K114-R117 PolarHBondContact O-N 2.97Å; S115-R117 PolarHBondContact O-N 3.39Å |
| 118 | G | 57.6 | Low | 63.8 | Low | 63 Ų | 63 | 101.2 Ų | 101.2 | 65% | 0.649 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.2 | -20.7 | -175.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | K114 S115 G120 | K114-G118 PolarHBondContact O-N 3.22Å; K114-G118 VanDerWaalsContact O-N 3.13Å; S115-G118 WeakPolarHBondContact O-CA 3.32Å; S115-G118 PolarHBondContact O-N 3.47Å; G118-G120 PolarHBondContact O-N 2.93Å |
| 119 | T | 51 | Low | 61.3 | Low | 124 Ų | 124 | 107.5 Ų | 107.5 | 76% | 0.761 | 61% | 0.607 | S | S | * | * | S | Bend | trans | -94.4 | 68.9 | 172.9 | -53.7 | 0 | 0 | 0 | 0 | 108.3 | S115 | S115-T119 PolarHBondContact O-N 3.24Å; S115-T119 VanDerWaalsContact O-N 3.11Å |
| 120 | G | 56.8 | Low | 58.8 | Low | 47 Ų | 47 | 111.8 Ų | 111.8 | 49% | 0.485 | 64% | 0.635 | S | S | . | * | S | Bend | trans | -157.3 | -60.5 | -160.9 | 0 | 0 | 0 | 0 | 0 | 118.4 | G118 | G118-G120 PolarHBondContact O-N 2.93Š|
| 121 | N | 48.2 | Very low | 56.6 | Low | 143 Ų | 143 | 114.6 Ų | 114.6 | 77% | 0.765 | 66% | 0.656 | S | S | * | * | trans | -149.5 | 89.1 | -163.7 | -55 | 86.8 | 0 | 0 | 0 | 112.3 | S123 | N121-S123 VanDerWaalsContact C-N 3.3Š| ||
| 122 | K | 46.6 | Very low | 54.4 | Low | 212 Ų | 212 | 120.5 Ų | 120.5 | 92% | 0.922 | 67% | 0.672 | S | S | * | * | trans | -99.5 | 48.5 | 149.9 | -62.4 | -171.5 | 163.8 | -64.4 | 0 | 109.1 | ||||
| 123 | S | 39.1 | Very low | 52.3 | Low | 96 Ų | 96 | 125 Ų | 125 | 67% | 0.671 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -145.3 | 115.6 | 175 | -56.4 | 0 | 0 | 0 | 0 | 107 | N121 | N121-S123 VanDerWaalsContact C-N 3.3Š|
| 124 | T | 42.7 | Very low | 50.1 | Low | 131 Ų | 131 | 129.3 Ų | 129.3 | 80% | 0.804 | 71% | 0.714 | S | S | * | * | trans | -9.8 | 146.6 | 165.6 | 56.1 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 125 | D | 36.3 | Very low | 47.6 | Very low | 158 Ų | 158 | 131.5 Ų | 131.5 | 85% | 0.845 | 72% | 0.724 | S | S | * | * | trans | 79.1 | 97.5 | 156.1 | -94 | -102 | 0 | 0 | 0 | 119.3 | A127 | D125-A127 PolarHBondContact O-N 3.39Š| ||
| 126 | G | 50.3 | Low | 45.9 | Very low | 81 Ų | 81 | 137 Ų | 137 | 84% | 0.835 | 74% | 0.742 | S | S | * | * | 71.3 | 40.1 | 104.9 | 0 | 0 | 0 | 0 | 0 | 118.6 | |||||
| 127 | A | 40.3 | Very low | 43.8 | Very low | 88 Ų | 88 | 134.3 Ų | 134.3 | 73% | 0.727 | 74% | 0.743 | S | S | * | * | trans | -163.2 | 76.5 | 158.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | D125 K129 | D125-A127 PolarHBondContact O-N 3.39Å; A127-K129 PolarHBondContact O-N 2.95Å | ||
| 128 | Y | 41.5 | Very low | 42.9 | Very low | 162 Ų | 162 | 131.3 Ų | 131.3 | 64% | 0.635 | 75% | 0.746 | S | S | * | * | trans | -72.1 | 83.4 | 167 | -173.3 | -100.8 | 0 | 0 | 0 | 109.4 | P130 | Y128-P130 HydrophobicContact CE1-CB 4.3Å; Y128-P130 HydrophobicContact CE1-CG 4.33Å | ||
| 129 | K | 38.8 | Very low | 42.2 | Very low | 176 Ų | 176 | 137.1 Ų | 137.1 | 77% | 0.765 | 76% | 0.756 | S | S | * | * | trans | -102 | 107.8 | 167.3 | -147.9 | 175.4 | 178.3 | -174.8 | 0 | 106.1 | A127 S131 | A127-K129 PolarHBondContact O-N 2.95Å; K129-S131 VanDerWaalsContact C-N 3.34Å; K129-S131 PolarHBondContact O-N 2.9Å | ||
| 130 | P | 39.1 | Very low | 41.5 | Very low | 92 Ų | 92 | 139.3 Ų | 139.3 | 60% | 0.597 | 76% | 0.757 | S | S | * | * | trans | -75.7 | 90.5 | 178.8 | 30.5 | -31.3 | 0 | 0 | 0 | 108.1 | Y128 F132 | Y128-P130 HydrophobicContact CE1-CB 4.3Å; Y128-P130 HydrophobicContact CE1-CG 4.33Å; P130-F132 PolarHBondContact O-N 3.37Å | ||
