| 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 | 37.2 | Very low | 42.8 | Very low | 239 Ų | 239 | 154.9 Ų | 154.9 | 100% | 1.177 | 82% | 0.821 | S | S | * | * | 0 | 101.7 | 0 | -77.7 | 171.7 | 173.3 | 0 | 0 | 106.4 | |||||
| 2 | S | 41.6 | Very low | 43.2 | Very low | 104 Ų | 104 | 157.9 Ų | 157.9 | 73% | 0.727 | 83% | 0.827 | S | S | * | * | 79.6 | 127.6 | 95.4 | -172.3 | 0 | 0 | 0 | 0 | 110.2 | |||||
| 3 | K | 38.6 | Very low | 43.4 | Very low | 190 Ų | 190 | 158.2 Ų | 158.2 | 83% | 0.826 | 83% | 0.829 | S | S | * | * | cis | -167 | 154.1 | 1.9 | -114 | 171.8 | -175.5 | 177.7 | 0 | 105.9 | ||||
| 4 | Y | 42.3 | Very low | 43.8 | Very low | 212 Ų | 212 | 159.9 Ų | 159.9 | 83% | 0.831 | 83% | 0.831 | S | S | * | * | trans | -26.9 | 140.2 | 164.5 | -77.7 | -102.3 | 0 | 0 | 0 | 117.5 | ||||
| 5 | T | 45.7 | Very low | 44.2 | Very low | 130 Ų | 130 | 155.3 Ų | 155.3 | 80% | 0.798 | 81% | 0.808 | S | S | * | * | -155.5 | 105.9 | 122.7 | 13.1 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 6 | S | 42.4 | Very low | 44.6 | Very low | 101 Ų | 101 | 152.9 Ų | 152.9 | 71% | 0.706 | 81% | 0.805 | S | S | * | * | trans | -66.6 | 137 | 165.6 | 47.7 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 7 | F | 39.6 | Very low | 44.5 | Very low | 188 Ų | 188 | 155 Ų | 155 | 83% | 0.825 | 81% | 0.806 | S | S | * | * | trans | -122.4 | 149.4 | 158 | -87.8 | -88.7 | 0 | 0 | 0 | 109.2 | ||||
| 8 | P | 45.1 | Very low | 44.8 | Very low | 114 Ų | 114 | 154.6 Ų | 154.6 | 74% | 0.74 | 80% | 0.8 | S | S | * | * | trans | -81.3 | 154.1 | -149.6 | -1.7 | 18.4 | 0 | 0 | 0 | 113.4 | ||||
| 9 | E | 49.8 | Very low | 44.8 | Very low | 179 Ų | 179 | 151.9 Ų | 151.9 | 84% | 0.836 | 79% | 0.787 | S | S | * | * | trans | -47.6 | 139.9 | 160.5 | -108.6 | 169.7 | 128.4 | 0 | 0 | 110.2 | T11 | E9-T11 PolarHBondContact O-N 3.43Š| ||
| 10 | P | 45.4 | Very low | 45.1 | Very low | 124 Ų | 124 | 149.7 Ų | 149.7 | 81% | 0.805 | 78% | 0.782 | S | S | * | * | trans | -65.1 | 106 | 172.1 | 26.3 | -29.5 | 0 | 0 | 0 | 108.2 | E12 | P10-E12 PolarHBondContact O-N 3.39Š| ||
| 11 | T | 43.7 | Very low | 45.2 | Very low | 123 Ų | 123 | 146.2 Ų | 146.2 | 76% | 0.755 | 78% | 0.776 | S | S | * | * | trans | -48.4 | 129.6 | 161.5 | 38.8 | 0 | 0 | 0 | 0 | 109 | E9 D13 | E9-T11 PolarHBondContact O-N 3.43Å; T11-D13 PolarHBondContact O-N 3.38Å | ||
| 12 | E | 46.8 | Very low | 45.8 | Very low | 191 Ų | 191 | 140.8 Ų | 140.8 | 89% | 0.893 | 76% | 0.755 | S | S | * | * | trans | -44.1 | 112.6 | 170.5 | -68.8 | 175.5 | 137.3 | 0 | 0 | 109.9 | P10 Q14 | P10-E12 PolarHBondContact O-N 3.39Å; E12-Q14 PolarHBondContact O-N 3.48Å | ||
| 13 | D | 46.4 | Very low | 45.9 | Very low | 161 Ų | 161 | 140.6 Ų | 140.6 | 86% | 0.861 | 75% | 0.75 | S | S | * | * | trans | -62.9 | 102.9 | 169.7 | -83.2 | -47.1 | 0 | 0 | 0 | 108 | T11 N15 | T11-D13 PolarHBondContact O-N 3.38Å; D13-N15 PolarHBondContact O-N 3.02Å | ||
| 14 | Q | 48.2 | Very low | 46.1 | Very low | 182 Ų | 182 | 139.9 Ų | 139.9 | 85% | 0.85 | 75% | 0.75 | S | S | * | * | trans | -57.5 | 106 | 174.6 | -163.5 | 162.1 | 26.3 | 0 | 0 | 108.7 | E12 P16 | E12-Q14 PolarHBondContact O-N 3.48Å; Q14-P16 WeakPolarHBondContact O-CD 3.5Å | ||
| 15 | N | 50.4 | Low | 46 | Very low | 91 Ų | 91 | 139 Ų | 139 | 49% | 0.487 | 75% | 0.753 | S | S | . | * | trans | -66.7 | 116 | -175.8 | -153.5 | -16.1 | 0 | 0 | 0 | 108.7 | D13 F17 Q18 | D13-N15 PolarHBondContact O-N 3.02Å; N15-F17 PolarHBondContact O-N 3.34Å; N15-Q18 HydrophobicContact CB-CG 4.19Å; N15-Q18 PolarHBondContact O-N 2.74Å | ||
| 16 | P | 50 | Low | 46 | Very low | 117 Ų | 117 | 137.4 Ų | 137.4 | 76% | 0.76 | 75% | 0.747 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.1 | 6.4 | -169.8 | 28.6 | -34.9 | 0 | 0 | 0 | 114.3 | Q14 | Q14-P16 WeakPolarHBondContact O-CD 3.5Š|
| 17 | F | 43.8 | Very low | 45.9 | Very low | 189 Ų | 189 | 137.9 Ų | 137.9 | 83% | 0.829 | 75% | 0.75 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.7 | 5.4 | 172.4 | -66.4 | -79.2 | 0 | 0 | 0 | 113.5 | N15 D19 | N15-F17 PolarHBondContact O-N 3.34Å; F17-D19 PolarHBondContact O-N 2.72Å |
| 18 | Q | 48.9 | Very low | 45.6 | Very low | 147 Ų | 147 | 136.1 Ų | 136.1 | 69% | 0.687 | 75% | 0.749 | S | S | * | * | trans | -85.7 | 92.2 | 173.1 | -82.3 | 176.3 | -18.2 | 0 | 0 | 110.3 | N15 | N15-Q18 HydrophobicContact CB-CG 4.19Å; N15-Q18 PolarHBondContact O-N 2.74Å | ||
| 19 | D | 45.7 | Very low | 45.6 | Very low | 105 Ų | 105 | 136.7 Ų | 136.7 | 56% | 0.561 | 75% | 0.751 | S | S | * | * | trans | -72.1 | 123.8 | 168.1 | -171.5 | -19.4 | 0 | 0 | 0 | 110 | F17 A21 V22 | F17-D19 PolarHBondContact O-N 2.72Å; D19-A21 PolarHBondContact O-N 2.75Å; D19-A21 VanDerWaalsContact O-N 3.08Å; D19-A21 WeakPolarHBondContact OD1-CB 3.49Å; D19-A21 PolarHBondContact OD1-N 3.38Å; D19-V22 PolarHBondContact O-N 3.19Å | ||
| 20 | P | 49.7 | Very low | 45.2 | Very low | 107 Ų | 107 | 136.6 Ų | 136.6 | 70% | 0.695 | 75% | 0.75 | S | S | * | * | G | 310 helix | trans | -65.8 | -2.5 | 177.6 | 25.5 | -32.8 | 0 | 0 | 0 | 114.8 | V22 | P20-V22 PolarHBondContact O-N 3.03Š|
| 21 | A | 48.7 | Very low | 44.6 | Very low | 77 Ų | 77 | 141 Ų | 141 | 64% | 0.636 | 75% | 0.752 | S | S | * | * | G | 310 helix | trans | -71.2 | -13.3 | 171.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | D19 | D19-A21 PolarHBondContact O-N 2.75Å; D19-A21 VanDerWaalsContact O-N 3.08Å; D19-A21 WeakPolarHBondContact OD1-CB 3.49Å; D19-A21 PolarHBondContact OD1-N 3.38Å |
| 22 | V | 49.7 | Very low | 44.4 | Very low | 124 Ų | 124 | 140 Ų | 140 | 75% | 0.752 | 76% | 0.756 | S | S | * | * | G | 310 helix | trans | -91.8 | -9.1 | -175.6 | -176.4 | 0 | 0 | 0 | 0 | 113.2 | D19 P20 | D19-V22 PolarHBondContact O-N 3.19Å; P20-V22 PolarHBondContact O-N 3.03Å |
| 23 | T | 42.6 | Very low | 44 | Very low | 101 Ų | 101 | 136.6 Ų | 136.6 | 62% | 0.62 | 75% | 0.749 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.4 | 4.3 | -174.5 | -8.9 | 0 | 0 | 0 | 0 | 115.2 | ||
| 24 | Q | 43.9 | Very low | 43.8 | Very low | 175 Ų | 175 | 137.4 Ų | 137.4 | 82% | 0.818 | 75% | 0.752 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.1 | 3.7 | 179.6 | -78.9 | -166 | -8 | 0 | 0 | 115.7 | ||
| 25 | H | 39.7 | Very low | 43.5 | Very low | 194 Ų | 194 | 135.9 Ų | 135.9 | 90% | 0.898 | 75% | 0.75 | S | S | * | * | trans | -126.1 | 64 | 170.7 | -83.2 | -5 | 0 | 0 | 0 | 111.9 | ||||
| 26 | S | 45.1 | Very low | 43.4 | Very low | 96 Ų | 96 | 139.6 Ų | 139.6 | 67% | 0.671 | 77% | 0.769 | S | S | * | * | trans | -134.4 | 67.5 | 163.3 | 55.5 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 27 | S | 41 | Very low | 42.9 | Very low | 111 Ų | 111 | 143.9 Ų | 143.9 | 78% | 0.776 | 77% | 0.772 | S | S | * | * | trans | -160.5 | 71.2 | 152.8 | 46.4 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 28 | N | 33.8 | Very low | 43.2 | Very low | 150 Ų | 150 | 139.5 Ų | 139.5 | 80% | 0.802 | 76% | 0.757 | S | S | * | * | trans | -156.4 | 136.6 | 140.9 | -114.4 | -43.8 | 0 | 0 | 0 | 111.2 | ||||
| 29 | T | 45.1 | Very low | 43 | Very low | 126 Ų | 126 | 136.2 Ų | 136.2 | 77% | 0.773 | 75% | 0.748 | S | S | * | * | trans | -64.1 | 154.8 | -178.5 | -47.7 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 30 | E | 40.4 | Very low | 42.9 | Very low | 177 Ų | 177 | 140 Ų | 140 | 83% | 0.827 | 76% | 0.76 | S | S | * | * | trans | 84.5 | 95.5 | 173.8 | -57.6 | -173.8 | 139.4 | 0 | 0 | 116.9 | ||||
| 31 | Y | 32.7 | Very low | 42.4 | Very low | 217 Ų | 217 | 140.6 Ų | 140.6 | 85% | 0.851 | 76% | 0.757 | S | S | * | * | trans | -120 | 109 | 152 | -79.9 | -77.8 | 0 | 0 | 0 | 110.4 | T33 | Y31-T33 PolarHBondContact O-N 3.39Š| ||
| 32 | A | 39.7 | Very low | 42 | Very low | 101 Ų | 101 | 146.7 Ų | 146.7 | 84% | 0.835 | 77% | 0.769 | S | S | * | * | trans | -63.1 | 113.2 | 156.9 | 0 | 0 | 0 | 0 | 0 | 108.9 | L34 | A32-L34 PolarHBondContact O-N 3.44Š| ||
| 33 | T | 39.7 | Very low | 41.5 | Very low | 120 Ų | 120 | 146.9 Ų | 146.9 | 74% | 0.736 | 77% | 0.773 | S | S | * | * | trans | -82 | 108.6 | 168.6 | 50.2 | 0 | 0 | 0 | 0 | 109.1 | Y31 D35 | Y31-T33 PolarHBondContact O-N 3.39Å; T33-D35 PolarHBondContact O-N 3.4Å | ||
| 34 | L | 40.6 | Very low | 41.2 | Very low | 178 Ų | 178 | 147.3 Ų | 147.3 | 93% | 0.932 | 79% | 0.787 | S | S | * | * | S | Bend | trans | -4.9 | 43.8 | 153 | -144.4 | 89 | 0 | 0 | 0 | 121 | A32 | A32-L34 PolarHBondContact O-N 3.44Š|
| 35 | D | 43.1 | Very low | 40.7 | Very low | 150 Ų | 150 | 142.3 Ų | 142.3 | 80% | 0.802 | 78% | 0.782 | S | S | * | * | trans | -108.8 | 16 | 172.8 | -89.2 | -30.7 | 0 | 0 | 0 | 113.5 | T33 | T33-D35 PolarHBondContact O-N 3.4Š| ||
| 36 | L | 47.2 | Very low | 40.4 | Very low | 170 Ų | 170 | 139.3 Ų | 139.3 | 89% | 0.89 | 78% | 0.778 | S | S | * | * | trans | -128.3 | 57.9 | -171.8 | -136.3 | 81.1 | 0 | 0 | 0 | 114.3 | ||||
| 37 | Y | 40.4 | Very low | 40 | Very low | 207 Ų | 207 | 142.5 Ų | 142.5 | 81% | 0.812 | 79% | 0.788 | S | S | * | * | trans | -149.3 | 84.7 | 151.9 | -160.4 | 80.1 | 0 | 0 | 0 | 111.3 | P39 | Y37-P39 HydrophobicContact CE2-CB 4.17Å; Y37-P39 HydrophobicContact CE2-CG 4.05Å | ||
| 38 | N | 49.2 | Very low | 39.7 | Very low | 96 Ų | 96 | 142 Ų | 142 | 51% | 0.513 | 79% | 0.79 | S | S | . | * | trans | -113.6 | 105.6 | 160.7 | -167.5 | 5.1 | 0 | 0 | 0 | 108.9 | F40 D41 | N38-F40 PolarHBondContact O-N 2.96Å; N38-D41 HydrophobicContact CB-CB 4.47Å; N38-D41 VanDerWaalsContact ND2-CG 3.33Å; N38-D41 PolarHBondContact ND2-OD2 3.45Å; N38-D41 PolarHBondContact O-N 2.95Å | ||
| 39 | P | 44.6 | Very low | 40.2 | Very low | 79 Ų | 79 | 143 Ų | 143 | 51% | 0.513 | 80% | 0.795 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -72.8 | 5.9 | -172.5 | 27.6 | -32.7 | 0 | 0 | 0 | 114.6 | Y37 | Y37-P39 HydrophobicContact CE2-CB 4.17Å; Y37-P39 HydrophobicContact CE2-CG 4.05Å |
| 40 | F | 44.3 | Very low | 39.9 | Very low | 184 Ų | 184 | 145.9 Ų | 145.9 | 81% | 0.807 | 80% | 0.799 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -125.5 | 2.4 | 179.2 | -68.8 | -75.7 | 0 | 0 | 0 | 115.6 | N38 | N38-F40 PolarHBondContact O-N 2.96Š|
| 41 | D | 39.6 | Very low | 40.1 | Very low | 119 Ų | 119 | 142.8 Ų | 142.8 | 64% | 0.636 | 80% | 0.795 | S | S | * | * | trans | -105.3 | 97.6 | 175.9 | -79.6 | -25.4 | 0 | 0 | 0 | 111.6 | N38 | N38-D41 HydrophobicContact CB-CB 4.47Å; N38-D41 VanDerWaalsContact ND2-CG 3.33Å; N38-D41 PolarHBondContact ND2-OD2 3.45Å; N38-D41 PolarHBondContact O-N 2.95Å | ||
| 42 | K | 39.7 | Very low | 40.6 | Very low | 205 Ų | 205 | 138.4 Ų | 138.4 | 89% | 0.891 | 79% | 0.792 | S | S | * | * | trans | -125.8 | 115.9 | 144.5 | -85.6 | -173.1 | 179.3 | 170.6 | 0 | 109.6 | ||||
| 43 | P | 39.8 | Very low | 40.7 | Very low | 129 Ų | 129 | 139 Ų | 139 | 84% | 0.838 | 79% | 0.788 | S | S | * | * | trans | -78.8 | 148.1 | -179.1 | 30.6 | -32.2 | 0 | 0 | 0 | 112 | ||||
| 44 | A | 36.3 | Very low | 40.5 | Very low | 109 Ų | 109 | 139.1 Ų | 139.1 | 90% | 0.901 | 79% | 0.791 | S | S | * | * | trans | -82.6 | 149.3 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 45 | G | 33.1 | Very low | 40.2 | Very low | 70 Ų | 70 | 141.5 Ų | 141.5 | 72% | 0.722 | 79% | 0.789 | S | S | * | * | trans | 156.6 | 116.9 | 159.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 46 | T | 33.6 | Very low | 39.8 | Very low | 132 Ų | 132 | 143.3 Ų | 143.3 | 81% | 0.81 | 79% | 0.793 | S | S | * | * | cis | -161.5 | 149.7 | 24.8 | 37.1 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 47 | N | 36.3 | Very low | 39.3 | Very low | 163 Ų | 163 | 139.9 Ų | 139.9 | 87% | 0.872 | 79% | 0.789 | S | S | * | * | trans | 53.2 | 104.7 | 159.2 | -65.3 | -22.9 | 0 | 0 | 0 | 121.6 | ||||
| 48 | A | 33.8 | Very low | 39 | Very low | 101 Ų | 101 | 136 Ų | 136 | 84% | 0.835 | 79% | 0.792 | S | S | * | * | -179.8 | 141.5 | 118.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 49 | L | 46.1 | Very low | 38.6 | Very low | 170 Ų | 170 | 136.7 Ų | 136.7 | 89% | 0.89 | 80% | 0.804 | S | S | * | * | trans | -57 | 129.9 | 180 | -77.2 | 75.8 | 0 | 0 | 0 | 113 | ||||
| 50 | Q | 37.3 | Very low | 38.4 | Very low | 187 Ų | 187 | 139 Ų | 139 | 87% | 0.874 | 82% | 0.819 | S | S | * | * | trans | -164.1 | 139.6 | 145 | -115.3 | 159.6 | -3.3 | 0 | 0 | 113.2 | ||||
| 51 | P | 44.5 | Very low | 38 | Very low | 112 Ų | 112 | 136 Ų | 136 | 73% | 0.727 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -74.4 | 152.1 | -179.4 | 29.5 | -33 | 0 | 0 | 0 | 112.4 | ||
| 52 | P | 44.2 | Very low | 38.2 | Very low | 124 Ų | 124 | 135.7 Ų | 135.7 | 81% | 0.805 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -73.8 | 144.6 | -178.1 | 29.3 | -33.3 | 0 | 0 | 0 | 112.6 | ||
| 53 | P | 41.4 | Very low | 38.6 | Very low | 115 Ų | 115 | 131.5 Ų | 131.5 | 75% | 0.747 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -80.8 | 163.2 | 177.2 | 33.4 | -32.8 | 0 | 0 | 0 | 112.6 | ||
| 54 | P | 35.6 | Very low | 38.9 | Very low | 122 Ų | 122 | 131.2 Ų | 131.2 | 79% | 0.792 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -74.5 | 149.7 | -168.9 | -6.8 | 24 | 0 | 0 | 0 | 112.8 | ||
| 55 | Y | 33.7 | Very low | 39.3 | Very low | 227 Ų | 227 | 131.6 Ų | 131.6 | 89% | 0.89 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -72 | 123.5 | 169.9 | 48.8 | -87.9 | 0 | 0 | 0 | 110.4 | ||
| 56 | E | 35 | Very low | 39.5 | Very low | 189 Ų | 189 | 133.3 Ų | 133.3 | 88% | 0.883 | 82% | 0.821 | S | S | * | * | trans | -108.8 | 115 | 168 | -131 | 174.1 | -170.5 | 0 | 0 | 108.1 | ||||
| 57 | A | 37.2 | Very low | 39.8 | Very low | 98 Ų | 98 | 136 Ų | 136 | 81% | 0.81 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -78.2 | 125.9 | -178.7 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||
| 58 | S | 33.2 | Very low | 39.9 | Very low | 124 Ų | 124 | 134.7 Ų | 134.7 | 87% | 0.867 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -97 | 130.6 | 172 | -9.6 | 0 | 0 | 0 | 0 | 111 | ||
| 59 | S | 41.2 | Very low | 40.7 | Very low | 111 Ų | 111 | 135.5 Ų | 135.5 | 78% | 0.776 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -73.3 | 164.2 | -174.5 | -23.9 | 0 | 0 | 0 | 0 | 114.2 | ||
| 60 | P | 41.4 | Very low | 40.6 | Very low | 128 Ų | 128 | 133.7 Ų | 133.7 | 83% | 0.831 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -78.8 | 138.7 | -175.5 | 31.7 | -32 | 0 | 0 | 0 | 112.8 | ||
| 61 | S | 35.5 | Very low | 40.4 | Very low | 121 Ų | 121 | 130.5 Ų | 130.5 | 85% | 0.846 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -97.8 | 134.5 | 178.1 | 55.8 | 0 | 0 | 0 | 0 | 113.3 | ||
| 62 | S | 43.1 | Very low | 39.9 | Very low | 112 Ų | 112 | 135.5 Ų | 135.5 | 78% | 0.783 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 164.2 | -174.8 | -20.6 | 0 | 0 | 0 | 0 | 115.5 | ||
| 63 | P | 47.8 | Very low | 39.6 | Very low | 118 Ų | 118 | 136.3 Ų | 136.3 | 77% | 0.766 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -81.2 | 156.4 | 179.5 | 31.8 | -32.2 | 0 | 0 | 0 | 114 | ||
| 64 | P | 46.7 | Very low | 39.4 | Very low | 123 Ų | 123 | 136.1 Ų | 136.1 | 80% | 0.799 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -79.3 | 158 | -172 | 30.2 | -33.6 | 0 | 0 | 0 | 114.8 | ||
| 65 | P | 43.9 | Very low | 39.6 | Very low | 117 Ų | 117 | 136.2 Ų | 136.2 | 76% | 0.76 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -89.5 | 156.7 | -167 | 34.6 | -35.4 | 0 | 0 | 0 | 115.5 | ||
| 66 | A | 38.5 | Very low | 39.7 | Very low | 105 Ų | 105 | 131.5 Ų | 131.5 | 87% | 0.868 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 139 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||
| 67 | Q | 39.3 | Very low | 39.7 | Very low | 188 Ų | 188 | 130.6 Ų | 130.6 | 88% | 0.879 | 81% | 0.811 | S | S | * | * | trans | -118.5 | 132.7 | 169.8 | -69.4 | -175.9 | 17.9 | 0 | 0 | 110.9 | ||||
| 68 | T | 38.6 | Very low | 40 | Very low | 137 Ų | 137 | 131 Ų | 131 | 84% | 0.84 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -85 | 146.1 | 178.8 | 35.9 | 0 | 0 | 0 | 0 | 112 | ||
| 69 | P | 49.9 | Very low | 40.5 | Very low | 118 Ų | 118 | 136.1 Ų | 136.1 | 77% | 0.766 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -92.2 | 148.7 | 167 | 31.6 | -29.2 | 0 | 0 | 0 | 113.1 | ||
| 70 | P | 45.2 | Very low | 40.2 | Very low | 132 Ų | 132 | 138.5 Ų | 138.5 | 86% | 0.857 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -87.7 | 166.5 | 179.4 | 35.1 | -33.6 | 0 | 0 | 0 | 114.3 | ||
| 71 | S | 33.4 | Very low | 40.2 | Very low | 120 Ų | 120 | 142.1 Ų | 142.1 | 84% | 0.839 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -97.5 | 142.8 | -165.3 | -91.4 | 0 | 0 | 0 | 0 | 116.7 | ||
| 72 | R | 33.8 | Very low | 40.1 | Very low | 216 Ų | 216 | 139.7 Ų | 139.7 | 82% | 0.815 | 80% | 0.803 | S | S | * | * | trans | 74.5 | 123.1 | 133.3 | -158.9 | -178.8 | -148 | -172.2 | 7 | 122 | ||||
| 73 | T | 36.9 | Very low | 40.4 | Very low | 142 Ų | 142 | 138.9 Ų | 138.9 | 87% | 0.871 | 80% | 0.797 | S | S | * | * | -155.2 | 129 | 121.9 | 46.8 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 74 | T | 37.8 | Very low | 40 | Very low | 111 Ų | 111 | 144 Ų | 144 | 68% | 0.681 | 80% | 0.802 | S | S | * | * | trans | -77.5 | 161.1 | 172.9 | 38 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 75 | P | 39.3 | Very low | 40 | Very low | 124 Ų | 124 | 145.8 Ų | 145.8 | 81% | 0.805 | 81% | 0.805 | S | S | * | * | -129 | 143.7 | 106.7 | 6.2 | 15.4 | 0 | 0 | 0 | 115.7 | |||||
| 76 | T | 36.9 | Very low | 40.3 | Very low | 127 Ų | 127 | 144.7 Ų | 144.7 | 78% | 0.779 | 81% | 0.806 | S | S | * | * | trans | -23.2 | 145.2 | 158.9 | -12.8 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 77 | E | 34.5 | Very low | 41 | Very low | 171 Ų | 171 | 147.6 Ų | 147.6 | 80% | 0.799 | 80% | 0.802 | S | S | * | * | cis | -178.7 | -179.6 | 29.5 | -148.1 | -163.7 | 137.8 | 0 | 0 | 107 | ||||
| 78 | P | 43.2 | Very low | 41.5 | Very low | 107 Ų | 107 | 143 Ų | 143 | 70% | 0.695 | 79% | 0.788 | S | S | * | * | cis | -115.4 | 165.3 | -29.7 | 19.4 | 3.7 | 0 | 0 | 0 | 114 | ||||
| 79 | R | 43.5 | Very low | 42.2 | Very low | 231 Ų | 231 | 140 Ų | 140 | 87% | 0.872 | 78% | 0.777 | S | S | * | * | trans | -54.2 | 134.8 | 169.6 | -107.8 | 174.8 | 164.5 | 161 | -4.6 | 113 | ||||
| 80 | N | 34.3 | Very low | 42.4 | Very low | 161 Ų | 161 | 138.8 Ų | 138.8 | 86% | 0.861 | 77% | 0.768 | S | S | * | * | trans | -127.6 | 134.2 | 144.4 | -161.2 | -8.7 | 0 | 0 | 0 | 109.3 | ||||
| 81 | Y | 41.9 | Very low | 42.8 | Very low | 204 Ų | 204 | 137.6 Ų | 137.6 | 80% | 0.8 | 75% | 0.754 | S | S | * | * | trans | -79.7 | 119.5 | -168.3 | -144.1 | -98.6 | 0 | 0 | 0 | 109.4 | ||||
| 82 | G | 34.3 | Very low | 43.9 | Very low | 70 Ų | 70 | 134.5 Ų | 134.5 | 72% | 0.722 | 74% | 0.736 | S | S | * | * | trans | -149.3 | 84.7 | 178.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | Y84 | G82-Y84 PolarHBondContact O-N 3.42Š| ||
| 83 | S | 48.3 | Very low | 45.3 | Very low | 94 Ų | 94 | 127.7 Ų | 127.7 | 66% | 0.657 | 72% | 0.718 | S | S | * | * | trans | -68.2 | 114.2 | 172.6 | 156.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 84 | Y | 39.3 | Very low | 46.7 | Very low | 225 Ų | 225 | 124 Ų | 124 | 88% | 0.882 | 70% | 0.696 | S | S | * | * | trans | -148.1 | 118.8 | 151 | -77.5 | -72.1 | 0 | 0 | 0 | 111.5 | G82 A86 | G82-Y84 PolarHBondContact O-N 3.42Å; Y84-A86 PolarHBondContact O-N 2.92Å | ||
| 85 | N | 48.3 | Very low | 48.5 | Very low | 161 Ų | 161 | 121.6 Ų | 121.6 | 86% | 0.861 | 69% | 0.687 | S | S | * | * | trans | -56.3 | 118.7 | 164.4 | -78.6 | -49.3 | 0 | 0 | 0 | 110.1 | ||||
| 86 | A | 49.6 | Very low | 50.3 | Low | 94 Ų | 94 | 122.2 Ų | 122.2 | 78% | 0.777 | 68% | 0.679 | S | S | * | * | trans | -105.8 | 73.2 | 166.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | Y84 | Y84-A86 PolarHBondContact O-N 2.92Š| ||
| 87 | Q | 52 | Low | 51.9 | Low | 166 Ų | 166 | 121.5 Ų | 121.5 | 78% | 0.776 | 67% | 0.67 | S | S | * | * | trans | -134.6 | 79 | 156.4 | -78.7 | -157.8 | -28.7 | 0 | 0 | 111.6 | ||||
| 88 | P | 50.8 | Low | 54 | Low | 91 Ų | 91 | 118.8 Ų | 118.8 | 59% | 0.591 | 66% | 0.66 | S | S | * | * | S | Bend | trans | -122.4 | -17.4 | 156.2 | 5 | 17.4 | 0 | 0 | 0 | 113.8 | A92 | P88-A92 PolarHBondContact O-N 3.42Š|
| 89 | A | 53.2 | Low | 56 | Low | 75 Ų | 75 | 121 Ų | 121 | 62% | 0.62 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -74.7 | -30.7 | -168.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | T93 | A89-T93 PolarHBondContact O-N 3.01Å; A89-T93 PolarHBondContact O-OG1 3.05Å |
| 90 | V | 53.6 | Low | 58 | Low | 92 Ų | 92 | 116.8 Ų | 116.8 | 56% | 0.558 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -76.8 | -34.2 | -178.6 | -162 | 0 | 0 | 0 | 0 | 111.5 | T93 T94 | V90-T93 WeakPolarHBondContact CA-OG1 3.17Å; V90-T93 PolarHBondContact O-N 3.29Å; V90-T93 PolarHBondContact O-OG1 3.32Å; V90-T94 WeakPolarHBondContact O-CG2 3.35Å; V90-T94 PolarHBondContact O-N 3.02Å; V90-T94 PolarHBondContact O-OG1 3.08Å |
| 91 | N | 53.7 | Low | 60.3 | Low | 108 Ų | 108 | 114.5 Ų | 114.5 | 58% | 0.578 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -73.8 | -32.2 | 180 | -66.4 | -11 | 0 | 0 | 0 | 112.4 | T94 A95 | N91-T94 WeakPolarHBondContact CA-OG1 3.27Å; N91-T94 PolarHBondContact O-OG1 3.38Å; N91-T94 VanDerWaalsContact O-OG1 3.05Å; N91-A95 VanDerWaalsContact O-CB 3.27Å; N91-A95 WeakPolarHBondContact O-CB 3.41Å; N91-A95 PolarHBondContact O-N 2.93Å |
