| 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 | 52.9 | Low | 69.8 | Low | 232 Ų | 232 | 151.9 Ų | 151.9 | 100% | 1.143 | 76% | 0.759 | S | S | * | * | 0 | 79.7 | 0 | -71 | -81.6 | -176.7 | 0 | 0 | 105.9 | L3 | M1-L3 PolarHBondContact O-N 3.48Š| |||
| 2 | D | 55.2 | Low | 69.6 | Low | 166 Ų | 166 | 151.8 Ų | 151.8 | 89% | 0.888 | 75% | 0.754 | S | S | * | * | trans | -79.2 | 112.7 | -174.8 | -65.4 | -53.3 | 0 | 0 | 0 | 110 | Q4 | D2-Q4 PolarHBondContact O-N 3.02Å; D2-Q4 VanDerWaalsContact O-N 3.12Å | ||
| 3 | L | 69.1 | Low | 68.8 | Low | 177 Ų | 177 | 151.6 Ų | 151.6 | 93% | 0.927 | 75% | 0.75 | S | S | * | * | trans | -76.4 | 91 | 172 | -82.7 | 154.8 | 0 | 0 | 0 | 108.5 | M1 A5 | M1-L3 PolarHBondContact O-N 3.48Å; L3-A5 PolarHBondContact O-N 3.42Å | ||
| 4 | Q | 70.2 | Confident | 68.5 | Low | 189 Ų | 189 | 148.4 Ų | 148.4 | 88% | 0.883 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 117.4 | 170.4 | -167.6 | 173.6 | -9.7 | 0 | 0 | 109.2 | D2 A6 | D2-Q4 PolarHBondContact O-N 3.02Å; D2-Q4 VanDerWaalsContact O-N 3.12Å; Q4-A6 PolarHBondContact O-N 3.44Å |
| 5 | A | 73.9 | Confident | 67.8 | Low | 91 Ų | 91 | 154.4 Ų | 154.4 | 75% | 0.752 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 127.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | L3 | L3-A5 PolarHBondContact O-N 3.42Š|
| 6 | A | 76.9 | Confident | 67.7 | Low | 65 Ų | 65 | 153 Ų | 153 | 54% | 0.537 | 76% | 0.762 | S | S | . | * | P | Polyproline II helix | trans | -65.3 | 139.1 | 178.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | Q4 | Q4-A6 PolarHBondContact O-N 3.44Š|
| 7 | P | 76.1 | Confident | 66.7 | Low | 62 Ų | 62 | 155.3 Ų | 155.3 | 40% | 0.403 | 76% | 0.761 | S | S | . | * | P | Polyproline II helix | trans | -60.9 | 141.6 | 176.5 | -22 | 32.3 | 0 | 0 | 0 | 112.3 | W9 R10 | P7-W9 VanDerWaalsContact CB-CD1 3.44Å; P7-W9 HydrophobicContact CB-CD2 4.39Å; P7-W9 HydrophobicContact CB-CG 4.19Å; P7-W9 HydrophobicContact CB-CZ2 4.44Å; P7-W9 HydrophobicContact CG-CZ2 4.27Å; P7-W9 PolarHBondContact O-N 2.95Å; P7-R10 PolarHBondContact O-N 3.37Å |
| 8 | W | 81.4 | Confident | 66 | Low | 201 Ų | 201 | 156.6 Ų | 156.6 | 76% | 0.761 | 77% | 0.765 | S | S | * | * | G | 310 helix | trans | -52.7 | -26.7 | -176.5 | 64.1 | -94.2 | 0 | 0 | 0 | 114.9 | R10 M11 | W8-R10 PolarHBondContact O-N 2.81Å; W8-M11 PolarHBondContact O-N 2.65Å |
| 9 | W | 74.7 | Confident | 65 | Low | 147 Ų | 147 | 156.4 Ų | 156.4 | 56% | 0.557 | 77% | 0.768 | S | S | * | * | G | 310 helix | trans | -66 | -20.3 | 179.8 | 58.6 | -106.6 | 0 | 0 | 0 | 113.4 | P7 M11 Q12 | P7-W9 VanDerWaalsContact CB-CD1 3.44Å; P7-W9 HydrophobicContact CB-CD2 4.39Å; P7-W9 HydrophobicContact CB-CG 4.19Å; P7-W9 HydrophobicContact CB-CZ2 4.44Å; P7-W9 HydrophobicContact CG-CZ2 4.27Å; P7-W9 PolarHBondContact O-N 2.95Å; W9-M11 PolarHBondContact O-N 2.97Å; W9-Q12 PolarHBondContact O-N 3.24Å |
| 10 | R | 68.2 | Low | 64.4 | Low | 160 Ų | 160 | 157.1 Ų | 157.1 | 60% | 0.604 | 77% | 0.769 | S | S | * | * | G | 310 helix | trans | -67.7 | -16.5 | 178 | -167.9 | 177 | -76.3 | -165 | -2.7 | 112.6 | P7 W8 | P7-R10 PolarHBondContact O-N 3.37Å; W8-R10 PolarHBondContact O-N 2.81Å |
| 11 | M | 69.6 | Low | 63.5 | Low | 181 Ų | 181 | 154.2 Ų | 154.2 | 89% | 0.892 | 77% | 0.771 | S | S | * | * | G | 310 helix | trans | -89.4 | 1.5 | -177 | -144.3 | 140.6 | 92.3 | 0 | 0 | 114.6 | W8 W9 | W8-M11 PolarHBondContact O-N 2.65Å; W9-M11 PolarHBondContact O-N 2.97Å |
| 12 | Q | 67 | Low | 63.6 | Low | 151 Ų | 151 | 148.8 Ų | 148.8 | 71% | 0.706 | 75% | 0.75 | S | S | * | * | G | 310 helix | trans | -99.5 | 17.9 | -179.8 | -77.8 | -173.3 | -18 | 0 | 0 | 114.6 | W9 P14 | W9-Q12 PolarHBondContact O-N 3.24Å; Q12-P14 WeakPolarHBondContact O-CD 3.33Å |
| 13 | Q | 59.2 | Low | 63.3 | Low | 149 Ų | 149 | 149 Ų | 149 | 70% | 0.696 | 75% | 0.749 | S | S | * | * | trans | -68.4 | 123.7 | 171.3 | -66.8 | -69.3 | -34.5 | 0 | 0 | 109.4 | Y15 | Q13-Y15 PolarHBondContact O-N 2.92Š| ||
| 14 | P | 65.1 | Low | 62.2 | Low | 107 Ų | 107 | 150.8 Ų | 150.8 | 70% | 0.695 | 75% | 0.749 | S | S | * | * | trans | -63.5 | 130.2 | 174.8 | 24.8 | -30.4 | 0 | 0 | 0 | 109.4 | Q12 T16 | Q12-P14 WeakPolarHBondContact O-CD 3.33Å; P14-T16 PolarHBondContact O-N 2.68Å; P14-T16 VanDerWaalsContact O-N 3.11Å | ||
| 15 | Y | 57.2 | Low | 60.9 | Low | 238 Ų | 238 | 146.8 Ų | 146.8 | 93% | 0.933 | 74% | 0.742 | S | S | * | * | trans | -52.8 | 115.1 | 174.2 | -77.7 | -92.4 | 0 | 0 | 0 | 110.3 | Q13 Y17 | Q13-Y15 PolarHBondContact O-N 2.92Å; Y15-Y17 PolarHBondContact O-N 3.13Å | ||
| 16 | T | 66.6 | Low | 59.7 | Low | 132 Ų | 132 | 150.1 Ų | 150.1 | 81% | 0.81 | 75% | 0.747 | S | S | * | * | trans | -77 | 116.5 | 168.3 | 49.1 | 0 | 0 | 0 | 0 | 108.8 | P14 H18 | P14-T16 PolarHBondContact O-N 2.68Å; P14-T16 VanDerWaalsContact O-N 3.11Å; T16-H18 PolarHBondContact O-N 3.17Å | ||
| 17 | Y | 50.3 | Low | 58.3 | Low | 192 Ų | 192 | 154.1 Ų | 154.1 | 75% | 0.753 | 76% | 0.759 | S | S | * | * | trans | -77.1 | 78.4 | -179.3 | -159.8 | -85.9 | 0 | 0 | 0 | 110.2 | Y15 | Y15-Y17 PolarHBondContact O-N 3.13Š| ||
| 18 | H | 53.7 | Low | 56.8 | Low | 179 Ų | 179 | 155.7 Ų | 155.7 | 83% | 0.829 | 77% | 0.772 | S | S | * | * | trans | -139.6 | 86.9 | 171.6 | -91.8 | 35.6 | 0 | 0 | 0 | 108.3 | T16 | T16-H18 PolarHBondContact O-N 3.17Š| ||
| 19 | D | 47.9 | Very low | 55.2 | Low | 153 Ų | 153 | 151.9 Ų | 151.9 | 82% | 0.818 | 78% | 0.776 | S | S | * | * | trans | 162.8 | 78.7 | 143.8 | -113 | -13.4 | 0 | 0 | 0 | 110 | ||||
| 20 | Q | 53.3 | Low | 53.8 | Low | 169 Ų | 169 | 149.7 Ų | 149.7 | 79% | 0.79 | 78% | 0.783 | S | S | * | * | trans | -148.3 | 60.1 | 164.4 | -66.4 | -170.6 | 39.6 | 0 | 0 | 108.6 | ||||
| 21 | A | 44.5 | Very low | 53 | Low | 98 Ų | 98 | 149.9 Ų | 149.9 | 81% | 0.81 | 80% | 0.796 | S | S | * | * | trans | -146.9 | 52 | 171.8 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 22 | T | 54.9 | Low | 51.9 | Low | 117 Ų | 117 | 147.4 Ų | 147.4 | 72% | 0.718 | 79% | 0.791 | S | S | * | * | trans | -120.4 | 139.9 | 157.8 | 57.8 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 23 | M | 49.3 | Very low | 50.8 | Low | 172 Ų | 172 | 150.3 Ų | 150.3 | 85% | 0.847 | 80% | 0.802 | S | S | * | * | trans | 91.2 | 80.2 | 179.9 | -47.4 | -154.2 | 164.2 | 0 | 0 | 114.1 | ||||
| 24 | F | 47.4 | Very low | 49.8 | Very low | 213 Ų | 213 | 146.9 Ų | 146.9 | 93% | 0.934 | 80% | 0.8 | S | S | * | * | trans | -177 | 94.5 | 130.2 | -91.9 | -67.6 | 0 | 0 | 0 | 107.2 | ||||
| 25 | S | 42.8 | Very low | 49 | Very low | 105 Ų | 105 | 148 Ų | 148 | 73% | 0.734 | 81% | 0.805 | S | S | * | * | trans | -118.8 | 153.4 | 165.8 | -63.4 | 0 | 0 | 0 | 0 | 108 | ||||
| 26 | D | 46.9 | Very low | 48.1 | Very low | 161 Ų | 161 | 144.4 Ų | 144.4 | 86% | 0.861 | 80% | 0.801 | S | S | * | * | trans | 82.9 | 134.7 | 177.2 | -45.1 | -25.4 | 0 | 0 | 0 | 113.7 | ||||
| 27 | D | 48.3 | Very low | 46.8 | Very low | 149 Ų | 149 | 142.7 Ų | 142.7 | 80% | 0.797 | 80% | 0.801 | S | S | * | * | cis | -161.4 | 160.2 | 22.1 | -168.8 | 9.2 | 0 | 0 | 0 | 110.9 | ||||
| 28 | S | 45.1 | Very low | 46.3 | Very low | 95 Ų | 95 | 138.7 Ų | 138.7 | 66% | 0.664 | 80% | 0.801 | S | S | * | * | trans | -24.8 | 143.5 | 169.8 | -51.7 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 29 | S | 48.2 | Very low | 45.8 | Very low | 122 Ų | 122 | 137.6 Ų | 137.6 | 85% | 0.853 | 80% | 0.801 | S | S | * | * | 179.9 | 146.1 | 112.2 | -80.4 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 30 | S | 45.1 | Very low | 45.3 | Very low | 101 Ų | 101 | 133.8 Ų | 133.8 | 71% | 0.706 | 80% | 0.798 | S | S | * | * | trans | -61.5 | 148 | -176.4 | 46.8 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 31 | D | 50.4 | Low | 45 | Very low | 163 Ų | 163 | 133.6 Ų | 133.6 | 87% | 0.872 | 80% | 0.797 | S | S | * | * | -165.7 | 126 | 123.8 | -95.4 | -22.2 | 0 | 0 | 0 | 112.4 | |||||
| 32 | T | 47.2 | Very low | 45.1 | Very low | 129 Ų | 129 | 135.7 Ų | 135.7 | 79% | 0.791 | 79% | 0.79 | S | S | * | * | trans | -80.2 | 129.8 | 171.6 | 31.7 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 33 | F | 43.6 | Very low | 44.5 | Very low | 212 Ų | 212 | 135.9 Ų | 135.9 | 93% | 0.93 | 79% | 0.79 | S | S | * | * | trans | -142.3 | 120.8 | 144.8 | -115.5 | -87.6 | 0 | 0 | 0 | 110.9 | ||||
| 34 | A | 38.9 | Very low | 44.3 | Very low | 78 Ų | 78 | 137.4 Ų | 137.4 | 65% | 0.645 | 79% | 0.793 | S | S | * | * | trans | -73.5 | 143.1 | 171.6 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 35 | T | 47.2 | Very low | 44.6 | Very low | 131 Ų | 131 | 132.4 Ų | 132.4 | 80% | 0.804 | 78% | 0.784 | S | S | * | * | 168.6 | 120.2 | 112.9 | 36.1 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 36 | N | 38.8 | Very low | 44.6 | Very low | 161 Ų | 161 | 136.2 Ų | 136.2 | 86% | 0.861 | 79% | 0.788 | S | S | * | * | trans | 17.3 | 117.2 | 145.5 | -59.7 | -13.9 | 0 | 0 | 0 | 119.7 | ||||
| 37 | A | 40.3 | Very low | 44.8 | Very low | 97 Ų | 97 | 134.4 Ų | 134.4 | 80% | 0.802 | 78% | 0.782 | S | S | * | * | -163.7 | 127.2 | 127.5 | 0 | 0 | 0 | 0 | 0 | 111 | |||||
| 38 | S | 38.3 | Very low | 44.8 | Very low | 107 Ų | 107 | 131.6 Ų | 131.6 | 75% | 0.748 | 77% | 0.774 | S | S | * | * | trans | -43.6 | 123.7 | 168.7 | 49 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 39 | N | 42.7 | Very low | 45.1 | Very low | 157 Ų | 157 | 136.9 Ų | 136.9 | 84% | 0.84 | 79% | 0.785 | S | S | * | * | 164 | 114.2 | 128.6 | -91.5 | -12.4 | 0 | 0 | 0 | 109.9 | Q41 | N39-Q41 PolarHBondContact O-N 3.38Š| |||
| 40 | G | 39.1 | Very low | 44.7 | Very low | 72 Ų | 72 | 142.4 Ų | 142.4 | 74% | 0.742 | 79% | 0.787 | S | S | * | * | trans | -60 | 124 | 168.4 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 41 | Q | 46.1 | Very low | 44.5 | Very low | 165 Ų | 165 | 141.7 Ų | 141.7 | 77% | 0.771 | 78% | 0.782 | S | S | * | * | 56.4 | 115.1 | 86.5 | -110.9 | -177.8 | -10.6 | 0 | 0 | 110.6 | N39 | N39-Q41 PolarHBondContact O-N 3.38Š| |||
| 42 | Q | 45.7 | Very low | 44.1 | Very low | 142 Ų | 142 | 143.1 Ų | 143.1 | 66% | 0.664 | 78% | 0.784 | S | S | * | * | -171.5 | 141.7 | 56 | -96.1 | -62.7 | 10 | 0 | 0 | 111.8 | |||||
| 43 | V | 43.3 | Very low | 43.9 | Very low | 121 Ų | 121 | 145.4 Ų | 145.4 | 73% | 0.733 | 79% | 0.786 | S | S | * | * | trans | 58.8 | 106.4 | 151.9 | -159.1 | 0 | 0 | 0 | 0 | 120.7 | S45 | V43-S45 PolarHBondContact O-N 3.04Š| ||
| 44 | K | 45.9 | Very low | 43.6 | Very low | 205 Ų | 205 | 138.3 Ų | 138.3 | 89% | 0.891 | 77% | 0.772 | S | S | * | * | trans | -72.3 | 115.4 | 164.3 | -72.4 | 165.7 | 174 | 172.9 | 0 | 111 | F46 | K44-F46 PolarHBondContact O-N 3.23Š| ||
| 45 | S | 53.2 | Low | 43.7 | Very low | 108 Ų | 108 | 142.4 Ų | 142.4 | 76% | 0.755 | 78% | 0.781 | S | S | * | * | trans | -76.7 | 109.4 | 162 | 58.6 | 0 | 0 | 0 | 0 | 109.8 | V43 V47 | V43-S45 PolarHBondContact O-N 3.04Å; S45-V47 PolarHBondContact O-N 3.19Å | ||
| 46 | F | 42.2 | Very low | 43.3 | Very low | 185 Ų | 185 | 147.3 Ų | 147.3 | 81% | 0.811 | 79% | 0.785 | S | S | * | * | trans | -85 | 91.2 | 172.8 | -157.9 | -93.1 | 0 | 0 | 0 | 109.2 | K44 S48 | K44-F46 PolarHBondContact O-N 3.23Å; F46-S48 WeakPolarHBondContact CE1-OG 3.37Å; F46-S48 PolarHBondContact O-N 3.32Å | ||
| 47 | V | 50.4 | Low | 43.5 | Very low | 123 Ų | 123 | 145.4 Ų | 145.4 | 75% | 0.745 | 78% | 0.781 | S | S | * | * | trans | -82.6 | 103.1 | 163.1 | 171.5 | 0 | 0 | 0 | 0 | 106.7 | S45 K49 | S45-V47 PolarHBondContact O-N 3.19Å; V47-K49 PolarHBondContact O-N 3Å | ||
| 48 | S | 49.1 | Very low | 43.4 | Very low | 90 Ų | 90 | 144.9 Ų | 144.9 | 63% | 0.629 | 78% | 0.777 | S | S | * | * | trans | -56.7 | 105.2 | 168.5 | -76.3 | 0 | 0 | 0 | 0 | 109.3 | F46 R50 | F46-S48 WeakPolarHBondContact CE1-OG 3.37Å; F46-S48 PolarHBondContact O-N 3.32Å; S48-R50 PolarHBondContact O-N 3.1Å | ||
| 49 | K | 51.3 | Low | 43.3 | Very low | 205 Ų | 205 | 146.9 Ų | 146.9 | 89% | 0.891 | 78% | 0.78 | S | S | * | * | trans | -60.1 | 107.4 | 163.3 | -74 | -176.8 | 177 | -179.8 | 0 | 107.4 | V47 S51 | V47-K49 PolarHBondContact O-N 3Å; K49-S51 PolarHBondContact O-N 3.15Å | ||