| 131 | S | 42.8 | Very low | 40.9 | Very low | 102 Ų | 102 | 143.6 Ų | 143.6 | 71% | 0.713 | 77% | 0.774 | S | S | * | * | trans | -72.7 | 108.3 | 172.4 | -64.9 | 0 | 0 | 0 | 0 | 108.9 | K129 L133 | K129-S131 VanDerWaalsContact C-N 3.34Å; K129-S131 PolarHBondContact O-N 2.9Å; S131-L133 PolarHBondContact O-N 2.99Å; S131-L133 VanDerWaalsContact O-N 3.13Å | ||
| 132 | F | 41.7 | Very low | 41 | Very low | 202 Ų | 202 | 141.3 Ų | 141.3 | 89% | 0.886 | 77% | 0.767 | S | S | * | * | trans | -69.4 | 4.8 | 178.5 | -161.1 | -99.8 | 0 | 0 | 0 | 113.8 | P130 | P130-F132 PolarHBondContact O-N 3.37Š| ||
| 133 | L | 42.7 | Very low | 40.4 | Very low | 148 Ų | 148 | 138 Ų | 138 | 78% | 0.775 | 76% | 0.759 | S | S | * | * | trans | -148.6 | 103.1 | -170.2 | -66 | 174.6 | 0 | 0 | 0 | 111.3 | S131 | S131-L133 PolarHBondContact O-N 2.99Å; S131-L133 VanDerWaalsContact O-N 3.13Å | ||
| 134 | F | 39.2 | Very low | 40.3 | Very low | 188 Ų | 188 | 140.6 Ų | 140.6 | 83% | 0.825 | 76% | 0.764 | S | S | * | * | trans | -160.7 | 86.3 | 139.3 | -160.5 | -96.6 | 0 | 0 | 0 | 110 | ||||
| 135 | F | 27.2 | Very low | 40.7 | Very low | 192 Ų | 192 | 139.4 Ų | 139.4 | 84% | 0.842 | 76% | 0.759 | S | S | * | * | trans | -155.2 | 77.6 | 153.1 | -128.9 | -85.9 | 0 | 0 | 0 | 109.7 | ||||
| 136 | H | 40.5 | Very low | 40.7 | Very low | 185 Ų | 185 | 136.7 Ų | 136.7 | 86% | 0.856 | 76% | 0.758 | S | S | * | * | S | Bend | trans | -119.8 | 112.7 | 152 | -93.2 | -90.1 | 0 | 0 | 0 | 106.9 | ||
| 137 | G | 29.4 | Very low | 39.9 | Very low | 56 Ų | 56 | 137.9 Ų | 137.9 | 58% | 0.577 | 76% | 0.761 | S | S | * | * | trans | 92.7 | 119.7 | 154.8 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 138 | P | 49.3 | Very low | 39.8 | Very low | 111 Ų | 111 | 143.5 Ų | 143.5 | 72% | 0.721 | 77% | 0.769 | S | S | * | * | trans | -73.5 | 176.8 | 157.8 | 34.9 | -30 | 0 | 0 | 0 | 109.9 | ||||
| 139 | E | 42.4 | Very low | 40.1 | Very low | 185 Ų | 185 | 141.6 Ų | 141.6 | 86% | 0.864 | 78% | 0.776 | S | S | * | * | trans | 93.1 | 87.8 | 175 | -47.9 | -80.2 | 121.6 | 0 | 0 | 115.2 | ||||
| 140 | H | 37.5 | Very low | 39.8 | Very low | 170 Ų | 170 | 142.4 Ų | 142.4 | 79% | 0.787 | 78% | 0.783 | S | S | * | * | -179.9 | 102 | 124.8 | -161.4 | 70.4 | 0 | 0 | 0 | 111.3 | |||||
| 141 | V | 42.9 | Very low | 39.7 | Very low | 138 Ų | 138 | 143.9 Ų | 143.9 | 84% | 0.836 | 80% | 0.795 | S | S | * | * | trans | -116.3 | 134.6 | 143.8 | -78.1 | 0 | 0 | 0 | 0 | 104.6 | ||||
| 142 | P | 49.9 | Very low | 39.3 | Very low | 95 Ų | 95 | 142.7 Ų | 142.7 | 62% | 0.617 | 80% | 0.799 | S | S | * | * | -149.4 | 146.4 | 65.2 | 34.7 | -12.7 | 0 | 0 | 0 | 117.4 | |||||
| 143 | N | 35.1 | Very low | 38.9 | Very low | 142 Ų | 142 | 136.3 Ų | 136.3 | 76% | 0.759 | 79% | 0.79 | S | S | * | * | 61.9 | 115.4 | 126.2 | -150.8 | -15.7 | 0 | 0 | 0 | 121.4 | |||||
| 144 | L | 37.7 | Very low | 39 | Very low | 150 Ų | 150 | 138.2 Ų | 138.2 | 79% | 0.785 | 80% | 0.797 | S | S | * | * | 172 | 172.3 | 111.9 | -128.4 | 75.5 | 0 | 0 | 0 | 109.5 | |||||
| 145 | P | 50.5 | Low | 38.8 | Very low | 107 Ų | 107 | 136.7 Ų | 136.7 | 70% | 0.695 | 80% | 0.798 | S | S | * | * | -122.1 | 179.1 | -124.1 | 33.4 | -10 | 0 | 0 | 0 | 114.4 | |||||
| 146 | A | 35.8 | Very low | 39.8 | Very low | 100 Ų | 100 | 139 Ų | 139 | 83% | 0.826 | 80% | 0.801 | S | S | * | * | trans | 68.7 | 105.5 | 151.6 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 147 | A | 34.6 | Very low | 39.5 | Very low | 107 Ų | 107 | 138.4 Ų | 138.4 | 88% | 0.884 | 80% | 0.799 | S | S | * | * | -160.2 | 132.4 | 125.6 | 0 | 0 | 0 | 0 | 0 | 109.7 | |||||
| 148 | K | 38 | Very low | 39.8 | Very low | 206 Ų | 206 | 141.4 Ų | 141.4 | 90% | 0.896 | 81% | 0.811 | S | S | * | * | trans | -110.2 | 173.6 | 172.6 | -128.7 | -173.4 | -171 | 173.9 | 0 | 107.2 | ||||
| 149 | P | 46.9 | Very low | 39.2 | Very low | 122 Ų | 122 | 141.6 Ų | 141.6 | 79% | 0.792 | 81% | 0.814 | S | S | * | * | -97.6 | 160 | -116.3 | 38.8 | -26.9 | 0 | 0 | 0 | 113.5 | |||||