| 92 | A | 56.5 | Low | 62.4 | Low | 55 Ų | 55 | 111.5 Ų | 111.5 | 46% | 0.455 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -65.7 | -41.8 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | P88 A95 E96 | P88-A92 PolarHBondContact O-N 3.42Å; A92-A95 PolarHBondContact O-N 2.99Å; A92-E96 WeakPolarHBondContact O-CB 3.47Å; A92-E96 WeakPolarHBondContact O-CG 3.27Å; A92-E96 PolarHBondContact O-N 3.47Å |
| 93 | T | 63.1 | Low | 64.9 | Low | 72 Ų | 72 | 112.7 Ų | 112.7 | 44% | 0.442 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -69.5 | -36.2 | 177.5 | 53.2 | 0 | 0 | 0 | 0 | 113.3 | A89 V90 L97 | A89-T93 PolarHBondContact O-N 3.01Å; A89-T93 PolarHBondContact O-OG1 3.05Å; V90-T93 WeakPolarHBondContact CA-OG1 3.17Å; V90-T93 PolarHBondContact O-N 3.29Å; V90-T93 PolarHBondContact O-OG1 3.32Å; T93-L97 WeakPolarHBondContact O-CB 3.44Å; T93-L97 WeakPolarHBondContact O-CG 3.38Å; T93-L97 PolarHBondContact O-N 3.21Å |
| 94 | T | 66.3 | Low | 66.4 | Low | 65 Ų | 65 | 113.9 Ų | 113.9 | 40% | 0.399 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -71 | -37.3 | 175.3 | 49.9 | 0 | 0 | 0 | 0 | 111.8 | V90 N91 L97 L98 | V90-T94 WeakPolarHBondContact O-CG2 3.35Å; V90-T94 PolarHBondContact O-N 3.02Å; V90-T94 PolarHBondContact O-OG1 3.08Å; N91-T94 WeakPolarHBondContact CA-OG1 3.27Å; N91-T94 PolarHBondContact O-OG1 3.38Å; N91-T94 VanDerWaalsContact O-OG1 3.05Å; T94-L97 PolarHBondContact O-N 3.46Å; T94-L98 WeakPolarHBondContact O-CB 3.41Å; T94-L98 VanDerWaalsContact O-CG 3.27Å; T94-L98 WeakPolarHBondContact O-CG 3.34Å; T94-L98 PolarHBondContact O-N 3.04Å |
| 95 | A | 75.6 | Confident | 68.7 | Low | 60 Ų | 60 | 108.6 Ų | 108.6 | 50% | 0.496 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -65.5 | -40.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | N91 A92 K99 | N91-A95 VanDerWaalsContact O-CB 3.27Å; N91-A95 WeakPolarHBondContact O-CB 3.41Å; N91-A95 PolarHBondContact O-N 2.93Å; A92-A95 PolarHBondContact O-N 2.99Å; A95-K99 WeakPolarHBondContact O-CB 3.35Å; A95-K99 PolarHBondContact O-N 2.99Å |
| 96 | E | 76.6 | Confident | 70.7 | Confident | 138 Ų | 138 | 109.3 Ų | 109.3 | 65% | 0.645 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -67.3 | -37.5 | 174.6 | -77.1 | -173.9 | 165.3 | 0 | 0 | 112.8 | A92 K99 K100 | A92-E96 WeakPolarHBondContact O-CB 3.47Å; A92-E96 WeakPolarHBondContact O-CG 3.27Å; A92-E96 PolarHBondContact O-N 3.47Å; E96-K99 PolarHBondContact O-N 3.21Å; E96-K100 PolarHBondContact O-N 2.89Å |
| 97 | L | 71.8 | Confident | 72.6 | Confident | 112 Ų | 112 | 110.2 Ų | 110.2 | 59% | 0.586 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -67 | -43.5 | 175.4 | -75.1 | 170.8 | 0 | 0 | 0 | 112 | T93 T94 K99 K100 Q101 | T93-L97 WeakPolarHBondContact O-CB 3.44Å; T93-L97 WeakPolarHBondContact O-CG 3.38Å; T93-L97 PolarHBondContact O-N 3.21Å; T94-L97 PolarHBondContact O-N 3.46Å; L97-K99 VanDerWaalsContact C-N 3.32Å; L97-K99 PolarHBondContact O-N 2.98Å; L97-K100 PolarHBondContact O-N 3.48Å; L97-Q101 WeakPolarHBondContact O-CB 3.39Å; L97-Q101 PolarHBondContact O-N 3.15Å |
| 98 | L | 79.1 | Confident | 74.1 | Confident | 114 Ų | 114 | 105 Ų | 105 | 60% | 0.597 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -61.4 | -41.7 | 175.1 | -75.5 | 169.7 | 0 | 0 | 0 | 111.4 | T94 K100 Q101 E102 | T94-L98 WeakPolarHBondContact O-CB 3.41Å; T94-L98 VanDerWaalsContact O-CG 3.27Å; T94-L98 WeakPolarHBondContact O-CG 3.34Å; T94-L98 PolarHBondContact O-N 3.04Å; L98-K100 PolarHBondContact O-N 3.48Å; L98-Q101 PolarHBondContact O-N 3.18Å; L98-E102 PolarHBondContact O-N 3.03Å |
| 99 | K | 85.4 | Confident | 75.8 | Confident | 154 Ų | 154 | 106.9 Ų | 106.9 | 67% | 0.67 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -64.9 | -38 | 176.3 | -165.8 | 177.9 | -177.4 | 179.8 | 0 | 112.5 | A95 E96 L97 E103 | A95-K99 WeakPolarHBondContact O-CB 3.35Å; A95-K99 PolarHBondContact O-N 2.99Å; E96-K99 PolarHBondContact O-N 3.21Å; L97-K99 VanDerWaalsContact C-N 3.32Å; L97-K99 PolarHBondContact O-N 2.98Å; K99-E103 PolarHBondContact O-N 3.43Å |
| 100 | K | 85.3 | Confident | 77.4 | Confident | 141 Ų | 141 | 107.1 Ų | 107.1 | 61% | 0.613 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -67.8 | -36.4 | 172.8 | -85.2 | -168.4 | 177.1 | 174.5 | 0 | 112.6 | E96 L97 L98 E103 L104 | E96-K100 PolarHBondContact O-N 2.89Å; L97-K100 PolarHBondContact O-N 3.48Å; L98-K100 PolarHBondContact O-N 3.48Å; K100-E103 PolarHBondContact O-N 2.93Å; K100-L104 WeakPolarHBondContact O-CB 3.46Å; K100-L104 VanDerWaalsContact O-CG 3.29Å; K100-L104 WeakPolarHBondContact O-CG 3.38Å; K100-L104 PolarHBondContact O-N 3.44Å |
| 101 | Q | 81.2 | Confident | 78.7 | Confident | 113 Ų | 113 | 107.7 Ų | 107.7 | 53% | 0.528 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -66 | -42.2 | 177.9 | -169.3 | 159.8 | -9.4 | 0 | 0 | 111.2 | L97 L98 L104 E105 | L97-Q101 WeakPolarHBondContact O-CB 3.39Å; L97-Q101 PolarHBondContact O-N 3.15Å; L98-Q101 PolarHBondContact O-N 3.18Å; Q101-L104 PolarHBondContact O-N 3.08Å; Q101-E105 PolarHBondContact O-N 2.99Å |
| 102 | E | 87.2 | Confident | 80.3 | Confident | 141 Ų | 141 | 107.4 Ų | 107.4 | 66% | 0.659 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -63.2 | -40.5 | 173 | -170.3 | -179.3 | 179.1 | 0 | 0 | 112.2 | L98 E105 R106 | L98-E102 PolarHBondContact O-N 3.03Å; E102-E105 PolarHBondContact O-N 3.25Å; E102-R106 PolarHBondContact O-N 3.31Å |
| 103 | E | 86.5 | Confident | 81.7 | Confident | 96 Ų | 96 | 112 Ų | 112 | 45% | 0.449 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -66.3 | -37.7 | 176 | -164.6 | -170.9 | 152.2 | 0 | 0 | 112.4 | K99 K100 R106 K107 | K99-E103 PolarHBondContact O-N 3.43Å; K100-E103 PolarHBondContact O-N 2.93Å; E103-R106 PolarHBondContact O-N 3.18Å; E103-K107 PolarHBondContact O-N 2.93Å; E103-K107 WeakPolarHBondContact OE1-CE 3.21Å; E103-K107 IonicContact OE1-NZ 2.74Å; E103-K107 PolarHBondContact OE1-NZ 3.43Å |
| 104 | L | 80.4 | Confident | 82.5 | Confident | 118 Ų | 118 | 115.6 Ų | 115.6 | 62% | 0.618 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -67.6 | -43.1 | 176.6 | -76.2 | 172.5 | 0 | 0 | 0 | 111.7 | K100 Q101 R106 K107 A108 | K100-L104 WeakPolarHBondContact O-CB 3.46Å; K100-L104 VanDerWaalsContact O-CG 3.29Å; K100-L104 WeakPolarHBondContact O-CG 3.38Å; K100-L104 PolarHBondContact O-N 3.44Å; Q101-L104 PolarHBondContact O-N 3.08Å; L104-R106 VanDerWaalsContact C-N 3.3Å; L104-R106 PolarHBondContact O-N 2.98Å; L104-K107 PolarHBondContact O-N 3.48Å; L104-A108 WeakPolarHBondContact O-CB 3.46Å; L104-A108 PolarHBondContact O-N 3.28Å |
| 105 | E | 87.4 | Confident | 83.1 | Confident | 114 Ų | 114 | 117.9 Ų | 117.9 | 53% | 0.533 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -61.8 | -39.9 | 174.9 | -78.2 | -177.3 | 178.1 | 0 | 0 | 111.5 | Q101 E102 K107 A108 Q109 | Q101-E105 PolarHBondContact O-N 2.99Å; E102-E105 PolarHBondContact O-N 3.25Å; E105-K107 PolarHBondContact O-N 3.36Å; E105-A108 PolarHBondContact O-N 2.94Å; E105-Q109 WeakPolarHBondContact O-CG 3.38Å; E105-Q109 PolarHBondContact O-N 3.1Å |
| 106 | R | 90.4 | Very high | 83.2 | Confident | 177 Ų | 177 | 122.6 Ų | 122.6 | 67% | 0.668 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -62.6 | -43 | 174.9 | -157.4 | -176.3 | 93.7 | 179.9 | 6.5 | 112.2 | E102 E103 L104 E110 | E102-R106 PolarHBondContact O-N 3.31Å; E103-R106 PolarHBondContact O-N 3.18Å; L104-R106 VanDerWaalsContact C-N 3.3Å; L104-R106 PolarHBondContact O-N 2.98Å; R106-E110 PolarHBondContact O-N 3.5Å; R106-E110 VanDerWaalsContact O-N 3.11Å |
| 107 | K | 88.6 | Confident | 83.1 | Confident | 112 Ų | 112 | 120 Ų | 120 | 49% | 0.487 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -67.5 | -37.1 | 176.1 | -77.2 | 179.6 | -173.5 | 159 | 0 | 112.1 | E103 L104 E105 E110 L111 | E103-K107 PolarHBondContact O-N 2.93Å; E103-K107 WeakPolarHBondContact OE1-CE 3.21Å; E103-K107 IonicContact OE1-NZ 2.74Å; E103-K107 PolarHBondContact OE1-NZ 3.43Å; L104-K107 PolarHBondContact O-N 3.48Å; E105-K107 PolarHBondContact O-N 3.36Å; K107-E110 PolarHBondContact O-N 3.48Å; K107-L111 WeakPolarHBondContact O-CB 3.44Å; K107-L111 PolarHBondContact O-N 3.24Å |
| 108 | A | 83.7 | Confident | 82.8 | Confident | 56 Ų | 56 | 120.3 Ų | 120.3 | 46% | 0.463 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -64.7 | -43.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | L104 E105 E110 L111 E112 | L104-A108 WeakPolarHBondContact O-CB 3.46Å; L104-A108 PolarHBondContact O-N 3.28Å; E105-A108 PolarHBondContact O-N 2.94Å; A108-E110 VanDerWaalsContact C-N 3.35Å; A108-E110 PolarHBondContact O-N 2.96Å; A108-L111 PolarHBondContact O-N 2.53Å; A108-E112 WeakPolarHBondContact O-CB 3.37Å; A108-E112 PolarHBondContact O-N 2.66Å |
| 109 | Q | 86.3 | Confident | 82.1 | Confident | 132 Ų | 132 | 120.1 Ų | 120.1 | 62% | 0.617 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -65.3 | -37 | 176.1 | -73.3 | 179 | -2.6 | 0 | 0 | 112.7 | E105 E112 R113 | E105-Q109 WeakPolarHBondContact O-CG 3.38Å; E105-Q109 PolarHBondContact O-N 3.1Å; Q109-E112 PolarHBondContact O-N 3.47Å; Q109-R113 WeakPolarHBondContact O-CB 3.49Å; Q109-R113 PolarHBondContact O-N 2.84Å |
| 110 | E | 85.9 | Confident | 80.7 | Confident | 79 Ų | 79 | 116 Ų | 116 | 37% | 0.369 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -71.9 | -36.6 | 176.8 | -171 | 157.6 | -172.3 | 0 | 0 | 112.3 | R106 K107 A108 R113 R114 | R106-E110 PolarHBondContact O-N 3.5Å; R106-E110 VanDerWaalsContact O-N 3.11Å; K107-E110 PolarHBondContact O-N 3.48Å; A108-E110 VanDerWaalsContact C-N 3.35Å; A108-E110 PolarHBondContact O-N 2.96Å; E110-R113 PolarHBondContact O-N 3.16Å; E110-R114 WeakPolarHBondContact O-CG 3.29Å; E110-R114 PolarHBondContact O-N 3.24Å; E110-R114 IonicContact OE1-NH2 3.91Å |
| 111 | L | 81.9 | Confident | 79.3 | Confident | 105 Ų | 105 | 117.2 Ų | 117.2 | 55% | 0.55 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -62.4 | -46.7 | 169.4 | -99 | 150.8 | 0 | 0 | 0 | 111.3 | K107 A108 R113 R114 E115 | K107-L111 WeakPolarHBondContact O-CB 3.44Å; K107-L111 PolarHBondContact O-N 3.24Å; A108-L111 PolarHBondContact O-N 2.53Å; L111-R113 VanDerWaalsContact C-N 3.29Å; L111-R113 PolarHBondContact O-N 3.15Å; L111-R114 CarbonylContact O-C 3.58Å; L111-R114 PolarHBondContact O-N 3.45Å; L111-E115 WeakPolarHBondContact O-CB 3.22Å; L111-E115 WeakPolarHBondContact O-CG 3.42Å; L111-E115 PolarHBondContact O-N 3.06Å |
| 112 | E | 87 | Confident | 78 | Confident | 102 Ų | 102 | 116.1 Ų | 116.1 | 48% | 0.477 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -63.7 | -36.5 | 177.8 | -166.7 | -173.3 | 169.8 | 0 | 0 | 111.3 | A108 Q109 E115 R116 | A108-E112 WeakPolarHBondContact O-CB 3.37Å; A108-E112 PolarHBondContact O-N 2.66Å; Q109-E112 PolarHBondContact O-N 3.47Å; E112-E115 PolarHBondContact O-N 3.02Å; E112-R116 WeakPolarHBondContact O-CB 3.11Å; E112-R116 PolarHBondContact O-N 3.48Å; E112-R116 IonicContact OE1-CZ 2.77Å; E112-R116 IonicContact OE1-NH2 2.72Å; E112-R116 PolarHBondContact OE1-NH2 2.95Å |
| 113 | R | 85.6 | Confident | 76.4 | Confident | 150 Ų | 150 | 115.8 Ų | 115.8 | 57% | 0.566 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -65 | -45.6 | 173.4 | -159.9 | -175.2 | 96.1 | -160.7 | 1.4 | 111.2 | Q109 E110 L111 R116 E117 | Q109-R113 WeakPolarHBondContact O-CB 3.49Å; Q109-R113 PolarHBondContact O-N 2.84Å; E110-R113 PolarHBondContact O-N 3.16Å; L111-R113 VanDerWaalsContact C-N 3.29Å; L111-R113 PolarHBondContact O-N 3.15Å; R113-R116 CarbonylContact O-C 3.56Å; R113-R116 PolarHBondContact O-N 2.85Å; R113-E117 IonicContact CZ-OE1 3.72Å; R113-E117 IonicContact NE-OE1 3.43Å; R113-E117 PolarHBondContact NE-OE1 2.6Å; R113-E117 IonicContact NH2-OE1 2.84Å; R113-E117 WeakPolarHBondContact O-CB 3.38Å; R113-E117 VanDerWaalsContact O-CG 3.23Å; R113-E117 WeakPolarHBondContact O-CG 3.3Å; R113-E117 PolarHBondContact O-N 2.76Å |
| 114 | R | 80.9 | Confident | 74.2 | Confident | 148 Ų | 148 | 112.6 Ų | 112.6 | 56% | 0.558 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -65.9 | -36.5 | 175.8 | -76.3 | -171.7 | -171.3 | 170.8 | 7 | 112.5 | E110 L111 E117 L118 | E110-R114 WeakPolarHBondContact O-CG 3.29Å; E110-R114 PolarHBondContact O-N 3.24Å; E110-R114 IonicContact OE1-NH2 3.91Å; L111-R114 CarbonylContact O-C 3.58Å; L111-R114 PolarHBondContact O-N 3.45Å; R114-E117 PolarHBondContact O-N 3.31Å; R114-L118 VanDerWaalsContact O-CB 3.25Å; R114-L118 WeakPolarHBondContact O-CB 3.44Å; R114-L118 VanDerWaalsContact O-CG 3.3Å; R114-L118 WeakPolarHBondContact O-CG 3.37Å; R114-L118 PolarHBondContact O-N 2.87Å |
| 115 | E | 78.3 | Confident | 72.7 | Confident | 113 Ų | 113 | 113.7 Ų | 113.7 | 53% | 0.528 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -68.5 | -37.8 | 174 | -79.9 | -170.9 | 166.6 | 0 | 0 | 110.9 | L111 E112 L118 Q119 | L111-E115 WeakPolarHBondContact O-CB 3.22Å; L111-E115 WeakPolarHBondContact O-CG 3.42Å; L111-E115 PolarHBondContact O-N 3.06Å; E112-E115 PolarHBondContact O-N 3.02Å; E115-L118 CarbonylContact O-C 3.6Å; E115-L118 PolarHBondContact O-N 3.28Å; E115-Q119 WeakPolarHBondContact O-CA 3.33Å; E115-Q119 WeakPolarHBondContact O-CB 3.44Å; E115-Q119 WeakPolarHBondContact O-CG 3.45Å; E115-Q119 PolarHBondContact O-N 2.7Å |
| 116 | R | 77.5 | Confident | 70.9 | Confident | 159 Ų | 159 | 112 Ų | 112 | 60% | 0.6 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -71.7 | -31.5 | 174.3 | -166.2 | 176 | -69 | 165.9 | 3.3 | 111.9 | E112 R113 S120 | E112-R116 WeakPolarHBondContact O-CB 3.11Å; E112-R116 PolarHBondContact O-N 3.48Å; E112-R116 IonicContact OE1-CZ 2.77Å; E112-R116 IonicContact OE1-NH2 2.72Å; E112-R116 PolarHBondContact OE1-NH2 2.95Å; R113-R116 CarbonylContact O-C 3.56Å; R113-R116 PolarHBondContact O-N 2.85Å; R116-S120 WeakPolarHBondContact O-CB 3.4Å; R116-S120 PolarHBondContact O-N 3.36Å; R116-S120 PolarHBondContact O-OG 3.45Å; R116-S120 VanDerWaalsContact O-OG 3.06Å |
| 117 | E | 75.8 | Confident | 68.8 | Low | 83 Ų | 83 | 107.7 Ų | 107.7 | 39% | 0.388 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -71.1 | -41.9 | 170.4 | -74.3 | 168.7 | -165 | 0 | 0 | 111.2 | R113 R114 S120 H121 | R113-E117 IonicContact CZ-OE1 3.72Å; R113-E117 IonicContact NE-OE1 3.43Å; R113-E117 PolarHBondContact NE-OE1 2.6Å; R113-E117 IonicContact NH2-OE1 2.84Å; R113-E117 WeakPolarHBondContact O-CB 3.38Å; R113-E117 VanDerWaalsContact O-CG 3.23Å; R113-E117 WeakPolarHBondContact O-CG 3.3Å; R113-E117 PolarHBondContact O-N 2.76Å; R114-E117 PolarHBondContact O-N 3.31Å; E117-S120 WeakPolarHBondContact CA-OG 3.32Å; E117-S120 PolarHBondContact O-N 3.26Å; E117-S120 PolarHBondContact O-OG 2.83Å; E117-H121 VanDerWaalsContact O-CB 3.26Å; E117-H121 WeakPolarHBondContact O-CB 3.06Å; E117-H121 PolarHBondContact O-CD2 2.81Å; E117-H121 VanDerWaalsContact O-CD2 3.26Å; E117-H121 PolarHBondContact O-N 3.42Å |
| 118 | L | 64.3 | Low | 67 | Low | 119 Ų | 119 | 107.8 Ų | 107.8 | 62% | 0.623 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -71.1 | -34.7 | 174.2 | -79.2 | 163.6 | 0 | 0 | 0 | 112.1 | R114 E115 H121 S122 | R114-L118 VanDerWaalsContact O-CB 3.25Å; R114-L118 WeakPolarHBondContact O-CB 3.44Å; R114-L118 VanDerWaalsContact O-CG 3.3Å; R114-L118 WeakPolarHBondContact O-CG 3.37Å; R114-L118 PolarHBondContact O-N 2.87Å; E115-L118 CarbonylContact O-C 3.6Å; E115-L118 PolarHBondContact O-N 3.28Å; L118-H121 CarbonylContact O-C 3.55Å; L118-H121 PolarHBondContact O-N 2.86Å; L118-S122 WeakPolarHBondContact O-CB 3.23Å; L118-S122 PolarHBondContact O-N 2.76Å; L118-S122 PolarHBondContact O-OG 2.92Å |
| 119 | Q | 64.3 | Low | 65.5 | Low | 111 Ų | 111 | 111 Ų | 111 | 52% | 0.519 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -71.8 | -40.3 | 171.7 | -84.2 | -178.4 | -13.6 | 0 | 0 | 110.7 | E115 H121 S122 L123 | E115-Q119 WeakPolarHBondContact O-CA 3.33Å; E115-Q119 WeakPolarHBondContact O-CB 3.44Å; E115-Q119 WeakPolarHBondContact O-CG 3.45Å; E115-Q119 PolarHBondContact O-N 2.7Å; Q119-H121 VanDerWaalsContact C-N 3.26Å; Q119-H121 PolarHBondContact O-N 2.98Å; Q119-S122 WeakPolarHBondContact CA-OG 3.17Å; Q119-S122 CarbonylContact O-C 3.5Å; Q119-S122 PolarHBondContact O-N 3.45Å; Q119-S122 PolarHBondContact O-OG 3Å; Q119-L123 HydrophobicContact CB-CD1 4.13Å; Q119-L123 HydrophobicContact CG-CD1 4.05Å; Q119-L123 WeakPolarHBondContact O-CA 3.18Å; Q119-L123 WeakPolarHBondContact O-CB 3.18Å; Q119-L123 PolarHBondContact O-N 2.84Å |
| 120 | S | 56.5 | Low | 64.1 | Low | 67 Ų | 67 | 113.4 Ų | 113.4 | 47% | 0.469 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -69.2 | -27.1 | 172.4 | 71.2 | 0 | 0 | 0 | 0 | 111.9 | R116 E117 G124 | R116-S120 WeakPolarHBondContact O-CB 3.4Å; R116-S120 PolarHBondContact O-N 3.36Å; R116-S120 PolarHBondContact O-OG 3.45Å; R116-S120 VanDerWaalsContact O-OG 3.06Å; E117-S120 WeakPolarHBondContact CA-OG 3.32Å; E117-S120 PolarHBondContact O-N 3.26Å; E117-S120 PolarHBondContact O-OG 2.83Å; S120-G124 WeakPolarHBondContact O-CA 3.31Å; S120-G124 PolarHBondContact O-N 3.45Å |
| 121 | H | 56.1 | Low | 62.7 | Low | 166 Ų | 166 | 113.5 Ų | 113.5 | 77% | 0.769 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -76.3 | -29 | 168.9 | -94.4 | -83.4 | 0 | 0 | 0 | 114 | E117 L118 Q119 | E117-H121 VanDerWaalsContact O-CB 3.26Å; E117-H121 WeakPolarHBondContact O-CB 3.06Å; E117-H121 PolarHBondContact O-CD2 2.81Å; E117-H121 VanDerWaalsContact O-CD2 3.26Å; E117-H121 PolarHBondContact O-N 3.42Å; L118-H121 CarbonylContact O-C 3.55Å; L118-H121 PolarHBondContact O-N 2.86Å; Q119-H121 VanDerWaalsContact C-N 3.26Å; Q119-H121 PolarHBondContact O-N 2.98Å |
| 122 | S | 53.2 | Low | 62 | Low | 91 Ų | 91 | 113.5 Ų | 113.5 | 64% | 0.636 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -96.4 | -20.1 | -180 | 60.6 | 0 | 0 | 0 | 0 | 114.2 | L118 Q119 | L118-S122 WeakPolarHBondContact O-CB 3.23Å; L118-S122 PolarHBondContact O-N 2.76Å; L118-S122 PolarHBondContact O-OG 2.92Å; Q119-S122 WeakPolarHBondContact CA-OG 3.17Å; Q119-S122 CarbonylContact O-C 3.5Å; Q119-S122 PolarHBondContact O-N 3.45Å; Q119-S122 PolarHBondContact O-OG 3Å |
| 123 | L | 53.5 | Low | 60.8 | Low | 133 Ų | 133 | 110 Ų | 110 | 70% | 0.696 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -124.6 | 8.4 | -179.6 | -68.2 | 137.3 | 0 | 0 | 0 | 112.9 | Q119 | Q119-L123 HydrophobicContact CB-CD1 4.13Å; Q119-L123 HydrophobicContact CG-CD1 4.05Å; Q119-L123 WeakPolarHBondContact O-CA 3.18Å; Q119-L123 WeakPolarHBondContact O-CB 3.18Å; Q119-L123 PolarHBondContact O-N 2.84Å |
| 124 | G | 40.3 | Very low | 59.3 | Low | 29 Ų | 29 | 104.2 Ų | 104.2 | 30% | 0.299 | 57% | 0.568 | S | S | . | * | trans | -64.2 | 135.6 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | S120 G126 | S120-G124 WeakPolarHBondContact O-CA 3.31Å; S120-G124 PolarHBondContact O-N 3.45Å; G124-G126 PolarHBondContact O-N 3.39Å | ||
| 125 | P | 48.9 | Very low | 58.1 | Low | 141 Ų | 141 | 101.7 Ų | 101.7 | 92% | 0.916 | 57% | 0.571 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.6 | 98.7 | -179.7 | 29 | -33.2 | 0 | 0 | 0 | 110.2 | ||
| 126 | G | 50.5 | Low | 56.8 | Low | 80 Ų | 80 | 99.6 Ų | 99.6 | 83% | 0.825 | 56% | 0.563 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 92 | 19.5 | 162.4 | 0 | 0 | 0 | 0 | 0 | 118.8 | G124 S128 | G124-G126 PolarHBondContact O-N 3.39Å; G126-S128 PolarHBondContact O-N 2.89Å |
| 127 | A | 45.9 | Very low | 55.8 | Low | 85 Ų | 85 | 96.6 Ų | 96.6 | 70% | 0.702 | 56% | 0.564 | S | S | * | * | trans | -89.2 | 92 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 128 | S | 49.8 | Very low | 54.9 | Low | 114 Ų | 114 | 99.1 Ų | 99.1 | 80% | 0.797 | 59% | 0.591 | S | S | * | * | trans | 51.8 | 69.9 | 148.2 | 67.7 | 0 | 0 | 0 | 0 | 120 | G126 | G126-S128 PolarHBondContact O-N 2.89Š| ||
| 129 | R | 53.7 | Low | 54.5 | Low | 125 Ų | 125 | 102.8 Ų | 102.8 | 47% | 0.472 | 60% | 0.602 | S | S | . | * | P | Polyproline II helix | trans | -99.3 | 121.2 | 139.8 | -84.5 | 154.8 | 161.1 | 177.7 | 16.7 | 107.1 | N131 Y147 E153 | R129-N131 PolarHBondContact O-N 2.97Å; R129-Y147 HydrophobicContact CB-CD1 3.81Å; R129-Y147 HydrophobicContact CB-CD2 3.49Å; R129-Y147 VanDerWaalsContact CB-CD2 3.49Å; R129-Y147 HydrophobicContact CB-CE1 4Å; R129-Y147 HydrophobicContact CB-CE2 3.65Å; R129-Y147 HydrophobicContact CB-CG 3.51Å; R129-Y147 VanDerWaalsContact CD-CZ 3.46Å; R129-Y147 HydrophobicContact CG-CD1 4.31Å; R129-Y147 HydrophobicContact CG-CD2 4.29Å; R129-Y147 HydrophobicContact CG-CE1 4.02Å; R129-Y147 HydrophobicContact CG-CE2 3.94Å; R129-Y147 HydrophobicContact CG-CG 4.41Å; R129-Y147 PolarHBondContact NE-OH 3.42Å; R129-E153 IonicContact NH1-OE1 3.56Å |
| 130 | Q | 56.7 | Low | 53.6 | Low | 181 Ų | 181 | 99.9 Ų | 99.9 | 85% | 0.846 | 59% | 0.594 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 132 | -179.4 | -85.7 | -178.7 | -13.1 | 0 | 0 | 110.1 | N132 Y147 | Q130-N132 PolarHBondContact O-N 3Å; Q130-N132 VanDerWaalsContact O-N 3.16Å; Q130-Y147 VanDerWaalsContact O-CD2 3.31Å; Q130-Y147 WeakPolarHBondContact O-CD2 3.38Å |
