| 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 | 48.1 | Very low | 56.5 | Low | 256 Ų | 256 | 139.7 Ų | 139.7 | 100% | 1.261 | 84% | 0.836 | S | S | * | * | 0 | 110.7 | 0 | -70.4 | 175.3 | 179.4 | 0 | 0 | 106.9 | |||||
| 2 | Q | 50.4 | Low | 55.9 | Low | 189 Ų | 189 | 137.8 Ų | 137.8 | 88% | 0.883 | 83% | 0.829 | S | S | * | * | trans | -126 | 135.6 | -176.4 | -167.9 | 156.1 | -9.5 | 0 | 0 | 107.1 | ||||
| 3 | P | 60.4 | Low | 55.2 | Low | 113 Ų | 113 | 137.9 Ų | 137.9 | 73% | 0.734 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -73 | 154 | -171.2 | 28.5 | -33.2 | 0 | 0 | 0 | 112 | ||
| 4 | P | 56.8 | Low | 54.7 | Low | 130 Ų | 130 | 137.6 Ų | 137.6 | 84% | 0.844 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 137.4 | -179.7 | 29.5 | -32 | 0 | 0 | 0 | 111 | ||
| 5 | G | 66.9 | Low | 54.2 | Low | 66 Ų | 66 | 132.7 Ų | 132.7 | 68% | 0.68 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 160.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||
| 6 | P | 67.9 | Low | 53.6 | Low | 122 Ų | 122 | 131.8 Ų | 131.8 | 79% | 0.792 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -72 | 153.8 | -176.7 | 29.6 | -33.4 | 0 | 0 | 0 | 112.5 | ||
| 7 | P | 60.5 | Low | 53 | Low | 118 Ų | 118 | 135.3 Ų | 135.3 | 77% | 0.766 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -72.3 | 152.4 | 178.8 | 29.4 | -33.3 | 0 | 0 | 0 | 112.2 | ||
| 8 | P | 58 | Low | 52.8 | Low | 127 Ų | 127 | 134.2 Ų | 134.2 | 83% | 0.825 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 132.9 | -179.9 | 27 | -32 | 0 | 0 | 0 | 111.6 | ||
| 9 | A | 50.8 | Low | 52.3 | Low | 100 Ų | 100 | 137.3 Ų | 137.3 | 83% | 0.826 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 125.4 | 171.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | A11 | A9-A11 PolarHBondContact O-N 3.31Š|
| 10 | Y | 48.4 | Very low | 52.2 | Low | 236 Ų | 236 | 136.9 Ų | 136.9 | 93% | 0.925 | 80% | 0.8 | S | S | * | * | trans | -65.6 | 112.9 | 168.9 | -112 | -96.2 | 0 | 0 | 0 | 108.9 | ||||
| 11 | A | 53.8 | Low | 51.9 | Low | 80 Ų | 80 | 135.3 Ų | 135.3 | 66% | 0.661 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -94.7 | 125.4 | 167.8 | 0 | 0 | 0 | 0 | 0 | 108.5 | A9 T13 | A9-A11 PolarHBondContact O-N 3.31Å; A11-T13 PolarHBondContact O-N 3.08Å |
| 12 | P | 48.5 | Very low | 52.1 | Low | 116 Ų | 116 | 129.2 Ų | 129.2 | 75% | 0.753 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -66 | 124 | 172.3 | 26.8 | -31.1 | 0 | 0 | 0 | 109.2 | N14 | P12-N14 PolarHBondContact O-N 3.14Š|
| 13 | T | 47.2 | Very low | 51.8 | Low | 140 Ų | 140 | 123.6 Ų | 123.6 | 86% | 0.859 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 118.1 | 169.4 | 39 | 0 | 0 | 0 | 0 | 108.9 | A11 G15 | A11-T13 PolarHBondContact O-N 3.08Å; T13-G15 VanDerWaalsContact C-N 3.28Å; T13-G15 PolarHBondContact O-N 3.16Å |
| 14 | N | 47.8 | Very low | 50.9 | Low | 133 Ų | 133 | 125.6 Ų | 125.6 | 71% | 0.711 | 77% | 0.769 | S | S | * | * | trans | -61.9 | 86.8 | 172.7 | -65.2 | -19.3 | 0 | 0 | 0 | 110.1 | P12 D16 | P12-N14 PolarHBondContact O-N 3.14Å; N14-D16 PolarHBondContact O-N 3.36Å; N14-D16 VanDerWaalsContact O-N 3.12Å | ||
| 15 | G | 47.8 | Very low | 50.5 | Low | 64 Ų | 64 | 124.4 Ų | 124.4 | 66% | 0.66 | 77% | 0.77 | S | S | * | * | trans | -73.8 | 77.1 | 149 | 0 | 0 | 0 | 0 | 0 | 107.3 | T13 F17 | T13-G15 VanDerWaalsContact C-N 3.28Å; T13-G15 PolarHBondContact O-N 3.16Å; G15-F17 PolarHBondContact O-N 3.01Å; G15-F17 VanDerWaalsContact O-N 3.11Å | ||
| 16 | D | 44.3 | Very low | 49.3 | Very low | 118 Ų | 118 | 129.4 Ų | 129.4 | 63% | 0.631 | 78% | 0.776 | S | S | * | * | trans | -61 | 108.3 | 179.1 | -87.7 | -34.2 | 0 | 0 | 0 | 109.7 | N14 T18 | N14-D16 PolarHBondContact O-N 3.36Å; N14-D16 VanDerWaalsContact O-N 3.12Å; D16-T18 VanDerWaalsContact C-N 3.26Å; D16-T18 HydrophobicContact CB-CG2 4.44Å; D16-T18 PolarHBondContact O-N 2.87Å | ||
| 17 | F | 44.1 | Very low | 48.5 | Very low | 192 Ų | 192 | 131.8 Ų | 131.8 | 84% | 0.842 | 78% | 0.782 | S | S | * | * | trans | -70.6 | 85.4 | 161.2 | -74.6 | -89.2 | 0 | 0 | 0 | 108.4 | G15 F19 | G15-F17 PolarHBondContact O-N 3.01Å; G15-F17 VanDerWaalsContact O-N 3.11Å; F17-F19 HydrophobicContact CB-CE2 4.4Å; F17-F19 PolarHBondContact O-N 3.02Å | ||
| 18 | T | 48.7 | Very low | 47.7 | Very low | 116 Ų | 116 | 134.1 Ų | 134.1 | 71% | 0.712 | 79% | 0.787 | S | S | * | * | trans | -78.8 | 102.9 | 171.7 | 39.5 | 0 | 0 | 0 | 0 | 110.4 | D16 V20 | D16-T18 VanDerWaalsContact C-N 3.26Å; D16-T18 HydrophobicContact CB-CG2 4.44Å; D16-T18 PolarHBondContact O-N 2.87Å; T18-V20 PolarHBondContact O-N 3.28Å | ||
| 19 | F | 43.8 | Very low | 47.6 | Very low | 193 Ų | 193 | 134.1 Ų | 134.1 | 85% | 0.846 | 79% | 0.79 | S | S | * | * | trans | -73.6 | 112.5 | 162.3 | -68.3 | -87.8 | 0 | 0 | 0 | 108.6 | F17 S21 | F17-F19 HydrophobicContact CB-CE2 4.4Å; F17-F19 PolarHBondContact O-N 3.02Å; F19-S21 PolarHBondContact O-N 3.42Å | ||
| 20 | V | 49.3 | Very low | 47.3 | Very low | 129 Ų | 129 | 132.4 Ų | 132.4 | 78% | 0.782 | 78% | 0.783 | S | S | * | * | trans | -79.2 | 110.4 | 173.4 | -178.8 | 0 | 0 | 0 | 0 | 108.3 | T18 | T18-V20 PolarHBondContact O-N 3.28Š| ||
| 21 | S | 46.1 | Very low | 47.3 | Very low | 103 Ų | 103 | 127 Ų | 127 | 72% | 0.72 | 78% | 0.779 | S | S | * | * | trans | -77.1 | 116 | 174.1 | -173.9 | 0 | 0 | 0 | 0 | 109.8 | F19 A23 | F19-S21 PolarHBondContact O-N 3.42Å; S21-A23 VanDerWaalsContact C-N 3.27Å; S21-A23 PolarHBondContact O-N 2.88Å | ||
| 22 | S | 52.3 | Low | 47.1 | Very low | 129 Ų | 129 | 130.3 Ų | 130.3 | 90% | 0.902 | 78% | 0.784 | S | S | * | * | trans | -75.4 | 70.6 | 176.3 | -58.5 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 23 | A | 45.3 | Very low | 47.1 | Very low | 71 Ų | 71 | 129 Ų | 129 | 59% | 0.587 | 78% | 0.783 | S | S | * | * | trans | -111.2 | -14 | 179.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | S21 | S21-A23 VanDerWaalsContact C-N 3.27Å; S21-A23 PolarHBondContact O-N 2.88Å | ||
| 24 | D | 41.2 | Very low | 47 | Very low | 155 Ų | 155 | 127.2 Ų | 127.2 | 83% | 0.829 | 78% | 0.776 | S | S | * | * | trans | -123.1 | 85.8 | -177.9 | -64.2 | -56.6 | 0 | 0 | 0 | 110.7 | E26 | D24-E26 PolarHBondContact O-N 3.26Š| ||
| 25 | A | 47.3 | Very low | 47 | Very low | 105 Ų | 105 | 125.9 Ų | 125.9 | 87% | 0.868 | 78% | 0.775 | S | S | * | * | trans | -81.5 | 93.2 | 165 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 26 | E | 42.3 | Very low | 47 | Very low | 171 Ų | 171 | 131.2 Ų | 131.2 | 80% | 0.799 | 79% | 0.788 | S | S | * | * | trans | -81.1 | 126.8 | 162.1 | -72.3 | -173.6 | 114.5 | 0 | 0 | 109.3 | D24 L28 | D24-E26 PolarHBondContact O-N 3.26Å; E26-L28 PolarHBondContact O-N 3.39Å | ||
| 27 | D | 50.9 | Low | 47.1 | Very low | 172 Ų | 172 | 130.7 Ų | 130.7 | 92% | 0.92 | 79% | 0.789 | S | S | * | * | trans | -57.1 | 90.3 | 177.5 | -88.5 | -54.6 | 0 | 0 | 0 | 111.7 | S29 | D27-S29 PolarHBondContact O-N 3.19Å; D27-S29 VanDerWaalsContact O-N 3.12Å | ||
| 28 | L | 44.6 | Very low | 46.9 | Very low | 166 Ų | 166 | 131.2 Ų | 131.2 | 87% | 0.869 | 79% | 0.791 | S | S | * | * | trans | -81.5 | 87.4 | 167.3 | -92.1 | 104.3 | 0 | 0 | 0 | 110.4 | E26 G30 | E26-L28 PolarHBondContact O-N 3.39Å; L28-G30 PolarHBondContact O-N 2.98Å | ||
| 29 | S | 55.1 | Low | 46.7 | Very low | 127 Ų | 127 | 133 Ų | 133 | 89% | 0.888 | 80% | 0.795 | S | S | * | * | trans | -68.4 | 103.6 | 157.8 | -175.5 | 0 | 0 | 0 | 0 | 109.2 | D27 | D27-S29 PolarHBondContact O-N 3.19Å; D27-S29 VanDerWaalsContact O-N 3.12Å | ||
| 30 | G | 43.7 | Very low | 46.5 | Very low | 65 Ų | 65 | 131.5 Ų | 131.5 | 67% | 0.67 | 80% | 0.796 | S | S | * | * | trans | -119 | 116.5 | 174 | 0 | 0 | 0 | 0 | 0 | 110.3 | L28 | L28-G30 PolarHBondContact O-N 2.98Š| ||
| 31 | S | 50 | Low | 46.3 | Very low | 121 Ų | 121 | 133.4 Ų | 133.4 | 85% | 0.846 | 80% | 0.801 | S | S | * | * | trans | -66.9 | 129.1 | 171.8 | -178 | 0 | 0 | 0 | 0 | 110.3 | A33 | S31-A33 PolarHBondContact O-N 3.29Š| ||
| 32 | I | 49.3 | Very low | 45.7 | Very low | 150 Ų | 150 | 132 Ų | 132 | 77% | 0.769 | 80% | 0.802 | S | S | * | * | trans | -73.7 | 105.6 | 169.5 | -75.6 | 172.7 | 0 | 0 | 0 | 107.8 | ||||
| 33 | A | 48.8 | Very low | 44.9 | Very low | 89 Ų | 89 | 129.4 Ų | 129.4 | 74% | 0.736 | 80% | 0.796 | S | S | * | * | trans | -84.6 | 110.2 | 157.4 | 0 | 0 | 0 | 0 | 0 | 107.7 | S31 P35 | S31-A33 PolarHBondContact O-N 3.29Å; A33-P35 WeakPolarHBondContact O-CD 3.47Å | ||
| 34 | S | 44.8 | Very low | 44.8 | Very low | 102 Ų | 102 | 133.7 Ų | 133.7 | 71% | 0.713 | 81% | 0.81 | S | S | * | * | trans | -69 | 123.8 | 171.1 | -50.5 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 35 | P | 48.5 | Very low | 44.6 | Very low | 106 Ų | 106 | 135.9 Ų | 135.9 | 69% | 0.688 | 81% | 0.812 | S | S | * | * | trans | -76.1 | 131.7 | 165.7 | 30.4 | -28.2 | 0 | 0 | 0 | 108.7 | A33 V37 | A33-P35 WeakPolarHBondContact O-CD 3.47Å; P35-V37 HydrophobicContact CG-CG2 4.4Å; P35-V37 PolarHBondContact O-N 3.09Å | ||
| 36 | D | 46.3 | Very low | 44.6 | Very low | 175 Ų | 175 | 138 Ų | 138 | 94% | 0.936 | 81% | 0.807 | S | S | * | * | trans | -65.8 | 100.2 | 169.6 | -110.5 | -55.8 | 0 | 0 | 0 | 109 | ||||
| 37 | V | 46.8 | Very low | 44.7 | Very low | 107 Ų | 107 | 139.7 Ų | 139.7 | 65% | 0.648 | 81% | 0.812 | S | S | * | * | trans | -99.5 | 108.5 | 176.1 | -178.9 | 0 | 0 | 0 | 0 | 109.2 | P35 L39 | P35-V37 HydrophobicContact CG-CG2 4.4Å; P35-V37 PolarHBondContact O-N 3.09Å; V37-L39 PolarHBondContact O-N 2.9Å | ||
| 38 | K | 40.2 | Very low | 44.8 | Very low | 203 Ų | 203 | 137.6 Ų | 137.6 | 88% | 0.883 | 80% | 0.796 | S | S | * | * | trans | -63.8 | 108.4 | 173 | -169.6 | 179.6 | -178 | -176.9 | 0 | 109.7 | N40 | K38-N40 PolarHBondContact O-N 3.27Š| ||
| 39 | L | 44.9 | Very low | 45.6 | Very low | 153 Ų | 153 | 133.3 Ų | 133.3 | 80% | 0.801 | 78% | 0.78 | S | S | * | * | trans | -71.3 | 114.6 | 177.2 | -63.8 | 173.9 | 0 | 0 | 0 | 110.2 | V37 | V37-L39 PolarHBondContact O-N 2.9Š| ||
| 40 | N | 38 | Very low | 46.1 | Very low | 163 Ų | 163 | 133.2 Ų | 133.2 | 87% | 0.872 | 78% | 0.775 | S | S | * | * | trans | -96.2 | 104.1 | 163.7 | -156.7 | -8 | 0 | 0 | 0 | 107.3 | K38 G42 | K38-N40 PolarHBondContact O-N 3.27Å; N40-G42 PolarHBondContact O-N 3.12Å | ||
| 41 | L | 46.5 | Very low | 47 | Very low | 169 Ų | 169 | 132.8 Ų | 132.8 | 89% | 0.885 | 77% | 0.765 | S | S | * | * | trans | -87.2 | 101.2 | -172.4 | -161.3 | 74.8 | 0 | 0 | 0 | 109.5 | ||||
| 42 | G | 31.9 | Very low | 47.7 | Very low | 72 Ų | 72 | 129 Ų | 129 | 74% | 0.742 | 74% | 0.737 | S | S | * | * | trans | -149.2 | 112.3 | 171.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | N40 | N40-G42 PolarHBondContact O-N 3.12Š| ||
| 43 | G | 35.6 | Very low | 48.7 | Very low | 75 Ų | 75 | 125.3 Ų | 125.3 | 77% | 0.773 | 72% | 0.721 | S | S | * | * | S | Bend | trans | 101.6 | 121.7 | 161.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | F45 | G43-F45 PolarHBondContact O-N 3.34Š|
| 44 | D | 43.6 | Very low | 49.9 | Very low | 162 Ų | 162 | 126 Ų | 126 | 87% | 0.866 | 71% | 0.708 | S | S | * | * | trans | -38.2 | 114.3 | 174.9 | -71 | -49.8 | 0 | 0 | 0 | 114.1 | ||||
| 45 | F | 38.4 | Very low | 51.2 | Low | 201 Ų | 201 | 124.2 Ų | 124.2 | 88% | 0.882 | 69% | 0.69 | S | S | * | * | trans | -148.5 | 140.5 | 156.4 | -105.7 | -87.5 | 0 | 0 | 0 | 109.5 | G43 K47 | G43-F45 PolarHBondContact O-N 3.34Å; F45-K47 PolarHBondContact O-N 3.23Å | ||
| 46 | I | 46.3 | Very low | 52.4 | Low | 149 Ų | 149 | 127.7 Ų | 127.7 | 76% | 0.764 | 69% | 0.689 | S | S | * | * | trans | -31.4 | 131.2 | 171.8 | -58.6 | -78.3 | 0 | 0 | 0 | 110.2 | E48 | I46-E48 PolarHBondContact O-N 3.21Š| ||
| 47 | K | 43.7 | Very low | 53.9 | Low | 206 Ų | 206 | 127.3 Ų | 127.3 | 90% | 0.896 | 68% | 0.682 | S | S | * | * | trans | -64.8 | 80.1 | 178.8 | -143.1 | -178.3 | -168.7 | -179.1 | 0 | 109 | F45 S49 | F45-K47 PolarHBondContact O-N 3.23Å; K47-S49 PolarHBondContact O-N 3.4Å | ||
| 48 | E | 53 | Low | 55.2 | Low | 128 Ų | 128 | 130.4 Ų | 130.4 | 60% | 0.598 | 68% | 0.682 | S | S | * | * | trans | -61.1 | 105.9 | 170.6 | -83.1 | -163.7 | 171.8 | 0 | 0 | 107.2 | I46 | I46-E48 PolarHBondContact O-N 3.21Š| ||
| 49 | S | 62.7 | Low | 56.6 | Low | 76 Ų | 76 | 123.7 Ų | 123.7 | 53% | 0.531 | 67% | 0.67 | S | S | . | * | trans | -61.6 | 138.9 | 177 | -174.4 | 0 | 0 | 0 | 0 | 108.1 | K47 A51 T52 | K47-S49 PolarHBondContact O-N 3.4Å; S49-A51 CarbonylContact O-C 3.57Å; S49-A51 PolarHBondContact O-N 3.09Å; S49-T52 PolarHBondContact O-N 2.84Å; S49-T52 PolarHBondContact O-OG1 2.99Å | ||
| 50 | T | 64.3 | Low | 57.9 | Low | 125 Ų | 125 | 122.8 Ų | 122.8 | 77% | 0.767 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -48.2 | -27 | -179.8 | -50.6 | 0 | 0 | 0 | 0 | 113.5 | F54 | T50-F54 WeakPolarHBondContact O-CB 3.45Å; T50-F54 PolarHBondContact O-N 3.35Å |
| 51 | A | 63.5 | Low | 59.3 | Low | 57 Ų | 57 | 115.6 Ų | 115.6 | 47% | 0.471 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -62.9 | -38.7 | 172 | 0 | 0 | 0 | 0 | 0 | 114.3 | S49 F54 L55 | S49-A51 CarbonylContact O-C 3.57Å; S49-A51 PolarHBondContact O-N 3.09Å; A51-F54 PolarHBondContact O-N 3.01Å; A51-L55 VanDerWaalsContact O-CG 3.29Å; A51-L55 WeakPolarHBondContact O-CG 3.46Å; A51-L55 PolarHBondContact O-N 3.21Å; A51-L55 VanDerWaalsContact O-N 3.08Å |
| 52 | T | 64.7 | Low | 60.5 | Low | 42 Ų | 42 | 116.3 Ų | 116.3 | 26% | 0.258 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -69 | -41.4 | -178.8 | 61 | 0 | 0 | 0 | 0 | 111.5 | S49 F54 L55 R56 L64 | S49-T52 PolarHBondContact O-N 2.84Å; S49-T52 PolarHBondContact O-OG1 2.99Å; T52-F54 PolarHBondContact O-N 3.48Å; T52-L55 PolarHBondContact O-N 2.87Å; T52-R56 PolarHBondContact O-N 2.88Å; T52-R56 VanDerWaalsContact O-N 3.15Å; T52-L64 HydrophobicContact CG2-CD1 4.21Å; T52-L64 WeakPolarHBondContact O-CD1 3.46Å |
| 53 | T | 70.6 | Confident | 62.3 | Low | 71 Ų | 71 | 118.7 Ų | 118.7 | 44% | 0.436 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -66.5 | -37.7 | 175.9 | -39.3 | 0 | 0 | 0 | 0 | 111.6 | R56 Q57 | T53-R56 PolarHBondContact O-N 2.83Å; T53-Q57 PolarHBondContact O-N 2.91Å |
| 54 | F | 73.3 | Confident | 64.1 | Low | 103 Ų | 103 | 118.7 Ų | 118.7 | 45% | 0.452 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -65.8 | -41.8 | 177.4 | -171.2 | -94.2 | 0 | 0 | 0 | 112.8 | T50 A51 T52 R56 Q57 R58 | T50-F54 WeakPolarHBondContact O-CB 3.45Å; T50-F54 PolarHBondContact O-N 3.35Å; A51-F54 PolarHBondContact O-N 3.01Å; T52-F54 PolarHBondContact O-N 3.48Å; F54-R56 VanDerWaalsContact C-N 3.34Å; F54-Q57 PolarHBondContact O-N 3.48Å; F54-R58 HydrophobicContact CE1-CG 4.49Å; F54-R58 PolarHBondContact O-N 3.39Å |
| 55 | L | 73.1 | Confident | 65.2 | Low | 65 Ų | 65 | 117.1 Ų | 117.1 | 34% | 0.34 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -64 | -40.7 | 176.5 | -71.1 | 170.5 | 0 | 0 | 0 | 111.6 | A51 T52 R58 Y60 L64 | A51-L55 VanDerWaalsContact O-CG 3.29Å; A51-L55 WeakPolarHBondContact O-CG 3.46Å; A51-L55 PolarHBondContact O-N 3.21Å; A51-L55 VanDerWaalsContact O-N 3.08Å; T52-L55 PolarHBondContact O-N 2.87Å; L55-R58 PolarHBondContact O-N 3.27Å; L55-Y60 CarbonylContact O-C 3.55Å; L55-Y60 WeakPolarHBondContact O-CA 3.33Å; L55-Y60 WeakPolarHBondContact O-CB 3.3Å; L55-Y60 PolarHBondContact O-N 2.99Å; L55-L64 HydrophobicContact CB-CD1 3.99Å; L55-L64 HydrophobicContact CD1-CD1 4.19Å; L55-L64 HydrophobicContact CD1-CD2 4.37Å; L55-L64 HydrophobicContact CD1-CG 4.49Å |
| 56 | R | 72.4 | Confident | 66.5 | Low | 179 Ų | 179 | 113.4 Ų | 113.4 | 68% | 0.675 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -65.1 | -39.5 | 177 | -155.2 | 170.1 | -178.2 | -123.7 | -0.5 | 112.2 | T52 T53 F54 R58 G59 | T52-R56 PolarHBondContact O-N 2.88Å; T52-R56 VanDerWaalsContact O-N 3.15Å; T53-R56 PolarHBondContact O-N 2.83Å; F54-R56 VanDerWaalsContact C-N 3.34Å; R56-R58 VanDerWaalsContact C-N 3.31Å; R56-R58 PolarHBondContact O-N 3.32Å; R56-G59 PolarHBondContact O-N 3.41Å |
| 57 | Q | 78.2 | Confident | 67.2 | Low | 167 Ų | 167 | 113.9 Ų | 113.9 | 78% | 0.78 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -68.1 | -27 | 178.8 | -162.9 | 174.9 | 11.2 | 0 | 0 | 113.4 | T53 F54 G59 | T53-Q57 PolarHBondContact O-N 2.91Å; F54-Q57 PolarHBondContact O-N 3.48Å; Q57-G59 VanDerWaalsContact C-N 3.32Å |
| 58 | R | 75.1 | Confident | 67.8 | Low | 172 Ų | 172 | 111.3 Ų | 111.3 | 65% | 0.649 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.1 | 5.9 | 174.5 | -78.4 | -155.4 | 174.5 | 162.9 | -0.5 | 114.7 | F54 L55 R56 Y60 | F54-R58 HydrophobicContact CE1-CG 4.49Å; F54-R58 PolarHBondContact O-N 3.39Å; L55-R58 PolarHBondContact O-N 3.27Å; R56-R58 VanDerWaalsContact C-N 3.31Å; R56-R58 PolarHBondContact O-N 3.32Å; R58-Y60 VanDerWaalsContact C-N 3.3Å; R58-Y60 HydrophobicContact CB-CD2 3.78Å; R58-Y60 HydrophobicContact CB-CE2 4.03Å |
| 59 | G | 68.1 | Low | 67.8 | Low | 62 Ų | 62 | 112.4 Ų | 112.4 | 64% | 0.639 | 58% | 0.576 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 81.4 | 6 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | R56 Q57 G61 | R56-G59 PolarHBondContact O-N 3.41Å; Q57-G59 VanDerWaalsContact C-N 3.32Å; G59-G61 PolarHBondContact O-N 3.32Å |
| 60 | Y | 72.4 | Confident | 67.5 | Low | 135 Ų | 135 | 114.1 Ų | 114.1 | 53% | 0.529 | 58% | 0.579 | S | S | . | * | G | 310 helix | trans | -86.1 | 24.2 | 170.1 | -59 | -69.7 | 0 | 0 | 0 | 112 | L55 R58 W62 L63 | L55-Y60 CarbonylContact O-C 3.55Å; L55-Y60 WeakPolarHBondContact O-CA 3.33Å; L55-Y60 WeakPolarHBondContact O-CB 3.3Å; L55-Y60 PolarHBondContact O-N 2.99Å; R58-Y60 VanDerWaalsContact C-N 3.3Å; R58-Y60 HydrophobicContact CB-CD2 3.78Å; R58-Y60 HydrophobicContact CB-CE2 4.03Å; Y60-W62 PolarHBondContact O-N 3.43Å; Y60-L63 HydrophobicContact CD1-CD1 4.46Å; Y60-L63 PolarHBondContact O-N 2.95Å; Y60-L63 VanDerWaalsContact O-N 3.12Å |
| 61 | G | 68.6 | Low | 67.1 | Low | 12 Ų | 12 | 113.3 Ų | 113.3 | 12% | 0.124 | 58% | 0.576 | C | S | . | * | G | 310 helix | trans | -58.8 | -33.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | G59 L63 L64 E65 | G59-G61 PolarHBondContact O-N 3.32Å; G61-L63 PolarHBondContact O-N 3.01Å; G61-L64 PolarHBondContact O-N 3.47Å; G61-E65 PolarHBondContact O-N 3.3Å |