| 150 | E | 32.5 | Very low | 39 | Very low | 193 Ų | 193 | 137.7 Ų | 137.7 | 90% | 0.902 | 81% | 0.814 | S | S | * | * | trans | -127.5 | 135.7 | 161.7 | 74.5 | -163.2 | 126.4 | 0 | 0 | 112 | ||||
| 151 | S | 37.5 | Very low | 39.1 | Very low | 123 Ų | 123 | 137.8 Ų | 137.8 | 86% | 0.86 | 82% | 0.82 | S | S | * | * | trans | -68.1 | 142 | -174 | 48.5 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 152 | G | 33.5 | Very low | 38.6 | Very low | 77 Ų | 77 | 136.9 Ų | 136.9 | 79% | 0.794 | 82% | 0.819 | S | S | * | * | trans | -154.8 | 75.4 | 164.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 153 | G | 34.6 | Very low | 37.8 | Very low | 68 Ų | 68 | 135.7 Ų | 135.7 | 70% | 0.701 | 83% | 0.825 | S | S | * | * | trans | -76.5 | 122.1 | 165.9 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 154 | M | 44.8 | Very low | 38.2 | Very low | 187 Ų | 187 | 135.6 Ų | 135.6 | 92% | 0.921 | 83% | 0.829 | S | S | * | * | trans | -127.8 | 87.5 | 163.9 | -74.1 | 171.3 | 162.7 | 0 | 0 | 106.9 | R156 | M154-R156 PolarHBondContact O-N 2.87Š| ||
| 155 | D | 34.8 | Very low | 38.1 | Very low | 157 Ų | 157 | 132.6 Ų | 132.6 | 84% | 0.84 | 83% | 0.826 | S | S | * | * | trans | -47.5 | 118 | 157.3 | 13 | -71.6 | 0 | 0 | 0 | 110.3 | ||||
| 156 | R | 46.9 | Very low | 37.6 | Very low | 240 Ų | 240 | 134.4 Ų | 134.4 | 91% | 0.906 | 83% | 0.83 | S | S | * | * | trans | -139.6 | 98.6 | 160.7 | -149.5 | 171.7 | -173.2 | 131.9 | -0 | 110.2 | M154 | M154-R156 PolarHBondContact O-N 2.87Š| ||
| 157 | E | 35.2 | Very low | 37.8 | Very low | 173 Ų | 173 | 135.9 Ų | 135.9 | 81% | 0.808 | 83% | 0.831 | S | S | * | * | trans | -52.9 | 132.2 | 163.2 | -170.3 | -174.3 | 104.8 | 0 | 0 | 110.6 | ||||
| 158 | S | 34.6 | Very low | 37.9 | Very low | 118 Ų | 118 | 137.4 Ų | 137.4 | 83% | 0.825 | 82% | 0.823 | S | S | * | * | trans | -162.1 | 101 | 149.8 | -80.4 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 159 | S | 38.4 | Very low | 38.2 | Very low | 115 Ų | 115 | 132.6 Ų | 132.6 | 80% | 0.804 | 82% | 0.815 | S | S | * | * | trans | -46.8 | 134.1 | 164.1 | -52.4 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 160 | A | 36.8 | Very low | 37.9 | Very low | 104 Ų | 104 | 133.1 Ų | 133.1 | 86% | 0.86 | 82% | 0.816 | S | S | * | * | trans | -136.3 | 129 | 157.3 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 161 | L | 39.3 | Very low | 38.1 | Very low | 172 Ų | 172 | 130.8 Ų | 130.8 | 90% | 0.901 | 81% | 0.805 | S | S | * | * | trans | -72.3 | 151 | -164.4 | -68.7 | 147.2 | 0 | 0 | 0 | 112.8 | G163 | L161-G163 PolarHBondContact O-N 3.48Š| ||
| 162 | S | 34.3 | Very low | 37.9 | Very low | 118 Ų | 118 | 133.3 Ų | 133.3 | 83% | 0.825 | 80% | 0.803 | S | S | * | * | trans | -43.2 | 121.8 | 159.8 | 164 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 163 | G | 33.1 | Very low | 37.9 | Very low | 71 Ų | 71 | 137 Ų | 137 | 73% | 0.732 | 81% | 0.805 | S | S | * | * | trans | -143.4 | 91.1 | 168 | 0 | 0 | 0 | 0 | 0 | 109.3 | L161 A165 | L161-G163 PolarHBondContact O-N 3.48Å; G163-A165 PolarHBondContact O-N 3.17Å | ||
| 164 | T | 42.8 | Very low | 38.2 | Very low | 139 Ų | 139 | 137.6 Ų | 137.6 | 85% | 0.853 | 80% | 0.798 | S | S | * | * | trans | -65.4 | 111.6 | 169.2 | 51.2 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 165 | A | 34.8 | Very low | 38.2 | Very low | 87 Ų | 87 | 133.8 Ų | 133.8 | 72% | 0.719 | 79% | 0.785 | S | S | * | * | trans | -152.7 | 102 | 161 | 0 | 0 | 0 | 0 | 0 | 109.1 | G163 P167 | G163-A165 PolarHBondContact O-N 3.17Å; A165-P167 VanDerWaalsContact O-CD 3.32Å; A165-P167 WeakPolarHBondContact O-CD 3.47Å | ||