| 131 | N | 56.9 | Low | 53.5 | Low | 82 Ų | 82 | 103 Ų | 103 | 44% | 0.439 | 61% | 0.612 | S | S | . | * | P | Polyproline II helix | trans | -57.4 | 123 | 174.7 | -68.9 | -29.5 | 0 | 0 | 0 | 109.3 | R129 P144 C145 F146 Y147 | R129-N131 PolarHBondContact O-N 2.97Å; N131-P144 HydrophobicContact CB-CB 3.85Å; N131-P144 WeakPolarHBondContact CB-O 3.27Å; N131-P144 PolarHBondContact ND2-O 2.88Å; N131-P144 WeakPolarHBondContact O-CB 3.28Å; N131-C145 VanDerWaalsContact CG-C 3.46Å; N131-C145 PolarHBondContact ND2-O 3.48Å; N131-F146 CarbonylContact C-O 3.55Å; N131-F146 WeakPolarHBondContact CA-O 3.18Å; N131-F146 VanDerWaalsContact OD1-C 3.25Å; N131-F146 VanDerWaalsContact OD1-CA 3.29Å; N131-F146 WeakPolarHBondContact OD1-CA 3.24Å; N131-Y147 PolarHBondContact OD1-N 2.88Å; N131-Y147 VanDerWaalsContact OD1-N 3.11Å |
| 132 | N | 65.6 | Low | 53.3 | Low | 105 Ų | 105 | 98.7 Ų | 98.7 | 56% | 0.561 | 60% | 0.598 | S | S | * | * | trans | -113.1 | 2.4 | -175.6 | -169.6 | 29.3 | 0 | 0 | 0 | 111.8 | Q130 F146 | Q130-N132 PolarHBondContact O-N 3Å; Q130-N132 VanDerWaalsContact O-N 3.16Å; N132-F146 PolarHBondContact N-O 2.99Å | ||
| 133 | W | 62.4 | Low | 53.3 | Low | 27 Ų | 27 | 96.3 Ų | 96.3 | 10% | 0.102 | 59% | 0.588 | C | S | . | * | B | Isolated β-bridge | trans | -142.4 | 137.9 | -168.5 | -161.3 | 90.2 | 0 | 0 | 0 | 114.1 | P144 C145 F146 Q148 Y166 W169 F212 | W133-P144 CarbonylContact O-C 3.59Å; W133-P144 WeakPolarHBondContact O-CA 3.12Å; W133-C145 PolarHBondContact O-N 3.33Å; W133-F146 WeakPolarHBondContact CB-O 3.11Å; W133-F146 PolarHBondContact N-O 3.21Å; W133-F146 PolarHBondContact O-N 2.93Å; W133-F146 VanDerWaalsContact O-N 3.09Å; W133-Q148 HydrophobicContact CB-CB 3.92Å; W133-Q148 HydrophobicContact CG-CB 4.22Å; W133-Y166 AromaticContact CE2-CE2 3.75Å; W133-Y166 AromaticContact CZ2-CE2 3.82Å; W133-Y166 HydrophobicContact CZ2-CE2 3.82Å; W133-Y166 AromaticContact NE1-CE2 3.28Å; W133-Y166 VanDerWaalsContact NE1-CE2 3.28Å; W133-Y166 AromaticContact NE1-CZ 3.38Å; W133-Y166 PolarHBondContact NE1-OH 2.96Å; W133-W169 AromaticContact CH2-CH2 3.4Å; W133-W169 HydrophobicContact CH2-CH2 3.4Å; W133-W169 HydrophobicContact CH2-CZ2 4.11Å; W133-W169 AromaticContact CH2-CZ3 3.7Å; W133-W169 HydrophobicContact CH2-CZ3 3.7Å; W133-W169 HydrophobicContact CZ2-CE3 4.21Å; W133-W169 AromaticContact CZ2-CH2 3.6Å; W133-W169 HydrophobicContact CZ2-CH2 3.6Å; W133-W169 AromaticContact CZ2-CZ3 3.37Å; W133-W169 HydrophobicContact CZ2-CZ3 3.37Å; W133-F212 HydrophobicContact CE3-CE2 4.19Å; W133-F212 AromaticContact CE3-CZ 3.96Å; W133-F212 HydrophobicContact CE3-CZ 3.96Å; W133-F212 AromaticContact CH2-CD2 3.73Å; W133-F212 HydrophobicContact CH2-CD2 3.73Å; W133-F212 AromaticContact CH2-CE2 3.31Å; W133-F212 HydrophobicContact CH2-CE2 3.31Å; W133-F212 AromaticContact CH2-CZ 3.82Å; W133-F212 HydrophobicContact CH2-CZ 3.82Å; W133-F212 HydrophobicContact CZ2-CE2 4.03Å; W133-F212 HydrophobicContact CZ3-CD2 4.13Å; W133-F212 HydrophobicContact CZ3-CE1 4.05Å; W133-F212 AromaticContact CZ3-CE2 3.42Å; W133-F212 HydrophobicContact CZ3-CE2 3.42Å; W133-F212 VanDerWaalsContact CZ3-CE2 3.42Å; W133-F212 AromaticContact CZ3-CZ 3.38Å; W133-F212 HydrophobicContact CZ3-CZ 3.38Å |
| 134 | P | 53.9 | Low | 53.5 | Low | 29 Ų | 29 | 93.1 Ų | 93.1 | 19% | 0.188 | 58% | 0.575 | C | S | . | * | S | Bend | cis | -71.7 | 144.4 | -7.6 | 29 | -33.4 | 0 | 0 | 0 | 111.5 | L136 | P134-L136 HydrophobicContact CB-CD1 4.27Å; P134-L136 HydrophobicContact CB-CG 4Å; P134-L136 HydrophobicContact CG-CD1 3.51Å; P134-L136 HydrophobicContact CG-CG 3.78Å; P134-L136 PolarHBondContact O-N 3.04Å |
| 135 | P | 56.3 | Low | 54.3 | Low | 95 Ų | 95 | 94.7 Ų | 94.7 | 62% | 0.617 | 58% | 0.58 | S | S | * | * | trans | -73.8 | 76.5 | 175.1 | 31.5 | -34.5 | 0 | 0 | 0 | 108.6 | ||||
| 136 | L | 51.8 | Low | 54.8 | Low | 69 Ų | 69 | 92 Ų | 92 | 36% | 0.361 | 56% | 0.555 | S | S | . | * | trans | -85.6 | 142.7 | 179 | -69.8 | 167.9 | 0 | 0 | 0 | 109.4 | P134 C140 V142 | P134-L136 HydrophobicContact CB-CD1 4.27Å; P134-L136 HydrophobicContact CB-CG 4Å; P134-L136 HydrophobicContact CG-CD1 3.51Å; P134-L136 HydrophobicContact CG-CG 3.78Å; P134-L136 PolarHBondContact O-N 3.04Å; L136-C140 HydrophobicContact CB-CB 3.73Å; L136-C140 HydrophobicContact CD1-CB 4.02Å; L136-C140 HydrophobicContact CD2-CB 4.37Å; L136-C140 HydrophobicContact CG-CB 4.24Å; L136-V142 HydrophobicContact CD1-CB 3.99Å; L136-V142 WeakPolarHBondContact CD1-O 3.2Å | ||
| 137 | P | 54.7 | Low | 55.2 | Low | 97 Ų | 97 | 90.8 Ų | 90.8 | 63% | 0.63 | 53% | 0.525 | S | S | * | . | trans | -52.4 | 147.6 | 167.4 | -20.8 | 31 | 0 | 0 | 0 | 109.8 | F139 C140 | P137-F139 PolarHBondContact O-N 3.41Å; P137-C140 PolarHBondContact O-N 2.91Å | ||
| 138 | S | 58.1 | Low | 56 | Low | 136 Ų | 136 | 87.7 Ų | 87.7 | 95% | 0.951 | 50% | 0.496 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.2 | -7.9 | -177.8 | 52.2 | 0 | 0 | 0 | 0 | 115.3 | ||
| 139 | F | 55.6 | Low | 56.8 | Low | 195 Ų | 195 | 84.3 Ų | 84.3 | 86% | 0.855 | 47% | 0.47 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.9 | -11.5 | 175.7 | -170.4 | -108.2 | 0 | 0 | 0 | 114.1 | P137 | P137-F139 PolarHBondContact O-N 3.41Š|
| 140 | C | 44.4 | Very low | 57.8 | Low | 51 Ų | 51 | 79.4 Ų | 79.4 | 35% | 0.345 | 45% | 0.452 | S | S | . | . | S | Bend | trans | -83.7 | 129 | 177.5 | -157.9 | 0 | 0 | 0 | 0 | 110.7 | L136 P137 V142 | L136-C140 HydrophobicContact CB-CB 3.73Å; L136-C140 HydrophobicContact CD1-CB 4.02Å; L136-C140 HydrophobicContact CD2-CB 4.37Å; L136-C140 HydrophobicContact CG-CB 4.24Å; P137-C140 PolarHBondContact O-N 2.91Å; C140-V142 PolarHBondContact O-N 3.05Å |
| 141 | P | 54.3 | Low | 58.2 | Low | 131 Ų | 131 | 76.2 Ų | 76.2 | 85% | 0.851 | 44% | 0.441 | S | S | * | . | S | Bend | trans | -69.2 | -3 | -178.3 | 25.5 | -33.2 | 0 | 0 | 0 | 114.5 | ||
| 142 | V | 53 | Low | 58.8 | Low | 77 Ų | 77 | 76.2 Ų | 76.2 | 47% | 0.467 | 44% | 0.444 | S | S | . | . | S | Bend | trans | -102.5 | 101.4 | 175.6 | -166.3 | 0 | 0 | 0 | 0 | 107.3 | L136 C140 | L136-V142 HydrophobicContact CD1-CB 3.99Å; L136-V142 WeakPolarHBondContact CD1-O 3.2Å; C140-V142 PolarHBondContact O-N 3.05Å |
| 143 | G | 53 | Low | 59.2 | Low | 41 Ų | 41 | 72.5 Ų | 72.5 | 42% | 0.423 | 42% | 0.423 | S | S | . | . | trans | -68.6 | 170.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | C145 | G143-C145 PolarHBondContact O-N 2.9Å; G143-C145 PolarHBondContact O-SG 2.86Å; G143-C145 VanDerWaalsContact O-SG 3.33Å | ||
| 144 | P | 57.3 | Low | 60 | Low | 65 Ų | 65 | 71.5 Ų | 71.5 | 42% | 0.422 | 42% | 0.42 | S | S | . | . | trans | -56.1 | 108.6 | 171.1 | -23.9 | 34.5 | 0 | 0 | 0 | 110.2 | N131 W133 | N131-P144 HydrophobicContact CB-CB 3.85Å; N131-P144 WeakPolarHBondContact CB-O 3.27Å; N131-P144 PolarHBondContact ND2-O 2.88Å; N131-P144 WeakPolarHBondContact O-CB 3.28Å; W133-P144 CarbonylContact O-C 3.59Å; W133-P144 WeakPolarHBondContact O-CA 3.12Å | ||
| 145 | C | 57.2 | Low | 61 | Low | 62 Ų | 62 | 73.8 Ų | 73.8 | 42% | 0.419 | 44% | 0.436 | S | S | . | . | trans | -88.8 | -20.1 | -176.5 | -71.1 | 0 | 0 | 0 | 0 | 112.5 | N131 W133 G143 | N131-C145 VanDerWaalsContact CG-C 3.46Å; N131-C145 PolarHBondContact ND2-O 3.48Å; W133-C145 PolarHBondContact O-N 3.33Å; G143-C145 PolarHBondContact O-N 2.9Å; G143-C145 PolarHBondContact O-SG 2.86Å; G143-C145 VanDerWaalsContact O-SG 3.33Å | ||
| 146 | F | 59.1 | Low | 61.8 | Low | 85 Ų | 85 | 77.3 Ų | 77.3 | 37% | 0.373 | 45% | 0.445 | S | S | . | . | B | Isolated β-bridge | trans | -142.2 | 146.7 | -173 | -58.6 | -74.5 | 0 | 0 | 0 | 113.3 | N131 N132 W133 | N131-F146 CarbonylContact C-O 3.55Å; N131-F146 WeakPolarHBondContact CA-O 3.18Å; N131-F146 VanDerWaalsContact OD1-C 3.25Å; N131-F146 VanDerWaalsContact OD1-CA 3.29Å; N131-F146 WeakPolarHBondContact OD1-CA 3.24Å; N132-F146 PolarHBondContact N-O 2.99Å; W133-F146 WeakPolarHBondContact CB-O 3.11Å; W133-F146 PolarHBondContact N-O 3.21Å; W133-F146 PolarHBondContact O-N 2.93Å; W133-F146 VanDerWaalsContact O-N 3.09Å |
| 147 | Y | 58.7 | Low | 62.9 | Low | 54 Ų | 54 | 83 Ų | 83 | 21% | 0.212 | 46% | 0.461 | C | S | . | . | trans | -80.4 | 130 | 161.4 | 179.8 | -101.5 | 0 | 0 | 0 | 109.8 | R129 Q130 N131 D149 E153 | R129-Y147 HydrophobicContact CB-CD1 3.81Å; R129-Y147 HydrophobicContact CB-CD2 3.49Å; R129-Y147 VanDerWaalsContact CB-CD2 3.49Å; R129-Y147 HydrophobicContact CB-CE1 4Å; R129-Y147 HydrophobicContact CB-CE2 3.65Å; R129-Y147 HydrophobicContact CB-CG 3.51Å; R129-Y147 VanDerWaalsContact CD-CZ 3.46Å; R129-Y147 HydrophobicContact CG-CD1 4.31Å; R129-Y147 HydrophobicContact CG-CD2 4.29Å; R129-Y147 HydrophobicContact CG-CE1 4.02Å; R129-Y147 HydrophobicContact CG-CE2 3.94Å; R129-Y147 HydrophobicContact CG-CG 4.41Å; R129-Y147 PolarHBondContact NE-OH 3.42Å; Q130-Y147 VanDerWaalsContact O-CD2 3.31Å; Q130-Y147 WeakPolarHBondContact O-CD2 3.38Å; N131-Y147 PolarHBondContact OD1-N 2.88Å; N131-Y147 VanDerWaalsContact OD1-N 3.11Å; Y147-D149 HydrophobicContact CE1-CB 3.68Å; Y147-D149 HydrophobicContact CE2-CB 4.06Å; Y147-D149 WeakPolarHBondContact OH-CB 3.39Å; Y147-D149 PolarHBondContact OH-OD2 2.74Å; Y147-E153 WeakPolarHBondContact CD1-OE1 3.48Å; Y147-E153 HydrophobicContact CE1-CG 4.22Å; Y147-E153 WeakPolarHBondContact CE1-OE1 3.39Å | ||
| 148 | Q | 62.9 | Low | 64.2 | Low | 20 Ų | 20 | 79.8 Ų | 79.8 | 9% | 0.093 | 44% | 0.438 | C | S | . | . | trans | -143.8 | 104.9 | -179.2 | 178.3 | 89.7 | 65.8 | 0 | 0 | 106.6 | W133 Y216 Y220 | W133-Q148 HydrophobicContact CB-CB 3.92Å; W133-Q148 HydrophobicContact CG-CB 4.22Å; Q148-Y216 PolarHBondContact NE2-OH 3.2Å; Q148-Y216 PolarHBondContact OE1-OH 2.87Å; Q148-Y220 PolarHBondContact NE2-OH 3.47Å | ||
| 149 | D | 68 | Low | 65.4 | Low | 44 Ų | 44 | 75 Ų | 75 | 24% | 0.235 | 40% | 0.4 | C | S | . | . | trans | -132.6 | 100.8 | 175.5 | -168.8 | -22.7 | 0 | 0 | 0 | 109.9 | Y147 N151 V152 E153 | Y147-D149 HydrophobicContact CE1-CB 3.68Å; Y147-D149 HydrophobicContact CE2-CB 4.06Å; Y147-D149 WeakPolarHBondContact OH-CB 3.39Å; Y147-D149 PolarHBondContact OH-OD2 2.74Å; D149-N151 PolarHBondContact O-N 3.44Å; D149-N151 PolarHBondContact OD1-N 3.33Å; D149-V152 HydrophobicContact CB-CB 4.32Å; D149-V152 PolarHBondContact O-N 2.84Å; D149-V152 PolarHBondContact OD1-N 2.67Å; D149-V152 WeakPolarHBondContact OD2-CG2 3.35Å; D149-E153 VanDerWaalsContact O-CB 3.29Å; D149-E153 WeakPolarHBondContact O-CB 3.37Å; D149-E153 WeakPolarHBondContact O-CG 3.33Å; D149-E153 PolarHBondContact O-N 3.27Å | ||
| 150 | I | 74 | Confident | 66.8 | Low | 21 Ų | 21 | 75 Ų | 75 | 11% | 0.108 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -65.6 | -31.9 | -176.1 | -56.9 | 174 | 0 | 0 | 0 | 110.6 | V152 I154 Q159 V162 Y220 | I150-V152 VanDerWaalsContact C-N 3.35Å; I150-I154 HydrophobicContact CG2-CB 4.35Å; I150-I154 HydrophobicContact CG2-CG1 4.14Å; I150-I154 WeakPolarHBondContact O-CB 3.21Å; I150-I154 PolarHBondContact O-N 2.84Å; I150-Q159 HydrophobicContact CG2-CB 4.31Å; I150-Q159 HydrophobicContact CG2-CG 4.34Å; I150-V162 HydrophobicContact CD1-CG1 4.34Å; I150-V162 HydrophobicContact CG1-CG1 4.35Å; I150-V162 HydrophobicContact CG2-CB 4.2Å; I150-V162 HydrophobicContact CG2-CG1 4.13Å; I150-Y220 HydrophobicContact CG1-CE2 4.34Å |
| 151 | N | 65.8 | Low | 68.9 | Low | 115 Ų | 115 | 73 Ų | 73 | 62% | 0.615 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -74.2 | -30.2 | -175.5 | -60.2 | -66.5 | 0 | 0 | 0 | 112.2 | D149 Q159 | D149-N151 PolarHBondContact O-N 3.44Å; D149-N151 PolarHBondContact OD1-N 3.33Å; N151-Q159 PolarHBondContact O-NE2 3.03Å |
| 152 | V | 69.6 | Low | 70.6 | Confident | 82 Ų | 82 | 66.8 Ų | 66.8 | 50% | 0.497 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -96.7 | -32.2 | -176.7 | -178.4 | 0 | 0 | 0 | 0 | 112 | D149 I150 | D149-V152 HydrophobicContact CB-CB 4.32Å; D149-V152 PolarHBondContact O-N 2.84Å; D149-V152 PolarHBondContact OD1-N 2.67Å; D149-V152 WeakPolarHBondContact OD2-CG2 3.35Å; I150-V152 VanDerWaalsContact C-N 3.35Å |
| 153 | E | 74.2 | Confident | 72.3 | Confident | 26 Ų | 26 | 65 Ų | 65 | 12% | 0.121 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -96.9 | -17.9 | -173.2 | -58 | -167.2 | 143.8 | 0 | 0 | 114.6 | R129 Y147 D149 Y220 R224 | R129-E153 IonicContact NH1-OE1 3.56Å; Y147-E153 WeakPolarHBondContact CD1-OE1 3.48Å; Y147-E153 HydrophobicContact CE1-CG 4.22Å; Y147-E153 WeakPolarHBondContact CE1-OE1 3.39Å; D149-E153 VanDerWaalsContact O-CB 3.29Å; D149-E153 WeakPolarHBondContact O-CB 3.37Å; D149-E153 WeakPolarHBondContact O-CG 3.33Å; D149-E153 PolarHBondContact O-N 3.27Å; E153-Y220 WeakPolarHBondContact CB-OH 3.41Å; E153-Y220 WeakPolarHBondContact OE2-CE1 3.24Å; E153-Y220 PolarHBondContact OE2-OH 2.84Å; E153-R224 IonicContact OE1-CZ 3.62Å; E153-R224 IonicContact OE1-NH1 3.55Å; E153-R224 PolarHBondContact OE1-NH1 3.23Å; E153-R224 IonicContact OE1-NH2 2.81Å; E153-R224 PolarHBondContact OE1-NH2 3.03Å; E153-R224 IonicContact OE2-CZ 3.5Å; E153-R224 IonicContact OE2-NH1 3.72Å; E153-R224 PolarHBondContact OE2-NH1 2.88Å |
| 154 | I | 77.5 | Confident | 74.2 | Confident | 6 Ų | 6 | 65.6 Ų | 65.6 | 3% | 0.031 | 32% | 0.323 | C | S | . | . | S | Bend | trans | -112.5 | 136.3 | -179.6 | -55.5 | -60.7 | 0 | 0 | 0 | 109.8 | I150 F158 Q159 V162 Y220 F223 R224 | I150-I154 HydrophobicContact CG2-CB 4.35Å; I150-I154 HydrophobicContact CG2-CG1 4.14Å; I150-I154 WeakPolarHBondContact O-CB 3.21Å; I150-I154 PolarHBondContact O-N 2.84Å; I154-F158 HydrophobicContact CG2-CB 3.69Å; I154-Q159 HydrophobicContact CB-CG 4.05Å; I154-Q159 HydrophobicContact CG2-CG 4.1Å; I154-Q159 WeakPolarHBondContact O-CG 3.39Å; I154-Q159 PolarHBondContact O-NE2 3.11Å; I154-V162 HydrophobicContact CD1-CG2 4.36Å; I154-V162 HydrophobicContact CG1-CB 4.44Å; I154-V162 HydrophobicContact CG1-CG1 4.25Å; I154-V162 HydrophobicContact CG1-CG2 4.24Å; I154-V162 HydrophobicContact CG2-CG2 4.05Å; I154-Y220 HydrophobicContact CD1-CD2 4.28Å; I154-Y220 HydrophobicContact CD1-CE2 3.88Å; I154-Y220 HydrophobicContact CG1-CE2 3.9Å; I154-F223 HydrophobicContact CD1-CB 4.12Å; I154-F223 HydrophobicContact CG2-CB 4.46Å; I154-R224 HydrophobicContact CD1-CB 3.71Å |
| 155 | S | 75.1 | Confident | 75.9 | Confident | 77 Ų | 77 | 62.5 Ų | 62.5 | 54% | 0.538 | 30% | 0.303 | S | S | . | . | trans | -58.1 | 141.1 | 173.8 | -50.6 | 0 | 0 | 0 | 0 | 111.4 | R157 F158 Q159 | S155-R157 PolarHBondContact O-N 3.36Å; S155-F158 PolarHBondContact O-N 3.48Å; S155-Q159 PolarHBondContact O-N 3.29Å | ||
| 156 | Q | 73.7 | Confident | 77.5 | Confident | 169 Ų | 169 | 61.3 Ų | 61.3 | 79% | 0.79 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -52.5 | -31.5 | -171.6 | -160.3 | 165.3 | 8.6 | 0 | 0 | 114.5 | F158 | Q156-F158 VanDerWaalsContact C-N 3.33Å; Q156-F158 PolarHBondContact O-N 2.95Å |
| 157 | R | 75.5 | Confident | 79.1 | Confident | 188 Ų | 188 | 64.1 Ų | 64.1 | 71% | 0.709 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -61.7 | -34.9 | 174.9 | -172.5 | 176.9 | -177.4 | -177 | -0.5 | 113.8 | S155 | S155-R157 PolarHBondContact O-N 3.36Å |
| 158 | F | 81.4 | Confident | 80.8 | Confident | 31 Ų | 31 | 61.6 Ų | 61.6 | 14% | 0.136 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -102.5 | -13 | -173.2 | -59.2 | -59.3 | 0 | 0 | 0 | 113.9 | I154 S155 Q156 R160 T161 V162 F223 | I154-F158 HydrophobicContact CG2-CB 3.69Å; S155-F158 PolarHBondContact O-N 3.48Å; Q156-F158 VanDerWaalsContact C-N 3.33Å; Q156-F158 PolarHBondContact O-N 2.95Å; F158-R160 VanDerWaalsContact C-N 3.35Å; F158-R160 PolarHBondContact O-N 3.44Å; F158-T161 WeakPolarHBondContact O-CB 3.44Å; F158-T161 PolarHBondContact O-N 2.84Å; F158-V162 PolarHBondContact O-N 2.96Å; F158-F223 HydrophobicContact CB-CB 4.44Å; F158-F223 HydrophobicContact CB-CD1 3.66Å; F158-F223 HydrophobicContact CB-CE1 4.25Å; F158-F223 HydrophobicContact CB-CG 4.29Å; F158-F223 AromaticContact CD1-CD1 3.68Å; F158-F223 HydrophobicContact CD1-CD1 3.68Å; F158-F223 AromaticContact CD1-CE1 3.59Å; F158-F223 HydrophobicContact CD1-CE1 3.59Å; F158-F223 HydrophobicContact CD2-CD1 4.19Å; F158-F223 HydrophobicContact CE1-CD1 4.35Å; F158-F223 HydrophobicContact CE1-CE1 4.12Å; F158-F223 AromaticContact CG-CD1 3.58Å; F158-F223 HydrophobicContact CG-CD1 3.58Å; F158-F223 HydrophobicContact CG-CE1 4.01Å |
| 159 | Q | 83.8 | Confident | 82.3 | Confident | 34 Ų | 34 | 61.8 Ų | 61.8 | 16% | 0.159 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -50.3 | -51.2 | -178.3 | -74.3 | 175.8 | -2.6 | 0 | 0 | 112.3 | I150 N151 I154 S155 T161 V162 T163 | I150-Q159 HydrophobicContact CG2-CB 4.31Å; I150-Q159 HydrophobicContact CG2-CG 4.34Å; N151-Q159 PolarHBondContact O-NE2 3.03Å; I154-Q159 HydrophobicContact CB-CG 4.05Å; I154-Q159 HydrophobicContact CG2-CG 4.1Å; I154-Q159 WeakPolarHBondContact O-CG 3.39Å; I154-Q159 PolarHBondContact O-NE2 3.11Å; S155-Q159 PolarHBondContact O-N 3.29Å; Q159-T161 VanDerWaalsContact C-N 3.27Å; Q159-T161 PolarHBondContact O-N 2.97Å; Q159-V162 PolarHBondContact O-N 3.41Å; Q159-V162 VanDerWaalsContact O-N 3.16Å; Q159-T163 WeakPolarHBondContact O-CB 3.42Å; Q159-T163 PolarHBondContact O-N 2.92Å; Q159-T163 PolarHBondContact O-OG1 3.48Å |
| 160 | R | 85.1 | Confident | 83.5 | Confident | 196 Ų | 196 | 63.3 Ų | 63.3 | 74% | 0.74 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -57.2 | -39.7 | -179.9 | -173.3 | 173.9 | -176.5 | 163.4 | 2.2 | 112.6 | F158 I164 | F158-R160 VanDerWaalsContact C-N 3.35Å; F158-R160 PolarHBondContact O-N 3.44Å; R160-I164 HydrophobicContact CG-CD1 3.98Å; R160-I164 WeakPolarHBondContact O-CB 3.4Å; R160-I164 WeakPolarHBondContact O-CD1 3.42Å; R160-I164 WeakPolarHBondContact O-CG1 3.47Å; R160-I164 PolarHBondContact O-N 3.38Å |
| 161 | T | 87.9 | Confident | 84.5 | Confident | 8 Ų | 8 | 64.7 Ų | 64.7 | 5% | 0.049 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -67.7 | -47.5 | 178.5 | -65.6 | 0 | 0 | 0 | 0 | 111.1 | F158 Q159 T163 I164 M165 F223 I298 M301 | F158-T161 WeakPolarHBondContact O-CB 3.44Å; F158-T161 PolarHBondContact O-N 2.84Å; Q159-T161 VanDerWaalsContact C-N 3.27Å; Q159-T161 PolarHBondContact O-N 2.97Å; T161-T163 VanDerWaalsContact C-N 3.34Å; T161-T163 PolarHBondContact O-N 2.74Å; T161-I164 PolarHBondContact O-N 3.32Å; T161-M165 WeakPolarHBondContact O-CB 3.4Å; T161-M165 PolarHBondContact O-N 3.33Å; T161-F223 HydrophobicContact CG2-CE2 4.03Å; T161-F223 HydrophobicContact CG2-CZ 3.88Å; T161-I298 HydrophobicContact CG2-CD1 4.2Å; T161-I298 HydrophobicContact CG2-CG1 3.85Å; T161-M301 HydrophobicContact CG2-CE 3.4Å; T161-M301 HydrophobicContact CG2-SD 4.44Å; T161-M301 WeakPolarHBondContact OG1-CE 3.12Å; T161-M301 PolarHBondContact OG1-SD 3.16Å |
| 162 | V | 89.1 | Confident | 85.9 | Confident | 1 Ų | 1 | 59.4 Ų | 59.4 | 1% | 0.006 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -64.1 | -40.4 | 179.6 | 177.3 | 0 | 0 | 0 | 0 | 111 | I150 I154 F158 Q159 M165 Y166 Y220 F223 | I150-V162 HydrophobicContact CD1-CG1 4.34Å; I150-V162 HydrophobicContact CG1-CG1 4.35Å; I150-V162 HydrophobicContact CG2-CB 4.2Å; I150-V162 HydrophobicContact CG2-CG1 4.13Å; I154-V162 HydrophobicContact CD1-CG2 4.36Å; I154-V162 HydrophobicContact CG1-CB 4.44Å; I154-V162 HydrophobicContact CG1-CG1 4.25Å; I154-V162 HydrophobicContact CG1-CG2 4.24Å; I154-V162 HydrophobicContact CG2-CG2 4.05Å; F158-V162 PolarHBondContact O-N 2.96Å; Q159-V162 PolarHBondContact O-N 3.41Å; Q159-V162 VanDerWaalsContact O-N 3.16Å; V162-M165 PolarHBondContact O-N 3.23Å; V162-Y166 PolarHBondContact O-N 2.86Å; V162-Y220 HydrophobicContact CG1-CD2 3.6Å; V162-Y220 HydrophobicContact CG1-CE2 3.97Å; V162-F223 HydrophobicContact CG2-CB 3.57Å; V162-F223 HydrophobicContact CG2-CD2 3.57Å; V162-F223 HydrophobicContact CG2-CE2 4.41Å; V162-F223 HydrophobicContact CG2-CG 3.68Å |
| 163 | T | 89.1 | Confident | 87.1 | Confident | 41 Ų | 41 | 56.4 Ų | 56.4 | 25% | 0.252 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -60.9 | -47.7 | 174.1 | -59.7 | 0 | 0 | 0 | 0 | 112 | Q159 T161 M165 Y166 Y167 | Q159-T163 WeakPolarHBondContact O-CB 3.42Å; Q159-T163 PolarHBondContact O-N 2.92Å; Q159-T163 PolarHBondContact O-OG1 3.48Å; T161-T163 VanDerWaalsContact C-N 3.34Å; T161-T163 PolarHBondContact O-N 2.74Å; T163-M165 PolarHBondContact O-N 3.42Å; T163-Y166 WeakPolarHBondContact O-CB 3.48Å; T163-Y166 PolarHBondContact O-N 2.98Å; T163-Y167 HydrophobicContact CG2-CD2 3.77Å; T163-Y167 HydrophobicContact CG2-CE2 3.45Å; T163-Y167 VanDerWaalsContact CG2-CE2 3.45Å; T163-Y167 WeakPolarHBondContact O-CD2 3.38Å; T163-Y167 PolarHBondContact O-N 3.11Å |
| 164 | I | 92.4 | Very high | 88.1 | Confident | 53 Ų | 53 | 60.4 Ų | 60.4 | 27% | 0.272 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -59.9 | -40.3 | 175.8 | -69.1 | 163.8 | 0 | 0 | 0 | 110.2 | R160 T161 Y166 Y167 F168 L294 | R160-I164 HydrophobicContact CG-CD1 3.98Å; R160-I164 WeakPolarHBondContact O-CB 3.4Å; R160-I164 WeakPolarHBondContact O-CD1 3.42Å; R160-I164 WeakPolarHBondContact O-CG1 3.47Å; R160-I164 PolarHBondContact O-N 3.38Å; T161-I164 PolarHBondContact O-N 3.32Å; I164-Y166 VanDerWaalsContact C-N 3.34Å; I164-Y166 PolarHBondContact O-N 3.23Å; I164-Y167 PolarHBondContact O-N 2.73Å; I164-F168 WeakPolarHBondContact O-CB 3.44Å; I164-F168 PolarHBondContact O-N 3.48Å; I164-L294 HydrophobicContact CG2-CD1 4.36Å; I164-L294 HydrophobicContact CG2-CD2 3.62Å |
