| 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 | 46.2 | Very low | 38.4 | Very low | 250 Ų | 250 | 162.6 Ų | 162.6 | 100% | 1.232 | 85% | 0.846 | S | S | * | * | 0 | 135.2 | 0 | -83.3 | 175.4 | 143.1 | 0 | 0 | 108.4 | |||||
| 2 | V | 41.6 | Very low | 38.4 | Very low | 143 Ų | 143 | 158.5 Ų | 158.5 | 87% | 0.867 | 84% | 0.841 | S | S | * | * | trans | -91.2 | 141.8 | -163.4 | 165.2 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 3 | S | 35 | Very low | 37.9 | Very low | 101 Ų | 101 | 152.2 Ų | 152.2 | 71% | 0.706 | 84% | 0.837 | S | S | * | * | trans | 60.1 | 129.9 | 147.2 | -166.8 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 4 | S | 39.9 | Very low | 37.9 | Very low | 117 Ų | 117 | 155.4 Ų | 155.4 | 82% | 0.818 | 84% | 0.839 | S | S | * | * | -170.6 | 110.8 | 113.3 | -81.4 | 0 | 0 | 0 | 0 | 110.6 | |||||
| 5 | G | 35.8 | Very low | 38.4 | Very low | 74 Ų | 74 | 153.1 Ų | 153.1 | 76% | 0.763 | 84% | 0.835 | S | S | * | * | trans | -68.1 | 155.1 | 163.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 6 | K | 42.3 | Very low | 38.8 | Very low | 209 Ų | 209 | 147.8 Ų | 147.8 | 91% | 0.909 | 81% | 0.812 | S | S | * | * | trans | -149.4 | 109.5 | 151.2 | -133 | 169.1 | -176.4 | 172.8 | 0 | 110.3 | ||||
| 7 | K | 36.7 | Very low | 39.6 | Very low | 163 Ų | 163 | 146.6 Ų | 146.6 | 71% | 0.709 | 80% | 0.802 | S | S | * | * | trans | -61.4 | 167.6 | 162.9 | -73.8 | 176.2 | 173.5 | 176.4 | 0 | 110.5 | ||||
| 8 | Y | 35.1 | Very low | 40.3 | Very low | 208 Ų | 208 | 146.4 Ų | 146.4 | 82% | 0.816 | 80% | 0.795 | S | S | * | * | trans | 93.4 | 104.4 | 156.9 | -53.1 | -77.1 | 0 | 0 | 0 | 116.9 | ||||
| 9 | S | 40.5 | Very low | 40.8 | Very low | 125 Ų | 125 | 145.6 Ų | 145.6 | 87% | 0.874 | 79% | 0.789 | S | S | * | * | -146.7 | 127.8 | 103.4 | 87.4 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 10 | R | 32.5 | Very low | 41.3 | Very low | 217 Ų | 217 | 145.9 Ų | 145.9 | 82% | 0.819 | 79% | 0.785 | S | S | * | * | trans | -99.5 | 147.2 | 170.1 | -174.6 | -168.4 | -177.9 | 171.9 | 1.6 | 105.4 | ||||
| 11 | K | 36.7 | Very low | 41.7 | Very low | 182 Ų | 182 | 146.1 Ų | 146.1 | 79% | 0.791 | 78% | 0.779 | S | S | * | * | trans | 91.2 | 113.1 | 165 | -55.1 | -179.6 | 174.4 | 179 | 0 | 116.3 | ||||
| 12 | S | 38.3 | Very low | 41.9 | Very low | 113 Ų | 113 | 139 Ų | 139 | 79% | 0.79 | 75% | 0.75 | S | S | * | * | -151.5 | 120.5 | 102 | 51.8 | 0 | 0 | 0 | 0 | 107.9 | K14 | S12-K14 PolarHBondContact O-N 3.22Š| |||
| 13 | G | 32.5 | Very low | 42.4 | Very low | 77 Ų | 77 | 142.2 Ų | 142.2 | 79% | 0.794 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 118.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||
| 14 | K | 37.5 | Very low | 43.1 | Very low | 197 Ų | 197 | 141.1 Ų | 141.1 | 86% | 0.857 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -77.4 | 121.2 | 158.5 | -79.3 | 178.7 | 174.8 | 179.6 | 0 | 106.2 | S12 S16 | S12-K14 PolarHBondContact O-N 3.22Å; K14-S16 PolarHBondContact O-N 3.31Å |
| 15 | P | 44.9 | Very low | 43.3 | Very low | 120 Ų | 120 | 145 Ų | 145 | 78% | 0.779 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 132.2 | 169.3 | 26.3 | -29.9 | 0 | 0 | 0 | 107.9 | M17 | P15-M17 PolarHBondContact O-N 3.15Š|
| 16 | S | 45.2 | Very low | 43.6 | Very low | 68 Ų | 68 | 147.2 Ų | 147.2 | 48% | 0.476 | 74% | 0.736 | S | S | . | * | P | Polyproline II helix | trans | -56.8 | 132 | -179.1 | -174.5 | 0 | 0 | 0 | 0 | 109.7 | K14 E18 D19 | K14-S16 PolarHBondContact O-N 3.31Å; S16-E18 PolarHBondContact O-N 2.96Å; S16-E18 PolarHBondContact OG-N 3.43Å; S16-E18 PolarHBondContact OG-OE2 3.15Å; S16-D19 PolarHBondContact O-N 3.48Å; S16-D19 VanDerWaalsContact O-N 3.16Å |
| 17 | M | 52.7 | Low | 43.6 | Very low | 128 Ų | 128 | 147.3 Ų | 147.3 | 63% | 0.631 | 74% | 0.737 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.8 | -15 | 172.9 | -88.8 | 176.8 | 179 | 0 | 0 | 113 | P15 D19 Q20 F21 | P15-M17 PolarHBondContact O-N 3.15Å; M17-D19 PolarHBondContact O-N 3.39Å; M17-Q20 PolarHBondContact O-N 3.16Å; M17-Q20 VanDerWaalsContact O-N 3.16Å; M17-F21 PolarHBondContact O-N 3.23Å |
| 18 | E | 52 | Low | 43.8 | Very low | 144 Ų | 144 | 146.9 Ų | 146.9 | 67% | 0.673 | 74% | 0.737 | S | S | * | * | H | α-helix | trans | -57.7 | -34.4 | 173.2 | -88.7 | 136.2 | 171.4 | 0 | 0 | 112.8 | S16 Q20 F21 T22 | S16-E18 PolarHBondContact O-N 2.96Å; S16-E18 PolarHBondContact OG-N 3.43Å; S16-E18 PolarHBondContact OG-OE2 3.15Å; E18-Q20 PolarHBondContact O-N 2.79Å; E18-F21 PolarHBondContact O-N 3.46Å; E18-T22 PolarHBondContact O-N 2.95Å; E18-T22 PolarHBondContact O-OG1 3.39Å |
| 19 | D | 50.6 | Low | 43.9 | Very low | 130 Ų | 130 | 142.9 Ų | 142.9 | 70% | 0.695 | 74% | 0.735 | S | S | * | * | H | α-helix | trans | -73.4 | -20.2 | -178.7 | -131.2 | 20.2 | 0 | 0 | 0 | 112.7 | S16 M17 R23 | S16-D19 PolarHBondContact O-N 3.48Å; S16-D19 VanDerWaalsContact O-N 3.16Å; M17-D19 PolarHBondContact O-N 3.39Å; D19-R23 PolarHBondContact O-N 2.98Å |
| 20 | Q | 50.5 | Low | 43.8 | Very low | 151 Ų | 151 | 145.6 Ų | 145.6 | 71% | 0.706 | 73% | 0.734 | S | S | * | * | H | α-helix | trans | -84.5 | -28.5 | 177 | -152.1 | 171.2 | 39.1 | 0 | 0 | 112.4 | M17 E18 | M17-Q20 PolarHBondContact O-N 3.16Å; M17-Q20 VanDerWaalsContact O-N 3.16Å; E18-Q20 PolarHBondContact O-N 2.79Å |
| 21 | F | 50.3 | Low | 44.1 | Very low | 152 Ų | 152 | 143.4 Ų | 143.4 | 67% | 0.667 | 73% | 0.733 | S | S | * | * | H | α-helix | trans | -71.4 | -36.1 | 171.8 | -87.3 | -82.7 | 0 | 0 | 0 | 111.8 | M17 E18 R23 A24 | M17-F21 PolarHBondContact O-N 3.23Å; E18-F21 PolarHBondContact O-N 3.46Å; F21-R23 VanDerWaalsContact C-N 3.32Å; F21-R23 PolarHBondContact O-N 3.28Å; F21-A24 PolarHBondContact O-N 2.93Å |
| 22 | T | 50.5 | Low | 44.3 | Very low | 99 Ų | 99 | 144.8 Ų | 144.8 | 61% | 0.607 | 74% | 0.739 | S | S | * | * | H | α-helix | trans | -66.3 | -35.1 | 176.8 | -38.7 | 0 | 0 | 0 | 0 | 111.7 | E18 A24 Y25 | E18-T22 PolarHBondContact O-N 2.95Å; E18-T22 PolarHBondContact O-OG1 3.39Å; T22-A24 VanDerWaalsContact C-N 3.3Å; T22-A24 PolarHBondContact O-N 3.31Å; T22-Y25 PolarHBondContact O-N 2.91Å |
| 23 | R | 51.2 | Low | 44.8 | Very low | 211 Ų | 211 | 146.9 Ų | 146.9 | 80% | 0.796 | 73% | 0.734 | S | S | * | * | H | α-helix | trans | -73.3 | -17.8 | 179.2 | -159.7 | 173.3 | -170.6 | -175.6 | 3.3 | 114.5 | D19 F21 Y25 | D19-R23 PolarHBondContact O-N 2.98Å; F21-R23 VanDerWaalsContact C-N 3.32Å; F21-R23 PolarHBondContact O-N 3.28Å; R23-Y25 PolarHBondContact O-N 3.49Å |
| 24 | A | 50.5 | Low | 45.1 | Very low | 79 Ų | 79 | 150.6 Ų | 150.6 | 65% | 0.653 | 74% | 0.735 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.8 | -13.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | F21 T22 | F21-A24 PolarHBondContact O-N 2.93Å; T22-A24 VanDerWaalsContact C-N 3.3Å; T22-A24 PolarHBondContact O-N 3.31Å |
| 25 | Y | 43.8 | Very low | 45.4 | Very low | 199 Ų | 199 | 149.5 Ų | 149.5 | 78% | 0.78 | 74% | 0.738 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -114.5 | 30.6 | -177.4 | -77.1 | -83.1 | 0 | 0 | 0 | 113.1 | T22 R23 F27 | T22-Y25 PolarHBondContact O-N 2.91Å; R23-Y25 PolarHBondContact O-N 3.49Å; Y25-F27 VanDerWaalsContact C-N 3.34Å; Y25-F27 PolarHBondContact O-N 3.44Å; Y25-F27 VanDerWaalsContact O-N 3.1Å |
| 26 | D | 42.2 | Very low | 45.2 | Very low | 120 Ų | 120 | 149.2 Ų | 149.2 | 64% | 0.642 | 74% | 0.739 | S | S | * | * | trans | -84.1 | 81.6 | 172.3 | -142.9 | -1.5 | 0 | 0 | 0 | 109.1 | E28 | D26-E28 PolarHBondContact O-N 3.35Š| ||
| 27 | F | 41.9 | Very low | 44.8 | Very low | 211 Ų | 211 | 149.6 Ų | 149.6 | 93% | 0.925 | 75% | 0.753 | S | S | * | * | trans | -88.8 | 59.5 | 171.7 | -155 | -89.8 | 0 | 0 | 0 | 108.7 | Y25 | Y25-F27 VanDerWaalsContact C-N 3.34Å; Y25-F27 PolarHBondContact O-N 3.44Å; Y25-F27 VanDerWaalsContact O-N 3.1Å | ||
| 28 | E | 40.2 | Very low | 44.3 | Very low | 153 Ų | 153 | 148.2 Ų | 148.2 | 72% | 0.715 | 76% | 0.756 | S | S | * | * | trans | -105.4 | 124.6 | 172.8 | -74.1 | -144.9 | 166.4 | 0 | 0 | 111.4 | D26 | D26-E28 PolarHBondContact O-N 3.35Š| ||
| 29 | T | 38 | Very low | 43.6 | Very low | 124 Ų | 124 | 150.5 Ų | 150.5 | 76% | 0.761 | 77% | 0.767 | S | S | * | * | S | Bend | trans | 93.6 | 116.3 | 158.7 | 63.1 | 0 | 0 | 0 | 0 | 119.9 | ||
| 30 | E | 37.5 | Very low | 43 | Very low | 183 Ų | 183 | 151.9 Ų | 151.9 | 86% | 0.855 | 77% | 0.769 | S | S | * | * | trans | 86.5 | 87.3 | 150.7 | -68 | -173.9 | 159.4 | 0 | 0 | 119.5 | ||||
| 31 | E | 38.4 | Very low | 42.4 | Very low | 171 Ų | 171 | 152.4 Ų | 152.4 | 80% | 0.799 | 78% | 0.777 | S | S | * | * | -154.1 | 83.7 | 107.9 | -106.4 | -177.3 | 169.1 | 0 | 0 | 108.9 | K33 | E31-K33 VanDerWaalsContact C-N 3.28Å; E31-K33 PolarHBondContact O-N 2.97Å | |||
| 32 | K | 41.8 | Very low | 41.9 | Very low | 210 Ų | 210 | 150.9 Ų | 150.9 | 91% | 0.913 | 78% | 0.78 | S | S | * | * | trans | -66.5 | 95.2 | 156.5 | -72.1 | -176.1 | 178.9 | 177.7 | 0 | 106.4 | ||||
| 33 | K | 48.2 | Very low | 41.4 | Very low | 157 Ų | 157 | 153.6 Ų | 153.6 | 68% | 0.683 | 79% | 0.789 | S | S | * | * | trans | -133.1 | 84.7 | 170.6 | -151.8 | 169.7 | -169.4 | 169.3 | 0 | 108.8 | E31 L35 | E31-K33 VanDerWaalsContact C-N 3.28Å; E31-K33 PolarHBondContact O-N 2.97Å; K33-L35 PolarHBondContact O-N 3.42Å; K33-L35 VanDerWaalsContact O-N 3.11Å | ||
| 34 | D | 40 | Very low | 40.6 | Very low | 155 Ų | 155 | 152.7 Ų | 152.7 | 83% | 0.829 | 79% | 0.794 | S | S | * | * | trans | 18.5 | 80.8 | 150.9 | -55.5 | -37.2 | 0 | 0 | 0 | 115.6 | ||||
| 35 | L | 42.1 | Very low | 39.6 | Very low | 175 Ų | 175 | 152.1 Ų | 152.1 | 92% | 0.916 | 80% | 0.795 | S | S | * | * | trans | -99.1 | 68 | 160.7 | -69 | 172.7 | 0 | 0 | 0 | 108 | K33 G37 | K33-L35 PolarHBondContact O-N 3.42Å; K33-L35 VanDerWaalsContact O-N 3.11Å; L35-G37 PolarHBondContact O-N 3.41Å | ||
| 36 | S | 41.6 | Very low | 39.1 | Very low | 114 Ų | 114 | 152.1 Ų | 152.1 | 80% | 0.797 | 80% | 0.799 | S | S | * | * | trans | -86.3 | 86.8 | 164.7 | -169.3 | 0 | 0 | 0 | 0 | 108 | S38 | S36-S38 PolarHBondContact O-N 3.15Š| ||
| 37 | G | 36.4 | Very low | 38.6 | Very low | 75 Ų | 75 | 152.5 Ų | 152.5 | 77% | 0.773 | 81% | 0.806 | S | S | * | * | trans | -88.2 | 90.7 | 168.1 | 0 | 0 | 0 | 0 | 0 | 108.9 | L35 E39 | L35-G37 PolarHBondContact O-N 3.41Å; G37-E39 PolarHBondContact O-N 3.3Å | ||
| 38 | S | 41.6 | Very low | 38.4 | Very low | 100 Ų | 100 | 147.1 Ų | 147.1 | 70% | 0.699 | 80% | 0.801 | S | S | * | * | trans | -79.9 | 106.6 | 170.3 | -170.5 | 0 | 0 | 0 | 0 | 108.5 | S36 E40 | S36-S38 PolarHBondContact O-N 3.15Å; S38-E40 PolarHBondContact O-N 2.94Å | ||
| 39 | E | 37.4 | Very low | 38.2 | Very low | 191 Ų | 191 | 146.1 Ų | 146.1 | 89% | 0.893 | 81% | 0.805 | S | S | * | * | trans | -71.3 | 114 | 163.8 | -70.4 | 176.7 | 163.1 | 0 | 0 | 108 | G37 | G37-E39 PolarHBondContact O-N 3.3Š| ||
| 40 | E | 38.2 | Very low | 38.2 | Very low | 160 Ų | 160 | 148.2 Ų | 148.2 | 75% | 0.748 | 81% | 0.81 | S | S | * | * | trans | -133.8 | 74.4 | 171.9 | -144.6 | -176.7 | -167.4 | 0 | 0 | 108.3 | S38 V42 | S38-E40 PolarHBondContact O-N 2.94Å; E40-V42 HydrophobicContact CG-CG2 4.13Å; E40-V42 PolarHBondContact O-N 3.38Å | ||
| 41 | D | 38.6 | Very low | 38.1 | Very low | 161 Ų | 161 | 146.2 Ų | 146.2 | 86% | 0.861 | 80% | 0.8 | S | S | * | * | trans | -81.4 | 84.1 | 166.4 | -88 | -26.1 | 0 | 0 | 0 | 108.5 | I43 | D41-I43 PolarHBondContact O-N 3.41Š| ||
| 42 | V | 39.5 | Very low | 38.2 | Very low | 120 Ų | 120 | 146 Ų | 146 | 73% | 0.727 | 80% | 0.797 | S | S | * | * | trans | -78.9 | 101.8 | 167.7 | 177.5 | 0 | 0 | 0 | 0 | 108.2 | E40 E44 | E40-V42 HydrophobicContact CG-CG2 4.13Å; E40-V42 PolarHBondContact O-N 3.38Å; V42-E44 PolarHBondContact O-N 3.38Å | ||
| 43 | I | 40.1 | Very low | 37.9 | Very low | 157 Ų | 157 | 147.6 Ų | 147.6 | 81% | 0.805 | 80% | 0.797 | S | S | * | * | trans | -62 | 112.9 | 173.2 | -67.1 | 172.2 | 0 | 0 | 0 | 109.7 | D41 | D41-I43 PolarHBondContact O-N 3.41Š| ||
| 44 | E | 35.1 | Very low | 37.4 | Very low | 192 Ų | 192 | 151.6 Ų | 151.6 | 90% | 0.897 | 81% | 0.808 | S | S | * | * | trans | -60.3 | 128.3 | 165.3 | -175.6 | 174 | -169 | 0 | 0 | 111.2 | V42 | V42-E44 PolarHBondContact O-N 3.38Š| ||
| 45 | G | 29 | Very low | 37.2 | Very low | 66 Ų | 66 | 153.2 Ų | 153.2 | 68% | 0.68 | 81% | 0.807 | S | S | * | * | trans | 166.6 | 111.8 | 167.2 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 46 | K | 32.3 | Very low | 37 | Very low | 200 Ų | 200 | 153.9 Ų | 153.9 | 87% | 0.87 | 80% | 0.803 | S | S | * | * | trans | 120.9 | 79.2 | 145.2 | -66.2 | 173.9 | 178 | 174.7 | 0 | 116.5 | ||||
| 47 | T | 32.8 | Very low | 36.6 | Very low | 128 Ų | 128 | 160.3 Ų | 160.3 | 79% | 0.785 | 81% | 0.81 | S | S | * | * | 27.9 | 99.2 | 118.1 | 53.4 | 0 | 0 | 0 | 0 | 117.6 | |||||
| 48 | A | 36.8 | Very low | 36.5 | Very low | 98 Ų | 98 | 162 Ų | 162 | 81% | 0.81 | 81% | 0.81 | S | S | * | * | trans | -102.4 | 108 | 156.4 | 0 | 0 | 0 | 0 | 0 | 109 | I50 | A48-I50 PolarHBondContact O-N 2.94Š| ||
| 49 | V | 36.8 | Very low | 36.4 | Very low | 131 Ų | 131 | 162.6 Ų | 162.6 | 79% | 0.794 | 81% | 0.814 | S | S | * | * | trans | -74.6 | 114.6 | -178.4 | 172.2 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 50 | I | 38.9 | Very low | 36.4 | Very low | 169 Ų | 169 | 158.2 Ų | 158.2 | 87% | 0.867 | 81% | 0.81 | S | S | * | * | trans | -85.4 | 114.1 | 169.5 | -68.9 | 171.9 | 0 | 0 | 0 | 108.4 | A48 | A48-I50 PolarHBondContact O-N 2.94Š| ||
| 51 | E | 35.4 | Very low | 36.4 | Very low | 140 Ų | 140 | 154 Ų | 154 | 65% | 0.654 | 81% | 0.81 | S | S | * | * | trans | -96.8 | 108.3 | -179.3 | -168.5 | 163.8 | -153.4 | 0 | 0 | 112.4 | ||||
| 52 | K | 38.8 | Very low | 36.9 | Very low | 168 Ų | 168 | 152.1 Ų | 152.1 | 73% | 0.73 | 80% | 0.803 | S | S | * | * | trans | 47.1 | 107.1 | 139 | -56.9 | 170.8 | -165.9 | 146.8 | 0 | 119 | ||||
| 53 | R | 36.7 | Very low | 37.3 | Very low | 243 Ų | 243 | 151.5 Ų | 151.5 | 92% | 0.917 | 80% | 0.8 | S | S | * | * | trans | -155.6 | 132.6 | 135.8 | -123.8 | 178.8 | -177.5 | -145.5 | 1.9 | 114.2 | ||||
| 54 | R | 37.4 | Very low | 38 | Very low | 240 Ų | 240 | 153.5 Ų | 153.5 | 91% | 0.906 | 81% | 0.806 | S | S | * | * | trans | 94.4 | 109.3 | 166.5 | -69 | -172.3 | 167.8 | 169.9 | -2.3 | 118 | ||||
| 55 | K | 36.2 | Very low | 39.3 | Very low | 189 Ų | 189 | 150.5 Ų | 150.5 | 82% | 0.822 | 80% | 0.796 | S | S | * | * | trans | -105 | 138.2 | 179.3 | -159.9 | 169.9 | -171.2 | 174.3 | 0 | 108.1 | ||||
| 56 | K | 37.1 | Very low | 40.9 | Very low | 190 Ų | 190 | 152.9 Ų | 152.9 | 83% | 0.826 | 79% | 0.791 | S | S | * | * | trans | 68.6 | 92 | 157.7 | -76.2 | 173.5 | 175.4 | -170.4 | 0 | 118.3 | ||||
| 57 | R | 33.5 | Very low | 43.1 | Very low | 249 Ų | 249 | 145.7 Ų | 145.7 | 94% | 0.94 | 77% | 0.773 | S | S | * | * | -117.3 | 117.5 | 122.9 | -152.5 | 171.2 | -165.2 | 147.1 | 1.5 | 107.2 | S59 | R57-S59 PolarHBondContact O-N 3.38Š| |||