| 166 | N | 40 | Very low | 38.6 | Very low | 145 Ų | 145 | 133.6 Ų | 133.6 | 78% | 0.775 | 78% | 0.783 | S | S | * | * | trans | -65.9 | 131.2 | 159.9 | -65 | -65.2 | 0 | 0 | 0 | 108.7 | I168 | N166-I168 HydrophobicContact CB-CG1 4.41Š| ||
| 167 | P | 39.7 | Very low | 37.9 | Very low | 131 Ų | 131 | 127.3 Ų | 127.3 | 85% | 0.851 | 78% | 0.775 | S | S | * | * | trans | -99.1 | 82.2 | 148.9 | 32.6 | -27.6 | 0 | 0 | 0 | 108.3 | A165 | A165-P167 VanDerWaalsContact O-CD 3.32Å; A165-P167 WeakPolarHBondContact O-CD 3.47Å | ||
| 168 | I | 37.5 | Very low | 38.2 | Very low | 139 Ų | 139 | 126 Ų | 126 | 71% | 0.713 | 77% | 0.773 | S | S | * | * | trans | -87.6 | 134.1 | 154.8 | -65.2 | 171 | 0 | 0 | 0 | 105.7 | N166 | N166-I168 HydrophobicContact CB-CG1 4.41Š| ||
| 169 | S | 44.3 | Very low | 38.5 | Very low | 106 Ų | 106 | 128.9 Ų | 128.9 | 74% | 0.741 | 77% | 0.766 | S | S | * | * | trans | 88 | 90 | 175.8 | -38.9 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 170 | V | 41 | Very low | 38.4 | Very low | 133 Ų | 133 | 129 Ų | 129 | 81% | 0.806 | 76% | 0.758 | S | S | * | * | S | Bend | -154.2 | 133.9 | 114.4 | -173.5 | 0 | 0 | 0 | 0 | 107.3 | |||
| 171 | Q | 35.8 | Very low | 38.5 | Very low | 144 Ų | 144 | 134.8 Ų | 134.8 | 67% | 0.673 | 76% | 0.757 | S | S | * | * | trans | 87.8 | 50.5 | 168 | -125.9 | 92.9 | 26.5 | 0 | 0 | 119.2 | D173 | Q171-D173 VanDerWaalsContact C-N 3.34Š| ||
| 172 | Q | 33.1 | Very low | 39 | Very low | 175 Ų | 175 | 131.1 Ų | 131.1 | 82% | 0.818 | 74% | 0.739 | S | S | * | * | trans | -86.6 | 4.2 | 161.1 | -91.9 | -172.8 | 1.2 | 0 | 0 | 114.8 | ||||
| 173 | D | 35 | Very low | 39.2 | Very low | 156 Ų | 156 | 132.9 Ų | 132.9 | 83% | 0.834 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -103.1 | 22.9 | -173.7 | -62.9 | -39.4 | 0 | 0 | 0 | 115.1 | Q171 | Q171-D173 VanDerWaalsContact C-N 3.34Š|
| 174 | S | 41.1 | Very low | 39.6 | Very low | 80 Ų | 80 | 133.2 Ų | 133.2 | 56% | 0.559 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -141.4 | 6.4 | 178.5 | -57.1 | 0 | 0 | 0 | 0 | 116.7 | ||
| 175 | V | 43.3 | Very low | 39.7 | Very low | 106 Ų | 106 | 134.9 Ų | 134.9 | 64% | 0.642 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -97.4 | 4.7 | -179.6 | -63.9 | 0 | 0 | 0 | 0 | 114.6 | ||
| 176 | I | 42.9 | Very low | 39.8 | Very low | 154 Ų | 154 | 137.8 Ų | 137.8 | 79% | 0.79 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.7 | -10.8 | 175.3 | -61.9 | 176.1 | 0 | 0 | 0 | 111.9 | ||
| 177 | S | 33.7 | Very low | 39.9 | Very low | 108 Ų | 108 | 137.1 Ų | 137.1 | 76% | 0.755 | 73% | 0.727 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.5 | 7 | -178.2 | -54.9 | 0 | 0 | 0 | 0 | 115.6 | ||
| 178 | L | 39.8 | Very low | 40.4 | Very low | 145 Ų | 145 | 134.5 Ų | 134.5 | 76% | 0.759 | 72% | 0.724 | S | S | * | * | trans | -122.3 | 36.3 | -177.2 | -156.4 | 73.2 | 0 | 0 | 0 | 114.2 | D180 | L178-D180 VanDerWaalsContact C-N 3.31Š| ||
| 179 | W | 42.9 | Very low | 40.6 | Very low | 179 Ų | 179 | 138.6 Ų | 138.6 | 68% | 0.678 | 73% | 0.731 | S | S | * | * | trans | -106.4 | 47.8 | 154.7 | -58.2 | 99.9 | 0 | 0 | 0 | 109.3 | W181 | W179-W181 VanDerWaalsContact C-N 3.27Å; W179-W181 PolarHBondContact O-N 2.87Å | ||
| 180 | D | 34.3 | Very low | 40.6 | Very low | 117 Ų | 117 | 139.1 Ų | 139.1 | 63% | 0.626 | 73% | 0.732 | S | S | * | * | trans | -72.4 | 89.8 | 162.8 | -170.5 | 24.6 | 0 | 0 | 0 | 107.6 | L178 N182 | L178-D180 VanDerWaalsContact C-N 3.31Å; D180-N182 PolarHBondContact O-N 2.74Å | ||
| 181 | W | 39.9 | Very low | 40.6 | Very low | 225 Ų | 225 | 140.5 Ų | 140.5 | 85% | 0.852 | 73% | 0.734 | S | S | * | * | trans | -79.8 | 51.6 | 177.4 | -149.3 | -22.1 | 0 | 0 | 0 | 109.9 | W179 | W179-W181 VanDerWaalsContact C-N 3.27Å; W179-W181 PolarHBondContact O-N 2.87Å | ||