| 165 | M | 92.8 | Very high | 89 | Confident | 0 Ų | 0 | 60.1 Ų | 60.1 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -67.8 | -34.7 | -179.9 | -167.1 | 53.4 | 82.5 | 0 | 0 | 112.8 | T161 V162 T163 F168 W169 W215 V219 F234 F238 L294 I298 | T161-M165 WeakPolarHBondContact O-CB 3.4Å; T161-M165 PolarHBondContact O-N 3.33Å; V162-M165 PolarHBondContact O-N 3.23Å; T163-M165 PolarHBondContact O-N 3.42Å; M165-F168 WeakPolarHBondContact O-CB 3.37Å; M165-F168 PolarHBondContact O-N 3.31Å; M165-F168 HydrophobicContact SD-CB 4.34Å; M165-F168 HydrophobicContact SD-CD1 3.86Å; M165-F168 HydrophobicContact SD-CG 4.48Å; M165-W169 PolarHBondContact O-N 2.92Å; M165-W215 HydrophobicContact CG-CZ3 3.72Å; M165-W215 HydrophobicContact SD-CE3 4.28Å; M165-W215 HydrophobicContact SD-CH2 3.98Å; M165-W215 HydrophobicContact SD-CZ3 3.38Å; M165-W215 WeakPolarHBondContact SD-CZ3 3.49Å; M165-V219 HydrophobicContact CG-CG1 3.84Å; M165-F234 HydrophobicContact CE-CE2 4.49Å; M165-F234 HydrophobicContact CE-CZ 3.98Å; M165-F238 HydrophobicContact CE-CE1 4.25Å; M165-F238 HydrophobicContact CE-CZ 4.1Å; M165-F238 HydrophobicContact SD-CE2 4.38Å; M165-F238 HydrophobicContact SD-CZ 4.16Å; M165-L294 HydrophobicContact CE-CB 3.67Å; M165-L294 HydrophobicContact CE-CD1 3.94Å; M165-L294 HydrophobicContact CE-CD2 4.5Å; M165-L294 HydrophobicContact CE-CG 4.24Å; M165-L294 HydrophobicContact SD-CD1 4.03Å; M165-I298 HydrophobicContact CE-CD1 3.17Å; M165-I298 HydrophobicContact CE-CG1 4.49Å |
| 166 | Y | 91.1 | Very high | 90 | Very high | 36 Ų | 36 | 56.8 Ų | 56.8 | 14% | 0.141 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -63.4 | -48.9 | 171.1 | 171.6 | -107.5 | 0 | 0 | 0 | 112.1 | W133 V162 T163 I164 F168 W169 M170 Y216 | W133-Y166 AromaticContact CE2-CE2 3.75Å; W133-Y166 AromaticContact CZ2-CE2 3.82Å; W133-Y166 HydrophobicContact CZ2-CE2 3.82Å; W133-Y166 AromaticContact NE1-CE2 3.28Å; W133-Y166 VanDerWaalsContact NE1-CE2 3.28Å; W133-Y166 AromaticContact NE1-CZ 3.38Å; W133-Y166 PolarHBondContact NE1-OH 2.96Å; V162-Y166 PolarHBondContact O-N 2.86Å; T163-Y166 WeakPolarHBondContact O-CB 3.48Å; T163-Y166 PolarHBondContact O-N 2.98Å; I164-Y166 VanDerWaalsContact C-N 3.34Å; I164-Y166 PolarHBondContact O-N 3.23Å; Y166-F168 VanDerWaalsContact C-N 3.26Å; Y166-F168 PolarHBondContact O-N 3.35Å; Y166-W169 HydrophobicContact CD2-CE3 4.5Å; Y166-W169 HydrophobicContact CE2-CE3 4.29Å; Y166-W169 HydrophobicContact CE2-CZ3 4.45Å; Y166-W169 WeakPolarHBondContact O-CB 3.33Å; Y166-W169 PolarHBondContact O-N 3.41Å; Y166-M170 HydrophobicContact CD1-SD 4.12Å; Y166-M170 HydrophobicContact CE1-CG 4.23Å; Y166-M170 HydrophobicContact CE1-SD 3.33Å; Y166-M170 WeakPolarHBondContact CE1-SD 3.32Å; Y166-M170 HydrophobicContact CE2-CG 4.26Å; Y166-M170 HydrophobicContact CE2-SD 4.29Å; Y166-M170 PolarHBondContact O-N 2.84Å; Y166-M170 PolarHBondContact OH-SD 2.94Å; Y166-M170 VanDerWaalsContact OH-SD 3.36Å; Y166-Y216 VanDerWaalsContact CA-CE2 3.49Å; Y166-Y216 HydrophobicContact CD2-CE1 4.4Å; Y166-Y216 HydrophobicContact CD2-CE2 4.02Å; Y166-Y216 AromaticContact CD2-CZ 3.69Å; Y166-Y216 WeakPolarHBondContact CD2-OH 3.39Å; Y166-Y216 HydrophobicContact CG-CE2 4.37Å |
| 167 | Y | 92.4 | Very high | 91 | Very high | 144 Ų | 144 | 52.3 Ų | 52.3 | 57% | 0.565 | 23% | 0.232 | S | C | * | . | H | α-helix | trans | -64.3 | -32.8 | 175.6 | -73.8 | -63.9 | 0 | 0 | 0 | 112.3 | T163 I164 M170 F171 | T163-Y167 HydrophobicContact CG2-CD2 3.77Å; T163-Y167 HydrophobicContact CG2-CE2 3.45Å; T163-Y167 VanDerWaalsContact CG2-CE2 3.45Å; T163-Y167 WeakPolarHBondContact O-CD2 3.38Å; T163-Y167 PolarHBondContact O-N 3.11Å; I164-Y167 PolarHBondContact O-N 2.73Å; Y167-M170 HydrophobicContact CD1-SD 4.03Å; Y167-M170 HydrophobicContact CE1-SD 4.34Å; Y167-M170 PolarHBondContact O-N 2.86Å; Y167-F171 WeakPolarHBondContact O-CB 3.4Å; Y167-F171 PolarHBondContact O-N 3.41Å |
| 168 | F | 95.4 | Very high | 92 | Very high | 2 Ų | 2 | 45.5 Ų | 45.5 | 1% | 0.009 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -64.2 | -41.7 | 173.2 | -178.9 | -110.4 | 0 | 0 | 0 | 112.3 | I164 M165 Y166 F171 S172 W215 F238 F245 Q287 M290 L294 | I164-F168 WeakPolarHBondContact O-CB 3.44Å; I164-F168 PolarHBondContact O-N 3.48Å; M165-F168 WeakPolarHBondContact O-CB 3.37Å; M165-F168 PolarHBondContact O-N 3.31Å; M165-F168 HydrophobicContact SD-CB 4.34Å; M165-F168 HydrophobicContact SD-CD1 3.86Å; M165-F168 HydrophobicContact SD-CG 4.48Å; Y166-F168 VanDerWaalsContact C-N 3.26Å; Y166-F168 PolarHBondContact O-N 3.35Å; F168-F171 PolarHBondContact O-N 3.48Å; F168-S172 PolarHBondContact O-N 2.98Å; F168-S172 PolarHBondContact O-OG 3.28Å; F168-W215 AromaticContact CD1-CH2 3.77Å; F168-W215 HydrophobicContact CD1-CH2 3.77Å; F168-W215 HydrophobicContact CD1-CZ2 4.38Å; F168-W215 HydrophobicContact CD1-CZ3 4.49Å; F168-W215 HydrophobicContact CE1-CH2 4.3Å; F168-F238 HydrophobicContact CD1-CE2 4.19Å; F168-F238 HydrophobicContact CD1-CZ 4.03Å; F168-F238 AromaticContact CE1-CE2 3.7Å; F168-F238 HydrophobicContact CE1-CE2 3.7Å; F168-F238 AromaticContact CE1-CZ 3.53Å; F168-F238 HydrophobicContact CE1-CZ 3.53Å; F168-F238 HydrophobicContact CZ-CZ 4.44Å; F168-F245 AromaticContact CE1-CE2 3.85Å; F168-F245 HydrophobicContact CE1-CE2 3.85Å; F168-F245 HydrophobicContact CE1-CZ 4.48Å; F168-F245 HydrophobicContact CZ-CD2 4.31Å; F168-F245 AromaticContact CZ-CE2 3.65Å; F168-F245 HydrophobicContact CZ-CE2 3.65Å; F168-F245 HydrophobicContact CZ-CZ 4.45Å; F168-Q287 HydrophobicContact CE2-CG 4.1Å; F168-Q287 WeakPolarHBondContact CE2-O 3.46Å; F168-Q287 HydrophobicContact CZ-CG 4.12Å; F168-Q287 WeakPolarHBondContact CZ-O 3.43Å; F168-M290 HydrophobicContact CD2-CB 4.15Å; F168-M290 HydrophobicContact CD2-CE 3.52Å; F168-M290 HydrophobicContact CD2-CG 3.54Å; F168-M290 HydrophobicContact CD2-SD 3.68Å; F168-M290 HydrophobicContact CE2-CB 3.82Å; F168-M290 HydrophobicContact CE2-CE 3.84Å; F168-M290 HydrophobicContact CE2-CG 3.73Å; F168-M290 HydrophobicContact CE2-SD 4.3Å; F168-L294 HydrophobicContact CB-CD1 3.69Å; F168-L294 HydrophobicContact CD1-CD1 3.85Å; F168-L294 HydrophobicContact CD2-CD1 3.87Å; F168-L294 HydrophobicContact CE1-CD1 4.49Å; F168-L294 HydrophobicContact CG-CD1 3.5Å; F168-L294 VanDerWaalsContact CG-CD1 3.5Å |
| 169 | W | 94.8 | Very high | 92.8 | Very high | 23 Ų | 23 | 44 Ų | 44 | 9% | 0.087 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -61.6 | -45.3 | 172.4 | 174.3 | 80.1 | 0 | 0 | 0 | 111.4 | W133 M165 Y166 F171 S172 A173 T208 S211 F212 W215 Y216 | W133-W169 AromaticContact CH2-CH2 3.4Å; W133-W169 HydrophobicContact CH2-CH2 3.4Å; W133-W169 HydrophobicContact CH2-CZ2 4.11Å; W133-W169 AromaticContact CH2-CZ3 3.7Å; W133-W169 HydrophobicContact CH2-CZ3 3.7Å; W133-W169 HydrophobicContact CZ2-CE3 4.21Å; W133-W169 AromaticContact CZ2-CH2 3.6Å; W133-W169 HydrophobicContact CZ2-CH2 3.6Å; W133-W169 AromaticContact CZ2-CZ3 3.37Å; W133-W169 HydrophobicContact CZ2-CZ3 3.37Å; M165-W169 PolarHBondContact O-N 2.92Å; Y166-W169 HydrophobicContact CD2-CE3 4.5Å; Y166-W169 HydrophobicContact CE2-CE3 4.29Å; Y166-W169 HydrophobicContact CE2-CZ3 4.45Å; Y166-W169 WeakPolarHBondContact O-CB 3.33Å; Y166-W169 PolarHBondContact O-N 3.41Å; W169-F171 VanDerWaalsContact C-N 3.34Å; W169-F171 PolarHBondContact O-N 3.43Å; W169-S172 WeakPolarHBondContact O-CB 3.48Å; W169-S172 PolarHBondContact O-N 2.97Å; W169-S172 VanDerWaalsContact O-N 3.11Å; W169-A173 PolarHBondContact O-N 2.89Å; W169-T208 HydrophobicContact CZ2-CG2 4.2Å; W169-S211 PolarHBondContact NE1-OG 3.42Å; W169-S211 VanDerWaalsContact NE1-OG 3.15Å; W169-F212 HydrophobicContact CD2-CD2 4.22Å; W169-F212 AromaticContact CE2-CD2 3.79Å; W169-F212 HydrophobicContact CH2-CD2 4.35Å; W169-F212 HydrophobicContact CZ2-CB 3.9Å; W169-F212 AromaticContact CZ2-CD2 3.83Å; W169-F212 HydrophobicContact CZ2-CD2 3.83Å; W169-F212 HydrophobicContact CZ2-CG 4.2Å; W169-W215 HydrophobicContact CB-CH2 3.56Å; W169-W215 HydrophobicContact CB-CZ2 3.98Å; W169-W215 HydrophobicContact CB-CZ3 4.41Å; W169-W215 AromaticContact CD1-CZ2 3.8Å; W169-W215 HydrophobicContact CG-CH2 4.3Å; W169-W215 HydrophobicContact CG-CZ2 4.31Å; W169-Y216 HydrophobicContact CB-CD2 4.27Å; W169-Y216 HydrophobicContact CG-CG 4.46Å |
| 170 | M | 92.7 | Very high | 93.4 | Very high | 77 Ų | 77 | 44.7 Ų | 44.7 | 38% | 0.379 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -60.3 | -43.3 | 175.2 | -71.9 | -179.6 | 60.9 | 0 | 0 | 112.2 | Y166 Y167 S172 A173 F174 | Y166-M170 HydrophobicContact CD1-SD 4.12Å; Y166-M170 HydrophobicContact CE1-CG 4.23Å; Y166-M170 HydrophobicContact CE1-SD 3.33Å; Y166-M170 WeakPolarHBondContact CE1-SD 3.32Å; Y166-M170 HydrophobicContact CE2-CG 4.26Å; Y166-M170 HydrophobicContact CE2-SD 4.29Å; Y166-M170 PolarHBondContact O-N 2.84Å; Y166-M170 PolarHBondContact OH-SD 2.94Å; Y166-M170 VanDerWaalsContact OH-SD 3.36Å; Y167-M170 HydrophobicContact CD1-SD 4.03Å; Y167-M170 HydrophobicContact CE1-SD 4.34Å; Y167-M170 PolarHBondContact O-N 2.86Å; M170-S172 PolarHBondContact O-N 3.31Å; M170-A173 PolarHBondContact O-N 3.49Å; M170-F174 WeakPolarHBondContact O-CB 3.35Å; M170-F174 PolarHBondContact O-N 3.03Å |
| 171 | F | 95.3 | Very high | 93.9 | Very high | 50 Ų | 50 | 39.2 Ų | 39.2 | 22% | 0.219 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -61.4 | -35 | 175.8 | 179.1 | -107.9 | 0 | 0 | 0 | 111.8 | Y167 F168 W169 F174 S175 L283 A286 Q287 M290 | Y167-F171 WeakPolarHBondContact O-CB 3.4Å; Y167-F171 PolarHBondContact O-N 3.41Å; F168-F171 PolarHBondContact O-N 3.48Å; W169-F171 VanDerWaalsContact C-N 3.34Å; W169-F171 PolarHBondContact O-N 3.43Å; F171-F174 PolarHBondContact O-N 3.07Å; F171-S175 WeakPolarHBondContact O-CB 3.5Å; F171-S175 PolarHBondContact O-N 3.15Å; F171-S175 PolarHBondContact O-OG 3.47Å; F171-L283 HydrophobicContact CE2-CD2 3.91Å; F171-L283 HydrophobicContact CZ-CD2 3.95Å; F171-A286 HydrophobicContact CZ-CB 4.38Å; F171-Q287 HydrophobicContact CD1-CB 4.28Å; F171-Q287 HydrophobicContact CD1-CG 4.34Å; F171-Q287 HydrophobicContact CE1-CB 3.75Å; F171-Q287 HydrophobicContact CE1-CG 4.29Å; F171-M290 HydrophobicContact CD1-CE 3.5Å; F171-M290 VanDerWaalsContact CD1-CE 3.5Å; F171-M290 HydrophobicContact CE1-CE 3.78Å; F171-M290 HydrophobicContact CG-CE 4.15Å |
| 172 | S | 94.6 | Very high | 94.2 | Very high | 4 Ų | 4 | 38.9 Ų | 38.9 | 3% | 0.028 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -66.4 | -44 | 174.9 | -55.3 | 0 | 0 | 0 | 0 | 112.1 | F168 W169 M170 S175 L176 | F168-S172 PolarHBondContact O-N 2.98Å; F168-S172 PolarHBondContact O-OG 3.28Å; W169-S172 WeakPolarHBondContact O-CB 3.48Å; W169-S172 PolarHBondContact O-N 2.97Å; W169-S172 VanDerWaalsContact O-N 3.11Å; M170-S172 PolarHBondContact O-N 3.31Å; S172-S175 PolarHBondContact O-N 3.46Å; S172-L176 PolarHBondContact O-N 3.43Å; S172-L176 VanDerWaalsContact O-N 3.14Å |
| 173 | A | 94.2 | Very high | 94.4 | Very high | 19 Ų | 19 | 39.1 Ų | 39.1 | 16% | 0.157 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -63.7 | -43.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | W169 M170 S175 L176 V177 T208 | W169-A173 PolarHBondContact O-N 2.89Å; M170-A173 PolarHBondContact O-N 3.49Å; A173-S175 VanDerWaalsContact C-N 3.35Å; A173-S175 PolarHBondContact O-N 2.73Å; A173-L176 PolarHBondContact O-N 3.49Å; A173-V177 WeakPolarHBondContact O-CG2 3.16Å; A173-V177 PolarHBondContact O-N 2.8Å; A173-T208 HydrophobicContact CB-CG2 3.94Å |
| 174 | F | 95.4 | Very high | 94.7 | Very high | 109 Ų | 109 | 40.5 Ų | 40.5 | 48% | 0.478 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -58.4 | -45.1 | 175 | 171.7 | -98 | 0 | 0 | 0 | 111.9 | M170 F171 L176 V177 F178 L283 | M170-F174 WeakPolarHBondContact O-CB 3.35Å; M170-F174 PolarHBondContact O-N 3.03Å; F171-F174 PolarHBondContact O-N 3.07Å; F174-L176 VanDerWaalsContact C-N 3.29Å; F174-L176 PolarHBondContact O-N 3.27Å; F174-V177 PolarHBondContact O-N 3.43Å; F174-V177 VanDerWaalsContact O-N 3.14Å; F174-F178 HydrophobicContact CZ-CD2 4.28Å; F174-F178 PolarHBondContact O-N 2.67Å; F174-L283 HydrophobicContact CE1-CD1 4.08Å |
| 175 | S | 96.6 | Very high | 94.8 | Very high | 0 Ų | 0 | 39.3 Ų | 39.3 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -64.2 | -34 | 179.1 | -59.4 | 0 | 0 | 0 | 0 | 112.2 | F171 S172 A173 F178 N179 Q287 | F171-S175 WeakPolarHBondContact O-CB 3.5Å; F171-S175 PolarHBondContact O-N 3.15Å; F171-S175 PolarHBondContact O-OG 3.47Å; S172-S175 PolarHBondContact O-N 3.46Å; A173-S175 VanDerWaalsContact C-N 3.35Å; A173-S175 PolarHBondContact O-N 2.73Å; S175-F178 PolarHBondContact O-N 3.18Å; S175-N179 WeakPolarHBondContact O-CB 3.4Å; S175-N179 PolarHBondContact O-N 2.93Å; S175-Q287 PolarHBondContact OG-OE1 3.39Å |
| 176 | L | 95.8 | Very high | 94.7 | Very high | 8 Ų | 8 | 40.3 Ų | 40.3 | 4% | 0.042 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -68.1 | -37.9 | 172.8 | -72.9 | 171.3 | 0 | 0 | 0 | 112.6 | S172 A173 F174 N179 L180 A204 F207 M248 F257 | S172-L176 PolarHBondContact O-N 3.43Å; S172-L176 VanDerWaalsContact O-N 3.14Å; A173-L176 PolarHBondContact O-N 3.49Å; F174-L176 VanDerWaalsContact C-N 3.29Å; F174-L176 PolarHBondContact O-N 3.27Å; L176-N179 WeakPolarHBondContact O-CB 3.44Å; L176-N179 PolarHBondContact O-N 3.28Å; L176-L180 PolarHBondContact O-N 3.26Å; L176-A204 HydrophobicContact CB-CB 4.41Å; L176-F207 HydrophobicContact CD1-CB 3.75Å; L176-F207 HydrophobicContact CD2-CD2 4.5Å; L176-M248 HydrophobicContact CD2-CE 3.5Å; L176-M248 HydrophobicContact CG-CE 4.35Å; L176-F257 HydrophobicContact CD2-CE1 4.31Å |
| 177 | V | 95.8 | Very high | 94.8 | Very high | 75 Ų | 75 | 41.8 Ų | 41.8 | 46% | 0.455 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -66.7 | -42.3 | 173.6 | 176 | 0 | 0 | 0 | 0 | 110.9 | A173 F174 N179 L180 I181 | A173-V177 WeakPolarHBondContact O-CG2 3.16Å; A173-V177 PolarHBondContact O-N 2.8Å; F174-V177 PolarHBondContact O-N 3.43Å; F174-V177 VanDerWaalsContact O-N 3.14Å; V177-N179 VanDerWaalsContact C-N 3.29Å; V177-N179 PolarHBondContact O-N 3.1Å; V177-L180 WeakPolarHBondContact O-CB 3.45Å; V177-L180 PolarHBondContact O-N 3.06Å; V177-L180 VanDerWaalsContact O-N 3.16Å; V177-I181 HydrophobicContact CG1-CD1 4.46Å; V177-I181 WeakPolarHBondContact O-CG1 3.42Å; V177-I181 PolarHBondContact O-N 2.92Å |
| 178 | F | 96.8 | Very high | 94.8 | Very high | 44 Ų | 44 | 39.6 Ų | 39.6 | 19% | 0.193 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -63.5 | -37.4 | 175.4 | -163.6 | -85.7 | 0 | 0 | 0 | 111.6 | F174 S175 L180 I181 S182 L279 N280 L283 | F174-F178 HydrophobicContact CZ-CD2 4.28Å; F174-F178 PolarHBondContact O-N 2.67Å; S175-F178 PolarHBondContact O-N 3.18Å; F178-L180 VanDerWaalsContact C-N 3.35Å; F178-I181 PolarHBondContact O-N 3.29Å; F178-S182 WeakPolarHBondContact O-CB 3.02Å; F178-S182 PolarHBondContact O-N 2.91Å; F178-S182 PolarHBondContact O-OG 3.42Å; F178-L279 HydrophobicContact CE1-CB 4.15Å; F178-L279 HydrophobicContact CZ-CB 4.15Å; F178-N280 HydrophobicContact CD1-CB 3.7Å; F178-N280 WeakPolarHBondContact CD1-OD1 3.12Å; F178-N280 HydrophobicContact CE1-CB 3.82Å; F178-L283 HydrophobicContact CB-CD1 4.14Å; F178-L283 HydrophobicContact CD1-CD1 3.76Å; F178-L283 HydrophobicContact CD2-CD1 4.25Å; F178-L283 HydrophobicContact CE1-CD1 4.22Å; F178-L283 HydrophobicContact CG-CD1 3.77Å |
| 179 | N | 97.1 | Very high | 94.6 | Very high | 0 Ų | 0 | 42.3 Ų | 42.3 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -63.4 | -39.7 | 172.5 | -179.5 | 75.4 | 0 | 0 | 0 | 112.3 | S175 L176 V177 S182 S183 G256 S258 N280 F284 | S175-N179 WeakPolarHBondContact O-CB 3.4Å; S175-N179 PolarHBondContact O-N 2.93Å; L176-N179 WeakPolarHBondContact O-CB 3.44Å; L176-N179 PolarHBondContact O-N 3.28Å; V177-N179 VanDerWaalsContact C-N 3.29Å; V177-N179 PolarHBondContact O-N 3.1Å; N179-S182 WeakPolarHBondContact O-CB 3.35Å; N179-S182 PolarHBondContact O-N 3.11Å; N179-S182 VanDerWaalsContact O-N 3.16Å; N179-S183 PolarHBondContact O-N 3.14Å; N179-S183 PolarHBondContact O-OG 2.96Å; N179-G256 PolarHBondContact ND2-O 2.99Å; N179-S258 WeakPolarHBondContact OD1-CB 3.39Å; N179-S258 PolarHBondContact OD1-N 3.33Å; N179-S258 PolarHBondContact OD1-OG 3.1Å; N179-N280 WeakPolarHBondContact CA-OD1 3.31Å; N179-N280 PolarHBondContact N-OD1 3.05Å; N179-N280 PolarHBondContact OD1-ND2 3.42Å; N179-N280 VanDerWaalsContact OD1-ND2 3.16Å; N179-F284 HydrophobicContact CB-CE1 4.31Å; N179-F284 HydrophobicContact CB-CE2 4.37Å; N179-F284 HydrophobicContact CB-CZ 3.58Å |
| 180 | L | 96.2 | Very high | 94.2 | Very high | 49 Ų | 49 | 44 Ų | 44 | 26% | 0.257 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -60.7 | -43.7 | 174.2 | 179.5 | 125.1 | 0 | 0 | 0 | 111.7 | L176 V177 F178 S182 S183 L184 F197 I201 A204 | L176-L180 PolarHBondContact O-N 3.26Å; V177-L180 WeakPolarHBondContact O-CB 3.45Å; V177-L180 PolarHBondContact O-N 3.06Å; V177-L180 VanDerWaalsContact O-N 3.16Å; F178-L180 VanDerWaalsContact C-N 3.35Å; L180-S182 VanDerWaalsContact C-N 3.29Å; L180-S182 PolarHBondContact O-N 3.46Å; L180-S183 PolarHBondContact O-N 3.33Å; L180-L184 VanDerWaalsContact O-CB 3.32Å; L180-L184 WeakPolarHBondContact O-CB 3.46Å; L180-L184 PolarHBondContact O-N 2.93Å; L180-F197 HydrophobicContact CG-CE2 4.43Å; L180-I201 HydrophobicContact CD1-CB 4.09Å; L180-I201 HydrophobicContact CD1-CG1 3.51Å; L180-A204 HydrophobicContact CD1-CB 4.35Å |
| 181 | I | 95.8 | Very high | 94.1 | Very high | 81 Ų | 81 | 45.4 Ų | 45.4 | 42% | 0.415 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -62 | -40.5 | 173.7 | -63.1 | 166.9 | 0 | 0 | 0 | 110.6 | V177 F178 L184 A185 | V177-I181 HydrophobicContact CG1-CD1 4.46Å; V177-I181 WeakPolarHBondContact O-CG1 3.42Å; V177-I181 PolarHBondContact O-N 2.92Å; F178-I181 PolarHBondContact O-N 3.29Å; I181-L184 PolarHBondContact O-N 3.09Å; I181-A185 WeakPolarHBondContact O-CB 3.31Å; I181-A185 PolarHBondContact O-N 3.48Å |
| 182 | S | 94.6 | Very high | 93.8 | Very high | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -64.7 | -45.9 | 178.9 | -54.3 | 0 | 0 | 0 | 0 | 112.9 | F178 N179 L180 L184 A185 M186 L276 N280 | F178-S182 WeakPolarHBondContact O-CB 3.02Å; F178-S182 PolarHBondContact O-N 2.91Å; F178-S182 PolarHBondContact O-OG 3.42Å; N179-S182 WeakPolarHBondContact O-CB 3.35Å; N179-S182 PolarHBondContact O-N 3.11Å; N179-S182 VanDerWaalsContact O-N 3.16Å; L180-S182 VanDerWaalsContact C-N 3.29Å; L180-S182 PolarHBondContact O-N 3.46Å; S182-L184 VanDerWaalsContact C-N 3.34Å; S182-A185 PolarHBondContact O-N 3.03Å; S182-M186 PolarHBondContact O-N 3.03Å; S182-L276 VanDerWaalsContact CB-CD2 3.49Å; S182-L276 WeakPolarHBondContact OG-CD2 3.33Å; S182-N280 WeakPolarHBondContact OG-CB 3.47Å |
| 183 | S | 94.4 | Very high | 93.4 | Very high | 6 Ų | 6 | 50 Ų | 50 | 4% | 0.042 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -70.1 | -31.2 | 176.8 | -59.8 | 0 | 0 | 0 | 0 | 112.2 | N179 L180 M186 F187 S258 | N179-S183 PolarHBondContact O-N 3.14Å; N179-S183 PolarHBondContact O-OG 2.96Å; L180-S183 PolarHBondContact O-N 3.33Å; S183-M186 PolarHBondContact O-N 3.28Å; S183-F187 WeakPolarHBondContact O-CB 3.46Å; S183-F187 PolarHBondContact O-N 3.16Å; S183-S258 PolarHBondContact OG-OG 2.85Å |
| 184 | L | 94.8 | Very high | 93.2 | Very high | 71 Ų | 71 | 50.3 Ų | 50.3 | 37% | 0.372 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -64 | -48.3 | 170.6 | 177.8 | 60.3 | 0 | 0 | 0 | 111.2 | L180 I181 S182 M186 F187 C188 F197 | L180-L184 VanDerWaalsContact O-CB 3.32Å; L180-L184 WeakPolarHBondContact O-CB 3.46Å; L180-L184 PolarHBondContact O-N 2.93Å; I181-L184 PolarHBondContact O-N 3.09Å; S182-L184 VanDerWaalsContact C-N 3.34Å; L184-M186 VanDerWaalsContact C-N 3.26Å; L184-M186 PolarHBondContact O-N 2.96Å; L184-F187 PolarHBondContact O-N 3.26Å; L184-F187 VanDerWaalsContact O-N 3.15Å; L184-C188 PolarHBondContact O-N 2.86Å; L184-C188 PolarHBondContact O-SG 2.96Å; L184-C188 VanDerWaalsContact O-SG 3.32Å; L184-F197 HydrophobicContact CB-CD2 3.99Å; L184-F197 HydrophobicContact CB-CE2 3.69Å; L184-F197 HydrophobicContact CB-CZ 4.4Å; L184-F197 HydrophobicContact CD1-CD2 4.45Å; L184-F197 HydrophobicContact CD1-CE1 4.2Å; L184-F197 HydrophobicContact CD1-CE2 3.91Å; L184-F197 HydrophobicContact CD1-CZ 3.76Å; L184-F197 HydrophobicContact CG-CE2 4.31Å |
| 185 | A | 93.7 | Very high | 93 | Very high | 27 Ų | 27 | 49 Ų | 49 | 22% | 0.223 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -59.2 | -39.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | I181 S182 C188 A189 V273 L276 | I181-A185 WeakPolarHBondContact O-CB 3.31Å; I181-A185 PolarHBondContact O-N 3.48Å; S182-A185 PolarHBondContact O-N 3.03Å; A185-C188 PolarHBondContact O-N 3.22Å; A185-A189 PolarHBondContact O-N 3.32Å; A185-A189 VanDerWaalsContact O-N 3.1Å; A185-V273 HydrophobicContact CB-CG1 4.11Å; A185-L276 HydrophobicContact CB-CD2 4.49Å |