| 58 | S | 34 | Very low | 45.5 | Very low | 111 Ų | 111 | 141 Ų | 141 | 78% | 0.776 | 75% | 0.75 | S | S | * | * | trans | -57.3 | 107.1 | 177.1 | 39.8 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 59 | S | 39 | Very low | 47.7 | Very low | 112 Ų | 112 | 141.2 Ų | 141.2 | 78% | 0.783 | 74% | 0.735 | S | S | * | * | trans | -120.2 | 71.6 | 146.1 | 178.1 | 0 | 0 | 0 | 0 | 105.9 | R57 | R57-S59 PolarHBondContact O-N 3.38Š| ||
| 60 | A | 37.5 | Very low | 50 | Low | 99 Ų | 99 | 138.9 Ų | 138.9 | 82% | 0.818 | 72% | 0.72 | S | S | * | * | trans | -70.8 | 127.6 | 166 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 61 | G | 38.9 | Very low | 52.3 | Low | 71 Ų | 71 | 136.1 Ų | 136.1 | 73% | 0.732 | 70% | 0.704 | S | S | * | * | S | Bend | trans | 143.9 | 11.5 | 165.5 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||
| 62 | V | 48.5 | Very low | 54.8 | Low | 121 Ų | 121 | 134.6 Ų | 134.6 | 73% | 0.733 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -146 | -7.2 | 163.1 | -165.6 | 0 | 0 | 0 | 0 | 113.3 | ||
| 63 | V | 48.7 | Very low | 57.1 | Low | 107 Ų | 107 | 132.1 Ų | 132.1 | 65% | 0.648 | 69% | 0.693 | S | S | * | * | H | α-helix | trans | -91.9 | -9.1 | -167.9 | -170.8 | 0 | 0 | 0 | 0 | 113.9 | D65 | V63-D65 VanDerWaalsContact C-N 3.34Å; V63-D65 PolarHBondContact O-N 3.47Å |
| 64 | E | 54.7 | Low | 59.6 | Low | 200 Ų | 200 | 126.1 Ų | 126.1 | 94% | 0.935 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -75.5 | -20.2 | 179.6 | -75.6 | -176.6 | 166 | 0 | 0 | 113.5 | ||
| 65 | D | 62.4 | Low | 62.2 | Low | 128 Ų | 128 | 119.5 Ų | 119.5 | 68% | 0.684 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -91.9 | -24 | -179.8 | -163.8 | 30 | 0 | 0 | 0 | 113.6 | V63 G67 G68 E69 | V63-D65 VanDerWaalsContact C-N 3.34Å; V63-D65 PolarHBondContact O-N 3.47Å; D65-G67 VanDerWaalsContact C-N 3.26Å; D65-G67 PolarHBondContact O-N 2.96Å; D65-G68 PolarHBondContact O-N 3.37Å; D65-E69 PolarHBondContact O-N 2.89Å; D65-E69 VanDerWaalsContact O-N 3.08Å |
| 66 | M | 63.6 | Low | 64.9 | Low | 117 Ų | 117 | 112.1 Ų | 112.1 | 58% | 0.576 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -63 | -31.6 | 177.4 | -78 | -179.8 | 105.3 | 0 | 0 | 112.6 | V70 | M66-V70 WeakPolarHBondContact O-CB 3.46Å; M66-V70 WeakPolarHBondContact O-CG2 3.47Å; M66-V70 PolarHBondContact O-N 2.9Å |
| 67 | G | 77.1 | Confident | 67.5 | Low | 48 Ų | 48 | 106.9 Ų | 106.9 | 50% | 0.495 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -67.3 | -42.1 | 179 | 0 | 0 | 0 | 0 | 0 | 112.9 | D65 Q71 | D65-G67 VanDerWaalsContact C-N 3.26Å; D65-G67 PolarHBondContact O-N 2.96Å; G67-Q71 WeakPolarHBondContact O-CB 3.31Å; G67-Q71 PolarHBondContact O-N 3.18Å |
| 68 | G | 84 | Confident | 70.4 | Confident | 30 Ų | 30 | 96.3 Ų | 96.3 | 31% | 0.309 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -69.1 | -40.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | D65 Q71 N72 | D65-G68 PolarHBondContact O-N 3.37Å; G68-Q71 PolarHBondContact O-N 2.9Å; G68-N72 WeakPolarHBondContact O-CB 3.4Å; G68-N72 VanDerWaalsContact O-CG 3.26Å; G68-N72 PolarHBondContact O-N 3.04Å; G68-N72 PolarHBondContact O-ND2 3.22Å |
| 69 | E | 82.3 | Confident | 73.3 | Confident | 103 Ų | 103 | 94.5 Ų | 94.5 | 48% | 0.481 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -61.9 | -46 | 174.9 | -168.2 | 176.3 | -166.3 | 0 | 0 | 111.8 | D65 Q71 N72 M73 | D65-E69 PolarHBondContact O-N 2.89Å; D65-E69 VanDerWaalsContact O-N 3.08Å; E69-Q71 VanDerWaalsContact C-N 3.34Å; E69-Q71 PolarHBondContact O-N 3.17Å; E69-N72 PolarHBondContact O-N 2.96Å; E69-M73 HydrophobicContact CG-CE 3.95Å; E69-M73 VanDerWaalsContact O-CG 3.32Å; E69-M73 WeakPolarHBondContact O-CG 3.34Å; E69-M73 PolarHBondContact O-N 2.89Å |
| 70 | V | 84.8 | Confident | 76 | Confident | 81 Ų | 81 | 93.9 Ų | 93.9 | 49% | 0.491 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -62.2 | -40.6 | 175.1 | 170.9 | 0 | 0 | 0 | 0 | 111.4 | M66 M73 L74 | M66-V70 WeakPolarHBondContact O-CB 3.46Å; M66-V70 WeakPolarHBondContact O-CG2 3.47Å; M66-V70 PolarHBondContact O-N 2.9Å; V70-M73 PolarHBondContact O-N 2.9Å; V70-L74 HydrophobicContact CG1-CD1 4.07Å; V70-L74 HydrophobicContact CG1-CG 4.44Å; V70-L74 VanDerWaalsContact O-CG 3.29Å; V70-L74 WeakPolarHBondContact O-CG 3.39Å; V70-L74 PolarHBondContact O-N 2.89Å |
| 71 | Q | 87 | Confident | 78.7 | Confident | 112 Ų | 112 | 93.6 Ų | 93.6 | 52% | 0.523 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -63.3 | -46.5 | 176 | -178 | 177.1 | -16.5 | 0 | 0 | 111.6 | G67 G68 E69 M73 L74 E75 | G67-Q71 WeakPolarHBondContact O-CB 3.31Å; G67-Q71 PolarHBondContact O-N 3.18Å; G68-Q71 PolarHBondContact O-N 2.9Å; E69-Q71 VanDerWaalsContact C-N 3.34Å; E69-Q71 PolarHBondContact O-N 3.17Å; Q71-M73 VanDerWaalsContact C-N 3.29Å; Q71-M73 PolarHBondContact O-N 3.31Å; Q71-L74 WeakPolarHBondContact O-CB 3.26Å; Q71-L74 PolarHBondContact O-N 3.22Å; Q71-L74 VanDerWaalsContact O-N 3.14Å; Q71-E75 PolarHBondContact NE2-OE1 3.4Å; Q71-E75 WeakPolarHBondContact O-CG 3.35Å; Q71-E75 PolarHBondContact O-N 3.1Å |
| 72 | N | 88.6 | Confident | 81.5 | Confident | 108 Ų | 108 | 94.8 Ų | 94.8 | 58% | 0.578 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -61.5 | -39 | 177.1 | -71.3 | -23.7 | 0 | 0 | 0 | 111.4 | G68 E69 E75 G76 | G68-N72 WeakPolarHBondContact O-CB 3.4Å; G68-N72 VanDerWaalsContact O-CG 3.26Å; G68-N72 PolarHBondContact O-N 3.04Å; G68-N72 PolarHBondContact O-ND2 3.22Å; E69-N72 PolarHBondContact O-N 2.96Å; N72-E75 PolarHBondContact O-N 3.37Å; N72-G76 PolarHBondContact O-N 3.43Å |
| 73 | M | 86.6 | Confident | 83.8 | Confident | 116 Ų | 116 | 95 Ų | 95 | 57% | 0.571 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -62.8 | -44.3 | 173.5 | -73.4 | -178 | -179.7 | 0 | 0 | 111.5 | E69 V70 Q71 G76 V77 | E69-M73 HydrophobicContact CG-CE 3.95Å; E69-M73 VanDerWaalsContact O-CG 3.32Å; E69-M73 WeakPolarHBondContact O-CG 3.34Å; E69-M73 PolarHBondContact O-N 2.89Å; V70-M73 PolarHBondContact O-N 2.9Å; Q71-M73 VanDerWaalsContact C-N 3.29Å; Q71-M73 PolarHBondContact O-N 3.31Å; M73-G76 PolarHBondContact O-N 3.06Å; M73-V77 WeakPolarHBondContact O-CB 3.45Å; M73-V77 VanDerWaalsContact O-CG2 3.26Å; M73-V77 WeakPolarHBondContact O-CG2 3.4Å; M73-V77 PolarHBondContact O-N 3.49Å |
| 74 | L | 90.7 | Very high | 86.1 | Confident | 117 Ų | 117 | 92.3 Ų | 92.3 | 61% | 0.613 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -64.3 | -40.3 | 176.6 | -72.9 | 170.5 | 0 | 0 | 0 | 112.3 | V70 Q71 V77 G78 | V70-L74 HydrophobicContact CG1-CD1 4.07Å; V70-L74 HydrophobicContact CG1-CG 4.44Å; V70-L74 VanDerWaalsContact O-CG 3.29Å; V70-L74 WeakPolarHBondContact O-CG 3.39Å; V70-L74 PolarHBondContact O-N 2.89Å; Q71-L74 WeakPolarHBondContact O-CB 3.26Å; Q71-L74 PolarHBondContact O-N 3.22Å; Q71-L74 VanDerWaalsContact O-N 3.14Å; L74-V77 PolarHBondContact O-N 3.18Å; L74-G78 PolarHBondContact O-N 3Å |
| 75 | E | 91.5 | Very high | 88.1 | Confident | 101 Ų | 101 | 87.5 Ų | 87.5 | 47% | 0.472 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.7 | -44 | 174.4 | -74.5 | 178.6 | -162.9 | 0 | 0 | 111.2 | Q71 N72 V77 G78 V79 | Q71-E75 PolarHBondContact NE2-OE1 3.4Å; Q71-E75 WeakPolarHBondContact O-CG 3.35Å; Q71-E75 PolarHBondContact O-N 3.1Å; N72-E75 PolarHBondContact O-N 3.37Å; E75-V77 PolarHBondContact O-N 3.02Å; E75-G78 PolarHBondContact O-N 3.21Å; E75-V79 WeakPolarHBondContact O-CG2 3.41Å; E75-V79 PolarHBondContact O-N 2.86Å |
| 76 | G | 92.3 | Very high | 89.7 | Confident | 33 Ų | 33 | 86.7 Ų | 86.7 | 34% | 0.34 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -58.4 | -47.2 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | N72 M73 G78 V79 D80 | N72-G76 PolarHBondContact O-N 3.43Å; M73-G76 PolarHBondContact O-N 3.06Å; G76-G78 VanDerWaalsContact C-N 3.34Å; G76-G78 PolarHBondContact O-N 3.45Å; G76-V79 PolarHBondContact O-N 2.9Å; G76-D80 PolarHBondContact O-N 2.92Å |
| 77 | V | 91.3 | Very high | 91.3 | Very high | 81 Ų | 81 | 83.6 Ų | 83.6 | 49% | 0.491 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -59.9 | -43.3 | 174.3 | 169.7 | 0 | 0 | 0 | 0 | 111 | M73 L74 E75 V79 D80 I81 | M73-V77 WeakPolarHBondContact O-CB 3.45Å; M73-V77 VanDerWaalsContact O-CG2 3.26Å; M73-V77 WeakPolarHBondContact O-CG2 3.4Å; M73-V77 PolarHBondContact O-N 3.49Å; L74-V77 PolarHBondContact O-N 3.18Å; E75-V77 PolarHBondContact O-N 3.02Å; V77-V79 PolarHBondContact O-N 3.39Å; V77-D80 PolarHBondContact O-N 3.41Å; V77-I81 HydrophobicContact CG1-CD1 3.67Å; V77-I81 HydrophobicContact CG1-CG1 4.32Å; V77-I81 WeakPolarHBondContact O-CB 3.45Å; V77-I81 VanDerWaalsContact O-CG1 3.22Å; V77-I81 WeakPolarHBondContact O-CG1 3.45Å; V77-I81 PolarHBondContact O-N 3.28Å |
| 78 | G | 95.1 | Very high | 92.3 | Very high | 27 Ų | 27 | 88.2 Ų | 88.2 | 28% | 0.278 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -62.4 | -39.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | L74 E75 G76 N82 | L74-G78 PolarHBondContact O-N 3Å; E75-G78 PolarHBondContact O-N 3.21Å; G76-G78 VanDerWaalsContact C-N 3.34Å; G76-G78 PolarHBondContact O-N 3.45Å; G78-N82 WeakPolarHBondContact O-CB 2.91Å; G78-N82 PolarHBondContact O-N 2.9Å; G78-N82 PolarHBondContact O-ND2 3.43Å |
| 79 | V | 94.8 | Very high | 93 | Very high | 73 Ų | 73 | 94.6 Ų | 94.6 | 44% | 0.442 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.2 | -44.8 | 174.7 | 168.9 | 0 | 0 | 0 | 0 | 111.1 | E75 G76 V77 N82 K83 | E75-V79 WeakPolarHBondContact O-CG2 3.41Å; E75-V79 PolarHBondContact O-N 2.86Å; G76-V79 PolarHBondContact O-N 2.9Å; V77-V79 PolarHBondContact O-N 3.39Å; V79-N82 PolarHBondContact O-N 2.97Å; V79-K83 HydrophobicContact CG1-CD 4.21Å; V79-K83 VanDerWaalsContact CG1-CE 3.48Å; V79-K83 WeakPolarHBondContact O-CG 3.46Å; V79-K83 PolarHBondContact O-N 3.5Å |
| 80 | D | 95.1 | Very high | 93.7 | Very high | 98 Ų | 98 | 96.2 Ų | 96.2 | 52% | 0.524 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -70 | -37.3 | -178.7 | -73.3 | -18.6 | 0 | 0 | 0 | 112.4 | G76 V77 K83 A84 | G76-D80 PolarHBondContact O-N 2.92Å; V77-D80 PolarHBondContact O-N 3.41Å; D80-K83 PolarHBondContact O-N 2.89Å; D80-K83 IonicContact OD1-NZ 3.45Å; D80-K83 PolarHBondContact OD1-NZ 3.41Å; D80-A84 WeakPolarHBondContact O-CB 3.41Å; D80-A84 PolarHBondContact O-N 3.13Å |
| 81 | I | 95.3 | Very high | 94.3 | Very high | 93 Ų | 93 | 99 Ų | 99 | 48% | 0.477 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -58.8 | -48.9 | 169.7 | -70.6 | 168.2 | 0 | 0 | 0 | 110.1 | V77 K83 A84 L85 | V77-I81 HydrophobicContact CG1-CD1 3.67Å; V77-I81 HydrophobicContact CG1-CG1 4.32Å; V77-I81 WeakPolarHBondContact O-CB 3.45Å; V77-I81 VanDerWaalsContact O-CG1 3.22Å; V77-I81 WeakPolarHBondContact O-CG1 3.45Å; V77-I81 PolarHBondContact O-N 3.28Å; I81-K83 PolarHBondContact O-N 3.33Å; I81-A84 PolarHBondContact O-N 3.05Å; I81-L85 HydrophobicContact CG2-CD1 3.9Å; I81-L85 HydrophobicContact CG2-CG 4.26Å; I81-L85 WeakPolarHBondContact O-CB 3.47Å; I81-L85 VanDerWaalsContact O-CG 3.31Å; I81-L85 WeakPolarHBondContact O-CG 3.44Å; I81-L85 PolarHBondContact O-N 2.88Å |
| 82 | N | 96.6 | Very high | 94.8 | Very high | 97 Ų | 97 | 99.1 Ų | 99.1 | 52% | 0.519 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.9 | -42 | 179.1 | -82.8 | -53.5 | 0 | 0 | 0 | 112.5 | G78 V79 L85 L86 | G78-N82 WeakPolarHBondContact O-CB 2.91Å; G78-N82 PolarHBondContact O-N 2.9Å; G78-N82 PolarHBondContact O-ND2 3.43Å; V79-N82 PolarHBondContact O-N 2.97Å; N82-L85 PolarHBondContact O-N 3.39Å; N82-L86 WeakPolarHBondContact O-CB 3.41Å; N82-L86 VanDerWaalsContact O-CG 3.32Å; N82-L86 WeakPolarHBondContact O-CG 3.45Å; N82-L86 PolarHBondContact O-N 3.16Å |
| 83 | K | 96.8 | Very high | 95.3 | Very high | 125 Ų | 125 | 99.4 Ų | 99.4 | 54% | 0.543 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.2 | -45 | 173.9 | -73.1 | 172.3 | -172.5 | 160.5 | 0 | 111.6 | V79 D80 I81 L86 A87 | V79-K83 HydrophobicContact CG1-CD 4.21Å; V79-K83 VanDerWaalsContact CG1-CE 3.48Å; V79-K83 WeakPolarHBondContact O-CG 3.46Å; V79-K83 PolarHBondContact O-N 3.5Å; D80-K83 PolarHBondContact O-N 2.89Å; D80-K83 IonicContact OD1-NZ 3.45Å; D80-K83 PolarHBondContact OD1-NZ 3.41Å; I81-K83 PolarHBondContact O-N 3.33Å; K83-L86 PolarHBondContact O-N 2.93Å; K83-A87 WeakPolarHBondContact O-CB 3.5Å; K83-A87 PolarHBondContact O-N 3.25Å |
| 84 | A | 96.7 | Very high | 95.8 | Very high | 51 Ų | 51 | 99 Ų | 99 | 42% | 0.421 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.7 | -42 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | D80 I81 A87 K88 | D80-A84 WeakPolarHBondContact O-CB 3.41Å; D80-A84 PolarHBondContact O-N 3.13Å; I81-A84 PolarHBondContact O-N 3.05Å; A84-A87 PolarHBondContact O-N 3.43Å; A84-K88 WeakPolarHBondContact O-CB 3.45Å; A84-K88 WeakPolarHBondContact O-CG 3.43Å; A84-K88 PolarHBondContact O-N 3.29Å |
| 85 | L | 97.1 | Very high | 96.1 | Very high | 98 Ų | 98 | 101.2 Ų | 101.2 | 51% | 0.513 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.4 | -44.9 | 175.4 | -73.1 | 176.1 | 0 | 0 | 0 | 111.9 | I81 N82 A87 K88 R89 | I81-L85 HydrophobicContact CG2-CD1 3.9Å; I81-L85 HydrophobicContact CG2-CG 4.26Å; I81-L85 WeakPolarHBondContact O-CB 3.47Å; I81-L85 VanDerWaalsContact O-CG 3.31Å; I81-L85 WeakPolarHBondContact O-CG 3.44Å; I81-L85 PolarHBondContact O-N 2.88Å; N82-L85 PolarHBondContact O-N 3.39Å; L85-A87 PolarHBondContact O-N 2.98Å; L85-K88 PolarHBondContact O-N 3.41Å; L85-R89 WeakPolarHBondContact O-CB 3.38Å; L85-R89 PolarHBondContact O-N 3.05Å |
| 86 | L | 97.2 | Very high | 96.4 | Very high | 112 Ų | 112 | 100.2 Ų | 100.2 | 59% | 0.586 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -62.3 | -42.3 | 175.7 | -73.6 | 172.7 | 0 | 0 | 0 | 111.9 | N82 K83 R89 K90 | N82-L86 WeakPolarHBondContact O-CB 3.41Å; N82-L86 VanDerWaalsContact O-CG 3.32Å; N82-L86 WeakPolarHBondContact O-CG 3.45Å; N82-L86 PolarHBondContact O-N 3.16Å; K83-L86 PolarHBondContact O-N 2.93Å; L86-R89 PolarHBondContact O-N 3.49Å; L86-K90 WeakPolarHBondContact O-CB 3.39Å; L86-K90 PolarHBondContact O-N 2.88Å |
| 87 | A | 97.3 | Very high | 96.7 | Very high | 51 Ų | 51 | 106.5 Ų | 106.5 | 42% | 0.421 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.6 | -42 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | K83 A84 L85 K90 R91 | K83-A87 WeakPolarHBondContact O-CB 3.5Å; K83-A87 PolarHBondContact O-N 3.25Å; A84-A87 PolarHBondContact O-N 3.43Å; L85-A87 PolarHBondContact O-N 2.98Å; A87-K90 PolarHBondContact O-N 2.94Å; A87-R91 WeakPolarHBondContact O-CB 3.44Å; A87-R91 PolarHBondContact O-N 3.11Å |
| 88 | K | 97.8 | Very high | 97 | Very high | 146 Ų | 146 | 105.1 Ų | 105.1 | 64% | 0.635 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -61.5 | -45.5 | 173.9 | -78.3 | -173.1 | 177.5 | -162.6 | 0 | 111.4 | A84 L85 R91 L92 | A84-K88 WeakPolarHBondContact O-CB 3.45Å; A84-K88 WeakPolarHBondContact O-CG 3.43Å; A84-K88 PolarHBondContact O-N 3.29Å; L85-K88 PolarHBondContact O-N 3.41Å; K88-R91 PolarHBondContact O-N 3.04Å; K88-L92 WeakPolarHBondContact O-CB 3.38Å; K88-L92 PolarHBondContact O-N 3.43Å |