| 62 | W | 70.4 | Confident | 66.6 | Low | 183 Ų | 183 | 118.7 Ų | 118.7 | 69% | 0.693 | 59% | 0.591 | S | S | * | * | G | 310 helix | trans | -60.8 | -27.1 | 176.3 | -174.1 | 76.6 | 0 | 0 | 0 | 113.8 | Y60 L64 E65 | Y60-W62 PolarHBondContact O-N 3.43Å; W62-L64 PolarHBondContact O-N 2.74Å; W62-E65 PolarHBondContact O-N 2.91Å |
| 63 | L | 71 | Confident | 66.1 | Low | 122 Ų | 122 | 122 Ų | 122 | 64% | 0.639 | 61% | 0.607 | S | S | * | * | G | 310 helix | trans | -72.1 | -14.8 | 174.9 | -92.5 | 168.4 | 0 | 0 | 0 | 113.5 | Y60 G61 | Y60-L63 HydrophobicContact CD1-CD1 4.46Å; Y60-L63 PolarHBondContact O-N 2.95Å; Y60-L63 VanDerWaalsContact O-N 3.12Å; G61-L63 PolarHBondContact O-N 3.01Å |
| 64 | L | 72.1 | Confident | 65.3 | Low | 75 Ų | 75 | 124.8 Ų | 124.8 | 39% | 0.393 | 62% | 0.619 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -109.8 | -5.5 | 179.6 | -61.6 | 177.5 | 0 | 0 | 0 | 112.3 | T52 L55 G61 W62 V66 | T52-L64 HydrophobicContact CG2-CD1 4.21Å; T52-L64 WeakPolarHBondContact O-CD1 3.46Å; L55-L64 HydrophobicContact CB-CD1 3.99Å; L55-L64 HydrophobicContact CD1-CD1 4.19Å; L55-L64 HydrophobicContact CD1-CD2 4.37Å; L55-L64 HydrophobicContact CD1-CG 4.49Å; G61-L64 PolarHBondContact O-N 3.47Å; W62-L64 PolarHBondContact O-N 2.74Å; L64-V66 VanDerWaalsContact C-N 3.3Å; L64-V66 PolarHBondContact O-N 3.17Å |
| 65 | E | 66.7 | Low | 64.6 | Low | 129 Ų | 129 | 124.9 Ų | 124.9 | 60% | 0.603 | 62% | 0.62 | S | S | * | * | trans | -72.9 | 91.2 | 166.8 | -77.5 | 173.3 | 175.1 | 0 | 0 | 107 | G61 W62 E67 | G61-E65 PolarHBondContact O-N 3.3Å; W62-E65 PolarHBondContact O-N 2.91Å; E65-E67 PolarHBondContact O-N 3.49Å | ||
| 66 | V | 66.8 | Low | 64.1 | Low | 123 Ų | 123 | 125.5 Ų | 125.5 | 75% | 0.745 | 63% | 0.628 | S | S | * | * | trans | -69.7 | 106.8 | 156.5 | -174.8 | 0 | 0 | 0 | 0 | 103.8 | L64 D68 | L64-V66 VanDerWaalsContact C-N 3.3Å; L64-V66 PolarHBondContact O-N 3.17Å; V66-D68 PolarHBondContact O-N 3.41Å | ||
| 67 | E | 61.5 | Low | 63.5 | Low | 159 Ų | 159 | 123.5 Ų | 123.5 | 74% | 0.743 | 63% | 0.63 | S | S | * | * | trans | -53.7 | 114.1 | 168.1 | -75.8 | 172.9 | 164.6 | 0 | 0 | 106.1 | E65 D69 | E65-E67 PolarHBondContact O-N 3.49Å; E67-D69 PolarHBondContact O-N 3.24Å | ||
| 68 | D | 54.8 | Low | 62.3 | Low | 153 Ų | 153 | 119.5 Ų | 119.5 | 82% | 0.818 | 61% | 0.613 | S | S | * | * | trans | -61.4 | 106 | 172.5 | -73.6 | -50.7 | 0 | 0 | 0 | 105.8 | V66 D70 | V66-D68 PolarHBondContact O-N 3.41Å; D68-D70 PolarHBondContact O-N 2.98Å | ||
| 69 | D | 53.4 | Low | 61.6 | Low | 150 Ų | 150 | 116.8 Ų | 116.8 | 80% | 0.802 | 61% | 0.608 | S | S | * | * | trans | -52.4 | 103.3 | 174.2 | -81.2 | -56.2 | 0 | 0 | 0 | 108.4 | E67 | E67-D69 PolarHBondContact O-N 3.24Š| ||
| 70 | D | 55.7 | Low | 61.2 | Low | 113 Ų | 113 | 120.2 Ų | 120.2 | 60% | 0.604 | 61% | 0.607 | S | S | * | * | trans | -59.4 | 129 | 175.1 | -105 | -48 | 0 | 0 | 0 | 108 | D68 E72 D73 | D68-D70 PolarHBondContact O-N 2.98Å; D70-E72 PolarHBondContact O-N 2.99Å; D70-D73 PolarHBondContact O-N 2.9Å | ||
| 71 | P | 56 | Low | 60.6 | Low | 108 Ų | 108 | 118.4 Ų | 118.4 | 70% | 0.701 | 61% | 0.606 | S | S | * | * | G | 310 helix | trans | -64.7 | -7.8 | -179.2 | 25.4 | -33.3 | 0 | 0 | 0 | 113.4 | ||
| 72 | E | 53.1 | Low | 60 | Low | 170 Ų | 170 | 124.3 Ų | 124.3 | 79% | 0.794 | 64% | 0.635 | S | S | * | * | G | 310 helix | trans | -79.1 | -13.6 | 173 | -67.3 | -169.7 | 169.1 | 0 | 0 | 114 | D70 | D70-E72 PolarHBondContact O-N 2.99Š|
| 73 | D | 55.6 | Low | 59.6 | Low | 110 Ų | 110 | 116.8 Ų | 116.8 | 59% | 0.588 | 61% | 0.608 | S | S | * | * | G | 310 helix | trans | -90.1 | 1.9 | 173.8 | -93.9 | -22 | 0 | 0 | 0 | 113.7 | D70 K75 | D70-D73 PolarHBondContact O-N 2.9Å; D73-K75 PolarHBondContact O-N 3.3Å |
| 74 | N | 53.7 | Low | 59.3 | Low | 130 Ų | 130 | 115.2 Ų | 115.2 | 70% | 0.695 | 60% | 0.6 | S | S | * | * | trans | -78.7 | 46.9 | 168.7 | -73.7 | -90.4 | 0 | 0 | 0 | 111.7 | ||||
| 75 | K | 58.6 | Low | 58.8 | Low | 106 Ų | 106 | 116.8 Ų | 116.8 | 46% | 0.461 | 61% | 0.608 | S | S | . | * | trans | -59.6 | 134.2 | 158.1 | -74.9 | 168.8 | -177.4 | 166 | 0 | 106.4 | D73 L77 E79 | D73-K75 PolarHBondContact O-N 3.3Å; K75-L77 PolarHBondContact O-N 2.99Å; K75-E79 HydrophobicContact CB-CB 4.15Å; K75-E79 HydrophobicContact CB-CG 4.13Å; K75-E79 HydrophobicContact CD-CG 4.23Å; K75-E79 HydrophobicContact CG-CG 4.31Å | ||
| 76 | P | 62.7 | Low | 58.5 | Low | 77 Ų | 77 | 119 Ų | 119 | 50% | 0.5 | 62% | 0.616 | S | S | . | * | trans | -51.3 | 141.1 | 178.5 | 21.6 | -31.7 | 0 | 0 | 0 | 108.7 | L78 E79 E80 | P76-L78 CarbonylContact O-C 3.6Å; P76-L78 PolarHBondContact O-N 3.31Å; P76-E79 WeakPolarHBondContact CD-OE2 3.5Å; P76-E79 HydrophobicContact CG-CB 3.9Å; P76-E79 WeakPolarHBondContact O-CA 3.33Å; P76-E79 WeakPolarHBondContact O-CB 3.43Å; P76-E79 PolarHBondContact O-N 3.31Å; P76-E80 PolarHBondContact O-N 3.36Å | ||
| 77 | L | 58.3 | Low | 58.3 | Low | 138 Ų | 138 | 114.5 Ų | 114.5 | 72% | 0.723 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -52.1 | -16.4 | -178.2 | -61.1 | 175 | 0 | 0 | 0 | 113.8 | K75 E80 L81 | K75-L77 PolarHBondContact O-N 2.99Å; L77-E80 WeakPolarHBondContact CD2-OE2 3.37Å; L77-L81 WeakPolarHBondContact O-CB 3.48Å; L77-L81 PolarHBondContact O-N 2.79Å |
| 78 | L | 54.3 | Low | 58.6 | Low | 83 Ų | 83 | 107.8 Ų | 107.8 | 44% | 0.435 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -76.1 | -37.1 | 172 | -61.6 | 177.1 | 0 | 0 | 0 | 113.5 | P76 L81 D82 I83 L85 | P76-L78 CarbonylContact O-C 3.6Å; P76-L78 PolarHBondContact O-N 3.31Å; L78-L81 CarbonylContact O-C 3.57Å; L78-L81 PolarHBondContact O-N 3.14Å; L78-D82 PolarHBondContact O-N 3.41Å; L78-D82 VanDerWaalsContact O-N 3.14Å; L78-I83 PolarHBondContact O-N 3.44Å; L78-L85 HydrophobicContact CD1-CD1 4.25Å |
| 79 | E | 59.8 | Low | 59.1 | Low | 114 Ų | 114 | 107 Ų | 107 | 53% | 0.533 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -74.3 | -31.9 | 172.9 | -176.5 | 172.2 | 173 | 0 | 0 | 111 | K75 P76 D82 | K75-E79 HydrophobicContact CB-CB 4.15Å; K75-E79 HydrophobicContact CB-CG 4.13Å; K75-E79 HydrophobicContact CD-CG 4.23Å; K75-E79 HydrophobicContact CG-CG 4.31Å; P76-E79 WeakPolarHBondContact CD-OE2 3.5Å; P76-E79 HydrophobicContact CG-CB 3.9Å; P76-E79 WeakPolarHBondContact O-CA 3.33Å; P76-E79 WeakPolarHBondContact O-CB 3.43Å; P76-E79 PolarHBondContact O-N 3.31Å; E79-D82 PolarHBondContact O-N 2.93Å |
| 80 | E | 60.1 | Low | 59.6 | Low | 134 Ų | 134 | 103.2 Ų | 103.2 | 63% | 0.626 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -70.1 | -31 | 170.1 | -128.4 | 179.2 | -171.2 | 0 | 0 | 112.9 | P76 L77 | P76-E80 PolarHBondContact O-N 3.36Å; L77-E80 WeakPolarHBondContact CD2-OE2 3.37Å |
| 81 | L | 59.8 | Low | 60.1 | Low | 97 Ų | 97 | 97.9 Ų | 97.9 | 51% | 0.508 | 49% | 0.49 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.6 | 4.4 | 176.8 | -165.4 | 60.3 | 0 | 0 | 0 | 113.3 | L77 L78 I83 | L77-L81 WeakPolarHBondContact O-CB 3.48Å; L77-L81 PolarHBondContact O-N 2.79Å; L78-L81 CarbonylContact O-C 3.57Å; L78-L81 PolarHBondContact O-N 3.14Å; L81-I83 VanDerWaalsContact C-N 3.27Å; L81-I83 HydrophobicContact CB-CD1 4.45Å; L81-I83 HydrophobicContact CB-CG1 4.33Å; L81-I83 HydrophobicContact CD2-CD1 3.59Å; L81-I83 HydrophobicContact CD2-CG1 4.36Å; L81-I83 HydrophobicContact CG-CD1 3.82Å; L81-I83 HydrophobicContact CG-CG1 4.08Å; L81-I83 WeakPolarHBondContact O-CG1 3.39Å; L81-I83 PolarHBondContact O-N 2.88Å |
| 82 | D | 56.3 | Low | 60.7 | Low | 137 Ų | 137 | 94.6 Ų | 94.6 | 73% | 0.733 | 47% | 0.466 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 59.1 | 32.5 | -179.4 | -138.1 | 3.9 | 0 | 0 | 0 | 113.5 | L78 E79 | L78-D82 PolarHBondContact O-N 3.41Å; L78-D82 VanDerWaalsContact O-N 3.14Å; E79-D82 PolarHBondContact O-N 2.93Å |
| 83 | I | 60.5 | Low | 61.2 | Low | 25 Ų | 25 | 93.1 Ų | 93.1 | 13% | 0.128 | 45% | 0.453 | C | S | . | . | trans | -111 | 88 | 178.3 | -52.7 | -178 | 0 | 0 | 0 | 110.3 | L78 L81 L85 I88 W116 | L78-I83 PolarHBondContact O-N 3.44Å; L81-I83 VanDerWaalsContact C-N 3.27Å; L81-I83 HydrophobicContact CB-CD1 4.45Å; L81-I83 HydrophobicContact CB-CG1 4.33Å; L81-I83 HydrophobicContact CD2-CD1 3.59Å; L81-I83 HydrophobicContact CD2-CG1 4.36Å; L81-I83 HydrophobicContact CG-CD1 3.82Å; L81-I83 HydrophobicContact CG-CG1 4.08Å; L81-I83 WeakPolarHBondContact O-CG1 3.39Å; L81-I83 PolarHBondContact O-N 2.88Å; I83-L85 HydrophobicContact CG2-CD2 4.25Å; I83-L85 PolarHBondContact O-N 3.37Å; I83-I88 HydrophobicContact CG2-CD1 3.84Å; I83-W116 HydrophobicContact CD1-CB 4.11Å; I83-W116 HydrophobicContact CD1-CD2 4.24Å; I83-W116 HydrophobicContact CD1-CG 3.74Å; I83-W116 HydrophobicContact CG1-CB 4.34Å; I83-W116 HydrophobicContact CG1-CG 4.15Å | ||
| 84 | D | 65.6 | Low | 61.3 | Low | 88 Ų | 88 | 88.2 Ų | 88.2 | 47% | 0.471 | 43% | 0.427 | S | S | . | . | trans | -87.1 | 101.8 | 168.5 | -172.6 | -14 | 0 | 0 | 0 | 111.2 | K86 D87 I88 | D84-K86 VanDerWaalsContact C-N 3.26Å; D84-K86 PolarHBondContact O-N 3.11Å; D84-K86 WeakPolarHBondContact OD1-CA 3.36Å; D84-K86 WeakPolarHBondContact OD1-CB 3.42Å; D84-K86 PolarHBondContact OD1-N 3.13Å; D84-D87 HydrophobicContact CB-CB 3.78Å; D84-D87 PolarHBondContact O-N 3.19Å; D84-D87 PolarHBondContact OD1-N 2.84Å; D84-I88 VanDerWaalsContact O-CG1 3.3Å; D84-I88 WeakPolarHBondContact O-CG1 3.17Å; D84-I88 PolarHBondContact O-N 3.12Å | ||
| 85 | L | 61.5 | Low | 61.6 | Low | 108 Ų | 108 | 82 Ų | 82 | 57% | 0.565 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -62 | -30.1 | 177.8 | -67 | 173.3 | 0 | 0 | 0 | 113.5 | L78 I83 I88 Y89 | L78-L85 HydrophobicContact CD1-CD1 4.25Å; I83-L85 HydrophobicContact CG2-CD2 4.25Å; I83-L85 PolarHBondContact O-N 3.37Å; L85-I88 HydrophobicContact CD2-CD1 4.39Å; L85-Y89 WeakPolarHBondContact O-CB 3.27Å; L85-Y89 PolarHBondContact O-N 2.96Å |
| 86 | K | 60 | Low | 61.8 | Low | 175 Ų | 175 | 80 Ų | 80 | 76% | 0.761 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -72 | -39.8 | 176.6 | -70.3 | 177.9 | -177.8 | 167.1 | 0 | 110.2 | D84 Y89 Y90 | D84-K86 VanDerWaalsContact C-N 3.26Å; D84-K86 PolarHBondContact O-N 3.11Å; D84-K86 WeakPolarHBondContact OD1-CA 3.36Å; D84-K86 WeakPolarHBondContact OD1-CB 3.42Å; D84-K86 PolarHBondContact OD1-N 3.13Å; K86-Y89 PolarHBondContact O-N 2.86Å; K86-Y90 WeakPolarHBondContact O-CB 3.42Å; K86-Y90 PolarHBondContact O-N 3.19Å |
| 87 | D | 62.7 | Low | 61.7 | Low | 29 Ų | 29 | 81 Ų | 81 | 16% | 0.155 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -67.5 | -43 | 175 | -164.6 | 30.8 | 0 | 0 | 0 | 111.3 | D84 Y89 Y90 K91 | D84-D87 HydrophobicContact CB-CB 3.78Å; D84-D87 PolarHBondContact O-N 3.19Å; D84-D87 PolarHBondContact OD1-N 2.84Å; D87-Y89 VanDerWaalsContact C-N 3.33Å; D87-Y89 PolarHBondContact O-N 3.31Å; D87-Y90 CarbonylContact O-C 3.59Å; D87-Y90 WeakPolarHBondContact O-CB 3.49Å; D87-Y90 PolarHBondContact O-N 2.97Å; D87-Y90 VanDerWaalsContact O-N 3.14Å; D87-K91 WeakPolarHBondContact O-CB 3.1Å; D87-K91 VanDerWaalsContact O-CG 3.23Å; D87-K91 WeakPolarHBondContact O-CG 3.42Å; D87-K91 PolarHBondContact O-N 3.38Å; D87-K91 WeakPolarHBondContact OD2-CE 3.39Å; D87-K91 IonicContact OD2-NZ 2.65Å; D87-K91 PolarHBondContact OD2-NZ 3.32Å |
| 88 | I | 67.6 | Low | 61.5 | Low | 19 Ų | 19 | 75 Ų | 75 | 10% | 0.097 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -57.1 | -45.4 | 172.4 | -68.8 | 165.9 | 0 | 0 | 0 | 111.1 | I83 D84 L85 K91 I92 D114 Y173 | I83-I88 HydrophobicContact CG2-CD1 3.84Å; D84-I88 VanDerWaalsContact O-CG1 3.3Å; D84-I88 WeakPolarHBondContact O-CG1 3.17Å; D84-I88 PolarHBondContact O-N 3.12Å; L85-I88 HydrophobicContact CD2-CD1 4.39Å; I88-K91 PolarHBondContact O-N 3.08Å; I88-I92 HydrophobicContact CG2-CD1 3.85Å; I88-I92 HydrophobicContact CG2-CG1 4.46Å; I88-I92 WeakPolarHBondContact O-CB 3.45Å; I88-I92 WeakPolarHBondContact O-CG1 3.42Å; I88-I92 PolarHBondContact O-N 3.42Å; I88-D114 WeakPolarHBondContact CG1-OD2 3.35Å; I88-Y173 HydrophobicContact CG2-CE1 4.3Å |
| 89 | Y | 65.1 | Low | 61.1 | Low | 137 Ų | 137 | 76.5 Ų | 76.5 | 54% | 0.537 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -63.9 | -40.3 | 176.8 | 178.1 | -99.2 | 0 | 0 | 0 | 112.3 | L85 K86 D87 I92 R93 | L85-Y89 WeakPolarHBondContact O-CB 3.27Å; L85-Y89 PolarHBondContact O-N 2.96Å; K86-Y89 PolarHBondContact O-N 2.86Å; D87-Y89 VanDerWaalsContact C-N 3.33Å; D87-Y89 PolarHBondContact O-N 3.31Å; Y89-I92 PolarHBondContact O-N 3.04Å; Y89-R93 WeakPolarHBondContact O-CB 3.28Å; Y89-R93 PolarHBondContact O-N 3.28Å; Y89-R93 PolarHBondContact OH-NH1 3.29Å; Y89-R93 VanDerWaalsContact OH-NH1 3.14Å |
| 90 | Y | 64.1 | Low | 60.5 | Low | 70 Ų | 70 | 76.2 Ų | 76.2 | 28% | 0.275 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -64 | -44 | 175.1 | -178.3 | -93.4 | 0 | 0 | 0 | 111.8 | K86 D87 R93 C94 F104 N105 | K86-Y90 WeakPolarHBondContact O-CB 3.42Å; K86-Y90 PolarHBondContact O-N 3.19Å; D87-Y90 CarbonylContact O-C 3.59Å; D87-Y90 WeakPolarHBondContact O-CB 3.49Å; D87-Y90 PolarHBondContact O-N 2.97Å; D87-Y90 VanDerWaalsContact O-N 3.14Å; Y90-R93 PolarHBondContact O-N 2.82Å; Y90-C94 WeakPolarHBondContact O-CB 3.37Å; Y90-C94 PolarHBondContact O-N 3.36Å; Y90-C94 PolarHBondContact O-SG 2.97Å; Y90-F104 HydrophobicContact CD2-CD1 4.3Å; Y90-F104 HydrophobicContact CD2-CE1 4.25Å; Y90-F104 AromaticContact CE2-CD1 3.29Å; Y90-F104 HydrophobicContact CE2-CD1 3.29Å; Y90-F104 AromaticContact CE2-CE1 3.53Å; Y90-F104 HydrophobicContact CE2-CE1 3.53Å; Y90-F104 HydrophobicContact CE2-CG 4.31Å; Y90-F104 AromaticContact CZ-CD1 3.44Å; Y90-F104 VanDerWaalsContact CZ-CD1 3.44Å; Y90-F104 WeakPolarHBondContact OH-CA 3.09Å; Y90-F104 VanDerWaalsContact OH-CD1 3.27Å; Y90-F104 WeakPolarHBondContact OH-CD1 3.46Å; Y90-N105 PolarHBondContact OH-N 2.91Å |
| 91 | K | 67 | Low | 59.6 | Low | 0 Ų | 0 | 75.1 Ų | 75.1 | 0% | 0 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -59.9 | -46.1 | 174.1 | -71.4 | 168.2 | 176.4 | 164.2 | 0 | 111.4 | D87 I88 R93 C94 V95 V109 N112 D114 Y173 | D87-K91 WeakPolarHBondContact O-CB 3.1Å; D87-K91 VanDerWaalsContact O-CG 3.23Å; D87-K91 WeakPolarHBondContact O-CG 3.42Å; D87-K91 PolarHBondContact O-N 3.38Å; D87-K91 WeakPolarHBondContact OD2-CE 3.39Å; D87-K91 IonicContact OD2-NZ 2.65Å; D87-K91 PolarHBondContact OD2-NZ 3.32Å; I88-K91 PolarHBondContact O-N 3.08Å; K91-R93 VanDerWaalsContact C-N 3.34Å; K91-R93 PolarHBondContact O-N 3.33Å; K91-C94 WeakPolarHBondContact O-CB 3.46Å; K91-C94 PolarHBondContact O-N 3.44Å; K91-V95 WeakPolarHBondContact O-CB 3.11Å; K91-V95 WeakPolarHBondContact O-CG2 3.3Å; K91-V95 PolarHBondContact O-N 3.25Å; K91-V109 HydrophobicContact CB-CG1 4.39Å; K91-V109 HydrophobicContact CB-CG2 4.34Å; K91-V109 HydrophobicContact CG-CB 4.34Å; K91-V109 HydrophobicContact CG-CG1 4.21Å; K91-V109 HydrophobicContact CG-CG2 4Å; K91-N112 WeakPolarHBondContact CE-O 3.35Å; K91-N112 PolarHBondContact NZ-O 3.09Å; K91-D114 WeakPolarHBondContact CD-OD2 3.34Å; K91-D114 IonicContact NZ-OD1 3Å; K91-D114 PolarHBondContact NZ-OD1 3.36Å; K91-D114 IonicContact NZ-OD2 2.68Å; K91-D114 PolarHBondContact NZ-OD2 3.3Å; K91-Y173 HydrophobicContact CB-CE1 4.48Å; K91-Y173 HydrophobicContact CD-CE2 4.31Å |
| 92 | I | 68.5 | Low | 58.7 | Low | 40 Ų | 40 | 74.5 Ų | 74.5 | 21% | 0.205 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -56.5 | -46.1 | 174.1 | -77.4 | 171.4 | 0 | 0 | 0 | 111.4 | I88 Y89 V95 L96 Y173 L176 | I88-I92 HydrophobicContact CG2-CD1 3.85Å; I88-I92 HydrophobicContact CG2-CG1 4.46Å; I88-I92 WeakPolarHBondContact O-CB 3.45Å; I88-I92 WeakPolarHBondContact O-CG1 3.42Å; I88-I92 PolarHBondContact O-N 3.42Å; Y89-I92 PolarHBondContact O-N 3.04Å; I92-V95 PolarHBondContact O-N 3.38Å; I92-L96 WeakPolarHBondContact O-CB 3.13Å; I92-L96 PolarHBondContact O-N 2.81Å; I92-Y173 HydrophobicContact CG1-CD1 4.16Å; I92-Y173 HydrophobicContact CG1-CE1 4.3Å; I92-L176 HydrophobicContact CB-CD1 3.81Å; I92-L176 HydrophobicContact CD1-CD1 3.99Å; I92-L176 HydrophobicContact CG1-CD1 3.5Å; I92-L176 HydrophobicContact CG2-CD1 3.3Å; I92-L176 HydrophobicContact CG2-CD2 4.21Å; I92-L176 HydrophobicContact CG2-CG 4.41Å |
| 93 | R | 63 | Low | 58 | Low | 138 Ų | 138 | 71.5 Ų | 71.5 | 52% | 0.521 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -69.5 | -36.8 | -179 | -165.9 | 167.6 | -176.8 | 143.8 | -3.6 | 112.4 | Y89 Y90 K91 V95 M97 | Y89-R93 WeakPolarHBondContact O-CB 3.28Å; Y89-R93 PolarHBondContact O-N 3.28Å; Y89-R93 PolarHBondContact OH-NH1 3.29Å; Y89-R93 VanDerWaalsContact OH-NH1 3.14Å; Y90-R93 PolarHBondContact O-N 2.82Å; K91-R93 VanDerWaalsContact C-N 3.34Å; K91-R93 PolarHBondContact O-N 3.33Å; R93-V95 VanDerWaalsContact C-N 3.31Å; R93-V95 PolarHBondContact O-N 2.76Å; R93-M97 PolarHBondContact O-N 2.76Å |
| 94 | C | 59.2 | Low | 57.4 | Low | 7 Ų | 7 | 73.4 Ų | 73.4 | 5% | 0.047 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -61.7 | -39.2 | 172.5 | -71.3 | 0 | 0 | 0 | 0 | 112.2 | Y90 K91 M97 F104 V109 | Y90-C94 WeakPolarHBondContact O-CB 3.37Å; Y90-C94 PolarHBondContact O-N 3.36Å; Y90-C94 PolarHBondContact O-SG 2.97Å; K91-C94 WeakPolarHBondContact O-CB 3.46Å; K91-C94 PolarHBondContact O-N 3.44Å; C94-M97 CarbonylContact O-C 3.57Å; C94-F104 VanDerWaalsContact SG-CB 3.55Å; C94-V109 HydrophobicContact CB-CG2 4.32Å |
| 95 | V | 59.2 | Low | 56.8 | Low | 0 Ų | 0 | 74.1 Ų | 74.1 | 0% | 0 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -79.1 | -34.9 | -177.8 | 174.3 | 0 | 0 | 0 | 0 | 111.6 | K91 I92 R93 M97 Y173 S209 L213 | K91-V95 WeakPolarHBondContact O-CB 3.11Å; K91-V95 WeakPolarHBondContact O-CG2 3.3Å; K91-V95 PolarHBondContact O-N 3.25Å; I92-V95 PolarHBondContact O-N 3.38Å; R93-V95 VanDerWaalsContact C-N 3.31Å; R93-V95 PolarHBondContact O-N 2.76Å; V95-M97 VanDerWaalsContact C-N 3.3Å; V95-M97 PolarHBondContact O-N 2.84Å; V95-Y173 WeakPolarHBondContact CG1-O 3.49Å; V95-S209 WeakPolarHBondContact CG1-OG 3.36Å; V95-S209 PolarHBondContact O-OG 3.08Å; V95-L213 HydrophobicContact CG2-CD1 3.65Å |
| 96 | L | 63.8 | Low | 56.6 | Low | 65 Ų | 65 | 73 Ų | 73 | 34% | 0.34 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -67.2 | -31.9 | 176.9 | -173.3 | 66 | 0 | 0 | 0 | 111.6 | I92 P98 L176 V180 W205 | I92-L96 WeakPolarHBondContact O-CB 3.13Å; I92-L96 PolarHBondContact O-N 2.81Å; L96-P98 WeakPolarHBondContact O-CD 3.36Å; L96-L176 HydrophobicContact CB-CD2 4.34Å; L96-L176 HydrophobicContact CD1-CD2 3.81Å; L96-L176 HydrophobicContact CG-CD2 4.45Å; L96-V180 HydrophobicContact CD1-CB 4.39Å; L96-V180 HydrophobicContact CD1-CG2 3.88Å; L96-W205 VanDerWaalsContact O-CE2 3.25Å; L96-W205 WeakPolarHBondContact O-CZ2 3.47Å; L96-W205 PolarHBondContact O-NE1 3.32Å |