| 50 | R | 39.8 | Very low | 43.5 | Very low | 238 Ų | 238 | 146.2 Ų | 146.2 | 90% | 0.898 | 78% | 0.781 | S | S | * | * | trans | -66.3 | 115.6 | 169 | -169.4 | 176.2 | -163 | -160 | 2.1 | 107.5 | S48 E52 | S48-R50 PolarHBondContact O-N 3.1Å; R50-E52 PolarHBondContact O-N 3.41Å | ||
| 51 | S | 41.8 | Very low | 43.3 | Very low | 87 Ų | 87 | 148.4 Ų | 148.4 | 61% | 0.608 | 79% | 0.785 | S | S | * | * | trans | -52.3 | 126.8 | 173.4 | 162 | 0 | 0 | 0 | 0 | 110.8 | K49 Q53 | K49-S51 PolarHBondContact O-N 3.15Å; S51-Q53 PolarHBondContact O-N 3.39Å; S51-Q53 VanDerWaalsContact O-N 3.08Å | ||
| 52 | E | 41.7 | Very low | 42.8 | Very low | 193 Ų | 193 | 148.5 Ų | 148.5 | 90% | 0.902 | 78% | 0.783 | S | S | * | * | trans | -72.2 | 83.1 | 171.2 | -66.4 | -169.6 | 154.7 | 0 | 0 | 110.1 | R50 | R50-E52 PolarHBondContact O-N 3.41Š| ||
| 53 | Q | 43.1 | Very low | 42.2 | Very low | 177 Ų | 177 | 150.4 Ų | 150.4 | 83% | 0.827 | 79% | 0.793 | S | S | * | * | trans | -142.9 | 109.9 | 164.8 | -68.1 | -172.7 | -2.4 | 0 | 0 | 108.8 | S51 | S51-Q53 PolarHBondContact O-N 3.39Å; S51-Q53 VanDerWaalsContact O-N 3.08Å | ||
| 54 | G | 37 | Very low | 42.2 | Very low | 62 Ų | 62 | 151.1 Ų | 151.1 | 64% | 0.639 | 79% | 0.791 | S | S | * | * | trans | 141.9 | 48.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | W56 | G54-W56 PolarHBondContact O-N 3.12Š| ||
| 55 | I | 41.2 | Very low | 41.7 | Very low | 165 Ų | 165 | 147.3 Ų | 147.3 | 85% | 0.846 | 79% | 0.79 | S | S | * | * | trans | -77.7 | 102.1 | 166.8 | -60.6 | 164.1 | 0 | 0 | 0 | 106.2 | ||||
| 56 | W | 39.1 | Very low | 40.9 | Very low | 234 Ų | 234 | 145.6 Ų | 145.6 | 89% | 0.886 | 79% | 0.79 | S | S | * | * | trans | -78.8 | 118.9 | 166.3 | -66.9 | 89.5 | 0 | 0 | 0 | 107.5 | G54 A58 | G54-W56 PolarHBondContact O-N 3.12Å; W56-A58 PolarHBondContact O-N 3.28Å | ||
| 57 | P | 42.8 | Very low | 41 | Very low | 120 Ų | 120 | 145.3 Ų | 145.3 | 78% | 0.779 | 79% | 0.791 | S | S | * | * | trans | -72.4 | 116.4 | 176.8 | 3.9 | 10.5 | 0 | 0 | 0 | 108.5 | ||||
| 58 | A | 36.9 | Very low | 40.4 | Very low | 87 Ų | 87 | 147.7 Ų | 147.7 | 72% | 0.719 | 79% | 0.794 | S | S | * | * | trans | -81.7 | 113 | 157.6 | 0 | 0 | 0 | 0 | 0 | 106.1 | W56 | W56-A58 PolarHBondContact O-N 3.28Š| ||
| 59 | D | 36 | Very low | 39.9 | Very low | 149 Ų | 149 | 147.4 Ų | 147.4 | 80% | 0.797 | 80% | 0.797 | S | S | * | * | trans | 167.2 | 88.6 | 151.1 | -83.7 | -15.8 | 0 | 0 | 0 | 109 | ||||
| 60 | T | 47 | Very low | 39.5 | Very low | 142 Ų | 142 | 142.9 Ų | 142.9 | 87% | 0.871 | 79% | 0.791 | S | S | * | * | trans | -133 | 88.3 | 152 | 42.7 | 0 | 0 | 0 | 0 | 107.9 | F62 | T60-F62 PolarHBondContact O-N 3.09Å; T60-F62 VanDerWaalsContact O-N 3.15Å | ||
| 61 | S | 35.3 | Very low | 40 | Very low | 118 Ų | 118 | 140.2 Ų | 140.2 | 83% | 0.825 | 79% | 0.789 | S | S | * | * | trans | -51.4 | 112 | 162.2 | -49.9 | 0 | 0 | 0 | 0 | 109 | ||||
| 62 | F | 35.5 | Very low | 40.2 | Very low | 167 Ų | 167 | 141.7 Ų | 141.7 | 73% | 0.732 | 80% | 0.799 | S | S | * | * | trans | -120.4 | 96.9 | 164.9 | -166.2 | -118.2 | 0 | 0 | 0 | 107 | T60 L64 | T60-F62 PolarHBondContact O-N 3.09Å; T60-F62 VanDerWaalsContact O-N 3.15Å; F62-L64 HydrophobicContact CD1-CD1 4.02Å; F62-L64 HydrophobicContact CD1-CG 4Å; F62-L64 HydrophobicContact CE1-CB 4.48Å; F62-L64 HydrophobicContact CE1-CD1 3.2Å; F62-L64 HydrophobicContact CE1-CG 3.48Å; F62-L64 VanDerWaalsContact CE1-CG 3.48Å; F62-L64 HydrophobicContact CZ-CD1 3.81Å; F62-L64 HydrophobicContact CZ-CG 3.93Å; F62-L64 PolarHBondContact O-N 3.4Å | ||
| 63 | E | 34.1 | Very low | 40.2 | Very low | 183 Ų | 183 | 135.5 Ų | 135.5 | 86% | 0.855 | 78% | 0.776 | S | S | * | * | trans | -66.6 | 115.3 | 165.8 | -75.7 | -157.2 | 150.2 | 0 | 0 | 108.5 | ||||
| 64 | L | 42.2 | Very low | 40.8 | Very low | 135 Ų | 135 | 131.2 Ų | 131.2 | 71% | 0.707 | 77% | 0.766 | S | S | * | * | trans | -132.6 | 112.9 | 154.4 | -83.7 | -178 | 0 | 0 | 0 | 108.6 | F62 | F62-L64 HydrophobicContact CD1-CD1 4.02Å; F62-L64 HydrophobicContact CD1-CG 4Å; F62-L64 HydrophobicContact CE1-CB 4.48Å; F62-L64 HydrophobicContact CE1-CD1 3.2Å; F62-L64 HydrophobicContact CE1-CG 3.48Å; F62-L64 VanDerWaalsContact CE1-CG 3.48Å; F62-L64 HydrophobicContact CZ-CD1 3.81Å; F62-L64 HydrophobicContact CZ-CG 3.93Å; F62-L64 PolarHBondContact O-N 3.4Å | ||
| 65 | S | 36.2 | Very low | 41.4 | Very low | 125 Ų | 125 | 135 Ų | 135 | 87% | 0.874 | 76% | 0.761 | S | S | * | * | trans | -44.3 | 139.2 | 165.1 | 16.9 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 66 | G | 37.3 | Very low | 41.6 | Very low | 72 Ų | 72 | 135.7 Ų | 135.7 | 74% | 0.742 | 76% | 0.76 | S | S | * | * | trans | 151.2 | 80.1 | 167.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 67 | E | 42.8 | Very low | 42.1 | Very low | 179 Ų | 179 | 130.8 Ų | 130.8 | 84% | 0.836 | 75% | 0.75 | S | S | * | * | trans | 28.4 | 128.7 | 133.5 | -85 | 173 | 137.6 | 0 | 0 | 121.4 | ||||
| 68 | E | 37.9 | Very low | 42.5 | Very low | 174 Ų | 174 | 131.2 Ų | 131.2 | 81% | 0.813 | 75% | 0.751 | S | S | * | * | trans | 96.8 | 124.3 | 149.1 | -58.5 | -66 | 116 | 0 | 0 | 121.3 | ||||
| 69 | A | 39.1 | Very low | 43.3 | Very low | 83 Ų | 83 | 136.4 Ų | 136.4 | 69% | 0.686 | 76% | 0.757 | S | S | * | * | trans | 83.9 | 87 | 148 | 0 | 0 | 0 | 0 | 0 | 121.6 | H71 | A69-H71 PolarHBondContact O-N 3.07Š| ||
| 70 | S | 42.8 | Very low | 44 | Very low | 111 Ų | 111 | 134.9 Ų | 134.9 | 78% | 0.776 | 76% | 0.756 | S | S | * | * | 62.6 | 36.6 | 116.9 | -61.8 | 0 | 0 | 0 | 0 | 122.7 | |||||
| 71 | H | 51.4 | Low | 44.1 | Very low | 182 Ų | 182 | 136 Ų | 136 | 84% | 0.843 | 76% | 0.755 | S | S | * | * | trans | -146 | 57.7 | 156.6 | -71.9 | -80.2 | 0 | 0 | 0 | 112.7 | A69 C73 | A69-H71 PolarHBondContact O-N 3.07Å; H71-C73 PolarHBondContact O-N 3.41Å | ||
| 72 | S | 46 | Very low | 44.6 | Very low | 118 Ų | 118 | 137.8 Ų | 137.8 | 83% | 0.825 | 75% | 0.754 | S | S | * | * | trans | -73.1 | 97.9 | 177.7 | -175.4 | 0 | 0 | 0 | 0 | 111.8 | S74 | S72-S74 PolarHBondContact O-N 3.49Š| ||
| 73 | C | 40.7 | Very low | 44.8 | Very low | 63 Ų | 63 | 135.6 Ų | 135.6 | 43% | 0.426 | 75% | 0.75 | S | S | . | * | trans | -95.2 | 74.6 | 165.3 | -164.4 | 0 | 0 | 0 | 0 | 108.7 | H71 W75 | H71-C73 PolarHBondContact O-N 3.41Å; C73-W75 VanDerWaalsContact O-CD1 3.28Å; C73-W75 PolarHBondContact O-N 3.19Å; C73-W75 PolarHBondContact O-NE1 2.95Å; C73-W75 WeakPolarHBondContact SG-CZ2 3.49Å | ||
| 74 | S | 55.3 | Low | 45.4 | Very low | 86 Ų | 86 | 135.5 Ų | 135.5 | 60% | 0.601 | 75% | 0.747 | S | S | * | * | trans | -70.9 | 116.4 | 178.9 | -178.6 | 0 | 0 | 0 | 0 | 111.3 | S72 Q76 | S72-S74 PolarHBondContact O-N 3.49Å; S74-Q76 VanDerWaalsContact C-N 3.33Å | ||
| 75 | W | 51 | Low | 45.5 | Very low | 141 Ų | 141 | 139.6 Ų | 139.6 | 53% | 0.534 | 75% | 0.753 | S | S | . | * | trans | -86.4 | 3.9 | -177.9 | -70.2 | 105.1 | 0 | 0 | 0 | 114.4 | C73 I77 R140 A144 | C73-W75 VanDerWaalsContact O-CD1 3.28Å; C73-W75 PolarHBondContact O-N 3.19Å; C73-W75 PolarHBondContact O-NE1 2.95Å; C73-W75 WeakPolarHBondContact SG-CZ2 3.49Å; W75-I77 PolarHBondContact O-N 2.88Å; W75-R140 HydrophobicContact CH2-CB 3.86Å; W75-R140 WeakPolarHBondContact CH2-O 3.27Å; W75-R140 HydrophobicContact CZ3-CB 3.73Å; W75-R140 HydrophobicContact CZ3-CG 4.19Å; W75-A144 HydrophobicContact CH2-CB 4.14Å; W75-A144 HydrophobicContact CZ2-CB 3.41Å; W75-A144 VanDerWaalsContact CZ2-CB 3.41Å | ||
| 76 | Q | 43.7 | Very low | 45.5 | Very low | 180 Ų | 180 | 142.4 Ų | 142.4 | 84% | 0.841 | 75% | 0.746 | S | S | * | * | trans | -86.2 | 76.3 | -172.4 | -61.5 | -166.7 | -8.4 | 0 | 0 | 111.5 | S74 | S74-Q76 VanDerWaalsContact C-N 3.33Š| ||
| 77 | I | 51 | Low | 46.2 | Very low | 131 Ų | 131 | 144.8 Ų | 144.8 | 67% | 0.672 | 74% | 0.74 | S | S | * | * | trans | -96.8 | 110.2 | 164.4 | -62.5 | 171 | 0 | 0 | 0 | 107.4 | W75 | W75-I77 PolarHBondContact O-N 2.88Š| ||
| 78 | T | 49.5 | Very low | 46.2 | Very low | 130 Ų | 130 | 141 Ų | 141 | 80% | 0.798 | 73% | 0.725 | S | S | * | * | trans | -43.3 | 130.4 | 169 | 33.3 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 79 | K | 53.8 | Low | 46.3 | Very low | 195 Ų | 195 | 140.8 Ų | 140.8 | 85% | 0.848 | 72% | 0.722 | S | S | * | * | trans | -60.9 | 132 | 175.6 | -63.1 | 176.6 | -178.2 | 172.4 | 0 | 108.7 | I81 | K79-I81 PolarHBondContact O-N 3.32Š| ||
| 80 | P | 52.2 | Low | 46.8 | Very low | 117 Ų | 117 | 142.3 Ų | 142.3 | 76% | 0.76 | 72% | 0.723 | S | S | * | * | trans | -67.5 | 129.1 | 171.5 | 28.3 | -31.1 | 0 | 0 | 0 | 108.6 | L82 | P80-L82 PolarHBondContact O-N 3.36Å; P80-L82 VanDerWaalsContact O-N 3.08Å | ||
| 81 | I | 48.3 | Very low | 46.9 | Very low | 166 Ų | 166 | 145.3 Ų | 145.3 | 85% | 0.851 | 73% | 0.725 | S | S | * | * | trans | -60.1 | 108.7 | 171.7 | -64.9 | 161.7 | 0 | 0 | 0 | 106.7 | K79 D83 | K79-I81 PolarHBondContact O-N 3.32Å; I81-D83 PolarHBondContact O-N 3.43Å | ||
| 82 | L | 46.7 | Very low | 46.4 | Very low | 156 Ų | 156 | 145.5 Ų | 145.5 | 82% | 0.817 | 73% | 0.731 | S | S | * | * | trans | -70.6 | 106.2 | 170 | -112.2 | 120.2 | 0 | 0 | 0 | 107.4 | P80 K84 | P80-L82 PolarHBondContact O-N 3.36Å; P80-L82 VanDerWaalsContact O-N 3.08Å; L82-K84 PolarHBondContact O-N 3.3Å | ||
| 83 | D | 39.5 | Very low | 46 | Very low | 120 Ų | 120 | 143 Ų | 143 | 64% | 0.642 | 72% | 0.723 | S | S | * | * | trans | -60 | 104.5 | 168.3 | -177.1 | 13 | 0 | 0 | 0 | 108.9 | I81 R85 | I81-D83 PolarHBondContact O-N 3.43Å; D83-R85 VanDerWaalsContact C-N 3.33Å; D83-R85 PolarHBondContact O-N 2.95Å | ||
| 84 | K | 45.3 | Very low | 46 | Very low | 181 Ų | 181 | 149.4 Ų | 149.4 | 79% | 0.787 | 75% | 0.747 | S | S | * | * | trans | -76.8 | 82.5 | 176.2 | -71 | -173.8 | 179.3 | -176.3 | 0 | 108.8 | L82 Y86 | L82-K84 PolarHBondContact O-N 3.3Å; K84-Y86 PolarHBondContact O-N 2.91Å | ||
| 85 | R | 45.2 | Very low | 45.1 | Very low | 222 Ų | 222 | 149.8 Ų | 149.8 | 84% | 0.838 | 76% | 0.756 | S | S | * | * | trans | -71.3 | 76.2 | 149.9 | -65.7 | -170.3 | -163 | 169.7 | 3.4 | 108.1 | D83 | D83-R85 VanDerWaalsContact C-N 3.33Å; D83-R85 PolarHBondContact O-N 2.95Å | ||
| 86 | Y | 36.9 | Very low | 44.8 | Very low | 184 Ų | 184 | 152.2 Ų | 152.2 | 72% | 0.722 | 77% | 0.773 | S | S | * | * | trans | -68.2 | 122.4 | 171.4 | -174.4 | -98.2 | 0 | 0 | 0 | 107.6 | K84 D88 | K84-Y86 PolarHBondContact O-N 2.91Å; Y86-D88 PolarHBondContact O-N 3.09Å | ||
| 87 | I | 51.4 | Low | 45.1 | Very low | 121 Ų | 121 | 147.8 Ų | 147.8 | 62% | 0.621 | 77% | 0.767 | S | S | * | * | trans | -64.9 | 115.1 | 170.6 | -63 | 171.2 | 0 | 0 | 0 | 106.4 | F89 | I87-F89 HydrophobicContact CB-CD2 4.37Å; I87-F89 HydrophobicContact CB-CE2 3.94Å; I87-F89 HydrophobicContact CG2-CD2 4.09Å; I87-F89 HydrophobicContact CG2-CE2 3.74Å; I87-F89 HydrophobicContact CG2-CZ 3.98Å; I87-F89 VanDerWaalsContact O-CD2 3.3Å; I87-F89 WeakPolarHBondContact O-CD2 3.24Å; I87-F89 PolarHBondContact O-N 3.35Å | ||
| 88 | D | 42.6 | Very low | 44.7 | Very low | 100 Ų | 100 | 148.5 Ų | 148.5 | 54% | 0.535 | 78% | 0.777 | S | S | . | * | trans | -72.7 | 106.3 | 176.5 | -172.6 | 7 | 0 | 0 | 0 | 109.2 | Y86 T90 | Y86-D88 PolarHBondContact O-N 3.09Å; D88-T90 PolarHBondContact O-N 3.41Å; D88-T90 VanDerWaalsContact OD1-CB 3.29Å; D88-T90 WeakPolarHBondContact OD1-CB 3.26Å; D88-T90 PolarHBondContact OD1-N 2.84Å; D88-T90 PolarHBondContact OD1-OG1 3.13Å | ||
| 89 | F | 40.6 | Very low | 45 | Very low | 169 Ų | 169 | 147.5 Ų | 147.5 | 74% | 0.741 | 78% | 0.775 | S | S | * | * | trans | -84.7 | 14.5 | -179.7 | -82.5 | -81.6 | 0 | 0 | 0 | 113.2 | I87 Q91 | I87-F89 HydrophobicContact CB-CD2 4.37Å; I87-F89 HydrophobicContact CB-CE2 3.94Å; I87-F89 HydrophobicContact CG2-CD2 4.09Å; I87-F89 HydrophobicContact CG2-CE2 3.74Å; I87-F89 HydrophobicContact CG2-CZ 3.98Å; I87-F89 VanDerWaalsContact O-CD2 3.3Å; I87-F89 WeakPolarHBondContact O-CD2 3.24Å; I87-F89 PolarHBondContact O-N 3.35Å; F89-Q91 PolarHBondContact O-N 3.03Å | ||