| 89 | R | 97.6 | Very high | 97.1 | Very high | 164 Ų | 164 | 107.7 Ų | 107.7 | 62% | 0.619 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -58.6 | -52.2 | 176 | -178.5 | -177.7 | -69.8 | -173.2 | -2 | 111.4 | L85 L86 R91 L92 E93 | L85-R89 WeakPolarHBondContact O-CB 3.38Å; L85-R89 PolarHBondContact O-N 3.05Å; L86-R89 PolarHBondContact O-N 3.49Å; R89-R91 VanDerWaalsContact C-N 3.27Å; R89-R91 PolarHBondContact O-N 3.5Å; R89-L92 PolarHBondContact O-N 2.89Å; R89-L92 VanDerWaalsContact O-N 3.14Å; R89-E93 WeakPolarHBondContact CG-OE1 3.45Å; R89-E93 WeakPolarHBondContact O-CG 3.46Å; R89-E93 PolarHBondContact O-N 3.23Å |
| 90 | K | 97.9 | Very high | 97.2 | Very high | 136 Ų | 136 | 109 Ų | 109 | 59% | 0.591 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -58.1 | -41 | 178.4 | -173.5 | 178.2 | -179.2 | 178.5 | 0 | 111.7 | L86 A87 M94 | L86-K90 WeakPolarHBondContact O-CB 3.39Å; L86-K90 PolarHBondContact O-N 2.88Å; A87-K90 PolarHBondContact O-N 2.94Å; K90-M94 HydrophobicContact CG-CE 4.27Å; K90-M94 VanDerWaalsContact O-CG 3.29Å; K90-M94 WeakPolarHBondContact O-CG 3.32Å; K90-M94 PolarHBondContact O-N 3.44Å |
| 91 | R | 97.7 | Very high | 97.4 | Very high | 141 Ų | 141 | 110.7 Ų | 110.7 | 53% | 0.532 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -64.1 | -45.3 | 176.8 | -172 | -176.8 | -61.5 | 162.9 | 0.4 | 111.8 | A87 K88 R89 M94 Y95 | A87-R91 WeakPolarHBondContact O-CB 3.44Å; A87-R91 PolarHBondContact O-N 3.11Å; K88-R91 PolarHBondContact O-N 3.04Å; R89-R91 VanDerWaalsContact C-N 3.27Å; R89-R91 PolarHBondContact O-N 3.5Å; R91-M94 HydrophobicContact CB-CE 4.48Å; R91-M94 PolarHBondContact O-N 2.97Å; R91-Y95 HydrophobicContact CG-CD2 3.74Å; R91-Y95 HydrophobicContact CG-CE2 3.31Å; R91-Y95 WeakPolarHBondContact O-CD2 3.41Å; R91-Y95 PolarHBondContact O-N 3.38Å |
| 92 | L | 97.7 | Very high | 97.5 | Very high | 113 Ų | 113 | 109.6 Ų | 109.6 | 59% | 0.592 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -61 | -47.2 | 176.6 | -174.9 | 148.7 | 0 | 0 | 0 | 111.2 | K88 R89 M94 Y95 T96 | K88-L92 WeakPolarHBondContact O-CB 3.38Å; K88-L92 PolarHBondContact O-N 3.43Å; R89-L92 PolarHBondContact O-N 2.89Å; R89-L92 VanDerWaalsContact O-N 3.14Å; L92-M94 VanDerWaalsContact C-N 3.33Å; L92-M94 PolarHBondContact O-N 3.32Å; L92-Y95 PolarHBondContact O-N 3.41Å; L92-T96 WeakPolarHBondContact O-CB 3.46Å; L92-T96 PolarHBondContact O-N 3.5Å; L92-T96 PolarHBondContact O-OG1 3.2Å; L92-T96 VanDerWaalsContact O-OG1 3.09Å |
| 93 | E | 97.6 | Very high | 97.6 | Very high | 114 Ų | 114 | 107.6 Ų | 107.6 | 53% | 0.533 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -58.2 | -43.7 | 176.2 | -73 | 171.5 | -169.4 | 0 | 0 | 112.2 | R89 K97 | R89-E93 WeakPolarHBondContact CG-OE1 3.45Å; R89-E93 WeakPolarHBondContact O-CG 3.46Å; R89-E93 PolarHBondContact O-N 3.23Å; E93-K97 VanDerWaalsContact O-CB 3.3Å; E93-K97 WeakPolarHBondContact O-CB 3.32Å; E93-K97 PolarHBondContact O-N 3.18Å |
| 94 | M | 97.6 | Very high | 97.6 | Very high | 109 Ų | 109 | 105.3 Ų | 105.3 | 54% | 0.537 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.2 | -45.9 | 175.9 | -73.3 | -174.8 | -59 | 0 | 0 | 112 | K90 R91 L92 K97 A98 | K90-M94 HydrophobicContact CG-CE 4.27Å; K90-M94 VanDerWaalsContact O-CG 3.29Å; K90-M94 WeakPolarHBondContact O-CG 3.32Å; K90-M94 PolarHBondContact O-N 3.44Å; R91-M94 HydrophobicContact CB-CE 4.48Å; R91-M94 PolarHBondContact O-N 2.97Å; L92-M94 VanDerWaalsContact C-N 3.33Å; L92-M94 PolarHBondContact O-N 3.32Å; M94-K97 PolarHBondContact O-N 3.15Å; M94-A98 WeakPolarHBondContact O-CB 3.38Å; M94-A98 PolarHBondContact O-N 3.01Å |
| 95 | Y | 97.5 | Very high | 97.7 | Very high | 162 Ų | 162 | 107.9 Ų | 107.9 | 64% | 0.635 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -63.9 | -45.5 | 177.6 | -75.7 | -50.8 | 0 | 0 | 0 | 112.1 | R91 L92 K97 A98 S99 | R91-Y95 HydrophobicContact CG-CD2 3.74Å; R91-Y95 HydrophobicContact CG-CE2 3.31Å; R91-Y95 WeakPolarHBondContact O-CD2 3.41Å; R91-Y95 PolarHBondContact O-N 3.38Å; L92-Y95 PolarHBondContact O-N 3.41Å; Y95-K97 VanDerWaalsContact C-N 3.33Å; Y95-K97 PolarHBondContact O-N 3.14Å; Y95-A98 PolarHBondContact O-N 2.86Å; Y95-S99 VanDerWaalsContact O-CB 3.25Å; Y95-S99 WeakPolarHBondContact O-CB 3.33Å; Y95-S99 PolarHBondContact O-N 2.94Å |
| 96 | T | 97.7 | Very high | 97.8 | Very high | 81 Ų | 81 | 110.1 Ų | 110.1 | 50% | 0.497 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -60.5 | -44.3 | 177.2 | -61.7 | 0 | 0 | 0 | 0 | 110.8 | L92 S99 L100 | L92-T96 WeakPolarHBondContact O-CB 3.46Å; L92-T96 PolarHBondContact O-N 3.5Å; L92-T96 PolarHBondContact O-OG1 3.2Å; L92-T96 VanDerWaalsContact O-OG1 3.09Å; T96-S99 PolarHBondContact O-N 2.76Å; T96-L100 VanDerWaalsContact O-CB 3.32Å; T96-L100 WeakPolarHBondContact O-CB 3.49Å; T96-L100 PolarHBondContact O-N 3.15Å |
| 97 | K | 97.8 | Very high | 97.8 | Very high | 164 Ų | 164 | 109.8 Ų | 109.8 | 71% | 0.713 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -63.4 | -43.4 | 177.4 | -174.3 | 176 | -178.7 | 176.2 | 0 | 112.4 | E93 M94 Y95 K101 | E93-K97 VanDerWaalsContact O-CB 3.3Å; E93-K97 WeakPolarHBondContact O-CB 3.32Å; E93-K97 PolarHBondContact O-N 3.18Å; M94-K97 PolarHBondContact O-N 3.15Å; Y95-K97 VanDerWaalsContact C-N 3.33Å; Y95-K97 PolarHBondContact O-N 3.14Å; K97-K101 WeakPolarHBondContact O-CB 3.36Å; K97-K101 PolarHBondContact O-N 2.95Å |
| 98 | A | 97.4 | Very high | 97.9 | Very high | 53 Ų | 53 | 113.7 Ų | 113.7 | 44% | 0.438 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -65.5 | -44.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | M94 Y95 K101 T102 | M94-A98 WeakPolarHBondContact O-CB 3.38Å; M94-A98 PolarHBondContact O-N 3.01Å; Y95-A98 PolarHBondContact O-N 2.86Å; A98-K101 PolarHBondContact O-N 2.91Å; A98-T102 PolarHBondContact O-N 2.98Å; A98-T102 PolarHBondContact O-OG1 3.13Å; A98-T102 VanDerWaalsContact O-OG1 3.11Å |
| 99 | S | 97.6 | Very high | 97.9 | Very high | 81 Ų | 81 | 112.9 Ų | 112.9 | 57% | 0.566 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -60.8 | -47.5 | 177.1 | -174 | 0 | 0 | 0 | 0 | 111.5 | Y95 T96 K101 T102 S103 | Y95-S99 VanDerWaalsContact O-CB 3.25Å; Y95-S99 WeakPolarHBondContact O-CB 3.33Å; Y95-S99 PolarHBondContact O-N 2.94Å; T96-S99 PolarHBondContact O-N 2.76Å; S99-K101 PolarHBondContact O-N 3.5Å; S99-T102 PolarHBondContact O-N 3.47Å; S99-S103 WeakPolarHBondContact O-CB 3.35Å; S99-S103 PolarHBondContact O-N 3.42Å |
| 100 | L | 98 | Very high | 97.9 | Very high | 100 Ų | 100 | 108.6 Ų | 108.6 | 52% | 0.524 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -62.8 | -41.7 | 177.5 | -176 | 62.2 | 0 | 0 | 0 | 112 | T96 S103 N104 | T96-L100 VanDerWaalsContact O-CB 3.32Å; T96-L100 WeakPolarHBondContact O-CB 3.49Å; T96-L100 PolarHBondContact O-N 3.15Å; L100-S103 PolarHBondContact O-N 3.05Å; L100-N104 WeakPolarHBondContact O-CB 3.34Å; L100-N104 VanDerWaalsContact O-CG 3.27Å; L100-N104 PolarHBondContact O-N 3.41Å |
| 101 | K | 98.1 | Very high | 98 | Very high | 134 Ų | 134 | 109.7 Ų | 109.7 | 58% | 0.583 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -60.2 | -49.1 | 175.9 | -176.7 | -178.8 | 177.7 | -175.7 | 0 | 111.3 | K97 A98 S99 S103 N104 Q105 | K97-K101 WeakPolarHBondContact O-CB 3.36Å; K97-K101 PolarHBondContact O-N 2.95Å; A98-K101 PolarHBondContact O-N 2.91Å; S99-K101 PolarHBondContact O-N 3.5Å; K101-S103 VanDerWaalsContact C-N 3.34Å; K101-N104 PolarHBondContact O-N 2.96Å; K101-Q105 VanDerWaalsContact O-CG 3.3Å; K101-Q105 WeakPolarHBondContact O-CG 3.47Å; K101-Q105 PolarHBondContact O-N 3.26Å |
| 102 | T | 98 | Very high | 98 | Very high | 70 Ų | 70 | 109.2 Ų | 109.2 | 43% | 0.429 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -62.6 | -42.1 | 178 | -60.1 | 0 | 0 | 0 | 0 | 111.5 | A98 S99 Q105 K106 | A98-T102 PolarHBondContact O-N 2.98Å; A98-T102 PolarHBondContact O-OG1 3.13Å; A98-T102 VanDerWaalsContact O-OG1 3.11Å; S99-T102 PolarHBondContact O-N 3.47Å; T102-Q105 PolarHBondContact O-N 3.1Å; T102-K106 WeakPolarHBondContact O-CG 3.47Å; T102-K106 PolarHBondContact O-N 3.24Å |
| 103 | S | 98.1 | Very high | 98.1 | Very high | 55 Ų | 55 | 106.3 Ų | 106.3 | 39% | 0.385 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -61.3 | -48.9 | 176.9 | -172.4 | 0 | 0 | 0 | 0 | 111.6 | S99 L100 K101 Q105 K106 I107 | S99-S103 WeakPolarHBondContact O-CB 3.35Å; S99-S103 PolarHBondContact O-N 3.42Å; L100-S103 PolarHBondContact O-N 3.05Å; K101-S103 VanDerWaalsContact C-N 3.34Å; S103-Q105 VanDerWaalsContact C-N 3.33Å; S103-Q105 PolarHBondContact O-N 3.45Å; S103-K106 WeakPolarHBondContact O-CB 3.47Å; S103-K106 PolarHBondContact O-N 2.91Å; S103-K106 VanDerWaalsContact O-N 3.14Å; S103-I107 WeakPolarHBondContact O-CG1 3.49Å; S103-I107 PolarHBondContact O-N 3.41Å |
| 104 | N | 98.3 | Very high | 98.1 | Very high | 77 Ų | 77 | 104.8 Ų | 104.8 | 41% | 0.412 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -59.4 | -43.8 | 177.1 | -73.8 | -7.1 | 0 | 0 | 0 | 111.7 | L100 K101 K106 I107 E108 | L100-N104 WeakPolarHBondContact O-CB 3.34Å; L100-N104 VanDerWaalsContact O-CG 3.27Å; L100-N104 PolarHBondContact O-N 3.41Å; K101-N104 PolarHBondContact O-N 2.96Å; N104-K106 VanDerWaalsContact C-N 3.33Å; N104-K106 PolarHBondContact O-N 2.95Å; N104-I107 PolarHBondContact O-N 3.42Å; N104-E108 WeakPolarHBondContact O-CB 3.44Å; N104-E108 WeakPolarHBondContact O-CG 3.36Å; N104-E108 PolarHBondContact O-N 2.99Å |
| 105 | Q | 98.3 | Very high | 98.1 | Very high | 105 Ų | 105 | 104.1 Ų | 104.1 | 49% | 0.491 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -60.9 | -40.5 | 176.1 | -74.1 | 177.1 | -26.4 | 0 | 0 | 112.5 | K101 T102 S103 H109 | K101-Q105 VanDerWaalsContact O-CG 3.3Å; K101-Q105 WeakPolarHBondContact O-CG 3.47Å; K101-Q105 PolarHBondContact O-N 3.26Å; T102-Q105 PolarHBondContact O-N 3.1Å; S103-Q105 VanDerWaalsContact C-N 3.33Å; S103-Q105 PolarHBondContact O-N 3.45Å; Q105-H109 VanDerWaalsContact O-CB 3.29Å; Q105-H109 WeakPolarHBondContact O-CB 3.46Å; Q105-H109 PolarHBondContact O-N 2.77Å |
| 106 | K | 98.3 | Very high | 98.2 | Very high | 144 Ų | 144 | 100.3 Ų | 100.3 | 63% | 0.626 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -64.1 | -45.2 | 175.5 | -74.5 | -178.5 | 177.6 | -173.9 | 0 | 111.4 | T102 S103 N104 H109 V110 | T102-K106 WeakPolarHBondContact O-CG 3.47Å; T102-K106 PolarHBondContact O-N 3.24Å; S103-K106 WeakPolarHBondContact O-CB 3.47Å; S103-K106 PolarHBondContact O-N 2.91Å; S103-K106 VanDerWaalsContact O-N 3.14Å; N104-K106 VanDerWaalsContact C-N 3.33Å; N104-K106 PolarHBondContact O-N 2.95Å; K106-H109 PolarHBondContact O-N 2.93Å; K106-V110 WeakPolarHBondContact O-CG2 3.41Å; K106-V110 PolarHBondContact O-N 3.16Å |
| 107 | I | 98.2 | Very high | 98.3 | Very high | 106 Ų | 106 | 102.2 Ų | 102.2 | 54% | 0.544 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.1 | -46.6 | 179.1 | -67 | 167 | 0 | 0 | 0 | 110.7 | S103 N104 H109 V110 W111 | S103-I107 WeakPolarHBondContact O-CG1 3.49Å; S103-I107 PolarHBondContact O-N 3.41Å; N104-I107 PolarHBondContact O-N 3.42Å; I107-H109 VanDerWaalsContact C-N 3.33Å; I107-H109 PolarHBondContact O-N 3.32Å; I107-V110 PolarHBondContact O-N 2.97Å; I107-W111 VanDerWaalsContact O-CB 3.3Å; I107-W111 WeakPolarHBondContact O-CB 3.42Å; I107-W111 PolarHBondContact O-N 3.35Å |
| 108 | E | 98.3 | Very high | 98.3 | Very high | 133 Ų | 133 | 100.1 Ų | 100.1 | 62% | 0.621 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -59.8 | -43 | 176.2 | -76 | 176.8 | -175.5 | 0 | 0 | 111.9 | N104 W111 K112 | N104-E108 WeakPolarHBondContact O-CB 3.44Å; N104-E108 WeakPolarHBondContact O-CG 3.36Å; N104-E108 PolarHBondContact O-N 2.99Å; E108-W111 PolarHBondContact O-N 3.14Å; E108-K112 WeakPolarHBondContact O-CB 3.46Å; E108-K112 PolarHBondContact O-N 3.04Å |
| 109 | H | 98.4 | Very high | 98.4 | Very high | 128 Ų | 128 | 102.3 Ų | 102.3 | 59% | 0.593 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.5 | -46.3 | 178.3 | -179 | 64.9 | 0 | 0 | 0 | 112.2 | Q105 K106 I107 K112 T113 | Q105-H109 VanDerWaalsContact O-CB 3.29Å; Q105-H109 WeakPolarHBondContact O-CB 3.46Å; Q105-H109 PolarHBondContact O-N 2.77Å; K106-H109 PolarHBondContact O-N 2.93Å; I107-H109 VanDerWaalsContact C-N 3.33Å; I107-H109 PolarHBondContact O-N 3.32Å; H109-K112 PolarHBondContact O-N 3.24Å; H109-T113 WeakPolarHBondContact O-CB 3.44Å; H109-T113 PolarHBondContact O-N 3.19Å; H109-T113 PolarHBondContact O-OG1 3.48Å |
| 110 | V | 98.5 | Very high | 98.4 | Very high | 75 Ų | 75 | 105.4 Ų | 105.4 | 46% | 0.455 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.1 | -46.5 | 176.1 | 171.1 | 0 | 0 | 0 | 0 | 110.5 | K106 I107 K112 T113 Q114 | K106-V110 WeakPolarHBondContact O-CG2 3.41Å; K106-V110 PolarHBondContact O-N 3.16Å; I107-V110 PolarHBondContact O-N 2.97Å; V110-K112 PolarHBondContact O-N 2.74Å; V110-T113 PolarHBondContact O-N 3Å; V110-Q114 HydrophobicContact CG1-CG 4.4Å; V110-Q114 WeakPolarHBondContact O-CB 3.4Å; V110-Q114 WeakPolarHBondContact O-CG 3.46Å; V110-Q114 PolarHBondContact O-N 3.33Å |
| 111 | W | 98.3 | Very high | 98.4 | Very high | 158 Ų | 158 | 105.1 Ų | 105.1 | 60% | 0.598 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -57.7 | -50.3 | 178.6 | 179.4 | -91.7 | 0 | 0 | 0 | 112 | I107 E108 T113 Q114 Q115 | I107-W111 VanDerWaalsContact O-CB 3.3Å; I107-W111 WeakPolarHBondContact O-CB 3.42Å; I107-W111 PolarHBondContact O-N 3.35Å; E108-W111 PolarHBondContact O-N 3.14Å; W111-T113 PolarHBondContact O-N 2.96Å; W111-Q114 PolarHBondContact O-N 3.5Å; W111-Q115 WeakPolarHBondContact O-CB 3.37Å; W111-Q115 PolarHBondContact O-N 3.2Å |
| 112 | K | 98.5 | Very high | 98.5 | Very high | 131 Ų | 131 | 103.8 Ų | 103.8 | 57% | 0.57 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -61.1 | -46.3 | 178.8 | -176 | 176.3 | -179.6 | 178.6 | 0 | 111.5 | E108 H109 V110 Q114 Q115 D116 | E108-K112 WeakPolarHBondContact O-CB 3.46Å; E108-K112 PolarHBondContact O-N 3.04Å; H109-K112 PolarHBondContact O-N 3.24Å; V110-K112 PolarHBondContact O-N 2.74Å; K112-Q114 VanDerWaalsContact C-N 3.33Å; K112-Q114 PolarHBondContact O-N 3.39Å; K112-Q115 PolarHBondContact O-N 3.23Å; K112-D116 WeakPolarHBondContact O-CB 3.42Å; K112-D116 VanDerWaalsContact O-CG 3.28Å; K112-D116 PolarHBondContact O-N 3.03Å |
| 113 | T | 98.5 | Very high | 98.5 | Very high | 52 Ų | 52 | 105.9 Ų | 105.9 | 32% | 0.319 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.3 | -45.1 | 178.6 | -58.5 | 0 | 0 | 0 | 0 | 111.3 | H109 V110 W111 D116 Q117 | H109-T113 WeakPolarHBondContact O-CB 3.44Å; H109-T113 PolarHBondContact O-N 3.19Å; H109-T113 PolarHBondContact O-OG1 3.48Å; V110-T113 PolarHBondContact O-N 3Å; W111-T113 PolarHBondContact O-N 2.96Å; T113-D116 PolarHBondContact O-N 3.01Å; T113-Q117 WeakPolarHBondContact O-CB 3.48Å; T113-Q117 VanDerWaalsContact O-CG 3.23Å; T113-Q117 WeakPolarHBondContact O-CG 3.42Å; T113-Q117 PolarHBondContact O-N 3.32Å |