| 97 | M | 60.5 | Low | 56.4 | Low | 96 Ų | 96 | 71 Ų | 71 | 47% | 0.473 | 37% | 0.369 | S | S | . | . | trans | -119.3 | 92.3 | -179.8 | -157.7 | 179.6 | -144.1 | 0 | 0 | 111 | R93 C94 V95 M99 L102 | R93-M97 PolarHBondContact O-N 2.76Å; C94-M97 CarbonylContact O-C 3.57Å; V95-M97 VanDerWaalsContact C-N 3.3Å; V95-M97 PolarHBondContact O-N 2.84Å; M97-M99 HydrophobicContact CG-CB 4.23Å; M97-M99 HydrophobicContact CG-CG 4.16Å; M97-M99 PolarHBondContact O-N 3.02Å; M97-L102 HydrophobicContact SD-CD1 3.45Å; M97-L102 WeakPolarHBondContact SD-CD1 3.49Å | ||
| 98 | P | 53.6 | Low | 56.1 | Low | 13 Ų | 13 | 71.2 Ų | 71.2 | 8% | 0.084 | 37% | 0.372 | C | S | . | . | trans | -77.4 | 32.9 | -176.9 | 34.7 | -36.7 | 0 | 0 | 0 | 112.7 | L96 P100 W205 Y208 | L96-P98 WeakPolarHBondContact O-CD 3.36Å; P98-P100 WeakPolarHBondContact O-CD 3.32Å; P98-W205 VanDerWaalsContact CD-CE2 3.45Å; P98-W205 HydrophobicContact CG-CD2 4.38Å; P98-W205 HydrophobicContact CG-CZ2 4.07Å; P98-Y208 HydrophobicContact CB-CD1 3.74Å; P98-Y208 HydrophobicContact CB-CE1 3.84Å; P98-Y208 HydrophobicContact CG-CD1 3.96Å; P98-Y208 HydrophobicContact CG-CE1 4.25Å | ||
| 99 | M | 45.6 | Very low | 55.8 | Low | 115 Ų | 115 | 70.5 Ų | 70.5 | 57% | 0.567 | 37% | 0.368 | S | S | * | . | trans | -85.8 | 119.9 | -179.1 | -79.4 | -76.9 | -102.2 | 0 | 0 | 110.6 | M97 S101 | M97-M99 HydrophobicContact CG-CB 4.23Å; M97-M99 HydrophobicContact CG-CG 4.16Å; M97-M99 PolarHBondContact O-N 3.02Å; M99-S101 PolarHBondContact O-N 2.8Å; M99-S101 VanDerWaalsContact O-N 3.09Å | ||
| 100 | P | 47.9 | Very low | 55.6 | Low | 108 Ų | 108 | 65.7 Ų | 65.7 | 70% | 0.701 | 35% | 0.349 | S | S | * | . | G | 310 helix | trans | -62.6 | -14.7 | 177.8 | -21.6 | 32.5 | 0 | 0 | 0 | 114.9 | P98 | P98-P100 WeakPolarHBondContact O-CD 3.32Š|
| 101 | S | 40.3 | Very low | 55.6 | Low | 110 Ų | 110 | 66.5 Ų | 66.5 | 77% | 0.769 | 36% | 0.358 | S | S | * | . | G | 310 helix | trans | -84 | -7.9 | -169.9 | -177.9 | 0 | 0 | 0 | 0 | 115.1 | M99 | M99-S101 PolarHBondContact O-N 2.8Å; M99-S101 VanDerWaalsContact O-N 3.09Å |
| 102 | L | 41.8 | Very low | 55.6 | Low | 84 Ų | 84 | 70.6 Ų | 70.6 | 44% | 0.44 | 38% | 0.38 | S | S | . | . | G | 310 helix | trans | -94.2 | 8.9 | -168.7 | -124.1 | 147.3 | 0 | 0 | 0 | 114.6 | M97 F104 | M97-L102 HydrophobicContact SD-CD1 3.45Å; M97-L102 WeakPolarHBondContact SD-CD1 3.49Å; L102-F104 HydrophobicContact CB-CD2 3.7Å; L102-F104 HydrophobicContact CB-CE2 3.78Å; L102-F104 HydrophobicContact CD1-CE2 4.19Å; L102-F104 HydrophobicContact CD2-CD2 4.05Å; L102-F104 HydrophobicContact CD2-CE1 4.38Å; L102-F104 HydrophobicContact CD2-CE2 3.28Å; L102-F104 HydrophobicContact CD2-CZ 3.49Å; L102-F104 VanDerWaalsContact CD2-CZ 3.49Å; L102-F104 HydrophobicContact CG-CD2 4.35Å; L102-F104 HydrophobicContact CG-CE2 3.9Å; L102-F104 PolarHBondContact O-N 3.24Å |
| 103 | G | 39.8 | Very low | 55.5 | Low | 74 Ų | 74 | 71.8 Ų | 71.8 | 76% | 0.763 | 39% | 0.39 | S | S | * | . | trans | 62.9 | 14.5 | 172.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 104 | F | 49 | Very low | 56.2 | Low | 66 Ų | 66 | 66.1 Ų | 66.1 | 29% | 0.289 | 37% | 0.37 | S | S | . | . | trans | -78.6 | 131.2 | 177.4 | -66.3 | -52.7 | 0 | 0 | 0 | 110.2 | Y90 C94 L102 R106 | Y90-F104 HydrophobicContact CD2-CD1 4.3Å; Y90-F104 HydrophobicContact CD2-CE1 4.25Å; Y90-F104 AromaticContact CE2-CD1 3.29Å; Y90-F104 HydrophobicContact CE2-CD1 3.29Å; Y90-F104 AromaticContact CE2-CE1 3.53Å; Y90-F104 HydrophobicContact CE2-CE1 3.53Å; Y90-F104 HydrophobicContact CE2-CG 4.31Å; Y90-F104 AromaticContact CZ-CD1 3.44Å; Y90-F104 VanDerWaalsContact CZ-CD1 3.44Å; Y90-F104 WeakPolarHBondContact OH-CA 3.09Å; Y90-F104 VanDerWaalsContact OH-CD1 3.27Å; Y90-F104 WeakPolarHBondContact OH-CD1 3.46Å; C94-F104 VanDerWaalsContact SG-CB 3.55Å; L102-F104 HydrophobicContact CB-CD2 3.7Å; L102-F104 HydrophobicContact CB-CE2 3.78Å; L102-F104 HydrophobicContact CD1-CE2 4.19Å; L102-F104 HydrophobicContact CD2-CD2 4.05Å; L102-F104 HydrophobicContact CD2-CE1 4.38Å; L102-F104 HydrophobicContact CD2-CE2 3.28Å; L102-F104 HydrophobicContact CD2-CZ 3.49Å; L102-F104 VanDerWaalsContact CD2-CZ 3.49Å; L102-F104 HydrophobicContact CG-CD2 4.35Å; L102-F104 HydrophobicContact CG-CE2 3.9Å; L102-F104 PolarHBondContact O-N 3.24Å; F104-R106 VanDerWaalsContact C-N 3.29Å; F104-R106 PolarHBondContact O-N 3.48Å | ||
| 105 | N | 52.6 | Low | 57 | Low | 103 Ų | 103 | 71.1 Ų | 71.1 | 55% | 0.551 | 39% | 0.392 | S | S | * | . | trans | -69.2 | 90.1 | 178.8 | -84 | -37.6 | 0 | 0 | 0 | 109.2 | Y90 Q107 V108 | Y90-N105 PolarHBondContact OH-N 2.91Å; N105-Q107 PolarHBondContact O-N 3.5Å; N105-Q107 VanDerWaalsContact O-N 3.08Å; N105-V108 HydrophobicContact CB-CB 4.29Å; N105-V108 HydrophobicContact CB-CG2 3.51Å; N105-V108 WeakPolarHBondContact O-CB 3.39Å; N105-V108 PolarHBondContact O-N 2.85Å | ||
| 106 | R | 56.8 | Low | 58.1 | Low | 83 Ų | 83 | 77.5 Ų | 77.5 | 31% | 0.313 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -61.4 | -20.7 | -179.6 | -153.4 | 136 | 86.4 | 143.8 | 7.5 | 113.1 | F104 S212 L213 | F104-R106 VanDerWaalsContact C-N 3.29Å; F104-R106 PolarHBondContact O-N 3.48Å; R106-S212 VanDerWaalsContact CZ-OG 3.31Å; R106-S212 PolarHBondContact NH1-OG 2.95Å; R106-S212 PolarHBondContact NH2-O 3.36Å; R106-S212 PolarHBondContact NH2-OG 2.89Å; R106-L213 HydrophobicContact CG-CD2 3.28Å; R106-L213 HydrophobicContact CG-CG 4.26Å |
| 107 | Q | 55.8 | Low | 59 | Low | 134 Ų | 134 | 74.6 Ų | 74.6 | 63% | 0.626 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -67.8 | -32.7 | 171.4 | -65.3 | -178.6 | -20.5 | 0 | 0 | 112.2 | N105 V109 R110 D111 | N105-Q107 PolarHBondContact O-N 3.5Å; N105-Q107 VanDerWaalsContact O-N 3.08Å; Q107-V109 VanDerWaalsContact C-N 3.29Å; Q107-V109 PolarHBondContact O-N 2.82Å; Q107-R110 CarbonylContact O-C 3.55Å; Q107-R110 WeakPolarHBondContact O-CA 3.23Å; Q107-R110 WeakPolarHBondContact O-CB 3.4Å; Q107-R110 PolarHBondContact O-N 3.42Å; Q107-D111 WeakPolarHBondContact CB-OD2 3.45Å; Q107-D111 WeakPolarHBondContact O-CB 3.37Å; Q107-D111 PolarHBondContact O-N 2.87Å |
| 108 | V | 58.1 | Low | 60.2 | Low | 34 Ų | 34 | 70.1 Ų | 70.1 | 21% | 0.206 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -61.1 | -33.9 | -178.8 | 171.8 | 0 | 0 | 0 | 0 | 112.9 | N105 R110 N112 | N105-V108 HydrophobicContact CB-CB 4.29Å; N105-V108 HydrophobicContact CB-CG2 3.51Å; N105-V108 WeakPolarHBondContact O-CB 3.39Å; N105-V108 PolarHBondContact O-N 2.85Å; V108-R110 VanDerWaalsContact C-N 3.29Å; V108-R110 PolarHBondContact O-N 3.41Å; V108-N112 PolarHBondContact O-N 2.65Å; V108-N112 VanDerWaalsContact O-N 3.16Å |
| 109 | V | 61 | Low | 61.8 | Low | 4 Ų | 4 | 71.2 Ų | 71.2 | 2% | 0.024 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -66.6 | -33.3 | 174.4 | -167.7 | 0 | 0 | 0 | 0 | 111.7 | K91 C94 Q107 V170 Y173 L213 | K91-V109 HydrophobicContact CB-CG1 4.39Å; K91-V109 HydrophobicContact CB-CG2 4.34Å; K91-V109 HydrophobicContact CG-CB 4.34Å; K91-V109 HydrophobicContact CG-CG1 4.21Å; K91-V109 HydrophobicContact CG-CG2 4Å; C94-V109 HydrophobicContact CB-CG2 4.32Å; Q107-V109 VanDerWaalsContact C-N 3.29Å; Q107-V109 PolarHBondContact O-N 2.82Å; V109-V170 HydrophobicContact CG1-CG2 4.3Å; V109-Y173 HydrophobicContact CG1-CD2 4.35Å; V109-L213 HydrophobicContact CB-CD2 4.22Å; V109-L213 HydrophobicContact CG2-CD2 4.19Å |
| 110 | R | 60.5 | Low | 63.8 | Low | 36 Ų | 36 | 68.4 Ų | 68.4 | 14% | 0.136 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -80.7 | -45.4 | 176.7 | 174.5 | 175.6 | 161.3 | 178.6 | -9.2 | 109.9 | Q107 V108 E161 Q166 E218 | Q107-R110 CarbonylContact O-C 3.55Å; Q107-R110 WeakPolarHBondContact O-CA 3.23Å; Q107-R110 WeakPolarHBondContact O-CB 3.4Å; Q107-R110 PolarHBondContact O-N 3.42Å; V108-R110 VanDerWaalsContact C-N 3.29Å; V108-R110 PolarHBondContact O-N 3.41Å; R110-E161 PolarHBondContact NH2-O 2.95Å; R110-Q166 HydrophobicContact CG-CB 4.29Å; R110-Q166 HydrophobicContact CG-CG 4.41Å; R110-Q166 WeakPolarHBondContact O-CG 3.22Å; R110-Q166 PolarHBondContact O-NE2 3.36Å; R110-E218 IonicContact CZ-OE1 3.63Å; R110-E218 IonicContact CZ-OE2 3.64Å; R110-E218 IonicContact NH1-OE1 3.47Å; R110-E218 PolarHBondContact NH1-OE1 2.92Å; R110-E218 IonicContact NH1-OE2 3.25Å; R110-E218 PolarHBondContact NH1-OE2 3.42Å; R110-E218 IonicContact NH2-OE1 2.96Å; R110-E218 PolarHBondContact NH2-OE1 2.82Å; R110-E218 IonicContact NH2-OE2 3.04Å; R110-E218 PolarHBondContact NH2-OE2 3.35Å |
| 111 | D | 63.6 | Low | 65.7 | Low | 86 Ų | 86 | 63.9 Ų | 63.9 | 46% | 0.46 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -75.8 | -29.6 | -167.3 | -61.6 | -19.8 | 0 | 0 | 0 | 113.1 | Q107 P113 | Q107-D111 WeakPolarHBondContact CB-OD2 3.45Å; Q107-D111 WeakPolarHBondContact O-CB 3.37Å; Q107-D111 PolarHBondContact O-N 2.87Å; D111-P113 VanDerWaalsContact O-CD 3.28Å; D111-P113 WeakPolarHBondContact O-CD 3.33Å |
| 112 | N | 66.6 | Low | 68.1 | Low | 86 Ų | 86 | 58.7 Ų | 58.7 | 46% | 0.46 | 31% | 0.313 | S | S | . | . | S | Bend | trans | -114.5 | 85.2 | 174.1 | -59 | -56.3 | 0 | 0 | 0 | 110 | K91 V108 D114 | K91-N112 WeakPolarHBondContact CE-O 3.35Å; K91-N112 PolarHBondContact NZ-O 3.09Å; V108-N112 PolarHBondContact O-N 2.65Å; V108-N112 VanDerWaalsContact O-N 3.16Å; N112-D114 PolarHBondContact O-N 2.76Å |
| 113 | P | 66.1 | Low | 70.4 | Confident | 65 Ų | 65 | 58.7 Ų | 58.7 | 42% | 0.422 | 31% | 0.313 | S | S | . | . | trans | -75.5 | 104.9 | -178.1 | 29.1 | -33.5 | 0 | 0 | 0 | 111.8 | D111 Q166 | D111-P113 VanDerWaalsContact O-CD 3.28Å; D111-P113 WeakPolarHBondContact O-CD 3.33Å; P113-Q166 HydrophobicContact CB-CG 4.2Å; P113-Q166 HydrophobicContact CG-CG 4.28Å | ||
| 114 | D | 78.1 | Confident | 72.6 | Confident | 19 Ų | 19 | 60.7 Ų | 60.7 | 10% | 0.102 | 30% | 0.301 | C | S | . | . | trans | -82.8 | 134.2 | 170 | -42.7 | -39 | 0 | 0 | 0 | 109.9 | I88 K91 N112 P118 Y173 | I88-D114 WeakPolarHBondContact CG1-OD2 3.35Å; K91-D114 WeakPolarHBondContact CD-OD2 3.34Å; K91-D114 IonicContact NZ-OD1 3Å; K91-D114 PolarHBondContact NZ-OD1 3.36Å; K91-D114 IonicContact NZ-OD2 2.68Å; K91-D114 PolarHBondContact NZ-OD2 3.3Å; N112-D114 PolarHBondContact O-N 2.76Å; D114-P118 WeakPolarHBondContact O-CD 3.17Å; D114-P118 WeakPolarHBondContact O-CG 3.37Å; D114-Y173 PolarHBondContact OD2-OH 3.14Å; D114-Y173 VanDerWaalsContact OD2-OH 3.05Å | ||
| 115 | F | 76.2 | Confident | 74.5 | Confident | 113 Ų | 113 | 57.7 Ų | 57.7 | 50% | 0.496 | 29% | 0.288 | S | S | . | . | S | Bend | trans | -81.5 | -37.6 | 172.8 | 179.1 | -106.2 | 0 | 0 | 0 | 112.4 | P118 L119 L168 | F115-P118 WeakPolarHBondContact O-CD 3.3Å; F115-L119 HydrophobicContact CD1-CD1 4.19Å; F115-L119 HydrophobicContact CE1-CD1 3.41Å; F115-L119 VanDerWaalsContact CE1-CD1 3.41Å; F115-L119 HydrophobicContact CZ-CD1 3.63Å; F115-L119 VanDerWaalsContact O-CB 3.24Å; F115-L119 WeakPolarHBondContact O-CB 3.41Å; F115-L119 PolarHBondContact O-N 3.2Å; F115-L168 HydrophobicContact CD2-CD2 3.98Å; F115-L168 HydrophobicContact CE2-CD2 3.99Å |
| 116 | W | 81.8 | Confident | 76.1 | Confident | 134 Ų | 134 | 52.9 Ų | 52.9 | 51% | 0.508 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -74.4 | -38.4 | -171 | -71.6 | 104.4 | 0 | 0 | 0 | 114 | I83 L119 A120 | I83-W116 HydrophobicContact CD1-CB 4.11Å; I83-W116 HydrophobicContact CD1-CD2 4.24Å; I83-W116 HydrophobicContact CD1-CG 3.74Å; I83-W116 HydrophobicContact CG1-CB 4.34Å; I83-W116 HydrophobicContact CG1-CG 4.15Å; W116-L119 PolarHBondContact O-N 2.87Å; W116-A120 WeakPolarHBondContact O-CB 3.45Å; W116-A120 PolarHBondContact O-N 3.19Å |
| 117 | G | 83.3 | Confident | 77.5 | Confident | 4 Ų | 4 | 54.6 Ų | 54.6 | 4% | 0.041 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -61.5 | -56 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | L119 A120 V121 | G117-L119 VanDerWaalsContact C-N 3.3Å; G117-L119 PolarHBondContact O-N 3Å; G117-A120 PolarHBondContact O-N 2.68Å; G117-V121 WeakPolarHBondContact O-CG2 3.43Å; G117-V121 PolarHBondContact O-N 3.31Å |
| 118 | P | 85.6 | Confident | 78.7 | Confident | 1 Ų | 1 | 50.2 Ų | 50.2 | 1% | 0.006 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -63.5 | -36.6 | 177.5 | -3.8 | 12.6 | 0 | 0 | 0 | 112 | D114 F115 A120 V121 V122 W144 Y173 | D114-P118 WeakPolarHBondContact O-CD 3.17Å; D114-P118 WeakPolarHBondContact O-CG 3.37Å; F115-P118 WeakPolarHBondContact O-CD 3.3Å; P118-A120 VanDerWaalsContact C-N 3.35Å; P118-A120 PolarHBondContact O-N 3.06Å; P118-V121 PolarHBondContact O-N 3.05Å; P118-V122 WeakPolarHBondContact O-CG2 3.47Å; P118-V122 PolarHBondContact O-N 3.27Å; P118-W144 HydrophobicContact CB-CZ2 4.02Å; P118-Y173 HydrophobicContact CB-CD2 4.21Å; P118-Y173 HydrophobicContact CB-CE2 4.25Å; P118-Y173 HydrophobicContact CB-CG 4.43Å; P118-Y173 VanDerWaalsContact CD-CZ 3.4Å; P118-Y173 WeakPolarHBondContact CD-OH 3.49Å; P118-Y173 HydrophobicContact CG-CD2 3.82Å; P118-Y173 HydrophobicContact CG-CE1 4.42Å; P118-Y173 HydrophobicContact CG-CE2 3.43Å; P118-Y173 VanDerWaalsContact CG-CE2 3.43Å; P118-Y173 HydrophobicContact CG-CG 4.44Å |
| 119 | L | 88 | Confident | 79.6 | Confident | 37 Ų | 37 | 49.3 Ų | 49.3 | 19% | 0.194 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -59 | -46.6 | 174.7 | -177.2 | 158 | 0 | 0 | 0 | 111.1 | F115 W116 G117 V121 V122 L123 W144 | F115-L119 HydrophobicContact CD1-CD1 4.19Å; F115-L119 HydrophobicContact CE1-CD1 3.41Å; F115-L119 VanDerWaalsContact CE1-CD1 3.41Å; F115-L119 HydrophobicContact CZ-CD1 3.63Å; F115-L119 VanDerWaalsContact O-CB 3.24Å; F115-L119 WeakPolarHBondContact O-CB 3.41Å; F115-L119 PolarHBondContact O-N 3.2Å; W116-L119 PolarHBondContact O-N 2.87Å; G117-L119 VanDerWaalsContact C-N 3.3Å; G117-L119 PolarHBondContact O-N 3Å; L119-V121 VanDerWaalsContact C-N 3.33Å; L119-V121 PolarHBondContact O-N 3.44Å; L119-V122 PolarHBondContact O-N 3.05Å; L119-L123 HydrophobicContact CD2-CD1 3.69Å; L119-L123 HydrophobicContact CD2-CG 4.13Å; L119-L123 WeakPolarHBondContact O-CB 3.47Å; L119-L123 PolarHBondContact O-N 2.87Å; L119-W144 HydrophobicContact CB-CH2 4.09Å; L119-W144 HydrophobicContact CB-CZ3 4.47Å |
| 120 | A | 86.9 | Confident | 79.9 | Confident | 55 Ų | 55 | 52.2 Ų | 52.2 | 46% | 0.455 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -61.8 | -40.7 | 177 | 0 | 0 | 0 | 0 | 0 | 111.8 | W116 G117 P118 L123 F124 | W116-A120 WeakPolarHBondContact O-CB 3.45Å; W116-A120 PolarHBondContact O-N 3.19Å; G117-A120 PolarHBondContact O-N 2.68Å; P118-A120 VanDerWaalsContact C-N 3.35Å; P118-A120 PolarHBondContact O-N 3.06Å; A120-L123 PolarHBondContact O-N 2.96Å; A120-F124 WeakPolarHBondContact O-CB 3.21Å; A120-F124 PolarHBondContact O-N 3.14Å |
| 121 | V | 88.1 | Confident | 80 | Confident | 14 Ų | 14 | 60.9 Ų | 60.9 | 9% | 0.085 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -62.4 | -46 | 175.6 | 174.5 | 0 | 0 | 0 | 0 | 111.2 | G117 P118 L119 F124 F125 G172 Y173 L175 L176 I179 | G117-V121 WeakPolarHBondContact O-CG2 3.43Å; G117-V121 PolarHBondContact O-N 3.31Å; P118-V121 PolarHBondContact O-N 3.05Å; L119-V121 VanDerWaalsContact C-N 3.33Å; L119-V121 PolarHBondContact O-N 3.44Å; V121-F124 PolarHBondContact O-N 3.16Å; V121-F125 PolarHBondContact O-N 3.04Å; V121-G172 WeakPolarHBondContact CG1-O 3.38Å; V121-Y173 HydrophobicContact CG2-CD1 4.24Å; V121-L175 HydrophobicContact CG1-CB 4.19Å; V121-L176 HydrophobicContact CG1-CB 4.29Å; V121-L176 HydrophobicContact CG2-CD1 4.29Å; V121-I179 HydrophobicContact CG1-CD1 3.65Å; V121-I179 WeakPolarHBondContact O-CD1 3.15Å |
| 122 | V | 90.3 | Very high | 79.6 | Confident | 0 Ų | 0 | 59.4 Ų | 59.4 | 0% | 0 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -65.3 | -40.8 | 178.6 | 179.5 | 0 | 0 | 0 | 0 | 110.8 | P118 L119 F124 F125 S126 I140 I141 W144 L175 | P118-V122 WeakPolarHBondContact O-CG2 3.47Å; P118-V122 PolarHBondContact O-N 3.27Å; L119-V122 PolarHBondContact O-N 3.05Å; V122-F124 VanDerWaalsContact C-N 3.35Å; V122-F125 PolarHBondContact O-N 3.05Å; V122-S126 WeakPolarHBondContact O-CB 3.46Å; V122-S126 PolarHBondContact O-N 3.23Å; V122-I140 HydrophobicContact CG1-CG2 3.9Å; V122-I141 HydrophobicContact CB-CD1 4.46Å; V122-I141 HydrophobicContact CG1-CD1 3.65Å; V122-W144 HydrophobicContact CB-CD2 4.42Å; V122-W144 HydrophobicContact CB-CE3 4.49Å; V122-W144 HydrophobicContact CG1-CB 4.35Å; V122-W144 HydrophobicContact CG1-CD2 4.25Å; V122-W144 HydrophobicContact CG1-CE3 4.27Å; V122-W144 HydrophobicContact CG1-CG 4.29Å; V122-W144 HydrophobicContact CG2-CD2 3.68Å; V122-W144 HydrophobicContact CG2-CE3 4.19Å; V122-W144 HydrophobicContact CG2-CG 3.92Å; V122-W144 HydrophobicContact CG2-CZ2 4.16Å; V122-L175 HydrophobicContact CB-CD1 4.24Å; V122-L175 HydrophobicContact CG1-CD1 4.35Å; V122-L175 HydrophobicContact CG2-CD1 3.57Å |
| 123 | L | 89.3 | Confident | 79.5 | Confident | 84 Ų | 84 | 61.5 Ų | 61.5 | 44% | 0.44 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -62.8 | -41.3 | 174.2 | -86.5 | -174.4 | 0 | 0 | 0 | 112 | L119 A120 S126 M127 I141 | L119-L123 HydrophobicContact CD2-CD1 3.69Å; L119-L123 HydrophobicContact CD2-CG 4.13Å; L119-L123 WeakPolarHBondContact O-CB 3.47Å; L119-L123 PolarHBondContact O-N 2.87Å; A120-L123 PolarHBondContact O-N 2.96Å; L123-S126 CarbonylContact O-C 3.56Å; L123-S126 WeakPolarHBondContact O-CB 3.38Å; L123-S126 PolarHBondContact O-N 3.06Å; L123-M127 WeakPolarHBondContact O-CB 3.23Å; L123-M127 PolarHBondContact O-N 2.88Å; L123-I141 HydrophobicContact CD2-CD1 4.41Å |