| 186 | M | 91.9 | Very high | 92.8 | Very high | 21 Ų | 21 | 49.6 Ų | 49.6 | 10% | 0.103 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -65.1 | -43.4 | 174.3 | -172.7 | -177.5 | -129.3 | 0 | 0 | 112.7 | S182 S183 L184 C188 A189 D190 N193 V262 L266 V273 M277 | S182-M186 PolarHBondContact O-N 3.03Å; S183-M186 PolarHBondContact O-N 3.28Å; L184-M186 VanDerWaalsContact C-N 3.26Å; L184-M186 PolarHBondContact O-N 2.96Å; M186-C188 VanDerWaalsContact C-N 3.34Å; M186-A189 PolarHBondContact O-N 3.42Å; M186-D190 PolarHBondContact O-N 2.84Å; M186-N193 HydrophobicContact CG-CB 4.13Å; M186-N193 HydrophobicContact SD-CB 4.32Å; M186-V262 HydrophobicContact CE-CG1 3.42Å; M186-V262 VanDerWaalsContact CE-CG1 3.42Å; M186-V262 HydrophobicContact SD-CG1 4.16Å; M186-L266 HydrophobicContact CE-CB 4.16Å; M186-L266 HydrophobicContact CE-CD1 3.85Å; M186-L266 HydrophobicContact CE-CD2 3.69Å; M186-L266 HydrophobicContact CE-CG 4.1Å; M186-L266 HydrophobicContact CG-CD2 4.05Å; M186-V273 HydrophobicContact CB-CG1 4.13Å; M186-M277 HydrophobicContact CB-SD 4.37Å; M186-M277 HydrophobicContact CE-CE 3.58Å; M186-M277 HydrophobicContact CE-SD 3.69Å; M186-M277 HydrophobicContact CG-SD 4.43Å; M186-M277 HydrophobicContact SD-CE 3.65Å; M186-M277 HydrophobicContact SD-SD 4.07Å |
| 187 | F | 93.3 | Very high | 92.8 | Very high | 67 Ų | 67 | 51.5 Ų | 51.5 | 29% | 0.294 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -64.3 | -38 | 176 | 174.9 | -114.6 | 0 | 0 | 0 | 112.6 | S183 L184 A189 D190 T191 F197 | S183-F187 WeakPolarHBondContact O-CB 3.46Å; S183-F187 PolarHBondContact O-N 3.16Å; L184-F187 PolarHBondContact O-N 3.26Å; L184-F187 VanDerWaalsContact O-N 3.15Å; F187-A189 VanDerWaalsContact C-N 3.3Å; F187-A189 PolarHBondContact O-N 2.86Å; F187-D190 CarbonylContact O-C 3.22Å; F187-D190 VanDerWaalsContact O-C 3.22Å; F187-D190 PolarHBondContact O-N 3.37Å; F187-T191 HydrophobicContact CE2-CG2 4.47Å; F187-T191 WeakPolarHBondContact CE2-O 3.27Å; F187-T191 PolarHBondContact O-N 2.96Å; F187-F197 HydrophobicContact CB-CB 3.94Å; F187-F197 HydrophobicContact CB-CG 4.35Å; F187-F197 HydrophobicContact CD1-CD1 4.09Å; F187-F197 HydrophobicContact CG-CB 4.27Å; F187-F197 HydrophobicContact CG-CD1 4.4Å |
| 188 | C | 91.9 | Very high | 92.7 | Very high | 98 Ų | 98 | 49.7 Ų | 49.7 | 66% | 0.662 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -66.9 | -30.9 | 174.6 | -68.6 | 0 | 0 | 0 | 0 | 112.8 | L184 A185 M186 | L184-C188 PolarHBondContact O-N 2.86Å; L184-C188 PolarHBondContact O-SG 2.96Å; L184-C188 VanDerWaalsContact O-SG 3.32Å; A185-C188 PolarHBondContact O-N 3.22Å; M186-C188 VanDerWaalsContact C-N 3.34Å |
| 189 | A | 90.2 | Very high | 92.7 | Very high | 59 Ų | 59 | 50 Ų | 50 | 49% | 0.488 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -78.5 | -34.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | A185 M186 F187 V273 | A185-A189 PolarHBondContact O-N 3.32Å; A185-A189 VanDerWaalsContact O-N 3.1Å; M186-A189 PolarHBondContact O-N 3.42Å; F187-A189 VanDerWaalsContact C-N 3.3Å; F187-A189 PolarHBondContact O-N 2.86Å; A189-V273 HydrophobicContact CB-CG2 4Å |
| 190 | D | 88.2 | Confident | 92.6 | Very high | 58 Ų | 58 | 50 Ų | 50 | 31% | 0.31 | 31% | 0.312 | S | S | . | . | trans | -150.6 | 110 | 178.4 | -179.8 | -7.2 | 0 | 0 | 0 | 110.3 | M186 F187 T192 N193 | M186-D190 PolarHBondContact O-N 2.84Å; F187-D190 CarbonylContact O-C 3.22Å; F187-D190 VanDerWaalsContact O-C 3.22Å; F187-D190 PolarHBondContact O-N 3.37Å; D190-T192 PolarHBondContact O-N 3.48Å; D190-T192 VanDerWaalsContact O-N 3.14Å; D190-T192 WeakPolarHBondContact OD1-CB 3.26Å; D190-T192 WeakPolarHBondContact OD1-CG2 3.18Å; D190-T192 PolarHBondContact OD1-N 3.48Å; D190-T192 PolarHBondContact OD1-OG1 2.95Å; D190-T192 PolarHBondContact OD2-OG1 3.32Å; D190-N193 WeakPolarHBondContact CB-ND2 3.43Å; D190-N193 WeakPolarHBondContact O-CB 3.32Å; D190-N193 PolarHBondContact O-N 3.06Å; D190-N193 VanDerWaalsContact O-N 3.09Å; D190-N193 PolarHBondContact O-ND2 2.92Å; D190-N193 VanDerWaalsContact O-ND2 3.14Å | ||
| 191 | T | 89.3 | Confident | 92.6 | Very high | 107 Ų | 107 | 50.6 Ų | 50.6 | 66% | 0.656 | 31% | 0.314 | S | S | * | . | G | 310 helix | trans | -65.9 | -15.6 | -174.3 | 54.1 | 0 | 0 | 0 | 0 | 113.5 | F187 N193 G194 | F187-T191 HydrophobicContact CE2-CG2 4.47Å; F187-T191 WeakPolarHBondContact CE2-O 3.27Å; F187-T191 PolarHBondContact O-N 2.96Å; T191-N193 PolarHBondContact O-N 3.26Å; T191-G194 PolarHBondContact O-N 2.84Å |
| 192 | T | 88.8 | Confident | 92.5 | Very high | 106 Ų | 106 | 51 Ų | 51 | 65% | 0.65 | 32% | 0.317 | S | S | * | . | G | 310 helix | trans | -64.2 | -20 | 173.3 | 64.6 | 0 | 0 | 0 | 0 | 112.6 | D190 G194 | D190-T192 PolarHBondContact O-N 3.48Å; D190-T192 VanDerWaalsContact O-N 3.14Å; D190-T192 WeakPolarHBondContact OD1-CB 3.26Å; D190-T192 WeakPolarHBondContact OD1-CG2 3.18Å; D190-T192 PolarHBondContact OD1-N 3.48Å; D190-T192 PolarHBondContact OD1-OG1 2.95Å; D190-T192 PolarHBondContact OD2-OG1 3.32Å; T192-G194 PolarHBondContact O-N 2.95Å |
| 193 | N | 87.1 | Confident | 92.5 | Very high | 46 Ų | 46 | 53.6 Ų | 53.6 | 25% | 0.246 | 33% | 0.327 | C | S | . | . | G | 310 helix | trans | -84.6 | 15.3 | 178.8 | -61.2 | -76.4 | 0 | 0 | 0 | 114 | M186 D190 T191 S195 G196 F197 | M186-N193 HydrophobicContact CG-CB 4.13Å; M186-N193 HydrophobicContact SD-CB 4.32Å; D190-N193 WeakPolarHBondContact CB-ND2 3.43Å; D190-N193 WeakPolarHBondContact O-CB 3.32Å; D190-N193 PolarHBondContact O-N 3.06Å; D190-N193 VanDerWaalsContact O-N 3.09Å; D190-N193 PolarHBondContact O-ND2 2.92Å; D190-N193 VanDerWaalsContact O-ND2 3.14Å; T191-N193 PolarHBondContact O-N 3.26Å; N193-S195 VanDerWaalsContact C-N 3.27Å; N193-S195 PolarHBondContact O-N 2.93Å; N193-G196 PolarHBondContact O-N 3.31Å; N193-F197 PolarHBondContact O-N 3.23Å |
| 194 | G | 89.7 | Confident | 92.4 | Very high | 25 Ų | 25 | 54 Ų | 54 | 26% | 0.258 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -58.9 | -33.4 | -177.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | T191 T192 G196 F197 G198 | T191-G194 PolarHBondContact O-N 2.84Å; T192-G194 PolarHBondContact O-N 2.95Å; G194-G196 PolarHBondContact O-N 2.99Å; G194-F197 PolarHBondContact O-N 3.5Å; G194-G198 PolarHBondContact O-N 2.77Å |
| 195 | S | 92.2 | Very high | 92.3 | Very high | 80 Ų | 80 | 56.7 Ų | 56.7 | 56% | 0.559 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -64.1 | -39 | 174.5 | 56.7 | 0 | 0 | 0 | 0 | 112.4 | N193 G198 L199 | N193-S195 VanDerWaalsContact C-N 3.27Å; N193-S195 PolarHBondContact O-N 2.93Å; S195-G198 PolarHBondContact O-N 3.46Å; S195-L199 WeakPolarHBondContact O-CB 3.37Å; S195-L199 WeakPolarHBondContact O-CG 3.13Å; S195-L199 PolarHBondContact O-N 3.33Å |
| 196 | G | 92.2 | Very high | 92.3 | Very high | 14 Ų | 14 | 59.5 Ų | 59.5 | 14% | 0.144 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -63.8 | -42.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | N193 G194 S200 G256 | N193-G196 PolarHBondContact O-N 3.31Å; G194-G196 PolarHBondContact O-N 2.99Å; G196-S200 PolarHBondContact O-N 3.22Å; G196-G256 WeakPolarHBondContact O-CA 3.25Å |
| 197 | F | 94.9 | Very high | 92.2 | Very high | 47 Ų | 47 | 60.2 Ų | 60.2 | 21% | 0.206 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -64.2 | -47 | 174 | 176.7 | -123.7 | 0 | 0 | 0 | 112.2 | L180 L184 F187 N193 G194 L199 S200 I201 | L180-F197 HydrophobicContact CG-CE2 4.43Å; L184-F197 HydrophobicContact CB-CD2 3.99Å; L184-F197 HydrophobicContact CB-CE2 3.69Å; L184-F197 HydrophobicContact CB-CZ 4.4Å; L184-F197 HydrophobicContact CD1-CD2 4.45Å; L184-F197 HydrophobicContact CD1-CE1 4.2Å; L184-F197 HydrophobicContact CD1-CE2 3.91Å; L184-F197 HydrophobicContact CD1-CZ 3.76Å; L184-F197 HydrophobicContact CG-CE2 4.31Å; F187-F197 HydrophobicContact CB-CB 3.94Å; F187-F197 HydrophobicContact CB-CG 4.35Å; F187-F197 HydrophobicContact CD1-CD1 4.09Å; F187-F197 HydrophobicContact CG-CB 4.27Å; F187-F197 HydrophobicContact CG-CD1 4.4Å; N193-F197 PolarHBondContact O-N 3.23Å; G194-F197 PolarHBondContact O-N 3.5Å; F197-L199 VanDerWaalsContact C-N 3.33Å; F197-L199 PolarHBondContact O-N 3.44Å; F197-S200 WeakPolarHBondContact O-CB 3.5Å; F197-S200 PolarHBondContact O-N 2.77Å; F197-S200 VanDerWaalsContact O-N 3.1Å; F197-S200 PolarHBondContact O-OG 3.45Å; F197-I201 HydrophobicContact CD1-CD1 4.25Å; F197-I201 HydrophobicContact CD2-CD1 4.49Å; F197-I201 HydrophobicContact CE1-CD1 3.79Å; F197-I201 HydrophobicContact CE2-CD1 4.04Å; F197-I201 HydrophobicContact CE2-CG1 4.14Å; F197-I201 HydrophobicContact CZ-CD1 3.67Å; F197-I201 HydrophobicContact CZ-CG1 4.24Å; F197-I201 PolarHBondContact O-N 2.75Å; F197-I201 VanDerWaalsContact O-N 3.15Å |
| 198 | G | 94.5 | Very high | 92 | Very high | 38 Ų | 38 | 58.7 Ų | 58.7 | 39% | 0.392 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -57.7 | -43.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | G194 S195 I201 L202 | G194-G198 PolarHBondContact O-N 2.77Å; S195-G198 PolarHBondContact O-N 3.46Å; G198-I201 PolarHBondContact O-N 3.26Å; G198-L202 PolarHBondContact O-N 2.81Å; G198-L202 VanDerWaalsContact O-N 3.07Å |
| 199 | L | 95.2 | Very high | 91.9 | Very high | 49 Ų | 49 | 57.5 Ų | 57.5 | 26% | 0.257 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -65.2 | -38.2 | 174.8 | -77.3 | 167.5 | 0 | 0 | 0 | 112.2 | S195 F197 I201 L202 W203 G254 | S195-L199 WeakPolarHBondContact O-CB 3.37Å; S195-L199 WeakPolarHBondContact O-CG 3.13Å; S195-L199 PolarHBondContact O-N 3.33Å; F197-L199 VanDerWaalsContact C-N 3.33Å; F197-L199 PolarHBondContact O-N 3.44Å; L199-I201 VanDerWaalsContact C-N 3.28Å; L199-I201 PolarHBondContact O-N 2.98Å; L199-L202 HydrophobicContact CD2-CD2 4.18Å; L199-L202 WeakPolarHBondContact O-CB 3.18Å; L199-L202 PolarHBondContact O-N 3.46Å; L199-W203 HydrophobicContact CD2-CZ2 4.08Å; L199-W203 WeakPolarHBondContact O-CB 3.4Å; L199-W203 PolarHBondContact O-N 3.4Å; L199-G254 WeakPolarHBondContact CD1-O 3.44Å |
| 200 | S | 95.4 | Very high | 91.9 | Very high | 1 Ų | 1 | 57.1 Ų | 57.1 | 1% | 0.007 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -60.5 | -37.7 | 176.1 | 78.7 | 0 | 0 | 0 | 0 | 112.6 | G196 F197 A204 | G196-S200 PolarHBondContact O-N 3.22Å; F197-S200 WeakPolarHBondContact O-CB 3.5Å; F197-S200 PolarHBondContact O-N 2.77Å; F197-S200 VanDerWaalsContact O-N 3.1Å; F197-S200 PolarHBondContact O-OG 3.45Å; S200-A204 WeakPolarHBondContact O-CB 3.37Å; S200-A204 PolarHBondContact O-N 3.21Å |
| 201 | I | 95.7 | Very high | 92 | Very high | 61 Ų | 61 | 54.7 Ų | 54.7 | 31% | 0.313 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -65.2 | -50.3 | 173.5 | -62.6 | 161.5 | 0 | 0 | 0 | 110.1 | L180 F197 G198 L199 W203 A204 L205 | L180-I201 HydrophobicContact CD1-CB 4.09Å; L180-I201 HydrophobicContact CD1-CG1 3.51Å; F197-I201 HydrophobicContact CD1-CD1 4.25Å; F197-I201 HydrophobicContact CD2-CD1 4.49Å; F197-I201 HydrophobicContact CE1-CD1 3.79Å; F197-I201 HydrophobicContact CE2-CD1 4.04Å; F197-I201 HydrophobicContact CE2-CG1 4.14Å; F197-I201 HydrophobicContact CZ-CD1 3.67Å; F197-I201 HydrophobicContact CZ-CG1 4.24Å; F197-I201 PolarHBondContact O-N 2.75Å; F197-I201 VanDerWaalsContact O-N 3.15Å; G198-I201 PolarHBondContact O-N 3.26Å; L199-I201 VanDerWaalsContact C-N 3.28Å; L199-I201 PolarHBondContact O-N 2.98Å; I201-W203 VanDerWaalsContact C-N 3.31Å; I201-W203 PolarHBondContact O-N 3.05Å; I201-A204 PolarHBondContact O-N 3.21Å; I201-L205 HydrophobicContact CG2-CD1 3.94Å; I201-L205 HydrophobicContact CG2-CG 4.42Å; I201-L205 WeakPolarHBondContact O-CG 3.44Å; I201-L205 PolarHBondContact O-N 3.14Å |
| 202 | L | 95.6 | Very high | 92 | Very high | 89 Ų | 89 | 50.3 Ų | 50.3 | 47% | 0.466 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -55.8 | -47.6 | 178.9 | 179.2 | 66.8 | 0 | 0 | 0 | 111 | G198 L199 L205 L206 | G198-L202 PolarHBondContact O-N 2.81Å; G198-L202 VanDerWaalsContact O-N 3.07Å; L199-L202 HydrophobicContact CD2-CD2 4.18Å; L199-L202 WeakPolarHBondContact O-CB 3.18Å; L199-L202 PolarHBondContact O-N 3.46Å; L202-L205 PolarHBondContact O-N 3.47Å; L202-L206 WeakPolarHBondContact O-CB 3.44Å; L202-L206 PolarHBondContact O-N 3.36Å |
| 203 | W | 93.8 | Very high | 91.9 | Very high | 56 Ų | 56 | 49.6 Ų | 49.6 | 21% | 0.212 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -66 | -42 | 179.3 | -60.2 | 136.7 | 0 | 0 | 0 | 112.4 | L199 I201 L205 L206 F207 S255 F257 | L199-W203 HydrophobicContact CD2-CZ2 4.08Å; L199-W203 WeakPolarHBondContact O-CB 3.4Å; L199-W203 PolarHBondContact O-N 3.4Å; I201-W203 VanDerWaalsContact C-N 3.31Å; I201-W203 PolarHBondContact O-N 3.05Å; W203-L205 VanDerWaalsContact C-N 3.31Å; W203-L205 PolarHBondContact O-N 3.49Å; W203-L206 HydrophobicContact CE3-CD2 4.33Å; W203-L206 HydrophobicContact CZ3-CD2 4.09Å; W203-L206 PolarHBondContact O-N 3.47Å; W203-F207 HydrophobicContact CB-CD2 4.22Å; W203-F207 HydrophobicContact CB-CE2 4.47Å; W203-F207 HydrophobicContact CD2-CE2 4.25Å; W203-F207 HydrophobicContact CD2-CZ 4.23Å; W203-F207 HydrophobicContact CE3-CD1 4.26Å; W203-F207 HydrophobicContact CE3-CD2 4.45Å; W203-F207 AromaticContact CE3-CE1 3.72Å; W203-F207 HydrophobicContact CE3-CE1 3.72Å; W203-F207 AromaticContact CE3-CE2 3.96Å; W203-F207 HydrophobicContact CE3-CE2 3.96Å; W203-F207 AromaticContact CE3-CZ 3.55Å; W203-F207 HydrophobicContact CE3-CZ 3.55Å; W203-F207 HydrophobicContact CG-CE2 4.47Å; W203-F207 AromaticContact CZ3-CE1 3.94Å; W203-F207 HydrophobicContact CZ3-CE1 3.94Å; W203-F207 AromaticContact CZ3-CZ 3.86Å; W203-F207 HydrophobicContact CZ3-CZ 3.86Å; W203-F207 VanDerWaalsContact O-CB 3.24Å; W203-F207 WeakPolarHBondContact O-CB 3.24Å; W203-F207 PolarHBondContact O-N 2.91Å; W203-S255 PolarHBondContact NE1-O 3.35Å; W203-F257 HydrophobicContact CB-CE1 4.02Å; W203-F257 HydrophobicContact CB-CZ 4.18Å; W203-F257 AromaticContact CD1-CE1 3.59Å; W203-F257 AromaticContact CD1-CZ 3.44Å; W203-F257 VanDerWaalsContact CD1-CZ 3.44Å; W203-F257 HydrophobicContact CD2-CZ 4.12Å; W203-F257 AromaticContact CG-CE1 3.89Å; W203-F257 HydrophobicContact CG-CE1 3.89Å; W203-F257 AromaticContact CG-CZ 3.66Å; W203-F257 HydrophobicContact CG-CZ 3.66Å; W203-F257 AromaticContact NE1-CZ 3.78Å |
| 204 | A | 93.1 | Very high | 91.9 | Very high | 15 Ų | 15 | 49.5 Ų | 49.5 | 12% | 0.124 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -59.9 | -42.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | L176 L180 S200 I201 T208 | L176-A204 HydrophobicContact CB-CB 4.41Å; L180-A204 HydrophobicContact CD1-CB 4.35Å; S200-A204 WeakPolarHBondContact O-CB 3.37Å; S200-A204 PolarHBondContact O-N 3.21Å; I201-A204 PolarHBondContact O-N 3.21Å; A204-T208 VanDerWaalsContact O-CB 3.27Å; A204-T208 WeakPolarHBondContact O-CB 3.4Å; A204-T208 PolarHBondContact O-OG1 2.87Å |
| 205 | L | 92.4 | Very high | 91.9 | Very high | 126 Ų | 126 | 48.3 Ų | 48.3 | 66% | 0.66 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -76.9 | -33.5 | 179.8 | -66.8 | 179.5 | 0 | 0 | 0 | 113.6 | I201 L202 W203 P209 | I201-L205 HydrophobicContact CG2-CD1 3.94Å; I201-L205 HydrophobicContact CG2-CG 4.42Å; I201-L205 WeakPolarHBondContact O-CG 3.44Å; I201-L205 PolarHBondContact O-N 3.14Å; L202-L205 PolarHBondContact O-N 3.47Å; W203-L205 VanDerWaalsContact C-N 3.31Å; W203-L205 PolarHBondContact O-N 3.49Å; L205-P209 WeakPolarHBondContact O-CD 3.47Å; L205-P209 WeakPolarHBondContact O-CG 3.41Å |
| 206 | L | 92.2 | Very high | 91.9 | Very high | 86 Ų | 86 | 44.5 Ų | 44.5 | 45% | 0.45 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -84.6 | -50.3 | -178 | -177.8 | 64.5 | 0 | 0 | 0 | 112 | L202 W203 P209 C210 | L202-L206 WeakPolarHBondContact O-CB 3.44Å; L202-L206 PolarHBondContact O-N 3.36Å; W203-L206 HydrophobicContact CE3-CD2 4.33Å; W203-L206 HydrophobicContact CZ3-CD2 4.09Å; W203-L206 PolarHBondContact O-N 3.47Å; L206-P209 WeakPolarHBondContact O-CD 3.37Å; L206-C210 WeakPolarHBondContact O-CB 3.3Å; L206-C210 PolarHBondContact O-N 2.78Å; L206-C210 VanDerWaalsContact O-N 3.14Å |
| 207 | F | 91.1 | Very high | 91.6 | Very high | 37 Ų | 37 | 46.9 Ų | 46.9 | 16% | 0.162 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -73.1 | -30.2 | -173 | -71.7 | -11.7 | 0 | 0 | 0 | 112.9 | L176 W203 S211 V244 F257 | L176-F207 HydrophobicContact CD1-CB 3.75Å; L176-F207 HydrophobicContact CD2-CD2 4.5Å; W203-F207 HydrophobicContact CB-CD2 4.22Å; W203-F207 HydrophobicContact CB-CE2 4.47Å; W203-F207 HydrophobicContact CD2-CE2 4.25Å; W203-F207 HydrophobicContact CD2-CZ 4.23Å; W203-F207 HydrophobicContact CE3-CD1 4.26Å; W203-F207 HydrophobicContact CE3-CD2 4.45Å; W203-F207 AromaticContact CE3-CE1 3.72Å; W203-F207 HydrophobicContact CE3-CE1 3.72Å; W203-F207 AromaticContact CE3-CE2 3.96Å; W203-F207 HydrophobicContact CE3-CE2 3.96Å; W203-F207 AromaticContact CE3-CZ 3.55Å; W203-F207 HydrophobicContact CE3-CZ 3.55Å; W203-F207 HydrophobicContact CG-CE2 4.47Å; W203-F207 AromaticContact CZ3-CE1 3.94Å; W203-F207 HydrophobicContact CZ3-CE1 3.94Å; W203-F207 AromaticContact CZ3-CZ 3.86Å; W203-F207 HydrophobicContact CZ3-CZ 3.86Å; W203-F207 VanDerWaalsContact O-CB 3.24Å; W203-F207 WeakPolarHBondContact O-CB 3.24Å; W203-F207 PolarHBondContact O-N 2.91Å; F207-S211 WeakPolarHBondContact O-CB 3.4Å; F207-S211 PolarHBondContact O-N 3.28Å; F207-S211 PolarHBondContact O-OG 3.48Å; F207-V244 HydrophobicContact CE2-CG1 3.83Å; F207-V244 HydrophobicContact CZ-CG1 4.2Å; F207-F257 HydrophobicContact CD2-CZ 4.43Å; F207-F257 AromaticContact CE2-CZ 3.76Å; F207-F257 HydrophobicContact CE2-CZ 3.76Å |
| 208 | T | 89.5 | Confident | 91.3 | Very high | 35 Ų | 35 | 45.2 Ų | 45.2 | 22% | 0.215 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -62.3 | -55.3 | 178.4 | -56.2 | 0 | 0 | 0 | 0 | 112.9 | W169 A173 A204 S211 F212 | W169-T208 HydrophobicContact CZ2-CG2 4.2Å; A173-T208 HydrophobicContact CB-CG2 3.94Å; A204-T208 VanDerWaalsContact O-CB 3.27Å; A204-T208 WeakPolarHBondContact O-CB 3.4Å; A204-T208 PolarHBondContact O-OG1 2.87Å; T208-S211 PolarHBondContact O-OG 3.04Å; T208-F212 PolarHBondContact O-N 3.48Å |
| 209 | P | 89.2 | Confident | 91 | Very high | 72 Ų | 72 | 43.5 Ų | 43.5 | 47% | 0.468 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -71.2 | -36.1 | 176.3 | 27.9 | -34.6 | 0 | 0 | 0 | 112.5 | L205 L206 F212 V213 | L205-P209 WeakPolarHBondContact O-CD 3.47Å; L205-P209 WeakPolarHBondContact O-CG 3.41Å; L206-P209 WeakPolarHBondContact O-CD 3.37Å; P209-F212 WeakPolarHBondContact O-CB 3.28Å; P209-F212 PolarHBondContact O-N 2.8Å; P209-V213 WeakPolarHBondContact O-CG2 3.17Å; P209-V213 PolarHBondContact O-N 2.93Å; P209-V213 VanDerWaalsContact O-N 3.1Å |
| 210 | C | 89.1 | Confident | 90.6 | Very high | 52 Ų | 52 | 41.7 Ų | 41.7 | 35% | 0.351 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -62.3 | -49.6 | 178.2 | -177.6 | 0 | 0 | 0 | 0 | 111.2 | L206 F212 V213 C214 | L206-C210 WeakPolarHBondContact O-CB 3.3Å; L206-C210 PolarHBondContact O-N 2.78Å; L206-C210 VanDerWaalsContact O-N 3.14Å; C210-F212 VanDerWaalsContact C-N 3.25Å; C210-F212 PolarHBondContact O-N 3.31Å; C210-V213 PolarHBondContact O-N 3.43Å; C210-C214 WeakPolarHBondContact O-CB 3.39Å; C210-C214 PolarHBondContact O-N 2.67Å; C210-C214 PolarHBondContact O-SG 2.78Å |
| 211 | S | 90.8 | Very high | 90 | Very high | 7 Ų | 7 | 47.1 Ų | 47.1 | 5% | 0.049 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -58 | -38.3 | 177.2 | 60.7 | 0 | 0 | 0 | 0 | 112.7 | W169 F207 T208 W215 Y216 | W169-S211 PolarHBondContact NE1-OG 3.42Å; W169-S211 VanDerWaalsContact NE1-OG 3.15Å; F207-S211 WeakPolarHBondContact O-CB 3.4Å; F207-S211 PolarHBondContact O-N 3.28Å; F207-S211 PolarHBondContact O-OG 3.48Å; T208-S211 PolarHBondContact O-OG 3.04Å; S211-W215 PolarHBondContact O-N 3.06Å; S211-W215 PolarHBondContact O-NE1 2.78Å; S211-Y216 PolarHBondContact O-N 2.81Å |
| 212 | F | 88.6 | Confident | 89.6 | Confident | 14 Ų | 14 | 44.2 Ų | 44.2 | 6% | 0.061 | 24% | 0.235 | C | C | . | . | I | π-helix | trans | -62.2 | -49.3 | 176.9 | -177.4 | -103.8 | 0 | 0 | 0 | 111.6 | W133 W169 T208 P209 C210 Y216 R217 | W133-F212 HydrophobicContact CE3-CE2 4.19Å; W133-F212 AromaticContact CE3-CZ 3.96Å; W133-F212 HydrophobicContact CE3-CZ 3.96Å; W133-F212 AromaticContact CH2-CD2 3.73Å; W133-F212 HydrophobicContact CH2-CD2 3.73Å; W133-F212 AromaticContact CH2-CE2 3.31Å; W133-F212 HydrophobicContact CH2-CE2 3.31Å; W133-F212 AromaticContact CH2-CZ 3.82Å; W133-F212 HydrophobicContact CH2-CZ 3.82Å; W133-F212 HydrophobicContact CZ2-CE2 4.03Å; W133-F212 HydrophobicContact CZ3-CD2 4.13Å; W133-F212 HydrophobicContact CZ3-CE1 4.05Å; W133-F212 AromaticContact CZ3-CE2 3.42Å; W133-F212 HydrophobicContact CZ3-CE2 3.42Å; W133-F212 VanDerWaalsContact CZ3-CE2 3.42Å; W133-F212 AromaticContact CZ3-CZ 3.38Å; W133-F212 HydrophobicContact CZ3-CZ 3.38Å; W169-F212 HydrophobicContact CD2-CD2 4.22Å; W169-F212 AromaticContact CE2-CD2 3.79Å; W169-F212 HydrophobicContact CH2-CD2 4.35Å; W169-F212 HydrophobicContact CZ2-CB 3.9Å; W169-F212 AromaticContact CZ2-CD2 3.83Å; W169-F212 HydrophobicContact CZ2-CD2 3.83Å; W169-F212 HydrophobicContact CZ2-CG 4.2Å; T208-F212 PolarHBondContact O-N 3.48Å; P209-F212 WeakPolarHBondContact O-CB 3.28Å; P209-F212 PolarHBondContact O-N 2.8Å; C210-F212 VanDerWaalsContact C-N 3.25Å; C210-F212 PolarHBondContact O-N 3.31Å; F212-Y216 AromaticContact CD2-CD1 3.45Å; F212-Y216 HydrophobicContact CD2-CD1 3.45Å; F212-Y216 VanDerWaalsContact CD2-CD1 3.45Å; F212-Y216 HydrophobicContact CD2-CE1 4.11Å; F212-Y216 HydrophobicContact CD2-CG 4.24Å; F212-Y216 AromaticContact CE2-CD1 3.31Å; F212-Y216 HydrophobicContact CE2-CD1 3.31Å; F212-Y216 AromaticContact CE2-CE1 3.51Å; F212-Y216 HydrophobicContact CE2-CE1 3.51Å; F212-Y216 HydrophobicContact CE2-CG 4.45Å; F212-Y216 HydrophobicContact CG-CD1 4.42Å; F212-Y216 HydrophobicContact CZ-CD1 4.2Å; F212-Y216 HydrophobicContact CZ-CE1 4.3Å; F212-Y216 PolarHBondContact O-N 3.25Å; F212-R217 HydrophobicContact CD1-CG 4.16Å; F212-R217 HydrophobicContact CE1-CG 3.96Å; F212-R217 HydrophobicContact CZ-CG 4.35Å; F212-R217 WeakPolarHBondContact O-CB 3.32Å; F212-R217 VanDerWaalsContact O-CG 3.26Å; F212-R217 WeakPolarHBondContact O-CG 3.32Å; F212-R217 PolarHBondContact O-N 3.05Å |