| 114 | Q | 98.7 | Very high | 98.5 | Very high | 83 Ų | 83 | 108 Ų | 108 | 39% | 0.388 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -66.3 | -38.9 | 176.8 | -72.8 | -174.6 | 2.4 | 0 | 0 | 112.7 | V110 W111 K112 Q117 R118 | V110-Q114 HydrophobicContact CG1-CG 4.4Å; V110-Q114 WeakPolarHBondContact O-CB 3.4Å; V110-Q114 WeakPolarHBondContact O-CG 3.46Å; V110-Q114 PolarHBondContact O-N 3.33Å; W111-Q114 PolarHBondContact O-N 3.5Å; K112-Q114 VanDerWaalsContact C-N 3.33Å; K112-Q114 PolarHBondContact O-N 3.39Å; Q114-Q117 PolarHBondContact O-N 2.93Å; Q114-R118 WeakPolarHBondContact O-CB 3.36Å; Q114-R118 WeakPolarHBondContact O-CG 3.36Å; Q114-R118 PolarHBondContact O-N 3.34Å |
| 115 | Q | 98.5 | Very high | 98.5 | Very high | 95 Ų | 95 | 109.2 Ų | 109.2 | 44% | 0.444 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.8 | -47.9 | 176.1 | -179.5 | 174.4 | -0.6 | 0 | 0 | 111 | W111 K112 Q117 R118 Q119 | W111-Q115 WeakPolarHBondContact O-CB 3.37Å; W111-Q115 PolarHBondContact O-N 3.2Å; K112-Q115 PolarHBondContact O-N 3.23Å; Q115-Q117 VanDerWaalsContact C-N 3.34Å; Q115-Q117 PolarHBondContact O-N 2.98Å; Q115-R118 PolarHBondContact O-N 3.39Å; Q115-Q119 WeakPolarHBondContact O-CB 3.49Å; Q115-Q119 PolarHBondContact O-N 3.32Å |
| 116 | D | 98.7 | Very high | 98.5 | Very high | 82 Ų | 82 | 107.8 Ų | 107.8 | 44% | 0.439 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.1 | -42 | 178.8 | -68.5 | -16.4 | 0 | 0 | 0 | 111.1 | K112 T113 Q119 K120 | K112-D116 WeakPolarHBondContact O-CB 3.42Å; K112-D116 VanDerWaalsContact O-CG 3.28Å; K112-D116 PolarHBondContact O-N 3.03Å; T113-D116 PolarHBondContact O-N 3.01Å; D116-Q119 PolarHBondContact O-N 2.94Å; D116-K120 WeakPolarHBondContact O-CB 3.42Å; D116-K120 PolarHBondContact O-N 3.29Å |
| 117 | Q | 98.7 | Very high | 98.6 | Very high | 121 Ų | 121 | 106 Ų | 106 | 57% | 0.565 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -62.6 | -47.2 | 175.8 | -75.2 | 173.4 | -11.1 | 0 | 0 | 112.4 | T113 Q114 Q115 Q119 K120 L121 | T113-Q117 WeakPolarHBondContact O-CB 3.48Å; T113-Q117 VanDerWaalsContact O-CG 3.23Å; T113-Q117 WeakPolarHBondContact O-CG 3.42Å; T113-Q117 PolarHBondContact O-N 3.32Å; Q114-Q117 PolarHBondContact O-N 2.93Å; Q115-Q117 VanDerWaalsContact C-N 3.34Å; Q115-Q117 PolarHBondContact O-N 2.98Å; Q117-Q119 VanDerWaalsContact C-N 3.31Å; Q117-Q119 PolarHBondContact O-N 3.49Å; Q117-K120 PolarHBondContact O-N 3.37Å; Q117-L121 WeakPolarHBondContact O-CB 3.47Å; Q117-L121 PolarHBondContact O-N 3.42Å |
| 118 | R | 98.7 | Very high | 98.6 | Very high | 119 Ų | 119 | 105.3 Ų | 105.3 | 45% | 0.449 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.3 | -39.4 | 176.6 | -76.7 | -172 | -66.4 | -97.4 | -0.3 | 111.7 | Q114 Q115 N122 | Q114-R118 WeakPolarHBondContact O-CB 3.36Å; Q114-R118 WeakPolarHBondContact O-CG 3.36Å; Q114-R118 PolarHBondContact O-N 3.34Å; Q115-R118 PolarHBondContact O-N 3.39Å; R118-N122 WeakPolarHBondContact O-CB 3.46Å; R118-N122 PolarHBondContact O-N 3.44Å; R118-N122 PolarHBondContact O-ND2 2.93Å |
| 119 | Q | 98.7 | Very high | 98.6 | Very high | 99 Ų | 99 | 104.4 Ų | 104.4 | 46% | 0.463 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.6 | -46.5 | 177.5 | -178.2 | 175.2 | -11.9 | 0 | 0 | 111.2 | Q115 D116 Q117 L121 N122 Q123 | Q115-Q119 WeakPolarHBondContact O-CB 3.49Å; Q115-Q119 PolarHBondContact O-N 3.32Å; D116-Q119 PolarHBondContact O-N 2.94Å; Q117-Q119 VanDerWaalsContact C-N 3.31Å; Q117-Q119 PolarHBondContact O-N 3.49Å; Q119-L121 VanDerWaalsContact C-N 3.33Å; Q119-L121 PolarHBondContact O-N 3.26Å; Q119-N122 PolarHBondContact O-N 2.95Å; Q119-Q123 HydrophobicContact CG-CG 4.49Å; Q119-Q123 WeakPolarHBondContact O-CG 3.31Å; Q119-Q123 PolarHBondContact O-N 3.43Å |
| 120 | K | 98.6 | Very high | 98.6 | Very high | 146 Ų | 146 | 102.2 Ų | 102.2 | 64% | 0.635 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -58.1 | -46.3 | 177.3 | -174.5 | -179.2 | 178.3 | -177 | 0 | 111.6 | D116 Q117 Q123 E124 | D116-K120 WeakPolarHBondContact O-CB 3.42Å; D116-K120 PolarHBondContact O-N 3.29Å; Q117-K120 PolarHBondContact O-N 3.37Å; K120-Q123 PolarHBondContact O-N 3.31Å; K120-E124 WeakPolarHBondContact O-CB 3.41Å; K120-E124 PolarHBondContact O-N 2.96Å |
| 121 | L | 98.6 | Very high | 98.6 | Very high | 95 Ų | 95 | 102 Ų | 102 | 50% | 0.497 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61.1 | -46.7 | 178.1 | -170.9 | 67.7 | 0 | 0 | 0 | 111.6 | Q117 Q119 Q123 E124 Y125 | Q117-L121 WeakPolarHBondContact O-CB 3.47Å; Q117-L121 PolarHBondContact O-N 3.42Å; Q119-L121 VanDerWaalsContact C-N 3.33Å; Q119-L121 PolarHBondContact O-N 3.26Å; L121-Q123 VanDerWaalsContact C-N 3.34Å; L121-Q123 PolarHBondContact O-N 2.98Å; L121-E124 PolarHBondContact O-N 3.46Å; L121-Y125 HydrophobicContact CD1-CD2 3.9Å; L121-Y125 HydrophobicContact CD1-CE2 3.62Å; L121-Y125 HydrophobicContact CG-CD2 4.09Å; L121-Y125 HydrophobicContact CG-CE2 4.2Å; L121-Y125 WeakPolarHBondContact O-CD2 3.37Å; L121-Y125 PolarHBondContact O-N 2.9Å |
| 122 | N | 98.7 | Very high | 98.6 | Very high | 106 Ų | 106 | 99.3 Ų | 99.3 | 57% | 0.567 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -60.6 | -42.8 | 177.1 | -85.5 | -65.6 | 0 | 0 | 0 | 112 | R118 Q119 S126 | R118-N122 WeakPolarHBondContact O-CB 3.46Å; R118-N122 PolarHBondContact O-N 3.44Å; R118-N122 PolarHBondContact O-ND2 2.93Å; Q119-N122 PolarHBondContact O-N 2.95Å; N122-S126 WeakPolarHBondContact O-CB 3.31Å; N122-S126 PolarHBondContact O-N 3.36Å; N122-S126 PolarHBondContact O-OG 3.28Å |
| 123 | Q | 98.7 | Very high | 98.7 | Very high | 114 Ų | 114 | 98.7 Ų | 98.7 | 53% | 0.533 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -63 | -44.5 | 177.5 | -73.7 | 175 | -9.8 | 0 | 0 | 111.8 | Q119 K120 L121 S126 Q127 | Q119-Q123 HydrophobicContact CG-CG 4.49Å; Q119-Q123 WeakPolarHBondContact O-CG 3.31Å; Q119-Q123 PolarHBondContact O-N 3.43Å; K120-Q123 PolarHBondContact O-N 3.31Å; L121-Q123 VanDerWaalsContact C-N 3.34Å; L121-Q123 PolarHBondContact O-N 2.98Å; Q123-S126 PolarHBondContact O-N 3.38Å; Q123-Q127 WeakPolarHBondContact O-CB 3.42Å; Q123-Q127 PolarHBondContact O-N 2.99Å |
| 124 | E | 98.6 | Very high | 98.7 | Very high | 100 Ų | 100 | 101.3 Ų | 101.3 | 47% | 0.467 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -59.6 | -50.7 | 178.7 | -175.5 | 178.7 | 166.6 | 0 | 0 | 111.5 | K120 L121 Q127 Q128 | K120-E124 WeakPolarHBondContact O-CB 3.41Å; K120-E124 PolarHBondContact O-N 2.96Å; L121-E124 PolarHBondContact O-N 3.46Å; E124-Q127 PolarHBondContact O-N 3.43Å; E124-Q128 WeakPolarHBondContact O-CG 3.46Å; E124-Q128 PolarHBondContact O-N 3.39Å |
| 125 | Y | 98.6 | Very high | 98.7 | Very high | 102 Ų | 102 | 102.5 Ų | 102.5 | 40% | 0.4 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -68.3 | -38.7 | 178.6 | -83.9 | -79.2 | 0 | 0 | 0 | 112.6 | L121 Q127 Q128 F129 | L121-Y125 HydrophobicContact CD1-CD2 3.9Å; L121-Y125 HydrophobicContact CD1-CE2 3.62Å; L121-Y125 HydrophobicContact CG-CD2 4.09Å; L121-Y125 HydrophobicContact CG-CE2 4.2Å; L121-Y125 WeakPolarHBondContact O-CD2 3.37Å; L121-Y125 PolarHBondContact O-N 2.9Å; Y125-Q127 VanDerWaalsContact C-N 3.26Å; Y125-Q127 PolarHBondContact O-N 3.2Å; Y125-Q128 PolarHBondContact O-N 3.29Å; Y125-F129 HydrophobicContact CD1-CE2 4.28Å; Y125-F129 WeakPolarHBondContact O-CD2 3.36Å; Y125-F129 PolarHBondContact O-N 3.49Å |
| 126 | S | 98.7 | Very high | 98.7 | Very high | 74 Ų | 74 | 105.7 Ų | 105.7 | 52% | 0.517 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -58.7 | -41.9 | 175.5 | -61.6 | 0 | 0 | 0 | 0 | 111.2 | N122 Q123 L130 | N122-S126 WeakPolarHBondContact O-CB 3.31Å; N122-S126 PolarHBondContact O-N 3.36Å; N122-S126 PolarHBondContact O-OG 3.28Å; Q123-S126 PolarHBondContact O-N 3.38Å; S126-L130 WeakPolarHBondContact O-CB 3.31Å; S126-L130 PolarHBondContact O-N 2.95Å |
| 127 | Q | 98.7 | Very high | 98.7 | Very high | 108 Ų | 108 | 106.1 Ų | 106.1 | 51% | 0.505 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67 | -42.4 | 176.6 | -174.5 | 59.9 | 59.1 | 0 | 0 | 112 | Q123 E124 Y125 L130 T131 | Q123-Q127 WeakPolarHBondContact O-CB 3.42Å; Q123-Q127 PolarHBondContact O-N 2.99Å; E124-Q127 PolarHBondContact O-N 3.43Å; Y125-Q127 VanDerWaalsContact C-N 3.26Å; Y125-Q127 PolarHBondContact O-N 3.2Å; Q127-L130 PolarHBondContact O-N 3.05Å; Q127-T131 PolarHBondContact O-N 2.97Å; Q127-T131 PolarHBondContact O-OG1 2.89Å; Q127-T131 VanDerWaalsContact O-OG1 3.07Å |
| 128 | Q | 98.7 | Very high | 98.7 | Very high | 90 Ų | 90 | 104.7 Ų | 104.7 | 42% | 0.421 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.8 | -46.4 | 176.6 | -72 | -177.1 | 45.1 | 0 | 0 | 111.6 | E124 Y125 L130 T131 L132 | E124-Q128 WeakPolarHBondContact O-CG 3.46Å; E124-Q128 PolarHBondContact O-N 3.39Å; Y125-Q128 PolarHBondContact O-N 3.29Å; Q128-L130 PolarHBondContact O-N 3.48Å; Q128-T131 PolarHBondContact O-N 3.48Å; Q128-L132 WeakPolarHBondContact O-CG 3.42Å; Q128-L132 PolarHBondContact O-N 3.29Å |
| 129 | F | 98.7 | Very high | 98.7 | Very high | 114 Ų | 114 | 102.5 Ų | 102.5 | 50% | 0.5 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61 | -44.7 | 175.9 | -79.1 | -61.3 | 0 | 0 | 0 | 111.7 | Y125 T131 L132 F133 | Y125-F129 HydrophobicContact CD1-CE2 4.28Å; Y125-F129 WeakPolarHBondContact O-CD2 3.36Å; Y125-F129 PolarHBondContact O-N 3.49Å; F129-T131 VanDerWaalsContact C-N 3.35Å; F129-T131 PolarHBondContact O-N 3.41Å; F129-L132 PolarHBondContact O-N 3.01Å; F129-F133 HydrophobicContact CB-CD2 4.27Å; F129-F133 HydrophobicContact CB-CE2 3.99Å; F129-F133 HydrophobicContact CD1-CE2 4.41Å; F129-F133 WeakPolarHBondContact O-CD2 3.41Å; F129-F133 WeakPolarHBondContact O-CG 3.42Å; F129-F133 PolarHBondContact O-N 2.97Å |
| 130 | L | 98.7 | Very high | 98.7 | Very high | 83 Ų | 83 | 101.9 Ų | 101.9 | 44% | 0.435 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -57.7 | -47.9 | 177.8 | -179.9 | 62.5 | 0 | 0 | 0 | 111.6 | S126 Q127 Q128 L132 F133 Q134 | S126-L130 WeakPolarHBondContact O-CB 3.31Å; S126-L130 PolarHBondContact O-N 2.95Å; Q127-L130 PolarHBondContact O-N 3.05Å; Q128-L130 PolarHBondContact O-N 3.48Å; L130-L132 VanDerWaalsContact C-N 3.33Å; L130-L132 PolarHBondContact O-N 3.44Å; L130-F133 PolarHBondContact O-N 3.32Å; L130-Q134 WeakPolarHBondContact O-CG 3.45Å; L130-Q134 PolarHBondContact O-N 3.15Å |
| 131 | T | 98.7 | Very high | 98.7 | Very high | 69 Ų | 69 | 99.1 Ų | 99.1 | 42% | 0.423 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -61 | -42.7 | 177.6 | -58.7 | 0 | 0 | 0 | 0 | 111.6 | Q127 Q128 F129 Q134 Q135 | Q127-T131 PolarHBondContact O-N 2.97Å; Q127-T131 PolarHBondContact O-OG1 2.89Å; Q127-T131 VanDerWaalsContact O-OG1 3.07Å; Q128-T131 PolarHBondContact O-N 3.48Å; F129-T131 VanDerWaalsContact C-N 3.35Å; F129-T131 PolarHBondContact O-N 3.41Å; T131-Q134 PolarHBondContact O-N 3.12Å; T131-Q135 PolarHBondContact O-N 2.94Å |
| 132 | L | 98.7 | Very high | 98.7 | Very high | 102 Ų | 102 | 99.9 Ų | 99.9 | 53% | 0.534 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64.2 | -41.7 | 177.5 | -73.1 | 173 | 0 | 0 | 0 | 112.1 | Q128 F129 L130 Q135 W136 | Q128-L132 WeakPolarHBondContact O-CG 3.42Å; Q128-L132 PolarHBondContact O-N 3.29Å; F129-L132 PolarHBondContact O-N 3.01Å; L130-L132 VanDerWaalsContact C-N 3.33Å; L130-L132 PolarHBondContact O-N 3.44Å; L132-Q135 PolarHBondContact O-N 2.96Å; L132-W136 WeakPolarHBondContact O-CB 3.49Å; L132-W136 PolarHBondContact O-N 3.5Å |
| 133 | F | 98.7 | Very high | 98.7 | Very high | 118 Ų | 118 | 97.4 Ų | 97.4 | 52% | 0.518 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -65.5 | -40 | 176.9 | -72.3 | -52.8 | 0 | 0 | 0 | 112.1 | F129 L130 W136 D137 | F129-F133 HydrophobicContact CB-CD2 4.27Å; F129-F133 HydrophobicContact CB-CE2 3.99Å; F129-F133 HydrophobicContact CD1-CE2 4.41Å; F129-F133 WeakPolarHBondContact O-CD2 3.41Å; F129-F133 WeakPolarHBondContact O-CG 3.42Å; F129-F133 PolarHBondContact O-N 2.97Å; L130-F133 PolarHBondContact O-N 3.32Å; F133-W136 HydrophobicContact CD1-CE3 4.16Å; F133-W136 HydrophobicContact CE1-CE3 4.39Å; F133-W136 HydrophobicContact CE1-CZ3 4.38Å; F133-W136 PolarHBondContact O-N 3.37Å; F133-D137 WeakPolarHBondContact O-CB 3.32Å; F133-D137 PolarHBondContact O-N 3.05Å |
| 134 | Q | 98.8 | Very high | 98.6 | Very high | 108 Ų | 108 | 97.5 Ų | 97.5 | 51% | 0.505 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -63.1 | -42.5 | 174.6 | -72.8 | 173.2 | -10.4 | 0 | 0 | 111.9 | L130 T131 D137 L138 | L130-Q134 WeakPolarHBondContact O-CG 3.45Å; L130-Q134 PolarHBondContact O-N 3.15Å; T131-Q134 PolarHBondContact O-N 3.12Å; Q134-D137 PolarHBondContact O-N 3.29Å; Q134-L138 WeakPolarHBondContact O-CG 3.38Å; Q134-L138 PolarHBondContact O-N 3.21Å; Q134-L138 VanDerWaalsContact O-N 3.08Å |
| 135 | Q | 98.7 | Very high | 98.6 | Very high | 108 Ų | 108 | 98.6 Ų | 98.6 | 51% | 0.505 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64 | -44 | 176.3 | -176.1 | 179 | -12.1 | 0 | 0 | 111.4 | T131 L132 L138 D139 | T131-Q135 PolarHBondContact O-N 2.94Å; L132-Q135 PolarHBondContact O-N 2.96Å; Q135-L138 PolarHBondContact O-N 3.5Å; Q135-D139 PolarHBondContact O-N 3.42Å |
| 136 | W | 98.8 | Very high | 98.6 | Very high | 161 Ų | 161 | 98.7 Ų | 98.7 | 61% | 0.61 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -62.2 | -43.7 | 177.6 | -176.5 | 9.3 | 0 | 0 | 0 | 111.5 | L132 F133 L138 D139 M140 | L132-W136 WeakPolarHBondContact O-CB 3.49Å; L132-W136 PolarHBondContact O-N 3.5Å; F133-W136 HydrophobicContact CD1-CE3 4.16Å; F133-W136 HydrophobicContact CE1-CE3 4.39Å; F133-W136 HydrophobicContact CE1-CZ3 4.38Å; F133-W136 PolarHBondContact O-N 3.37Å; W136-L138 VanDerWaalsContact C-N 3.33Å; W136-L138 PolarHBondContact O-N 2.86Å; W136-D139 PolarHBondContact O-N 3.47Å; W136-D139 VanDerWaalsContact O-N 3.16Å; W136-M140 PolarHBondContact O-N 2.98Å |
| 137 | D | 98.6 | Very high | 98.6 | Very high | 91 Ų | 91 | 100.8 Ų | 100.8 | 49% | 0.487 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -58.6 | -45.1 | 176.4 | -172.7 | 66 | 0 | 0 | 0 | 111.9 | F133 Q134 D139 M140 Q141 | F133-D137 WeakPolarHBondContact O-CB 3.32Å; F133-D137 PolarHBondContact O-N 3.05Å; Q134-D137 PolarHBondContact O-N 3.29Å; D137-D139 VanDerWaalsContact C-N 3.34Å; D137-D139 PolarHBondContact O-N 2.86Å; D137-M140 WeakPolarHBondContact O-CB 3.48Å; D137-M140 PolarHBondContact O-N 3.4Å; D137-Q141 WeakPolarHBondContact O-CG 3.39Å; D137-Q141 PolarHBondContact O-N 3.43Å; D137-Q141 PolarHBondContact OD2-NE2 3.18Å |