| 90 | T | 49.3 | Very low | 45 | Very low | 116 Ų | 116 | 144.5 Ų | 144.5 | 71% | 0.712 | 77% | 0.769 | S | S | * | * | trans | -96.4 | 20.9 | -165.3 | -27 | 0 | 0 | 0 | 0 | 115.4 | D88 | D88-T90 PolarHBondContact O-N 3.41Å; D88-T90 VanDerWaalsContact OD1-CB 3.29Å; D88-T90 WeakPolarHBondContact OD1-CB 3.26Å; D88-T90 PolarHBondContact OD1-N 2.84Å; D88-T90 PolarHBondContact OD1-OG1 3.13Å | ||
| 91 | Q | 45.5 | Very low | 44.6 | Very low | 174 Ų | 174 | 144.5 Ų | 144.5 | 81% | 0.813 | 77% | 0.769 | S | S | * | * | trans | -121.5 | 18.5 | -174.2 | -78.6 | -167.8 | 59.1 | 0 | 0 | 117.6 | F89 | F89-Q91 PolarHBondContact O-N 3.03Š| ||
| 92 | L | 40.5 | Very low | 44.7 | Very low | 186 Ų | 186 | 144.2 Ų | 144.2 | 97% | 0.974 | 77% | 0.768 | S | S | * | * | trans | -106.1 | 69.6 | 172.8 | -126.5 | 102.5 | 0 | 0 | 0 | 112.2 | ||||
| 93 | G | 37.1 | Very low | 45.1 | Very low | 64 Ų | 64 | 142.3 Ų | 142.3 | 66% | 0.66 | 76% | 0.762 | S | S | * | * | trans | -98.2 | 154.1 | 158.8 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 94 | E | 40.1 | Very low | 45.6 | Very low | 198 Ų | 198 | 140.7 Ų | 140.7 | 93% | 0.925 | 77% | 0.765 | S | S | * | * | trans | 86.2 | 77 | 175 | -57.8 | -178.5 | 175.2 | 0 | 0 | 116.3 | ||||
| 95 | A | 36.5 | Very low | 45.8 | Very low | 95 Ų | 95 | 142.5 Ų | 142.5 | 79% | 0.785 | 77% | 0.769 | S | S | * | * | trans | -69.6 | 118.5 | 151.2 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 96 | H | 45.4 | Very low | 46.3 | Very low | 192 Ų | 192 | 136.7 Ų | 136.7 | 89% | 0.889 | 76% | 0.76 | S | S | * | * | trans | -153.6 | 131.2 | 155.1 | -114.2 | -85.7 | 0 | 0 | 0 | 112.5 | ||||
| 97 | A | 48.9 | Very low | 46.8 | Very low | 86 Ų | 86 | 135.8 Ų | 135.8 | 71% | 0.711 | 76% | 0.76 | S | S | * | * | trans | 66.6 | 84.6 | 160.4 | 0 | 0 | 0 | 0 | 0 | 118.7 | S99 | A97-S99 PolarHBondContact O-N 2.97Š| ||
| 98 | V | 43.5 | Very low | 46.6 | Very low | 146 Ų | 146 | 136.8 Ų | 136.8 | 89% | 0.885 | 76% | 0.762 | S | S | * | * | trans | -53.9 | 116.3 | 152.6 | 178.8 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 99 | S | 55.8 | Low | 47.1 | Very low | 109 Ų | 109 | 135.7 Ų | 135.7 | 76% | 0.762 | 76% | 0.759 | S | S | * | * | trans | -139.4 | 125.4 | 158.3 | 56.8 | 0 | 0 | 0 | 0 | 110.3 | A97 | A97-S99 PolarHBondContact O-N 2.97Š| ||
| 100 | N | 52.8 | Low | 47.5 | Very low | 133 Ų | 133 | 133.9 Ų | 133.9 | 71% | 0.711 | 75% | 0.753 | S | S | * | * | trans | 81.2 | 87.4 | 170.3 | -116.8 | -8 | 0 | 0 | 0 | 119.7 | L102 | N100-L102 VanDerWaalsContact C-N 3.35Å; N100-L102 PolarHBondContact O-N 3.25Å | ||
| 101 | P | 44.7 | Very low | 47.5 | Very low | 117 Ų | 117 | 136.9 Ų | 136.9 | 76% | 0.76 | 75% | 0.751 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.7 | 54.2 | 173.4 | 39.4 | -32.6 | 0 | 0 | 0 | 111.4 | ||
| 102 | L | 50.6 | Low | 48 | Very low | 160 Ų | 160 | 132.7 Ų | 132.7 | 84% | 0.838 | 73% | 0.73 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -149.8 | 29.7 | 171.4 | -74 | -174.1 | 0 | 0 | 0 | 112.8 | N100 A104 | N100-L102 VanDerWaalsContact C-N 3.35Å; N100-L102 PolarHBondContact O-N 3.25Å; L102-A104 PolarHBondContact O-N 3.42Å |
| 103 | V | 54.7 | Low | 48.9 | Very low | 116 Ų | 116 | 128.8 Ų | 128.8 | 70% | 0.703 | 71% | 0.709 | S | S | * | * | trans | -77.4 | 108.8 | 163.2 | 175.4 | 0 | 0 | 0 | 0 | 106.6 | Y105 | V103-Y105 PolarHBondContact O-N 3.17Š| ||
| 104 | A | 50.8 | Low | 50.5 | Low | 85 Ų | 85 | 132.2 Ų | 132.2 | 70% | 0.702 | 71% | 0.712 | S | S | * | * | trans | -46.7 | 109.2 | 168.9 | 0 | 0 | 0 | 0 | 0 | 108.4 | L102 P106 | L102-A104 PolarHBondContact O-N 3.42Å; A104-P106 VanDerWaalsContact O-CD 3.27Å; A104-P106 WeakPolarHBondContact O-CD 3.31Å; A104-P106 VanDerWaalsContact O-N 3.1Å | ||
| 105 | Y | 48.1 | Very low | 51.7 | Low | 219 Ų | 219 | 128.8 Ų | 128.8 | 86% | 0.859 | 69% | 0.694 | S | S | * | * | trans | -56.6 | 119.6 | 166.2 | -99.2 | -91.9 | 0 | 0 | 0 | 105.7 | V103 F107 | V103-Y105 PolarHBondContact O-N 3.17Å; Y105-F107 PolarHBondContact O-N 3.46Å | ||
| 106 | P | 57.2 | Low | 53.3 | Low | 100 Ų | 100 | 127.8 Ų | 127.8 | 65% | 0.649 | 67% | 0.674 | S | S | * | * | trans | -55.8 | 118.2 | 161.5 | -9.1 | 23.8 | 0 | 0 | 0 | 103.7 | A104 E108 | A104-P106 VanDerWaalsContact O-CD 3.27Å; A104-P106 WeakPolarHBondContact O-CD 3.31Å; A104-P106 VanDerWaalsContact O-N 3.1Å; P106-E108 PolarHBondContact O-N 3.13Å | ||
| 107 | F | 47.2 | Very low | 54.4 | Low | 166 Ų | 166 | 120.6 Ų | 120.6 | 73% | 0.728 | 65% | 0.648 | S | S | * | * | trans | -60.1 | 90.8 | 164.1 | 145.5 | -105.5 | 0 | 0 | 0 | 105 | Y105 T109 | Y105-F107 PolarHBondContact O-N 3.46Å; F107-T109 HydrophobicContact CD1-CG2 4.39Å; F107-T109 HydrophobicContact CE1-CG2 3.42Å; F107-T109 VanDerWaalsContact CE1-CG2 3.42Å; F107-T109 HydrophobicContact CE2-CG2 3.64Å; F107-T109 HydrophobicContact CZ-CG2 2.99Å; F107-T109 PolarHBondContact O-N 2.7Å | ||
| 108 | E | 47.5 | Very low | 55.3 | Low | 142 Ų | 142 | 122.4 Ų | 122.4 | 66% | 0.664 | 64% | 0.642 | S | S | * | * | trans | -66.6 | 90.4 | 172.6 | -84.8 | -165.9 | -178.3 | 0 | 0 | 106.2 | P106 E110 | P106-E108 PolarHBondContact O-N 3.13Å; E108-E110 VanDerWaalsContact C-CA 3.47Å; E108-E110 VanDerWaalsContact C-N 3.25Å; E108-E110 WeakPolarHBondContact O-CA 3.49Å | ||
| 109 | T | 53.2 | Low | 56.4 | Low | 77 Ų | 77 | 119.1 Ų | 119.1 | 47% | 0.472 | 63% | 0.625 | S | S | . | * | trans | -85.6 | 1.5 | 173.3 | 75.5 | 0 | 0 | 0 | 0 | 111.9 | F107 W111 | F107-T109 HydrophobicContact CD1-CG2 4.39Å; F107-T109 HydrophobicContact CE1-CG2 3.42Å; F107-T109 VanDerWaalsContact CE1-CG2 3.42Å; F107-T109 HydrophobicContact CE2-CG2 3.64Å; F107-T109 HydrophobicContact CZ-CG2 2.99Å; F107-T109 PolarHBondContact O-N 2.7Å; T109-W111 PolarHBondContact O-N 3.09Å | ||
| 110 | E | 47.7 | Very low | 57 | Low | 131 Ų | 131 | 120.7 Ų | 120.7 | 61% | 0.612 | 62% | 0.618 | S | S | * | * | 30.5 | 12.1 | 96 | -74.9 | -172.4 | -157.4 | 0 | 0 | 121.3 | E108 K112 | E108-E110 VanDerWaalsContact C-CA 3.47Å; E108-E110 VanDerWaalsContact C-N 3.25Å; E108-E110 WeakPolarHBondContact O-CA 3.49Å; E110-K112 PolarHBondContact O-N 3.11Å; E110-K112 WeakPolarHBondContact OE2-CE 3.3Å; E110-K112 IonicContact OE2-NZ 3.65Å | |||
| 111 | W | 49.4 | Very low | 57.8 | Low | 179 Ų | 179 | 123.1 Ų | 123.1 | 68% | 0.678 | 62% | 0.618 | S | S | * | * | trans | -65.2 | 89.3 | 178.5 | -72.6 | 90.8 | 0 | 0 | 0 | 107.4 | T109 M113 | T109-W111 PolarHBondContact O-N 3.09Å; W111-M113 HydrophobicContact CB-CG 3.82Å; W111-M113 HydrophobicContact CE3-CE 4.16Å; W111-M113 PolarHBondContact O-N 3.19Å | ||
| 112 | K | 57.2 | Low | 58.8 | Low | 85 Ų | 85 | 123 Ų | 123 | 37% | 0.37 | 61% | 0.61 | S | S | . | * | trans | -67.9 | 57.5 | 167.6 | -76.5 | 166.8 | 177 | 143.3 | 0 | 108.7 | E110 D114 K115 I116 | E110-K112 PolarHBondContact O-N 3.11Å; E110-K112 WeakPolarHBondContact OE2-CE 3.3Å; E110-K112 IonicContact OE2-NZ 3.65Å; K112-D114 PolarHBondContact O-N 3.34Å; K112-K115 HydrophobicContact CB-CB 4.13Å; K112-K115 HydrophobicContact CB-CD 4.29Å; K112-K115 HydrophobicContact CB-CG 4.06Å; K112-K115 HydrophobicContact CD-CD 4Å; K112-K115 HydrophobicContact CG-CD 4.41Å; K112-K115 PolarHBondContact O-N 3.35Å; K112-I116 PolarHBondContact O-N 3.47Å | ||
| 113 | M | 59.5 | Low | 59.8 | Low | 105 Ų | 105 | 117.6 Ų | 117.6 | 52% | 0.517 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -54.1 | -35.7 | 173.9 | -72.2 | -109.3 | 90 | 0 | 0 | 109.1 | W111 I116 A117 | W111-M113 HydrophobicContact CB-CG 3.82Å; W111-M113 HydrophobicContact CE3-CE 4.16Å; W111-M113 PolarHBondContact O-N 3.19Å; M113-I116 PolarHBondContact O-N 3.07Å; M113-A117 WeakPolarHBondContact O-CB 3.2Å; M113-A117 PolarHBondContact O-N 3.17Å |
| 114 | D | 68.8 | Low | 60.8 | Low | 135 Ų | 135 | 115 Ų | 115 | 72% | 0.722 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -62.8 | -44.7 | 175.5 | -63.6 | -23.9 | 0 | 0 | 0 | 112.3 | K112 A117 E118 | K112-D114 PolarHBondContact O-N 3.34Å; D114-A117 PolarHBondContact O-N 3.11Å; D114-E118 VanDerWaalsContact O-CB 3.25Å; D114-E118 WeakPolarHBondContact O-CB 3.33Å; D114-E118 PolarHBondContact O-N 2.76Å |
| 115 | K | 67.1 | Low | 62.3 | Low | 127 Ų | 127 | 115.3 Ų | 115.3 | 55% | 0.552 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -69 | -35.7 | 177.6 | -60.3 | -164.7 | -174 | -170.5 | 0 | 112.3 | K112 S119 | K112-K115 HydrophobicContact CB-CB 4.13Å; K112-K115 HydrophobicContact CB-CD 4.29Å; K112-K115 HydrophobicContact CB-CG 4.06Å; K112-K115 HydrophobicContact CD-CD 4Å; K112-K115 HydrophobicContact CG-CD 4.41Å; K112-K115 PolarHBondContact O-N 3.35Å; K115-S119 WeakPolarHBondContact O-CB 3.41Å; K115-S119 PolarHBondContact O-N 3.34Å; K115-S119 PolarHBondContact O-OG 2.98Å |
| 116 | I | 68.3 | Low | 64.1 | Low | 74 Ų | 74 | 108.1 Ų | 108.1 | 38% | 0.379 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -69.7 | -41.7 | 174.9 | -63.4 | 170.2 | 0 | 0 | 0 | 110.2 | K112 M113 S119 K120 | K112-I116 PolarHBondContact O-N 3.47Å; M113-I116 PolarHBondContact O-N 3.07Å; I116-S119 PolarHBondContact O-N 3.14Å; I116-K120 HydrophobicContact CG2-CD 4.06Å; I116-K120 HydrophobicContact CG2-CG 4.47Å; I116-K120 VanDerWaalsContact O-CB 3.32Å; I116-K120 WeakPolarHBondContact O-CB 3.35Å; I116-K120 WeakPolarHBondContact O-CG 3.37Å; I116-K120 PolarHBondContact O-N 3.21Å |
| 117 | A | 69.8 | Low | 65.6 | Low | 41 Ų | 41 | 107.9 Ų | 107.9 | 34% | 0.339 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -65.8 | -41 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | M113 D114 K120 R121 | M113-A117 WeakPolarHBondContact O-CB 3.2Å; M113-A117 PolarHBondContact O-N 3.17Å; D114-A117 PolarHBondContact O-N 3.11Å; A117-K120 PolarHBondContact O-N 3.45Å; A117-R121 WeakPolarHBondContact O-CB 3.48Å; A117-R121 VanDerWaalsContact O-CG 3.27Å; A117-R121 WeakPolarHBondContact O-CG 3.46Å; A117-R121 PolarHBondContact O-N 3.25Å |
| 118 | E | 68.6 | Low | 67.6 | Low | 123 Ų | 123 | 102.8 Ų | 102.8 | 58% | 0.575 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -65.8 | -45.6 | 175.2 | -171.2 | 161.9 | -147.6 | 0 | 0 | 111.7 | D114 K120 R121 L122 | D114-E118 VanDerWaalsContact O-CB 3.25Å; D114-E118 WeakPolarHBondContact O-CB 3.33Å; D114-E118 PolarHBondContact O-N 2.76Å; E118-K120 VanDerWaalsContact C-N 3.3Å; E118-K120 PolarHBondContact O-N 3.4Å; E118-R121 PolarHBondContact O-N 2.83Å; E118-R121 VanDerWaalsContact O-N 3.16Å; E118-L122 WeakPolarHBondContact O-CG 3.3Å; E118-L122 PolarHBondContact O-N 2.9Å |
| 119 | S | 66.3 | Low | 69.7 | Low | 77 Ų | 77 | 100.9 Ų | 100.9 | 54% | 0.538 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.6 | -38.8 | 173.6 | -58.9 | 0 | 0 | 0 | 0 | 112 | K115 I116 A123 | K115-S119 WeakPolarHBondContact O-CB 3.41Å; K115-S119 PolarHBondContact O-N 3.34Å; K115-S119 PolarHBondContact O-OG 2.98Å; I116-S119 PolarHBondContact O-N 3.14Å; S119-A123 VanDerWaalsContact O-CB 3.24Å; S119-A123 WeakPolarHBondContact O-CB 3.35Å; S119-A123 PolarHBondContact O-N 3Å |
| 120 | K | 67.1 | Low | 71.6 | Confident | 142 Ų | 142 | 101.1 Ų | 101.1 | 62% | 0.617 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -68.9 | -37.1 | 174.8 | -76.4 | 176.1 | 179.9 | -177.1 | 0 | 112.6 | I116 A117 E118 S124 | I116-K120 HydrophobicContact CG2-CD 4.06Å; I116-K120 HydrophobicContact CG2-CG 4.47Å; I116-K120 VanDerWaalsContact O-CB 3.32Å; I116-K120 WeakPolarHBondContact O-CB 3.35Å; I116-K120 WeakPolarHBondContact O-CG 3.37Å; I116-K120 PolarHBondContact O-N 3.21Å; A117-K120 PolarHBondContact O-N 3.45Å; E118-K120 VanDerWaalsContact C-N 3.3Å; E118-K120 PolarHBondContact O-N 3.4Å; K120-S124 WeakPolarHBondContact O-CB 3.4Å; K120-S124 PolarHBondContact O-N 3.48Å |