| 182 | N | 48.7 | Very low | 41 | Very low | 96 Ų | 96 | 142.6 Ų | 142.6 | 51% | 0.513 | 74% | 0.741 | S | S | . | * | trans | -157.2 | 89.1 | 173.8 | -173.6 | 72.4 | 0 | 0 | 0 | 110.3 | D180 | D180-N182 PolarHBondContact O-N 2.74Š| ||
| 183 | E | 39.4 | Very low | 41.5 | Very low | 155 Ų | 155 | 142.4 Ų | 142.4 | 72% | 0.724 | 74% | 0.744 | S | S | * | * | trans | -131.3 | 115.5 | 156.8 | -133.1 | 174.3 | 140 | 0 | 0 | 110.7 | ||||
| 184 | P | 42 | Very low | 42.2 | Very low | 77 Ų | 77 | 141.9 Ų | 141.9 | 50% | 0.5 | 74% | 0.737 | S | S | . | * | trans | -71.5 | 134 | 173.7 | 30.8 | -30.3 | 0 | 0 | 0 | 108.7 | L186 | P184-L186 PolarHBondContact O-N 3.4Š| ||
| 185 | H | 45.1 | Very low | 42.6 | Very low | 174 Ų | 174 | 143 Ų | 143 | 81% | 0.806 | 74% | 0.743 | S | S | * | * | trans | -0.2 | 104 | 159.7 | 58.1 | -73.4 | 0 | 0 | 0 | 116.5 | ||||
| 186 | L | 37.3 | Very low | 42.7 | Very low | 148 Ų | 148 | 143 Ų | 143 | 78% | 0.775 | 75% | 0.745 | S | S | * | * | trans | -129 | 136.8 | 156.6 | -72.3 | 177 | 0 | 0 | 0 | 110.1 | P184 | P184-L186 PolarHBondContact O-N 3.4Š| ||
| 187 | P | 42.2 | Very low | 43.1 | Very low | 131 Ų | 131 | 140.6 Ų | 140.6 | 85% | 0.851 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -79.8 | 129.2 | -179.8 | 32.4 | -31 | 0 | 0 | 0 | 110.1 | ||
| 188 | G | 48.9 | Very low | 43.7 | Very low | 77 Ų | 77 | 140.5 Ų | 140.5 | 79% | 0.794 | 72% | 0.721 | S | S | * | * | trans | 116.9 | 49.2 | 160.6 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 189 | R | 42.3 | Very low | 44.1 | Very low | 225 Ų | 225 | 136.2 Ų | 136.2 | 85% | 0.849 | 70% | 0.701 | S | S | * | * | trans | -106 | 134.9 | 160.6 | -81.2 | -170.1 | 177.7 | -119.9 | 4.7 | 112.2 | ||||
| 190 | P | 43.2 | Very low | 44.3 | Very low | 117 Ų | 117 | 131.6 Ų | 131.6 | 76% | 0.76 | 70% | 0.696 | S | S | * | * | trans | -74 | 139.3 | -177.4 | 29.2 | -32.7 | 0 | 0 | 0 | 111.9 | F192 | P190-F192 PolarHBondContact O-N 2.97Š| ||
| 191 | L | 42.2 | Very low | 45.1 | Very low | 162 Ų | 162 | 132.4 Ų | 132.4 | 85% | 0.848 | 69% | 0.691 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.4 | 31.5 | -170.3 | -68.1 | 171.6 | 0 | 0 | 0 | 115.8 | ||
| 192 | F | 44.4 | Very low | 45.9 | Very low | 188 Ų | 188 | 125.9 Ų | 125.9 | 83% | 0.825 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.2 | 1.5 | -167.9 | -131.7 | -93.9 | 0 | 0 | 0 | 117.9 | P190 | P190-F192 PolarHBondContact O-N 2.97Š|
| 193 | L | 43.7 | Very low | 46.2 | Very low | 170 Ų | 170 | 125.7 Ų | 125.7 | 89% | 0.89 | 67% | 0.671 | S | S | * | * | trans | -133.4 | 73.5 | 169.3 | -84.8 | 96 | 0 | 0 | 0 | 111.3 | ||||
| 194 | Q | 48 | Very low | 47.3 | Very low | 145 Ų | 145 | 120.7 Ų | 120.7 | 68% | 0.678 | 66% | 0.657 | S | S | * | * | trans | -95.7 | 127.4 | 150.1 | -77.1 | 177.8 | 54.8 | 0 | 0 | 107 | ||||
| 195 | P | 50.9 | Low | 48.2 | Very low | 105 Ų | 105 | 121.6 Ų | 121.6 | 68% | 0.682 | 65% | 0.653 | S | S | * | * | trans | -57.8 | 142.2 | 168.7 | 24.5 | -30.9 | 0 | 0 | 0 | 108.4 | L197 | P195-L197 PolarHBondContact O-N 3.13Š| ||
| 196 | P | 44.9 | Very low | 48.9 | Very low | 106 Ų | 106 | 116.4 Ų | 116.4 | 69% | 0.688 | 63% | 0.626 | S | S | * | * | trans | -58.4 | 112.7 | 180 | 24.1 | -32 | 0 | 0 | 0 | 107.7 | Q198 | P196-Q198 PolarHBondContact O-N 3.26Š| ||
| 197 | L | 51.8 | Low | 50 | Low | 103 Ų | 103 | 115.5 Ų | 115.5 | 54% | 0.539 | 62% | 0.618 | S | S | . | * | trans | -65.6 | 81.1 | 174.3 | -73.2 | 168 | 0 | 0 | 0 | 107.6 | P195 P199 L202 | P195-L197 PolarHBondContact O-N 3.13Å; L197-P199 WeakPolarHBondContact O-CD 3.44Å; L197-L202 HydrophobicContact CB-CD1 4.23Å; L197-L202 HydrophobicContact CD2-CD2 4.16Å; L197-L202 HydrophobicContact CD2-CG 4.42Å | ||