| 138 | L | 98.7 | Very high | 98.6 | Very high | 92 Ų | 92 | 101.5 Ų | 101.5 | 48% | 0.482 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61.9 | -40.2 | 174.8 | -71.3 | 172 | 0 | 0 | 0 | 112.8 | Q134 Q135 W136 M140 K142 | Q134-L138 WeakPolarHBondContact O-CG 3.38Å; Q134-L138 PolarHBondContact O-N 3.21Å; Q134-L138 VanDerWaalsContact O-N 3.08Å; Q135-L138 PolarHBondContact O-N 3.5Å; W136-L138 VanDerWaalsContact C-N 3.33Å; W136-L138 PolarHBondContact O-N 2.86Å; L138-M140 VanDerWaalsContact C-N 3.34Å; L138-K142 WeakPolarHBondContact O-CG 3.43Å; L138-K142 PolarHBondContact O-N 3.01Å; L138-K142 VanDerWaalsContact O-N 3.11Å |
| 139 | D | 98.7 | Very high | 98.6 | Very high | 72 Ų | 72 | 103.2 Ų | 103.2 | 39% | 0.385 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -70.8 | -32.4 | 178.6 | -70.9 | -20.2 | 0 | 0 | 0 | 111.7 | Q135 W136 D137 K142 A143 | Q135-D139 PolarHBondContact O-N 3.42Å; W136-D139 PolarHBondContact O-N 3.47Å; W136-D139 VanDerWaalsContact O-N 3.16Å; D137-D139 VanDerWaalsContact C-N 3.34Å; D137-D139 PolarHBondContact O-N 2.86Å; D139-K142 IonicContact OD1-NZ 3.32Å; D139-K142 PolarHBondContact OD1-NZ 2.92Å; D139-A143 WeakPolarHBondContact O-CB 3.35Å; D139-A143 PolarHBondContact O-N 2.9Å |
| 140 | M | 98.5 | Very high | 98.6 | Very high | 87 Ų | 87 | 103.1 Ų | 103.1 | 43% | 0.429 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.8 | -48.7 | 172.3 | -168.8 | 66.3 | 74.8 | 0 | 0 | 111.2 | W136 D137 L138 K142 A143 E144 | W136-M140 PolarHBondContact O-N 2.98Å; D137-M140 WeakPolarHBondContact O-CB 3.48Å; D137-M140 PolarHBondContact O-N 3.4Å; L138-M140 VanDerWaalsContact C-N 3.34Å; M140-K142 VanDerWaalsContact C-N 3.31Å; M140-K142 PolarHBondContact O-N 3.36Å; M140-A143 WeakPolarHBondContact O-CA 3.4Å; M140-A143 WeakPolarHBondContact O-CB 3.43Å; M140-A143 PolarHBondContact O-N 3.25Å; M140-E144 PolarHBondContact O-N 3.13Å |
| 141 | Q | 98.6 | Very high | 98.6 | Very high | 88 Ų | 88 | 103.3 Ų | 103.3 | 41% | 0.411 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -57.3 | -44 | 177.1 | -70.1 | 174 | 22.1 | 0 | 0 | 111.6 | D137 A143 E144 E145 | D137-Q141 WeakPolarHBondContact O-CG 3.39Å; D137-Q141 PolarHBondContact O-N 3.43Å; D137-Q141 PolarHBondContact OD2-NE2 3.18Å; Q141-A143 VanDerWaalsContact C-N 3.31Å; Q141-A143 PolarHBondContact O-N 3.35Å; Q141-E144 PolarHBondContact O-N 3.34Å; Q141-E145 WeakPolarHBondContact O-CG 3.47Å; Q141-E145 PolarHBondContact O-N 3.45Å |
| 142 | K | 98.5 | Very high | 98.6 | Very high | 110 Ų | 110 | 102.9 Ų | 102.9 | 48% | 0.478 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.4 | -38.1 | 175 | -70.8 | 170.8 | -167.2 | 157.7 | 0 | 112.6 | L138 D139 M140 E145 Q146 | L138-K142 WeakPolarHBondContact O-CG 3.43Å; L138-K142 PolarHBondContact O-N 3.01Å; L138-K142 VanDerWaalsContact O-N 3.11Å; D139-K142 IonicContact OD1-NZ 3.32Å; D139-K142 PolarHBondContact OD1-NZ 2.92Å; M140-K142 VanDerWaalsContact C-N 3.31Å; M140-K142 PolarHBondContact O-N 3.36Å; K142-E145 PolarHBondContact O-N 3.36Å; K142-Q146 WeakPolarHBondContact O-CG 3.34Å; K142-Q146 PolarHBondContact O-N 3.32Å |
| 143 | A | 98.6 | Very high | 98.5 | Very high | 54 Ų | 54 | 103.5 Ų | 103.5 | 45% | 0.446 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.7 | -43.1 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111 | D139 M140 Q141 Q146 E147 | D139-A143 WeakPolarHBondContact O-CB 3.35Å; D139-A143 PolarHBondContact O-N 2.9Å; M140-A143 WeakPolarHBondContact O-CA 3.4Å; M140-A143 WeakPolarHBondContact O-CB 3.43Å; M140-A143 PolarHBondContact O-N 3.25Å; Q141-A143 VanDerWaalsContact C-N 3.31Å; Q141-A143 PolarHBondContact O-N 3.35Å; A143-Q146 PolarHBondContact O-N 3.32Å; A143-E147 PolarHBondContact O-N 3.07Å |
| 144 | E | 98.4 | Very high | 98.5 | Very high | 117 Ų | 117 | 104.1 Ų | 104.1 | 55% | 0.547 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.7 | -43.4 | 174.6 | -69.5 | 178.7 | 175.8 | 0 | 0 | 111.8 | M140 Q141 Q146 E147 E148 | M140-E144 PolarHBondContact O-N 3.13Å; Q141-E144 PolarHBondContact O-N 3.34Å; E144-Q146 VanDerWaalsContact C-N 3.33Å; E144-Q146 PolarHBondContact O-N 2.91Å; E144-E147 WeakPolarHBondContact O-CB 3.41Å; E144-E147 PolarHBondContact O-N 3.23Å; E144-E148 PolarHBondContact O-N 3.4Å |
| 145 | E | 98.5 | Very high | 98.5 | Very high | 123 Ų | 123 | 106.4 Ų | 106.4 | 58% | 0.575 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -60.1 | -41.1 | 174.7 | -72.3 | 176.5 | 179.4 | 0 | 0 | 112.5 | Q141 K142 K149 | Q141-E145 WeakPolarHBondContact O-CG 3.47Å; Q141-E145 PolarHBondContact O-N 3.45Å; K142-E145 PolarHBondContact O-N 3.36Å; E145-K149 PolarHBondContact O-N 2.92Å; E145-K149 VanDerWaalsContact O-N 3.13Å |
| 146 | Q | 98.4 | Very high | 98.5 | Very high | 103 Ų | 103 | 107.1 Ų | 107.1 | 48% | 0.481 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -67.8 | -39.2 | 175.9 | -67.1 | -45.8 | -60.1 | 0 | 0 | 111.8 | K142 A143 E144 K149 I150 | K142-Q146 WeakPolarHBondContact O-CG 3.34Å; K142-Q146 PolarHBondContact O-N 3.32Å; A143-Q146 PolarHBondContact O-N 3.32Å; E144-Q146 VanDerWaalsContact C-N 3.33Å; E144-Q146 PolarHBondContact O-N 2.91Å; Q146-K149 PolarHBondContact O-N 3.2Å; Q146-I150 WeakPolarHBondContact O-CG1 3.39Å; Q146-I150 PolarHBondContact O-N 2.98Å |
| 147 | E | 98.4 | Very high | 98.5 | Very high | 119 Ų | 119 | 104.9 Ų | 104.9 | 56% | 0.556 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -60 | -48.3 | 175.4 | -176.6 | 177.3 | -178.5 | 0 | 0 | 111 | A143 E144 K149 I150 L151 | A143-E147 PolarHBondContact O-N 3.07Å; E144-E147 WeakPolarHBondContact O-CB 3.41Å; E144-E147 PolarHBondContact O-N 3.23Å; E147-K149 VanDerWaalsContact C-N 3.29Å; E147-K149 PolarHBondContact O-N 2.9Å; E147-I150 PolarHBondContact O-N 3.45Å; E147-I150 VanDerWaalsContact O-N 3.13Å; E147-L151 HydrophobicContact CG-CD1 4.21Å; E147-L151 HydrophobicContact CG-CG 4.48Å; E147-L151 WeakPolarHBondContact O-CG 3.46Å; E147-L151 PolarHBondContact O-N 3.24Å |
| 148 | E | 98.4 | Very high | 98.5 | Very high | 123 Ų | 123 | 105.1 Ų | 105.1 | 58% | 0.575 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -59.7 | -41.4 | 178.4 | -171 | -178.8 | 177.1 | 0 | 0 | 111.6 | E144 I150 L151 N152 | E144-E148 PolarHBondContact O-N 3.4Å; E148-I150 PolarHBondContact O-N 3.05Å; E148-L151 PolarHBondContact O-N 3.13Å; E148-N152 WeakPolarHBondContact O-CB 3.39Å; E148-N152 PolarHBondContact O-N 3.42Å; E148-N152 PolarHBondContact O-ND2 2.95Å |
| 149 | K | 98.3 | Very high | 98.5 | Very high | 125 Ų | 125 | 107.8 Ų | 107.8 | 54% | 0.543 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60 | -44.6 | 175.9 | -174.1 | 178.1 | 178.4 | -178.5 | 0 | 111.9 | E145 Q146 E147 N152 M153 | E145-K149 PolarHBondContact O-N 2.92Å; E145-K149 VanDerWaalsContact O-N 3.13Å; Q146-K149 PolarHBondContact O-N 3.2Å; E147-K149 VanDerWaalsContact C-N 3.29Å; E147-K149 PolarHBondContact O-N 2.9Å; K149-N152 PolarHBondContact O-N 2.98Å; K149-M153 WeakPolarHBondContact O-CG 3.33Å; K149-M153 PolarHBondContact O-N 3.02Å |
| 150 | I | 98.5 | Very high | 98.5 | Very high | 113 Ų | 113 | 109.5 Ų | 109.5 | 58% | 0.579 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63.9 | -45.3 | 177.5 | -68.5 | 166.4 | 0 | 0 | 0 | 110.6 | Q146 E147 E148 N152 M153 F154 | Q146-I150 WeakPolarHBondContact O-CG1 3.39Å; Q146-I150 PolarHBondContact O-N 2.98Å; E147-I150 PolarHBondContact O-N 3.45Å; E147-I150 VanDerWaalsContact O-N 3.13Å; E148-I150 PolarHBondContact O-N 3.05Å; I150-N152 VanDerWaalsContact C-N 3.28Å; I150-N152 PolarHBondContact O-N 3.34Å; I150-M153 PolarHBondContact O-N 3.03Å; I150-F154 PolarHBondContact O-N 2.88Å |
| 151 | L | 98.5 | Very high | 98.5 | Very high | 86 Ų | 86 | 110.5 Ų | 110.5 | 45% | 0.45 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -59.1 | -41.2 | 177.1 | -71.2 | 174.2 | 0 | 0 | 0 | 111.7 | E147 E148 F154 R155 | E147-L151 HydrophobicContact CG-CD1 4.21Å; E147-L151 HydrophobicContact CG-CG 4.48Å; E147-L151 WeakPolarHBondContact O-CG 3.46Å; E147-L151 PolarHBondContact O-N 3.24Å; E148-L151 PolarHBondContact O-N 3.13Å; L151-F154 PolarHBondContact O-N 3.33Å; L151-R155 WeakPolarHBondContact O-CG 3.41Å; L151-R155 PolarHBondContact O-N 3.42Å |
| 152 | N | 98.5 | Very high | 98.5 | Very high | 60 Ų | 60 | 111.4 Ų | 111.4 | 32% | 0.321 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65.2 | -41.7 | 176.3 | -76.2 | -32.2 | 0 | 0 | 0 | 112.3 | E148 K149 I150 F154 R155 Q156 | E148-N152 WeakPolarHBondContact O-CB 3.39Å; E148-N152 PolarHBondContact O-N 3.42Å; E148-N152 PolarHBondContact O-ND2 2.95Å; K149-N152 PolarHBondContact O-N 2.98Å; I150-N152 VanDerWaalsContact C-N 3.28Å; I150-N152 PolarHBondContact O-N 3.34Å; N152-F154 VanDerWaalsContact C-N 3.35Å; N152-F154 PolarHBondContact O-N 3.11Å; N152-R155 PolarHBondContact O-N 3.29Å; N152-Q156 WeakPolarHBondContact O-CG 3.49Å; N152-Q156 PolarHBondContact O-N 3.41Å |
| 153 | M | 98.4 | Very high | 98.5 | Very high | 116 Ų | 116 | 112.5 Ų | 112.5 | 57% | 0.571 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -61.6 | -42.4 | 173.1 | -71 | 178.5 | 65.8 | 0 | 0 | 111.8 | K149 I150 R155 Q156 Q157 | K149-M153 WeakPolarHBondContact O-CG 3.33Å; K149-M153 PolarHBondContact O-N 3.02Å; I150-M153 PolarHBondContact O-N 3.03Å; M153-R155 PolarHBondContact O-N 3.32Å; M153-Q156 PolarHBondContact O-N 2.9Å; M153-Q157 WeakPolarHBondContact O-CB 3.49Å; M153-Q157 PolarHBondContact O-N 3.16Å |
| 154 | F | 98.4 | Very high | 98.4 | Very high | 131 Ų | 131 | 112.3 Ų | 112.3 | 58% | 0.575 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -62.5 | -42.8 | 177.8 | -168.2 | -97.2 | 0 | 0 | 0 | 111.8 | I150 L151 N152 Q156 Q157 Q158 | I150-F154 PolarHBondContact O-N 2.88Å; L151-F154 PolarHBondContact O-N 3.33Å; N152-F154 VanDerWaalsContact C-N 3.35Å; N152-F154 PolarHBondContact O-N 3.11Å; F154-Q156 VanDerWaalsContact C-N 3.33Å; F154-Q156 PolarHBondContact O-N 2.95Å; F154-Q157 PolarHBondContact O-N 3.39Å; F154-Q158 WeakPolarHBondContact O-CB 3.34Å; F154-Q158 PolarHBondContact O-N 3.08Å |
| 155 | R | 98.5 | Very high | 98.5 | Very high | 155 Ų | 155 | 116.1 Ų | 116.1 | 59% | 0.585 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -59.5 | -42.6 | 173.8 | -73.5 | 173.4 | 177.9 | 170.1 | -1.2 | 112 | L151 N152 M153 Q158 K159 | L151-R155 WeakPolarHBondContact O-CG 3.41Å; L151-R155 PolarHBondContact O-N 3.42Å; N152-R155 PolarHBondContact O-N 3.29Å; M153-R155 PolarHBondContact O-N 3.32Å; R155-Q158 PolarHBondContact O-N 3.45Å; R155-K159 WeakPolarHBondContact O-CG 3.35Å; R155-K159 PolarHBondContact O-N 2.97Å; R155-K159 VanDerWaalsContact O-N 3.12Å |
| 156 | Q | 98.6 | Very high | 98.5 | Very high | 124 Ų | 124 | 115.9 Ų | 115.9 | 58% | 0.579 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -65.3 | -45.7 | 176.5 | -70.9 | 179.4 | 5.2 | 0 | 0 | 111.6 | N152 M153 F154 Q158 K159 I160 | N152-Q156 WeakPolarHBondContact O-CG 3.49Å; N152-Q156 PolarHBondContact O-N 3.41Å; M153-Q156 PolarHBondContact O-N 2.9Å; F154-Q156 VanDerWaalsContact C-N 3.33Å; F154-Q156 PolarHBondContact O-N 2.95Å; Q156-Q158 VanDerWaalsContact C-N 3.31Å; Q156-Q158 PolarHBondContact O-N 2.84Å; Q156-K159 WeakPolarHBondContact O-CB 3.42Å; Q156-K159 PolarHBondContact O-N 3Å; Q156-K159 VanDerWaalsContact O-N 3.15Å; Q156-I160 WeakPolarHBondContact O-CG1 3.2Å; Q156-I160 PolarHBondContact O-N 3.21Å |
| 157 | Q | 98.2 | Very high | 98.5 | Very high | 114 Ų | 114 | 114.1 Ų | 114.1 | 53% | 0.533 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -59.4 | -42.6 | 177 | -174 | 176.3 | -4.8 | 0 | 0 | 111.4 | M153 F154 K159 I160 L161 | M153-Q157 WeakPolarHBondContact O-CB 3.49Å; M153-Q157 PolarHBondContact O-N 3.16Å; F154-Q157 PolarHBondContact O-N 3.39Å; Q157-K159 VanDerWaalsContact C-N 3.35Å; Q157-K159 PolarHBondContact O-N 3.45Å; Q157-I160 PolarHBondContact O-N 2.98Å; Q157-L161 HydrophobicContact CG-CD1 4.16Å; Q157-L161 WeakPolarHBondContact O-CB 3.44Å; Q157-L161 WeakPolarHBondContact O-CG 3.33Å; Q157-L161 PolarHBondContact O-N 3.37Å |
| 158 | Q | 98.5 | Very high | 98.5 | Very high | 96 Ų | 96 | 114.3 Ų | 114.3 | 45% | 0.449 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -59.3 | -44.2 | 175.3 | -175.7 | 178.5 | -18.8 | 0 | 0 | 111.8 | F154 R155 Q156 L161 Q162 | F154-Q158 WeakPolarHBondContact O-CB 3.34Å; F154-Q158 PolarHBondContact O-N 3.08Å; R155-Q158 PolarHBondContact O-N 3.45Å; Q156-Q158 VanDerWaalsContact C-N 3.31Å; Q156-Q158 PolarHBondContact O-N 2.84Å; Q158-L161 PolarHBondContact O-N 3.43Å; Q158-Q162 WeakPolarHBondContact O-CB 3.02Å; Q158-Q162 VanDerWaalsContact O-CG 3.31Å; Q158-Q162 WeakPolarHBondContact O-CG 3.42Å; Q158-Q162 PolarHBondContact O-N 3.36Å |
| 159 | K | 98.5 | Very high | 98.5 | Very high | 148 Ų | 148 | 112.3 Ų | 112.3 | 64% | 0.643 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -61 | -46.1 | 176.3 | -72.7 | 177.2 | 179.4 | -177.6 | 0 | 112 | R155 Q156 Q157 L161 Q162 Q163 | R155-K159 WeakPolarHBondContact O-CG 3.35Å; R155-K159 PolarHBondContact O-N 2.97Å; R155-K159 VanDerWaalsContact O-N 3.12Å; Q156-K159 WeakPolarHBondContact O-CB 3.42Å; Q156-K159 PolarHBondContact O-N 3Å; Q156-K159 VanDerWaalsContact O-N 3.15Å; Q157-K159 VanDerWaalsContact C-N 3.35Å; Q157-K159 PolarHBondContact O-N 3.45Å; K159-L161 VanDerWaalsContact C-N 3.35Å; K159-L161 PolarHBondContact O-N 2.91Å; K159-Q162 PolarHBondContact O-N 3.36Å; K159-Q163 PolarHBondContact O-N 3.07Å |
| 160 | I | 98.4 | Very high | 98.5 | Very high | 108 Ų | 108 | 111.1 Ų | 111.1 | 55% | 0.554 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -62 | -44.2 | 179.4 | -67.1 | 166.6 | 0 | 0 | 0 | 110.6 | Q156 Q157 Q163 S164 | Q156-I160 WeakPolarHBondContact O-CG1 3.2Å; Q156-I160 PolarHBondContact O-N 3.21Å; Q157-I160 PolarHBondContact O-N 2.98Å; I160-Q163 PolarHBondContact O-N 3.37Å; I160-S164 WeakPolarHBondContact O-CB 3.08Å; I160-S164 PolarHBondContact O-N 3.01Å |
| 161 | L | 98.6 | Very high | 98.5 | Very high | 108 Ų | 108 | 114 Ų | 114 | 57% | 0.565 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -63.5 | -42.5 | 177.7 | -72.5 | 172.8 | 0 | 0 | 0 | 112.1 | Q157 Q158 K159 S164 R165 | Q157-L161 HydrophobicContact CG-CD1 4.16Å; Q157-L161 WeakPolarHBondContact O-CB 3.44Å; Q157-L161 WeakPolarHBondContact O-CG 3.33Å; Q157-L161 PolarHBondContact O-N 3.37Å; Q158-L161 PolarHBondContact O-N 3.43Å; K159-L161 VanDerWaalsContact C-N 3.35Å; K159-L161 PolarHBondContact O-N 2.91Å; L161-S164 PolarHBondContact O-N 2.95Å; L161-R165 WeakPolarHBondContact O-CB 3.33Å; L161-R165 PolarHBondContact O-N 2.94Å |
| 162 | Q | 98.5 | Very high | 98.5 | Very high | 106 Ų | 106 | 115.7 Ų | 115.7 | 50% | 0.495 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -60.9 | -47.6 | 175.4 | -75.5 | 176.7 | -13.5 | 0 | 0 | 111.6 | Q158 K159 S164 R165 I166 | Q158-Q162 WeakPolarHBondContact O-CB 3.02Å; Q158-Q162 VanDerWaalsContact O-CG 3.31Å; Q158-Q162 WeakPolarHBondContact O-CG 3.42Å; Q158-Q162 PolarHBondContact O-N 3.36Å; K159-Q162 PolarHBondContact O-N 3.36Å; Q162-S164 PolarHBondContact O-N 3.3Å; Q162-R165 PolarHBondContact O-N 2.87Å; Q162-I166 WeakPolarHBondContact O-CG1 3.48Å; Q162-I166 PolarHBondContact O-N 3.49Å |