| 121 | R | 69.6 | Low | 73.7 | Confident | 185 Ų | 185 | 103.9 Ų | 103.9 | 70% | 0.698 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -64.3 | -48.6 | 174.6 | -77.2 | 174.9 | -179.5 | -170 | 1.9 | 110.8 | A117 E118 A123 S124 D125 | A117-R121 WeakPolarHBondContact O-CB 3.48Å; A117-R121 VanDerWaalsContact O-CG 3.27Å; A117-R121 WeakPolarHBondContact O-CG 3.46Å; A117-R121 PolarHBondContact O-N 3.25Å; E118-R121 PolarHBondContact O-N 2.83Å; E118-R121 VanDerWaalsContact O-N 3.16Å; R121-A123 PolarHBondContact O-N 3.43Å; R121-S124 WeakPolarHBondContact O-CB 3.44Å; R121-S124 PolarHBondContact O-N 3.45Å; R121-D125 WeakPolarHBondContact O-CB 3.45Å; R121-D125 PolarHBondContact O-N 3.32Å |
| 122 | L | 66.4 | Low | 75.9 | Confident | 115 Ų | 115 | 98.4 Ų | 98.4 | 60% | 0.602 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.4 | -40.4 | 176.6 | -65.4 | 175.7 | 0 | 0 | 0 | 112.3 | E118 D125 S126 | E118-L122 WeakPolarHBondContact O-CG 3.3Å; E118-L122 PolarHBondContact O-N 2.9Å; L122-D125 PolarHBondContact O-N 2.88Å; L122-S126 WeakPolarHBondContact O-CB 3.28Å; L122-S126 PolarHBondContact O-N 3.27Å |
| 123 | A | 71 | Confident | 77.7 | Confident | 45 Ų | 45 | 100.9 Ų | 100.9 | 37% | 0.372 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.6 | -45.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | S119 R121 D125 S126 D127 | S119-A123 VanDerWaalsContact O-CB 3.24Å; S119-A123 WeakPolarHBondContact O-CB 3.35Å; S119-A123 PolarHBondContact O-N 3Å; R121-A123 PolarHBondContact O-N 3.43Å; A123-D125 VanDerWaalsContact C-N 3.32Å; A123-D125 PolarHBondContact O-N 3.37Å; A123-S126 WeakPolarHBondContact O-CB 3.45Å; A123-S126 PolarHBondContact O-N 2.95Å; A123-S126 VanDerWaalsContact O-N 3.12Å; A123-S126 PolarHBondContact O-OG 3.44Å; A123-D127 PolarHBondContact O-N 3.11Å |
| 124 | S | 75.9 | Confident | 79.3 | Confident | 62 Ų | 62 | 100.4 Ų | 100.4 | 43% | 0.434 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -58.7 | -42.4 | 173.9 | 173.9 | 0 | 0 | 0 | 0 | 111.8 | K120 R121 D127 T128 | K120-S124 WeakPolarHBondContact O-CB 3.4Å; K120-S124 PolarHBondContact O-N 3.48Å; R121-S124 WeakPolarHBondContact O-CB 3.44Å; R121-S124 PolarHBondContact O-N 3.45Å; S124-D127 PolarHBondContact O-N 3.36Å; S124-T128 WeakPolarHBondContact O-CB 3.35Å; S124-T128 WeakPolarHBondContact O-CG2 3.16Å; S124-T128 PolarHBondContact O-N 3.35Å; S124-T128 PolarHBondContact O-OG1 2.86Å; S124-T128 VanDerWaalsContact O-OG1 3.05Å |
| 125 | D | 83.2 | Confident | 80.6 | Confident | 92 Ų | 92 | 101.6 Ų | 101.6 | 49% | 0.492 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64 | -41.7 | 175 | -73.8 | -7.8 | 0 | 0 | 0 | 110.9 | R121 L122 A123 D127 T128 Q129 | R121-D125 WeakPolarHBondContact O-CB 3.45Å; R121-D125 PolarHBondContact O-N 3.32Å; L122-D125 PolarHBondContact O-N 2.88Å; A123-D125 VanDerWaalsContact C-N 3.32Å; A123-D125 PolarHBondContact O-N 3.37Å; D125-D127 PolarHBondContact O-N 3.12Å; D125-T128 WeakPolarHBondContact CA-OG1 3.12Å; D125-T128 PolarHBondContact O-N 3.01Å; D125-T128 PolarHBondContact O-OG1 3.1Å; D125-Q129 VanDerWaalsContact O-CB 3.28Å; D125-Q129 WeakPolarHBondContact O-CB 3.42Å; D125-Q129 WeakPolarHBondContact O-CG 3.35Å; D125-Q129 PolarHBondContact O-N 3.04Å |
| 126 | S | 85.3 | Confident | 82 | Confident | 68 Ų | 68 | 98.5 Ų | 98.5 | 48% | 0.476 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63.8 | -39.9 | 175.9 | 82.2 | 0 | 0 | 0 | 0 | 112.9 | L122 A123 Q129 N130 | L122-S126 WeakPolarHBondContact O-CB 3.28Å; L122-S126 PolarHBondContact O-N 3.27Å; A123-S126 WeakPolarHBondContact O-CB 3.45Å; A123-S126 PolarHBondContact O-N 2.95Å; A123-S126 VanDerWaalsContact O-N 3.12Å; A123-S126 PolarHBondContact O-OG 3.44Å; S126-Q129 PolarHBondContact O-N 2.99Å; S126-N130 WeakPolarHBondContact O-CB 3.23Å; S126-N130 PolarHBondContact O-N 2.98Å |
| 127 | D | 87.7 | Confident | 83.4 | Confident | 94 Ų | 94 | 104.2 Ų | 104.2 | 50% | 0.503 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -70.7 | -42.4 | 178.4 | -79 | -27 | 0 | 0 | 0 | 111.5 | A123 S124 D125 Q129 N130 R131 | A123-D127 PolarHBondContact O-N 3.11Å; S124-D127 PolarHBondContact O-N 3.36Å; D125-D127 PolarHBondContact O-N 3.12Å; D127-Q129 VanDerWaalsContact C-N 3.35Å; D127-N130 PolarHBondContact O-N 2.75Å; D127-R131 WeakPolarHBondContact O-CB 3.47Å; D127-R131 VanDerWaalsContact O-CG 3.3Å; D127-R131 WeakPolarHBondContact O-CG 3.37Å; D127-R131 PolarHBondContact O-N 3.13Å |
| 128 | T | 91 | Very high | 84.7 | Confident | 60 Ų | 60 | 106.1 Ų | 106.1 | 37% | 0.368 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.1 | -43 | 174.3 | 58.7 | 0 | 0 | 0 | 0 | 110.5 | S124 D125 N130 R131 L132 | S124-T128 WeakPolarHBondContact O-CB 3.35Å; S124-T128 WeakPolarHBondContact O-CG2 3.16Å; S124-T128 PolarHBondContact O-N 3.35Å; S124-T128 PolarHBondContact O-OG1 2.86Å; S124-T128 VanDerWaalsContact O-OG1 3.05Å; D125-T128 WeakPolarHBondContact CA-OG1 3.12Å; D125-T128 PolarHBondContact O-N 3.01Å; D125-T128 PolarHBondContact O-OG1 3.1Å; T128-N130 PolarHBondContact O-N 3.23Å; T128-R131 PolarHBondContact O-N 3.34Å; T128-L132 WeakPolarHBondContact O-CB 3.34Å; T128-L132 VanDerWaalsContact O-CG 3.27Å; T128-L132 WeakPolarHBondContact O-CG 3.37Å; T128-L132 PolarHBondContact O-N 2.68Å |
| 129 | Q | 90.9 | Very high | 86 | Confident | 101 Ų | 101 | 107.5 Ų | 107.5 | 47% | 0.472 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.3 | -43 | 173.3 | -72.3 | -64.2 | -28.5 | 0 | 0 | 111.8 | D125 S126 D127 L132 K133 | D125-Q129 VanDerWaalsContact O-CB 3.28Å; D125-Q129 WeakPolarHBondContact O-CB 3.42Å; D125-Q129 WeakPolarHBondContact O-CG 3.35Å; D125-Q129 PolarHBondContact O-N 3.04Å; S126-Q129 PolarHBondContact O-N 2.99Å; D127-Q129 VanDerWaalsContact C-N 3.35Å; Q129-L132 PolarHBondContact O-N 3.36Å; Q129-K133 WeakPolarHBondContact O-CB 3.45Å; Q129-K133 WeakPolarHBondContact O-CG 3.29Å; Q129-K133 PolarHBondContact O-N 3.28Å |
| 130 | N | 92.1 | Very high | 87.5 | Confident | 83 Ų | 83 | 110 Ų | 110 | 44% | 0.444 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63 | -44.1 | 176.2 | -172.6 | 38.7 | 0 | 0 | 0 | 111.6 | S126 D127 T128 L132 K133 I134 | S126-N130 WeakPolarHBondContact O-CB 3.23Å; S126-N130 PolarHBondContact O-N 2.98Å; D127-N130 PolarHBondContact O-N 2.75Å; T128-N130 PolarHBondContact O-N 3.23Å; N130-L132 PolarHBondContact O-N 3.22Å; N130-K133 WeakPolarHBondContact O-CB 3.41Å; N130-K133 PolarHBondContact O-N 3.09Å; N130-I134 VanDerWaalsContact O-CG1 3.3Å; N130-I134 WeakPolarHBondContact O-CG1 3.34Å; N130-I134 PolarHBondContact O-N 2.94Å |
| 131 | R | 93.6 | Very high | 88.9 | Confident | 188 Ų | 188 | 109.5 Ų | 109.5 | 71% | 0.709 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -59.5 | -44.2 | 174.4 | -74.1 | 175.7 | 174.7 | -83.7 | -0.5 | 112 | D127 T128 I134 R135 | D127-R131 WeakPolarHBondContact O-CB 3.47Å; D127-R131 VanDerWaalsContact O-CG 3.3Å; D127-R131 WeakPolarHBondContact O-CG 3.37Å; D127-R131 PolarHBondContact O-N 3.13Å; T128-R131 PolarHBondContact O-N 3.34Å; R131-I134 PolarHBondContact O-N 3.49Å; R131-R135 WeakPolarHBondContact O-CB 3.32Å; R131-R135 PolarHBondContact O-N 3.33Å |
| 132 | L | 95.2 | Very high | 90.3 | Very high | 65 Ų | 65 | 102.3 Ų | 102.3 | 34% | 0.34 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -64 | -42.4 | 175.7 | -70.4 | 173.5 | 0 | 0 | 0 | 111.8 | T128 Q129 N130 R135 N136 | T128-L132 WeakPolarHBondContact O-CB 3.34Å; T128-L132 VanDerWaalsContact O-CG 3.27Å; T128-L132 WeakPolarHBondContact O-CG 3.37Å; T128-L132 PolarHBondContact O-N 2.68Å; Q129-L132 PolarHBondContact O-N 3.36Å; N130-L132 PolarHBondContact O-N 3.22Å; L132-R135 PolarHBondContact O-N 3.25Å; L132-N136 WeakPolarHBondContact O-CB 3.37Å; L132-N136 PolarHBondContact O-N 3.23Å; L132-N136 PolarHBondContact O-ND2 3.28Å |
| 133 | K | 94.4 | Very high | 91.7 | Very high | 136 Ų | 136 | 101.3 Ų | 101.3 | 59% | 0.591 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -59 | -47.1 | 174.4 | -74.6 | 170.2 | -176 | 177.8 | 0 | 111.2 | Q129 N130 N136 R137 | Q129-K133 WeakPolarHBondContact O-CB 3.45Å; Q129-K133 WeakPolarHBondContact O-CG 3.29Å; Q129-K133 PolarHBondContact O-N 3.28Å; N130-K133 WeakPolarHBondContact O-CB 3.41Å; N130-K133 PolarHBondContact O-N 3.09Å; K133-N136 PolarHBondContact O-N 2.68Å; K133-R137 WeakPolarHBondContact O-CB 3.42Å; K133-R137 PolarHBondContact O-N 3.32Å |
| 134 | I | 93.4 | Very high | 92.9 | Very high | 96 Ų | 96 | 100.8 Ų | 100.8 | 49% | 0.492 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -62.7 | -47.4 | 176.9 | -67.2 | 165.1 | 0 | 0 | 0 | 110.8 | N130 R131 N136 R137 E138 | N130-I134 VanDerWaalsContact O-CG1 3.3Å; N130-I134 WeakPolarHBondContact O-CG1 3.34Å; N130-I134 PolarHBondContact O-N 2.94Å; R131-I134 PolarHBondContact O-N 3.49Å; I134-N136 VanDerWaalsContact C-N 3.31Å; I134-N136 PolarHBondContact O-N 2.93Å; I134-R137 WeakPolarHBondContact O-CB 3.25Å; I134-R137 PolarHBondContact O-N 2.7Å; I134-E138 PolarHBondContact O-N 3.07Å |
| 135 | R | 96.7 | Very high | 93.9 | Very high | 160 Ų | 160 | 101.2 Ų | 101.2 | 60% | 0.604 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -57.9 | -43.2 | 176.5 | -173.8 | -170.6 | 71.7 | 172 | 0.8 | 111.8 | R131 L132 E138 K139 | R131-R135 WeakPolarHBondContact O-CB 3.32Å; R131-R135 PolarHBondContact O-N 3.33Å; L132-R135 PolarHBondContact O-N 3.25Å; R135-E138 PolarHBondContact O-N 3.11Å; R135-K139 WeakPolarHBondContact O-CB 3.37Å; R135-K139 PolarHBondContact O-N 3.46Å |
| 136 | N | 96.5 | Very high | 94.4 | Very high | 62 Ų | 62 | 104.2 Ų | 104.2 | 33% | 0.332 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -67.7 | -38.2 | 178.5 | -71.4 | -13.3 | 0 | 0 | 0 | 111.7 | L132 K133 I134 K139 R140 | L132-N136 WeakPolarHBondContact O-CB 3.37Å; L132-N136 PolarHBondContact O-N 3.23Å; L132-N136 PolarHBondContact O-ND2 3.28Å; K133-N136 PolarHBondContact O-N 2.68Å; I134-N136 VanDerWaalsContact C-N 3.31Å; I134-N136 PolarHBondContact O-N 2.93Å; N136-K139 PolarHBondContact O-N 3.12Å; N136-R140 WeakPolarHBondContact O-CB 3.4Å; N136-R140 WeakPolarHBondContact O-CG 3.38Å; N136-R140 PolarHBondContact O-N 2.99Å |
| 137 | R | 96.7 | Very high | 94.9 | Very high | 194 Ų | 194 | 103.5 Ų | 103.5 | 73% | 0.732 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -60.8 | -45.6 | 172.5 | -177.7 | -179.2 | 179.4 | 176.5 | 0.2 | 111.3 | K133 I134 R140 R141 | K133-R137 WeakPolarHBondContact O-CB 3.42Å; K133-R137 PolarHBondContact O-N 3.32Å; I134-R137 WeakPolarHBondContact O-CB 3.25Å; I134-R137 PolarHBondContact O-N 2.7Å; R137-R140 WeakPolarHBondContact O-CB 3.38Å; R137-R140 PolarHBondContact O-N 3.37Å; R137-R141 PolarHBondContact O-N 3.47Å |
| 138 | E | 96.9 | Very high | 95.3 | Very high | 80 Ų | 80 | 101.6 Ų | 101.6 | 37% | 0.374 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -68.4 | -39.8 | 179 | -179.5 | 52.5 | -153.5 | 0 | 0 | 112.3 | I134 R135 R140 R141 C142 | I134-E138 PolarHBondContact O-N 3.07Å; R135-E138 PolarHBondContact O-N 3.11Å; E138-R140 VanDerWaalsContact C-N 3.29Å; E138-R140 PolarHBondContact O-N 3.11Å; E138-R141 VanDerWaalsContact CD-NE 3.34Å; E138-R141 PolarHBondContact O-N 3.16Å; E138-R141 IonicContact OE1-CZ 3.7Å; E138-R141 VanDerWaalsContact OE1-CZ 3.28Å; E138-R141 IonicContact OE1-NE 2.65Å; E138-R141 PolarHBondContact OE1-NE 2.99Å; E138-R141 VanDerWaalsContact OE1-NE 3.12Å; E138-R141 IonicContact OE1-NH2 3.75Å; E138-R141 PolarHBondContact OE1-NH2 3.33Å; E138-R141 IonicContact OE2-CZ 2.68Å; E138-R141 IonicContact OE2-NE 2.79Å; E138-R141 PolarHBondContact OE2-NE 3.19Å; E138-R141 IonicContact OE2-NH2 3.12Å; E138-C142 WeakPolarHBondContact O-CB 3.48Å; E138-C142 PolarHBondContact O-N 2.9Å; E138-C142 PolarHBondContact OE1-SG 3.15Å |
| 139 | K | 97.3 | Very high | 95.5 | Very high | 152 Ų | 152 | 100.5 Ų | 100.5 | 66% | 0.661 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -55.9 | -45.7 | 171.9 | -177.5 | 179.4 | 178.6 | -179.3 | 0 | 111.1 | R135 N136 C142 Q143 | R135-K139 WeakPolarHBondContact O-CB 3.37Å; R135-K139 PolarHBondContact O-N 3.46Å; N136-K139 PolarHBondContact O-N 3.12Å; K139-C142 PolarHBondContact O-N 3.04Å; K139-Q143 WeakPolarHBondContact O-CB 3.46Å; K139-Q143 PolarHBondContact O-N 3.42Å |