| 213 | V | 87.6 | Confident | 89 | Confident | 92 Ų | 92 | 40.4 Ų | 40.4 | 56% | 0.558 | 22% | 0.215 | S | C | * | . | I | π-helix | trans | -75.2 | -40.3 | -177.1 | 176.5 | 0 | 0 | 0 | 0 | 111.9 | P209 C210 P218 | P209-V213 WeakPolarHBondContact O-CG2 3.17Å; P209-V213 PolarHBondContact O-N 2.93Å; P209-V213 VanDerWaalsContact O-N 3.1Å; C210-V213 PolarHBondContact O-N 3.43Å; V213-P218 WeakPolarHBondContact O-CD 3.25Å |
| 214 | C | 86.6 | Confident | 88.4 | Confident | 43 Ų | 43 | 43.8 Ų | 43.8 | 29% | 0.291 | 23% | 0.228 | S | C | . | . | I | π-helix | trans | -85.3 | -26.8 | -167.5 | -64.8 | 0 | 0 | 0 | 0 | 113.2 | C210 P218 I237 | C210-C214 WeakPolarHBondContact O-CB 3.39Å; C210-C214 PolarHBondContact O-N 2.67Å; C210-C214 PolarHBondContact O-SG 2.78Å; C214-P218 WeakPolarHBondContact O-CG 3.21Å; C214-I237 HydrophobicContact CB-CD1 4.49Å; C214-I237 HydrophobicContact CB-CG2 3.87Å; C214-I237 WeakPolarHBondContact O-CD1 3.24Å; C214-I237 WeakPolarHBondContact O-CG2 3.49Å |
| 215 | W | 91.2 | Very high | 87.5 | Confident | 0 Ų | 0 | 46.4 Ų | 46.4 | 0% | 0 | 25% | 0.245 | C | C | . | . | I | π-helix | trans | -133.9 | -37.2 | 177 | 68.8 | -102.5 | 0 | 0 | 0 | 114.7 | M165 F168 W169 S211 V219 F234 I237 F238 | M165-W215 HydrophobicContact CG-CZ3 3.72Å; M165-W215 HydrophobicContact SD-CE3 4.28Å; M165-W215 HydrophobicContact SD-CH2 3.98Å; M165-W215 HydrophobicContact SD-CZ3 3.38Å; M165-W215 WeakPolarHBondContact SD-CZ3 3.49Å; F168-W215 AromaticContact CD1-CH2 3.77Å; F168-W215 HydrophobicContact CD1-CH2 3.77Å; F168-W215 HydrophobicContact CD1-CZ2 4.38Å; F168-W215 HydrophobicContact CD1-CZ3 4.49Å; F168-W215 HydrophobicContact CE1-CH2 4.3Å; W169-W215 HydrophobicContact CB-CH2 3.56Å; W169-W215 HydrophobicContact CB-CZ2 3.98Å; W169-W215 HydrophobicContact CB-CZ3 4.41Å; W169-W215 AromaticContact CD1-CZ2 3.8Å; W169-W215 HydrophobicContact CG-CH2 4.3Å; W169-W215 HydrophobicContact CG-CZ2 4.31Å; S211-W215 PolarHBondContact O-N 3.06Å; S211-W215 PolarHBondContact O-NE1 2.78Å; W215-V219 WeakPolarHBondContact O-CG1 3.34Å; W215-V219 PolarHBondContact O-N 2.9Å; W215-F234 HydrophobicContact CB-CD2 4.26Å; W215-F234 HydrophobicContact CE3-CE2 4.11Å; W215-I237 HydrophobicContact CB-CG2 4.1Å; W215-F238 HydrophobicContact CB-CB 4.33Å; W215-F238 HydrophobicContact CB-CD2 4.24Å; W215-F238 AromaticContact CD2-CD2 3.59Å; W215-F238 HydrophobicContact CD2-CD2 3.59Å; W215-F238 AromaticContact CD2-CE2 3.89Å; W215-F238 HydrophobicContact CD2-CE2 3.89Å; W215-F238 AromaticContact CE3-CD2 3.7Å; W215-F238 HydrophobicContact CE3-CD2 3.7Å; W215-F238 AromaticContact CE3-CE2 3.78Å; W215-F238 HydrophobicContact CE3-CE2 3.78Å; W215-F238 AromaticContact CG-CD2 3.86Å; W215-F238 HydrophobicContact CG-CD2 3.86Å; W215-F238 HydrophobicContact CH2-CE2 4.04Å; W215-F238 HydrophobicContact CZ2-CE2 4.13Å; W215-F238 HydrophobicContact CZ3-CD2 4.29Å; W215-F238 AromaticContact CZ3-CE2 3.88Å; W215-F238 HydrophobicContact CZ3-CE2 3.88Å |
| 216 | Y | 90.3 | Very high | 86.5 | Confident | 0 Ų | 0 | 42.7 Ų | 42.7 | 0% | 0 | 23% | 0.226 | C | C | . | . | I | π-helix | trans | -67.7 | -42.6 | 179.6 | 174.7 | -99.6 | 0 | 0 | 0 | 111.8 | Q148 Y166 W169 S211 F212 V219 Y220 | Q148-Y216 PolarHBondContact NE2-OH 3.2Å; Q148-Y216 PolarHBondContact OE1-OH 2.87Å; Y166-Y216 VanDerWaalsContact CA-CE2 3.49Å; Y166-Y216 HydrophobicContact CD2-CE1 4.4Å; Y166-Y216 HydrophobicContact CD2-CE2 4.02Å; Y166-Y216 AromaticContact CD2-CZ 3.69Å; Y166-Y216 WeakPolarHBondContact CD2-OH 3.39Å; Y166-Y216 HydrophobicContact CG-CE2 4.37Å; W169-Y216 HydrophobicContact CB-CD2 4.27Å; W169-Y216 HydrophobicContact CG-CG 4.46Å; S211-Y216 PolarHBondContact O-N 2.81Å; F212-Y216 AromaticContact CD2-CD1 3.45Å; F212-Y216 HydrophobicContact CD2-CD1 3.45Å; F212-Y216 VanDerWaalsContact CD2-CD1 3.45Å; F212-Y216 HydrophobicContact CD2-CE1 4.11Å; F212-Y216 HydrophobicContact CD2-CG 4.24Å; F212-Y216 AromaticContact CE2-CD1 3.31Å; F212-Y216 HydrophobicContact CE2-CD1 3.31Å; F212-Y216 AromaticContact CE2-CE1 3.51Å; F212-Y216 HydrophobicContact CE2-CE1 3.51Å; F212-Y216 HydrophobicContact CE2-CG 4.45Å; F212-Y216 HydrophobicContact CG-CD1 4.42Å; F212-Y216 HydrophobicContact CZ-CD1 4.2Å; F212-Y216 HydrophobicContact CZ-CE1 4.3Å; F212-Y216 PolarHBondContact O-N 3.25Å; Y216-V219 HydrophobicContact CD2-CG1 4.45Å; Y216-V219 WeakPolarHBondContact O-CG1 3.41Å; Y216-V219 PolarHBondContact O-N 3.25Å; Y216-Y220 WeakPolarHBondContact O-CB 3.47Å; Y216-Y220 PolarHBondContact O-N 3.43Å |
| 217 | R | 87.4 | Confident | 85.7 | Confident | 64 Ų | 64 | 39.7 Ų | 39.7 | 24% | 0.242 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -63.5 | -48.7 | 175.6 | -79.8 | -75.9 | -165.7 | 145.6 | 12.9 | 112.5 | F212 V219 Y220 K221 | F212-R217 HydrophobicContact CD1-CG 4.16Å; F212-R217 HydrophobicContact CE1-CG 3.96Å; F212-R217 HydrophobicContact CZ-CG 4.35Å; F212-R217 WeakPolarHBondContact O-CB 3.32Å; F212-R217 VanDerWaalsContact O-CG 3.26Å; F212-R217 WeakPolarHBondContact O-CG 3.32Å; F212-R217 PolarHBondContact O-N 3.05Å; R217-V219 PolarHBondContact O-N 3.26Å; R217-Y220 PolarHBondContact O-N 2.9Å; R217-K221 WeakPolarHBondContact O-CB 3.48Å; R217-K221 WeakPolarHBondContact O-CG 3.03Å; R217-K221 PolarHBondContact O-N 3.36Å |
| 218 | P | 88.1 | Confident | 85 | Confident | 13 Ų | 13 | 39 Ų | 39 | 8% | 0.084 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -55.9 | -46.2 | 173.6 | -33.6 | 38.6 | 0 | 0 | 0 | 113.6 | V213 C214 Y220 K221 A222 I233 F234 | V213-P218 WeakPolarHBondContact O-CD 3.25Å; C214-P218 WeakPolarHBondContact O-CG 3.21Å; P218-Y220 VanDerWaalsContact C-N 3.35Å; P218-Y220 PolarHBondContact O-N 3.48Å; P218-K221 PolarHBondContact O-N 3.04Å; P218-A222 VanDerWaalsContact O-CB 3.26Å; P218-A222 WeakPolarHBondContact O-CB 3.42Å; P218-A222 PolarHBondContact O-N 3.36Å; P218-I233 HydrophobicContact CB-CG2 4.24Å; P218-I233 HydrophobicContact CG-CG2 4.18Å; P218-F234 HydrophobicContact CB-CB 4.17Å |
| 219 | V | 88.6 | Confident | 84.4 | Confident | 1 Ų | 1 | 44.1 Ų | 44.1 | 1% | 0.006 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -66.5 | -38.1 | 179.2 | 71.4 | 0 | 0 | 0 | 0 | 112.1 | M165 W215 Y216 R217 A222 F223 F234 I298 | M165-V219 HydrophobicContact CG-CG1 3.84Å; W215-V219 WeakPolarHBondContact O-CG1 3.34Å; W215-V219 PolarHBondContact O-N 2.9Å; Y216-V219 HydrophobicContact CD2-CG1 4.45Å; Y216-V219 WeakPolarHBondContact O-CG1 3.41Å; Y216-V219 PolarHBondContact O-N 3.25Å; R217-V219 PolarHBondContact O-N 3.26Å; V219-A222 WeakPolarHBondContact O-CB 3.26Å; V219-A222 PolarHBondContact O-N 2.92Å; V219-F223 HydrophobicContact CG2-CD2 3.72Å; V219-F223 HydrophobicContact CG2-CE2 3.53Å; V219-F223 VanDerWaalsContact O-CD2 3.28Å; V219-F223 WeakPolarHBondContact O-CD2 3.5Å; V219-F223 PolarHBondContact O-N 3.41Å; V219-F223 VanDerWaalsContact O-N 3.07Å; V219-F234 HydrophobicContact CB-CB 4.42Å; V219-F234 HydrophobicContact CB-CD1 4.35Å; V219-F234 HydrophobicContact CB-CD2 3.48Å; V219-F234 VanDerWaalsContact CB-CD2 3.48Å; V219-F234 HydrophobicContact CB-CE2 3.7Å; V219-F234 HydrophobicContact CB-CG 3.8Å; V219-F234 HydrophobicContact CB-CZ 4.25Å; V219-F234 HydrophobicContact CG1-CD2 4.25Å; V219-F234 HydrophobicContact CG1-CE2 4.16Å; V219-F234 HydrophobicContact CG2-CD1 4.12Å; V219-F234 HydrophobicContact CG2-CD2 4.02Å; V219-F234 HydrophobicContact CG2-CE1 4.05Å; V219-F234 HydrophobicContact CG2-CE2 3.91Å; V219-F234 HydrophobicContact CG2-CG 4.08Å; V219-F234 HydrophobicContact CG2-CZ 3.93Å; V219-I298 HydrophobicContact CG2-CD1 4.18Å |
| 220 | Y | 86.9 | Confident | 84.2 | Confident | 12 Ų | 12 | 42.3 Ų | 42.3 | 5% | 0.047 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -60.8 | -47.8 | 174.6 | -173.6 | -102.6 | 0 | 0 | 0 | 111.7 | Q148 I150 E153 I154 V162 Y216 R217 P218 A222 F223 R224 | Q148-Y220 PolarHBondContact NE2-OH 3.47Å; I150-Y220 HydrophobicContact CG1-CE2 4.34Å; E153-Y220 WeakPolarHBondContact CB-OH 3.41Å; E153-Y220 WeakPolarHBondContact OE2-CE1 3.24Å; E153-Y220 PolarHBondContact OE2-OH 2.84Å; I154-Y220 HydrophobicContact CD1-CD2 4.28Å; I154-Y220 HydrophobicContact CD1-CE2 3.88Å; I154-Y220 HydrophobicContact CG1-CE2 3.9Å; V162-Y220 HydrophobicContact CG1-CD2 3.6Å; V162-Y220 HydrophobicContact CG1-CE2 3.97Å; Y216-Y220 WeakPolarHBondContact O-CB 3.47Å; Y216-Y220 PolarHBondContact O-N 3.43Å; R217-Y220 PolarHBondContact O-N 2.9Å; P218-Y220 VanDerWaalsContact C-N 3.35Å; P218-Y220 PolarHBondContact O-N 3.48Å; Y220-A222 VanDerWaalsContact C-N 3.34Å; Y220-A222 PolarHBondContact O-N 3.45Å; Y220-F223 PolarHBondContact O-N 3.35Å; Y220-R224 WeakPolarHBondContact O-CB 3.47Å; Y220-R224 PolarHBondContact O-N 3.34Å |
| 221 | K | 82.9 | Confident | 84.1 | Confident | 114 Ų | 114 | 40.2 Ų | 40.2 | 50% | 0.496 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -62.4 | -42 | 175.8 | -74.2 | -178.3 | 174.8 | -175.1 | 0 | 111.7 | R217 P218 F223 R224 S225 | R217-K221 WeakPolarHBondContact O-CB 3.48Å; R217-K221 WeakPolarHBondContact O-CG 3.03Å; R217-K221 PolarHBondContact O-N 3.36Å; P218-K221 PolarHBondContact O-N 3.04Å; K221-F223 PolarHBondContact O-N 3.21Å; K221-R224 PolarHBondContact O-N 3.49Å; K221-S225 PolarHBondContact O-N 2.97Å; K221-S225 PolarHBondContact O-OG 3.38Å; K221-S225 VanDerWaalsContact O-OG 3.09Å |
| 222 | A | 85.6 | Confident | 84 | Confident | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -57.3 | -47.7 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | P218 V219 Y220 D226 S227 N230 F231 | P218-A222 VanDerWaalsContact O-CB 3.26Å; P218-A222 WeakPolarHBondContact O-CB 3.42Å; P218-A222 PolarHBondContact O-N 3.36Å; V219-A222 WeakPolarHBondContact O-CB 3.26Å; V219-A222 PolarHBondContact O-N 2.92Å; Y220-A222 VanDerWaalsContact C-N 3.34Å; Y220-A222 PolarHBondContact O-N 3.45Å; A222-D226 CarbonylContact O-C 3.53Å; A222-D226 WeakPolarHBondContact O-CA 3.18Å; A222-D226 PolarHBondContact O-N 2.84Å; A222-S227 PolarHBondContact O-N 3.37Å; A222-S227 VanDerWaalsContact O-N 3.15Å; A222-N230 HydrophobicContact CB-CB 3.75Å; A222-F231 HydrophobicContact CB-CB 4.47Å; A222-F231 HydrophobicContact CB-CD1 3.75Å; A222-F231 HydrophobicContact CB-CD2 3.77Å; A222-F231 HydrophobicContact CB-CE1 3.79Å; A222-F231 HydrophobicContact CB-CE2 3.81Å; A222-F231 HydrophobicContact CB-CG 3.73Å; A222-F231 HydrophobicContact CB-CZ 3.82Å; A222-F231 WeakPolarHBondContact O-CE2 3.4Å |
| 223 | F | 83.7 | Confident | 84 | Confident | 9 Ų | 9 | 48.2 Ų | 48.2 | 4% | 0.039 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -76.9 | -24.5 | 178 | -75.7 | -68.1 | 0 | 0 | 0 | 114.2 | I154 F158 T161 V162 V219 Y220 K221 F231 I298 M301 | I154-F223 HydrophobicContact CD1-CB 4.12Å; I154-F223 HydrophobicContact CG2-CB 4.46Å; F158-F223 HydrophobicContact CB-CB 4.44Å; F158-F223 HydrophobicContact CB-CD1 3.66Å; F158-F223 HydrophobicContact CB-CE1 4.25Å; F158-F223 HydrophobicContact CB-CG 4.29Å; F158-F223 AromaticContact CD1-CD1 3.68Å; F158-F223 HydrophobicContact CD1-CD1 3.68Å; F158-F223 AromaticContact CD1-CE1 3.59Å; F158-F223 HydrophobicContact CD1-CE1 3.59Å; F158-F223 HydrophobicContact CD2-CD1 4.19Å; F158-F223 HydrophobicContact CE1-CD1 4.35Å; F158-F223 HydrophobicContact CE1-CE1 4.12Å; F158-F223 AromaticContact CG-CD1 3.58Å; F158-F223 HydrophobicContact CG-CD1 3.58Å; F158-F223 HydrophobicContact CG-CE1 4.01Å; T161-F223 HydrophobicContact CG2-CE2 4.03Å; T161-F223 HydrophobicContact CG2-CZ 3.88Å; V162-F223 HydrophobicContact CG2-CB 3.57Å; V162-F223 HydrophobicContact CG2-CD2 3.57Å; V162-F223 HydrophobicContact CG2-CE2 4.41Å; V162-F223 HydrophobicContact CG2-CG 3.68Å; V219-F223 HydrophobicContact CG2-CD2 3.72Å; V219-F223 HydrophobicContact CG2-CE2 3.53Å; V219-F223 VanDerWaalsContact O-CD2 3.28Å; V219-F223 WeakPolarHBondContact O-CD2 3.5Å; V219-F223 PolarHBondContact O-N 3.41Å; V219-F223 VanDerWaalsContact O-N 3.07Å; Y220-F223 PolarHBondContact O-N 3.35Å; K221-F223 PolarHBondContact O-N 3.21Å; F223-F231 HydrophobicContact CD1-CE1 4.19Å; F223-F231 AromaticContact CD1-CZ 3.71Å; F223-F231 HydrophobicContact CD1-CZ 3.71Å; F223-F231 HydrophobicContact CD2-CE1 4.2Å; F223-F231 HydrophobicContact CD2-CZ 4.35Å; F223-F231 AromaticContact CE1-CE1 3.84Å; F223-F231 HydrophobicContact CE1-CE1 3.84Å; F223-F231 AromaticContact CE1-CZ 3.67Å; F223-F231 HydrophobicContact CE1-CZ 3.67Å; F223-F231 AromaticContact CE2-CE1 3.84Å; F223-F231 HydrophobicContact CE2-CE1 3.84Å; F223-F231 HydrophobicContact CE2-CZ 4.32Å; F223-F231 HydrophobicContact CG-CE1 4.37Å; F223-F231 HydrophobicContact CG-CZ 4.06Å; F223-F231 AromaticContact CZ-CE1 3.66Å; F223-F231 HydrophobicContact CZ-CE1 3.66Å; F223-F231 AromaticContact CZ-CZ 4Å; F223-F231 HydrophobicContact CZ-CZ 4Å; F223-I298 HydrophobicContact CE2-CD1 4.35Å; F223-I298 HydrophobicContact CE2-CG1 4.43Å; F223-I298 HydrophobicContact CE2-CG2 4.21Å; F223-I298 HydrophobicContact CZ-CG1 4.29Å; F223-I298 HydrophobicContact CZ-CG2 3.92Å; F223-M301 HydrophobicContact CZ-CE 4.39Å |
| 224 | R | 81.6 | Confident | 84.2 | Confident | 128 Ų | 128 | 43.9 Ų | 43.9 | 48% | 0.483 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -72 | -47.3 | 176.1 | 176.9 | 173.4 | 178.9 | 155.6 | 5 | 112.4 | E153 I154 Y220 K221 | E153-R224 IonicContact OE1-CZ 3.62Å; E153-R224 IonicContact OE1-NH1 3.55Å; E153-R224 PolarHBondContact OE1-NH1 3.23Å; E153-R224 IonicContact OE1-NH2 2.81Å; E153-R224 PolarHBondContact OE1-NH2 3.03Å; E153-R224 IonicContact OE2-CZ 3.5Å; E153-R224 IonicContact OE2-NH1 3.72Å; E153-R224 PolarHBondContact OE2-NH1 2.88Å; I154-R224 HydrophobicContact CD1-CB 3.71Å; Y220-R224 WeakPolarHBondContact O-CB 3.47Å; Y220-R224 PolarHBondContact O-N 3.34Å; K221-R224 PolarHBondContact O-N 3.49Å |
| 225 | S | 74.4 | Confident | 84.5 | Confident | 69 Ų | 69 | 43.3 Ų | 43.3 | 48% | 0.483 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -108.5 | 11.4 | -173.2 | 71.1 | 0 | 0 | 0 | 0 | 113.1 | K221 S227 | K221-S225 PolarHBondContact O-N 2.97Å; K221-S225 PolarHBondContact O-OG 3.38Å; K221-S225 VanDerWaalsContact O-OG 3.09Å; S225-S227 PolarHBondContact O-N 3.42Å; S225-S227 VanDerWaalsContact OG-CB 3.27Å; S225-S227 WeakPolarHBondContact OG-CB 3.32Å |
| 226 | D | 70.6 | Confident | 84.6 | Confident | 49 Ų | 49 | 50.2 Ų | 50.2 | 26% | 0.262 | 24% | 0.235 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 49.7 | 33.4 | -175.8 | -158.9 | 24.8 | 0 | 0 | 0 | 113.1 | A222 S228 K311 | A222-D226 CarbonylContact O-C 3.53Å; A222-D226 WeakPolarHBondContact O-CA 3.18Å; A222-D226 PolarHBondContact O-N 2.84Å; D226-S228 PolarHBondContact O-N 2.89Å; D226-K311 IonicContact OD2-NZ 3.27Å; D226-K311 PolarHBondContact OD2-NZ 3.41Å |
| 227 | S | 76.2 | Confident | 84.7 | Confident | 23 Ų | 23 | 52.6 Ų | 52.6 | 16% | 0.161 | 25% | 0.247 | C | C | . | . | trans | -87.9 | 109.8 | -167.8 | 175.7 | 0 | 0 | 0 | 0 | 111.7 | A222 S225 F229 N230 F231 | A222-S227 PolarHBondContact O-N 3.37Å; A222-S227 VanDerWaalsContact O-N 3.15Å; S225-S227 PolarHBondContact O-N 3.42Å; S225-S227 VanDerWaalsContact OG-CB 3.27Å; S225-S227 WeakPolarHBondContact OG-CB 3.32Å; S227-F229 VanDerWaalsContact C-N 3.25Å; S227-F229 PolarHBondContact O-N 3.42Å; S227-N230 VanDerWaalsContact CB-ND2 3.32Å; S227-N230 WeakPolarHBondContact CB-ND2 3.16Å; S227-N230 PolarHBondContact O-N 2.9Å; S227-N230 VanDerWaalsContact O-N 3.1Å; S227-N230 PolarHBondContact OG-ND2 2.81Å; S227-F231 WeakPolarHBondContact O-CD2 3.36Å; S227-F231 PolarHBondContact O-N 2.9Å; S227-F231 VanDerWaalsContact O-N 3.1Å | ||
| 228 | S | 75.8 | Confident | 85.1 | Confident | 21 Ų | 21 | 49.5 Ų | 49.5 | 15% | 0.147 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -57.6 | -34.2 | 177.1 | -76.6 | 0 | 0 | 0 | 0 | 113.9 | D226 F231 F232 A312 | D226-S228 PolarHBondContact O-N 2.89Å; S228-F231 WeakPolarHBondContact O-CB 3.36Å; S228-F231 PolarHBondContact O-N 2.98Å; S228-F232 PolarHBondContact O-N 3.08Å; S228-A312 VanDerWaalsContact OG-CB 3.3Å; S228-A312 WeakPolarHBondContact OG-CB 3.3Å |
| 229 | F | 77.1 | Confident | 85.5 | Confident | 143 Ų | 143 | 54.8 Ų | 54.8 | 63% | 0.627 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -64.8 | -41.2 | 176.2 | -178.2 | -105.6 | 0 | 0 | 0 | 112.2 | S227 F231 F232 I233 | S227-F229 VanDerWaalsContact C-N 3.25Å; S227-F229 PolarHBondContact O-N 3.42Å; F229-F231 VanDerWaalsContact C-N 3.34Å; F229-F232 PolarHBondContact O-N 3.25Å; F229-I233 HydrophobicContact CD1-CD1 3.91Å; F229-I233 HydrophobicContact CE1-CD1 3.35Å; F229-I233 HydrophobicContact CE1-CG1 4.4Å; F229-I233 HydrophobicContact CE2-CD1 4.39Å; F229-I233 HydrophobicContact CZ-CD1 3.63Å; F229-I233 HydrophobicContact CZ-CG1 4.4Å; F229-I233 PolarHBondContact O-N 2.77Å; F229-I233 VanDerWaalsContact O-N 3.14Å |
| 230 | N | 85.9 | Confident | 85.8 | Confident | 34 Ų | 34 | 57 Ų | 57 | 18% | 0.182 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -68.5 | -34.1 | 175.3 | -73.4 | -79.3 | 0 | 0 | 0 | 111.7 | A222 S227 F234 | A222-N230 HydrophobicContact CB-CB 3.75Å; S227-N230 VanDerWaalsContact CB-ND2 3.32Å; S227-N230 WeakPolarHBondContact CB-ND2 3.16Å; S227-N230 PolarHBondContact O-N 2.9Å; S227-N230 VanDerWaalsContact O-N 3.1Å; S227-N230 PolarHBondContact OG-ND2 2.81Å; N230-F234 VanDerWaalsContact O-CB 3.31Å; N230-F234 WeakPolarHBondContact O-CB 3.23Å; N230-F234 PolarHBondContact O-N 3.06Å |
| 231 | F | 87 | Confident | 86.2 | Confident | 9 Ų | 9 | 57.7 Ų | 57.7 | 4% | 0.039 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -61.5 | -44.9 | 170.9 | -81.5 | -66.6 | 0 | 0 | 0 | 112.1 | A222 F223 S227 S228 F229 F234 F235 I298 Y302 | A222-F231 HydrophobicContact CB-CB 4.47Å; A222-F231 HydrophobicContact CB-CD1 3.75Å; A222-F231 HydrophobicContact CB-CD2 3.77Å; A222-F231 HydrophobicContact CB-CE1 3.79Å; A222-F231 HydrophobicContact CB-CE2 3.81Å; A222-F231 HydrophobicContact CB-CG 3.73Å; A222-F231 HydrophobicContact CB-CZ 3.82Å; A222-F231 WeakPolarHBondContact O-CE2 3.4Å; F223-F231 HydrophobicContact CD1-CE1 4.19Å; F223-F231 AromaticContact CD1-CZ 3.71Å; F223-F231 HydrophobicContact CD1-CZ 3.71Å; F223-F231 HydrophobicContact CD2-CE1 4.2Å; F223-F231 HydrophobicContact CD2-CZ 4.35Å; F223-F231 AromaticContact CE1-CE1 3.84Å; F223-F231 HydrophobicContact CE1-CE1 3.84Å; F223-F231 AromaticContact CE1-CZ 3.67Å; F223-F231 HydrophobicContact CE1-CZ 3.67Å; F223-F231 AromaticContact CE2-CE1 3.84Å; F223-F231 HydrophobicContact CE2-CE1 3.84Å; F223-F231 HydrophobicContact CE2-CZ 4.32Å; F223-F231 HydrophobicContact CG-CE1 4.37Å; F223-F231 HydrophobicContact CG-CZ 4.06Å; F223-F231 AromaticContact CZ-CE1 3.66Å; F223-F231 HydrophobicContact CZ-CE1 3.66Å; F223-F231 AromaticContact CZ-CZ 4Å; F223-F231 HydrophobicContact CZ-CZ 4Å; S227-F231 WeakPolarHBondContact O-CD2 3.36Å; S227-F231 PolarHBondContact O-N 2.9Å; S227-F231 VanDerWaalsContact O-N 3.1Å; S228-F231 WeakPolarHBondContact O-CB 3.36Å; S228-F231 PolarHBondContact O-N 2.98Å; F229-F231 VanDerWaalsContact C-N 3.34Å; F231-F234 WeakPolarHBondContact O-CB 3.11Å; F231-F234 PolarHBondContact O-N 3.44Å; F231-F235 HydrophobicContact CB-CD2 4.46Å; F231-F235 HydrophobicContact CB-CE2 4.14Å; F231-F235 HydrophobicContact CD1-CE2 4.36Å; F231-F235 WeakPolarHBondContact O-CD2 3.35Å; F231-F235 PolarHBondContact O-N 3.5Å; F231-I298 HydrophobicContact CD1-CG2 4.41Å; F231-I298 HydrophobicContact CE1-CG2 4.22Å; F231-Y302 HydrophobicContact CB-CD2 4.07Å; F231-Y302 HydrophobicContact CB-CE2 4.01Å; F231-Y302 HydrophobicContact CD1-CD2 4.4Å; F231-Y302 HydrophobicContact CD2-CD2 4.06Å; F231-Y302 HydrophobicContact CD2-CE2 4.23Å; F231-Y302 AromaticContact CG-CD2 3.93Å; F231-Y302 HydrophobicContact CG-CD2 3.93Å; F231-Y302 HydrophobicContact CG-CE2 4.23Å |
| 232 | F | 87.5 | Confident | 86.9 | Confident | 140 Ų | 140 | 52.7 Ų | 52.7 | 61% | 0.614 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -59.6 | -49.7 | 177.7 | 176.2 | -100.2 | 0 | 0 | 0 | 112.3 | S228 F229 F234 F235 F236 | S228-F232 PolarHBondContact O-N 3.08Å; F229-F232 PolarHBondContact O-N 3.25Å; F232-F234 VanDerWaalsContact C-N 3.31Å; F232-F234 PolarHBondContact O-N 3.34Å; F232-F235 PolarHBondContact O-N 3.43Å; F232-F236 PolarHBondContact O-N 3.13Å; F232-F236 VanDerWaalsContact O-N 3.11Å |