| 163 | Q | 98.6 | Very high | 98.5 | Very high | 133 Ų | 133 | 118.3 Ų | 118.3 | 62% | 0.621 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -60.9 | -46.1 | 177.4 | -172.8 | -177.3 | 18.5 | 0 | 0 | 111.6 | K159 I160 R165 I166 V167 | K159-Q163 PolarHBondContact O-N 3.07Å; I160-Q163 PolarHBondContact O-N 3.37Å; Q163-R165 VanDerWaalsContact C-N 3.31Å; Q163-R165 PolarHBondContact O-N 3.35Å; Q163-I166 PolarHBondContact O-N 2.87Å; Q163-V167 WeakPolarHBondContact O-CG2 3.43Å; Q163-V167 PolarHBondContact O-N 2.67Å |
| 164 | S | 98.3 | Very high | 98.5 | Very high | 50 Ų | 50 | 115.7 Ų | 115.7 | 35% | 0.35 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -57.8 | -44.6 | 177.3 | -176.9 | 0 | 0 | 0 | 0 | 111.4 | I160 L161 Q162 I166 V167 Q168 | I160-S164 WeakPolarHBondContact O-CB 3.08Å; I160-S164 PolarHBondContact O-N 3.01Å; L161-S164 PolarHBondContact O-N 2.95Å; Q162-S164 PolarHBondContact O-N 3.3Å; S164-I166 PolarHBondContact O-N 3.2Å; S164-V167 PolarHBondContact O-N 3.31Å; S164-Q168 WeakPolarHBondContact O-CB 3.4Å; S164-Q168 VanDerWaalsContact O-CG 3.31Å; S164-Q168 WeakPolarHBondContact O-CG 3.46Å; S164-Q168 PolarHBondContact O-N 3.44Å; S164-Q168 PolarHBondContact OG-NE2 3.36Å |
| 165 | R | 98.5 | Very high | 98.6 | Very high | 197 Ų | 197 | 114.5 Ų | 114.5 | 74% | 0.743 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -62.1 | -40.7 | 177.5 | -170.5 | 174.9 | -178.1 | 178 | 0.3 | 112.5 | L161 Q162 Q163 S169 | L161-R165 WeakPolarHBondContact O-CB 3.33Å; L161-R165 PolarHBondContact O-N 2.94Å; Q162-R165 PolarHBondContact O-N 2.87Å; Q163-R165 VanDerWaalsContact C-N 3.31Å; Q163-R165 PolarHBondContact O-N 3.35Å; R165-S169 VanDerWaalsContact O-CB 3.31Å; R165-S169 WeakPolarHBondContact O-CB 3.38Å; R165-S169 PolarHBondContact O-N 2.87Å |
| 166 | I | 98.6 | Very high | 98.6 | Very high | 119 Ų | 119 | 116.2 Ų | 116.2 | 61% | 0.61 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -62.8 | -48.7 | 175.9 | -68 | 165.5 | 0 | 0 | 0 | 110.4 | Q162 Q163 S164 Q168 S169 Q170 | Q162-I166 WeakPolarHBondContact O-CG1 3.48Å; Q162-I166 PolarHBondContact O-N 3.49Å; Q163-I166 PolarHBondContact O-N 2.87Å; S164-I166 PolarHBondContact O-N 3.2Å; I166-Q168 PolarHBondContact O-N 3.4Å; I166-S169 PolarHBondContact O-N 3.02Å; I166-Q170 WeakPolarHBondContact O-CB 3.43Å; I166-Q170 PolarHBondContact O-N 3.07Å |
| 167 | V | 98.6 | Very high | 98.6 | Very high | 65 Ų | 65 | 114.7 Ų | 114.7 | 39% | 0.394 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -61.3 | -45 | 179.9 | 172.3 | 0 | 0 | 0 | 0 | 111.3 | Q163 S164 Q170 R171 | Q163-V167 WeakPolarHBondContact O-CG2 3.43Å; Q163-V167 PolarHBondContact O-N 2.67Å; S164-V167 PolarHBondContact O-N 3.31Å; V167-Q170 PolarHBondContact O-N 2.92Å; V167-R171 WeakPolarHBondContact O-CG 3.33Å; V167-R171 PolarHBondContact O-N 2.86Å |
| 168 | Q | 98.6 | Very high | 98.6 | Very high | 123 Ų | 123 | 114.1 Ų | 114.1 | 58% | 0.575 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -62.1 | -45.5 | 177.4 | -72.5 | 177.7 | 6.9 | 0 | 0 | 111.9 | S164 I166 Q170 R171 L172 | S164-Q168 WeakPolarHBondContact O-CB 3.4Å; S164-Q168 VanDerWaalsContact O-CG 3.31Å; S164-Q168 WeakPolarHBondContact O-CG 3.46Å; S164-Q168 PolarHBondContact O-N 3.44Å; S164-Q168 PolarHBondContact OG-NE2 3.36Å; I166-Q168 PolarHBondContact O-N 3.4Å; Q168-Q170 VanDerWaalsContact C-N 3.32Å; Q168-Q170 PolarHBondContact O-N 3.33Å; Q168-R171 PolarHBondContact O-N 3.28Å; Q168-L172 PolarHBondContact O-N 2.99Å |
| 169 | S | 98.7 | Very high | 98.6 | Very high | 81 Ų | 81 | 116.9 Ų | 116.9 | 57% | 0.566 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -58.8 | -44.6 | 176.5 | -175.7 | 0 | 0 | 0 | 0 | 111.7 | R165 I166 L172 K173 | R165-S169 VanDerWaalsContact O-CB 3.31Å; R165-S169 WeakPolarHBondContact O-CB 3.38Å; R165-S169 PolarHBondContact O-N 2.87Å; I166-S169 PolarHBondContact O-N 3.02Å; S169-L172 PolarHBondContact O-N 3.43Å; S169-K173 PolarHBondContact O-N 3.47Å |
| 170 | Q | 98.7 | Very high | 98.6 | Very high | 101 Ų | 101 | 114.5 Ų | 114.5 | 47% | 0.472 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -64.6 | -43.4 | 178 | -175.1 | 58.2 | 33.4 | 0 | 0 | 112.1 | I166 V167 Q168 L172 K173 T174 | I166-Q170 WeakPolarHBondContact O-CB 3.43Å; I166-Q170 PolarHBondContact O-N 3.07Å; V167-Q170 PolarHBondContact O-N 2.92Å; Q168-Q170 VanDerWaalsContact C-N 3.32Å; Q168-Q170 PolarHBondContact O-N 3.33Å; Q170-L172 PolarHBondContact O-N 2.9Å; Q170-K173 WeakPolarHBondContact O-CB 3.46Å; Q170-K173 PolarHBondContact O-N 2.96Å; Q170-T174 PolarHBondContact O-N 2.91Å; Q170-T174 PolarHBondContact O-OG1 2.96Å |
| 171 | R | 98.5 | Very high | 98.6 | Very high | 173 Ų | 173 | 114.9 Ų | 114.9 | 65% | 0.653 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -60.6 | -44.9 | 175.8 | -74.3 | 177.9 | -178.6 | -166.7 | 0.8 | 111.7 | V167 Q168 K173 T174 I175 | V167-R171 WeakPolarHBondContact O-CG 3.33Å; V167-R171 PolarHBondContact O-N 2.86Å; Q168-R171 PolarHBondContact O-N 3.28Å; R171-K173 VanDerWaalsContact C-N 3.29Å; R171-K173 PolarHBondContact O-N 3.03Å; R171-T174 PolarHBondContact O-N 3.31Å; R171-I175 WeakPolarHBondContact O-CG1 3.4Å; R171-I175 PolarHBondContact O-N 3.29Å |
| 172 | L | 98.7 | Very high | 98.6 | Very high | 121 Ų | 121 | 115.4 Ų | 115.4 | 63% | 0.634 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -61.5 | -40.5 | 177.6 | -176.3 | 63.2 | 0 | 0 | 0 | 111.4 | Q168 S169 Q170 I175 R176 | Q168-L172 PolarHBondContact O-N 2.99Å; S169-L172 PolarHBondContact O-N 3.43Å; Q170-L172 PolarHBondContact O-N 2.9Å; L172-I175 PolarHBondContact O-N 3.4Å; L172-R176 WeakPolarHBondContact O-CB 3.5Å; L172-R176 PolarHBondContact O-N 3.37Å |
| 173 | K | 98.7 | Very high | 98.6 | Very high | 116 Ų | 116 | 113.1 Ų | 113.1 | 50% | 0.504 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -59.5 | -46 | 174.1 | -174.9 | 178.9 | 178.4 | -179.9 | 0 | 111.7 | S169 Q170 R171 R176 Q177 | S169-K173 PolarHBondContact O-N 3.47Å; Q170-K173 WeakPolarHBondContact O-CB 3.46Å; Q170-K173 PolarHBondContact O-N 2.96Å; R171-K173 VanDerWaalsContact C-N 3.29Å; R171-K173 PolarHBondContact O-N 3.03Å; K173-R176 PolarHBondContact O-N 2.89Å; K173-Q177 WeakPolarHBondContact O-CG 3.23Å; K173-Q177 PolarHBondContact O-N 3.45Å |
| 174 | T | 98.7 | Very high | 98.6 | Very high | 60 Ų | 60 | 112.1 Ų | 112.1 | 37% | 0.368 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -61.8 | -44.8 | 176.4 | -59.2 | 0 | 0 | 0 | 0 | 111.9 | Q170 R171 R176 Q177 L178 | Q170-T174 PolarHBondContact O-N 2.91Å; Q170-T174 PolarHBondContact O-OG1 2.96Å; R171-T174 PolarHBondContact O-N 3.31Å; T174-R176 VanDerWaalsContact C-N 3.3Å; T174-R176 PolarHBondContact O-N 3.36Å; T174-Q177 PolarHBondContact O-N 3.45Å; T174-L178 HydrophobicContact CG2-CD1 4.28Å; T174-L178 WeakPolarHBondContact O-CG 3.44Å; T174-L178 PolarHBondContact O-N 3.5Å |
| 175 | I | 98.7 | Very high | 98.6 | Very high | 106 Ų | 106 | 113 Ų | 113 | 54% | 0.544 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -58.7 | -44.8 | 177 | -68.9 | 166.6 | 0 | 0 | 0 | 110.5 | R171 L172 Q177 L178 Y179 | R171-I175 WeakPolarHBondContact O-CG1 3.4Å; R171-I175 PolarHBondContact O-N 3.29Å; L172-I175 PolarHBondContact O-N 3.4Å; I175-Q177 VanDerWaalsContact C-N 3.33Å; I175-Q177 PolarHBondContact O-N 2.93Å; I175-L178 PolarHBondContact O-N 2.97Å; I175-Y179 PolarHBondContact O-N 3.18Å |
| 176 | R | 98.6 | Very high | 98.6 | Very high | 192 Ų | 192 | 108 Ų | 108 | 73% | 0.725 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -60.1 | -43.6 | 177.5 | -168.2 | -177.5 | -162.1 | -142.1 | 3.8 | 112 | L172 K173 T174 Y179 E180 | L172-R176 WeakPolarHBondContact O-CB 3.5Å; L172-R176 PolarHBondContact O-N 3.37Å; K173-R176 PolarHBondContact O-N 2.89Å; T174-R176 VanDerWaalsContact C-N 3.3Å; T174-R176 PolarHBondContact O-N 3.36Å; R176-Y179 PolarHBondContact O-N 3.48Å; R176-E180 PolarHBondContact O-N 3.34Å |
| 177 | Q | 98.7 | Very high | 98.6 | Very high | 91 Ų | 91 | 108 Ų | 108 | 43% | 0.425 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -64.1 | -43.1 | 178.3 | -72.7 | 173.6 | -32.3 | 0 | 0 | 112 | K173 T174 I175 Y179 E180 Q181 | K173-Q177 WeakPolarHBondContact O-CG 3.23Å; K173-Q177 PolarHBondContact O-N 3.45Å; T174-Q177 PolarHBondContact O-N 3.45Å; I175-Q177 VanDerWaalsContact C-N 3.33Å; I175-Q177 PolarHBondContact O-N 2.93Å; Q177-Y179 VanDerWaalsContact C-N 3.34Å; Q177-Y179 PolarHBondContact O-N 3Å; Q177-E180 PolarHBondContact O-N 3.34Å; Q177-Q181 WeakPolarHBondContact O-CG 3.49Å; Q177-Q181 PolarHBondContact O-N 2.91Å |
| 178 | L | 98.7 | Very high | 98.6 | Very high | 102 Ų | 102 | 110.9 Ų | 110.9 | 53% | 0.534 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62 | -42.7 | 176.2 | -72.7 | 172.8 | 0 | 0 | 0 | 111.7 | T174 I175 Q181 F182 | T174-L178 HydrophobicContact CG2-CD1 4.28Å; T174-L178 WeakPolarHBondContact O-CG 3.44Å; T174-L178 PolarHBondContact O-N 3.5Å; I175-L178 PolarHBondContact O-N 2.97Å; L178-Q181 PolarHBondContact O-N 3.47Å; L178-F182 WeakPolarHBondContact O-CB 3.3Å; L178-F182 PolarHBondContact O-N 3.5Å |
| 179 | Y | 98.6 | Very high | 98.6 | Very high | 154 Ų | 154 | 108.8 Ų | 108.8 | 60% | 0.604 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -61.7 | -45.2 | 176.4 | -174.9 | -96.1 | 0 | 0 | 0 | 111.7 | I175 R176 Q177 Q181 F182 I183 | I175-Y179 PolarHBondContact O-N 3.18Å; R176-Y179 PolarHBondContact O-N 3.48Å; Q177-Y179 VanDerWaalsContact C-N 3.34Å; Q177-Y179 PolarHBondContact O-N 3Å; Y179-Q181 VanDerWaalsContact C-N 3.33Å; Y179-Q181 PolarHBondContact O-N 2.89Å; Y179-F182 WeakPolarHBondContact O-CB 3.49Å; Y179-F182 PolarHBondContact O-N 2.79Å; Y179-I183 HydrophobicContact CD1-CG1 4.2Å; Y179-I183 HydrophobicContact CE1-CD1 4.23Å; Y179-I183 HydrophobicContact CE1-CG1 3.79Å; Y179-I183 HydrophobicContact CE2-CD1 4.47Å; Y179-I183 WeakPolarHBondContact O-CG1 3.42Å; Y179-I183 PolarHBondContact O-N 3.36Å |
| 180 | E | 98.7 | Very high | 98.6 | Very high | 98 Ų | 98 | 111 Ų | 111 | 46% | 0.458 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.3 | -40 | 177.8 | -167 | -174.6 | 152.5 | 0 | 0 | 112.3 | R176 Q177 K184 | R176-E180 PolarHBondContact O-N 3.34Å; Q177-E180 PolarHBondContact O-N 3.34Å; E180-K184 WeakPolarHBondContact O-CG 3.29Å; E180-K184 PolarHBondContact O-N 3.16Å; E180-K184 VanDerWaalsContact O-N 3.16Å; E180-K184 WeakPolarHBondContact OE1-CE 3.38Å; E180-K184 IonicContact OE1-NZ 2.74Å; E180-K184 PolarHBondContact OE1-NZ 3.16Å |
| 181 | Q | 98.6 | Very high | 98.6 | Very high | 116 Ų | 116 | 112.8 Ų | 112.8 | 54% | 0.542 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -65.9 | -40.4 | 175.1 | -73.5 | 175.4 | -8.2 | 0 | 0 | 112.4 | Q177 L178 Y179 K184 S185 | Q177-Q181 WeakPolarHBondContact O-CG 3.49Å; Q177-Q181 PolarHBondContact O-N 2.91Å; L178-Q181 PolarHBondContact O-N 3.47Å; Y179-Q181 VanDerWaalsContact C-N 3.33Å; Y179-Q181 PolarHBondContact O-N 2.89Å; Q181-K184 PolarHBondContact O-N 3.41Å; Q181-S185 WeakPolarHBondContact O-CB 3.46Å; Q181-S185 PolarHBondContact O-N 3.38Å; Q181-S185 PolarHBondContact O-OG 2.96Å |
| 182 | F | 98.6 | Very high | 98.5 | Very high | 119 Ų | 119 | 108.4 Ų | 108.4 | 52% | 0.522 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59.9 | -47.6 | 176.6 | 173.3 | -100.9 | 0 | 0 | 0 | 111.4 | L178 Y179 K184 S185 M186 | L178-F182 WeakPolarHBondContact O-CB 3.3Å; L178-F182 PolarHBondContact O-N 3.5Å; Y179-F182 WeakPolarHBondContact O-CB 3.49Å; Y179-F182 PolarHBondContact O-N 2.79Å; F182-K184 PolarHBondContact O-N 3.31Å; F182-S185 PolarHBondContact O-N 2.69Å; F182-M186 HydrophobicContact CD1-CG 4.38Å; F182-M186 HydrophobicContact CD2-CG 4.43Å; F182-M186 HydrophobicContact CE1-CG 3.91Å; F182-M186 HydrophobicContact CE2-CG 3.96Å; F182-M186 HydrophobicContact CE2-SD 4.25Å; F182-M186 HydrophobicContact CZ-CG 3.68Å; F182-M186 HydrophobicContact CZ-SD 4.06Å; F182-M186 WeakPolarHBondContact O-CG 3.38Å; F182-M186 PolarHBondContact O-N 3.43Å |
| 183 | I | 98.7 | Very high | 98.5 | Very high | 58 Ų | 58 | 107.4 Ų | 107.4 | 30% | 0.297 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -59.5 | -48.6 | 177.6 | -63.8 | -59.4 | 0 | 0 | 0 | 111.1 | Y179 S185 M186 E187 | Y179-I183 HydrophobicContact CD1-CG1 4.2Å; Y179-I183 HydrophobicContact CE1-CD1 4.23Å; Y179-I183 HydrophobicContact CE1-CG1 3.79Å; Y179-I183 HydrophobicContact CE2-CD1 4.47Å; Y179-I183 WeakPolarHBondContact O-CG1 3.42Å; Y179-I183 PolarHBondContact O-N 3.36Å; I183-S185 VanDerWaalsContact C-N 3.29Å; I183-S185 PolarHBondContact O-N 2.98Å; I183-M186 WeakPolarHBondContact O-CB 3.36Å; I183-M186 PolarHBondContact O-N 3.34Å; I183-M186 VanDerWaalsContact O-N 3.14Å; I183-E187 WeakPolarHBondContact O-CG 3.36Å; I183-E187 PolarHBondContact O-N 3.33Å |
| 184 | K | 98.6 | Very high | 98.5 | Very high | 112 Ų | 112 | 106.3 Ų | 106.3 | 49% | 0.487 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -58.5 | -41.1 | 177.2 | -71.8 | 175 | -173.6 | 169.1 | 0 | 112.6 | E180 Q181 F182 M186 E187 E188 | E180-K184 WeakPolarHBondContact O-CG 3.29Å; E180-K184 PolarHBondContact O-N 3.16Å; E180-K184 VanDerWaalsContact O-N 3.16Å; E180-K184 WeakPolarHBondContact OE1-CE 3.38Å; E180-K184 IonicContact OE1-NZ 2.74Å; E180-K184 PolarHBondContact OE1-NZ 3.16Å; Q181-K184 PolarHBondContact O-N 3.41Å; F182-K184 PolarHBondContact O-N 3.31Å; K184-M186 VanDerWaalsContact C-N 3.34Å; K184-E187 PolarHBondContact O-N 3.04Å; K184-E188 PolarHBondContact O-N 3.38Å |
| 185 | S | 98.5 | Very high | 98.4 | Very high | 70 Ų | 70 | 108 Ų | 108 | 49% | 0.49 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -67.8 | -36 | 179 | -53.7 | 0 | 0 | 0 | 0 | 111.8 | Q181 F182 I183 L189 | Q181-S185 WeakPolarHBondContact O-CB 3.46Å; Q181-S185 PolarHBondContact O-N 3.38Å; Q181-S185 PolarHBondContact O-OG 2.96Å; F182-S185 PolarHBondContact O-N 2.69Å; I183-S185 VanDerWaalsContact C-N 3.29Å; I183-S185 PolarHBondContact O-N 2.98Å; S185-L189 WeakPolarHBondContact O-CB 3.35Å; S185-L189 PolarHBondContact O-N 3.36Å |
| 186 | M | 98.5 | Very high | 98.3 | Very high | 91 Ų | 91 | 109 Ų | 109 | 45% | 0.448 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -66.1 | -44.1 | 174.6 | -76.6 | -65.6 | -60 | 0 | 0 | 111.8 | F182 I183 K184 E188 L189 E190 | F182-M186 HydrophobicContact CD1-CG 4.38Å; F182-M186 HydrophobicContact CD2-CG 4.43Å; F182-M186 HydrophobicContact CE1-CG 3.91Å; F182-M186 HydrophobicContact CE2-CG 3.96Å; F182-M186 HydrophobicContact CE2-SD 4.25Å; F182-M186 HydrophobicContact CZ-CG 3.68Å; F182-M186 HydrophobicContact CZ-SD 4.06Å; F182-M186 WeakPolarHBondContact O-CG 3.38Å; F182-M186 PolarHBondContact O-N 3.43Å; I183-M186 WeakPolarHBondContact O-CB 3.36Å; I183-M186 PolarHBondContact O-N 3.34Å; I183-M186 VanDerWaalsContact O-N 3.14Å; K184-M186 VanDerWaalsContact C-N 3.34Å; M186-E188 VanDerWaalsContact C-N 3.32Å; M186-E188 PolarHBondContact O-N 3.43Å; M186-L189 PolarHBondContact O-N 2.88Å; M186-E190 WeakPolarHBondContact O-CB 3.3Å; M186-E190 PolarHBondContact O-N 3.33Å |