| 140 | R | 96.6 | Very high | 95.5 | Very high | 131 Ų | 131 | 99.3 Ų | 99.3 | 49% | 0.494 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -62.2 | -47.9 | 176 | -78.1 | 177.8 | -163 | 150.3 | 1.5 | 112.3 | W75 N136 R137 E138 C142 Q143 A144 | W75-R140 HydrophobicContact CH2-CB 3.86Å; W75-R140 WeakPolarHBondContact CH2-O 3.27Å; W75-R140 HydrophobicContact CZ3-CB 3.73Å; W75-R140 HydrophobicContact CZ3-CG 4.19Å; N136-R140 WeakPolarHBondContact O-CB 3.4Å; N136-R140 WeakPolarHBondContact O-CG 3.38Å; N136-R140 PolarHBondContact O-N 2.99Å; R137-R140 WeakPolarHBondContact O-CB 3.38Å; R137-R140 PolarHBondContact O-N 3.37Å; E138-R140 VanDerWaalsContact C-N 3.29Å; E138-R140 PolarHBondContact O-N 3.11Å; R140-C142 VanDerWaalsContact C-N 3.31Å; R140-C142 PolarHBondContact O-N 3.03Å; R140-Q143 WeakPolarHBondContact O-CB 3.49Å; R140-Q143 PolarHBondContact O-N 3.36Å; R140-Q143 VanDerWaalsContact O-N 3.08Å; R140-A144 PolarHBondContact O-N 3.48Å |
| 141 | R | 97.5 | Very high | 95.6 | Very high | 131 Ų | 131 | 101 Ų | 101 | 49% | 0.494 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -56.5 | -45.8 | 175.5 | -170.4 | -165.6 | 72.3 | 82.5 | -1.2 | 111.6 | R137 E138 Q143 A144 M145 | R137-R141 PolarHBondContact O-N 3.47Å; E138-R141 VanDerWaalsContact CD-NE 3.34Å; E138-R141 PolarHBondContact O-N 3.16Å; E138-R141 IonicContact OE1-CZ 3.7Å; E138-R141 VanDerWaalsContact OE1-CZ 3.28Å; E138-R141 IonicContact OE1-NE 2.65Å; E138-R141 PolarHBondContact OE1-NE 2.99Å; E138-R141 VanDerWaalsContact OE1-NE 3.12Å; E138-R141 IonicContact OE1-NH2 3.75Å; E138-R141 PolarHBondContact OE1-NH2 3.33Å; E138-R141 IonicContact OE2-CZ 2.68Å; E138-R141 IonicContact OE2-NE 2.79Å; E138-R141 PolarHBondContact OE2-NE 3.19Å; E138-R141 IonicContact OE2-NH2 3.12Å; R141-Q143 VanDerWaalsContact C-N 3.34Å; R141-Q143 PolarHBondContact O-N 2.91Å; R141-A144 WeakPolarHBondContact O-CB 3.36Å; R141-A144 PolarHBondContact O-N 3.05Å; R141-M145 PolarHBondContact O-N 3.34Å; R141-M145 VanDerWaalsContact O-N 3.15Å |
| 142 | C | 97.2 | Very high | 95.7 | Very high | 34 Ų | 34 | 94.7 Ų | 94.7 | 23% | 0.23 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -64.1 | -36.4 | 175.9 | -81.2 | 0 | 0 | 0 | 0 | 112.7 | E138 K139 R140 M145 R146 | E138-C142 WeakPolarHBondContact O-CB 3.48Å; E138-C142 PolarHBondContact O-N 2.9Å; E138-C142 PolarHBondContact OE1-SG 3.15Å; K139-C142 PolarHBondContact O-N 3.04Å; R140-C142 VanDerWaalsContact C-N 3.31Å; R140-C142 PolarHBondContact O-N 3.03Å; C142-M145 PolarHBondContact O-N 3.33Å; C142-R146 VanDerWaalsContact O-CG 3.27Å; C142-R146 WeakPolarHBondContact O-CG 3.36Å; C142-R146 PolarHBondContact O-N 2.9Å |
| 143 | Q | 97.2 | Very high | 95.5 | Very high | 94 Ų | 94 | 93.1 Ų | 93.1 | 44% | 0.439 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -65 | -44.8 | 175.3 | -174.6 | 61.8 | 29.6 | 0 | 0 | 111.4 | K139 R140 R141 M145 R146 C147 | K139-Q143 WeakPolarHBondContact O-CB 3.46Å; K139-Q143 PolarHBondContact O-N 3.42Å; R140-Q143 WeakPolarHBondContact O-CB 3.49Å; R140-Q143 PolarHBondContact O-N 3.36Å; R140-Q143 VanDerWaalsContact O-N 3.08Å; R141-Q143 VanDerWaalsContact C-N 3.34Å; R141-Q143 PolarHBondContact O-N 2.91Å; Q143-M145 VanDerWaalsContact C-N 3.26Å; Q143-M145 PolarHBondContact O-N 3.15Å; Q143-R146 WeakPolarHBondContact O-CB 3.46Å; Q143-R146 PolarHBondContact O-N 3.12Å; Q143-C147 PolarHBondContact O-N 3.32Å; Q143-C147 PolarHBondContact O-SG 2.88Å; Q143-C147 VanDerWaalsContact O-SG 3.33Å |
| 144 | A | 96.6 | Very high | 95.4 | Very high | 34 Ų | 34 | 92.4 Ų | 92.4 | 28% | 0.281 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -53.5 | -47.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | W75 R140 R141 R146 C147 A148 | W75-A144 HydrophobicContact CH2-CB 4.14Å; W75-A144 HydrophobicContact CZ2-CB 3.41Å; W75-A144 VanDerWaalsContact CZ2-CB 3.41Å; R140-A144 PolarHBondContact O-N 3.48Å; R141-A144 WeakPolarHBondContact O-CB 3.36Å; R141-A144 PolarHBondContact O-N 3.05Å; A144-R146 PolarHBondContact O-N 3.22Å; A144-C147 PolarHBondContact O-N 3.33Å; A144-A148 PolarHBondContact O-N 3.49Å; A144-A148 VanDerWaalsContact O-N 3.08Å |
| 145 | M | 96.7 | Very high | 95.4 | Very high | 70 Ų | 70 | 93.6 Ų | 93.6 | 35% | 0.345 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -64.2 | -38.8 | 177.1 | -177.6 | 172.9 | 58.4 | 0 | 0 | 112.1 | R141 C142 Q143 A148 F149 | R141-M145 PolarHBondContact O-N 3.34Å; R141-M145 VanDerWaalsContact O-N 3.15Å; C142-M145 PolarHBondContact O-N 3.33Å; Q143-M145 VanDerWaalsContact C-N 3.26Å; Q143-M145 PolarHBondContact O-N 3.15Å; M145-A148 PolarHBondContact O-N 3.08Å; M145-F149 HydrophobicContact CG-CD2 3.98Å; M145-F149 HydrophobicContact CG-CE2 4.08Å; M145-F149 WeakPolarHBondContact O-CD2 3.37Å; M145-F149 PolarHBondContact O-N 3.08Å |
| 146 | R | 93.9 | Very high | 95.2 | Very high | 156 Ų | 156 | 86.4 Ų | 86.4 | 59% | 0.589 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -62.8 | -46 | 175.8 | -74.3 | 170.4 | -172.9 | -125.8 | 3.7 | 111.1 | C142 Q143 A144 A148 F149 E150 | C142-R146 VanDerWaalsContact O-CG 3.27Å; C142-R146 WeakPolarHBondContact O-CG 3.36Å; C142-R146 PolarHBondContact O-N 2.9Å; Q143-R146 WeakPolarHBondContact O-CB 3.46Å; Q143-R146 PolarHBondContact O-N 3.12Å; A144-R146 PolarHBondContact O-N 3.22Å; R146-A148 PolarHBondContact O-N 2.65Å; R146-F149 WeakPolarHBondContact O-CB 3.5Å; R146-F149 PolarHBondContact O-N 3.45Å; R146-F149 VanDerWaalsContact O-N 3.16Å; R146-E150 PolarHBondContact O-N 3.01Å |
| 147 | C | 95 | Very high | 94.8 | Very high | 52 Ų | 52 | 85.2 Ų | 85.2 | 35% | 0.351 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -59.1 | -46.5 | 177 | -62.4 | 0 | 0 | 0 | 0 | 111.8 | Q143 A144 F149 E150 E151 | Q143-C147 PolarHBondContact O-N 3.32Å; Q143-C147 PolarHBondContact O-SG 2.88Å; Q143-C147 VanDerWaalsContact O-SG 3.33Å; A144-C147 PolarHBondContact O-N 3.33Å; C147-F149 VanDerWaalsContact C-N 3.28Å; C147-F149 PolarHBondContact O-N 3.04Å; C147-E150 PolarHBondContact O-N 3.33Å; C147-E150 VanDerWaalsContact O-N 3.11Å; C147-E151 PolarHBondContact O-N 3.38Å |
| 148 | A | 96 | Very high | 94.1 | Very high | 54 Ų | 54 | 82.7 Ų | 82.7 | 45% | 0.446 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -61.9 | -33.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113 | A144 M145 R146 L152 | A144-A148 PolarHBondContact O-N 3.49Å; A144-A148 VanDerWaalsContact O-N 3.08Å; M145-A148 PolarHBondContact O-N 3.08Å; R146-A148 PolarHBondContact O-N 2.65Å; A148-L152 WeakPolarHBondContact O-CB 3.48Å; A148-L152 PolarHBondContact O-N 3.49Å |
| 149 | F | 94.6 | Very high | 93.4 | Very high | 37 Ų | 37 | 79.5 Ų | 79.5 | 16% | 0.162 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -69 | -37.6 | 173.5 | -98.7 | -76.2 | 0 | 0 | 0 | 112.5 | M145 R146 C147 R153 K167 T170 L171 | M145-F149 HydrophobicContact CG-CD2 3.98Å; M145-F149 HydrophobicContact CG-CE2 4.08Å; M145-F149 WeakPolarHBondContact O-CD2 3.37Å; M145-F149 PolarHBondContact O-N 3.08Å; R146-F149 WeakPolarHBondContact O-CB 3.5Å; R146-F149 PolarHBondContact O-N 3.45Å; R146-F149 VanDerWaalsContact O-N 3.16Å; C147-F149 VanDerWaalsContact C-N 3.28Å; C147-F149 PolarHBondContact O-N 3.04Å; F149-R153 WeakPolarHBondContact O-CG 3.45Å; F149-R153 PolarHBondContact O-N 2.79Å; F149-R153 VanDerWaalsContact O-N 3.12Å; F149-K167 HydrophobicContact CD1-CG 4.38Å; F149-K167 HydrophobicContact CE1-CB 3.93Å; F149-K167 HydrophobicContact CE1-CG 4.08Å; F149-K167 HydrophobicContact CE2-CD 4.29Å; F149-K167 HydrophobicContact CZ-CB 4.15Å; F149-K167 HydrophobicContact CZ-CD 4.2Å; F149-K167 HydrophobicContact CZ-CG 4.23Å; F149-T170 HydrophobicContact CD1-CG2 4.46Å; F149-L171 HydrophobicContact CE1-CD2 4.15Å; F149-L171 HydrophobicContact CE1-CG 4.19Å; F149-L171 HydrophobicContact CZ-CD2 4.37Å; F149-L171 HydrophobicContact CZ-CG 4.5Å |
| 150 | E | 92.5 | Very high | 92.5 | Very high | 76 Ų | 76 | 74.2 Ų | 74.2 | 36% | 0.355 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -67.3 | -46.8 | 174.1 | -63.2 | -46.3 | 137.5 | 0 | 0 | 110.6 | R146 C147 L152 R153 H154 | R146-E150 PolarHBondContact O-N 3.01Å; C147-E150 PolarHBondContact O-N 3.33Å; C147-E150 VanDerWaalsContact O-N 3.11Å; E150-L152 VanDerWaalsContact C-N 3.29Å; E150-L152 PolarHBondContact O-N 3.38Å; E150-R153 WeakPolarHBondContact O-CA 3.27Å; E150-R153 WeakPolarHBondContact O-CB 3.4Å; E150-R153 PolarHBondContact O-N 2.87Å; E150-R153 IonicContact OE1-CZ 3.89Å; E150-R153 IonicContact OE1-NH1 2.94Å; E150-R153 PolarHBondContact OE1-NH1 3.48Å; E150-R153 WeakPolarHBondContact OE2-CD 3.43Å; E150-R153 IonicContact OE2-CZ 3.09Å; E150-R153 IonicContact OE2-NH1 3.57Å; E150-R153 PolarHBondContact OE2-NH1 3.46Å; E150-H154 PolarHBondContact O-N 3.41Å; E150-H154 PolarHBondContact O-ND1 2.96Å |
| 151 | E | 93.2 | Very high | 91.5 | Very high | 120 Ų | 120 | 72.7 Ų | 72.7 | 56% | 0.561 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -53.7 | -46.3 | 174.3 | -173.6 | 178.4 | -174.7 | 0 | 0 | 111.5 | C147 R153 H154 H155 | C147-E151 PolarHBondContact O-N 3.38Å; E151-R153 VanDerWaalsContact C-N 3.28Å; E151-R153 PolarHBondContact O-N 3.25Å; E151-H154 WeakPolarHBondContact O-CB 3.37Å; E151-H154 PolarHBondContact O-N 3.35Å; E151-H154 VanDerWaalsContact O-N 3.15Å; E151-H155 PolarHBondContact O-CD2 3.38Å; E151-H155 PolarHBondContact O-N 3.45Å |
| 152 | L | 95.2 | Very high | 90.4 | Very high | 54 Ų | 54 | 74.3 Ų | 74.3 | 28% | 0.283 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -58.4 | -37.8 | 174.3 | -178.4 | 60.6 | 0 | 0 | 0 | 112.7 | A148 E150 H155 I156 T170 L171 A174 | A148-L152 WeakPolarHBondContact O-CB 3.48Å; A148-L152 PolarHBondContact O-N 3.49Å; E150-L152 VanDerWaalsContact C-N 3.29Å; E150-L152 PolarHBondContact O-N 3.38Å; L152-H155 PolarHBondContact O-N 2.85Å; L152-I156 WeakPolarHBondContact O-CG1 3.43Å; L152-T170 HydrophobicContact CD2-CG2 4Å; L152-T170 HydrophobicContact CG-CG2 4.1Å; L152-L171 HydrophobicContact CD2-CD2 4.16Å; L152-A174 HydrophobicContact CD1-CB 3.89Å; L152-A174 HydrophobicContact CD2-CB 4.37Å; L152-A174 HydrophobicContact CG-CB 4.39Å |
| 153 | R | 92.4 | Very high | 89.2 | Confident | 33 Ų | 33 | 78.2 Ų | 78.2 | 13% | 0.125 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -67.6 | -36.9 | 177.3 | -73.7 | 172.2 | 177.8 | 163.1 | 4.3 | 112.7 | F149 E150 E151 H155 I156 L161 V165 T170 | F149-R153 WeakPolarHBondContact O-CG 3.45Å; F149-R153 PolarHBondContact O-N 2.79Å; F149-R153 VanDerWaalsContact O-N 3.12Å; E150-R153 WeakPolarHBondContact O-CA 3.27Å; E150-R153 WeakPolarHBondContact O-CB 3.4Å; E150-R153 PolarHBondContact O-N 2.87Å; E150-R153 IonicContact OE1-CZ 3.89Å; E150-R153 IonicContact OE1-NH1 2.94Å; E150-R153 PolarHBondContact OE1-NH1 3.48Å; E150-R153 WeakPolarHBondContact OE2-CD 3.43Å; E150-R153 IonicContact OE2-CZ 3.09Å; E150-R153 IonicContact OE2-NH1 3.57Å; E150-R153 PolarHBondContact OE2-NH1 3.46Å; E151-R153 VanDerWaalsContact C-N 3.28Å; E151-R153 PolarHBondContact O-N 3.25Å; R153-H155 PolarHBondContact O-N 2.97Å; R153-I156 PolarHBondContact O-N 2.87Å; R153-I156 VanDerWaalsContact O-N 3.13Å; R153-L161 HydrophobicContact CB-CD2 4.35Å; R153-V165 PolarHBondContact NH2-O 2.92Å; R153-T170 HydrophobicContact CG-CG2 3.65Å |
| 154 | H | 92.3 | Very high | 88.3 | Confident | 121 Ų | 121 | 76.7 Ų | 76.7 | 56% | 0.56 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -61.7 | -32.2 | 176.4 | -67.1 | 88.2 | 0 | 0 | 0 | 111.8 | E150 E151 I156 | E150-H154 PolarHBondContact O-N 3.41Å; E150-H154 PolarHBondContact O-ND1 2.96Å; E151-H154 WeakPolarHBondContact O-CB 3.37Å; E151-H154 PolarHBondContact O-N 3.35Å; E151-H154 VanDerWaalsContact O-N 3.15Å; H154-I156 VanDerWaalsContact C-N 3.33Å; H154-I156 PolarHBondContact O-N 3.37Å |
| 155 | H | 93.1 | Very high | 87.6 | Confident | 120 Ų | 120 | 75.3 Ų | 75.3 | 56% | 0.556 | 39% | 0.389 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.1 | -12.2 | 177.2 | -69.8 | -58.7 | 0 | 0 | 0 | 114.8 | E151 L152 R153 P157 Y177 | E151-H155 PolarHBondContact O-CD2 3.38Å; E151-H155 PolarHBondContact O-N 3.45Å; L152-H155 PolarHBondContact O-N 2.85Å; R153-H155 PolarHBondContact O-N 2.97Å; H155-P157 WeakPolarHBondContact O-CD 3.42Å; H155-Y177 VanDerWaalsContact O-CE1 3.27Å; H155-Y177 WeakPolarHBondContact O-CE1 3.48Å |