| 124 | F | 87.9 | Confident | 79.9 | Confident | 116 Ų | 116 | 66.9 Ų | 66.9 | 51% | 0.509 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -65.7 | -44.3 | 177.6 | -168.1 | -102.8 | 0 | 0 | 0 | 111.6 | A120 V121 V122 S126 M127 I128 I179 | A120-F124 WeakPolarHBondContact O-CB 3.21Å; A120-F124 PolarHBondContact O-N 3.14Å; V121-F124 PolarHBondContact O-N 3.16Å; V122-F124 VanDerWaalsContact C-N 3.35Å; F124-S126 VanDerWaalsContact C-N 3.27Å; F124-S126 PolarHBondContact O-N 3.43Å; F124-M127 WeakPolarHBondContact O-CB 3.09Å; F124-M127 PolarHBondContact O-N 3.42Å; F124-M127 VanDerWaalsContact O-N 3.12Å; F124-I128 HydrophobicContact CD1-CD1 3.93Å; F124-I128 HydrophobicContact CE1-CD1 3.7Å; F124-I128 HydrophobicContact CE1-CG1 4.39Å; F124-I128 HydrophobicContact CZ-CD1 4.46Å; F124-I128 WeakPolarHBondContact O-CG1 3.29Å; F124-I128 PolarHBondContact O-N 3.39Å; F124-I128 VanDerWaalsContact O-N 3.08Å; F124-I179 HydrophobicContact CB-CD1 4.45Å; F124-I179 HydrophobicContact CD1-CD1 4.03Å; F124-I179 HydrophobicContact CD1-CG1 4.37Å; F124-I179 HydrophobicContact CD1-CG2 3.45Å; F124-I179 VanDerWaalsContact CD1-CG2 3.45Å; F124-I179 HydrophobicContact CE1-CG2 3.45Å; F124-I179 VanDerWaalsContact CE1-CG2 3.45Å |
| 125 | F | 88.3 | Confident | 79.9 | Confident | 4 Ų | 4 | 75 Ų | 75 | 2% | 0.018 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -55.9 | -45 | 170.9 | 174.4 | -101.6 | 0 | 0 | 0 | 111.5 | V121 V122 M127 I128 S129 I140 L178 I179 F237 Y241 | V121-F125 PolarHBondContact O-N 3.04Å; V122-F125 PolarHBondContact O-N 3.05Å; F125-M127 VanDerWaalsContact C-N 3.3Å; F125-M127 PolarHBondContact O-N 3.41Å; F125-I128 PolarHBondContact O-N 3.31Å; F125-S129 PolarHBondContact O-N 2.93Å; F125-S129 VanDerWaalsContact O-N 3.09Å; F125-I140 HydrophobicContact CD1-CD1 4.37Å; F125-I140 HydrophobicContact CD1-CG2 4.09Å; F125-I140 HydrophobicContact CE1-CD1 4.18Å; F125-I140 HydrophobicContact CE1-CG2 4.33Å; F125-L178 HydrophobicContact CD2-CB 4.4Å; F125-L178 HydrophobicContact CE2-CB 4.15Å; F125-I179 HydrophobicContact CB-CD1 3.85Å; F125-I179 HydrophobicContact CB-CG1 3.8Å; F125-I179 HydrophobicContact CD2-CG1 4.1Å; F125-I179 HydrophobicContact CG-CG1 4.47Å; F125-F237 HydrophobicContact CE1-CD1 4.2Å; F125-F237 HydrophobicContact CZ-CB 4.35Å; F125-Y241 HydrophobicContact CE2-CD2 4.49Å |
| 126 | S | 86.9 | Confident | 80.2 | Confident | 2 Ų | 2 | 71.3 Ų | 71.3 | 1% | 0.014 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -64.6 | -33.8 | 177.5 | -172 | 0 | 0 | 0 | 0 | 113 | V122 L123 F124 S129 L130 V137 | V122-S126 WeakPolarHBondContact O-CB 3.46Å; V122-S126 PolarHBondContact O-N 3.23Å; L123-S126 CarbonylContact O-C 3.56Å; L123-S126 WeakPolarHBondContact O-CB 3.38Å; L123-S126 PolarHBondContact O-N 3.06Å; F124-S126 VanDerWaalsContact C-N 3.27Å; F124-S126 PolarHBondContact O-N 3.43Å; S126-S129 WeakPolarHBondContact O-CB 3.34Å; S126-S129 PolarHBondContact O-N 3.24Å; S126-L130 PolarHBondContact O-N 2.86Å; S126-V137 VanDerWaalsContact OG-CA 3.31Å; S126-V137 WeakPolarHBondContact OG-CA 3.47Å; S126-V137 WeakPolarHBondContact OG-CB 3.48Å; S126-V137 VanDerWaalsContact OG-CG1 3.32Å; S126-V137 WeakPolarHBondContact OG-CG1 3.35Å; S126-V137 WeakPolarHBondContact OG-CG2 3.49Å |
| 127 | M | 84.2 | Confident | 80.4 | Confident | 119 Ų | 119 | 66.5 Ų | 66.5 | 59% | 0.586 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -66.4 | -42.6 | 176.7 | -166.2 | -75.9 | 174.7 | 0 | 0 | 110.6 | L123 F124 F125 S129 L130 | L123-M127 WeakPolarHBondContact O-CB 3.23Å; L123-M127 PolarHBondContact O-N 2.88Å; F124-M127 WeakPolarHBondContact O-CB 3.09Å; F124-M127 PolarHBondContact O-N 3.42Å; F124-M127 VanDerWaalsContact O-N 3.12Å; F125-M127 VanDerWaalsContact C-N 3.3Å; F125-M127 PolarHBondContact O-N 3.41Å; M127-S129 PolarHBondContact O-N 3.45Å; M127-L130 HydrophobicContact CB-CD1 4.45Å; M127-L130 HydrophobicContact CG-CD1 4.11Å; M127-L130 WeakPolarHBondContact O-CB 3.32Å; M127-L130 PolarHBondContact O-N 3.24Å |
| 128 | I | 82.1 | Confident | 80.6 | Confident | 41 Ų | 41 | 70 Ų | 70 | 21% | 0.21 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -62.3 | -34.3 | 174.2 | -61.9 | 170.8 | 0 | 0 | 0 | 110.7 | F124 F125 L130 I179 A182 Y241 | F124-I128 HydrophobicContact CD1-CD1 3.93Å; F124-I128 HydrophobicContact CE1-CD1 3.7Å; F124-I128 HydrophobicContact CE1-CG1 4.39Å; F124-I128 HydrophobicContact CZ-CD1 4.46Å; F124-I128 WeakPolarHBondContact O-CG1 3.29Å; F124-I128 PolarHBondContact O-N 3.39Å; F124-I128 VanDerWaalsContact O-N 3.08Å; F125-I128 PolarHBondContact O-N 3.31Å; I128-L130 VanDerWaalsContact C-N 3.26Å; I128-L130 PolarHBondContact O-N 3.27Å; I128-I179 HydrophobicContact CD1-CB 4.45Å; I128-I179 HydrophobicContact CD1-CG1 4.48Å; I128-I179 HydrophobicContact CD1-CG2 3.86Å; I128-A182 HydrophobicContact CD1-CB 4.34Å; I128-A182 HydrophobicContact CG2-CB 3.86Å; I128-Y241 HydrophobicContact CG2-CE2 3.93Å |
| 129 | S | 76.9 | Confident | 80.7 | Confident | 15 Ų | 15 | 76.4 Ų | 76.4 | 11% | 0.105 | 38% | 0.379 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -74.5 | -6.1 | 176 | -162.4 | 0 | 0 | 0 | 0 | 114.4 | F125 S126 M127 Y131 | F125-S129 PolarHBondContact O-N 2.93Å; F125-S129 VanDerWaalsContact O-N 3.09Å; S126-S129 WeakPolarHBondContact O-CB 3.34Å; S126-S129 PolarHBondContact O-N 3.24Å; M127-S129 PolarHBondContact O-N 3.45Å; S129-Y131 PolarHBondContact O-N 3.48Å |
| 130 | L | 66.8 | Low | 80.8 | Confident | 66 Ų | 66 | 74.6 Ų | 74.6 | 35% | 0.346 | 37% | 0.369 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.1 | 4.2 | -175.4 | -81 | 171.8 | 0 | 0 | 0 | 115.5 | S126 M127 I128 G132 F134 V137 | S126-L130 PolarHBondContact O-N 2.86Å; M127-L130 HydrophobicContact CB-CD1 4.45Å; M127-L130 HydrophobicContact CG-CD1 4.11Å; M127-L130 WeakPolarHBondContact O-CB 3.32Å; M127-L130 PolarHBondContact O-N 3.24Å; I128-L130 VanDerWaalsContact C-N 3.26Å; I128-L130 PolarHBondContact O-N 3.27Å; L130-G132 PolarHBondContact O-N 3.4Å; L130-F134 HydrophobicContact CD2-CD1 4.39Å; L130-V137 HydrophobicContact CD2-CG2 3.42Å; L130-V137 VanDerWaalsContact CD2-CG2 3.42Å; L130-V137 HydrophobicContact CG-CG2 4.17Å |
| 131 | Y | 62.7 | Low | 81 | Confident | 218 Ų | 218 | 74 Ų | 74 | 86% | 0.855 | 36% | 0.358 | S | S | * | . | S | Bend | trans | -64 | 12.3 | 172.7 | -82.3 | -83 | 0 | 0 | 0 | 114.4 | S129 | S129-Y131 PolarHBondContact O-N 3.48Š|
| 132 | G | 55.9 | Low | 81.2 | Confident | 55 Ų | 55 | 75.9 Ų | 75.9 | 57% | 0.567 | 37% | 0.37 | S | S | * | . | S | Bend | trans | -139.7 | -51.4 | -176 | 0 | 0 | 0 | 0 | 0 | 118.3 | L130 | L130-G132 PolarHBondContact O-N 3.4Š|
| 133 | Q | 65 | Low | 81.3 | Confident | 130 Ų | 130 | 76.9 Ų | 76.9 | 61% | 0.607 | 38% | 0.375 | S | S | * | . | trans | -179.4 | 146 | -176.6 | -106.7 | 147.7 | 18.5 | 0 | 0 | 112.9 | R135 V136 | Q133-R135 HydrophobicContact CB-CB 4.38Å; Q133-R135 PolarHBondContact O-N 3.43Å; Q133-R135 VanDerWaalsContact O-N 3.09Å; Q133-V136 HydrophobicContact CB-CG2 4.41Å; Q133-V136 PolarHBondContact O-N 3.02Å | ||
| 134 | F | 73.3 | Confident | 81.5 | Confident | 177 Ų | 177 | 73 Ų | 73 | 78% | 0.776 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -57.2 | -24 | 171.4 | -71.1 | -73.5 | 0 | 0 | 0 | 114 | L130 V136 V137 | L130-F134 HydrophobicContact CD2-CD1 4.39Å; F134-V136 PolarHBondContact O-N 2.76Å; F134-V137 WeakPolarHBondContact O-CB 3.18Å; F134-V137 PolarHBondContact O-N 2.9Å |
| 135 | R | 77.9 | Confident | 81.7 | Confident | 189 Ų | 189 | 70.9 Ų | 70.9 | 71% | 0.713 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -60.1 | -32.4 | 176.1 | -176.3 | 179.7 | -80.7 | -132.4 | -0.6 | 112.3 | Q133 W139 | Q133-R135 HydrophobicContact CB-CB 4.38Å; Q133-R135 PolarHBondContact O-N 3.43Å; Q133-R135 VanDerWaalsContact O-N 3.09Å; R135-W139 PolarHBondContact O-N 3.35Å |
| 136 | V | 83.1 | Confident | 82 | Confident | 36 Ų | 36 | 76.9 Ų | 76.9 | 22% | 0.218 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -70.7 | -36.3 | -178.4 | -174.4 | 0 | 0 | 0 | 0 | 111.1 | Q133 F134 S138 W139 I140 | Q133-V136 HydrophobicContact CB-CG2 4.41Å; Q133-V136 PolarHBondContact O-N 3.02Å; F134-V136 PolarHBondContact O-N 2.76Å; V136-S138 PolarHBondContact O-N 2.87Å; V136-W139 WeakPolarHBondContact O-CB 3.42Å; V136-W139 PolarHBondContact O-N 2.92Å; V136-I140 HydrophobicContact CG1-CD1 3.95Å; V136-I140 HydrophobicContact CG1-CG1 4.31Å; V136-I140 WeakPolarHBondContact O-CG1 3.45Å; V136-I140 PolarHBondContact O-N 3.07Å |
| 137 | V | 85.4 | Confident | 82.3 | Confident | 34 Ų | 34 | 77.4 Ų | 77.4 | 21% | 0.206 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -58.8 | -50.3 | 178.4 | -179.8 | 0 | 0 | 0 | 0 | 111.4 | S126 L130 F134 W139 I140 I141 | S126-V137 VanDerWaalsContact OG-CA 3.31Å; S126-V137 WeakPolarHBondContact OG-CA 3.47Å; S126-V137 WeakPolarHBondContact OG-CB 3.48Å; S126-V137 VanDerWaalsContact OG-CG1 3.32Å; S126-V137 WeakPolarHBondContact OG-CG1 3.35Å; S126-V137 WeakPolarHBondContact OG-CG2 3.49Å; L130-V137 HydrophobicContact CD2-CG2 3.42Å; L130-V137 VanDerWaalsContact CD2-CG2 3.42Å; L130-V137 HydrophobicContact CG-CG2 4.17Å; F134-V137 WeakPolarHBondContact O-CB 3.18Å; F134-V137 PolarHBondContact O-N 2.9Å; V137-W139 VanDerWaalsContact C-N 3.26Å; V137-W139 PolarHBondContact O-N 3.42Å; V137-I140 PolarHBondContact O-N 3.09Å; V137-I141 WeakPolarHBondContact O-CG1 2.99Å; V137-I141 PolarHBondContact O-N 2.72Å; V137-I141 VanDerWaalsContact O-N 3.08Å |
| 138 | S | 87.1 | Confident | 82.7 | Confident | 77 Ų | 77 | 71.7 Ų | 71.7 | 54% | 0.538 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -60.5 | -39.2 | 178.7 | -177.4 | 0 | 0 | 0 | 0 | 111.4 | V136 T142 | V136-S138 PolarHBondContact O-N 2.87Å; S138-T142 WeakPolarHBondContact O-CB 3.47Å; S138-T142 PolarHBondContact O-N 3.06Å; S138-T142 PolarHBondContact O-OG1 2.95Å |
| 139 | W | 88.6 | Confident | 83.3 | Confident | 135 Ų | 135 | 72.8 Ų | 72.8 | 51% | 0.511 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -64.4 | -45.2 | 175 | -96.6 | 106.1 | 0 | 0 | 0 | 113.2 | R135 V136 V137 I141 T142 I143 | R135-W139 PolarHBondContact O-N 3.35Å; V136-W139 WeakPolarHBondContact O-CB 3.42Å; V136-W139 PolarHBondContact O-N 2.92Å; V137-W139 VanDerWaalsContact C-N 3.26Å; V137-W139 PolarHBondContact O-N 3.42Å; W139-I141 VanDerWaalsContact C-N 3.35Å; W139-I141 PolarHBondContact O-N 3.46Å; W139-T142 PolarHBondContact O-N 2.83Å; W139-I143 HydrophobicContact CE3-CD1 3.56Å; W139-I143 HydrophobicContact CE3-CG1 4.01Å; W139-I143 HydrophobicContact CZ3-CD1 4.09Å; W139-I143 HydrophobicContact CZ3-CG1 4.29Å; W139-I143 WeakPolarHBondContact O-CB 3.38Å; W139-I143 WeakPolarHBondContact O-CD1 3.43Å; W139-I143 WeakPolarHBondContact O-CG1 3.42Å; W139-I143 PolarHBondContact O-N 2.86Å |
| 140 | I | 90.4 | Very high | 84 | Confident | 0 Ų | 0 | 76.2 Ų | 76.2 | 0% | 0 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -57.6 | -48.4 | 177.4 | -69.9 | 166.1 | 0 | 0 | 0 | 110.4 | V122 F125 V136 V137 I143 W144 F237 L240 | V122-I140 HydrophobicContact CG1-CG2 3.9Å; F125-I140 HydrophobicContact CD1-CD1 4.37Å; F125-I140 HydrophobicContact CD1-CG2 4.09Å; F125-I140 HydrophobicContact CE1-CD1 4.18Å; F125-I140 HydrophobicContact CE1-CG2 4.33Å; V136-I140 HydrophobicContact CG1-CD1 3.95Å; V136-I140 HydrophobicContact CG1-CG1 4.31Å; V136-I140 WeakPolarHBondContact O-CG1 3.45Å; V136-I140 PolarHBondContact O-N 3.07Å; V137-I140 PolarHBondContact O-N 3.09Å; I140-I143 PolarHBondContact O-N 2.87Å; I140-W144 WeakPolarHBondContact O-CB 3.28Å; I140-W144 PolarHBondContact O-N 3.19Å; I140-F237 HydrophobicContact CG2-CE1 4.17Å; I140-L240 HydrophobicContact CG1-CD1 3.81Å |
| 141 | I | 90.6 | Very high | 85.2 | Confident | 41 Ų | 41 | 73.3 Ų | 73.3 | 21% | 0.21 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -64.6 | -43.9 | 179.2 | -64.8 | -69.4 | 0 | 0 | 0 | 111.1 | V122 L123 V137 W139 I143 W144 I145 | V122-I141 HydrophobicContact CB-CD1 4.46Å; V122-I141 HydrophobicContact CG1-CD1 3.65Å; L123-I141 HydrophobicContact CD2-CD1 4.41Å; V137-I141 WeakPolarHBondContact O-CG1 2.99Å; V137-I141 PolarHBondContact O-N 2.72Å; V137-I141 VanDerWaalsContact O-N 3.08Å; W139-I141 VanDerWaalsContact C-N 3.35Å; W139-I141 PolarHBondContact O-N 3.46Å; I141-I143 PolarHBondContact O-N 2.96Å; I141-W144 HydrophobicContact CD1-CE3 4.36Å; I141-W144 PolarHBondContact O-N 2.94Å; I141-I145 HydrophobicContact CG2-CD1 3.94Å; I141-I145 WeakPolarHBondContact O-CG1 3.31Å; I141-I145 PolarHBondContact O-N 3.17Å |
| 142 | T | 92.2 | Very high | 86.6 | Confident | 54 Ų | 54 | 64.8 Ų | 64.8 | 33% | 0.331 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -59.4 | -47.8 | 178.2 | -59.9 | 0 | 0 | 0 | 0 | 110.8 | S138 W139 W144 I145 F146 | S138-T142 WeakPolarHBondContact O-CB 3.47Å; S138-T142 PolarHBondContact O-N 3.06Å; S138-T142 PolarHBondContact O-OG1 2.95Å; W139-T142 PolarHBondContact O-N 2.83Å; T142-W144 VanDerWaalsContact C-N 3.33Å; T142-W144 PolarHBondContact O-N 3.31Å; T142-I145 PolarHBondContact O-N 3.08Å; T142-F146 HydrophobicContact CG2-CD2 3.67Å; T142-F146 HydrophobicContact CG2-CE2 4.03Å; T142-F146 WeakPolarHBondContact O-CB 3.34Å; T142-F146 WeakPolarHBondContact O-CD2 3.07Å; T142-F146 PolarHBondContact O-N 3.01Å |
| 143 | I | 92.3 | Very high | 88.3 | Confident | 21 Ų | 21 | 66.7 Ų | 66.7 | 11% | 0.108 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -67.9 | -34.9 | 178.8 | -74.5 | 154.8 | 0 | 0 | 0 | 111.9 | W139 I140 I141 G147 L233 Y236 F237 L240 | W139-I143 HydrophobicContact CE3-CD1 3.56Å; W139-I143 HydrophobicContact CE3-CG1 4.01Å; W139-I143 HydrophobicContact CZ3-CD1 4.09Å; W139-I143 HydrophobicContact CZ3-CG1 4.29Å; W139-I143 WeakPolarHBondContact O-CB 3.38Å; W139-I143 WeakPolarHBondContact O-CD1 3.43Å; W139-I143 WeakPolarHBondContact O-CG1 3.42Å; W139-I143 PolarHBondContact O-N 2.86Å; I140-I143 PolarHBondContact O-N 2.87Å; I141-I143 PolarHBondContact O-N 2.96Å; I143-G147 WeakPolarHBondContact O-CA 3.35Å; I143-G147 PolarHBondContact O-N 2.71Å; I143-L233 HydrophobicContact CG2-CD1 3.78Å; I143-Y236 HydrophobicContact CD1-CD1 3.69Å; I143-Y236 HydrophobicContact CD1-CE1 3.04Å; I143-Y236 HydrophobicContact CG1-CE1 4.19Å; I143-Y236 HydrophobicContact CG2-CD1 4.19Å; I143-F237 HydrophobicContact CG2-CE1 4.2Å; I143-F237 HydrophobicContact CG2-CZ 4.17Å; I143-L240 HydrophobicContact CD1-CD1 3.79Å |
| 144 | W | 93.3 | Very high | 89.5 | Confident | 3 Ų | 3 | 63.1 Ų | 63.1 | 1% | 0.011 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -61.5 | -46 | 174.8 | 172.5 | 54.9 | 0 | 0 | 0 | 111.5 | P118 L119 V122 I140 I141 T142 S148 L168 F237 | P118-W144 HydrophobicContact CB-CZ2 4.02Å; L119-W144 HydrophobicContact CB-CH2 4.09Å; L119-W144 HydrophobicContact CB-CZ3 4.47Å; V122-W144 HydrophobicContact CB-CD2 4.42Å; V122-W144 HydrophobicContact CB-CE3 4.49Å; V122-W144 HydrophobicContact CG1-CB 4.35Å; V122-W144 HydrophobicContact CG1-CD2 4.25Å; V122-W144 HydrophobicContact CG1-CE3 4.27Å; V122-W144 HydrophobicContact CG1-CG 4.29Å; V122-W144 HydrophobicContact CG2-CD2 3.68Å; V122-W144 HydrophobicContact CG2-CE3 4.19Å; V122-W144 HydrophobicContact CG2-CG 3.92Å; V122-W144 HydrophobicContact CG2-CZ2 4.16Å; I140-W144 WeakPolarHBondContact O-CB 3.28Å; I140-W144 PolarHBondContact O-N 3.19Å; I141-W144 HydrophobicContact CD1-CE3 4.36Å; I141-W144 PolarHBondContact O-N 2.94Å; T142-W144 VanDerWaalsContact C-N 3.33Å; T142-W144 PolarHBondContact O-N 3.31Å; W144-S148 WeakPolarHBondContact O-CB 3.4Å; W144-S148 PolarHBondContact O-N 3.31Å; W144-S148 PolarHBondContact O-OG 3.06Å; W144-L168 HydrophobicContact CD2-CD1 4.02Å; W144-L168 HydrophobicContact CE3-CD1 4.44Å; W144-L168 HydrophobicContact CH2-CD1 4.07Å; W144-L168 HydrophobicContact CH2-CD2 4.3Å; W144-L168 HydrophobicContact CH2-CG 4.1Å; W144-L168 HydrophobicContact CZ2-CD1 3.57Å; W144-L168 HydrophobicContact CZ2-CD2 4.25Å; W144-L168 HydrophobicContact CZ2-CG 3.58Å; W144-L168 HydrophobicContact CZ3-CD1 4.47Å; W144-L168 PolarHBondContact NE1-O 3.16Å; W144-F237 HydrophobicContact CB-CE1 4.43Å; W144-F237 HydrophobicContact CB-CZ 4Å |
| 145 | I | 93.5 | Very high | 90.1 | Very high | 71 Ų | 71 | 54.9 Ų | 54.9 | 36% | 0.364 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -68.6 | -54.6 | 177.7 | -65 | 171.8 | 0 | 0 | 0 | 111.1 | I141 T142 G147 S148 L149 Y164 | I141-I145 HydrophobicContact CG2-CD1 3.94Å; I141-I145 WeakPolarHBondContact O-CG1 3.31Å; I141-I145 PolarHBondContact O-N 3.17Å; T142-I145 PolarHBondContact O-N 3.08Å; I145-G147 PolarHBondContact O-N 3.44Å; I145-S148 PolarHBondContact O-OG 3.41Å; I145-L149 WeakPolarHBondContact O-CB 3.4Å; I145-L149 PolarHBondContact O-N 2.86Å; I145-Y164 PolarHBondContact O-OH 3.13Å; I145-Y164 VanDerWaalsContact O-OH 3.11Å |
| 146 | F | 94.7 | Very high | 90.6 | Very high | 131 Ų | 131 | 53.6 Ų | 53.6 | 58% | 0.575 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -70.1 | -34.8 | -177.7 | -83 | -85.5 | 0 | 0 | 0 | 113.3 | T142 L149 T150 | T142-F146 HydrophobicContact CG2-CD2 3.67Å; T142-F146 HydrophobicContact CG2-CE2 4.03Å; T142-F146 WeakPolarHBondContact O-CB 3.34Å; T142-F146 WeakPolarHBondContact O-CD2 3.07Å; T142-F146 PolarHBondContact O-N 3.01Å; F146-L149 PolarHBondContact O-N 2.79Å; F146-T150 WeakPolarHBondContact O-CB 3.34Å; F146-T150 PolarHBondContact O-N 3.5Å; F146-T150 PolarHBondContact O-OG1 2.96Å |
| 147 | G | 93.3 | Very high | 90.8 | Very high | 12 Ų | 12 | 57.7 Ų | 57.7 | 12% | 0.124 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -65.6 | -49.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111 | I143 I145 L149 T150 I151 | I143-G147 WeakPolarHBondContact O-CA 3.35Å; I143-G147 PolarHBondContact O-N 2.71Å; I145-G147 PolarHBondContact O-N 3.44Å; G147-L149 VanDerWaalsContact C-N 3.29Å; G147-L149 PolarHBondContact O-N 3.47Å; G147-T150 WeakPolarHBondContact O-CB 3.48Å; G147-T150 PolarHBondContact O-N 2.85Å; G147-T150 VanDerWaalsContact O-N 3.17Å; G147-I151 WeakPolarHBondContact O-CG1 3.45Å; G147-I151 PolarHBondContact O-N 3.42Å |
| 148 | S | 91.9 | Very high | 90.8 | Very high | 0 Ų | 0 | 57.9 Ų | 57.9 | 0% | 0 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -62.7 | -35.6 | 174 | 61.6 | 0 | 0 | 0 | 0 | 112.3 | W144 I145 T150 I151 F152 Y164 L168 | W144-S148 WeakPolarHBondContact O-CB 3.4Å; W144-S148 PolarHBondContact O-N 3.31Å; W144-S148 PolarHBondContact O-OG 3.06Å; I145-S148 PolarHBondContact O-OG 3.41Å; S148-T150 VanDerWaalsContact C-N 3.34Å; S148-T150 PolarHBondContact O-N 3.49Å; S148-I151 PolarHBondContact O-N 3.26Å; S148-F152 VanDerWaalsContact O-CB 3.26Å; S148-F152 WeakPolarHBondContact O-CB 3.49Å; S148-F152 PolarHBondContact O-N 2.89Å; S148-Y164 PolarHBondContact OG-OH 3.21Å; S148-L168 WeakPolarHBondContact OG-CD1 3.5Å |