| 187 | E | 98.4 | Very high | 98.3 | Very high | 120 Ų | 120 | 105.3 Ų | 105.3 | 56% | 0.561 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -60.6 | -41.6 | 175.8 | -70.2 | 170.7 | 178.4 | 0 | 0 | 111.6 | I183 K184 K191 | I183-E187 WeakPolarHBondContact O-CG 3.36Å; I183-E187 PolarHBondContact O-N 3.33Å; K184-E187 PolarHBondContact O-N 3.04Å; E187-K191 WeakPolarHBondContact O-CB 3.42Å; E187-K191 PolarHBondContact O-N 3.46Å; E187-K191 VanDerWaalsContact O-N 3.1Å |
| 188 | E | 98.4 | Very high | 98.3 | Very high | 125 Ų | 125 | 104.4 Ų | 104.4 | 58% | 0.584 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -66.7 | -41.2 | 175.9 | -174.9 | 173 | -172 | 0 | 0 | 112.2 | K184 M186 K191 N192 | K184-E188 PolarHBondContact O-N 3.38Å; M186-E188 VanDerWaalsContact C-N 3.32Å; M186-E188 PolarHBondContact O-N 3.43Å; E188-K191 PolarHBondContact O-N 3.46Å; E188-N192 VanDerWaalsContact O-CG 3.25Å; E188-N192 PolarHBondContact O-N 3.44Å; E188-N192 PolarHBondContact O-ND2 3.23Å |
| 189 | L | 98.4 | Very high | 98.2 | Very high | 78 Ų | 78 | 101.3 Ų | 101.3 | 41% | 0.408 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.8 | -44.9 | 176.8 | -178.5 | 62.6 | 0 | 0 | 0 | 111.8 | S185 M186 K191 N192 H193 | S185-L189 WeakPolarHBondContact O-CB 3.35Å; S185-L189 PolarHBondContact O-N 3.36Å; M186-L189 PolarHBondContact O-N 2.88Å; L189-K191 PolarHBondContact O-N 2.86Å; L189-N192 WeakPolarHBondContact O-CB 3.49Å; L189-N192 PolarHBondContact O-N 3.31Å; L189-H193 PolarHBondContact O-N 3.37Å |
| 190 | E | 98.1 | Very high | 98.1 | Very high | 128 Ų | 128 | 96.4 Ų | 96.4 | 60% | 0.598 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -59.6 | -46.9 | 176.9 | -173.2 | 169.2 | -157.8 | 0 | 0 | 110.9 | M186 N192 H193 D194 | M186-E190 WeakPolarHBondContact O-CB 3.3Å; M186-E190 PolarHBondContact O-N 3.33Å; E190-N192 VanDerWaalsContact C-N 3.3Å; E190-N192 PolarHBondContact O-N 2.96Å; E190-H193 WeakPolarHBondContact O-CB 3.39Å; E190-H193 PolarHBondContact O-N 3.43Å; E190-H193 VanDerWaalsContact O-N 3.13Å; E190-D194 PolarHBondContact O-N 3Å |
| 191 | K | 98.2 | Very high | 98.1 | Very high | 138 Ų | 138 | 97 Ų | 97 | 60% | 0.6 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -59 | -39.4 | 174.7 | -175 | -179.8 | 179.6 | -177.8 | 0 | 112.8 | E187 E188 L189 D194 N195 | E187-K191 WeakPolarHBondContact O-CB 3.42Å; E187-K191 PolarHBondContact O-N 3.46Å; E187-K191 VanDerWaalsContact O-N 3.1Å; E188-K191 PolarHBondContact O-N 3.46Å; L189-K191 PolarHBondContact O-N 2.86Å; K191-D194 PolarHBondContact O-N 3.14Å; K191-N195 VanDerWaalsContact O-CG 3.28Å; K191-N195 PolarHBondContact O-N 3.4Å; K191-N195 VanDerWaalsContact O-N 3.14Å; K191-N195 PolarHBondContact O-ND2 3.25Å; K191-N195 VanDerWaalsContact O-ND2 3.15Å |
| 192 | N | 98 | Very high | 98 | Very high | 82 Ų | 82 | 95 Ų | 95 | 44% | 0.439 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -66.7 | -39.4 | 177 | -72.9 | -27.9 | 0 | 0 | 0 | 112 | E188 L189 E190 N195 L196 | E188-N192 VanDerWaalsContact O-CG 3.25Å; E188-N192 PolarHBondContact O-N 3.44Å; E188-N192 PolarHBondContact O-ND2 3.23Å; L189-N192 WeakPolarHBondContact O-CB 3.49Å; L189-N192 PolarHBondContact O-N 3.31Å; E190-N192 VanDerWaalsContact C-N 3.3Å; E190-N192 PolarHBondContact O-N 2.96Å; N192-N195 PolarHBondContact O-N 3.39Å; N192-L196 PolarHBondContact O-N 2.99Å |
| 193 | H | 98.2 | Very high | 98 | Very high | 100 Ų | 100 | 95 Ų | 95 | 46% | 0.463 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.3 | -44 | 174.3 | -70.6 | 173.5 | 0 | 0 | 0 | 112 | L189 E190 N195 L196 L197 | L189-H193 PolarHBondContact O-N 3.37Å; E190-H193 WeakPolarHBondContact O-CB 3.39Å; E190-H193 PolarHBondContact O-N 3.43Å; E190-H193 VanDerWaalsContact O-N 3.13Å; H193-N195 VanDerWaalsContact C-N 3.3Å; H193-N195 PolarHBondContact O-N 2.95Å; H193-L196 PolarHBondContact O-N 3.31Å; H193-L196 VanDerWaalsContact O-N 3.15Å; H193-L197 WeakPolarHBondContact O-CB 3.39Å; H193-L197 WeakPolarHBondContact O-CG 3.34Å; H193-L197 PolarHBondContact O-N 3Å |
| 194 | D | 98 | Very high | 97.9 | Very high | 92 Ų | 92 | 98 Ų | 98 | 49% | 0.492 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.3 | -41.8 | 176.7 | -75.7 | -16.6 | 0 | 0 | 0 | 112.2 | E190 K191 T198 | E190-D194 PolarHBondContact O-N 3Å; K191-D194 PolarHBondContact O-N 3.14Å; D194-T198 VanDerWaalsContact O-CB 3.32Å; D194-T198 WeakPolarHBondContact O-CB 3.39Å; D194-T198 PolarHBondContact O-N 3.45Å; D194-T198 PolarHBondContact O-OG1 3.42Å |
| 195 | N | 97.7 | Very high | 97.9 | Very high | 96 Ų | 96 | 98 Ų | 98 | 51% | 0.513 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.6 | -43.6 | 175.3 | -69.7 | -31.5 | 0 | 0 | 0 | 111.8 | K191 N192 H193 T198 G199 | K191-N195 VanDerWaalsContact O-CG 3.28Å; K191-N195 PolarHBondContact O-N 3.4Å; K191-N195 VanDerWaalsContact O-N 3.14Å; K191-N195 PolarHBondContact O-ND2 3.25Å; K191-N195 VanDerWaalsContact O-ND2 3.15Å; N192-N195 PolarHBondContact O-N 3.39Å; H193-N195 VanDerWaalsContact C-N 3.3Å; H193-N195 PolarHBondContact O-N 2.95Å; N195-T198 PolarHBondContact O-N 3.26Å; N195-G199 PolarHBondContact O-N 3.28Å |
| 196 | L | 97 | Very high | 97.8 | Very high | 126 Ų | 126 | 101.6 Ų | 101.6 | 66% | 0.66 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -64.3 | -45.6 | 178.7 | -177.2 | 66.7 | 0 | 0 | 0 | 111.5 | N192 H193 T198 G199 A200 | N192-L196 PolarHBondContact O-N 2.99Å; H193-L196 PolarHBondContact O-N 3.31Å; H193-L196 VanDerWaalsContact O-N 3.15Å; L196-T198 VanDerWaalsContact C-N 3.35Å; L196-T198 PolarHBondContact O-N 3.35Å; L196-G199 PolarHBondContact O-N 3.01Å; L196-A200 PolarHBondContact O-N 2.87Å |
| 197 | L | 97.8 | Very high | 97.7 | Very high | 116 Ų | 116 | 102 Ų | 102 | 61% | 0.607 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -60.7 | -44.9 | 176.4 | -73.7 | 172 | 0 | 0 | 0 | 111.2 | H193 G199 A200 Q201 | H193-L197 WeakPolarHBondContact O-CB 3.39Å; H193-L197 WeakPolarHBondContact O-CG 3.34Å; H193-L197 PolarHBondContact O-N 3Å; L197-G199 VanDerWaalsContact C-N 3.31Å; L197-G199 PolarHBondContact O-N 3.11Å; L197-A200 PolarHBondContact O-N 2.81Å; L197-Q201 WeakPolarHBondContact O-CB 3.32Å; L197-Q201 PolarHBondContact O-N 3.3Å |
| 198 | T | 97.9 | Very high | 97.7 | Very high | 72 Ų | 72 | 100.3 Ų | 100.3 | 44% | 0.442 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.9 | -42.1 | 175.3 | -58.5 | 0 | 0 | 0 | 0 | 111.1 | D194 N195 L196 Q201 N202 | D194-T198 VanDerWaalsContact O-CB 3.32Å; D194-T198 WeakPolarHBondContact O-CB 3.39Å; D194-T198 PolarHBondContact O-N 3.45Å; D194-T198 PolarHBondContact O-OG1 3.42Å; N195-T198 PolarHBondContact O-N 3.26Å; L196-T198 VanDerWaalsContact C-N 3.35Å; L196-T198 PolarHBondContact O-N 3.35Å; T198-Q201 PolarHBondContact O-N 2.87Å; T198-N202 WeakPolarHBondContact O-CB 3.25Å; T198-N202 PolarHBondContact O-N 3.36Å; T198-N202 PolarHBondContact O-ND2 2.84Å; T198-N202 VanDerWaalsContact O-ND2 3.11Å |
| 199 | G | 97.6 | Very high | 97.6 | Very high | 37 Ų | 37 | 97 Ų | 97 | 38% | 0.381 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59.3 | -52.8 | 175 | 0 | 0 | 0 | 0 | 0 | 112.7 | N195 L196 L197 Q201 N202 E203 | N195-G199 PolarHBondContact O-N 3.28Å; L196-G199 PolarHBondContact O-N 3.01Å; L197-G199 VanDerWaalsContact C-N 3.31Å; L197-G199 PolarHBondContact O-N 3.11Å; G199-Q201 VanDerWaalsContact C-N 3.34Å; G199-Q201 PolarHBondContact O-N 3.1Å; G199-N202 PolarHBondContact O-N 3.43Å; G199-N202 VanDerWaalsContact O-N 3.16Å; G199-E203 PolarHBondContact O-N 2.94Å |
| 200 | A | 97.1 | Very high | 97.6 | Very high | 51 Ų | 51 | 99.1 Ų | 99.1 | 42% | 0.421 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.2 | -41.2 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | L196 L197 N202 E203 F204 | L196-A200 PolarHBondContact O-N 2.87Å; L197-A200 PolarHBondContact O-N 2.81Å; A200-N202 VanDerWaalsContact C-N 3.31Å; A200-N202 PolarHBondContact O-N 3.4Å; A200-E203 PolarHBondContact O-N 3.44Å; A200-F204 PolarHBondContact O-N 2.97Å |
| 201 | Q | 97.7 | Very high | 97.6 | Very high | 110 Ų | 110 | 97.1 Ų | 97.1 | 51% | 0.514 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62 | -40.1 | 175.9 | -170.7 | -174.5 | 5.7 | 0 | 0 | 111.7 | L197 T198 G199 K205 | L197-Q201 WeakPolarHBondContact O-CB 3.32Å; L197-Q201 PolarHBondContact O-N 3.3Å; T198-Q201 PolarHBondContact O-N 2.87Å; G199-Q201 VanDerWaalsContact C-N 3.34Å; G199-Q201 PolarHBondContact O-N 3.1Å; Q201-K205 WeakPolarHBondContact O-CG 3.3Å; Q201-K205 PolarHBondContact O-N 3.3Å |
| 202 | N | 97.8 | Very high | 97.5 | Very high | 73 Ų | 73 | 97.4 Ų | 97.4 | 39% | 0.39 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -69.2 | -36.6 | 177.8 | -72.6 | -29.6 | 0 | 0 | 0 | 112.3 | T198 G199 A200 K205 K206 | T198-N202 WeakPolarHBondContact O-CB 3.25Å; T198-N202 PolarHBondContact O-N 3.36Å; T198-N202 PolarHBondContact O-ND2 2.84Å; T198-N202 VanDerWaalsContact O-ND2 3.11Å; G199-N202 PolarHBondContact O-N 3.43Å; G199-N202 VanDerWaalsContact O-N 3.16Å; A200-N202 VanDerWaalsContact C-N 3.31Å; A200-N202 PolarHBondContact O-N 3.4Å; N202-K205 PolarHBondContact O-N 3.3Å; N202-K206 WeakPolarHBondContact O-CG 3.44Å; N202-K206 PolarHBondContact O-N 3.39Å; N202-K206 VanDerWaalsContact O-N 3.13Å |
| 203 | E | 97.3 | Very high | 97.4 | Very high | 121 Ų | 121 | 99.6 Ų | 99.6 | 57% | 0.565 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -63.5 | -49.5 | 173.5 | -174.9 | 169 | -157.3 | 0 | 0 | 111.2 | G199 A200 K205 K206 E207 | G199-E203 PolarHBondContact O-N 2.94Å; A200-E203 PolarHBondContact O-N 3.44Å; E203-K205 VanDerWaalsContact C-N 3.29Å; E203-K205 PolarHBondContact O-N 2.92Å; E203-K206 WeakPolarHBondContact O-CA 3.46Å; E203-K206 WeakPolarHBondContact O-CB 3.48Å; E203-K206 PolarHBondContact O-N 3.22Å; E203-E207 PolarHBondContact O-N 2.97Å |
| 204 | F | 97 | Very high | 97.4 | Very high | 120 Ų | 120 | 100.6 Ų | 100.6 | 53% | 0.526 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -56.9 | -42.1 | 176.2 | -174.6 | -99.2 | 0 | 0 | 0 | 112.3 | A200 K206 E207 M208 | A200-F204 PolarHBondContact O-N 2.97Å; F204-K206 VanDerWaalsContact C-N 3.32Å; F204-K206 PolarHBondContact O-N 3.34Å; F204-E207 PolarHBondContact O-N 2.84Å; F204-M208 HydrophobicContact CD1-CG 4.01Å; F204-M208 HydrophobicContact CE1-CE 4.37Å; F204-M208 HydrophobicContact CE1-CG 3.64Å; F204-M208 HydrophobicContact CE1-SD 4.4Å; F204-M208 HydrophobicContact CE2-CE 3.68Å; F204-M208 HydrophobicContact CE2-CG 4.38Å; F204-M208 HydrophobicContact CZ-CE 3.6Å; F204-M208 HydrophobicContact CZ-CG 3.86Å; F204-M208 HydrophobicContact CZ-SD 4.13Å; F204-M208 WeakPolarHBondContact O-CB 3.38Å; F204-M208 VanDerWaalsContact O-CG 3.32Å; F204-M208 WeakPolarHBondContact O-CG 3.45Å; F204-M208 PolarHBondContact O-N 3.11Å |
| 205 | K | 97.6 | Very high | 97.2 | Very high | 113 Ų | 113 | 100.5 Ų | 100.5 | 49% | 0.491 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -59.8 | -40.6 | 174.3 | -76.9 | 173.8 | -177.1 | 170.1 | 0 | 112.2 | Q201 N202 E203 A209 | Q201-K205 WeakPolarHBondContact O-CG 3.3Å; Q201-K205 PolarHBondContact O-N 3.3Å; N202-K205 PolarHBondContact O-N 3.3Å; E203-K205 VanDerWaalsContact C-N 3.29Å; E203-K205 PolarHBondContact O-N 2.92Å; K205-A209 WeakPolarHBondContact O-CB 3.29Å; K205-A209 PolarHBondContact O-N 3.03Å |
| 206 | K | 97.7 | Very high | 97.1 | Very high | 144 Ų | 144 | 101.7 Ų | 101.7 | 63% | 0.626 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -67.1 | -45.1 | 176.7 | -71.3 | 173 | -177.2 | 176.8 | 0 | 111.3 | N202 E203 F204 M208 A209 M210 | N202-K206 WeakPolarHBondContact O-CG 3.44Å; N202-K206 PolarHBondContact O-N 3.39Å; N202-K206 VanDerWaalsContact O-N 3.13Å; E203-K206 WeakPolarHBondContact O-CA 3.46Å; E203-K206 WeakPolarHBondContact O-CB 3.48Å; E203-K206 PolarHBondContact O-N 3.22Å; F204-K206 VanDerWaalsContact C-N 3.32Å; F204-K206 PolarHBondContact O-N 3.34Å; K206-M208 PolarHBondContact O-N 3.03Å; K206-A209 PolarHBondContact O-N 2.9Å; K206-M210 WeakPolarHBondContact O-CG 3.33Å; K206-M210 PolarHBondContact O-N 3.09Å |
| 207 | E | 97 | Very high | 97.1 | Very high | 100 Ų | 100 | 100.6 Ų | 100.6 | 47% | 0.467 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -59.8 | -45.6 | 176.8 | -70.4 | -170.9 | 158.5 | 0 | 0 | 111.8 | E203 F204 A209 M210 L211 | E203-E207 PolarHBondContact O-N 2.97Å; F204-E207 PolarHBondContact O-N 2.84Å; E207-A209 VanDerWaalsContact C-N 3.34Å; E207-A209 PolarHBondContact O-N 2.9Å; E207-M210 HydrophobicContact CG-CE 4.23Å; E207-M210 PolarHBondContact O-N 3.14Å; E207-L211 WeakPolarHBondContact O-CB 3.45Å; E207-L211 PolarHBondContact O-N 2.94Å |
| 208 | M | 97.2 | Very high | 97 | Very high | 84 Ų | 84 | 100.1 Ų | 100.1 | 41% | 0.414 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.8 | -41.3 | 175.7 | -74.4 | -66.9 | 132 | 0 | 0 | 112.1 | F204 K206 L211 Q212 | F204-M208 HydrophobicContact CD1-CG 4.01Å; F204-M208 HydrophobicContact CE1-CE 4.37Å; F204-M208 HydrophobicContact CE1-CG 3.64Å; F204-M208 HydrophobicContact CE1-SD 4.4Å; F204-M208 HydrophobicContact CE2-CE 3.68Å; F204-M208 HydrophobicContact CE2-CG 4.38Å; F204-M208 HydrophobicContact CZ-CE 3.6Å; F204-M208 HydrophobicContact CZ-CG 3.86Å; F204-M208 HydrophobicContact CZ-SD 4.13Å; F204-M208 WeakPolarHBondContact O-CB 3.38Å; F204-M208 VanDerWaalsContact O-CG 3.32Å; F204-M208 WeakPolarHBondContact O-CG 3.45Å; F204-M208 PolarHBondContact O-N 3.11Å; K206-M208 PolarHBondContact O-N 3.03Å; M208-L211 HydrophobicContact CE-CD2 4.43Å; M208-L211 PolarHBondContact O-N 3.39Å; M208-Q212 WeakPolarHBondContact O-CB 3.21Å; M208-Q212 PolarHBondContact O-N 3.32Å |
| 209 | A | 97.7 | Very high | 96.8 | Very high | 55 Ų | 55 | 99.7 Ų | 99.7 | 46% | 0.455 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65 | -39.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | K205 K206 E207 K213 | K205-A209 WeakPolarHBondContact O-CB 3.29Å; K205-A209 PolarHBondContact O-N 3.03Å; K206-A209 PolarHBondContact O-N 2.9Å; E207-A209 VanDerWaalsContact C-N 3.34Å; E207-A209 PolarHBondContact O-N 2.9Å; A209-K213 WeakPolarHBondContact O-CB 3.4Å; A209-K213 PolarHBondContact O-N 3.49Å |
| 210 | M | 97.3 | Very high | 96.6 | Very high | 123 Ų | 123 | 103.2 Ų | 103.2 | 61% | 0.606 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -65.3 | -43.2 | 174.9 | -72.3 | -171.9 | -67.9 | 0 | 0 | 111.7 | K206 E207 K213 K214 | K206-M210 WeakPolarHBondContact O-CG 3.33Å; K206-M210 PolarHBondContact O-N 3.09Å; E207-M210 HydrophobicContact CG-CE 4.23Å; E207-M210 PolarHBondContact O-N 3.14Å; M210-K213 PolarHBondContact O-N 2.92Å; M210-K214 WeakPolarHBondContact O-CB 3.32Å; M210-K214 PolarHBondContact O-N 3.38Å |