| 156 | I | 91.5 | Very high | 87.2 | Confident | 9 Ų | 9 | 74 Ų | 74 | 5% | 0.046 | 39% | 0.385 | C | S | . | . | S | Bend | trans | -93.6 | 115.7 | -178.5 | -57.9 | 166.2 | 0 | 0 | 0 | 109.5 | L152 R153 H154 V159 T170 L173 A174 F197 | L152-I156 WeakPolarHBondContact O-CG1 3.43Å; R153-I156 PolarHBondContact O-N 2.87Å; R153-I156 VanDerWaalsContact O-N 3.13Å; H154-I156 VanDerWaalsContact C-N 3.33Å; H154-I156 PolarHBondContact O-N 3.37Å; I156-V159 HydrophobicContact CB-CB 4.45Å; I156-V159 HydrophobicContact CB-CG2 3.87Å; I156-V159 HydrophobicContact CG2-CB 4.39Å; I156-V159 HydrophobicContact CG2-CG2 3.37Å; I156-T170 HydrophobicContact CD1-CG2 3.75Å; I156-T170 WeakPolarHBondContact CD1-O 3.34Å; I156-L173 HydrophobicContact CD1-CB 4.12Å; I156-L173 HydrophobicContact CG2-CB 3.9Å; I156-L173 HydrophobicContact CG2-CD1 4.49Å; I156-A174 HydrophobicContact CD1-CB 4.13Å; I156-A174 HydrophobicContact CG1-CB 4.43Å; I156-F197 HydrophobicContact CG2-CE1 4.18Å; I156-F197 HydrophobicContact CG2-CZ 3.93Å |
| 157 | P | 88.1 | Confident | 87 | Confident | 37 Ų | 37 | 71.8 Ų | 71.8 | 24% | 0.24 | 38% | 0.38 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62.7 | 149 | 178.9 | -23.6 | 34.6 | 0 | 0 | 0 | 113 | H155 V159 Y177 F197 | H155-P157 WeakPolarHBondContact O-CD 3.42Å; P157-V159 PolarHBondContact O-N 2.88Å; P157-Y177 HydrophobicContact CG-CD2 4.12Å; P157-Y177 HydrophobicContact CG-CE1 4.15Å; P157-Y177 HydrophobicContact CG-CE2 3.52Å; P157-F197 HydrophobicContact CB-CD1 4.45Å; P157-F197 HydrophobicContact CB-CE1 4.25Å; P157-F197 HydrophobicContact CG-CE1 4.34Å |
| 158 | F | 82.8 | Confident | 86.9 | Confident | 142 Ų | 142 | 73.6 Ų | 73.6 | 62% | 0.623 | 39% | 0.385 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 64.3 | 2.8 | 175.9 | -42.7 | -68.4 | 0 | 0 | 0 | 116.1 | P160 F197 V201 | F158-P160 WeakPolarHBondContact O-CD 3.33Å; F158-F197 HydrophobicContact CD2-CD1 4.07Å; F158-F197 HydrophobicContact CE2-CD1 4.3Å; F158-V201 HydrophobicContact CB-CB 4.3Å; F158-V201 HydrophobicContact CB-CG1 4.03Å |
| 159 | V | 81 | Confident | 86.7 | Confident | 13 Ų | 13 | 71.1 Ų | 71.1 | 8% | 0.079 | 36% | 0.364 | C | S | . | . | trans | -77 | 123 | 175.2 | 170.3 | 0 | 0 | 0 | 0 | 109.5 | I156 P157 L161 V165 L173 V201 | I156-V159 HydrophobicContact CB-CB 4.45Å; I156-V159 HydrophobicContact CB-CG2 3.87Å; I156-V159 HydrophobicContact CG2-CB 4.39Å; I156-V159 HydrophobicContact CG2-CG2 3.37Å; P157-V159 PolarHBondContact O-N 2.88Å; V159-L161 PolarHBondContact O-N 3.39Å; V159-L161 VanDerWaalsContact O-N 3.1Å; V159-V165 HydrophobicContact CG1-CB 4.38Å; V159-V165 HydrophobicContact CG1-CG2 3.65Å; V159-L173 HydrophobicContact CG2-CD1 3.65Å; V159-V201 HydrophobicContact CG2-CG1 3.81Å | ||
| 160 | P | 78.6 | Confident | 86.5 | Confident | 41 Ų | 41 | 69.4 Ų | 69.4 | 27% | 0.266 | 36% | 0.357 | S | S | . | . | trans | -67.2 | 110.2 | 174.8 | 24.9 | -31.4 | 0 | 0 | 0 | 109.9 | F158 D162 K163 V205 | F158-P160 WeakPolarHBondContact O-CD 3.33Å; P160-D162 PolarHBondContact O-N 3.36Å; P160-K163 HydrophobicContact CB-CB 3.98Å; P160-K163 HydrophobicContact CB-CD 3.95Å; P160-K163 HydrophobicContact CB-CG 3.91Å; P160-K163 HydrophobicContact CG-CB 3.85Å; P160-K163 HydrophobicContact CG-CD 3.84Å; P160-K163 HydrophobicContact CG-CG 4.1Å; P160-K163 PolarHBondContact O-N 2.91Å; P160-K163 VanDerWaalsContact O-O 3.1Å; P160-V205 HydrophobicContact CG-CG1 3.85Å | ||
| 161 | L | 76.6 | Confident | 86.7 | Confident | 98 Ų | 98 | 69.5 Ų | 69.5 | 51% | 0.513 | 36% | 0.36 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.4 | -30.6 | -178.9 | -63.5 | 170.6 | 0 | 0 | 0 | 112.7 | R153 V159 | R153-L161 HydrophobicContact CB-CD2 4.35Å; V159-L161 PolarHBondContact O-N 3.39Å; V159-L161 VanDerWaalsContact O-N 3.1Å |
| 162 | D | 74.2 | Confident | 86.6 | Confident | 165 Ų | 165 | 68.6 Ų | 68.6 | 88% | 0.882 | 35% | 0.351 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.8 | -24.2 | -179.9 | -165.4 | 29.5 | 0 | 0 | 0 | 112.7 | P160 | P160-D162 PolarHBondContact O-N 3.36Š|
| 163 | K | 71.3 | Confident | 86.5 | Confident | 116 Ų | 116 | 66 Ų | 66 | 50% | 0.504 | 34% | 0.338 | S | S | . | . | S | Bend | trans | -88.4 | 126.6 | 177.8 | -60.8 | -176.8 | -175.7 | 179.7 | 0 | 108.4 | P160 V165 | P160-K163 HydrophobicContact CB-CB 3.98Å; P160-K163 HydrophobicContact CB-CD 3.95Å; P160-K163 HydrophobicContact CB-CG 3.91Å; P160-K163 HydrophobicContact CG-CB 3.85Å; P160-K163 HydrophobicContact CG-CD 3.84Å; P160-K163 HydrophobicContact CG-CG 4.1Å; P160-K163 PolarHBondContact O-N 2.91Å; P160-K163 VanDerWaalsContact O-O 3.1Å; K163-V165 WeakPolarHBondContact O-CG2 3.49Å; K163-V165 PolarHBondContact O-N 3.17Å |
| 164 | G | 78.3 | Confident | 86.6 | Confident | 63 Ų | 63 | 65.1 Ų | 65.1 | 65% | 0.649 | 34% | 0.337 | S | S | * | . | trans | -64.2 | 74.3 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | P166 | G164-P166 WeakPolarHBondContact O-CD 3.35Š| ||
| 165 | V | 82.5 | Confident | 86.7 | Confident | 4 Ų | 4 | 64.5 Ų | 64.5 | 2% | 0.024 | 34% | 0.337 | C | S | . | . | trans | -60.4 | 122.7 | 178.4 | 177.4 | 0 | 0 | 0 | 0 | 108.9 | R153 V159 K163 T169 V205 | R153-V165 PolarHBondContact NH2-O 2.92Å; V159-V165 HydrophobicContact CG1-CB 4.38Å; V159-V165 HydrophobicContact CG1-CG2 3.65Å; K163-V165 WeakPolarHBondContact O-CG2 3.49Å; K163-V165 PolarHBondContact O-N 3.17Å; V165-T169 WeakPolarHBondContact CG1-OG1 3.41Å; V165-V205 HydrophobicContact CG2-CG1 4.39Å; V165-V205 HydrophobicContact CG2-CG2 4.22Å | ||
| 166 | P | 88.4 | Confident | 86.7 | Confident | 43 Ų | 43 | 62 Ų | 62 | 28% | 0.279 | 33% | 0.325 | S | S | . | . | trans | -51.5 | 150.7 | 179.6 | -27.2 | 31.4 | 0 | 0 | 0 | 113.4 | G164 I168 T169 T170 | G164-P166 WeakPolarHBondContact O-CD 3.35Å; P166-I168 VanDerWaalsContact C-N 3.25Å; P166-I168 HydrophobicContact CB-CG2 4.12Å; P166-I168 PolarHBondContact O-N 3.37Å; P166-T169 WeakPolarHBondContact CA-OG1 3.48Å; P166-T169 HydrophobicContact CB-CG2 4.36Å; P166-T169 WeakPolarHBondContact CB-OG1 3.44Å; P166-T169 WeakPolarHBondContact CD-OG1 3.3Å; P166-T169 HydrophobicContact CG-CG2 4.39Å; P166-T169 VanDerWaalsContact N-OG1 3.14Å; P166-T169 PolarHBondContact O-N 3.34Å; P166-T169 PolarHBondContact O-OG1 3.36Å; P166-T170 PolarHBondContact O-N 3.05Å; P166-T170 PolarHBondContact O-OG1 2.88Å | ||
| 167 | K | 90.2 | Very high | 86.8 | Confident | 110 Ų | 110 | 64.5 Ų | 64.5 | 48% | 0.478 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -56.4 | -43 | 178 | -68.9 | -176.6 | 178.7 | -178.9 | 0 | 111.7 | F149 T169 T170 L171 | F149-K167 HydrophobicContact CD1-CG 4.38Å; F149-K167 HydrophobicContact CE1-CB 3.93Å; F149-K167 HydrophobicContact CE1-CG 4.08Å; F149-K167 HydrophobicContact CE2-CD 4.29Å; F149-K167 HydrophobicContact CZ-CB 4.15Å; F149-K167 HydrophobicContact CZ-CD 4.2Å; F149-K167 HydrophobicContact CZ-CG 4.23Å; K167-T169 PolarHBondContact O-N 3.32Å; K167-T170 WeakPolarHBondContact O-CB 3.48Å; K167-T170 PolarHBondContact O-N 2.85Å; K167-L171 WeakPolarHBondContact O-CG 3.46Å; K167-L171 PolarHBondContact O-N 3.37Å; K167-L171 VanDerWaalsContact O-N 3.09Å |
| 168 | I | 92.2 | Very high | 87.1 | Confident | 90 Ų | 90 | 67.1 Ų | 67.1 | 46% | 0.462 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -65.3 | -37.5 | -180 | -173.5 | 57.9 | 0 | 0 | 0 | 112.7 | P166 R172 | P166-I168 VanDerWaalsContact C-N 3.25Å; P166-I168 HydrophobicContact CB-CG2 4.12Å; P166-I168 PolarHBondContact O-N 3.37Å; I168-R172 WeakPolarHBondContact O-CD 3.27Å; I168-R172 VanDerWaalsContact O-CG 3.23Å; I168-R172 WeakPolarHBondContact O-CG 3.39Å; I168-R172 PolarHBondContact O-N 2.88Å; I168-R172 VanDerWaalsContact O-N 3.11Å |
| 169 | T | 90.8 | Very high | 87.5 | Confident | 1 Ų | 1 | 63 Ų | 63 | 1% | 0.006 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -71.7 | -39.6 | 177.4 | 44.5 | 0 | 0 | 0 | 0 | 110.5 | V165 P166 K167 L171 R172 L173 E204 K208 | V165-T169 WeakPolarHBondContact CG1-OG1 3.41Å; P166-T169 WeakPolarHBondContact CA-OG1 3.48Å; P166-T169 HydrophobicContact CB-CG2 4.36Å; P166-T169 WeakPolarHBondContact CB-OG1 3.44Å; P166-T169 WeakPolarHBondContact CD-OG1 3.3Å; P166-T169 HydrophobicContact CG-CG2 4.39Å; P166-T169 VanDerWaalsContact N-OG1 3.14Å; P166-T169 PolarHBondContact O-N 3.34Å; P166-T169 PolarHBondContact O-OG1 3.36Å; K167-T169 PolarHBondContact O-N 3.32Å; T169-L171 VanDerWaalsContact C-N 3.34Å; T169-L171 PolarHBondContact O-N 3.41Å; T169-R172 PolarHBondContact O-N 2.84Å; T169-L173 WeakPolarHBondContact O-CB 3.16Å; T169-L173 VanDerWaalsContact O-CG 3.29Å; T169-L173 WeakPolarHBondContact O-CG 3.34Å; T169-L173 PolarHBondContact O-N 3.49Å; T169-E204 HydrophobicContact CG2-CG 3.89Å; T169-K208 HydrophobicContact CG2-CD 4.22Å |
| 170 | T | 91.9 | Very high | 87.9 | Confident | 1 Ų | 1 | 65 Ų | 65 | 1% | 0.006 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -54.7 | -49.4 | 173.2 | -52.8 | 0 | 0 | 0 | 0 | 111 | F149 L152 R153 I156 P166 K167 R172 L173 A174 | F149-T170 HydrophobicContact CD1-CG2 4.46Å; L152-T170 HydrophobicContact CD2-CG2 4Å; L152-T170 HydrophobicContact CG-CG2 4.1Å; R153-T170 HydrophobicContact CG-CG2 3.65Å; I156-T170 HydrophobicContact CD1-CG2 3.75Å; I156-T170 WeakPolarHBondContact CD1-O 3.34Å; P166-T170 PolarHBondContact O-N 3.05Å; P166-T170 PolarHBondContact O-OG1 2.88Å; K167-T170 WeakPolarHBondContact O-CB 3.48Å; K167-T170 PolarHBondContact O-N 2.85Å; T170-R172 PolarHBondContact O-N 2.88Å; T170-L173 PolarHBondContact O-N 3.47Å; T170-A174 WeakPolarHBondContact O-CB 3.3Å; T170-A174 PolarHBondContact O-N 3.23Å |
| 171 | L | 94.9 | Very high | 88.5 | Confident | 78 Ų | 78 | 66.3 Ų | 66.3 | 41% | 0.408 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -62.1 | -42.8 | 178.5 | -66.2 | 174.7 | 0 | 0 | 0 | 112.5 | F149 L152 K167 T169 A174 I175 | F149-L171 HydrophobicContact CE1-CD2 4.15Å; F149-L171 HydrophobicContact CE1-CG 4.19Å; F149-L171 HydrophobicContact CZ-CD2 4.37Å; F149-L171 HydrophobicContact CZ-CG 4.5Å; L152-L171 HydrophobicContact CD2-CD2 4.16Å; K167-L171 WeakPolarHBondContact O-CG 3.46Å; K167-L171 PolarHBondContact O-N 3.37Å; K167-L171 VanDerWaalsContact O-N 3.09Å; T169-L171 VanDerWaalsContact C-N 3.34Å; T169-L171 PolarHBondContact O-N 3.41Å; L171-A174 PolarHBondContact O-N 3.34Å; L171-I175 WeakPolarHBondContact O-CG1 3.5Å; L171-I175 PolarHBondContact O-N 3.46Å; L171-I175 VanDerWaalsContact O-N 3.12Å |
| 172 | R | 92.7 | Very high | 89.2 | Confident | 102 Ų | 102 | 68.2 Ų | 68.2 | 39% | 0.385 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -63 | -42.8 | 177.7 | -73 | 167.5 | 176 | -148.2 | -7.7 | 112.2 | I168 T169 T170 Q176 E204 | I168-R172 WeakPolarHBondContact O-CD 3.27Å; I168-R172 VanDerWaalsContact O-CG 3.23Å; I168-R172 WeakPolarHBondContact O-CG 3.39Å; I168-R172 PolarHBondContact O-N 2.88Å; I168-R172 VanDerWaalsContact O-N 3.11Å; T169-R172 PolarHBondContact O-N 2.84Å; T170-R172 PolarHBondContact O-N 2.88Å; R172-Q176 VanDerWaalsContact O-CG 3.28Å; R172-Q176 WeakPolarHBondContact O-CG 3.2Å; R172-Q176 PolarHBondContact O-N 3.3Å; R172-Q176 VanDerWaalsContact O-N 3.14Å; R172-Q176 PolarHBondContact O-NE2 2.87Å; R172-E204 WeakPolarHBondContact CD-OE1 3.3Å; R172-E204 IonicContact NH1-OE1 3.28Å; R172-E204 PolarHBondContact NH1-OE1 2.85Å; R172-E204 VanDerWaalsContact NH1-OE1 3.09Å |
| 173 | L | 92.8 | Very high | 89.7 | Confident | 0 Ų | 0 | 66.9 Ų | 66.9 | 0% | 0 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -68 | -41.1 | 179 | -68.5 | 177.4 | 0 | 0 | 0 | 111.3 | I156 V159 T169 T170 I175 Q176 Y177 V201 E204 V205 | I156-L173 HydrophobicContact CD1-CB 4.12Å; I156-L173 HydrophobicContact CG2-CB 3.9Å; I156-L173 HydrophobicContact CG2-CD1 4.49Å; V159-L173 HydrophobicContact CG2-CD1 3.65Å; T169-L173 WeakPolarHBondContact O-CB 3.16Å; T169-L173 VanDerWaalsContact O-CG 3.29Å; T169-L173 WeakPolarHBondContact O-CG 3.34Å; T169-L173 PolarHBondContact O-N 3.49Å; T170-L173 PolarHBondContact O-N 3.47Å; L173-I175 PolarHBondContact O-N 2.84Å; L173-Q176 PolarHBondContact O-N 2.84Å; L173-Y177 WeakPolarHBondContact O-CB 3.41Å; L173-Y177 PolarHBondContact O-N 3.15Å; L173-V201 HydrophobicContact CD1-CG1 4.33Å; L173-V201 HydrophobicContact CD2-CB 4.44Å; L173-V201 HydrophobicContact CD2-CG2 3.95Å; L173-E204 HydrophobicContact CD2-CB 4.08Å; L173-E204 HydrophobicContact CD2-CG 4.34Å; L173-V205 HydrophobicContact CD1-CG2 4.22Å |