| 198 | Q | 46.9 | Very low | 50.8 | Low | 106 Ų | 106 | 113.4 Ų | 113.4 | 50% | 0.495 | 61% | 0.605 | S | S | . | * | trans | -58.8 | 128.1 | 173.4 | -71.5 | -69.5 | 2 | 0 | 0 | 107.3 | P196 S200 Y201 L202 | P196-Q198 PolarHBondContact O-N 3.26Å; Q198-S200 PolarHBondContact O-N 2.95Å; Q198-Y201 WeakPolarHBondContact O-CB 3.47Å; Q198-Y201 PolarHBondContact O-N 2.86Å; Q198-L202 PolarHBondContact O-N 2.72Å | ||
| 199 | P | 47.9 | Very low | 51.2 | Low | 55 Ų | 55 | 114.6 Ų | 114.6 | 36% | 0.357 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -54.8 | -27.5 | 179.3 | -27.9 | 34.8 | 0 | 0 | 0 | 113.1 | L197 L203 | L197-P199 WeakPolarHBondContact O-CD 3.44Å; P199-L203 WeakPolarHBondContact O-CB 3.33Å; P199-L203 WeakPolarHBondContact O-CG 3.36Å; P199-L203 PolarHBondContact O-N 2.92Å |
| 200 | S | 47.2 | Very low | 52 | Low | 81 Ų | 81 | 105.6 Ų | 105.6 | 57% | 0.566 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -65.1 | -37.8 | 173.2 | 53.4 | 0 | 0 | 0 | 0 | 113.3 | Q198 L203 A204 | Q198-S200 PolarHBondContact O-N 2.95Å; S200-L203 PolarHBondContact O-N 3Å; S200-A204 WeakPolarHBondContact O-CB 3.32Å; S200-A204 PolarHBondContact O-N 3.08Å |
| 201 | Y | 50.3 | Low | 52.8 | Low | 134 Ų | 134 | 105.3 Ų | 105.3 | 53% | 0.525 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -72.8 | -37.6 | 178.9 | -168.7 | -98.6 | 0 | 0 | 0 | 111.6 | Q198 A204 K205 | Q198-Y201 WeakPolarHBondContact O-CB 3.47Å; Q198-Y201 PolarHBondContact O-N 2.86Å; Y201-A204 PolarHBondContact O-N 3.09Å; Y201-K205 VanDerWaalsContact O-CB 3.32Å; Y201-K205 WeakPolarHBondContact O-CB 3.16Å; Y201-K205 PolarHBondContact O-N 3.16Å |
| 202 | L | 56.5 | Low | 53 | Low | 89 Ų | 89 | 101 Ų | 101 | 47% | 0.466 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -65.7 | -41.2 | 171.8 | -73.7 | 175.9 | 0 | 0 | 0 | 111.6 | L197 Q198 K205 W206 | L197-L202 HydrophobicContact CB-CD1 4.23Å; L197-L202 HydrophobicContact CD2-CD2 4.16Å; L197-L202 HydrophobicContact CD2-CG 4.42Å; Q198-L202 PolarHBondContact O-N 2.72Å; L202-K205 PolarHBondContact O-N 2.83Å; L202-W206 WeakPolarHBondContact O-CB 2.94Å; L202-W206 PolarHBondContact O-N 2.96Å |
| 203 | L | 55 | Low | 53.1 | Low | 91 Ų | 91 | 94.8 Ų | 94.8 | 48% | 0.476 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.9 | -46.2 | 174.1 | -81.6 | 167.7 | 0 | 0 | 0 | 111.9 | P199 S200 K205 W206 E207 | P199-L203 WeakPolarHBondContact O-CB 3.33Å; P199-L203 WeakPolarHBondContact O-CG 3.36Å; P199-L203 PolarHBondContact O-N 2.92Å; S200-L203 PolarHBondContact O-N 3Å; L203-K205 PolarHBondContact O-N 3.43Å; L203-W206 CarbonylContact O-C 3.58Å; L203-W206 PolarHBondContact O-N 3.42Å; L203-W206 VanDerWaalsContact O-N 3.16Å; L203-E207 WeakPolarHBondContact O-CG 3.32Å; L203-E207 PolarHBondContact O-N 3.19Å |
| 204 | A | 63.3 | Low | 53.6 | Low | 51 Ų | 51 | 90.5 Ų | 90.5 | 42% | 0.421 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63.1 | -44.2 | 178 | 0 | 0 | 0 | 0 | 0 | 112.1 | S200 Y201 W206 E207 C208 | S200-A204 WeakPolarHBondContact O-CB 3.32Å; S200-A204 PolarHBondContact O-N 3.08Å; Y201-A204 PolarHBondContact O-N 3.09Å; A204-W206 PolarHBondContact O-N 2.67Å; A204-E207 PolarHBondContact O-N 2.89Å; A204-C208 PolarHBondContact O-N 3.25Å |
| 205 | K | 59.6 | Low | 53.6 | Low | 96 Ų | 96 | 88.9 Ų | 88.9 | 42% | 0.417 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64.3 | -33.1 | 175.4 | -168.1 | 170.8 | -177.1 | 177.9 | 0 | 111.7 | Y201 L202 L203 L209 | Y201-K205 VanDerWaalsContact O-CB 3.32Å; Y201-K205 WeakPolarHBondContact O-CB 3.16Å; Y201-K205 PolarHBondContact O-N 3.16Å; L202-K205 PolarHBondContact O-N 2.83Å; L203-K205 PolarHBondContact O-N 3.43Å; K205-L209 WeakPolarHBondContact O-CG 3.05Å; K205-L209 PolarHBondContact O-N 3.47Å |