| 149 | L | 93.8 | Very high | 90.3 | Very high | 63 Ų | 63 | 57.2 Ų | 57.2 | 33% | 0.33 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -62.3 | -42.9 | 173.9 | -179.7 | 65.8 | 0 | 0 | 0 | 111.3 | I145 F146 G147 F152 L153 Y164 | I145-L149 WeakPolarHBondContact O-CB 3.4Å; I145-L149 PolarHBondContact O-N 2.86Å; F146-L149 PolarHBondContact O-N 2.79Å; G147-L149 VanDerWaalsContact C-N 3.29Å; G147-L149 PolarHBondContact O-N 3.47Å; L149-F152 HydrophobicContact CD1-CD1 4.13Å; L149-F152 WeakPolarHBondContact O-CB 3.38Å; L149-F152 PolarHBondContact O-N 3.46Å; L149-L153 HydrophobicContact CG-CD1 4.47Å; L149-L153 WeakPolarHBondContact O-CG 3.11Å; L149-L153 PolarHBondContact O-N 3.14Å; L149-Y164 HydrophobicContact CB-CE2 3.94Å; L149-Y164 HydrophobicContact CD1-CD2 4.36Å; L149-Y164 HydrophobicContact CD1-CE2 4.18Å |
| 150 | T | 93.1 | Very high | 89.8 | Confident | 87 Ų | 87 | 50.8 Ų | 50.8 | 53% | 0.534 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -62.8 | -45.1 | 177.1 | -57.4 | 0 | 0 | 0 | 0 | 111.2 | F146 G147 S148 F152 L153 L154 | F146-T150 WeakPolarHBondContact O-CB 3.34Å; F146-T150 PolarHBondContact O-N 3.5Å; F146-T150 PolarHBondContact O-OG1 2.96Å; G147-T150 WeakPolarHBondContact O-CB 3.48Å; G147-T150 PolarHBondContact O-N 2.85Å; G147-T150 VanDerWaalsContact O-N 3.17Å; S148-T150 VanDerWaalsContact C-N 3.34Å; S148-T150 PolarHBondContact O-N 3.49Å; T150-F152 VanDerWaalsContact C-N 3.33Å; T150-F152 PolarHBondContact O-N 3.2Å; T150-L153 PolarHBondContact O-N 3.48Å; T150-L154 WeakPolarHBondContact O-CB 3.32Å; T150-L154 PolarHBondContact O-N 2.6Å |
| 151 | I | 91.1 | Very high | 89.4 | Confident | 5 Ų | 5 | 59 Ų | 59 | 3% | 0.026 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -63.5 | -39.9 | 175.4 | -60.8 | -56.6 | 0 | 0 | 0 | 111.2 | G147 S148 L154 A155 V167 L214 L226 P229 I230 | G147-I151 WeakPolarHBondContact O-CG1 3.45Å; G147-I151 PolarHBondContact O-N 3.42Å; S148-I151 PolarHBondContact O-N 3.26Å; I151-L154 PolarHBondContact O-N 3.04Å; I151-A155 WeakPolarHBondContact O-CB 3.42Å; I151-A155 PolarHBondContact O-N 2.72Å; I151-V167 HydrophobicContact CB-CG1 4.04Å; I151-V167 HydrophobicContact CG2-CG1 3.85Å; I151-L214 HydrophobicContact CG2-CD1 4.18Å; I151-L226 HydrophobicContact CG2-CD2 4.46Å; I151-P229 HydrophobicContact CD1-CB 3.53Å; I151-P229 HydrophobicContact CD1-CG 3.7Å; I151-I230 HydrophobicContact CD1-CG1 3.96Å; I151-I230 HydrophobicContact CG1-CG1 4.33Å; I151-I230 HydrophobicContact CG2-CD1 4.42Å; I151-I230 HydrophobicContact CG2-CG1 4.09Å |
| 152 | F | 91.6 | Very high | 88.9 | Confident | 39 Ų | 39 | 57.5 Ų | 57.5 | 17% | 0.171 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -62.9 | -47.9 | 176.6 | 163.8 | -100.1 | 0 | 0 | 0 | 112.1 | S148 L149 T150 L154 A155 R156 V162 Y164 V167 | S148-F152 VanDerWaalsContact O-CB 3.26Å; S148-F152 WeakPolarHBondContact O-CB 3.49Å; S148-F152 PolarHBondContact O-N 2.89Å; L149-F152 HydrophobicContact CD1-CD1 4.13Å; L149-F152 WeakPolarHBondContact O-CB 3.38Å; L149-F152 PolarHBondContact O-N 3.46Å; T150-F152 VanDerWaalsContact C-N 3.33Å; T150-F152 PolarHBondContact O-N 3.2Å; F152-L154 VanDerWaalsContact C-N 3.27Å; F152-L154 PolarHBondContact O-N 2.6Å; F152-A155 WeakPolarHBondContact O-CB 3.31Å; F152-A155 PolarHBondContact O-N 3.2Å; F152-R156 WeakPolarHBondContact O-CB 3.32Å; F152-R156 PolarHBondContact O-N 2.99Å; F152-V162 VanDerWaalsContact CE2-O 3.28Å; F152-V162 WeakPolarHBondContact CE2-O 3.05Å; F152-Y164 HydrophobicContact CB-CD2 3.86Å; F152-Y164 HydrophobicContact CD1-CD2 4.16Å; F152-Y164 HydrophobicContact CD2-CD2 4.43Å; F152-Y164 AromaticContact CG-CD2 3.9Å; F152-Y164 HydrophobicContact CG-CD2 3.9Å; F152-V167 HydrophobicContact CB-CB 4.24Å; F152-V167 HydrophobicContact CB-CG1 4.27Å; F152-V167 HydrophobicContact CB-CG2 4.13Å; F152-V167 HydrophobicContact CD2-CG2 4.22Å |
| 153 | L | 91.8 | Very high | 88.7 | Confident | 96 Ų | 96 | 57.5 Ų | 57.5 | 50% | 0.503 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -60.2 | -41.5 | 176.3 | -70.5 | 178.4 | 0 | 0 | 0 | 110.9 | L149 T150 R156 V157 | L149-L153 HydrophobicContact CG-CD1 4.47Å; L149-L153 WeakPolarHBondContact O-CG 3.11Å; L149-L153 PolarHBondContact O-N 3.14Å; T150-L153 PolarHBondContact O-N 3.48Å; L153-R156 PolarHBondContact O-N 3.21Å; L153-V157 WeakPolarHBondContact O-CB 3.45Å; L153-V157 VanDerWaalsContact O-CG2 3.28Å; L153-V157 WeakPolarHBondContact O-CG2 3.46Å; L153-V157 PolarHBondContact O-N 3.2Å |
| 154 | L | 90 | Very high | 88.5 | Confident | 54 Ų | 54 | 59.8 Ų | 59.8 | 28% | 0.283 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -64.7 | -45 | 176.6 | -168.7 | 66.1 | 0 | 0 | 0 | 111.6 | T150 I151 F152 R156 V157 L158 P229 | T150-L154 WeakPolarHBondContact O-CB 3.32Å; T150-L154 PolarHBondContact O-N 2.6Å; I151-L154 PolarHBondContact O-N 3.04Å; F152-L154 VanDerWaalsContact C-N 3.27Å; F152-L154 PolarHBondContact O-N 2.6Å; L154-R156 VanDerWaalsContact C-N 3.27Å; L154-R156 PolarHBondContact O-N 2.91Å; L154-V157 PolarHBondContact O-N 3.07Å; L154-L158 HydrophobicContact CD1-CD1 3.91Å; L154-L158 HydrophobicContact CG-CD1 4.1Å; L154-L158 WeakPolarHBondContact O-CB 3.45Å; L154-L158 WeakPolarHBondContact O-CD1 3.08Å; L154-L158 PolarHBondContact O-N 2.99Å; L154-P229 HydrophobicContact CD2-CB 4.48Å; L154-P229 HydrophobicContact CD2-CG 3.46Å; L154-P229 VanDerWaalsContact CD2-CG 3.46Å |
| 155 | A | 87 | Confident | 88.1 | Confident | 4 Ų | 4 | 61.1 Ų | 61.1 | 3% | 0.033 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -56.4 | -44 | 175 | 0 | 0 | 0 | 0 | 0 | 111.4 | I151 F152 L158 G159 G160 V162 L226 | I151-A155 WeakPolarHBondContact O-CB 3.42Å; I151-A155 PolarHBondContact O-N 2.72Å; F152-A155 WeakPolarHBondContact O-CB 3.31Å; F152-A155 PolarHBondContact O-N 3.2Å; A155-L158 PolarHBondContact O-N 3.47Å; A155-G159 PolarHBondContact O-N 3.49Å; A155-G160 WeakPolarHBondContact O-CA 3.48Å; A155-G160 PolarHBondContact O-N 3.31Å; A155-V162 HydrophobicContact CB-CG2 3.66Å; A155-L226 HydrophobicContact CB-CD1 3.69Å |
| 156 | R | 87.6 | Confident | 87.8 | Confident | 163 Ų | 163 | 58.9 Ų | 58.9 | 62% | 0.615 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -65.9 | -43 | 179.4 | -165.6 | 63.6 | 150.1 | 96.6 | -0.2 | 112.4 | F152 L153 L154 L158 G159 | F152-R156 WeakPolarHBondContact O-CB 3.32Å; F152-R156 PolarHBondContact O-N 2.99Å; L153-R156 PolarHBondContact O-N 3.21Å; L154-R156 VanDerWaalsContact C-N 3.27Å; L154-R156 PolarHBondContact O-N 2.91Å; R156-L158 PolarHBondContact O-N 3.39Å; R156-G159 PolarHBondContact O-N 2.96Å |
| 157 | V | 88.1 | Confident | 87.5 | Confident | 122 Ų | 122 | 52.7 Ų | 52.7 | 74% | 0.739 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -64 | -32.9 | 175.8 | 168.7 | 0 | 0 | 0 | 0 | 111.4 | L153 L154 G159 | L153-V157 WeakPolarHBondContact O-CB 3.45Å; L153-V157 VanDerWaalsContact O-CG2 3.28Å; L153-V157 WeakPolarHBondContact O-CG2 3.46Å; L153-V157 PolarHBondContact O-N 3.2Å; L154-V157 PolarHBondContact O-N 3.07Å; V157-G159 PolarHBondContact O-N 2.88Å |
| 158 | L | 84.1 | Confident | 87.3 | Confident | 37 Ų | 37 | 52.7 Ų | 52.7 | 19% | 0.194 | 29% | 0.294 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -74.6 | -2.7 | 175.1 | -91.6 | 61.7 | 0 | 0 | 0 | 113.4 | L154 A155 R156 F219 L225 L226 | L154-L158 HydrophobicContact CD1-CD1 3.91Å; L154-L158 HydrophobicContact CG-CD1 4.1Å; L154-L158 WeakPolarHBondContact O-CB 3.45Å; L154-L158 WeakPolarHBondContact O-CD1 3.08Å; L154-L158 PolarHBondContact O-N 2.99Å; A155-L158 PolarHBondContact O-N 3.47Å; R156-L158 PolarHBondContact O-N 3.39Å; L158-F219 HydrophobicContact CB-CD1 4.43Å; L158-F219 HydrophobicContact CB-CE1 3.96Å; L158-L225 HydrophobicContact CD2-CB 4.17Å; L158-L226 HydrophobicContact CD2-CB 4.22Å; L158-L226 HydrophobicContact CD2-CD1 4.26Å |
| 159 | G | 78.1 | Confident | 87.1 | Confident | 63 Ų | 63 | 53 Ų | 53 | 65% | 0.649 | 30% | 0.296 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 89.2 | 17.3 | -179.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | A155 R156 V157 | A155-G159 PolarHBondContact O-N 3.49Å; R156-G159 PolarHBondContact O-N 2.96Å; V157-G159 PolarHBondContact O-N 2.88Å |
| 160 | G | 78.3 | Confident | 86.8 | Confident | 1 Ų | 1 | 50 Ų | 50 | 1% | 0.01 | 28% | 0.281 | C | S | . | . | trans | -74.5 | 132.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | A155 V162 F219 | A155-G160 WeakPolarHBondContact O-CA 3.48Å; A155-G160 PolarHBondContact O-N 3.31Å; G160-V162 VanDerWaalsContact C-N 3.34Å; G160-V162 PolarHBondContact O-N 3.39Å; G160-F219 VanDerWaalsContact CA-CZ 3.48Å | ||
| 161 | E | 80.9 | Confident | 86.7 | Confident | 171 Ų | 171 | 45.9 Ų | 45.9 | 80% | 0.799 | 26% | 0.255 | S | S | * | . | trans | -93.2 | 68.6 | 167.9 | -64.9 | -172.4 | 151.8 | 0 | 0 | 109.6 | R110 | R110-E161 PolarHBondContact NH2-O 2.95Š| ||
| 162 | V | 80.7 | Confident | 86.6 | Confident | 11 Ų | 11 | 45.6 Ų | 45.6 | 7% | 0.067 | 25% | 0.254 | C | S | . | . | trans | -115.9 | 138.4 | 174.1 | -66.8 | 0 | 0 | 0 | 0 | 109.5 | F152 A155 G160 V167 | F152-V162 VanDerWaalsContact CE2-O 3.28Å; F152-V162 WeakPolarHBondContact CE2-O 3.05Å; A155-V162 HydrophobicContact CB-CG2 3.66Å; G160-V162 VanDerWaalsContact C-N 3.34Å; G160-V162 PolarHBondContact O-N 3.39Å; V162-V167 HydrophobicContact CB-CG2 4.33Å; V162-V167 HydrophobicContact CG2-CG2 3.93Å | ||
| 163 | A | 87.2 | Confident | 86.4 | Confident | 54 Ų | 54 | 43.9 Ų | 43.9 | 45% | 0.446 | 25% | 0.246 | S | C | . | . | trans | -83.9 | 151.9 | 173.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | G165 Q166 V167 | A163-G165 VanDerWaalsContact C-N 3.31Å; A163-G165 PolarHBondContact O-N 3.19Å; A163-Q166 HydrophobicContact CB-CG 4.03Å; A163-Q166 WeakPolarHBondContact O-CB 3.27Å; A163-Q166 PolarHBondContact O-N 3.2Å; A163-Q166 VanDerWaalsContact O-N 3.08Å; A163-V167 PolarHBondContact O-N 3Å | ||
| 164 | Y | 88.3 | Confident | 86.2 | Confident | 69 Ų | 69 | 39.3 Ų | 39.3 | 27% | 0.271 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -59.7 | -40.2 | -177.3 | 175 | -118.5 | 0 | 0 | 0 | 112.6 | I145 S148 L149 F152 Q166 V167 L168 | I145-Y164 PolarHBondContact O-OH 3.13Å; I145-Y164 VanDerWaalsContact O-OH 3.11Å; S148-Y164 PolarHBondContact OG-OH 3.21Å; L149-Y164 HydrophobicContact CB-CE2 3.94Å; L149-Y164 HydrophobicContact CD1-CD2 4.36Å; L149-Y164 HydrophobicContact CD1-CE2 4.18Å; F152-Y164 HydrophobicContact CB-CD2 3.86Å; F152-Y164 HydrophobicContact CD1-CD2 4.16Å; F152-Y164 HydrophobicContact CD2-CD2 4.43Å; F152-Y164 AromaticContact CG-CD2 3.9Å; F152-Y164 HydrophobicContact CG-CD2 3.9Å; Y164-Q166 PolarHBondContact O-N 3.16Å; Y164-V167 PolarHBondContact O-N 3.49Å; Y164-V167 VanDerWaalsContact O-N 3.14Å; Y164-L168 HydrophobicContact CE1-CD2 4.31Å; Y164-L168 HydrophobicContact CE2-CB 4.49Å; Y164-L168 WeakPolarHBondContact O-CB 3.34Å; Y164-L168 PolarHBondContact O-N 2.94Å |
| 165 | G | 86.2 | Confident | 86.1 | Confident | 30 Ų | 30 | 36.8 Ų | 36.8 | 31% | 0.309 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -58.7 | -34.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | A163 G169 | A163-G165 VanDerWaalsContact C-N 3.31Å; A163-G165 PolarHBondContact O-N 3.19Å; G165-G169 PolarHBondContact O-N 2.88Å |
| 166 | Q | 85.4 | Confident | 86.1 | Confident | 24 Ų | 24 | 37.6 Ų | 37.6 | 11% | 0.112 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -68.1 | -44.1 | 176.8 | -50 | 179.8 | -51.1 | 0 | 0 | 110.8 | R110 P113 A163 Y164 V170 | R110-Q166 HydrophobicContact CG-CB 4.29Å; R110-Q166 HydrophobicContact CG-CG 4.41Å; R110-Q166 WeakPolarHBondContact O-CG 3.22Å; R110-Q166 PolarHBondContact O-NE2 3.36Å; P113-Q166 HydrophobicContact CB-CG 4.2Å; P113-Q166 HydrophobicContact CG-CG 4.28Å; A163-Q166 HydrophobicContact CB-CG 4.03Å; A163-Q166 WeakPolarHBondContact O-CB 3.27Å; A163-Q166 PolarHBondContact O-N 3.2Å; A163-Q166 VanDerWaalsContact O-N 3.08Å; Y164-Q166 PolarHBondContact O-N 3.16Å; Q166-V170 WeakPolarHBondContact O-CB 3.39Å; Q166-V170 WeakPolarHBondContact O-CG2 3.48Å; Q166-V170 PolarHBondContact O-N 3.5Å |
| 167 | V | 88.5 | Confident | 86 | Confident | 1 Ų | 1 | 30.1 Ų | 30.1 | 1% | 0.006 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -66.1 | -48.1 | 177.7 | -176.1 | 0 | 0 | 0 | 0 | 110.7 | I151 F152 V162 A163 Y164 G169 V170 I171 L214 | I151-V167 HydrophobicContact CB-CG1 4.04Å; I151-V167 HydrophobicContact CG2-CG1 3.85Å; F152-V167 HydrophobicContact CB-CB 4.24Å; F152-V167 HydrophobicContact CB-CG1 4.27Å; F152-V167 HydrophobicContact CB-CG2 4.13Å; F152-V167 HydrophobicContact CD2-CG2 4.22Å; V162-V167 HydrophobicContact CB-CG2 4.33Å; V162-V167 HydrophobicContact CG2-CG2 3.93Å; A163-V167 PolarHBondContact O-N 3Å; Y164-V167 PolarHBondContact O-N 3.49Å; Y164-V167 VanDerWaalsContact O-N 3.14Å; V167-G169 VanDerWaalsContact C-N 3.31Å; V167-G169 PolarHBondContact O-N 3.19Å; V167-V170 PolarHBondContact O-N 2.98Å; V167-I171 HydrophobicContact CG1-CG1 4.25Å; V167-I171 WeakPolarHBondContact O-CB 3.5Å; V167-I171 WeakPolarHBondContact O-CG1 3.45Å; V167-I171 PolarHBondContact O-N 3.45Å; V167-L214 HydrophobicContact CB-CD2 4.41Å; V167-L214 HydrophobicContact CG1-CD1 4.3Å; V167-L214 HydrophobicContact CG1-CD2 4.45Å; V167-L214 HydrophobicContact CG2-CD2 4.15Å |
| 168 | L | 90.6 | Very high | 86 | Confident | 13 Ų | 13 | 24.7 Ų | 24.7 | 7% | 0.068 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -56.7 | -46.5 | 177.3 | -177.1 | 71.5 | 0 | 0 | 0 | 111.3 | F115 W144 S148 Y164 G172 | F115-L168 HydrophobicContact CD2-CD2 3.98Å; F115-L168 HydrophobicContact CE2-CD2 3.99Å; W144-L168 HydrophobicContact CD2-CD1 4.02Å; W144-L168 HydrophobicContact CE3-CD1 4.44Å; W144-L168 HydrophobicContact CH2-CD1 4.07Å; W144-L168 HydrophobicContact CH2-CD2 4.3Å; W144-L168 HydrophobicContact CH2-CG 4.1Å; W144-L168 HydrophobicContact CZ2-CD1 3.57Å; W144-L168 HydrophobicContact CZ2-CD2 4.25Å; W144-L168 HydrophobicContact CZ2-CG 3.58Å; W144-L168 HydrophobicContact CZ3-CD1 4.47Å; W144-L168 PolarHBondContact NE1-O 3.16Å; S148-L168 WeakPolarHBondContact OG-CD1 3.5Å; Y164-L168 HydrophobicContact CE1-CD2 4.31Å; Y164-L168 HydrophobicContact CE2-CB 4.49Å; Y164-L168 WeakPolarHBondContact O-CB 3.34Å; Y164-L168 PolarHBondContact O-N 2.94Å; L168-G172 PolarHBondContact O-N 3.41Å |
| 169 | G | 87.4 | Confident | 86.2 | Confident | 5 Ų | 5 | 23.8 Ų | 23.8 | 5% | 0.052 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -66.5 | -50.7 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | G165 V167 I171 G172 Y173 | G165-G169 PolarHBondContact O-N 2.88Å; V167-G169 VanDerWaalsContact C-N 3.31Å; V167-G169 PolarHBondContact O-N 3.19Å; G169-I171 VanDerWaalsContact C-N 3.32Å; G169-I171 PolarHBondContact O-N 2.9Å; G169-G172 PolarHBondContact O-N 3.04Å; G169-G172 VanDerWaalsContact O-N 3.16Å; G169-Y173 WeakPolarHBondContact O-CD2 3.12Å; G169-Y173 PolarHBondContact O-N 3.44Å |
| 170 | V | 86.6 | Confident | 86.6 | Confident | 1 Ų | 1 | 23.9 Ų | 23.9 | 1% | 0.006 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -59.1 | -44 | 178.7 | 171.5 | 0 | 0 | 0 | 0 | 111.5 | V109 Q166 V167 G172 S174 L213 L214 | V109-V170 HydrophobicContact CG1-CG2 4.3Å; Q166-V170 WeakPolarHBondContact O-CB 3.39Å; Q166-V170 WeakPolarHBondContact O-CG2 3.48Å; Q166-V170 PolarHBondContact O-N 3.5Å; V167-V170 PolarHBondContact O-N 2.98Å; V170-G172 VanDerWaalsContact C-N 3.34Å; V170-G172 PolarHBondContact O-N 3.34Å; V170-S174 WeakPolarHBondContact O-CB 3.39Å; V170-S174 PolarHBondContact O-N 3.49Å; V170-S174 VanDerWaalsContact O-N 3.14Å; V170-S174 PolarHBondContact O-OG 3.08Å; V170-L213 HydrophobicContact CG1-CB 3.49Å; V170-L213 VanDerWaalsContact CG1-CB 3.49Å; V170-L213 HydrophobicContact CG1-CD1 3.94Å; V170-L213 HydrophobicContact CG1-CG 4.33Å; V170-L213 HydrophobicContact CG2-CB 4.28Å; V170-L214 HydrophobicContact CB-CD2 3.93Å; V170-L214 HydrophobicContact CB-CG 4.15Å; V170-L214 HydrophobicContact CG1-CD1 4.22Å; V170-L214 HydrophobicContact CG1-CD2 4.03Å; V170-L214 HydrophobicContact CG1-CG 3.69Å; V170-L214 HydrophobicContact CG2-CD2 4.16Å |
| 171 | I | 90.6 | Very high | 87 | Confident | 0 Ų | 0 | 24.7 Ų | 24.7 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -63.2 | -41.4 | 178.4 | -66.5 | -66 | 0 | 0 | 0 | 111.1 | V167 G169 S174 A210 L214 I230 L233 Y234 | V167-I171 HydrophobicContact CG1-CG1 4.25Å; V167-I171 WeakPolarHBondContact O-CB 3.5Å; V167-I171 WeakPolarHBondContact O-CG1 3.45Å; V167-I171 PolarHBondContact O-N 3.45Å; G169-I171 VanDerWaalsContact C-N 3.32Å; G169-I171 PolarHBondContact O-N 2.9Å; I171-S174 PolarHBondContact O-OG 3.36Å; I171-S174 VanDerWaalsContact O-OG 3.07Å; I171-A210 HydrophobicContact CD1-CB 4.37Å; I171-L214 HydrophobicContact CD1-CD1 3.8Å; I171-L214 HydrophobicContact CG1-CD1 4.16Å; I171-I230 HydrophobicContact CD1-CG1 4.49Å; I171-I230 HydrophobicContact CD1-CG2 4.5Å; I171-L233 HydrophobicContact CD1-CD2 4.34Å; I171-L233 HydrophobicContact CG2-CD2 3.66Å; I171-Y234 VanDerWaalsContact CA-OH 3.31Å; I171-Y234 WeakPolarHBondContact CA-OH 3.41Å; I171-Y234 HydrophobicContact CD1-CE2 4.37Å; I171-Y234 PolarHBondContact O-OH 3.29Å |
| 172 | G | 89.7 | Confident | 87.2 | Confident | 0 Ų | 0 | 17 Ų | 17 | 0% | 0 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -68.2 | -46.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | V121 L168 G169 V170 S174 L175 | V121-G172 WeakPolarHBondContact CG1-O 3.38Å; L168-G172 PolarHBondContact O-N 3.41Å; G169-G172 PolarHBondContact O-N 3.04Å; G169-G172 VanDerWaalsContact O-N 3.16Å; V170-G172 VanDerWaalsContact C-N 3.34Å; V170-G172 PolarHBondContact O-N 3.34Å; G172-S174 VanDerWaalsContact C-N 3.26Å; G172-S174 PolarHBondContact O-N 3.44Å; G172-L175 WeakPolarHBondContact O-CB 3.41Å; G172-L175 PolarHBondContact O-N 3.47Å |
| 173 | Y | 86.6 | Confident | 87.4 | Confident | 3 Ų | 3 | 20.2 Ų | 20.2 | 1% | 0.012 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -62.6 | -34.4 | 178.9 | -76.2 | -64 | 0 | 0 | 0 | 112.7 | I88 K91 I92 V95 V109 D114 P118 V121 G169 L175 L176 | I88-Y173 HydrophobicContact CG2-CE1 4.3Å; K91-Y173 HydrophobicContact CB-CE1 4.48Å; K91-Y173 HydrophobicContact CD-CE2 4.31Å; I92-Y173 HydrophobicContact CG1-CD1 4.16Å; I92-Y173 HydrophobicContact CG1-CE1 4.3Å; V95-Y173 WeakPolarHBondContact CG1-O 3.49Å; V109-Y173 HydrophobicContact CG1-CD2 4.35Å; D114-Y173 PolarHBondContact OD2-OH 3.14Å; D114-Y173 VanDerWaalsContact OD2-OH 3.05Å; P118-Y173 HydrophobicContact CB-CD2 4.21Å; P118-Y173 HydrophobicContact CB-CE2 4.25Å; P118-Y173 HydrophobicContact CB-CG 4.43Å; P118-Y173 VanDerWaalsContact CD-CZ 3.4Å; P118-Y173 WeakPolarHBondContact CD-OH 3.49Å; P118-Y173 HydrophobicContact CG-CD2 3.82Å; P118-Y173 HydrophobicContact CG-CE1 4.42Å; P118-Y173 HydrophobicContact CG-CE2 3.43Å; P118-Y173 VanDerWaalsContact CG-CE2 3.43Å; P118-Y173 HydrophobicContact CG-CG 4.44Å; V121-Y173 HydrophobicContact CG2-CD1 4.24Å; G169-Y173 WeakPolarHBondContact O-CD2 3.12Å; G169-Y173 PolarHBondContact O-N 3.44Å; Y173-L175 PolarHBondContact O-N 2.9Å; Y173-L176 WeakPolarHBondContact O-CB 3.38Å; Y173-L176 PolarHBondContact O-N 3.23Å |