| 174 | A | 95.2 | Very high | 90.5 | Very high | 13 Ų | 13 | 65.2 Ų | 65.2 | 11% | 0.107 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -58.7 | -47 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | L152 I156 T170 L171 Q176 Y177 I178 | L152-A174 HydrophobicContact CD1-CB 3.89Å; L152-A174 HydrophobicContact CD2-CB 4.37Å; L152-A174 HydrophobicContact CG-CB 4.39Å; I156-A174 HydrophobicContact CD1-CB 4.13Å; I156-A174 HydrophobicContact CG1-CB 4.43Å; T170-A174 WeakPolarHBondContact O-CB 3.3Å; T170-A174 PolarHBondContact O-N 3.23Å; L171-A174 PolarHBondContact O-N 3.34Å; A174-Q176 VanDerWaalsContact C-N 3.35Å; A174-Q176 PolarHBondContact O-N 3.27Å; A174-Y177 PolarHBondContact O-N 3.25Å; A174-I178 WeakPolarHBondContact O-CG1 3.48Å; A174-I178 PolarHBondContact O-N 3.45Å |
| 175 | I | 94.1 | Very high | 91 | Very high | 108 Ų | 108 | 69.4 Ų | 69.4 | 55% | 0.554 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -59.8 | -46.8 | 176.9 | -67 | 165.3 | 0 | 0 | 0 | 110.7 | L171 L173 Y177 I178 V179 | L171-I175 WeakPolarHBondContact O-CG1 3.5Å; L171-I175 PolarHBondContact O-N 3.46Å; L171-I175 VanDerWaalsContact O-N 3.12Å; L173-I175 PolarHBondContact O-N 2.84Å; I175-Y177 VanDerWaalsContact C-N 3.3Å; I175-Y177 PolarHBondContact O-N 3.41Å; I175-I178 PolarHBondContact O-N 3.41Å; I175-V179 WeakPolarHBondContact O-CG2 3.27Å; I175-V179 PolarHBondContact O-N 2.85Å; I175-V179 VanDerWaalsContact O-N 3.11Å |
| 176 | Q | 92.1 | Very high | 91 | Very high | 67 Ų | 67 | 74.3 Ų | 74.3 | 31% | 0.313 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -64.6 | -36.1 | 179.2 | -71.8 | 178.6 | 55.5 | 0 | 0 | 112.4 | R172 L173 A174 V179 H180 F197 | R172-Q176 VanDerWaalsContact O-CG 3.28Å; R172-Q176 WeakPolarHBondContact O-CG 3.2Å; R172-Q176 PolarHBondContact O-N 3.3Å; R172-Q176 VanDerWaalsContact O-N 3.14Å; R172-Q176 PolarHBondContact O-NE2 2.87Å; L173-Q176 PolarHBondContact O-N 2.84Å; A174-Q176 VanDerWaalsContact C-N 3.35Å; A174-Q176 PolarHBondContact O-N 3.27Å; Q176-V179 PolarHBondContact O-N 3.01Å; Q176-H180 WeakPolarHBondContact O-CB 3.48Å; Q176-H180 PolarHBondContact O-N 3.4Å; Q176-F197 HydrophobicContact CB-CE2 4.06Å |
| 177 | Y | 94.2 | Very high | 90 | Very high | 62 Ų | 62 | 75 Ų | 75 | 24% | 0.243 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -65.6 | -44.8 | 176.5 | -174.9 | -132.7 | 0 | 0 | 0 | 111.6 | H155 P157 L173 A174 I175 V179 H180 L181 F197 | H155-Y177 VanDerWaalsContact O-CE1 3.27Å; H155-Y177 WeakPolarHBondContact O-CE1 3.48Å; P157-Y177 HydrophobicContact CG-CD2 4.12Å; P157-Y177 HydrophobicContact CG-CE1 4.15Å; P157-Y177 HydrophobicContact CG-CE2 3.52Å; L173-Y177 WeakPolarHBondContact O-CB 3.41Å; L173-Y177 PolarHBondContact O-N 3.15Å; A174-Y177 PolarHBondContact O-N 3.25Å; I175-Y177 VanDerWaalsContact C-N 3.3Å; I175-Y177 PolarHBondContact O-N 3.41Å; Y177-V179 VanDerWaalsContact C-N 3.29Å; Y177-V179 PolarHBondContact O-N 3.49Å; Y177-H180 WeakPolarHBondContact O-CB 3.48Å; Y177-H180 PolarHBondContact O-N 3.08Å; Y177-H180 VanDerWaalsContact O-N 3.13Å; Y177-L181 HydrophobicContact CD1-CD1 4.14Å; Y177-L181 HydrophobicContact CD2-CD1 4.45Å; Y177-L181 HydrophobicContact CD2-CG 4.11Å; Y177-L181 HydrophobicContact CE1-CD1 3.7Å; Y177-L181 HydrophobicContact CE1-CG 4.34Å; Y177-L181 HydrophobicContact CE2-CD1 4.01Å; Y177-L181 HydrophobicContact CE2-CD2 3.72Å; Y177-L181 HydrophobicContact CE2-CG 3.72Å; Y177-L181 HydrophobicContact CG-CD1 4.5Å; Y177-L181 WeakPolarHBondContact O-CG 3.4Å; Y177-L181 PolarHBondContact O-N 3.27Å; Y177-F197 HydrophobicContact CD2-CD1 4.27Å; Y177-F197 HydrophobicContact CD2-CE1 4.04Å; Y177-F197 HydrophobicContact CD2-CE2 4.44Å; Y177-F197 HydrophobicContact CD2-CZ 4.14Å; Y177-F197 HydrophobicContact CG-CE1 4.44Å; Y177-F197 HydrophobicContact CG-CZ 4.19Å |
| 178 | I | 93.9 | Very high | 88.6 | Confident | 93 Ų | 93 | 77.7 Ų | 77.7 | 48% | 0.477 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -56.8 | -44.8 | 174 | -66.9 | 165.5 | 0 | 0 | 0 | 110.8 | A174 I175 K182 | A174-I178 WeakPolarHBondContact O-CG1 3.48Å; A174-I178 PolarHBondContact O-N 3.45Å; I175-I178 PolarHBondContact O-N 3.41Å; I178-K182 HydrophobicContact CG2-CD 4.29Å; I178-K182 WeakPolarHBondContact O-CG 3.45Å; I178-K182 PolarHBondContact O-N 2.95Å |
| 179 | V | 91.8 | Very high | 87 | Confident | 55 Ų | 55 | 80.4 Ų | 80.4 | 33% | 0.333 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -66.4 | -39.9 | 177.9 | 175.1 | 0 | 0 | 0 | 0 | 111.5 | I175 Q176 Y177 K182 R183 | I175-V179 WeakPolarHBondContact O-CG2 3.27Å; I175-V179 PolarHBondContact O-N 2.85Å; I175-V179 VanDerWaalsContact O-N 3.11Å; Q176-V179 PolarHBondContact O-N 3.01Å; Y177-V179 VanDerWaalsContact C-N 3.29Å; Y177-V179 PolarHBondContact O-N 3.49Å; V179-K182 PolarHBondContact O-N 3.06Å; V179-R183 VanDerWaalsContact CG1-NH1 3.33Å; V179-R183 WeakPolarHBondContact O-CG 3.38Å; V179-R183 PolarHBondContact O-N 3.23Å; V179-R183 VanDerWaalsContact O-N 3.13Å |
| 180 | H | 89 | Confident | 85.1 | Confident | 56 Ų | 56 | 84.7 Ų | 84.7 | 26% | 0.259 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -60.9 | -50.9 | 176.2 | 177.1 | 61.1 | 0 | 0 | 0 | 111.1 | Q176 Y177 K182 R183 T184 F197 | Q176-H180 WeakPolarHBondContact O-CB 3.48Å; Q176-H180 PolarHBondContact O-N 3.4Å; Y177-H180 WeakPolarHBondContact O-CB 3.48Å; Y177-H180 PolarHBondContact O-N 3.08Å; Y177-H180 VanDerWaalsContact O-N 3.13Å; H180-K182 PolarHBondContact O-N 2.84Å; H180-R183 PolarHBondContact O-N 3.42Å; H180-T184 PolarHBondContact O-N 3.16Å; H180-T184 PolarHBondContact O-OG1 2.84Å; H180-F197 HydrophobicContact CB-CD2 4.47Å |
| 181 | L | 91 | Very high | 83 | Confident | 68 Ų | 68 | 90.2 Ų | 90.2 | 36% | 0.356 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -58.5 | -45.1 | 176.8 | -68.7 | 179.2 | 0 | 0 | 0 | 112 | Y177 R183 T184 L185 | Y177-L181 HydrophobicContact CD1-CD1 4.14Å; Y177-L181 HydrophobicContact CD2-CD1 4.45Å; Y177-L181 HydrophobicContact CD2-CG 4.11Å; Y177-L181 HydrophobicContact CE1-CD1 3.7Å; Y177-L181 HydrophobicContact CE1-CG 4.34Å; Y177-L181 HydrophobicContact CE2-CD1 4.01Å; Y177-L181 HydrophobicContact CE2-CD2 3.72Å; Y177-L181 HydrophobicContact CE2-CG 3.72Å; Y177-L181 HydrophobicContact CG-CD1 4.5Å; Y177-L181 WeakPolarHBondContact O-CG 3.4Å; Y177-L181 PolarHBondContact O-N 3.27Å; L181-R183 VanDerWaalsContact C-N 3.29Å; L181-R183 PolarHBondContact O-N 3.4Å; L181-T184 PolarHBondContact O-N 2.82Å; L181-L185 WeakPolarHBondContact O-CB 3.17Å; L181-L185 VanDerWaalsContact O-CG 3.25Å; L181-L185 WeakPolarHBondContact O-CG 3.1Å; L181-L185 PolarHBondContact O-N 3.3Å |
| 182 | K | 90.8 | Very high | 80.7 | Confident | 138 Ų | 138 | 92.7 Ų | 92.7 | 60% | 0.6 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -57.1 | -41.2 | 176.9 | -77.4 | 179.2 | 175.9 | -172.7 | 0 | 112.5 | I178 V179 H180 S186 | I178-K182 HydrophobicContact CG2-CD 4.29Å; I178-K182 WeakPolarHBondContact O-CG 3.45Å; I178-K182 PolarHBondContact O-N 2.95Å; V179-K182 PolarHBondContact O-N 3.06Å; H180-K182 PolarHBondContact O-N 2.84Å; K182-S186 WeakPolarHBondContact O-CB 3.28Å; K182-S186 PolarHBondContact O-N 3.47Å; K182-S186 VanDerWaalsContact O-N 3.09Å; K182-S186 PolarHBondContact O-OG 3.46Å |
| 183 | R | 86.5 | Confident | 78.9 | Confident | 136 Ų | 136 | 94.1 Ų | 94.1 | 51% | 0.513 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -68.5 | -46 | 177.2 | -71.7 | 178 | -175.9 | 134.8 | 2.4 | 111.8 | V179 H180 L181 L185 S186 S187 M194 | V179-R183 VanDerWaalsContact CG1-NH1 3.33Å; V179-R183 WeakPolarHBondContact O-CG 3.38Å; V179-R183 PolarHBondContact O-N 3.23Å; V179-R183 VanDerWaalsContact O-N 3.13Å; H180-R183 PolarHBondContact O-N 3.42Å; L181-R183 VanDerWaalsContact C-N 3.29Å; L181-R183 PolarHBondContact O-N 3.4Å; R183-L185 VanDerWaalsContact C-N 3.26Å; R183-L185 PolarHBondContact O-N 2.69Å; R183-S186 PolarHBondContact O-N 3.12Å; R183-S187 WeakPolarHBondContact O-CB 3.21Å; R183-S187 PolarHBondContact O-N 2.92Å; R183-S187 VanDerWaalsContact O-N 3.11Å; R183-M194 PolarHBondContact NH1-SD 3.26Å |
| 184 | T | 86.7 | Confident | 77.1 | Confident | 82 Ų | 82 | 98.6 Ų | 98.6 | 50% | 0.503 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -60.8 | -35.5 | 177 | -53.1 | 0 | 0 | 0 | 0 | 112 | H180 L181 | H180-T184 PolarHBondContact O-N 3.16Å; H180-T184 PolarHBondContact O-OG1 2.84Å; L181-T184 PolarHBondContact O-N 2.82Å |
| 185 | L | 88.5 | Confident | 75.8 | Confident | 151 Ų | 151 | 106 Ų | 106 | 79% | 0.791 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -78.9 | -23.8 | 177.3 | -67.6 | 174.8 | 0 | 0 | 0 | 113.8 | L181 R183 | L181-L185 WeakPolarHBondContact O-CB 3.17Å; L181-L185 VanDerWaalsContact O-CG 3.25Å; L181-L185 WeakPolarHBondContact O-CG 3.1Å; L181-L185 PolarHBondContact O-N 3.3Å; R183-L185 VanDerWaalsContact C-N 3.26Å; R183-L185 PolarHBondContact O-N 2.69Å |
| 186 | S | 84.2 | Confident | 75.1 | Confident | 106 Ų | 106 | 107.9 Ų | 107.9 | 74% | 0.741 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -90.8 | -16.6 | -178.2 | -56.6 | 0 | 0 | 0 | 0 | 113.1 | K182 R183 | K182-S186 WeakPolarHBondContact O-CB 3.28Å; K182-S186 PolarHBondContact O-N 3.47Å; K182-S186 VanDerWaalsContact O-N 3.09Å; K182-S186 PolarHBondContact O-OG 3.46Å; R183-S186 PolarHBondContact O-N 3.12Å |
| 187 | S | 66.6 | Low | 74.8 | Confident | 59 Ų | 59 | 105.3 Ų | 105.3 | 41% | 0.413 | 57% | 0.565 | S | S | . | * | trans | -121 | 110.5 | -176.1 | -162.8 | 0 | 0 | 0 | 0 | 108.6 | R183 E189 | R183-S187 WeakPolarHBondContact O-CB 3.21Å; R183-S187 PolarHBondContact O-N 2.92Å; R183-S187 VanDerWaalsContact O-N 3.11Å; S187-E189 PolarHBondContact O-N 3.35Å; S187-E189 VanDerWaalsContact O-N 3.15Å; S187-E189 VanDerWaalsContact OG-CB 3.31Å; S187-E189 WeakPolarHBondContact OG-CB 3.32Å; S187-E189 PolarHBondContact OG-N 2.91Å | ||
| 188 | D | 61.7 | Low | 74.3 | Confident | 166 Ų | 166 | 104.1 Ų | 104.1 | 89% | 0.888 | 57% | 0.565 | S | S | * | * | trans | -63.8 | -4.3 | 163.4 | -158.3 | 28.1 | 0 | 0 | 0 | 111.4 | A190 | D188-A190 PolarHBondContact O-N 3.35Å; D188-A190 VanDerWaalsContact O-N 3.1Å | ||
| 189 | E | 57.5 | Low | 73.9 | Confident | 146 Ų | 146 | 103.4 Ų | 103.4 | 68% | 0.682 | 56% | 0.563 | S | S | * | * | trans | -83.5 | 88.7 | 174.1 | -49.7 | -64 | 154.2 | 0 | 0 | 109.7 | S187 C191 | S187-E189 PolarHBondContact O-N 3.35Å; S187-E189 VanDerWaalsContact O-N 3.15Å; S187-E189 VanDerWaalsContact OG-CB 3.31Å; S187-E189 WeakPolarHBondContact OG-CB 3.32Å; S187-E189 PolarHBondContact OG-N 2.91Å; E189-C191 PolarHBondContact O-N 2.75Å | ||
| 190 | A | 52.1 | Low | 73.6 | Confident | 92 Ų | 92 | 101.8 Ų | 101.8 | 76% | 0.76 | 55% | 0.553 | S | S | * | * | trans | -44.8 | 123.5 | 154.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | D188 | D188-A190 PolarHBondContact O-N 3.35Å; D188-A190 VanDerWaalsContact O-N 3.1Å | ||
| 191 | C | 46.8 | Very low | 73.5 | Confident | 117 Ų | 117 | 99.2 Ų | 99.2 | 79% | 0.791 | 54% | 0.541 | S | S | * | . | trans | 65.5 | 87 | 155.1 | -178.4 | 0 | 0 | 0 | 0 | 116.7 | E189 | E189-C191 PolarHBondContact O-N 2.75Š| ||
| 192 | T | 47 | Very low | 73.1 | Confident | 130 Ų | 130 | 100.9 Ų | 100.9 | 80% | 0.798 | 55% | 0.55 | S | S | * | . | trans | -150.8 | 124.2 | 139.3 | 47.4 | 0 | 0 | 0 | 0 | 112.5 | M194 | T192-M194 PolarHBondContact O-N 2.81Š| ||
| 193 | S | 55.5 | Low | 72.8 | Confident | 131 Ų | 131 | 98 Ų | 98 | 92% | 0.916 | 54% | 0.539 | S | S | * | . | S | Bend | trans | 71.7 | 29.9 | 148.9 | -158.4 | 0 | 0 | 0 | 0 | 121.4 | ||