| 233 | I | 88.8 | Confident | 87.4 | Confident | 49 Ų | 49 | 55.3 Ų | 55.3 | 25% | 0.251 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -58.6 | -45.6 | 176.3 | -70.2 | 174.6 | 0 | 0 | 0 | 110.7 | P218 F229 F235 F236 I237 | P218-I233 HydrophobicContact CB-CG2 4.24Å; P218-I233 HydrophobicContact CG-CG2 4.18Å; F229-I233 HydrophobicContact CD1-CD1 3.91Å; F229-I233 HydrophobicContact CE1-CD1 3.35Å; F229-I233 HydrophobicContact CE1-CG1 4.4Å; F229-I233 HydrophobicContact CE2-CD1 4.39Å; F229-I233 HydrophobicContact CZ-CD1 3.63Å; F229-I233 HydrophobicContact CZ-CG1 4.4Å; F229-I233 PolarHBondContact O-N 2.77Å; F229-I233 VanDerWaalsContact O-N 3.14Å; I233-F235 PolarHBondContact O-N 3.05Å; I233-F236 PolarHBondContact O-N 3.17Å; I233-I237 HydrophobicContact CG2-CD1 3.56Å; I233-I237 HydrophobicContact CG2-CG1 4.39Å; I233-I237 WeakPolarHBondContact O-CG1 3.45Å; I233-I237 PolarHBondContact O-N 3.44Å |
| 234 | F | 92.4 | Very high | 88 | Confident | 0 Ų | 0 | 56.8 Ų | 56.8 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -56.9 | -50.9 | 176.8 | 164.2 | -107.7 | 0 | 0 | 0 | 111.7 | M165 W215 P218 V219 N230 F231 F232 F236 I237 F238 I298 | M165-F234 HydrophobicContact CE-CE2 4.49Å; M165-F234 HydrophobicContact CE-CZ 3.98Å; W215-F234 HydrophobicContact CB-CD2 4.26Å; W215-F234 HydrophobicContact CE3-CE2 4.11Å; P218-F234 HydrophobicContact CB-CB 4.17Å; V219-F234 HydrophobicContact CB-CB 4.42Å; V219-F234 HydrophobicContact CB-CD1 4.35Å; V219-F234 HydrophobicContact CB-CD2 3.48Å; V219-F234 VanDerWaalsContact CB-CD2 3.48Å; V219-F234 HydrophobicContact CB-CE2 3.7Å; V219-F234 HydrophobicContact CB-CG 3.8Å; V219-F234 HydrophobicContact CB-CZ 4.25Å; V219-F234 HydrophobicContact CG1-CD2 4.25Å; V219-F234 HydrophobicContact CG1-CE2 4.16Å; V219-F234 HydrophobicContact CG2-CD1 4.12Å; V219-F234 HydrophobicContact CG2-CD2 4.02Å; V219-F234 HydrophobicContact CG2-CE1 4.05Å; V219-F234 HydrophobicContact CG2-CE2 3.91Å; V219-F234 HydrophobicContact CG2-CG 4.08Å; V219-F234 HydrophobicContact CG2-CZ 3.93Å; N230-F234 VanDerWaalsContact O-CB 3.31Å; N230-F234 WeakPolarHBondContact O-CB 3.23Å; N230-F234 PolarHBondContact O-N 3.06Å; F231-F234 WeakPolarHBondContact O-CB 3.11Å; F231-F234 PolarHBondContact O-N 3.44Å; F232-F234 VanDerWaalsContact C-N 3.31Å; F232-F234 PolarHBondContact O-N 3.34Å; F234-F236 PolarHBondContact O-N 2.72Å; F234-I237 PolarHBondContact O-N 2.5Å; F234-F238 HydrophobicContact CD2-CB 3.89Å; F234-F238 HydrophobicContact CD2-CG 4.36Å; F234-F238 HydrophobicContact CE1-CD1 4.46Å; F234-F238 HydrophobicContact CE2-CB 3.57Å; F234-F238 AromaticContact CE2-CD1 3.92Å; F234-F238 HydrophobicContact CE2-CD1 3.92Å; F234-F238 AromaticContact CE2-CD2 3.93Å; F234-F238 HydrophobicContact CE2-CD2 3.93Å; F234-F238 AromaticContact CE2-CG 3.55Å; F234-F238 HydrophobicContact CE2-CG 3.55Å; F234-F238 HydrophobicContact CZ-CB 3.98Å; F234-F238 AromaticContact CZ-CD1 3.62Å; F234-F238 HydrophobicContact CZ-CD1 3.62Å; F234-F238 HydrophobicContact CZ-CD2 4.44Å; F234-F238 HydrophobicContact CZ-CE1 4.2Å; F234-F238 AromaticContact CZ-CG 3.77Å; F234-F238 HydrophobicContact CZ-CG 3.77Å; F234-F238 WeakPolarHBondContact O-CA 3.35Å; F234-F238 WeakPolarHBondContact O-CB 3.48Å; F234-F238 PolarHBondContact O-N 3.26Å; F234-I298 HydrophobicContact CD1-CG2 4.36Å; F234-I298 HydrophobicContact CE1-CB 4.23Å; F234-I298 HydrophobicContact CE1-CD1 3.83Å; F234-I298 HydrophobicContact CE1-CG2 3.78Å; F234-I298 HydrophobicContact CZ-CD1 3.74Å |
| 235 | F | 92.6 | Very high | 88.7 | Confident | 31 Ų | 31 | 50.9 Ų | 50.9 | 14% | 0.136 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -61.3 | -44 | -177.5 | -73.9 | -58.1 | 0 | 0 | 0 | 112.4 | F231 F232 I233 F239 L295 I298 H299 Y302 | F231-F235 HydrophobicContact CB-CD2 4.46Å; F231-F235 HydrophobicContact CB-CE2 4.14Å; F231-F235 HydrophobicContact CD1-CE2 4.36Å; F231-F235 WeakPolarHBondContact O-CD2 3.35Å; F231-F235 PolarHBondContact O-N 3.5Å; F232-F235 PolarHBondContact O-N 3.43Å; I233-F235 PolarHBondContact O-N 3.05Å; F235-F239 WeakPolarHBondContact O-CB 3.32Å; F235-F239 PolarHBondContact O-N 2.89Å; F235-L295 HydrophobicContact CD1-CD1 3.85Å; F235-L295 HydrophobicContact CE1-CD1 4.5Å; F235-I298 HydrophobicContact CE1-CB 4.25Å; F235-I298 HydrophobicContact CE1-CG2 3.87Å; F235-I298 HydrophobicContact CZ-CB 4.5Å; F235-I298 HydrophobicContact CZ-CG2 3.75Å; F235-H299 HydrophobicContact CE1-CB 3.78Å; F235-H299 HydrophobicContact CZ-CB 4.07Å; F235-Y302 HydrophobicContact CE2-CD1 4.02Å; F235-Y302 HydrophobicContact CE2-CD2 4.48Å; F235-Y302 AromaticContact CE2-CG 3.93Å; F235-Y302 HydrophobicContact CE2-CG 3.93Å; F235-Y302 HydrophobicContact CZ-CG 4.33Å |
| 236 | F | 92.6 | Very high | 89.8 | Confident | 146 Ų | 146 | 50.6 Ų | 50.6 | 64% | 0.64 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -62.3 | -50.6 | 179.5 | 180 | -100.8 | 0 | 0 | 0 | 111.7 | F232 I233 F234 A240 | F232-F236 PolarHBondContact O-N 3.13Å; F232-F236 VanDerWaalsContact O-N 3.11Å; I233-F236 PolarHBondContact O-N 3.17Å; F234-F236 PolarHBondContact O-N 2.72Å; F236-A240 PolarHBondContact O-N 2.85Å |
| 237 | I | 94 | Very high | 91.1 | Very high | 49 Ų | 49 | 51.9 Ų | 51.9 | 25% | 0.251 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -70.8 | -42.3 | -177.2 | -62.3 | 174.9 | 0 | 0 | 0 | 111 | C214 W215 I233 F234 F239 A240 Q241 | C214-I237 HydrophobicContact CB-CD1 4.49Å; C214-I237 HydrophobicContact CB-CG2 3.87Å; C214-I237 WeakPolarHBondContact O-CD1 3.24Å; C214-I237 WeakPolarHBondContact O-CG2 3.49Å; W215-I237 HydrophobicContact CB-CG2 4.1Å; I233-I237 HydrophobicContact CG2-CD1 3.56Å; I233-I237 HydrophobicContact CG2-CG1 4.39Å; I233-I237 WeakPolarHBondContact O-CG1 3.45Å; I233-I237 PolarHBondContact O-N 3.44Å; F234-I237 PolarHBondContact O-N 2.5Å; I237-F239 VanDerWaalsContact C-N 3.33Å; I237-F239 PolarHBondContact O-N 3.36Å; I237-A240 PolarHBondContact O-N 3.43Å; I237-Q241 WeakPolarHBondContact O-CB 3.29Å; I237-Q241 PolarHBondContact O-N 2.96Å |
| 238 | F | 95.6 | Very high | 92 | Very high | 0 Ų | 0 | 50.9 Ų | 50.9 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -68.4 | -33.3 | -179.7 | -166.7 | -117.4 | 0 | 0 | 0 | 111.8 | M165 F168 W215 F234 Q241 V242 L294 L295 | M165-F238 HydrophobicContact CE-CE1 4.25Å; M165-F238 HydrophobicContact CE-CZ 4.1Å; M165-F238 HydrophobicContact SD-CE2 4.38Å; M165-F238 HydrophobicContact SD-CZ 4.16Å; F168-F238 HydrophobicContact CD1-CE2 4.19Å; F168-F238 HydrophobicContact CD1-CZ 4.03Å; F168-F238 AromaticContact CE1-CE2 3.7Å; F168-F238 HydrophobicContact CE1-CE2 3.7Å; F168-F238 AromaticContact CE1-CZ 3.53Å; F168-F238 HydrophobicContact CE1-CZ 3.53Å; F168-F238 HydrophobicContact CZ-CZ 4.44Å; W215-F238 HydrophobicContact CB-CB 4.33Å; W215-F238 HydrophobicContact CB-CD2 4.24Å; W215-F238 AromaticContact CD2-CD2 3.59Å; W215-F238 HydrophobicContact CD2-CD2 3.59Å; W215-F238 AromaticContact CD2-CE2 3.89Å; W215-F238 HydrophobicContact CD2-CE2 3.89Å; W215-F238 AromaticContact CE3-CD2 3.7Å; W215-F238 HydrophobicContact CE3-CD2 3.7Å; W215-F238 AromaticContact CE3-CE2 3.78Å; W215-F238 HydrophobicContact CE3-CE2 3.78Å; W215-F238 AromaticContact CG-CD2 3.86Å; W215-F238 HydrophobicContact CG-CD2 3.86Å; W215-F238 HydrophobicContact CH2-CE2 4.04Å; W215-F238 HydrophobicContact CZ2-CE2 4.13Å; W215-F238 HydrophobicContact CZ3-CD2 4.29Å; W215-F238 AromaticContact CZ3-CE2 3.88Å; W215-F238 HydrophobicContact CZ3-CE2 3.88Å; F234-F238 HydrophobicContact CD2-CB 3.89Å; F234-F238 HydrophobicContact CD2-CG 4.36Å; F234-F238 HydrophobicContact CE1-CD1 4.46Å; F234-F238 HydrophobicContact CE2-CB 3.57Å; F234-F238 AromaticContact CE2-CD1 3.92Å; F234-F238 HydrophobicContact CE2-CD1 3.92Å; F234-F238 AromaticContact CE2-CD2 3.93Å; F234-F238 HydrophobicContact CE2-CD2 3.93Å; F234-F238 AromaticContact CE2-CG 3.55Å; F234-F238 HydrophobicContact CE2-CG 3.55Å; F234-F238 HydrophobicContact CZ-CB 3.98Å; F234-F238 AromaticContact CZ-CD1 3.62Å; F234-F238 HydrophobicContact CZ-CD1 3.62Å; F234-F238 HydrophobicContact CZ-CD2 4.44Å; F234-F238 HydrophobicContact CZ-CE1 4.2Å; F234-F238 AromaticContact CZ-CG 3.77Å; F234-F238 HydrophobicContact CZ-CG 3.77Å; F234-F238 WeakPolarHBondContact O-CA 3.35Å; F234-F238 WeakPolarHBondContact O-CB 3.48Å; F234-F238 PolarHBondContact O-N 3.26Å; F238-Q241 HydrophobicContact CD2-CB 4.47Å; F238-Q241 WeakPolarHBondContact O-CB 3.45Å; F238-Q241 PolarHBondContact O-N 3.4Å; F238-V242 HydrophobicContact CD1-CG2 4.38Å; F238-V242 HydrophobicContact CE1-CG2 4.24Å; F238-V242 VanDerWaalsContact O-CG2 3.24Å; F238-V242 WeakPolarHBondContact O-CG2 3.4Å; F238-V242 PolarHBondContact O-N 2.99Å; F238-L294 HydrophobicContact CE1-CB 4.49Å; F238-L295 HydrophobicContact CD1-CB 4.12Å; F238-L295 HydrophobicContact CD1-CD1 3.75Å; F238-L295 HydrophobicContact CE1-CB 4.07Å |
| 239 | F | 95.6 | Very high | 93.1 | Very high | 123 Ų | 123 | 50.8 Ų | 50.8 | 54% | 0.539 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -61 | -48.1 | 170.1 | 174.8 | -100.6 | 0 | 0 | 0 | 111.7 | F235 I237 Q241 V242 C243 L295 | F235-F239 WeakPolarHBondContact O-CB 3.32Å; F235-F239 PolarHBondContact O-N 2.89Å; I237-F239 VanDerWaalsContact C-N 3.33Å; I237-F239 PolarHBondContact O-N 3.36Å; F239-Q241 VanDerWaalsContact C-N 3.27Å; F239-Q241 PolarHBondContact O-N 3.48Å; F239-V242 WeakPolarHBondContact O-CB 3.47Å; F239-V242 PolarHBondContact O-N 3.11Å; F239-V242 VanDerWaalsContact O-N 3.14Å; F239-C243 PolarHBondContact O-N 3.18Å; F239-C243 PolarHBondContact O-SG 2.94Å; F239-L295 HydrophobicContact CD2-CD2 4.19Å |
| 240 | A | 95.8 | Very high | 94 | Very high | 48 Ų | 48 | 47.6 Ų | 47.6 | 40% | 0.397 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -59.6 | -39.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | F236 I237 V242 C243 V244 | F236-A240 PolarHBondContact O-N 2.85Å; I237-A240 PolarHBondContact O-N 3.43Å; A240-V242 PolarHBondContact O-N 3.15Å; A240-C243 WeakPolarHBondContact O-CB 3.43Å; A240-C243 PolarHBondContact O-N 2.87Å; A240-V244 PolarHBondContact O-N 2.95Å |
| 241 | Q | 95.4 | Very high | 94.4 | Very high | 26 Ų | 26 | 46 Ų | 46 | 12% | 0.121 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -62.4 | -40.1 | 175.1 | -171.7 | 65.7 | 50.3 | 0 | 0 | 112.4 | I237 F238 F239 C243 V244 F245 | I237-Q241 WeakPolarHBondContact O-CB 3.29Å; I237-Q241 PolarHBondContact O-N 2.96Å; F238-Q241 HydrophobicContact CD2-CB 4.47Å; F238-Q241 WeakPolarHBondContact O-CB 3.45Å; F238-Q241 PolarHBondContact O-N 3.4Å; F239-Q241 VanDerWaalsContact C-N 3.27Å; F239-Q241 PolarHBondContact O-N 3.48Å; Q241-C243 VanDerWaalsContact C-N 3.32Å; Q241-C243 PolarHBondContact O-N 3.49Å; Q241-V244 WeakPolarHBondContact O-CB 3.37Å; Q241-V244 PolarHBondContact O-N 3.48Å; Q241-V244 VanDerWaalsContact O-N 3.15Å; Q241-F245 HydrophobicContact CG-CE1 3.89Å; Q241-F245 HydrophobicContact CG-CE2 3.92Å; Q241-F245 HydrophobicContact CG-CZ 3.56Å; Q241-F245 WeakPolarHBondContact O-CG 3.32Å; Q241-F245 PolarHBondContact O-N 3.01Å |
| 242 | V | 96.7 | Very high | 94.7 | Very high | 9 Ų | 9 | 49.9 Ų | 49.9 | 6% | 0.055 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -62.7 | -40.5 | 174.7 | 171.3 | 0 | 0 | 0 | 0 | 110.4 | F238 F239 A240 V244 F245 V246 V292 | F238-V242 HydrophobicContact CD1-CG2 4.38Å; F238-V242 HydrophobicContact CE1-CG2 4.24Å; F238-V242 VanDerWaalsContact O-CG2 3.24Å; F238-V242 WeakPolarHBondContact O-CG2 3.4Å; F238-V242 PolarHBondContact O-N 2.99Å; F239-V242 WeakPolarHBondContact O-CB 3.47Å; F239-V242 PolarHBondContact O-N 3.11Å; F239-V242 VanDerWaalsContact O-N 3.14Å; A240-V242 PolarHBondContact O-N 3.15Å; V242-V244 VanDerWaalsContact C-N 3.31Å; V242-V244 PolarHBondContact O-N 3.34Å; V242-F245 WeakPolarHBondContact O-CB 3.4Å; V242-F245 PolarHBondContact O-N 3.27Å; V242-F245 VanDerWaalsContact O-N 3.11Å; V242-V246 WeakPolarHBondContact O-CG2 3.38Å; V242-V246 PolarHBondContact O-N 2.75Å; V242-V292 HydrophobicContact CG1-CG2 3.65Å |
| 243 | C | 96.9 | Very high | 94.9 | Very high | 56 Ų | 56 | 47.5 Ų | 47.5 | 38% | 0.378 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -60.1 | -40.6 | 172.4 | -64.3 | 0 | 0 | 0 | 0 | 112 | F239 A240 Q241 F245 V246 I247 | F239-C243 PolarHBondContact O-N 3.18Å; F239-C243 PolarHBondContact O-SG 2.94Å; A240-C243 WeakPolarHBondContact O-CB 3.43Å; A240-C243 PolarHBondContact O-N 2.87Å; Q241-C243 VanDerWaalsContact C-N 3.32Å; Q241-C243 PolarHBondContact O-N 3.49Å; C243-F245 VanDerWaalsContact C-N 3.33Å; C243-F245 PolarHBondContact O-N 3.2Å; C243-V246 WeakPolarHBondContact O-CB 3.39Å; C243-V246 PolarHBondContact O-N 3.26Å; C243-I247 WeakPolarHBondContact O-CG1 3.42Å; C243-I247 PolarHBondContact O-N 3.01Å |
| 244 | V | 95.4 | Very high | 94.7 | Very high | 40 Ų | 40 | 47.9 Ų | 47.9 | 24% | 0.242 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -61.1 | -42.2 | 172.9 | 174.2 | 0 | 0 | 0 | 0 | 110.9 | F207 A240 Q241 V242 V246 I247 M248 | F207-V244 HydrophobicContact CE2-CG1 3.83Å; F207-V244 HydrophobicContact CZ-CG1 4.2Å; A240-V244 PolarHBondContact O-N 2.95Å; Q241-V244 WeakPolarHBondContact O-CB 3.37Å; Q241-V244 PolarHBondContact O-N 3.48Å; Q241-V244 VanDerWaalsContact O-N 3.15Å; V242-V244 VanDerWaalsContact C-N 3.31Å; V242-V244 PolarHBondContact O-N 3.34Å; V244-V246 VanDerWaalsContact C-N 3.32Å; V244-V246 PolarHBondContact O-N 2.93Å; V244-I247 WeakPolarHBondContact O-CB 3.39Å; V244-I247 PolarHBondContact O-N 3.17Å; V244-I247 VanDerWaalsContact O-N 3.13Å; V244-M248 HydrophobicContact CG1-CG 4.25Å; V244-M248 HydrophobicContact CG1-SD 3.97Å; V244-M248 VanDerWaalsContact O-CG 3.25Å; V244-M248 WeakPolarHBondContact O-CG 3.38Å; V244-M248 PolarHBondContact O-N 2.9Å |
| 245 | F | 97.3 | Very high | 94.7 | Very high | 4 Ų | 4 | 49 Ų | 49 | 2% | 0.018 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -62.7 | -36.7 | 176.5 | -60.1 | -23.7 | 0 | 0 | 0 | 113 | F168 Q241 V242 C243 M248 T249 Q287 T288 | F168-F245 AromaticContact CE1-CE2 3.85Å; F168-F245 HydrophobicContact CE1-CE2 3.85Å; F168-F245 HydrophobicContact CE1-CZ 4.48Å; F168-F245 HydrophobicContact CZ-CD2 4.31Å; F168-F245 AromaticContact CZ-CE2 3.65Å; F168-F245 HydrophobicContact CZ-CE2 3.65Å; F168-F245 HydrophobicContact CZ-CZ 4.45Å; Q241-F245 HydrophobicContact CG-CE1 3.89Å; Q241-F245 HydrophobicContact CG-CE2 3.92Å; Q241-F245 HydrophobicContact CG-CZ 3.56Å; Q241-F245 WeakPolarHBondContact O-CG 3.32Å; Q241-F245 PolarHBondContact O-N 3.01Å; V242-F245 WeakPolarHBondContact O-CB 3.4Å; V242-F245 PolarHBondContact O-N 3.27Å; V242-F245 VanDerWaalsContact O-N 3.11Å; C243-F245 VanDerWaalsContact C-N 3.33Å; C243-F245 PolarHBondContact O-N 3.2Å; F245-M248 HydrophobicContact CD1-SD 3.88Å; F245-M248 HydrophobicContact CE1-SD 4.47Å; F245-M248 PolarHBondContact O-N 2.77Å; F245-T249 WeakPolarHBondContact O-CB 3.37Å; F245-T249 PolarHBondContact O-N 2.89Å; F245-T249 PolarHBondContact O-OG1 3.39Å; F245-Q287 HydrophobicContact CD1-CG 4.46Å; F245-Q287 HydrophobicContact CD2-CG 4.08Å; F245-Q287 HydrophobicContact CE1-CG 4.43Å; F245-Q287 HydrophobicContact CE2-CG 4.08Å; F245-Q287 HydrophobicContact CG-CG 4.26Å; F245-Q287 HydrophobicContact CZ-CG 4.23Å; F245-T288 VanDerWaalsContact C-OG1 3.22Å; F245-T288 WeakPolarHBondContact CB-OG1 3.33Å; F245-T288 PolarHBondContact O-OG1 3.01Å; F245-T288 VanDerWaalsContact O-OG1 3.08Å |
| 246 | V | 97.8 | Very high | 94.7 | Very high | 63 Ų | 63 | 47.8 Ų | 47.8 | 38% | 0.382 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -61 | -47 | 171.6 | 174.7 | 0 | 0 | 0 | 0 | 110.5 | V242 C243 V244 M248 T249 I250 T288 | V242-V246 WeakPolarHBondContact O-CG2 3.38Å; V242-V246 PolarHBondContact O-N 2.75Å; C243-V246 WeakPolarHBondContact O-CB 3.39Å; C243-V246 PolarHBondContact O-N 3.26Å; V244-V246 VanDerWaalsContact C-N 3.32Å; V244-V246 PolarHBondContact O-N 2.93Å; V246-M248 VanDerWaalsContact C-N 3.34Å; V246-M248 PolarHBondContact O-N 3.41Å; V246-T249 WeakPolarHBondContact O-CB 3.37Å; V246-T249 PolarHBondContact O-N 3.43Å; V246-I250 HydrophobicContact CG1-CD1 4.04Å; V246-I250 WeakPolarHBondContact O-CG1 3.43Å; V246-I250 PolarHBondContact O-N 2.98Å; V246-T288 HydrophobicContact CG2-CG2 3.56Å |
| 247 | I | 96.2 | Very high | 94.8 | Very high | 76 Ų | 76 | 41.5 Ų | 41.5 | 39% | 0.39 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -61.6 | -42.2 | 177.4 | -65.9 | 165.9 | 0 | 0 | 0 | 111.1 | C243 V244 T249 I250 G251 I252 | C243-I247 WeakPolarHBondContact O-CG1 3.42Å; C243-I247 PolarHBondContact O-N 3.01Å; V244-I247 WeakPolarHBondContact O-CB 3.39Å; V244-I247 PolarHBondContact O-N 3.17Å; V244-I247 VanDerWaalsContact O-N 3.13Å; I247-T249 VanDerWaalsContact C-N 3.31Å; I247-T249 PolarHBondContact O-N 3.27Å; I247-I250 PolarHBondContact O-N 2.83Å; I247-G251 PolarHBondContact O-N 3.44Å; I247-I252 HydrophobicContact CG2-CD1 4.12Å |
| 248 | M | 96.4 | Very high | 94.8 | Very high | 2 Ų | 2 | 39.2 Ų | 39.2 | 1% | 0.01 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -60.4 | -42.1 | 175.2 | -68 | 172.2 | 67.6 | 0 | 0 | 111.5 | L176 V244 F245 V246 G251 F257 G259 F284 | L176-M248 HydrophobicContact CD2-CE 3.5Å; L176-M248 HydrophobicContact CG-CE 4.35Å; V244-M248 HydrophobicContact CG1-CG 4.25Å; V244-M248 HydrophobicContact CG1-SD 3.97Å; V244-M248 VanDerWaalsContact O-CG 3.25Å; V244-M248 WeakPolarHBondContact O-CG 3.38Å; V244-M248 PolarHBondContact O-N 2.9Å; F245-M248 HydrophobicContact CD1-SD 3.88Å; F245-M248 HydrophobicContact CE1-SD 4.47Å; F245-M248 PolarHBondContact O-N 2.77Å; V246-M248 VanDerWaalsContact C-N 3.34Å; V246-M248 PolarHBondContact O-N 3.41Å; M248-G251 PolarHBondContact O-N 3.37Å; M248-F257 HydrophobicContact CB-CD1 4.33Å; M248-F257 HydrophobicContact CB-CD2 4.36Å; M248-F257 HydrophobicContact CB-CG 4.16Å; M248-F257 HydrophobicContact CE-CD1 3.98Å; M248-F257 HydrophobicContact CE-CE1 3.82Å; M248-F257 HydrophobicContact CG-CD1 3.75Å; M248-F257 HydrophobicContact CG-CD2 3.77Å; M248-F257 HydrophobicContact CG-CE1 3.73Å; M248-F257 HydrophobicContact CG-CE2 3.75Å; M248-F257 HydrophobicContact CG-CG 3.8Å; M248-F257 HydrophobicContact CG-CZ 3.75Å; M248-F257 HydrophobicContact SD-CE1 4.13Å; M248-F257 HydrophobicContact SD-CZ 4.32Å; M248-G259 WeakPolarHBondContact O-CA 3.48Å; M248-F284 HydrophobicContact CB-CD2 3.98Å; M248-F284 HydrophobicContact CB-CE2 4.11Å; M248-F284 HydrophobicContact CB-CG 4.22Å; M248-F284 HydrophobicContact CB-CZ 4.47Å; M248-F284 HydrophobicContact CE-CD1 3.93Å; M248-F284 HydrophobicContact CE-CE1 3.31Å; M248-F284 HydrophobicContact CE-CE2 4.17Å; M248-F284 HydrophobicContact CE-CZ 3.42Å; M248-F284 VanDerWaalsContact CE-CZ 3.42Å; M248-F284 VanDerWaalsContact O-CD2 3.27Å; M248-F284 WeakPolarHBondContact O-CD2 3.02Å |
| 249 | T | 97.8 | Very high | 94.8 | Very high | 19 Ų | 19 | 39.2 Ų | 39.2 | 12% | 0.117 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -63.6 | -42.2 | 177.6 | -59.1 | 0 | 0 | 0 | 0 | 111.7 | F245 V246 I247 G259 W260 F284 T285 T288 | F245-T249 WeakPolarHBondContact O-CB 3.37Å; F245-T249 PolarHBondContact O-N 2.89Å; F245-T249 PolarHBondContact O-OG1 3.39Å; V246-T249 WeakPolarHBondContact O-CB 3.37Å; V246-T249 PolarHBondContact O-N 3.43Å; I247-T249 VanDerWaalsContact C-N 3.31Å; I247-T249 PolarHBondContact O-N 3.27Å; T249-G259 WeakPolarHBondContact O-CA 3.46Å; T249-W260 VanDerWaalsContact O-CD1 3.3Å; T249-W260 PolarHBondContact O-N 3.03Å; T249-F284 VanDerWaalsContact OG1-C 3.25Å; T249-F284 PolarHBondContact OG1-O 2.86Å; T249-F284 VanDerWaalsContact OG1-O 3.06Å; T249-T285 WeakPolarHBondContact CG2-OG1 3.45Å; T249-T288 PolarHBondContact OG1-OG1 2.82Å |
| 250 | I | 97.1 | Very high | 94.9 | Very high | 76 Ų | 76 | 37.6 Ų | 37.6 | 39% | 0.39 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -62.5 | -46.5 | 175.1 | -67.8 | 167.9 | 0 | 0 | 0 | 110.1 | V246 I247 I252 W260 I261 | V246-I250 HydrophobicContact CG1-CD1 4.04Å; V246-I250 WeakPolarHBondContact O-CG1 3.43Å; V246-I250 PolarHBondContact O-N 2.98Å; I247-I250 PolarHBondContact O-N 2.83Å; I250-I252 HydrophobicContact CG2-CG1 4.35Å; I250-W260 PolarHBondContact O-N 3.11Å; I250-I261 HydrophobicContact CG2-CD1 3.49Å; I250-I261 VanDerWaalsContact CG2-CD1 3.49Å; I250-I261 HydrophobicContact CG2-CG1 4.25Å; I250-I261 WeakPolarHBondContact O-CB 3.26Å; I250-I261 WeakPolarHBondContact O-CG1 3.42Å; I250-I261 PolarHBondContact O-N 2.95Å |
| 251 | G | 94.4 | Very high | 94.8 | Very high | 0 Ų | 0 | 39.6 Ų | 39.6 | 0% | 0 | 23% | 0.23 | C | C | . | . | trans | 70.1 | 73.2 | -179.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | I247 M248 V262 | I247-G251 PolarHBondContact O-N 3.44Å; M248-G251 PolarHBondContact O-N 3.37Å; G251-V262 WeakPolarHBondContact O-CG2 2.99Å | ||
| 252 | I | 93.1 | Very high | 94.7 | Very high | 90 Ų | 90 | 39.4 Ų | 39.4 | 46% | 0.462 | 23% | 0.23 | S | C | . | . | trans | -65.4 | 128.7 | 177.9 | -59.7 | 173.9 | 0 | 0 | 0 | 108.7 | I247 I250 G254 S255 | I247-I252 HydrophobicContact CG2-CD1 4.12Å; I250-I252 HydrophobicContact CG2-CG1 4.35Å; I252-G254 PolarHBondContact O-N 2.98Å; I252-S255 WeakPolarHBondContact O-CB 3.33Å; I252-S255 PolarHBondContact O-N 3.17Å; I252-S255 PolarHBondContact O-OG 3.33Å | ||
| 253 | P | 90.3 | Very high | 94.5 | Very high | 91 Ų | 91 | 39 Ų | 39 | 59% | 0.591 | 23% | 0.228 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -53 | 132.6 | 177.7 | -27.6 | 35.4 | 0 | 0 | 0 | 111.8 | S255 I261 | P253-S255 VanDerWaalsContact C-N 3.29Å; P253-S255 PolarHBondContact O-N 3.21Å; P253-I261 HydrophobicContact CG-CG2 4.06Å |
| 254 | G | 86.5 | Confident | 94.2 | Very high | 56 Ų | 56 | 40.5 Ų | 40.5 | 58% | 0.577 | 23% | 0.232 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 80 | -0.3 | -176.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | L199 I252 G256 | L199-G254 WeakPolarHBondContact CD1-O 3.44Å; I252-G254 PolarHBondContact O-N 2.98Å; G254-G256 VanDerWaalsContact C-N 3.33Å |