| 174 | S | 88 | Confident | 87.3 | Confident | 0 Ų | 0 | 21.6 Ų | 21.6 | 0% | 0 | 12% | 0.124 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -77.6 | 5.3 | -179.4 | 48.7 | 0 | 0 | 0 | 0 | 114.3 | V170 I171 G172 L176 P177 A206 A210 Y234 | V170-S174 WeakPolarHBondContact O-CB 3.39Å; V170-S174 PolarHBondContact O-N 3.49Å; V170-S174 VanDerWaalsContact O-N 3.14Å; V170-S174 PolarHBondContact O-OG 3.08Å; I171-S174 PolarHBondContact O-OG 3.36Å; I171-S174 VanDerWaalsContact O-OG 3.07Å; G172-S174 VanDerWaalsContact C-N 3.26Å; G172-S174 PolarHBondContact O-N 3.44Å; S174-L176 VanDerWaalsContact C-N 3.27Å; S174-P177 VanDerWaalsContact O-CD 3.32Å; S174-P177 WeakPolarHBondContact O-CD 3.38Å; S174-A206 WeakPolarHBondContact O-CB 3.38Å; S174-A210 WeakPolarHBondContact OG-CB 3.41Å; S174-Y234 PolarHBondContact OG-OH 3.36Å |
| 175 | L | 88.4 | Confident | 87.1 | Confident | 0 Ų | 0 | 18.8 Ų | 18.8 | 0% | 0 | 11% | 0.114 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -76.3 | -14.6 | 160.9 | -65.5 | 172.2 | 0 | 0 | 0 | 113 | V121 V122 G172 Y173 L178 I179 Y234 F237 | V121-L175 HydrophobicContact CG1-CB 4.19Å; V122-L175 HydrophobicContact CB-CD1 4.24Å; V122-L175 HydrophobicContact CG1-CD1 4.35Å; V122-L175 HydrophobicContact CG2-CD1 3.57Å; G172-L175 WeakPolarHBondContact O-CB 3.41Å; G172-L175 PolarHBondContact O-N 3.47Å; Y173-L175 PolarHBondContact O-N 2.9Å; L175-L178 HydrophobicContact CD2-CD1 3.9Å; L175-L178 WeakPolarHBondContact O-CA 3.38Å; L175-L178 VanDerWaalsContact O-CB 3.28Å; L175-L178 WeakPolarHBondContact O-CB 3.31Å; L175-L178 PolarHBondContact O-N 3.31Å; L175-I179 PolarHBondContact O-N 3.21Å; L175-I179 VanDerWaalsContact O-N 3.13Å; L175-Y234 HydrophobicContact CD2-CD1 4.13Å; L175-Y234 HydrophobicContact CD2-CE1 3.85Å; L175-Y234 HydrophobicContact CG-CE1 4.41Å; L175-F237 HydrophobicContact CD2-CB 4.22Å; L175-F237 HydrophobicContact CD2-CD1 4.3Å; L175-F237 HydrophobicContact CD2-CD2 3.66Å; L175-F237 HydrophobicContact CD2-CE2 4Å; L175-F237 HydrophobicContact CD2-CG 3.82Å; L175-F237 HydrophobicContact CD2-CZ 4.47Å |
| 176 | L | 86.9 | Confident | 87 | Confident | 22 Ų | 22 | 23.8 Ų | 23.8 | 12% | 0.115 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -60.7 | -38.9 | -175.9 | -157.1 | 149 | 0 | 0 | 0 | 114.5 | I92 L96 V121 Y173 S174 L178 I179 V180 | I92-L176 HydrophobicContact CB-CD1 3.81Å; I92-L176 HydrophobicContact CD1-CD1 3.99Å; I92-L176 HydrophobicContact CG1-CD1 3.5Å; I92-L176 HydrophobicContact CG2-CD1 3.3Å; I92-L176 HydrophobicContact CG2-CD2 4.21Å; I92-L176 HydrophobicContact CG2-CG 4.41Å; L96-L176 HydrophobicContact CB-CD2 4.34Å; L96-L176 HydrophobicContact CD1-CD2 3.81Å; L96-L176 HydrophobicContact CG-CD2 4.45Å; V121-L176 HydrophobicContact CG1-CB 4.29Å; V121-L176 HydrophobicContact CG2-CD1 4.29Å; Y173-L176 WeakPolarHBondContact O-CB 3.38Å; Y173-L176 PolarHBondContact O-N 3.23Å; S174-L176 VanDerWaalsContact C-N 3.27Å; L176-L178 PolarHBondContact O-N 3.01Å; L176-I179 WeakPolarHBondContact O-CB 3.21Å; L176-I179 PolarHBondContact O-N 3.3Å; L176-I179 VanDerWaalsContact O-N 3.11Å; L176-V180 HydrophobicContact CD2-CG2 3.86Å; L176-V180 WeakPolarHBondContact O-CG2 3.39Å; L176-V180 PolarHBondContact O-N 3.19Å |
| 177 | P | 86.2 | Confident | 86.9 | Confident | 6 Ų | 6 | 28 Ų | 28 | 4% | 0.039 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -56.8 | -37.2 | 170.6 | -25 | 35.5 | 0 | 0 | 0 | 113.2 | S174 V180 I181 W205 A206 | S174-P177 VanDerWaalsContact O-CD 3.32Å; S174-P177 WeakPolarHBondContact O-CD 3.38Å; P177-V180 PolarHBondContact O-N 3.37Å; P177-I181 WeakPolarHBondContact O-CG2 3.07Å; P177-I181 PolarHBondContact O-N 3.02Å; P177-I181 VanDerWaalsContact O-N 3.09Å; P177-W205 HydrophobicContact CB-CB 4.46Å; P177-W205 VanDerWaalsContact CB-CD1 3.42Å; P177-W205 HydrophobicContact CB-CG 4.16Å; P177-W205 VanDerWaalsContact CG-CD1 3.4Å; P177-A206 HydrophobicContact CB-CB 4.35Å; P177-A206 HydrophobicContact CG-CB 4.45Å |
| 178 | L | 87.4 | Confident | 86.6 | Confident | 7 Ų | 7 | 29.8 Ų | 29.8 | 4% | 0.037 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -66.5 | -38.5 | 175.8 | -73.5 | 152.1 | 0 | 0 | 0 | 111.5 | F125 L175 L176 V180 I181 A182 V203 A206 Y234 | F125-L178 HydrophobicContact CD2-CB 4.4Å; F125-L178 HydrophobicContact CE2-CB 4.15Å; L175-L178 HydrophobicContact CD2-CD1 3.9Å; L175-L178 WeakPolarHBondContact O-CA 3.38Å; L175-L178 VanDerWaalsContact O-CB 3.28Å; L175-L178 WeakPolarHBondContact O-CB 3.31Å; L175-L178 PolarHBondContact O-N 3.31Å; L176-L178 PolarHBondContact O-N 3.01Å; L178-V180 VanDerWaalsContact C-N 3.34Å; L178-I181 HydrophobicContact CD2-CD1 4.1Å; L178-I181 WeakPolarHBondContact O-CG1 3.37Å; L178-A182 PolarHBondContact O-N 2.73Å; L178-V203 HydrophobicContact CD2-CG2 3.93Å; L178-A206 HydrophobicContact CD1-CB 3.92Å; L178-A206 HydrophobicContact CG-CB 4.13Å; L178-Y234 HydrophobicContact CD1-CD1 3.92Å |
| 179 | I | 87.8 | Confident | 85.7 | Confident | 19 Ų | 19 | 31.1 Ų | 31.1 | 10% | 0.097 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -63.8 | -40.9 | 174.4 | -67.1 | 169.5 | 0 | 0 | 0 | 111 | V121 F124 F125 I128 L175 L176 A182 P183 | V121-I179 HydrophobicContact CG1-CD1 3.65Å; V121-I179 WeakPolarHBondContact O-CD1 3.15Å; F124-I179 HydrophobicContact CB-CD1 4.45Å; F124-I179 HydrophobicContact CD1-CD1 4.03Å; F124-I179 HydrophobicContact CD1-CG1 4.37Å; F124-I179 HydrophobicContact CD1-CG2 3.45Å; F124-I179 VanDerWaalsContact CD1-CG2 3.45Å; F124-I179 HydrophobicContact CE1-CG2 3.45Å; F124-I179 VanDerWaalsContact CE1-CG2 3.45Å; F125-I179 HydrophobicContact CB-CD1 3.85Å; F125-I179 HydrophobicContact CB-CG1 3.8Å; F125-I179 HydrophobicContact CD2-CG1 4.1Å; F125-I179 HydrophobicContact CG-CG1 4.47Å; I128-I179 HydrophobicContact CD1-CB 4.45Å; I128-I179 HydrophobicContact CD1-CG1 4.48Å; I128-I179 HydrophobicContact CD1-CG2 3.86Å; L175-I179 PolarHBondContact O-N 3.21Å; L175-I179 VanDerWaalsContact O-N 3.13Å; L176-I179 WeakPolarHBondContact O-CB 3.21Å; L176-I179 PolarHBondContact O-N 3.3Å; L176-I179 VanDerWaalsContact O-N 3.11Å; I179-A182 WeakPolarHBondContact O-CB 3.32Å; I179-A182 PolarHBondContact O-N 2.82Å; I179-P183 WeakPolarHBondContact O-CD 3.45Å |
| 180 | V | 86.3 | Confident | 85.2 | Confident | 64 Ų | 64 | 36.1 Ų | 36.1 | 39% | 0.388 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -69.8 | -36.1 | -178.6 | 170.6 | 0 | 0 | 0 | 0 | 112.2 | L96 L176 P177 L178 A182 P183 | L96-V180 HydrophobicContact CD1-CB 4.39Å; L96-V180 HydrophobicContact CD1-CG2 3.88Å; L176-V180 HydrophobicContact CD2-CG2 3.86Å; L176-V180 WeakPolarHBondContact O-CG2 3.39Å; L176-V180 PolarHBondContact O-N 3.19Å; P177-V180 PolarHBondContact O-N 3.37Å; L178-V180 VanDerWaalsContact C-N 3.34Å; V180-A182 VanDerWaalsContact C-N 3.33Å; V180-P183 WeakPolarHBondContact O-CD 3.41Å; V180-P183 WeakPolarHBondContact O-CG 3.22Å |
| 181 | I | 86.9 | Confident | 85.2 | Confident | 19 Ų | 19 | 42.7 Ų | 42.7 | 10% | 0.097 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -73.8 | -23.4 | 175.5 | 63.3 | 166.3 | 0 | 0 | 0 | 112.9 | P177 L178 I184 L185 I198 | P177-I181 WeakPolarHBondContact O-CG2 3.07Å; P177-I181 PolarHBondContact O-N 3.02Å; P177-I181 VanDerWaalsContact O-N 3.09Å; L178-I181 HydrophobicContact CD2-CD1 4.1Å; L178-I181 WeakPolarHBondContact O-CG1 3.37Å; I181-I184 WeakPolarHBondContact O-CB 3.33Å; I181-I184 PolarHBondContact O-N 2.82Å; I181-I184 VanDerWaalsContact O-N 3.12Å; I181-L185 HydrophobicContact CD1-CD1 4.27Å; I181-L185 HydrophobicContact CG1-CD1 4.4Å; I181-L185 WeakPolarHBondContact O-CG 3.47Å; I181-L185 PolarHBondContact O-N 3.47Å; I181-I198 HydrophobicContact CB-CG2 4.1Å; I181-I198 HydrophobicContact CG2-CG2 4.32Å |
| 182 | A | 84.8 | Confident | 84.9 | Confident | 8 Ų | 8 | 50.4 Ų | 50.4 | 7% | 0.066 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -57.2 | -48.8 | -177 | 0 | 0 | 0 | 0 | 0 | 114.7 | I128 L178 I179 V180 I184 L185 L186 Y241 | I128-A182 HydrophobicContact CD1-CB 4.34Å; I128-A182 HydrophobicContact CG2-CB 3.86Å; L178-A182 PolarHBondContact O-N 2.73Å; I179-A182 WeakPolarHBondContact O-CB 3.32Å; I179-A182 PolarHBondContact O-N 2.82Å; V180-A182 VanDerWaalsContact C-N 3.33Å; A182-I184 VanDerWaalsContact C-N 3.28Å; A182-I184 PolarHBondContact O-N 3.22Å; A182-L185 WeakPolarHBondContact O-CB 3.24Å; A182-L185 PolarHBondContact O-N 3.14Å; A182-L186 PolarHBondContact O-N 2.75Å; A182-Y241 HydrophobicContact CB-CE2 4.49Å |
| 183 | P | 85.2 | Confident | 84.8 | Confident | 79 Ų | 79 | 55.6 Ų | 55.6 | 51% | 0.513 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -66.1 | -30.4 | 174.9 | 25.6 | -35 | 0 | 0 | 0 | 112.7 | I179 V180 L185 L186 V187 | I179-P183 WeakPolarHBondContact O-CD 3.45Å; V180-P183 WeakPolarHBondContact O-CD 3.41Å; V180-P183 WeakPolarHBondContact O-CG 3.22Å; P183-L185 VanDerWaalsContact C-N 3.35Å; P183-L186 WeakPolarHBondContact O-CB 3.15Å; P183-L186 PolarHBondContact O-N 2.99Å; P183-V187 PolarHBondContact O-N 3.21Å |
| 184 | I | 84.7 | Confident | 84.9 | Confident | 83 Ų | 83 | 58.5 Ų | 58.5 | 43% | 0.426 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -66.3 | -41.4 | 175.9 | -56.4 | 174.7 | 0 | 0 | 0 | 109.9 | I181 A182 L186 V187 V188 I198 | I181-I184 WeakPolarHBondContact O-CB 3.33Å; I181-I184 PolarHBondContact O-N 2.82Å; I181-I184 VanDerWaalsContact O-N 3.12Å; A182-I184 VanDerWaalsContact C-N 3.28Å; A182-I184 PolarHBondContact O-N 3.22Å; I184-L186 VanDerWaalsContact C-N 3.25Å; I184-L186 PolarHBondContact O-N 3.48Å; I184-V187 PolarHBondContact O-N 3.28Å; I184-V187 VanDerWaalsContact O-N 3.16Å; I184-V188 HydrophobicContact CG2-CG2 4.35Å; I184-V188 WeakPolarHBondContact O-CG2 3.35Å; I184-V188 PolarHBondContact O-N 3.25Å; I184-I198 HydrophobicContact CG2-CD1 4.37Å |
| 185 | L | 84.5 | Confident | 84.8 | Confident | 11 Ų | 11 | 59.1 Ų | 59.1 | 6% | 0.058 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -63.1 | -30.7 | 175.6 | -71.6 | 170.2 | 0 | 0 | 0 | 112.6 | I181 A182 P183 V187 G189 S195 I198 K199 Y241 | I181-L185 HydrophobicContact CD1-CD1 4.27Å; I181-L185 HydrophobicContact CG1-CD1 4.4Å; I181-L185 WeakPolarHBondContact O-CG 3.47Å; I181-L185 PolarHBondContact O-N 3.47Å; A182-L185 WeakPolarHBondContact O-CB 3.24Å; A182-L185 PolarHBondContact O-N 3.14Å; P183-L185 VanDerWaalsContact C-N 3.35Å; L185-V187 VanDerWaalsContact C-N 3.32Å; L185-G189 WeakPolarHBondContact O-CA 3.46Å; L185-G189 PolarHBondContact O-N 3.5Å; L185-S195 WeakPolarHBondContact CD2-O 3.1Å; L185-S195 WeakPolarHBondContact CD2-OG 3.49Å; L185-I198 HydrophobicContact CD2-CB 3.89Å; L185-I198 HydrophobicContact CD2-CG2 3.74Å; L185-I198 HydrophobicContact CG-CG2 4.07Å; L185-K199 HydrophobicContact CD1-CG 3.66Å; L185-K199 HydrophobicContact CD2-CG 3.94Å; L185-K199 HydrophobicContact CG-CG 4.48Å; L185-Y241 HydrophobicContact CD1-CE1 4.12Å |
| 186 | L | 83.5 | Confident | 84.7 | Confident | 134 Ų | 134 | 62.6 Ų | 62.6 | 70% | 0.702 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -66.2 | -36 | 175.1 | -172.3 | 142.7 | 0 | 0 | 0 | 111.9 | A182 P183 I184 | A182-L186 PolarHBondContact O-N 2.75Å; P183-L186 WeakPolarHBondContact O-CB 3.15Å; P183-L186 PolarHBondContact O-N 2.99Å; I184-L186 VanDerWaalsContact C-N 3.25Å; I184-L186 PolarHBondContact O-N 3.48Å |
| 187 | V | 84.9 | Confident | 84.8 | Confident | 114 Ų | 114 | 66.8 Ų | 66.8 | 69% | 0.691 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -78.1 | -39.6 | 178.6 | 179.4 | 0 | 0 | 0 | 0 | 111.9 | P183 I184 L185 | P183-V187 PolarHBondContact O-N 3.21Å; I184-V187 PolarHBondContact O-N 3.28Å; I184-V187 VanDerWaalsContact O-N 3.16Å; L185-V187 VanDerWaalsContact C-N 3.32Å |
| 188 | V | 82.1 | Confident | 85 | Confident | 38 Ų | 38 | 68.2 Ų | 68.2 | 23% | 0.23 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -97.4 | 3.5 | -173.6 | -169.9 | 0 | 0 | 0 | 0 | 112.3 | I184 S190 F191 V194 I198 | I184-V188 HydrophobicContact CG2-CG2 4.35Å; I184-V188 WeakPolarHBondContact O-CG2 3.35Å; I184-V188 PolarHBondContact O-N 3.25Å; V188-S190 PolarHBondContact O-N 3.33Å; V188-F191 PolarHBondContact O-N 3.42Å; V188-F191 VanDerWaalsContact O-N 3.08Å; V188-V194 HydrophobicContact CG1-CB 4.01Å; V188-V194 HydrophobicContact CG1-CG1 3.46Å; V188-V194 VanDerWaalsContact CG1-CG1 3.46Å; V188-I198 HydrophobicContact CB-CD1 4.35Å; V188-I198 HydrophobicContact CG1-CD1 4.21Å |
| 189 | G | 71.3 | Confident | 85 | Confident | 40 Ų | 40 | 70.2 Ų | 70.2 | 41% | 0.412 | 40% | 0.399 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.9 | -19.3 | -173.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | L185 F191 | L185-G189 WeakPolarHBondContact O-CA 3.46Å; L185-G189 PolarHBondContact O-N 3.5Å; G189-F191 PolarHBondContact O-N 2.92Å |
| 190 | S | 77.6 | Confident | 85.1 | Confident | 111 Ų | 111 | 74.2 Ų | 74.2 | 78% | 0.776 | 42% | 0.42 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.6 | -20.8 | 175.5 | -53.1 | 0 | 0 | 0 | 0 | 114 | V188 | V188-S190 PolarHBondContact O-N 3.33Š|
| 191 | F | 86.3 | Confident | 85.3 | Confident | 139 Ų | 139 | 76.9 Ų | 76.9 | 61% | 0.61 | 43% | 0.427 | S | S | * | . | trans | -109.3 | 101.4 | 179 | -61.3 | -77.4 | 0 | 0 | 0 | 110.6 | V188 G189 V193 V194 S195 | V188-F191 PolarHBondContact O-N 3.42Å; V188-F191 VanDerWaalsContact O-N 3.08Å; G189-F191 PolarHBondContact O-N 2.92Å; F191-V193 VanDerWaalsContact C-N 3.34Å; F191-V193 PolarHBondContact O-N 3.03Å; F191-V194 HydrophobicContact CB-CB 3.92Å; F191-V194 HydrophobicContact CB-CG2 3.85Å; F191-V194 PolarHBondContact O-N 3.25Å; F191-S195 WeakPolarHBondContact O-CB 2.98Å; F191-S195 PolarHBondContact O-N 2.69Å | ||
| 192 | E | 84 | Confident | 85.3 | Confident | 161 Ų | 161 | 76 Ų | 76 | 75% | 0.752 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -56.4 | -43.1 | -175.3 | -65.4 | -175.2 | 167 | 0 | 0 | 113.5 | T196 | E192-T196 WeakPolarHBondContact O-CB 3.29Å; E192-T196 PolarHBondContact O-N 3.32Å; E192-T196 PolarHBondContact O-OG1 3.14Å |
| 193 | V | 87.8 | Confident | 85.6 | Confident | 109 Ų | 109 | 75.8 Ų | 75.8 | 66% | 0.661 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -64.9 | -45.3 | 179.5 | 179.7 | 0 | 0 | 0 | 0 | 111.1 | F191 T196 L197 | F191-V193 VanDerWaalsContact C-N 3.34Å; F191-V193 PolarHBondContact O-N 3.03Å; V193-T196 PolarHBondContact O-N 3.39Å; V193-L197 HydrophobicContact CG1-CD1 4.49Å; V193-L197 WeakPolarHBondContact O-CG 3.27Å; V193-L197 PolarHBondContact O-N 3.49Å |
| 194 | V | 87.7 | Confident | 85.8 | Confident | 64 Ų | 64 | 78 Ų | 78 | 39% | 0.388 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -68.9 | -43.7 | -178.4 | -176.4 | 0 | 0 | 0 | 0 | 110.5 | V188 F191 T196 L197 I198 | V188-V194 HydrophobicContact CG1-CB 4.01Å; V188-V194 HydrophobicContact CG1-CG1 3.46Å; V188-V194 VanDerWaalsContact CG1-CG1 3.46Å; F191-V194 HydrophobicContact CB-CB 3.92Å; F191-V194 HydrophobicContact CB-CG2 3.85Å; F191-V194 PolarHBondContact O-N 3.25Å; V194-T196 VanDerWaalsContact C-N 3.29Å; V194-T196 PolarHBondContact O-N 3.26Å; V194-L197 PolarHBondContact O-N 3.15Å; V194-I198 HydrophobicContact CG1-CD1 3.89Å; V194-I198 HydrophobicContact CG1-CG1 4.5Å; V194-I198 VanDerWaalsContact O-CG1 3.3Å; V194-I198 WeakPolarHBondContact O-CG1 3.38Å; V194-I198 PolarHBondContact O-N 3.02Å |
| 195 | S | 85.6 | Confident | 86 | Confident | 13 Ų | 13 | 78 Ų | 78 | 9% | 0.091 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -57.1 | -42.9 | 173.9 | -179.9 | 0 | 0 | 0 | 0 | 111.6 | L185 F191 I198 K199 | L185-S195 WeakPolarHBondContact CD2-O 3.1Å; L185-S195 WeakPolarHBondContact CD2-OG 3.49Å; F191-S195 WeakPolarHBondContact O-CB 2.98Å; F191-S195 PolarHBondContact O-N 2.69Å; S195-I198 PolarHBondContact O-N 3.08Å; S195-K199 VanDerWaalsContact O-CG 3.28Å; S195-K199 WeakPolarHBondContact O-CG 3.33Å; S195-K199 PolarHBondContact O-N 2.86Å |
| 196 | T | 86.7 | Confident | 86.2 | Confident | 74 Ų | 74 | 77.4 Ų | 77.4 | 45% | 0.454 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -65.7 | -43.4 | 177.4 | -57.5 | 0 | 0 | 0 | 0 | 112.2 | E192 V193 V194 I198 K199 L200 | E192-T196 WeakPolarHBondContact O-CB 3.29Å; E192-T196 PolarHBondContact O-N 3.32Å; E192-T196 PolarHBondContact O-OG1 3.14Å; V193-T196 PolarHBondContact O-N 3.39Å; V194-T196 VanDerWaalsContact C-N 3.29Å; V194-T196 PolarHBondContact O-N 3.26Å; T196-I198 PolarHBondContact O-N 3.28Å; T196-K199 PolarHBondContact O-N 2.9Å; T196-L200 HydrophobicContact CG2-CD1 4.37Å; T196-L200 WeakPolarHBondContact O-CG 3.46Å; T196-L200 PolarHBondContact O-N 2.73Å |
| 197 | L | 90.3 | Very high | 86.5 | Confident | 109 Ų | 109 | 71.3 Ų | 71.3 | 57% | 0.571 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -62.5 | -41.9 | 176.6 | -72.4 | 177.5 | 0 | 0 | 0 | 112.3 | V193 V194 L200 F201 | V193-L197 HydrophobicContact CG1-CD1 4.49Å; V193-L197 WeakPolarHBondContact O-CG 3.27Å; V193-L197 PolarHBondContact O-N 3.49Å; V194-L197 PolarHBondContact O-N 3.15Å; L197-L200 PolarHBondContact O-N 3.41Å; L197-F201 WeakPolarHBondContact O-CB 3.16Å; L197-F201 PolarHBondContact O-N 3.04Å |
| 198 | I | 88.8 | Confident | 86.5 | Confident | 36 Ų | 36 | 71.3 Ų | 71.3 | 19% | 0.185 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -63.9 | -42.2 | 177.4 | -67.9 | 166.6 | 0 | 0 | 0 | 110.7 | I181 I184 L185 V188 V194 S195 T196 F201 G202 | I181-I198 HydrophobicContact CB-CG2 4.1Å; I181-I198 HydrophobicContact CG2-CG2 4.32Å; I184-I198 HydrophobicContact CG2-CD1 4.37Å; L185-I198 HydrophobicContact CD2-CB 3.89Å; L185-I198 HydrophobicContact CD2-CG2 3.74Å; L185-I198 HydrophobicContact CG-CG2 4.07Å; V188-I198 HydrophobicContact CB-CD1 4.35Å; V188-I198 HydrophobicContact CG1-CD1 4.21Å; V194-I198 HydrophobicContact CG1-CD1 3.89Å; V194-I198 HydrophobicContact CG1-CG1 4.5Å; V194-I198 VanDerWaalsContact O-CG1 3.3Å; V194-I198 WeakPolarHBondContact O-CG1 3.38Å; V194-I198 PolarHBondContact O-N 3.02Å; S195-I198 PolarHBondContact O-N 3.08Å; T196-I198 PolarHBondContact O-N 3.28Å; I198-F201 PolarHBondContact O-N 2.71Å; I198-G202 PolarHBondContact O-N 3.25Å |