| 194 | M | 54.6 | Low | 72.6 | Confident | 95 Ų | 95 | 92 Ų | 92 | 47% | 0.468 | 52% | 0.517 | S | S | . | . | S | Bend | trans | -127.6 | 134.2 | 163.5 | -166.6 | 178.3 | 59.2 | 0 | 0 | 109.8 | R183 T192 K196 | R183-M194 PolarHBondContact NH1-SD 3.26Å; T192-M194 PolarHBondContact O-N 2.81Å; M194-K196 PolarHBondContact O-N 3.36Å |
| 195 | R | 68.1 | Low | 72.3 | Confident | 167 Ų | 167 | 88.6 Ų | 88.6 | 63% | 0.63 | 50% | 0.495 | S | S | * | . | trans | -41.3 | 128.2 | 180 | -66.9 | -174.7 | -168.9 | 177.7 | 4.2 | 109.1 | F197 V200 E203 | R195-F197 PolarHBondContact O-N 3.37Å; R195-V200 HydrophobicContact CB-CG2 3.92Å; R195-E203 IonicContact NH1-OE2 3.02Å; R195-E203 PolarHBondContact NH1-OE2 3.36Å | ||
| 196 | K | 78.1 | Confident | 71.6 | Confident | 148 Ų | 148 | 86.5 Ų | 86.5 | 64% | 0.643 | 48% | 0.481 | S | S | * | . | trans | -56.9 | 137.6 | 178.7 | -65.3 | 176.7 | 178.6 | 177.1 | 0 | 106.7 | M194 S198 D199 V200 | M194-K196 PolarHBondContact O-N 3.36Å; K196-S198 VanDerWaalsContact CB-OG 3.26Å; K196-S198 WeakPolarHBondContact CB-OG 3.49Å; K196-S198 PolarHBondContact O-N 2.89Å; K196-D199 WeakPolarHBondContact CB-OD2 3.14Å; K196-D199 PolarHBondContact N-OD2 3.08Å; K196-D199 WeakPolarHBondContact O-CB 3.49Å; K196-D199 PolarHBondContact O-N 2.92Å; K196-V200 PolarHBondContact O-N 3.34Å | ||
| 197 | F | 85.5 | Confident | 71 | Confident | 14 Ų | 14 | 85.9 Ų | 85.9 | 6% | 0.061 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -52.6 | -34 | -178.9 | 177.9 | -102.1 | 0 | 0 | 0 | 111.2 | I156 P157 F158 Q176 Y177 H180 R195 D199 V200 V201 | I156-F197 HydrophobicContact CG2-CE1 4.18Å; I156-F197 HydrophobicContact CG2-CZ 3.93Å; P157-F197 HydrophobicContact CB-CD1 4.45Å; P157-F197 HydrophobicContact CB-CE1 4.25Å; P157-F197 HydrophobicContact CG-CE1 4.34Å; F158-F197 HydrophobicContact CD2-CD1 4.07Å; F158-F197 HydrophobicContact CE2-CD1 4.3Å; Q176-F197 HydrophobicContact CB-CE2 4.06Å; Y177-F197 HydrophobicContact CD2-CD1 4.27Å; Y177-F197 HydrophobicContact CD2-CE1 4.04Å; Y177-F197 HydrophobicContact CD2-CE2 4.44Å; Y177-F197 HydrophobicContact CD2-CZ 4.14Å; Y177-F197 HydrophobicContact CG-CE1 4.44Å; Y177-F197 HydrophobicContact CG-CZ 4.19Å; H180-F197 HydrophobicContact CB-CD2 4.47Å; R195-F197 PolarHBondContact O-N 3.37Å; F197-D199 VanDerWaalsContact C-N 3.34Å; F197-D199 PolarHBondContact O-N 2.79Å; F197-V200 PolarHBondContact O-N 2.68Å; F197-V200 VanDerWaalsContact O-N 3.17Å; F197-V201 HydrophobicContact CD1-CG2 3.8Å; F197-V201 HydrophobicContact CE1-CG2 3.3Å; F197-V201 HydrophobicContact CE2-CG2 4.17Å; F197-V201 HydrophobicContact CG-CG2 4.41Å; F197-V201 HydrophobicContact CZ-CG2 3.51Å; F197-V201 WeakPolarHBondContact O-CG2 3.24Å; F197-V201 PolarHBondContact O-N 3.06Å |
| 198 | S | 85.4 | Confident | 70.6 | Confident | 36 Ų | 36 | 86.5 Ų | 86.5 | 25% | 0.252 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -51.1 | -45.8 | 170.2 | 56.6 | 0 | 0 | 0 | 0 | 114 | K196 V200 V201 L202 | K196-S198 VanDerWaalsContact CB-OG 3.26Å; K196-S198 WeakPolarHBondContact CB-OG 3.49Å; K196-S198 PolarHBondContact O-N 2.89Å; S198-V200 VanDerWaalsContact C-N 3.28Å; S198-V200 PolarHBondContact O-N 3.49Å; S198-V201 PolarHBondContact O-N 2.94Å; S198-L202 WeakPolarHBondContact O-CB 3.33Å; S198-L202 PolarHBondContact O-N 2.74Å |
| 199 | D | 84 | Confident | 70.2 | Confident | 78 Ų | 78 | 83.2 Ų | 83.2 | 42% | 0.417 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -66.1 | -38.4 | -177.7 | -53.7 | -24.1 | 0 | 0 | 0 | 109.7 | K196 F197 E203 | K196-D199 WeakPolarHBondContact CB-OD2 3.14Å; K196-D199 PolarHBondContact N-OD2 3.08Å; K196-D199 WeakPolarHBondContact O-CB 3.49Å; K196-D199 PolarHBondContact O-N 2.92Å; F197-D199 VanDerWaalsContact C-N 3.34Å; F197-D199 PolarHBondContact O-N 2.79Å; D199-E203 WeakPolarHBondContact O-CB 3.45Å; D199-E203 PolarHBondContact O-N 2.7Å |
| 200 | V | 85.5 | Confident | 70.1 | Confident | 22 Ų | 22 | 85.5 Ų | 85.5 | 13% | 0.133 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -70.6 | -40.9 | 178.9 | -172.2 | 0 | 0 | 0 | 0 | 111.8 | R195 K196 F197 S198 E203 E204 | R195-V200 HydrophobicContact CB-CG2 3.92Å; K196-V200 PolarHBondContact O-N 3.34Å; F197-V200 PolarHBondContact O-N 2.68Å; F197-V200 VanDerWaalsContact O-N 3.17Å; S198-V200 VanDerWaalsContact C-N 3.28Å; S198-V200 PolarHBondContact O-N 3.49Å; V200-E203 PolarHBondContact O-N 3.07Å; V200-E204 WeakPolarHBondContact O-CB 3.48Å; V200-E204 PolarHBondContact O-N 2.72Å |
| 201 | V | 87.4 | Confident | 70 | Confident | 2 Ų | 2 | 91.6 Ų | 91.6 | 1% | 0.012 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -60.7 | -49.3 | 174.2 | 174.7 | 0 | 0 | 0 | 0 | 110.2 | F158 V159 L173 F197 S198 E203 E204 V205 | F158-V201 HydrophobicContact CB-CB 4.3Å; F158-V201 HydrophobicContact CB-CG1 4.03Å; V159-V201 HydrophobicContact CG2-CG1 3.81Å; L173-V201 HydrophobicContact CD1-CG1 4.33Å; L173-V201 HydrophobicContact CD2-CB 4.44Å; L173-V201 HydrophobicContact CD2-CG2 3.95Å; F197-V201 HydrophobicContact CD1-CG2 3.8Å; F197-V201 HydrophobicContact CE1-CG2 3.3Å; F197-V201 HydrophobicContact CE2-CG2 4.17Å; F197-V201 HydrophobicContact CG-CG2 4.41Å; F197-V201 HydrophobicContact CZ-CG2 3.51Å; F197-V201 WeakPolarHBondContact O-CG2 3.24Å; F197-V201 PolarHBondContact O-N 3.06Å; S198-V201 PolarHBondContact O-N 2.94Å; V201-E203 VanDerWaalsContact C-N 3.33Å; V201-E203 PolarHBondContact O-N 3.06Å; V201-E204 PolarHBondContact O-N 3.06Å; V201-V205 HydrophobicContact CG1-CG2 3.97Å; V201-V205 VanDerWaalsContact O-CB 3.3Å; V201-V205 WeakPolarHBondContact O-CB 3.25Å; V201-V205 WeakPolarHBondContact O-CG2 3.4Å; V201-V205 PolarHBondContact O-N 3.17Å |
| 202 | L | 82.9 | Confident | 70.4 | Confident | 102 Ų | 102 | 90.7 Ų | 90.7 | 53% | 0.534 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -59.2 | -45.4 | 179.6 | -171 | 67.5 | 0 | 0 | 0 | 111.3 | S198 H206 | S198-L202 WeakPolarHBondContact O-CB 3.33Å; S198-L202 PolarHBondContact O-N 2.74Å; L202-H206 WeakPolarHBondContact CD1-CE1 3.27Å; L202-H206 WeakPolarHBondContact O-CB 3.34Å; L202-H206 PolarHBondContact O-N 3.23Å; L202-H206 PolarHBondContact O-ND1 2.95Å |
| 203 | E | 83.5 | Confident | 70.8 | Confident | 78 Ų | 78 | 90 Ų | 90 | 36% | 0.364 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -64.7 | -45.6 | 179 | -150.2 | -167.2 | 145.9 | 0 | 0 | 111.6 | R195 D199 V200 V201 H206 R207 | R195-E203 IonicContact NH1-OE2 3.02Å; R195-E203 PolarHBondContact NH1-OE2 3.36Å; D199-E203 WeakPolarHBondContact O-CB 3.45Å; D199-E203 PolarHBondContact O-N 2.7Å; V200-E203 PolarHBondContact O-N 3.07Å; V201-E203 VanDerWaalsContact C-N 3.33Å; V201-E203 PolarHBondContact O-N 3.06Å; E203-H206 PolarHBondContact O-N 2.97Å; E203-R207 VanDerWaalsContact CG-NH2 3.28Å; E203-R207 VanDerWaalsContact O-CB 3.24Å; E203-R207 WeakPolarHBondContact O-CB 3.29Å; E203-R207 PolarHBondContact O-N 2.81Å; E203-R207 IonicContact OE1-CZ 3.2Å; E203-R207 IonicContact OE1-NE 2.97Å; E203-R207 PolarHBondContact OE1-NE 3.46Å; E203-R207 IonicContact OE1-NH2 2.68Å; E203-R207 PolarHBondContact OE1-NH2 2.52Å; E203-R207 IonicContact OE2-NH2 3.13Å; E203-R207 PolarHBondContact OE2-NH2 3.28Å; E203-R207 VanDerWaalsContact OE2-NH2 3.13Å |
| 204 | E | 83.7 | Confident | 70.2 | Confident | 11 Ų | 11 | 88.8 Ų | 88.8 | 5% | 0.051 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -72.8 | -40.6 | -176.7 | -168.5 | 73.2 | -167 | 0 | 0 | 112.6 | T169 R172 L173 V200 V201 H206 R207 K208 | T169-E204 HydrophobicContact CG2-CG 3.89Å; R172-E204 WeakPolarHBondContact CD-OE1 3.3Å; R172-E204 IonicContact NH1-OE1 3.28Å; R172-E204 PolarHBondContact NH1-OE1 2.85Å; R172-E204 VanDerWaalsContact NH1-OE1 3.09Å; L173-E204 HydrophobicContact CD2-CB 4.08Å; L173-E204 HydrophobicContact CD2-CG 4.34Å; V200-E204 WeakPolarHBondContact O-CB 3.48Å; V200-E204 PolarHBondContact O-N 2.72Å; V201-E204 PolarHBondContact O-N 3.06Å; E204-H206 PolarHBondContact O-N 3.23Å; E204-R207 PolarHBondContact O-N 3.25Å; E204-R207 IonicContact OE2-CZ 3.77Å; E204-R207 IonicContact OE2-NH1 2.65Å; E204-R207 PolarHBondContact OE2-NH1 3.27Å; E204-K208 IonicContact OE1-NZ 3.98Å |
| 205 | V | 80.1 | Confident | 69.5 | Low | 9 Ų | 9 | 94.7 Ų | 94.7 | 6% | 0.055 | 48% | 0.482 | C | S | . | . | H | α-helix | trans | -63.5 | -35.3 | 176.9 | 172.2 | 0 | 0 | 0 | 0 | 110.3 | P160 V165 L173 V201 | P160-V205 HydrophobicContact CG-CG1 3.85Å; V165-V205 HydrophobicContact CG2-CG1 4.39Å; V165-V205 HydrophobicContact CG2-CG2 4.22Å; L173-V205 HydrophobicContact CD1-CG2 4.22Å; V201-V205 HydrophobicContact CG1-CG2 3.97Å; V201-V205 VanDerWaalsContact O-CB 3.3Å; V201-V205 WeakPolarHBondContact O-CB 3.25Å; V201-V205 WeakPolarHBondContact O-CG2 3.4Å; V201-V205 PolarHBondContact O-N 3.17Å |
| 206 | H | 73.4 | Confident | 69.6 | Low | 108 Ų | 108 | 91.1 Ų | 91.1 | 50% | 0.5 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -81.5 | -28.1 | 176.7 | -65.9 | 171.9 | 0 | 0 | 0 | 113.6 | L202 E203 E204 K208 | L202-H206 WeakPolarHBondContact CD1-CE1 3.27Å; L202-H206 WeakPolarHBondContact O-CB 3.34Å; L202-H206 PolarHBondContact O-N 3.23Å; L202-H206 PolarHBondContact O-ND1 2.95Å; E203-H206 PolarHBondContact O-N 2.97Å; E204-H206 PolarHBondContact O-N 3.23Å; H206-K208 PolarHBondContact O-N 3.38Å; H206-K208 VanDerWaalsContact O-N 3.07Å |
| 207 | R | 70.9 | Confident | 69.1 | Low | 92 Ų | 92 | 88.1 Ų | 88.1 | 35% | 0.347 | 47% | 0.465 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.1 | -7.9 | -170.3 | -117.7 | -174.6 | -80.1 | 100.1 | -12.7 | 116.1 | E203 E204 | E203-R207 VanDerWaalsContact CG-NH2 3.28Å; E203-R207 VanDerWaalsContact O-CB 3.24Å; E203-R207 WeakPolarHBondContact O-CB 3.29Å; E203-R207 PolarHBondContact O-N 2.81Å; E203-R207 IonicContact OE1-CZ 3.2Å; E203-R207 IonicContact OE1-NE 2.97Å; E203-R207 PolarHBondContact OE1-NE 3.46Å; E203-R207 IonicContact OE1-NH2 2.68Å; E203-R207 PolarHBondContact OE1-NH2 2.52Å; E203-R207 IonicContact OE2-NH2 3.13Å; E203-R207 PolarHBondContact OE2-NH2 3.28Å; E203-R207 VanDerWaalsContact OE2-NH2 3.13Å; E204-R207 PolarHBondContact O-N 3.25Å; E204-R207 IonicContact OE2-CZ 3.77Å; E204-R207 IonicContact OE2-NH1 2.65Å; E204-R207 PolarHBondContact OE2-NH1 3.27Å |
| 208 | K | 59.7 | Low | 68.2 | Low | 72 Ų | 72 | 92.2 Ų | 92.2 | 31% | 0.313 | 49% | 0.488 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -137.8 | 8.4 | -168.8 | -68.4 | -174.4 | 175.5 | 177.8 | 0 | 117.7 | T169 E204 H206 R210 | T169-K208 HydrophobicContact CG2-CD 4.22Å; E204-K208 IonicContact OE1-NZ 3.98Å; H206-K208 PolarHBondContact O-N 3.38Å; H206-K208 VanDerWaalsContact O-N 3.07Å; K208-R210 PolarHBondContact O-N 3.29Å; K208-R210 VanDerWaalsContact O-N 3.09Å |
| 209 | N | 53.5 | Low | 67.2 | Low | 98 Ų | 98 | 95.5 Ų | 95.5 | 52% | 0.524 | 50% | 0.502 | S | S | . | . | trans | -78.5 | 24.9 | 169.7 | -79.8 | -17.9 | 0 | 0 | 0 | 114 | ||||
| 210 | R | 55.2 | Low | 66.2 | Low | 194 Ų | 194 | 96.6 Ų | 96.6 | 73% | 0.732 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.6 | 23.1 | -174.5 | -69.6 | -154.1 | -61.7 | -115 | 1.7 | 115.7 | K208 | K208-R210 PolarHBondContact O-N 3.29Å; K208-R210 VanDerWaalsContact O-N 3.09Å |
| 211 | Y | 50.2 | Low | 64.9 | Low | 219 Ų | 219 | 101.5 Ų | 101.5 | 86% | 0.859 | 53% | 0.532 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.6 | 1.5 | 172.6 | -61 | -74.2 | 0 | 0 | 0 | 113.7 | ||
| 212 | A | 54.3 | Low | 63.3 | Low | 99 Ų | 99 | 108.6 Ų | 108.6 | 82% | 0.818 | 57% | 0.569 | S | S | * | * | S | Bend | trans | -115.3 | 1.2 | -175.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||
| 213 | S | 54.5 | Low | 61.7 | Low | 116 Ų | 116 | 109.2 Ų | 109.2 | 81% | 0.811 | 57% | 0.572 | S | S | * | * | S | Bend | trans | -119.6 | 21.5 | -174.9 | -164.3 | 0 | 0 | 0 | 0 | 113.9 | ||
| 214 | S | 44.4 | Very low | 59.9 | Low | 104 Ų | 104 | 111.8 Ų | 111.8 | 73% | 0.727 | 59% | 0.589 | S | S | * | * | trans | -141.7 | 52.7 | -174.6 | 173 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 215 | V | 39.3 | Very low | 57.8 | Low | 219 Ų | 219 | 120.9 Ų | 120.9 | 100% | 1.327 | 64% | 0.638 | S | S | * | * | trans | -152.5 | 0 | 153.6 | -173.3 | 0 | 0 | 0 | 0 | 107.8 |
Retrieved 215 of 215 residues in 155.1 ms
(Link to these results)