| 206 | W | 61.1 | Low | 53 | Low | 65 Ų | 65 | 89.4 Ų | 89.4 | 25% | 0.246 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -77.4 | -38.3 | 179.3 | -170.6 | 83.7 | 0 | 0 | 0 | 113 | L106 V110 L202 L203 A204 C208 L209 L210 | L106-W206 HydrophobicContact CB-CZ2 3.84Å; L106-W206 HydrophobicContact CD1-CZ2 4.36Å; L106-W206 HydrophobicContact CD2-CZ2 4.08Å; L106-W206 HydrophobicContact CG-CZ2 4.3Å; V110-W206 HydrophobicContact CB-CH2 4.4Å; V110-W206 HydrophobicContact CG2-CH2 3.35Å; V110-W206 HydrophobicContact CG2-CZ2 3.75Å; V110-W206 HydrophobicContact CG2-CZ3 3.83Å; L202-W206 WeakPolarHBondContact O-CB 2.94Å; L202-W206 PolarHBondContact O-N 2.96Å; L203-W206 CarbonylContact O-C 3.58Å; L203-W206 PolarHBondContact O-N 3.42Å; L203-W206 VanDerWaalsContact O-N 3.16Å; A204-W206 PolarHBondContact O-N 2.67Å; W206-C208 VanDerWaalsContact C-N 3.29Å; W206-C208 PolarHBondContact O-N 2.9Å; W206-L209 PolarHBondContact O-N 3.44Å; W206-L209 VanDerWaalsContact O-N 3.12Å; W206-L210 HydrophobicContact CH2-CD1 4.28Å; W206-L210 HydrophobicContact CH2-CD2 4.17Å; W206-L210 HydrophobicContact CZ2-CD1 4.43Å; W206-L210 HydrophobicContact CZ3-CD2 3.91Å; W206-L210 WeakPolarHBondContact O-CB 3.5Å; W206-L210 PolarHBondContact O-N 2.96Å |
| 207 | E | 59.7 | Low | 52.8 | Low | 129 Ų | 129 | 88.2 Ų | 88.2 | 60% | 0.603 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -60 | -40.9 | 171.6 | -75.9 | -175 | 159.8 | 0 | 0 | 110.9 | L203 A204 L209 L210 Q211 | L203-E207 WeakPolarHBondContact O-CG 3.32Å; L203-E207 PolarHBondContact O-N 3.19Å; A204-E207 PolarHBondContact O-N 2.89Å; E207-L209 PolarHBondContact O-N 3.5Å; E207-L210 PolarHBondContact O-N 3.17Å; E207-Q211 WeakPolarHBondContact O-CB 3.03Å; E207-Q211 PolarHBondContact O-N 2.87Å |
| 208 | C | 59.6 | Low | 52.3 | Low | 87 Ų | 87 | 93.8 Ų | 93.8 | 59% | 0.588 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -60.1 | -43.4 | 171.4 | -78.5 | 0 | 0 | 0 | 0 | 112.9 | A204 W206 Q211 S212 | A204-C208 PolarHBondContact O-N 3.25Å; W206-C208 VanDerWaalsContact C-N 3.29Å; W206-C208 PolarHBondContact O-N 2.9Å; C208-Q211 PolarHBondContact O-N 3.19Å; C208-S212 PolarHBondContact O-N 3.04Å; C208-S212 VanDerWaalsContact O-N 3.1Å; C208-S212 PolarHBondContact O-OG 2.9Å |
| 209 | L | 55.7 | Low | 52.2 | Low | 101 Ų | 101 | 94.9 Ų | 94.9 | 53% | 0.529 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -68.5 | -35 | 178 | -73.9 | 169.3 | 0 | 0 | 0 | 112.7 | K205 W206 E207 S212 C213 | K205-L209 WeakPolarHBondContact O-CG 3.05Å; K205-L209 PolarHBondContact O-N 3.47Å; W206-L209 PolarHBondContact O-N 3.44Å; W206-L209 VanDerWaalsContact O-N 3.12Å; E207-L209 PolarHBondContact O-N 3.5Å; L209-S212 PolarHBondContact O-N 2.99Å; L209-C213 PolarHBondContact O-N 3.28Å; L209-C213 PolarHBondContact O-SG 2.68Å |
| 210 | L | 60.9 | Low | 51.8 | Low | 36 Ų | 36 | 106 Ų | 106 | 19% | 0.188 | 53% | 0.534 | C | S | . | . | H | α-helix | trans | -67.4 | -40.1 | 176.4 | -162 | 71.1 | 0 | 0 | 0 | 111 | L103 W206 E207 C213 Q214 | L103-L210 HydrophobicContact CD1-CD1 3.22Å; L103-L210 HydrophobicContact CD1-CG 4.21Å; W206-L210 HydrophobicContact CH2-CD1 4.28Å; W206-L210 HydrophobicContact CH2-CD2 4.17Å; W206-L210 HydrophobicContact CZ2-CD1 4.43Å; W206-L210 HydrophobicContact CZ3-CD2 3.91Å; W206-L210 WeakPolarHBondContact O-CB 3.5Å; W206-L210 PolarHBondContact O-N 2.96Å; E207-L210 PolarHBondContact O-N 3.17Å; L210-C213 PolarHBondContact O-N 3.35Å; L210-Q214 WeakPolarHBondContact O-CB 3.14Å; L210-Q214 PolarHBondContact O-N 2.97Å; L210-Q214 VanDerWaalsContact O-N 3.07Å |
| 211 | Q | 58.3 | Low | 52 | Low | 111 Ų | 111 | 107.2 Ų | 107.2 | 52% | 0.519 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62 | -45.2 | 174.9 | -158.5 | 72.7 | 12.9 | 0 | 0 | 110.8 | E207 C208 Q214 Q215 | E207-Q211 WeakPolarHBondContact O-CB 3.03Å; E207-Q211 PolarHBondContact O-N 2.87Å; C208-Q211 PolarHBondContact O-N 3.19Å; Q211-Q214 PolarHBondContact O-N 3.45Å; Q211-Q215 PolarHBondContact O-N 3.45Å; Q211-Q215 PolarHBondContact O-OE1 2.65Å |