| 199 | K | 87.9 | Confident | 86.7 | Confident | 50 Ų | 50 | 69.5 Ų | 69.5 | 22% | 0.217 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -59.9 | -48.9 | 175.1 | -74 | 171.4 | -173.7 | 179.3 | 0 | 111.9 | L185 S195 T196 F201 G202 V203 L238 T242 | L185-K199 HydrophobicContact CD1-CG 3.66Å; L185-K199 HydrophobicContact CD2-CG 3.94Å; L185-K199 HydrophobicContact CG-CG 4.48Å; S195-K199 VanDerWaalsContact O-CG 3.28Å; S195-K199 WeakPolarHBondContact O-CG 3.33Å; S195-K199 PolarHBondContact O-N 2.86Å; T196-K199 PolarHBondContact O-N 2.9Å; K199-F201 VanDerWaalsContact C-N 3.34Å; K199-F201 PolarHBondContact O-N 3.34Å; K199-G202 PolarHBondContact O-N 3.46Å; K199-V203 PolarHBondContact O-N 2.9Å; K199-L238 HydrophobicContact CB-CD1 3.97Å; K199-L238 HydrophobicContact CB-CD2 4.08Å; K199-L238 HydrophobicContact CD-CD1 4.32Å; K199-L238 HydrophobicContact CG-CD1 4.02Å; K199-T242 HydrophobicContact CD-CG2 4.21Å |
| 200 | L | 89.8 | Confident | 87.4 | Confident | 102 Ų | 102 | 67.6 Ų | 67.6 | 53% | 0.534 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -61.5 | -43.5 | 178.3 | -71 | 176.5 | 0 | 0 | 0 | 111.7 | T196 L197 V203 F204 | T196-L200 HydrophobicContact CG2-CD1 4.37Å; T196-L200 WeakPolarHBondContact O-CG 3.46Å; T196-L200 PolarHBondContact O-N 2.73Å; L197-L200 PolarHBondContact O-N 3.41Å; L200-V203 PolarHBondContact O-N 2.84Å; L200-F204 WeakPolarHBondContact O-CB 3.28Å; L200-F204 PolarHBondContact O-N 3.29Å |
| 201 | F | 90.4 | Very high | 87.7 | Confident | 120 Ų | 120 | 62.7 Ų | 62.7 | 53% | 0.526 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -61.6 | -44.3 | 176.1 | -177.8 | -99.9 | 0 | 0 | 0 | 111.7 | L197 I198 K199 F204 W205 | L197-F201 WeakPolarHBondContact O-CB 3.16Å; L197-F201 PolarHBondContact O-N 3.04Å; I198-F201 PolarHBondContact O-N 2.71Å; K199-F201 VanDerWaalsContact C-N 3.34Å; K199-F201 PolarHBondContact O-N 3.34Å; F201-F204 PolarHBondContact O-N 3.01Å; F201-W205 HydrophobicContact CE1-CD2 4.49Å; F201-W205 AromaticContact CE1-CE3 3.63Å; F201-W205 HydrophobicContact CE1-CE3 3.63Å; F201-W205 HydrophobicContact CE1-CZ3 4.08Å; F201-W205 HydrophobicContact CE2-CE3 4.32Å; F201-W205 AromaticContact CZ-CE3 3.43Å; F201-W205 HydrophobicContact CZ-CE3 3.43Å; F201-W205 VanDerWaalsContact CZ-CE3 3.43Å; F201-W205 AromaticContact CZ-CZ3 3.66Å; F201-W205 HydrophobicContact CZ-CZ3 3.66Å; F201-W205 VanDerWaalsContact O-CB 3.3Å; F201-W205 WeakPolarHBondContact O-CB 3.06Å; F201-W205 PolarHBondContact O-N 3.48Å |
| 202 | G | 87.9 | Confident | 87.4 | Confident | 1 Ų | 1 | 57 Ų | 57 | 1% | 0.01 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -64.6 | -40.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | I198 K199 W205 A206 | I198-G202 PolarHBondContact O-N 3.25Å; K199-G202 PolarHBondContact O-N 3.46Å; G202-W205 PolarHBondContact O-N 2.94Å; G202-A206 VanDerWaalsContact O-CB 3.29Å; G202-A206 WeakPolarHBondContact O-CB 3.37Å; G202-A206 PolarHBondContact O-N 2.99Å |
| 203 | V | 90.1 | Very high | 87.1 | Confident | 4 Ų | 4 | 49.8 Ų | 49.8 | 2% | 0.024 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -63.6 | -45.9 | 172.7 | 169 | 0 | 0 | 0 | 0 | 111.1 | L178 K199 L200 W205 A206 A207 F231 I235 L238 | L178-V203 HydrophobicContact CD2-CG2 3.93Å; K199-V203 PolarHBondContact O-N 2.9Å; L200-V203 PolarHBondContact O-N 2.84Å; V203-W205 VanDerWaalsContact C-N 3.3Å; V203-W205 PolarHBondContact O-N 3.2Å; V203-A206 PolarHBondContact O-N 3.25Å; V203-A207 VanDerWaalsContact O-CB 3.23Å; V203-A207 WeakPolarHBondContact O-CB 3.46Å; V203-A207 PolarHBondContact O-N 3.15Å; V203-F231 HydrophobicContact CG1-CE2 4.26Å; V203-I235 HydrophobicContact CG1-CG1 4.01Å; V203-L238 HydrophobicContact CG2-CB 3.54Å; V203-L238 HydrophobicContact CG2-CD1 4.23Å; V203-L238 HydrophobicContact CG2-CD2 3.5Å; V203-L238 VanDerWaalsContact CG2-CD2 3.5Å; V203-L238 HydrophobicContact CG2-CG 3.92Å |
| 204 | F | 89.6 | Confident | 86.5 | Confident | 125 Ų | 125 | 45.1 Ų | 45.1 | 55% | 0.548 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -61.4 | -41.7 | 178.1 | -172.8 | -94.3 | 0 | 0 | 0 | 111.3 | L200 F201 Y208 F231 | L200-F204 WeakPolarHBondContact O-CB 3.28Å; L200-F204 PolarHBondContact O-N 3.29Å; F201-F204 PolarHBondContact O-N 3.01Å; F204-Y208 WeakPolarHBondContact O-CB 3.11Å; F204-Y208 PolarHBondContact O-N 2.72Å; F204-F231 HydrophobicContact CD2-CE2 4.41Å |
| 205 | W | 89.2 | Confident | 85.8 | Confident | 82 Ų | 82 | 42.8 Ų | 42.8 | 31% | 0.311 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -63.4 | -47.7 | 176.4 | -170.3 | -69 | 0 | 0 | 0 | 112.3 | L96 P98 P177 F201 G202 V203 Y208 S209 | L96-W205 VanDerWaalsContact O-CE2 3.25Å; L96-W205 WeakPolarHBondContact O-CZ2 3.47Å; L96-W205 PolarHBondContact O-NE1 3.32Å; P98-W205 VanDerWaalsContact CD-CE2 3.45Å; P98-W205 HydrophobicContact CG-CD2 4.38Å; P98-W205 HydrophobicContact CG-CZ2 4.07Å; P177-W205 HydrophobicContact CB-CB 4.46Å; P177-W205 VanDerWaalsContact CB-CD1 3.42Å; P177-W205 HydrophobicContact CB-CG 4.16Å; P177-W205 VanDerWaalsContact CG-CD1 3.4Å; F201-W205 HydrophobicContact CE1-CD2 4.49Å; F201-W205 AromaticContact CE1-CE3 3.63Å; F201-W205 HydrophobicContact CE1-CE3 3.63Å; F201-W205 HydrophobicContact CE1-CZ3 4.08Å; F201-W205 HydrophobicContact CE2-CE3 4.32Å; F201-W205 AromaticContact CZ-CE3 3.43Å; F201-W205 HydrophobicContact CZ-CE3 3.43Å; F201-W205 VanDerWaalsContact CZ-CE3 3.43Å; F201-W205 AromaticContact CZ-CZ3 3.66Å; F201-W205 HydrophobicContact CZ-CZ3 3.66Å; F201-W205 VanDerWaalsContact O-CB 3.3Å; F201-W205 WeakPolarHBondContact O-CB 3.06Å; F201-W205 PolarHBondContact O-N 3.48Å; G202-W205 PolarHBondContact O-N 2.94Å; V203-W205 VanDerWaalsContact C-N 3.3Å; V203-W205 PolarHBondContact O-N 3.2Å; W205-Y208 PolarHBondContact O-N 3.44Å; W205-S209 WeakPolarHBondContact O-CB 3.21Å; W205-S209 PolarHBondContact O-N 3.42Å |
| 206 | A | 88.9 | Confident | 84.9 | Confident | 0 Ų | 0 | 43.3 Ų | 43.3 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -60.1 | -51.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | S174 P177 L178 G202 V203 Y208 S209 A210 Y234 | S174-A206 WeakPolarHBondContact O-CB 3.38Å; P177-A206 HydrophobicContact CB-CB 4.35Å; P177-A206 HydrophobicContact CG-CB 4.45Å; L178-A206 HydrophobicContact CD1-CB 3.92Å; L178-A206 HydrophobicContact CG-CB 4.13Å; G202-A206 VanDerWaalsContact O-CB 3.29Å; G202-A206 WeakPolarHBondContact O-CB 3.37Å; G202-A206 PolarHBondContact O-N 2.99Å; V203-A206 PolarHBondContact O-N 3.25Å; A206-Y208 PolarHBondContact O-N 3.33Å; A206-S209 WeakPolarHBondContact O-CB 3.13Å; A206-S209 PolarHBondContact O-N 3.46Å; A206-A210 WeakPolarHBondContact O-CB 3.34Å; A206-A210 PolarHBondContact O-N 3.12Å; A206-Y234 HydrophobicContact CB-CD1 3.73Å; A206-Y234 HydrophobicContact CB-CE1 4.07Å; A206-Y234 HydrophobicContact CB-CG 4.27Å |
| 207 | A | 88.9 | Confident | 83.4 | Confident | 5 Ų | 5 | 46.8 Ų | 46.8 | 4% | 0.041 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -64.5 | -41 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | V203 A210 A211 F231 Y234 | V203-A207 VanDerWaalsContact O-CB 3.23Å; V203-A207 WeakPolarHBondContact O-CB 3.46Å; V203-A207 PolarHBondContact O-N 3.15Å; A207-A210 PolarHBondContact O-N 3.5Å; A207-A211 WeakPolarHBondContact O-CB 3.44Å; A207-A211 PolarHBondContact O-N 3.42Å; A207-F231 HydrophobicContact CB-CB 4.49Å; A207-F231 HydrophobicContact CB-CD2 3.68Å; A207-F231 HydrophobicContact CB-CE2 4.48Å; A207-Y234 HydrophobicContact CB-CD2 3.71Å; A207-Y234 HydrophobicContact CB-CG 4.17Å |
| 208 | Y | 86.1 | Confident | 81.8 | Confident | 114 Ų | 114 | 46.9 Ų | 46.9 | 45% | 0.447 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -62.2 | -44.6 | 174.6 | -179 | -101.5 | 0 | 0 | 0 | 111 | P98 F204 W205 A206 A211 S212 | P98-Y208 HydrophobicContact CB-CD1 3.74Å; P98-Y208 HydrophobicContact CB-CE1 3.84Å; P98-Y208 HydrophobicContact CG-CD1 3.96Å; P98-Y208 HydrophobicContact CG-CE1 4.25Å; F204-Y208 WeakPolarHBondContact O-CB 3.11Å; F204-Y208 PolarHBondContact O-N 2.72Å; W205-Y208 PolarHBondContact O-N 3.44Å; A206-Y208 PolarHBondContact O-N 3.33Å; Y208-A211 PolarHBondContact O-N 3.22Å; Y208-S212 WeakPolarHBondContact O-CB 3.29Å; Y208-S212 PolarHBondContact O-N 2.96Å; Y208-S212 PolarHBondContact O-OG 3.21Å |
| 209 | S | 85.7 | Confident | 80.3 | Confident | 1 Ų | 1 | 45.9 Ų | 45.9 | 1% | 0.007 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -58.4 | -53.2 | 176.4 | -167.3 | 0 | 0 | 0 | 0 | 111.4 | V95 W205 A206 A211 S212 L213 | V95-S209 WeakPolarHBondContact CG1-OG 3.36Å; V95-S209 PolarHBondContact O-OG 3.08Å; W205-S209 WeakPolarHBondContact O-CB 3.21Å; W205-S209 PolarHBondContact O-N 3.42Å; A206-S209 WeakPolarHBondContact O-CB 3.13Å; A206-S209 PolarHBondContact O-N 3.46Å; S209-A211 PolarHBondContact O-N 3.06Å; S209-S212 PolarHBondContact O-N 3.08Å; S209-S212 PolarHBondContact O-OG 3.18Å; S209-L213 WeakPolarHBondContact O-CD1 3.48Å; S209-L213 WeakPolarHBondContact O-CG 3.41Å; S209-L213 PolarHBondContact O-N 3.37Å |
| 210 | A | 86.1 | Confident | 78.7 | Confident | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -57.8 | -49.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113 | I171 S174 A206 A207 S212 L213 L214 I230 Y234 | I171-A210 HydrophobicContact CD1-CB 4.37Å; S174-A210 WeakPolarHBondContact OG-CB 3.41Å; A206-A210 WeakPolarHBondContact O-CB 3.34Å; A206-A210 PolarHBondContact O-N 3.12Å; A207-A210 PolarHBondContact O-N 3.5Å; A210-S212 VanDerWaalsContact C-N 3.29Å; A210-S212 PolarHBondContact O-N 3.27Å; A210-L213 PolarHBondContact O-N 3.04Å; A210-L214 WeakPolarHBondContact O-CB 3.42Å; A210-L214 WeakPolarHBondContact O-CG 3.48Å; A210-L214 PolarHBondContact O-N 3.34Å; A210-I230 HydrophobicContact CB-CG2 3.84Å; A210-Y234 HydrophobicContact CB-CE2 3.49Å; A210-Y234 VanDerWaalsContact CB-CE2 3.49Å; A210-Y234 WeakPolarHBondContact CB-OH 3.22Å |
| 211 | A | 84.6 | Confident | 77.3 | Confident | 8 Ų | 8 | 51.7 Ų | 51.7 | 7% | 0.066 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -61 | -41.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | A207 Y208 S209 L213 V215 I227 I230 | A207-A211 WeakPolarHBondContact O-CB 3.44Å; A207-A211 PolarHBondContact O-N 3.42Å; Y208-A211 PolarHBondContact O-N 3.22Å; S209-A211 PolarHBondContact O-N 3.06Å; A211-L213 VanDerWaalsContact C-N 3.3Å; A211-L213 PolarHBondContact O-N 2.96Å; A211-V215 WeakPolarHBondContact O-CA 3.32Å; A211-V215 WeakPolarHBondContact O-CB 3.48Å; A211-V215 VanDerWaalsContact O-CG2 3.27Å; A211-V215 WeakPolarHBondContact O-CG2 3.45Å; A211-V215 PolarHBondContact O-N 2.84Å; A211-I227 HydrophobicContact CB-CG1 4.09Å; A211-I227 HydrophobicContact CB-CG2 4.42Å; A211-I230 HydrophobicContact CB-CD1 4.48Å; A211-I230 HydrophobicContact CB-CG2 4.5Å |
| 212 | S | 78.8 | Confident | 76 | Confident | 18 Ų | 18 | 52.2 Ų | 52.2 | 13% | 0.126 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -74.1 | -21.8 | -176.8 | 79 | 0 | 0 | 0 | 0 | 113.5 | R106 Y208 S209 A210 | R106-S212 VanDerWaalsContact CZ-OG 3.31Å; R106-S212 PolarHBondContact NH1-OG 2.95Å; R106-S212 PolarHBondContact NH2-O 3.36Å; R106-S212 PolarHBondContact NH2-OG 2.89Å; Y208-S212 WeakPolarHBondContact O-CB 3.29Å; Y208-S212 PolarHBondContact O-N 2.96Å; Y208-S212 PolarHBondContact O-OG 3.21Å; S209-S212 PolarHBondContact O-N 3.08Å; S209-S212 PolarHBondContact O-OG 3.18Å; A210-S212 VanDerWaalsContact C-N 3.29Å; A210-S212 PolarHBondContact O-N 3.27Å |
| 213 | L | 77.5 | Confident | 75.1 | Confident | 11 Ų | 11 | 55.6 Ų | 55.6 | 6% | 0.058 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -84.1 | -40.9 | 173.4 | -75.9 | 160.6 | 0 | 0 | 0 | 112.1 | V95 R106 V109 V170 S209 A210 A211 | V95-L213 HydrophobicContact CG2-CD1 3.65Å; R106-L213 HydrophobicContact CG-CD2 3.28Å; R106-L213 HydrophobicContact CG-CG 4.26Å; V109-L213 HydrophobicContact CB-CD2 4.22Å; V109-L213 HydrophobicContact CG2-CD2 4.19Å; V170-L213 HydrophobicContact CG1-CB 3.49Å; V170-L213 VanDerWaalsContact CG1-CB 3.49Å; V170-L213 HydrophobicContact CG1-CD1 3.94Å; V170-L213 HydrophobicContact CG1-CG 4.33Å; V170-L213 HydrophobicContact CG2-CB 4.28Å; S209-L213 WeakPolarHBondContact O-CD1 3.48Å; S209-L213 WeakPolarHBondContact O-CG 3.41Å; S209-L213 PolarHBondContact O-N 3.37Å; A210-L213 PolarHBondContact O-N 3.04Å; A211-L213 VanDerWaalsContact C-N 3.3Å; A211-L213 PolarHBondContact O-N 2.96Å |
| 214 | L | 76.6 | Confident | 74.4 | Confident | 10 Ų | 10 | 59.8 Ų | 59.8 | 5% | 0.052 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -81 | -38.9 | 179.9 | -70.2 | 174.6 | 0 | 0 | 0 | 113.1 | I151 V167 V170 I171 A210 G216 L226 I230 | I151-L214 HydrophobicContact CG2-CD1 4.18Å; V167-L214 HydrophobicContact CB-CD2 4.41Å; V167-L214 HydrophobicContact CG1-CD1 4.3Å; V167-L214 HydrophobicContact CG1-CD2 4.45Å; V167-L214 HydrophobicContact CG2-CD2 4.15Å; V170-L214 HydrophobicContact CB-CD2 3.93Å; V170-L214 HydrophobicContact CB-CG 4.15Å; V170-L214 HydrophobicContact CG1-CD1 4.22Å; V170-L214 HydrophobicContact CG1-CD2 4.03Å; V170-L214 HydrophobicContact CG1-CG 3.69Å; V170-L214 HydrophobicContact CG2-CD2 4.16Å; I171-L214 HydrophobicContact CD1-CD1 3.8Å; I171-L214 HydrophobicContact CG1-CD1 4.16Å; A210-L214 WeakPolarHBondContact O-CB 3.42Å; A210-L214 WeakPolarHBondContact O-CG 3.48Å; A210-L214 PolarHBondContact O-N 3.34Å; L214-G216 VanDerWaalsContact C-N 3.31Å; L214-G216 PolarHBondContact O-N 3.49Å; L214-G216 VanDerWaalsContact O-N 3.14Å; L214-L226 HydrophobicContact CB-CD2 4.38Å; L214-I230 HydrophobicContact CB-CD1 4.34Å; L214-I230 HydrophobicContact CD1-CD1 3.76Å |
| 215 | V | 72.5 | Confident | 74 | Confident | 15 Ų | 15 | 58.9 Ų | 58.9 | 9% | 0.091 | 30% | 0.295 | C | S | . | . | S | Bend | trans | -92 | 67.9 | -177.6 | -169.6 | 0 | 0 | 0 | 0 | 109.3 | A211 F219 K223 L226 I227 | A211-V215 WeakPolarHBondContact O-CA 3.32Å; A211-V215 WeakPolarHBondContact O-CB 3.48Å; A211-V215 VanDerWaalsContact O-CG2 3.27Å; A211-V215 WeakPolarHBondContact O-CG2 3.45Å; A211-V215 PolarHBondContact O-N 2.84Å; V215-F219 HydrophobicContact CG1-CB 4.15Å; V215-F219 HydrophobicContact CG1-CD2 4.49Å; V215-K223 HydrophobicContact CG1-CB 3.84Å; V215-K223 HydrophobicContact CG1-CD 3.89Å; V215-K223 HydrophobicContact CG1-CG 3.61Å; V215-L226 HydrophobicContact CG2-CB 4.42Å; V215-L226 HydrophobicContact CG2-CD2 3.59Å; V215-I227 HydrophobicContact CG2-CG1 4.07Å |
| 216 | G | 65.7 | Low | 73.7 | Confident | 24 Ų | 24 | 55.1 Ų | 55.1 | 25% | 0.247 | 28% | 0.281 | C | S | . | . | trans | -66 | -172.6 | 169.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | L214 E218 | L214-G216 VanDerWaalsContact C-N 3.31Å; L214-G216 PolarHBondContact O-N 3.49Å; L214-G216 VanDerWaalsContact O-N 3.14Å; G216-E218 PolarHBondContact O-N 2.82Å | ||
| 217 | E | 56.7 | Low | 73.5 | Confident | 147 Ų | 147 | 58.5 Ų | 58.5 | 69% | 0.687 | 30% | 0.298 | S | S | * | . | G | 310 helix | trans | -58.7 | -16.6 | -177.1 | -69.6 | -143.2 | -177.9 | 0 | 0 | 115.1 | F219 K220 | E217-F219 PolarHBondContact O-N 3.28Å; E217-K220 WeakPolarHBondContact OE2-CE 3.5Å; E217-K220 IonicContact OE2-NZ 2.75Å; E217-K220 PolarHBondContact OE2-NZ 2.98Å |
| 218 | E | 56.2 | Low | 73.5 | Confident | 112 Ų | 112 | 66 Ų | 66 | 52% | 0.523 | 33% | 0.327 | S | S | . | . | G | 310 helix | trans | -64.4 | -20.7 | -175.2 | -63.5 | 174.2 | -173.3 | 0 | 0 | 114.1 | R110 G216 | R110-E218 IonicContact CZ-OE1 3.63Å; R110-E218 IonicContact CZ-OE2 3.64Å; R110-E218 IonicContact NH1-OE1 3.47Å; R110-E218 PolarHBondContact NH1-OE1 2.92Å; R110-E218 IonicContact NH1-OE2 3.25Å; R110-E218 PolarHBondContact NH1-OE2 3.42Å; R110-E218 IonicContact NH2-OE1 2.96Å; R110-E218 PolarHBondContact NH2-OE1 2.82Å; R110-E218 IonicContact NH2-OE2 3.04Å; R110-E218 PolarHBondContact NH2-OE2 3.35Å; G216-E218 PolarHBondContact O-N 2.82Å |
| 219 | F | 57 | Low | 73.7 | Confident | 14 Ų | 14 | 62 Ų | 62 | 6% | 0.061 | 31% | 0.314 | C | S | . | . | G | 310 helix | trans | -114.8 | 23.7 | -171.5 | -61.2 | -75.3 | 0 | 0 | 0 | 115.6 | L158 G160 V215 E217 T221 K222 K223 | L158-F219 HydrophobicContact CB-CD1 4.43Å; L158-F219 HydrophobicContact CB-CE1 3.96Å; G160-F219 VanDerWaalsContact CA-CZ 3.48Å; V215-F219 HydrophobicContact CG1-CB 4.15Å; V215-F219 HydrophobicContact CG1-CD2 4.49Å; E217-F219 PolarHBondContact O-N 3.28Å; F219-T221 PolarHBondContact O-N 3.33Å; F219-K222 PolarHBondContact O-N 3.48Å; F219-K223 HydrophobicContact CB-CG 4.23Å; F219-K223 WeakPolarHBondContact O-CG 3.37Å; F219-K223 PolarHBondContact O-N 3.34Å; F219-K223 VanDerWaalsContact O-N 3.08Å |
| 220 | K | 55.1 | Low | 73.9 | Confident | 136 Ų | 136 | 62 Ų | 62 | 59% | 0.591 | 31% | 0.314 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -41.8 | -33.2 | -172.2 | -83.9 | 172.3 | -176.4 | 165.2 | 0 | 116.1 | E217 | E217-K220 WeakPolarHBondContact OE2-CE 3.5Å; E217-K220 IonicContact OE2-NZ 2.75Å; E217-K220 PolarHBondContact OE2-NZ 2.98Å |
| 221 | T | 58.8 | Low | 74.1 | Confident | 139 Ų | 139 | 65.7 Ų | 65.7 | 85% | 0.853 | 33% | 0.331 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.6 | -15.3 | -177.6 | -9.1 | 0 | 0 | 0 | 0 | 115.5 | F219 | F219-T221 PolarHBondContact O-N 3.33Š|
| 222 | K | 64.9 | Low | 74.4 | Confident | 130 Ų | 130 | 69.4 Ų | 69.4 | 57% | 0.565 | 35% | 0.349 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -128 | 14.9 | -175.9 | -62.6 | -163.2 | -179 | -179.1 | 0 | 115 | F219 L225 | F219-K222 PolarHBondContact O-N 3.48Å; K222-L225 WeakPolarHBondContact O-CB 3.14Å; K222-L225 PolarHBondContact O-N 3.17Å |
| 223 | K | 68.7 | Low | 75 | Confident | 72 Ų | 72 | 69.3 Ų | 69.3 | 31% | 0.313 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -42.4 | -48.8 | 176.2 | -58.4 | -165.5 | 163.4 | 168.4 | 0 | 115.7 | V215 F219 L225 L226 I227 | V215-K223 HydrophobicContact CG1-CB 3.84Å; V215-K223 HydrophobicContact CG1-CD 3.89Å; V215-K223 HydrophobicContact CG1-CG 3.61Å; F219-K223 HydrophobicContact CB-CG 4.23Å; F219-K223 WeakPolarHBondContact O-CG 3.37Å; F219-K223 PolarHBondContact O-N 3.34Å; F219-K223 VanDerWaalsContact O-N 3.08Å; K223-L225 PolarHBondContact O-N 2.91Å; K223-L226 PolarHBondContact O-N 3.39Å; K223-I227 HydrophobicContact CB-CD1 4.3Å; K223-I227 WeakPolarHBondContact O-CG1 3.47Å; K223-I227 PolarHBondContact O-N 2.94Å |