| 211 | L | 97.3 | Very high | 96.4 | Very high | 86 Ų | 86 | 106.2 Ų | 106.2 | 45% | 0.45 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.4 | -46.3 | 176.2 | -179.3 | 62.2 | 0 | 0 | 0 | 111.1 | E207 M208 K213 K214 I215 | E207-L211 WeakPolarHBondContact O-CB 3.45Å; E207-L211 PolarHBondContact O-N 2.94Å; M208-L211 HydrophobicContact CE-CD2 4.43Å; M208-L211 PolarHBondContact O-N 3.39Å; L211-K213 VanDerWaalsContact C-N 3.32Å; L211-K213 PolarHBondContact O-N 2.85Å; L211-K214 WeakPolarHBondContact O-CB 3.46Å; L211-K214 PolarHBondContact O-N 2.88Å; L211-I215 HydrophobicContact CD1-CD1 4.27Å; L211-I215 HydrophobicContact CD1-CG1 4.44Å; L211-I215 HydrophobicContact CG-CD1 4.06Å; L211-I215 WeakPolarHBondContact O-CG1 3.44Å; L211-I215 PolarHBondContact O-N 3.41Å |
| 212 | Q | 96.4 | Very high | 96.2 | Very high | 145 Ų | 145 | 107.8 Ų | 107.8 | 68% | 0.678 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -58.1 | -45.1 | 175.9 | -174.3 | -179.1 | 7.1 | 0 | 0 | 111.5 | M208 K214 I215 M216 | M208-Q212 WeakPolarHBondContact O-CB 3.21Å; M208-Q212 PolarHBondContact O-N 3.32Å; Q212-K214 PolarHBondContact O-N 3.49Å; Q212-I215 PolarHBondContact O-N 2.89Å; Q212-M216 PolarHBondContact O-N 3.45Å |
| 213 | K | 97 | Very high | 95.9 | Very high | 127 Ų | 127 | 110.1 Ų | 110.1 | 55% | 0.552 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -61.8 | -42.2 | 176.2 | -176.8 | 177.3 | 178.9 | -179.4 | 0 | 112 | A209 M210 L211 M216 M217 | A209-K213 WeakPolarHBondContact O-CB 3.4Å; A209-K213 PolarHBondContact O-N 3.49Å; M210-K213 PolarHBondContact O-N 2.92Å; L211-K213 VanDerWaalsContact C-N 3.32Å; L211-K213 PolarHBondContact O-N 2.85Å; K213-M216 PolarHBondContact O-N 2.88Å; K213-M217 HydrophobicContact CD-CE 4.43Å; K213-M217 VanDerWaalsContact CE-CE 3.43Å; K213-M217 HydrophobicContact CG-CE 4.19Å; K213-M217 WeakPolarHBondContact O-CG 3.38Å; K213-M217 PolarHBondContact O-N 3.39Å; K213-M217 VanDerWaalsContact O-N 3.1Å |
| 214 | K | 96.7 | Very high | 95.6 | Very high | 122 Ų | 122 | 107.3 Ų | 107.3 | 53% | 0.53 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.5 | -48.4 | 178 | -177.9 | 177.5 | 173.6 | -177.6 | 0 | 111.5 | M210 L211 Q212 M216 M217 E218 | M210-K214 WeakPolarHBondContact O-CB 3.32Å; M210-K214 PolarHBondContact O-N 3.38Å; L211-K214 WeakPolarHBondContact O-CB 3.46Å; L211-K214 PolarHBondContact O-N 2.88Å; Q212-K214 PolarHBondContact O-N 3.49Å; K214-M216 VanDerWaalsContact C-N 3.32Å; K214-M216 PolarHBondContact O-N 3.21Å; K214-M217 PolarHBondContact O-N 2.91Å; K214-E218 WeakPolarHBondContact CE-OE1 3.42Å; K214-E218 IonicContact NZ-OE1 3.93Å; K214-E218 WeakPolarHBondContact O-CG 3.34Å; K214-E218 PolarHBondContact O-N 3.35Å |
| 215 | I | 95.5 | Very high | 95.4 | Very high | 89 Ų | 89 | 104 Ų | 104 | 46% | 0.456 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -56.5 | -47.8 | 176.7 | -69.4 | 168.4 | 0 | 0 | 0 | 110.3 | L211 Q212 M217 E218 T219 | L211-I215 HydrophobicContact CD1-CD1 4.27Å; L211-I215 HydrophobicContact CD1-CG1 4.44Å; L211-I215 HydrophobicContact CG-CD1 4.06Å; L211-I215 WeakPolarHBondContact O-CG1 3.44Å; L211-I215 PolarHBondContact O-N 3.41Å; Q212-I215 PolarHBondContact O-N 2.89Å; I215-M217 VanDerWaalsContact C-N 3.34Å; I215-M217 PolarHBondContact O-N 3.44Å; I215-E218 PolarHBondContact O-N 3.49Å; I215-T219 PolarHBondContact O-N 3.33Å; I215-T219 PolarHBondContact O-OG1 3.26Å |
| 216 | M | 95.9 | Very high | 95 | Very high | 121 Ų | 121 | 102 Ų | 102 | 60% | 0.596 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -59.3 | -42.4 | 179.6 | -172.1 | -179.2 | 71.4 | 0 | 0 | 112.6 | Q212 K213 K214 Q220 | Q212-M216 PolarHBondContact O-N 3.45Å; K213-M216 PolarHBondContact O-N 2.88Å; K214-M216 VanDerWaalsContact C-N 3.32Å; K214-M216 PolarHBondContact O-N 3.21Å; M216-Q220 WeakPolarHBondContact O-CB 3.44Å; M216-Q220 PolarHBondContact O-N 2.88Å |
| 217 | M | 95.5 | Very high | 94.6 | Very high | 104 Ų | 104 | 99.2 Ų | 99.2 | 51% | 0.512 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.6 | -43.4 | 176.3 | -73.2 | -177.9 | 173.1 | 0 | 0 | 112.3 | K213 K214 I215 Q220 Q221 | K213-M217 HydrophobicContact CD-CE 4.43Å; K213-M217 VanDerWaalsContact CE-CE 3.43Å; K213-M217 HydrophobicContact CG-CE 4.19Å; K213-M217 WeakPolarHBondContact O-CG 3.38Å; K213-M217 PolarHBondContact O-N 3.39Å; K213-M217 VanDerWaalsContact O-N 3.1Å; K214-M217 PolarHBondContact O-N 2.91Å; I215-M217 VanDerWaalsContact C-N 3.34Å; I215-M217 PolarHBondContact O-N 3.44Å; M217-Q220 PolarHBondContact O-N 2.83Å; M217-Q221 WeakPolarHBondContact O-CB 3.31Å; M217-Q221 PolarHBondContact O-N 3.47Å |
| 218 | E | 95.1 | Very high | 94.1 | Very high | 106 Ų | 106 | 101.9 Ų | 101.9 | 50% | 0.495 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64 | -43.2 | 178.2 | -73.7 | 175 | 177.2 | 0 | 0 | 111.6 | K214 I215 Q221 Q222 | K214-E218 WeakPolarHBondContact CE-OE1 3.42Å; K214-E218 IonicContact NZ-OE1 3.93Å; K214-E218 WeakPolarHBondContact O-CG 3.34Å; K214-E218 PolarHBondContact O-N 3.35Å; I215-E218 PolarHBondContact O-N 3.49Å; E218-Q221 PolarHBondContact O-N 3.29Å; E218-Q222 WeakPolarHBondContact O-CB 3.33Å; E218-Q222 PolarHBondContact O-N 2.91Å |
| 219 | T | 94.7 | Very high | 93.8 | Very high | 62 Ų | 62 | 105.2 Ų | 105.2 | 38% | 0.38 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.5 | -47.4 | 174.6 | -56.4 | 0 | 0 | 0 | 0 | 111.3 | I215 Q221 Q222 E223 | I215-T219 PolarHBondContact O-N 3.33Å; I215-T219 PolarHBondContact O-OG1 3.26Å; T219-Q221 VanDerWaalsContact C-N 3.31Å; T219-Q221 PolarHBondContact O-N 3.04Å; T219-Q222 WeakPolarHBondContact O-CB 3.22Å; T219-Q222 PolarHBondContact O-N 3.39Å; T219-E223 WeakPolarHBondContact O-CG 3.37Å; T219-E223 PolarHBondContact O-N 3.26Å |
| 220 | Q | 92.8 | Very high | 93.3 | Very high | 111 Ų | 111 | 105.4 Ų | 105.4 | 52% | 0.519 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.2 | -40.7 | 177.6 | -171.7 | -179.9 | 3.2 | 0 | 0 | 111.7 | M216 M217 E223 I224 | M216-Q220 WeakPolarHBondContact O-CB 3.44Å; M216-Q220 PolarHBondContact O-N 2.88Å; M217-Q220 PolarHBondContact O-N 2.83Å; Q220-E223 PolarHBondContact O-N 2.9Å; Q220-I224 HydrophobicContact CG-CD1 4.13Å; Q220-I224 VanDerWaalsContact O-CG1 3.26Å; Q220-I224 WeakPolarHBondContact O-CG1 3.46Å; Q220-I224 PolarHBondContact O-N 3.5Å |
| 221 | Q | 92.8 | Very high | 92.7 | Very high | 114 Ų | 114 | 104 Ų | 104 | 53% | 0.533 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65 | -39.6 | 176.6 | -172.3 | 63.3 | 24.1 | 0 | 0 | 111.8 | M217 E218 T219 I224 A225 | M217-Q221 WeakPolarHBondContact O-CB 3.31Å; M217-Q221 PolarHBondContact O-N 3.47Å; E218-Q221 PolarHBondContact O-N 3.29Å; T219-Q221 VanDerWaalsContact C-N 3.31Å; T219-Q221 PolarHBondContact O-N 3.04Å; Q221-I224 PolarHBondContact O-N 3.4Å; Q221-A225 WeakPolarHBondContact O-CB 3.26Å; Q221-A225 PolarHBondContact O-N 3.34Å |
| 222 | Q | 93.2 | Very high | 92.1 | Very high | 143 Ų | 143 | 105.8 Ų | 105.8 | 67% | 0.668 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -64.6 | -41.6 | 175.3 | -174.1 | 177.4 | 0.4 | 0 | 0 | 111.7 | E218 T219 A225 S226 | E218-Q222 WeakPolarHBondContact O-CB 3.33Å; E218-Q222 PolarHBondContact O-N 2.91Å; T219-Q222 WeakPolarHBondContact O-CB 3.22Å; T219-Q222 PolarHBondContact O-N 3.39Å; Q222-A225 PolarHBondContact O-N 2.92Å; Q222-S226 WeakPolarHBondContact O-CB 3.43Å; Q222-S226 PolarHBondContact O-N 3.47Å |
| 223 | E | 91.6 | Very high | 91.7 | Very high | 122 Ų | 122 | 102.7 Ų | 102.7 | 57% | 0.57 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -62.1 | -47.8 | 174.3 | -73.5 | 177.8 | -179.7 | 0 | 0 | 111.7 | T219 Q220 A225 S226 V227 | T219-E223 WeakPolarHBondContact O-CG 3.37Å; T219-E223 PolarHBondContact O-N 3.26Å; Q220-E223 PolarHBondContact O-N 2.9Å; E223-A225 VanDerWaalsContact C-N 3.3Å; E223-A225 PolarHBondContact O-N 2.89Å; E223-S226 WeakPolarHBondContact O-CB 3.49Å; E223-S226 PolarHBondContact O-N 3.2Å; E223-V227 WeakPolarHBondContact O-CG2 3.47Å; E223-V227 PolarHBondContact O-N 3.45Å |
| 224 | I | 92.1 | Very high | 90.9 | Very high | 63 Ų | 63 | 103.3 Ų | 103.3 | 32% | 0.323 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -59.4 | -42.9 | 176.5 | -68.5 | 165.8 | 0 | 0 | 0 | 110.8 | Q220 Q221 V227 R228 | Q220-I224 HydrophobicContact CG-CD1 4.13Å; Q220-I224 VanDerWaalsContact O-CG1 3.26Å; Q220-I224 WeakPolarHBondContact O-CG1 3.46Å; Q220-I224 PolarHBondContact O-N 3.5Å; Q221-I224 PolarHBondContact O-N 3.4Å; I224-V227 PolarHBondContact O-N 2.99Å; I224-R228 WeakPolarHBondContact O-CG 3.29Å; I224-R228 PolarHBondContact O-N 3.45Å |
| 225 | A | 91.6 | Very high | 89.9 | Confident | 51 Ų | 51 | 104.3 Ų | 104.3 | 42% | 0.421 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -63.9 | -41.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q221 Q222 E223 R228 K229 | Q221-A225 WeakPolarHBondContact O-CB 3.26Å; Q221-A225 PolarHBondContact O-N 3.34Å; Q222-A225 PolarHBondContact O-N 2.92Å; E223-A225 VanDerWaalsContact C-N 3.3Å; E223-A225 PolarHBondContact O-N 2.89Å; A225-R228 PolarHBondContact O-N 3.31Å; A225-K229 WeakPolarHBondContact O-CB 3.49Å; A225-K229 PolarHBondContact O-N 3.2Å |
| 226 | S | 90.2 | Very high | 88.1 | Confident | 70 Ų | 70 | 110.9 Ų | 110.9 | 49% | 0.49 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -60.8 | -48.6 | 175 | -175.2 | 0 | 0 | 0 | 0 | 111.5 | Q222 E223 R228 K229 S230 | Q222-S226 WeakPolarHBondContact O-CB 3.43Å; Q222-S226 PolarHBondContact O-N 3.47Å; E223-S226 WeakPolarHBondContact O-CB 3.49Å; E223-S226 PolarHBondContact O-N 3.2Å; S226-R228 PolarHBondContact O-N 2.83Å; S226-K229 PolarHBondContact O-N 3.36Å; S226-K229 VanDerWaalsContact O-N 3.16Å; S226-S230 PolarHBondContact O-N 2.88Å; S226-S230 PolarHBondContact O-OG 2.85Å |
| 227 | V | 88.5 | Confident | 87.8 | Confident | 85 Ų | 85 | 110.4 Ų | 110.4 | 52% | 0.515 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -59.1 | -45.6 | 176.8 | 171.8 | 0 | 0 | 0 | 0 | 111.2 | E223 I224 K229 S230 L231 | E223-V227 WeakPolarHBondContact O-CG2 3.47Å; E223-V227 PolarHBondContact O-N 3.45Å; I224-V227 PolarHBondContact O-N 2.99Å; V227-K229 VanDerWaalsContact C-N 3.33Å; V227-K229 PolarHBondContact O-N 3.31Å; V227-S230 PolarHBondContact O-N 3.45Å; V227-L231 HydrophobicContact CG1-CD1 3.88Å; V227-L231 HydrophobicContact CG1-CG 4.43Å; V227-L231 WeakPolarHBondContact O-CB 3.44Å; V227-L231 VanDerWaalsContact O-CG 3.31Å; V227-L231 WeakPolarHBondContact O-CG 3.32Å; V227-L231 PolarHBondContact O-N 3.14Å |
| 228 | R | 87 | Confident | 87.4 | Confident | 156 Ų | 156 | 110.7 Ų | 110.7 | 59% | 0.589 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -59.4 | -43.6 | 175.9 | -77.4 | -179.7 | -174.2 | 168 | 3.1 | 112.1 | I224 A225 S226 L231 Q232 | I224-R228 WeakPolarHBondContact O-CG 3.29Å; I224-R228 PolarHBondContact O-N 3.45Å; A225-R228 PolarHBondContact O-N 3.31Å; S226-R228 PolarHBondContact O-N 2.83Å; R228-L231 PolarHBondContact O-N 3.23Å; R228-Q232 WeakPolarHBondContact O-CG 3.19Å; R228-Q232 PolarHBondContact O-N 2.99Å |
| 229 | K | 90.2 | Very high | 86.9 | Confident | 155 Ų | 155 | 111 Ų | 111 | 67% | 0.674 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -64.3 | -44.3 | 179.1 | -167.9 | 178.6 | -179.6 | -177.6 | 0 | 111.4 | A225 S226 V227 L231 Q232 S233 | A225-K229 WeakPolarHBondContact O-CB 3.49Å; A225-K229 PolarHBondContact O-N 3.2Å; S226-K229 PolarHBondContact O-N 3.36Å; S226-K229 VanDerWaalsContact O-N 3.16Å; V227-K229 VanDerWaalsContact C-N 3.33Å; V227-K229 PolarHBondContact O-N 3.31Å; K229-L231 PolarHBondContact O-N 2.92Å; K229-Q232 PolarHBondContact O-N 2.98Å; K229-S233 PolarHBondContact O-N 3.26Å; K229-S233 PolarHBondContact O-OG 3.48Å |
| 230 | S | 88.6 | Confident | 86.5 | Confident | 59 Ų | 59 | 113.9 Ų | 113.9 | 41% | 0.413 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -62.6 | -40 | 176.1 | -61.9 | 0 | 0 | 0 | 0 | 112.5 | S226 V227 S233 M234 | S226-S230 PolarHBondContact O-N 2.88Å; S226-S230 PolarHBondContact O-OG 2.85Å; V227-S230 PolarHBondContact O-N 3.45Å; S230-S233 WeakPolarHBondContact CA-OG 3.4Å; S230-S233 PolarHBondContact O-N 3.46Å; S230-S233 PolarHBondContact O-OG 3.23Å; S230-M234 PolarHBondContact O-N 2.9Å |
| 231 | L | 85.1 | Confident | 86.1 | Confident | 92 Ų | 92 | 114.1 Ų | 114.1 | 48% | 0.482 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -64.7 | -43.6 | 174.2 | -73.8 | 167.3 | 0 | 0 | 0 | 111.9 | V227 R228 K229 S233 M234 L235 | V227-L231 HydrophobicContact CG1-CD1 3.88Å; V227-L231 HydrophobicContact CG1-CG 4.43Å; V227-L231 WeakPolarHBondContact O-CB 3.44Å; V227-L231 VanDerWaalsContact O-CG 3.31Å; V227-L231 WeakPolarHBondContact O-CG 3.32Å; V227-L231 PolarHBondContact O-N 3.14Å; R228-L231 PolarHBondContact O-N 3.23Å; K229-L231 PolarHBondContact O-N 2.92Å; L231-S233 VanDerWaalsContact C-N 3.35Å; L231-S233 PolarHBondContact O-N 3.39Å; L231-M234 HydrophobicContact CD2-CE 3.94Å; L231-M234 PolarHBondContact O-N 3.38Å; L231-M234 VanDerWaalsContact O-N 3.15Å; L231-L235 PolarHBondContact O-N 3.28Å |
| 232 | Q | 84.1 | Confident | 85.6 | Confident | 125 Ų | 125 | 114.1 Ų | 114.1 | 58% | 0.584 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -61.2 | -42.2 | 175.9 | -79.4 | 179.4 | -21.8 | 0 | 0 | 112.1 | R228 K229 M234 L235 F236 | R228-Q232 WeakPolarHBondContact O-CG 3.19Å; R228-Q232 PolarHBondContact O-N 2.99Å; K229-Q232 PolarHBondContact O-N 2.98Å; Q232-M234 PolarHBondContact O-N 2.97Å; Q232-L235 PolarHBondContact O-N 3.08Å; Q232-L235 VanDerWaalsContact O-N 3.15Å; Q232-F236 PolarHBondContact O-N 3.31Å |
| 233 | S | 86.5 | Confident | 85.1 | Confident | 80 Ų | 80 | 112 Ų | 112 | 56% | 0.559 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -68.6 | -10.1 | 176.3 | 55.9 | 0 | 0 | 0 | 0 | 114.9 | K229 S230 L231 | K229-S233 PolarHBondContact O-N 3.26Å; K229-S233 PolarHBondContact O-OG 3.48Å; S230-S233 WeakPolarHBondContact CA-OG 3.4Å; S230-S233 PolarHBondContact O-N 3.46Å; S230-S233 PolarHBondContact O-OG 3.23Å; L231-S233 VanDerWaalsContact C-N 3.35Å; L231-S233 PolarHBondContact O-N 3.39Å |
| 234 | M | 81.5 | Confident | 84.6 | Confident | 140 Ų | 140 | 111.2 Ų | 111.2 | 69% | 0.69 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -92.8 | -19 | 172.4 | -77.5 | -172.4 | -76.3 | 0 | 0 | 112.9 | S230 L231 Q232 | S230-M234 PolarHBondContact O-N 2.9Å; L231-M234 HydrophobicContact CD2-CE 3.94Å; L231-M234 PolarHBondContact O-N 3.38Å; L231-M234 VanDerWaalsContact O-N 3.15Å; Q232-M234 PolarHBondContact O-N 2.97Å |
| 235 | L | 75.6 | Confident | 84 | Confident | 142 Ų | 142 | 115.3 Ų | 115.3 | 74% | 0.743 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -98 | -16.9 | -176.4 | -66.7 | 173.1 | 0 | 0 | 0 | 113.4 | L231 Q232 | L231-L235 PolarHBondContact O-N 3.28Å; Q232-L235 PolarHBondContact O-N 3.08Å; Q232-L235 VanDerWaalsContact O-N 3.15Å |
| 236 | F | 58.5 | Low | 83.3 | Confident | 228 Ų | 228 | 121.1 Ų | 121.1 | 100% | 1 | 61% | 0.613 | S | S | * | * | trans | -128.8 | 0 | 176.8 | -62.2 | -76.4 | 0 | 0 | 0 | 109.6 | Q232 | Q232-F236 PolarHBondContact O-N 3.31Š|
Retrieved 236 of 236 residues in 1348.6 ms
(Link to these results)