| 212 | S | 48.1 | Very low | 52.1 | Low | 72 Ų | 72 | 105.8 Ų | 105.8 | 50% | 0.503 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -65.7 | -38.9 | 176.4 | -65 | 0 | 0 | 0 | 0 | 113.3 | C208 L209 Q214 Q215 D216 | C208-S212 PolarHBondContact O-N 3.04Å; C208-S212 VanDerWaalsContact O-N 3.1Å; C208-S212 PolarHBondContact O-OG 2.9Å; L209-S212 PolarHBondContact O-N 2.99Å; S212-Q214 VanDerWaalsContact C-N 3.31Å; S212-Q214 PolarHBondContact O-N 2.8Å; S212-Q215 PolarHBondContact O-N 2.9Å; S212-D216 PolarHBondContact O-N 3.34Å |
| 213 | C | 46.6 | Very low | 51.8 | Low | 58 Ų | 58 | 106.7 Ų | 106.7 | 39% | 0.392 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -67.1 | -31.8 | 176.5 | -72.7 | 0 | 0 | 0 | 0 | 112.7 | L209 L210 Q215 D216 S217 | L209-C213 PolarHBondContact O-N 3.28Å; L209-C213 PolarHBondContact O-SG 2.68Å; L210-C213 PolarHBondContact O-N 3.35Å; C213-Q215 VanDerWaalsContact C-N 3.28Å; C213-D216 PolarHBondContact O-N 2.96Å; C213-S217 PolarHBondContact O-N 3.37Å |
| 214 | Q | 53.6 | Low | 51.6 | Low | 79 Ų | 79 | 107.6 Ų | 107.6 | 37% | 0.369 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -73.8 | -23.1 | 178.2 | -158.1 | 166.9 | 111.9 | 0 | 0 | 112.4 | L210 Q211 S212 S217 | L210-Q214 WeakPolarHBondContact O-CB 3.14Å; L210-Q214 PolarHBondContact O-N 2.97Å; L210-Q214 VanDerWaalsContact O-N 3.07Å; Q211-Q214 PolarHBondContact O-N 3.45Å; S212-Q214 VanDerWaalsContact C-N 3.31Å; S212-Q214 PolarHBondContact O-N 2.8Å; Q214-S217 PolarHBondContact O-OG 3.02Å |
| 215 | Q | 47.2 | Very low | 50.9 | Low | 111 Ų | 111 | 111.2 Ų | 111.2 | 52% | 0.519 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -79.4 | -35.3 | 173.4 | -75.5 | 142.5 | 10.2 | 0 | 0 | 111.8 | Q211 S212 C213 S217 R218 | Q211-Q215 PolarHBondContact O-N 3.45Å; Q211-Q215 PolarHBondContact O-OE1 2.65Å; S212-Q215 PolarHBondContact O-N 2.9Å; C213-Q215 VanDerWaalsContact C-N 3.28Å; Q215-S217 PolarHBondContact O-N 3.28Å; Q215-R218 PolarHBondContact O-N 3.25Å |
| 216 | D | 38 | Very low | 50.3 | Low | 117 Ų | 117 | 112.2 Ų | 112.2 | 63% | 0.626 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -66.2 | -35.1 | 175.7 | -161.6 | -95.4 | 0 | 0 | 0 | 112.6 | S212 C213 R218 | S212-D216 PolarHBondContact O-N 3.34Å; C213-D216 PolarHBondContact O-N 2.96Å; D216-R218 VanDerWaalsContact C-N 3.29Å; D216-R218 PolarHBondContact O-N 2.92Å |
| 217 | S | 41.2 | Very low | 49.6 | Very low | 81 Ų | 81 | 115.6 Ų | 115.6 | 57% | 0.566 | 58% | 0.578 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.3 | -6.2 | 177.7 | 71.3 | 0 | 0 | 0 | 0 | 114.9 | C213 Q214 Q215 | C213-S217 PolarHBondContact O-N 3.37Å; Q214-S217 PolarHBondContact O-OG 3.02Å; Q215-S217 PolarHBondContact O-N 3.28Å |
| 218 | R | 40.8 | Very low | 48.8 | Very low | 220 Ų | 220 | 114.5 Ų | 114.5 | 83% | 0.83 | 58% | 0.576 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.1 | -7.6 | 176.9 | -112.1 | -176.7 | -160.7 | -163.8 | 5.5 | 113.6 | Q215 D216 | Q215-R218 PolarHBondContact O-N 3.25Å; D216-R218 VanDerWaalsContact C-N 3.29Å; D216-R218 PolarHBondContact O-N 2.92Å |
| 219 | V | 44.6 | Very low | 47.9 | Very low | 129 Ų | 129 | 116.8 Ų | 116.8 | 78% | 0.782 | 58% | 0.576 | S | S | * | * | trans | -107.8 | 8.3 | -176 | -174.5 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 220 | R | 39.6 | Very low | 47.2 | Very low | 287 Ų | 287 | 118.3 Ų | 118.3 | 100% | 1.083 | 58% | 0.58 | S | S | * | * | trans | -111.3 | 0 | 170.1 | -80.6 | -177.9 | 176.1 | -104.8 | -1.8 | 111.5 |
Retrieved 220 of 220 residues in 29.1 ms
(Link to these results)