| 224 | P | 74.8 | Confident | 75.7 | Confident | 93 Ų | 93 | 68.8 Ų | 68.8 | 60% | 0.604 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -65.6 | -25.4 | -173.2 | 24.6 | -34.6 | 0 | 0 | 0 | 113.7 | L226 I227 Y228 | P224-L226 VanDerWaalsContact C-N 3.28Å; P224-L226 PolarHBondContact O-N 3.4Å; P224-I227 PolarHBondContact O-N 2.81Å; P224-Y228 PolarHBondContact O-N 3.11Å |
| 225 | L | 81.4 | Confident | 76.4 | Confident | 105 Ų | 105 | 72.1 Ų | 72.1 | 55% | 0.55 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -65.9 | -31.3 | -179.4 | -117.6 | 69.6 | 0 | 0 | 0 | 112.7 | L158 K222 K223 P229 | L158-L225 HydrophobicContact CD2-CB 4.17Å; K222-L225 WeakPolarHBondContact O-CB 3.14Å; K222-L225 PolarHBondContact O-N 3.17Å; K223-L225 PolarHBondContact O-N 2.91Å; L225-P229 WeakPolarHBondContact O-CD 3.26Å |
| 226 | L | 83.1 | Confident | 77.2 | Confident | 4 Ų | 4 | 76 Ų | 76 | 2% | 0.021 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -92.9 | -29.8 | -179.4 | -162 | 135.3 | 0 | 0 | 0 | 112.1 | I151 A155 L158 L214 V215 K223 P224 Y228 P229 I230 | I151-L226 HydrophobicContact CG2-CD2 4.46Å; A155-L226 HydrophobicContact CB-CD1 3.69Å; L158-L226 HydrophobicContact CD2-CB 4.22Å; L158-L226 HydrophobicContact CD2-CD1 4.26Å; L214-L226 HydrophobicContact CB-CD2 4.38Å; V215-L226 HydrophobicContact CG2-CB 4.42Å; V215-L226 HydrophobicContact CG2-CD2 3.59Å; K223-L226 PolarHBondContact O-N 3.39Å; P224-L226 VanDerWaalsContact C-N 3.28Å; P224-L226 PolarHBondContact O-N 3.4Å; L226-Y228 VanDerWaalsContact C-N 3.35Å; L226-P229 VanDerWaalsContact O-CD 3.27Å; L226-P229 WeakPolarHBondContact O-CD 3.37Å; L226-P229 WeakPolarHBondContact O-CG 3.46Å; L226-I230 HydrophobicContact CD2-CD1 3.46Å; L226-I230 VanDerWaalsContact CD2-CD1 3.46Å; L226-I230 HydrophobicContact CD2-CG1 4.32Å; L226-I230 VanDerWaalsContact O-CG1 3.29Å; L226-I230 WeakPolarHBondContact O-CG1 3.45Å; L226-I230 PolarHBondContact O-N 3.3Å |
| 227 | I | 84.9 | Confident | 78.3 | Confident | 71 Ų | 71 | 74.9 Ų | 74.9 | 36% | 0.364 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -65.6 | -38.7 | 176.4 | -65.2 | 170.1 | 0 | 0 | 0 | 111.4 | A211 V215 K223 P224 I230 F231 | A211-I227 HydrophobicContact CB-CG1 4.09Å; A211-I227 HydrophobicContact CB-CG2 4.42Å; V215-I227 HydrophobicContact CG2-CG1 4.07Å; K223-I227 HydrophobicContact CB-CD1 4.3Å; K223-I227 WeakPolarHBondContact O-CG1 3.47Å; K223-I227 PolarHBondContact O-N 2.94Å; P224-I227 PolarHBondContact O-N 2.81Å; I227-I230 PolarHBondContact O-N 3.03Å; I227-F231 WeakPolarHBondContact O-CB 3.28Å; I227-F231 PolarHBondContact O-N 3.49Å |
| 228 | Y | 88.7 | Confident | 79.8 | Confident | 162 Ų | 162 | 69 Ų | 69 | 64% | 0.635 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -55.9 | -55.6 | -178.9 | 177.9 | -99 | 0 | 0 | 0 | 113.8 | P224 L226 I230 F231 L232 | P224-Y228 PolarHBondContact O-N 3.11Å; L226-Y228 VanDerWaalsContact C-N 3.35Å; Y228-I230 VanDerWaalsContact C-N 3.32Å; Y228-I230 PolarHBondContact O-N 3.37Å; Y228-F231 PolarHBondContact O-N 3.4Å; Y228-L232 HydrophobicContact CE1-CD1 4.17Å; Y228-L232 PolarHBondContact O-N 3.35Å |
| 229 | P | 90.3 | Very high | 81.3 | Confident | 29 Ų | 29 | 66 Ų | 66 | 19% | 0.188 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -69.6 | -28 | 179.9 | 28.2 | -36.5 | 0 | 0 | 0 | 113 | I151 L154 L225 L226 L232 L233 | I151-P229 HydrophobicContact CD1-CB 3.53Å; I151-P229 HydrophobicContact CD1-CG 3.7Å; L154-P229 HydrophobicContact CD2-CB 4.48Å; L154-P229 HydrophobicContact CD2-CG 3.46Å; L154-P229 VanDerWaalsContact CD2-CG 3.46Å; L225-P229 WeakPolarHBondContact O-CD 3.26Å; L226-P229 VanDerWaalsContact O-CD 3.27Å; L226-P229 WeakPolarHBondContact O-CD 3.37Å; L226-P229 WeakPolarHBondContact O-CG 3.46Å; P229-L232 PolarHBondContact O-N 3.24Å; P229-L233 WeakPolarHBondContact O-CB 3.34Å; P229-L233 PolarHBondContact O-N 2.86Å |
| 230 | I | 90.3 | Very high | 82.5 | Confident | 1 Ų | 1 | 66.8 Ų | 66.8 | 1% | 0.005 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -61 | -50.8 | 170.5 | -68.8 | 175.9 | 0 | 0 | 0 | 109.7 | I151 I171 A210 A211 L214 L226 I227 Y228 L232 L233 Y234 | I151-I230 HydrophobicContact CD1-CG1 3.96Å; I151-I230 HydrophobicContact CG1-CG1 4.33Å; I151-I230 HydrophobicContact CG2-CD1 4.42Å; I151-I230 HydrophobicContact CG2-CG1 4.09Å; I171-I230 HydrophobicContact CD1-CG1 4.49Å; I171-I230 HydrophobicContact CD1-CG2 4.5Å; A210-I230 HydrophobicContact CB-CG2 3.84Å; A211-I230 HydrophobicContact CB-CD1 4.48Å; A211-I230 HydrophobicContact CB-CG2 4.5Å; L214-I230 HydrophobicContact CB-CD1 4.34Å; L214-I230 HydrophobicContact CD1-CD1 3.76Å; L226-I230 HydrophobicContact CD2-CD1 3.46Å; L226-I230 VanDerWaalsContact CD2-CD1 3.46Å; L226-I230 HydrophobicContact CD2-CG1 4.32Å; L226-I230 VanDerWaalsContact O-CG1 3.29Å; L226-I230 WeakPolarHBondContact O-CG1 3.45Å; L226-I230 PolarHBondContact O-N 3.3Å; I227-I230 PolarHBondContact O-N 3.03Å; Y228-I230 VanDerWaalsContact C-N 3.32Å; Y228-I230 PolarHBondContact O-N 3.37Å; I230-L232 VanDerWaalsContact C-N 3.31Å; I230-L232 PolarHBondContact O-N 3.19Å; I230-L233 WeakPolarHBondContact O-CB 3.36Å; I230-L233 PolarHBondContact O-N 3.38Å; I230-L233 VanDerWaalsContact O-N 3.15Å; I230-Y234 HydrophobicContact CG2-CD2 3.99Å; I230-Y234 HydrophobicContact CG2-CE2 3.65Å; I230-Y234 WeakPolarHBondContact O-CD2 3.46Å; I230-Y234 PolarHBondContact O-N 3.27Å |
| 231 | F | 90.1 | Very high | 83.8 | Confident | 79 Ų | 79 | 63.2 Ų | 63.2 | 35% | 0.346 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -59.8 | -42.7 | 179.9 | -176 | -109.2 | 0 | 0 | 0 | 112.1 | V203 F204 A207 I227 Y228 L233 Y234 I235 | V203-F231 HydrophobicContact CG1-CE2 4.26Å; F204-F231 HydrophobicContact CD2-CE2 4.41Å; A207-F231 HydrophobicContact CB-CB 4.49Å; A207-F231 HydrophobicContact CB-CD2 3.68Å; A207-F231 HydrophobicContact CB-CE2 4.48Å; I227-F231 WeakPolarHBondContact O-CB 3.28Å; I227-F231 PolarHBondContact O-N 3.49Å; Y228-F231 PolarHBondContact O-N 3.4Å; F231-L233 VanDerWaalsContact C-N 3.31Å; F231-L233 PolarHBondContact O-N 3.2Å; F231-Y234 PolarHBondContact O-N 3.3Å; F231-I235 HydrophobicContact CD1-CD1 3.59Å; F231-I235 HydrophobicContact CD1-CG1 4.46Å; F231-I235 HydrophobicContact CE1-CD1 3.26Å; F231-I235 HydrophobicContact CE1-CG1 4.19Å; F231-I235 HydrophobicContact CG-CD1 4.41Å; F231-I235 HydrophobicContact CZ-CD1 3.81Å; F231-I235 HydrophobicContact CZ-CG1 4.33Å; F231-I235 WeakPolarHBondContact O-CG1 3.48Å; F231-I235 PolarHBondContact O-N 2.99Å |
| 232 | L | 90.6 | Very high | 84.6 | Confident | 86 Ų | 86 | 59.2 Ų | 59.2 | 45% | 0.45 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -60.5 | -40.8 | 176.3 | -162.7 | 158.1 | 0 | 0 | 0 | 111.6 | Y228 P229 I230 Y234 I235 Y236 | Y228-L232 HydrophobicContact CE1-CD1 4.17Å; Y228-L232 PolarHBondContact O-N 3.35Å; P229-L232 PolarHBondContact O-N 3.24Å; I230-L232 VanDerWaalsContact C-N 3.31Å; I230-L232 PolarHBondContact O-N 3.19Å; L232-Y234 PolarHBondContact O-N 2.97Å; L232-I235 PolarHBondContact O-N 2.92Å; L232-Y236 PolarHBondContact O-N 2.89Å |
| 233 | L | 92.3 | Very high | 84.7 | Confident | 16 Ų | 16 | 56.3 Ų | 56.3 | 8% | 0.084 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -60.6 | -43.4 | 176.7 | -170.2 | 71.2 | 0 | 0 | 0 | 112.2 | I143 I171 P229 I230 F231 Y236 F237 | I143-L233 HydrophobicContact CG2-CD1 3.78Å; I171-L233 HydrophobicContact CD1-CD2 4.34Å; I171-L233 HydrophobicContact CG2-CD2 3.66Å; P229-L233 WeakPolarHBondContact O-CB 3.34Å; P229-L233 PolarHBondContact O-N 2.86Å; I230-L233 WeakPolarHBondContact O-CB 3.36Å; I230-L233 PolarHBondContact O-N 3.38Å; I230-L233 VanDerWaalsContact O-N 3.15Å; F231-L233 VanDerWaalsContact C-N 3.31Å; F231-L233 PolarHBondContact O-N 3.2Å; L233-Y236 WeakPolarHBondContact O-CB 3.44Å; L233-Y236 PolarHBondContact O-N 3.04Å; L233-F237 HydrophobicContact CD1-CE2 4.26Å; L233-F237 HydrophobicContact CD2-CE2 4.02Å; L233-F237 HydrophobicContact CG-CD2 4.15Å; L233-F237 HydrophobicContact CG-CE2 3.7Å; L233-F237 WeakPolarHBondContact O-CD2 3.45Å; L233-F237 PolarHBondContact O-N 3.29Å |
| 234 | Y | 90.8 | Very high | 83.8 | Confident | 0 Ų | 0 | 60.9 Ų | 60.9 | 0% | 0 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -70.7 | -33.1 | 176.9 | -71.4 | -76.7 | 0 | 0 | 0 | 113.7 | I171 S174 L175 L178 A206 A207 A210 I230 F231 L232 Y236 F237 L238 | I171-Y234 VanDerWaalsContact CA-OH 3.31Å; I171-Y234 WeakPolarHBondContact CA-OH 3.41Å; I171-Y234 HydrophobicContact CD1-CE2 4.37Å; I171-Y234 PolarHBondContact O-OH 3.29Å; S174-Y234 PolarHBondContact OG-OH 3.36Å; L175-Y234 HydrophobicContact CD2-CD1 4.13Å; L175-Y234 HydrophobicContact CD2-CE1 3.85Å; L175-Y234 HydrophobicContact CG-CE1 4.41Å; L178-Y234 HydrophobicContact CD1-CD1 3.92Å; A206-Y234 HydrophobicContact CB-CD1 3.73Å; A206-Y234 HydrophobicContact CB-CE1 4.07Å; A206-Y234 HydrophobicContact CB-CG 4.27Å; A207-Y234 HydrophobicContact CB-CD2 3.71Å; A207-Y234 HydrophobicContact CB-CG 4.17Å; A210-Y234 HydrophobicContact CB-CE2 3.49Å; A210-Y234 VanDerWaalsContact CB-CE2 3.49Å; A210-Y234 WeakPolarHBondContact CB-OH 3.22Å; I230-Y234 HydrophobicContact CG2-CD2 3.99Å; I230-Y234 HydrophobicContact CG2-CE2 3.65Å; I230-Y234 WeakPolarHBondContact O-CD2 3.46Å; I230-Y234 PolarHBondContact O-N 3.27Å; F231-Y234 PolarHBondContact O-N 3.3Å; L232-Y234 PolarHBondContact O-N 2.97Å; Y234-Y236 VanDerWaalsContact C-N 3.26Å; Y234-Y236 PolarHBondContact O-N 3.22Å; Y234-F237 HydrophobicContact CD1-CD2 4.34Å; Y234-F237 PolarHBondContact O-N 3.41Å; Y234-L238 PolarHBondContact O-N 2.87Å |
| 235 | I | 90.8 | Very high | 84.2 | Confident | 79 Ų | 79 | 59.3 Ų | 59.3 | 41% | 0.405 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -60.3 | -42.8 | 169.3 | -70.4 | 168.1 | 0 | 0 | 0 | 109.9 | V203 F231 L232 L238 S239 | V203-I235 HydrophobicContact CG1-CG1 4.01Å; F231-I235 HydrophobicContact CD1-CD1 3.59Å; F231-I235 HydrophobicContact CD1-CG1 4.46Å; F231-I235 HydrophobicContact CE1-CD1 3.26Å; F231-I235 HydrophobicContact CE1-CG1 4.19Å; F231-I235 HydrophobicContact CG-CD1 4.41Å; F231-I235 HydrophobicContact CZ-CD1 3.81Å; F231-I235 HydrophobicContact CZ-CG1 4.33Å; F231-I235 WeakPolarHBondContact O-CG1 3.48Å; F231-I235 PolarHBondContact O-N 2.99Å; L232-I235 PolarHBondContact O-N 2.92Å; I235-L238 WeakPolarHBondContact O-CB 3.45Å; I235-L238 PolarHBondContact O-N 3.43Å; I235-S239 PolarHBondContact O-N 3.33Å |
| 236 | Y | 89.9 | Confident | 84.3 | Confident | 97 Ų | 97 | 56.9 Ų | 56.9 | 38% | 0.38 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -64 | -43.2 | 178.7 | -165.2 | -78.8 | 0 | 0 | 0 | 111.9 | I143 L232 L233 Y234 L238 S239 L240 | I143-Y236 HydrophobicContact CD1-CD1 3.69Å; I143-Y236 HydrophobicContact CD1-CE1 3.04Å; I143-Y236 HydrophobicContact CG1-CE1 4.19Å; I143-Y236 HydrophobicContact CG2-CD1 4.19Å; L232-Y236 PolarHBondContact O-N 2.89Å; L233-Y236 WeakPolarHBondContact O-CB 3.44Å; L233-Y236 PolarHBondContact O-N 3.04Å; Y234-Y236 VanDerWaalsContact C-N 3.26Å; Y234-Y236 PolarHBondContact O-N 3.22Å; Y236-L238 VanDerWaalsContact C-N 3.29Å; Y236-L238 PolarHBondContact O-N 3.21Å; Y236-S239 WeakPolarHBondContact O-CB 3.43Å; Y236-S239 PolarHBondContact O-N 3.12Å; Y236-S239 VanDerWaalsContact O-N 3.13Å; Y236-L240 HydrophobicContact CD1-CD1 3.85Å; Y236-L240 HydrophobicContact CD1-CG 3.93Å; Y236-L240 HydrophobicContact CE1-CD1 3.57Å; Y236-L240 HydrophobicContact CE1-CD2 3.93Å; Y236-L240 HydrophobicContact CE1-CG 3.54Å; Y236-L240 PolarHBondContact O-N 3.38Å |
| 237 | F | 89.3 | Confident | 84.4 | Confident | 0 Ų | 0 | 59.8 Ų | 59.8 | 0% | 0 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -58.8 | -39.7 | 172.8 | -76.7 | -59.4 | 0 | 0 | 0 | 112.5 | F125 I140 I143 W144 L175 L233 Y234 L240 Y241 | F125-F237 HydrophobicContact CE1-CD1 4.2Å; F125-F237 HydrophobicContact CZ-CB 4.35Å; I140-F237 HydrophobicContact CG2-CE1 4.17Å; I143-F237 HydrophobicContact CG2-CE1 4.2Å; I143-F237 HydrophobicContact CG2-CZ 4.17Å; W144-F237 HydrophobicContact CB-CE1 4.43Å; W144-F237 HydrophobicContact CB-CZ 4Å; L175-F237 HydrophobicContact CD2-CB 4.22Å; L175-F237 HydrophobicContact CD2-CD1 4.3Å; L175-F237 HydrophobicContact CD2-CD2 3.66Å; L175-F237 HydrophobicContact CD2-CE2 4Å; L175-F237 HydrophobicContact CD2-CG 3.82Å; L175-F237 HydrophobicContact CD2-CZ 4.47Å; L233-F237 HydrophobicContact CD1-CE2 4.26Å; L233-F237 HydrophobicContact CD2-CE2 4.02Å; L233-F237 HydrophobicContact CG-CD2 4.15Å; L233-F237 HydrophobicContact CG-CE2 3.7Å; L233-F237 WeakPolarHBondContact O-CD2 3.45Å; L233-F237 PolarHBondContact O-N 3.29Å; Y234-F237 HydrophobicContact CD1-CD2 4.34Å; Y234-F237 PolarHBondContact O-N 3.41Å; F237-L240 PolarHBondContact O-N 3.01Å; F237-Y241 PolarHBondContact O-N 3.32Å |
| 238 | L | 87.9 | Confident | 84.4 | Confident | 24 Ų | 24 | 59.2 Ų | 59.2 | 13% | 0.126 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -63.8 | -44 | 173.3 | 178.9 | 69 | 0 | 0 | 0 | 111.8 | K199 V203 Y234 I235 Y236 L240 Y241 T242 | K199-L238 HydrophobicContact CB-CD1 3.97Å; K199-L238 HydrophobicContact CB-CD2 4.08Å; K199-L238 HydrophobicContact CD-CD1 4.32Å; K199-L238 HydrophobicContact CG-CD1 4.02Å; V203-L238 HydrophobicContact CG2-CB 3.54Å; V203-L238 HydrophobicContact CG2-CD1 4.23Å; V203-L238 HydrophobicContact CG2-CD2 3.5Å; V203-L238 VanDerWaalsContact CG2-CD2 3.5Å; V203-L238 HydrophobicContact CG2-CG 3.92Å; Y234-L238 PolarHBondContact O-N 2.87Å; I235-L238 WeakPolarHBondContact O-CB 3.45Å; I235-L238 PolarHBondContact O-N 3.43Å; Y236-L238 VanDerWaalsContact C-N 3.29Å; Y236-L238 PolarHBondContact O-N 3.21Å; L238-L240 VanDerWaalsContact C-N 3.32Å; L238-L240 PolarHBondContact O-N 2.88Å; L238-Y241 HydrophobicContact CD1-CD1 4.29Å; L238-Y241 WeakPolarHBondContact O-CB 3.28Å; L238-Y241 PolarHBondContact O-N 3.11Å; L238-Y241 VanDerWaalsContact O-N 3.16Å; L238-T242 HydrophobicContact CD1-CG2 4.39Å; L238-T242 PolarHBondContact O-N 3.12Å; L238-T242 PolarHBondContact O-OG1 2.94Å; L238-T242 VanDerWaalsContact O-OG1 3.05Å |
| 239 | S | 86.9 | Confident | 84.1 | Confident | 49 Ų | 49 | 52.8 Ų | 52.8 | 34% | 0.343 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -56.6 | -47.3 | 177.8 | -159.1 | 0 | 0 | 0 | 0 | 111.1 | I235 Y236 Y241 T242 G243 V244 | I235-S239 PolarHBondContact O-N 3.33Å; Y236-S239 WeakPolarHBondContact O-CB 3.43Å; Y236-S239 PolarHBondContact O-N 3.12Å; Y236-S239 VanDerWaalsContact O-N 3.13Å; S239-Y241 VanDerWaalsContact C-N 3.34Å; S239-Y241 PolarHBondContact O-N 2.82Å; S239-T242 WeakPolarHBondContact CA-OG1 3.44Å; S239-T242 CarbonylContact O-C 3.47Å; S239-T242 PolarHBondContact O-N 3Å; S239-T242 VanDerWaalsContact O-N 3.14Å; S239-T242 PolarHBondContact O-OG1 3.32Å; S239-G243 PolarHBondContact O-N 3.37Å; S239-V244 PolarHBondContact OG-O 3.4Å |
| 240 | L | 84.1 | Confident | 83.7 | Confident | 31 Ų | 31 | 54.3 Ų | 54.3 | 16% | 0.162 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -59.7 | -42.7 | 176 | -75.8 | 178.4 | 0 | 0 | 0 | 112.5 | I140 I143 Y236 F237 L238 T242 G243 | I140-L240 HydrophobicContact CG1-CD1 3.81Å; I143-L240 HydrophobicContact CD1-CD1 3.79Å; Y236-L240 HydrophobicContact CD1-CD1 3.85Å; Y236-L240 HydrophobicContact CD1-CG 3.93Å; Y236-L240 HydrophobicContact CE1-CD1 3.57Å; Y236-L240 HydrophobicContact CE1-CD2 3.93Å; Y236-L240 HydrophobicContact CE1-CG 3.54Å; Y236-L240 PolarHBondContact O-N 3.38Å; F237-L240 PolarHBondContact O-N 3.01Å; L238-L240 VanDerWaalsContact C-N 3.32Å; L238-L240 PolarHBondContact O-N 2.88Å; L240-T242 VanDerWaalsContact C-N 3.28Å; L240-T242 PolarHBondContact O-N 3.28Å; L240-G243 PolarHBondContact O-N 3.22Å |
| 241 | Y | 81.3 | Confident | 83.2 | Confident | 61 Ų | 61 | 58.1 Ų | 58.1 | 24% | 0.239 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -62.2 | -37.2 | 176.1 | 171.3 | -103.6 | 0 | 0 | 0 | 112.2 | F125 I128 A182 L185 F237 L238 S239 G243 | F125-Y241 HydrophobicContact CE2-CD2 4.49Å; I128-Y241 HydrophobicContact CG2-CE2 3.93Å; A182-Y241 HydrophobicContact CB-CE2 4.49Å; L185-Y241 HydrophobicContact CD1-CE1 4.12Å; F237-Y241 PolarHBondContact O-N 3.32Å; L238-Y241 HydrophobicContact CD1-CD1 4.29Å; L238-Y241 WeakPolarHBondContact O-CB 3.28Å; L238-Y241 PolarHBondContact O-N 3.11Å; L238-Y241 VanDerWaalsContact O-N 3.16Å; S239-Y241 VanDerWaalsContact C-N 3.34Å; S239-Y241 PolarHBondContact O-N 2.82Å; Y241-G243 VanDerWaalsContact C-N 3.35Å |
| 242 | T | 76.5 | Confident | 82.7 | Confident | 54 Ų | 54 | 56.5 Ų | 56.5 | 33% | 0.331 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -81.2 | -10.1 | 178.9 | 50.1 | 0 | 0 | 0 | 0 | 114.6 | K199 L238 S239 L240 V244 | K199-T242 HydrophobicContact CD-CG2 4.21Å; L238-T242 HydrophobicContact CD1-CG2 4.39Å; L238-T242 PolarHBondContact O-N 3.12Å; L238-T242 PolarHBondContact O-OG1 2.94Å; L238-T242 VanDerWaalsContact O-OG1 3.05Å; S239-T242 WeakPolarHBondContact CA-OG1 3.44Å; S239-T242 CarbonylContact O-C 3.47Å; S239-T242 PolarHBondContact O-N 3Å; S239-T242 VanDerWaalsContact O-N 3.14Å; S239-T242 PolarHBondContact O-OG1 3.32Å; L240-T242 VanDerWaalsContact C-N 3.28Å; L240-T242 PolarHBondContact O-N 3.28Å; T242-V244 VanDerWaalsContact C-N 3.29Å; T242-V244 PolarHBondContact O-N 3.34Å; T242-V244 VanDerWaalsContact OG1-CG2 3.31Å; T242-V244 WeakPolarHBondContact OG1-CG2 3.5Å |
| 243 | G | 66 | Low | 82.1 | Confident | 70 Ų | 70 | 54.1 Ų | 54.1 | 72% | 0.722 | 32% | 0.318 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68.8 | 21.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 115.3 | S239 L240 Y241 | S239-G243 PolarHBondContact O-N 3.37Å; L240-G243 PolarHBondContact O-N 3.22Å; Y241-G243 VanDerWaalsContact C-N 3.35Å |
| 244 | V | 48.9 | Very low | 81.1 | Confident | 168 Ų | 168 | 57.5 Ų | 57.5 | 100% | 1.018 | 34% | 0.339 | S | S | * | . | trans | -104.2 | 0 | 176.4 | -113.6 | 0 | 0 | 0 | 0 | 111.3 | S239 T242 | S239-V244 PolarHBondContact OG-O 3.4Å; T242-V244 VanDerWaalsContact C-N 3.29Å; T242-V244 PolarHBondContact O-N 3.34Å; T242-V244 VanDerWaalsContact OG1-CG2 3.31Å; T242-V244 WeakPolarHBondContact OG1-CG2 3.5Å |
Retrieved 244 of 244 residues in 322.6 ms
(Link to these results)