| 255 | S | 91 | Very high | 93.9 | Very high | 25 Ų | 25 | 41.6 Ų | 41.6 | 18% | 0.175 | 25% | 0.245 | C | C | . | . | S | Bend | trans | -81.8 | -10.2 | 176.7 | 82.9 | 0 | 0 | 0 | 0 | 114.1 | W203 I252 P253 F257 | W203-S255 PolarHBondContact NE1-O 3.35Å; I252-S255 WeakPolarHBondContact O-CB 3.33Å; I252-S255 PolarHBondContact O-N 3.17Å; I252-S255 PolarHBondContact O-OG 3.33Å; P253-S255 VanDerWaalsContact C-N 3.29Å; P253-S255 PolarHBondContact O-N 3.21Å; S255-F257 VanDerWaalsContact C-N 3.31Å; S255-F257 WeakPolarHBondContact OG-CD2 3.49Å; S255-F257 PolarHBondContact OG-N 2.92Å |
| 256 | G | 92.3 | Very high | 93.3 | Very high | 5 Ų | 5 | 42.2 Ų | 42.2 | 5% | 0.052 | 25% | 0.248 | C | C | . | . | S | Bend | trans | 78.6 | 8.4 | -173.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | N179 G196 G254 | N179-G256 PolarHBondContact ND2-O 2.99Å; G196-G256 WeakPolarHBondContact O-CA 3.25Å; G254-G256 VanDerWaalsContact C-N 3.33Å |
| 257 | F | 95.6 | Very high | 92.6 | Very high | 13 Ų | 13 | 41.7 Ų | 41.7 | 6% | 0.057 | 24% | 0.243 | C | C | . | . | trans | -104.3 | 125.3 | 173 | -61 | -54.2 | 0 | 0 | 0 | 111 | L176 W203 F207 M248 S255 G259 F284 | L176-F257 HydrophobicContact CD2-CE1 4.31Å; W203-F257 HydrophobicContact CB-CE1 4.02Å; W203-F257 HydrophobicContact CB-CZ 4.18Å; W203-F257 AromaticContact CD1-CE1 3.59Å; W203-F257 AromaticContact CD1-CZ 3.44Å; W203-F257 VanDerWaalsContact CD1-CZ 3.44Å; W203-F257 HydrophobicContact CD2-CZ 4.12Å; W203-F257 AromaticContact CG-CE1 3.89Å; W203-F257 HydrophobicContact CG-CE1 3.89Å; W203-F257 AromaticContact CG-CZ 3.66Å; W203-F257 HydrophobicContact CG-CZ 3.66Å; W203-F257 AromaticContact NE1-CZ 3.78Å; F207-F257 HydrophobicContact CD2-CZ 4.43Å; F207-F257 AromaticContact CE2-CZ 3.76Å; F207-F257 HydrophobicContact CE2-CZ 3.76Å; M248-F257 HydrophobicContact CB-CD1 4.33Å; M248-F257 HydrophobicContact CB-CD2 4.36Å; M248-F257 HydrophobicContact CB-CG 4.16Å; M248-F257 HydrophobicContact CE-CD1 3.98Å; M248-F257 HydrophobicContact CE-CE1 3.82Å; M248-F257 HydrophobicContact CG-CD1 3.75Å; M248-F257 HydrophobicContact CG-CD2 3.77Å; M248-F257 HydrophobicContact CG-CE1 3.73Å; M248-F257 HydrophobicContact CG-CE2 3.75Å; M248-F257 HydrophobicContact CG-CG 3.8Å; M248-F257 HydrophobicContact CG-CZ 3.75Å; M248-F257 HydrophobicContact SD-CE1 4.13Å; M248-F257 HydrophobicContact SD-CZ 4.32Å; S255-F257 VanDerWaalsContact C-N 3.31Å; S255-F257 WeakPolarHBondContact OG-CD2 3.49Å; S255-F257 PolarHBondContact OG-N 2.92Å; F257-G259 PolarHBondContact O-N 2.94Å; F257-F284 HydrophobicContact CB-CE2 4.2Å; F257-F284 HydrophobicContact CD1-CE2 4.32Å; F257-F284 HydrophobicContact CD1-CZ 4.27Å | ||
| 258 | S | 94.8 | Very high | 91.7 | Very high | 2 Ų | 2 | 45.2 Ų | 45.2 | 1% | 0.014 | 26% | 0.263 | C | S | . | . | trans | -84.6 | 58.7 | 177.2 | -50.4 | 0 | 0 | 0 | 0 | 110 | N179 S183 M277 N280 | N179-S258 WeakPolarHBondContact OD1-CB 3.39Å; N179-S258 PolarHBondContact OD1-N 3.33Å; N179-S258 PolarHBondContact OD1-OG 3.1Å; S183-S258 PolarHBondContact OG-OG 2.85Å; S258-M277 WeakPolarHBondContact OG-CE 3.38Å; S258-N280 WeakPolarHBondContact CB-ND2 3.34Å; S258-N280 PolarHBondContact O-ND2 3.15Å | ||
| 259 | G | 95 | Very high | 90.9 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 30% | 0.297 | C | S | . | . | trans | -84.3 | -171.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | M248 T249 F257 I261 V262 S263 | M248-G259 WeakPolarHBondContact O-CA 3.48Å; T249-G259 WeakPolarHBondContact O-CA 3.46Å; F257-G259 PolarHBondContact O-N 2.94Å; G259-I261 PolarHBondContact O-N 3.31Å; G259-V262 PolarHBondContact O-N 3.11Å; G259-S263 WeakPolarHBondContact O-CB 3.36Å; G259-S263 PolarHBondContact O-N 3.46Å; G259-S263 PolarHBondContact O-OG 3.34Å; G259-S263 VanDerWaalsContact O-OG 3.12Å | ||
| 260 | W | 97 | Very high | 90.4 | Very high | 88 Ų | 88 | 54 Ų | 54 | 33% | 0.333 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -58.2 | -42.6 | -171.6 | -76.6 | 108 | 0 | 0 | 0 | 114.4 | T249 I250 S263 L264 I278 A281 T282 T285 | T249-W260 VanDerWaalsContact O-CD1 3.3Å; T249-W260 PolarHBondContact O-N 3.03Å; I250-W260 PolarHBondContact O-N 3.11Å; W260-S263 WeakPolarHBondContact CA-OG 3.19Å; W260-S263 PolarHBondContact O-OG 3.3Å; W260-S263 VanDerWaalsContact O-OG 3.13Å; W260-L264 HydrophobicContact CE3-CD1 4.37Å; W260-L264 HydrophobicContact CE3-CG 4.34Å; W260-L264 WeakPolarHBondContact O-CB 3.14Å; W260-L264 WeakPolarHBondContact O-CG 3.18Å; W260-L264 PolarHBondContact O-N 3.26Å; W260-I278 HydrophobicContact CH2-CG2 4.35Å; W260-I278 HydrophobicContact CZ3-CG2 4.19Å; W260-A281 HydrophobicContact CD2-CB 3.87Å; W260-A281 HydrophobicContact CE3-CB 4.31Å; W260-A281 HydrophobicContact CG-CB 4.02Å; W260-T282 HydrophobicContact CH2-CG2 3.89Å; W260-T282 HydrophobicContact CZ2-CG2 3.9Å; W260-T285 PolarHBondContact NE1-OG1 3.3Å |
| 261 | I | 94.2 | Very high | 90 | Very high | 90 Ų | 90 | 55 Ų | 55 | 46% | 0.462 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -63.6 | -47.8 | -178.4 | -65.4 | 176.5 | 0 | 0 | 0 | 110.2 | I250 P253 G259 A265 | I250-I261 HydrophobicContact CG2-CD1 3.49Å; I250-I261 VanDerWaalsContact CG2-CD1 3.49Å; I250-I261 HydrophobicContact CG2-CG1 4.25Å; I250-I261 WeakPolarHBondContact O-CB 3.26Å; I250-I261 WeakPolarHBondContact O-CG1 3.42Å; I250-I261 PolarHBondContact O-N 2.95Å; P253-I261 HydrophobicContact CG-CG2 4.06Å; G259-I261 PolarHBondContact O-N 3.31Å; I261-A265 WeakPolarHBondContact O-CB 3.37Å; I261-A265 PolarHBondContact O-N 2.69Å; I261-A265 VanDerWaalsContact O-N 3.15Å |
| 262 | V | 92.3 | Very high | 89.8 | Confident | 22 Ų | 22 | 57.8 Ų | 57.8 | 13% | 0.133 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -67.8 | -42.1 | -178.8 | -166.9 | 0 | 0 | 0 | 0 | 111.5 | M186 G251 G259 A265 L266 M277 | M186-V262 HydrophobicContact CE-CG1 3.42Å; M186-V262 VanDerWaalsContact CE-CG1 3.42Å; M186-V262 HydrophobicContact SD-CG1 4.16Å; G251-V262 WeakPolarHBondContact O-CG2 2.99Å; G259-V262 PolarHBondContact O-N 3.11Å; V262-A265 PolarHBondContact O-N 3.15Å; V262-L266 PolarHBondContact O-N 2.88Å; V262-L266 VanDerWaalsContact O-N 3.16Å; V262-M277 HydrophobicContact CB-CE 4.08Å; V262-M277 HydrophobicContact CG1-CE 3.48Å; V262-M277 VanDerWaalsContact CG1-CE 3.48Å |
| 263 | S | 92.9 | Very high | 89.7 | Confident | 0 Ų | 0 | 54.3 Ų | 54.3 | 0% | 0 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -67.4 | -43.6 | -176.8 | 66.1 | 0 | 0 | 0 | 0 | 112.4 | G259 W260 L266 L267 M277 | G259-S263 WeakPolarHBondContact O-CB 3.36Å; G259-S263 PolarHBondContact O-N 3.46Å; G259-S263 PolarHBondContact O-OG 3.34Å; G259-S263 VanDerWaalsContact O-OG 3.12Å; W260-S263 WeakPolarHBondContact CA-OG 3.19Å; W260-S263 PolarHBondContact O-OG 3.3Å; W260-S263 VanDerWaalsContact O-OG 3.13Å; S263-L266 PolarHBondContact O-N 2.82Å; S263-L267 PolarHBondContact O-N 3.1Å; S263-M277 VanDerWaalsContact CB-CB 3.49Å |
| 264 | L | 91.8 | Very high | 89.8 | Confident | 88 Ų | 88 | 50 Ų | 50 | 46% | 0.461 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -67.1 | -35.9 | 176.5 | -67.1 | 175 | 0 | 0 | 0 | 112.2 | W260 L266 L267 | W260-L264 HydrophobicContact CE3-CD1 4.37Å; W260-L264 HydrophobicContact CE3-CG 4.34Å; W260-L264 WeakPolarHBondContact O-CB 3.14Å; W260-L264 WeakPolarHBondContact O-CG 3.18Å; W260-L264 PolarHBondContact O-N 3.26Å; L264-L266 VanDerWaalsContact C-N 3.27Å; L264-L266 PolarHBondContact O-N 3.33Å; L264-L267 HydrophobicContact CD2-CD1 4.12Å |
| 265 | A | 87.6 | Confident | 90.2 | Very high | 63 Ų | 63 | 50.8 Ų | 50.8 | 52% | 0.521 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -64 | -33.5 | 175 | 0 | 0 | 0 | 0 | 0 | 112.3 | I261 V262 | I261-A265 WeakPolarHBondContact O-CB 3.37Å; I261-A265 PolarHBondContact O-N 2.69Å; I261-A265 VanDerWaalsContact O-N 3.15Å; V262-A265 PolarHBondContact O-N 3.15Å |
| 266 | L | 85.4 | Confident | 90.4 | Very high | 17 Ų | 17 | 51.9 Ų | 51.9 | 9% | 0.089 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -83.9 | -23.2 | -177.1 | -160.2 | 69.4 | 0 | 0 | 0 | 114.1 | M186 V262 S263 L264 N268 K269 S270 V273 M277 | M186-L266 HydrophobicContact CE-CB 4.16Å; M186-L266 HydrophobicContact CE-CD1 3.85Å; M186-L266 HydrophobicContact CE-CD2 3.69Å; M186-L266 HydrophobicContact CE-CG 4.1Å; M186-L266 HydrophobicContact CG-CD2 4.05Å; V262-L266 PolarHBondContact O-N 2.88Å; V262-L266 VanDerWaalsContact O-N 3.16Å; S263-L266 PolarHBondContact O-N 2.82Å; L264-L266 VanDerWaalsContact C-N 3.27Å; L264-L266 PolarHBondContact O-N 3.33Å; L266-N268 PolarHBondContact O-N 3.31Å; L266-N268 VanDerWaalsContact O-N 3.11Å; L266-K269 HydrophobicContact CD1-CB 4.25Å; L266-K269 HydrophobicContact CD1-CD 4.44Å; L266-K269 PolarHBondContact O-N 3.17Å; L266-S270 PolarHBondContact O-N 3.14Å; L266-V273 HydrophobicContact CD2-CB 3.68Å; L266-V273 HydrophobicContact CD2-CG1 3.33Å; L266-M277 HydrophobicContact CB-SD 4.25Å; L266-M277 HydrophobicContact CD2-SD 3.41Å; L266-M277 WeakPolarHBondContact CD2-SD 3.33Å; L266-M277 HydrophobicContact CG-SD 4.45Å |
| 267 | L | 83.1 | Confident | 90.5 | Very high | 53 Ų | 53 | 51.7 Ų | 51.7 | 28% | 0.277 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -52.5 | -35.1 | 177.4 | -91.5 | 179.8 | 0 | 0 | 0 | 113.4 | S263 L264 K269 V275 I278 | S263-L267 PolarHBondContact O-N 3.1Å; L264-L267 HydrophobicContact CD2-CD1 4.12Å; L267-K269 VanDerWaalsContact C-N 3.29Å; L267-K269 PolarHBondContact O-N 3.02Å; L267-V275 HydrophobicContact CD2-CG2 4.36Å; L267-I278 HydrophobicContact CD1-CD1 3.35Å; L267-I278 HydrophobicContact CD2-CD1 3.95Å; L267-I278 HydrophobicContact CG-CD1 3.72Å |
| 268 | N | 77.3 | Confident | 90.5 | Very high | 150 Ų | 150 | 53 Ų | 53 | 80% | 0.802 | 30% | 0.299 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.5 | -13.4 | 179.9 | -66.2 | -53.7 | 0 | 0 | 0 | 113.8 | L266 | L266-N268 PolarHBondContact O-N 3.31Å; L266-N268 VanDerWaalsContact O-N 3.11Å |
| 269 | K | 80.1 | Confident | 90.6 | Very high | 165 Ų | 165 | 57.2 Ų | 57.2 | 72% | 0.717 | 32% | 0.321 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -107.3 | -44.5 | -177.5 | -70 | -173.8 | 174.4 | -175.1 | 0 | 112.8 | L266 L267 | L266-K269 HydrophobicContact CD1-CB 4.25Å; L266-K269 HydrophobicContact CD1-CD 4.44Å; L266-K269 PolarHBondContact O-N 3.17Å; L267-K269 VanDerWaalsContact C-N 3.29Å; L267-K269 PolarHBondContact O-N 3.02Å |
| 270 | S | 85.9 | Confident | 90.7 | Very high | 41 Ų | 41 | 57.2 Ų | 57.2 | 29% | 0.287 | 32% | 0.321 | S | S | . | . | trans | -145.4 | 104.4 | 179.2 | 178.5 | 0 | 0 | 0 | 0 | 109.6 | L266 G272 V273 G274 | L266-S270 PolarHBondContact O-N 3.14Å; S270-G272 VanDerWaalsContact C-N 3.32Å; S270-G272 PolarHBondContact O-N 3.33Å; S270-V273 PolarHBondContact O-N 3.11Å; S270-G274 PolarHBondContact O-N 3.18Å | ||
| 271 | T | 88.6 | Confident | 90.7 | Very high | 97 Ų | 97 | 53 Ų | 53 | 60% | 0.595 | 31% | 0.306 | S | S | * | . | H | α-helix | trans | -59.2 | -42.5 | -175.3 | -48.8 | 0 | 0 | 0 | 0 | 111.9 | G274 V275 | T271-G274 PolarHBondContact O-N 2.91Å; T271-V275 HydrophobicContact CG2-CG2 4.41Å; T271-V275 VanDerWaalsContact O-CG2 3.27Å; T271-V275 WeakPolarHBondContact O-CG2 3.39Å; T271-V275 PolarHBondContact O-N 2.66Å |
| 272 | G | 90.4 | Very high | 90.8 | Very high | 57 Ų | 57 | 51.4 Ų | 51.4 | 59% | 0.588 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -62.1 | -48.6 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | S270 L276 | S270-G272 VanDerWaalsContact C-N 3.32Å; S270-G272 PolarHBondContact O-N 3.33Å; G272-L276 PolarHBondContact O-N 2.89Å |
| 273 | V | 92.4 | Very high | 91.1 | Very high | 18 Ų | 18 | 52 Ų | 52 | 11% | 0.109 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -70.5 | -39.2 | 178.6 | -172.6 | 0 | 0 | 0 | 0 | 110.8 | A185 M186 A189 L266 S270 V275 L276 M277 | A185-V273 HydrophobicContact CB-CG1 4.11Å; M186-V273 HydrophobicContact CB-CG1 4.13Å; A189-V273 HydrophobicContact CB-CG2 4Å; L266-V273 HydrophobicContact CD2-CB 3.68Å; L266-V273 HydrophobicContact CD2-CG1 3.33Å; S270-V273 PolarHBondContact O-N 3.11Å; V273-V275 PolarHBondContact O-N 3.49Å; V273-L276 PolarHBondContact O-N 3.1Å; V273-M277 HydrophobicContact CG1-CG 4.32Å; V273-M277 HydrophobicContact CG1-SD 4.15Å; V273-M277 VanDerWaalsContact O-CG 3.3Å; V273-M277 WeakPolarHBondContact O-CG 3.34Å; V273-M277 PolarHBondContact O-N 3.31Å |
| 274 | G | 92.4 | Very high | 91.3 | Very high | 0 Ų | 0 | 52.1 Ų | 52.1 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -58.5 | -43.5 | 176 | 0 | 0 | 0 | 0 | 0 | 113 | S270 T271 M277 I278 | S270-G274 PolarHBondContact O-N 3.18Å; T271-G274 PolarHBondContact O-N 2.91Å; G274-M277 PolarHBondContact O-N 3.2Å; G274-I278 WeakPolarHBondContact O-CG1 3.18Å; G274-I278 PolarHBondContact O-N 2.91Å |
| 275 | V | 93.8 | Very high | 91.6 | Very high | 73 Ų | 73 | 50.4 Ų | 50.4 | 44% | 0.442 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -61.9 | -45.2 | 175.6 | 169.7 | 0 | 0 | 0 | 0 | 111.3 | L267 T271 V273 M277 I278 L279 | L267-V275 HydrophobicContact CD2-CG2 4.36Å; T271-V275 HydrophobicContact CG2-CG2 4.41Å; T271-V275 VanDerWaalsContact O-CG2 3.27Å; T271-V275 WeakPolarHBondContact O-CG2 3.39Å; T271-V275 PolarHBondContact O-N 2.66Å; V273-V275 PolarHBondContact O-N 3.49Å; V275-M277 VanDerWaalsContact C-N 3.31Å; V275-M277 PolarHBondContact O-N 2.86Å; V275-I278 PolarHBondContact O-N 3.47Å; V275-L279 PolarHBondContact O-N 3.38Å |
| 276 | L | 94.6 | Very high | 92.1 | Very high | 48 Ų | 48 | 49.7 Ų | 49.7 | 25% | 0.251 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -61.8 | -40.2 | 178 | -175.4 | 148.6 | 0 | 0 | 0 | 111.6 | S182 A185 G272 V273 L279 N280 | S182-L276 VanDerWaalsContact CB-CD2 3.49Å; S182-L276 WeakPolarHBondContact OG-CD2 3.33Å; A185-L276 HydrophobicContact CB-CD2 4.49Å; G272-L276 PolarHBondContact O-N 2.89Å; V273-L276 PolarHBondContact O-N 3.1Å; L276-L279 WeakPolarHBondContact O-CB 3.43Å; L276-L279 PolarHBondContact O-N 3.36Å; L276-N280 PolarHBondContact O-N 2.83Å; L276-N280 VanDerWaalsContact O-N 3.1Å |
| 277 | M | 94.6 | Very high | 92.7 | Very high | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -70.3 | -31 | 175.7 | -65 | -179.1 | 84.9 | 0 | 0 | 113 | M186 S258 V262 S263 L266 V273 G274 V275 N280 A281 | M186-M277 HydrophobicContact CB-SD 4.37Å; M186-M277 HydrophobicContact CE-CE 3.58Å; M186-M277 HydrophobicContact CE-SD 3.69Å; M186-M277 HydrophobicContact CG-SD 4.43Å; M186-M277 HydrophobicContact SD-CE 3.65Å; M186-M277 HydrophobicContact SD-SD 4.07Å; S258-M277 WeakPolarHBondContact OG-CE 3.38Å; V262-M277 HydrophobicContact CB-CE 4.08Å; V262-M277 HydrophobicContact CG1-CE 3.48Å; V262-M277 VanDerWaalsContact CG1-CE 3.48Å; S263-M277 VanDerWaalsContact CB-CB 3.49Å; L266-M277 HydrophobicContact CB-SD 4.25Å; L266-M277 HydrophobicContact CD2-SD 3.41Å; L266-M277 WeakPolarHBondContact CD2-SD 3.33Å; L266-M277 HydrophobicContact CG-SD 4.45Å; V273-M277 HydrophobicContact CG1-CG 4.32Å; V273-M277 HydrophobicContact CG1-SD 4.15Å; V273-M277 VanDerWaalsContact O-CG 3.3Å; V273-M277 WeakPolarHBondContact O-CG 3.34Å; V273-M277 PolarHBondContact O-N 3.31Å; G274-M277 PolarHBondContact O-N 3.2Å; V275-M277 VanDerWaalsContact C-N 3.31Å; V275-M277 PolarHBondContact O-N 2.86Å; M277-N280 WeakPolarHBondContact O-CB 3.45Å; M277-N280 PolarHBondContact O-N 3.42Å; M277-A281 PolarHBondContact O-N 2.95Å |
| 278 | I | 96.4 | Very high | 93.4 | Very high | 40 Ų | 40 | 47.3 Ų | 47.3 | 21% | 0.205 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -64.2 | -44.1 | 171 | -75 | 166.9 | 0 | 0 | 0 | 110.3 | W260 L267 G274 V275 N280 A281 T282 | W260-I278 HydrophobicContact CH2-CG2 4.35Å; W260-I278 HydrophobicContact CZ3-CG2 4.19Å; L267-I278 HydrophobicContact CD1-CD1 3.35Å; L267-I278 HydrophobicContact CD2-CD1 3.95Å; L267-I278 HydrophobicContact CG-CD1 3.72Å; G274-I278 WeakPolarHBondContact O-CG1 3.18Å; G274-I278 PolarHBondContact O-N 2.91Å; V275-I278 PolarHBondContact O-N 3.47Å; I278-N280 PolarHBondContact O-N 2.87Å; I278-A281 PolarHBondContact O-N 3.23Å; I278-A281 VanDerWaalsContact O-N 3.11Å; I278-T282 HydrophobicContact CG2-CG2 4.32Å; I278-T282 WeakPolarHBondContact O-CG2 3.39Å; I278-T282 PolarHBondContact O-N 3.12Å |
| 279 | L | 96.4 | Very high | 94.4 | Very high | 91 Ų | 91 | 43.1 Ų | 43.1 | 48% | 0.476 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -56.4 | -43.6 | 174.3 | -66.5 | 173.3 | 0 | 0 | 0 | 110.6 | F178 V275 L276 A281 T282 L283 | F178-L279 HydrophobicContact CE1-CB 4.15Å; F178-L279 HydrophobicContact CZ-CB 4.15Å; V275-L279 PolarHBondContact O-N 3.38Å; L276-L279 WeakPolarHBondContact O-CB 3.43Å; L276-L279 PolarHBondContact O-N 3.36Å; L279-A281 PolarHBondContact O-N 3.13Å; L279-T282 PolarHBondContact O-N 3.32Å; L279-T282 PolarHBondContact O-OG1 3.03Å; L279-L283 WeakPolarHBondContact O-CG 3.43Å; L279-L283 PolarHBondContact O-N 3.16Å |
| 280 | N | 96.8 | Very high | 95.2 | Very high | 0 Ų | 0 | 38.3 Ų | 38.3 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -62.1 | -43.8 | 174.7 | -170.3 | 65.4 | 0 | 0 | 0 | 113.2 | F178 N179 S182 S258 L276 M277 I278 T282 L283 F284 | F178-N280 HydrophobicContact CD1-CB 3.7Å; F178-N280 WeakPolarHBondContact CD1-OD1 3.12Å; F178-N280 HydrophobicContact CE1-CB 3.82Å; N179-N280 WeakPolarHBondContact CA-OD1 3.31Å; N179-N280 PolarHBondContact N-OD1 3.05Å; N179-N280 PolarHBondContact OD1-ND2 3.42Å; N179-N280 VanDerWaalsContact OD1-ND2 3.16Å; S182-N280 WeakPolarHBondContact OG-CB 3.47Å; S258-N280 WeakPolarHBondContact CB-ND2 3.34Å; S258-N280 PolarHBondContact O-ND2 3.15Å; L276-N280 PolarHBondContact O-N 2.83Å; L276-N280 VanDerWaalsContact O-N 3.1Å; M277-N280 WeakPolarHBondContact O-CB 3.45Å; M277-N280 PolarHBondContact O-N 3.42Å; I278-N280 PolarHBondContact O-N 2.87Å; N280-T282 VanDerWaalsContact C-N 3.29Å; N280-T282 PolarHBondContact O-N 3.22Å; N280-L283 WeakPolarHBondContact O-CB 3.46Å; N280-L283 PolarHBondContact O-N 2.9Å; N280-L283 VanDerWaalsContact O-N 3.17Å; N280-F284 WeakPolarHBondContact ND2-CE2 3.46Å; N280-F284 PolarHBondContact O-N 3.47Å |
| 281 | A | 97.1 | Very high | 95.7 | Very high | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -62.1 | -36.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | W260 M277 I278 L279 F284 T285 | W260-A281 HydrophobicContact CD2-CB 3.87Å; W260-A281 HydrophobicContact CE3-CB 4.31Å; W260-A281 HydrophobicContact CG-CB 4.02Å; M277-A281 PolarHBondContact O-N 2.95Å; I278-A281 PolarHBondContact O-N 3.23Å; I278-A281 VanDerWaalsContact O-N 3.11Å; L279-A281 PolarHBondContact O-N 3.13Å; A281-F284 PolarHBondContact O-N 3.37Å; A281-T285 WeakPolarHBondContact O-CB 3.42Å; A281-T285 PolarHBondContact O-N 3.23Å; A281-T285 PolarHBondContact O-OG1 3.06Å |
| 282 | T | 97.6 | Very high | 96.1 | Very high | 57 Ų | 57 | 34.7 Ų | 34.7 | 35% | 0.35 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -66.8 | -38.9 | 173.8 | 63.8 | 0 | 0 | 0 | 0 | 112.2 | W260 I278 L279 N280 T285 A286 | W260-T282 HydrophobicContact CH2-CG2 3.89Å; W260-T282 HydrophobicContact CZ2-CG2 3.9Å; I278-T282 HydrophobicContact CG2-CG2 4.32Å; I278-T282 WeakPolarHBondContact O-CG2 3.39Å; I278-T282 PolarHBondContact O-N 3.12Å; L279-T282 PolarHBondContact O-N 3.32Å; L279-T282 PolarHBondContact O-OG1 3.03Å; N280-T282 VanDerWaalsContact C-N 3.29Å; N280-T282 PolarHBondContact O-N 3.22Å; T282-T285 WeakPolarHBondContact O-CB 3.46Å; T282-T285 PolarHBondContact O-N 3.14Å; T282-A286 PolarHBondContact O-N 3.09Å |
| 283 | L | 97.6 | Very high | 96.4 | Very high | 35 Ų | 35 | 38 Ų | 38 | 18% | 0.183 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -61.4 | -46.2 | 173.4 | -70.8 | 173 | 0 | 0 | 0 | 111.4 | F171 F174 F178 L279 N280 T285 A286 Q287 | F171-L283 HydrophobicContact CE2-CD2 3.91Å; F171-L283 HydrophobicContact CZ-CD2 3.95Å; F174-L283 HydrophobicContact CE1-CD1 4.08Å; F178-L283 HydrophobicContact CB-CD1 4.14Å; F178-L283 HydrophobicContact CD1-CD1 3.76Å; F178-L283 HydrophobicContact CD2-CD1 4.25Å; F178-L283 HydrophobicContact CE1-CD1 4.22Å; F178-L283 HydrophobicContact CG-CD1 3.77Å; L279-L283 WeakPolarHBondContact O-CG 3.43Å; L279-L283 PolarHBondContact O-N 3.16Å; N280-L283 WeakPolarHBondContact O-CB 3.46Å; N280-L283 PolarHBondContact O-N 2.9Å; N280-L283 VanDerWaalsContact O-N 3.17Å; L283-T285 VanDerWaalsContact C-N 3.3Å; L283-T285 PolarHBondContact O-N 3.45Å; L283-A286 PolarHBondContact O-N 2.93Å; L283-Q287 WeakPolarHBondContact O-CB 3.06Å; L283-Q287 PolarHBondContact O-N 2.95Å |
| 284 | F | 97.9 | Very high | 96.6 | Very high | 1 Ų | 1 | 37.2 Ų | 37.2 | 0% | 0.004 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -62.6 | -36.5 | 175.3 | -70.3 | -19.3 | 0 | 0 | 0 | 113 | N179 M248 T249 F257 N280 A281 Q287 T288 | N179-F284 HydrophobicContact CB-CE1 4.31Å; N179-F284 HydrophobicContact CB-CE2 4.37Å; N179-F284 HydrophobicContact CB-CZ 3.58Å; M248-F284 HydrophobicContact CB-CD2 3.98Å; M248-F284 HydrophobicContact CB-CE2 4.11Å; M248-F284 HydrophobicContact CB-CG 4.22Å; M248-F284 HydrophobicContact CB-CZ 4.47Å; M248-F284 HydrophobicContact CE-CD1 3.93Å; M248-F284 HydrophobicContact CE-CE1 3.31Å; M248-F284 HydrophobicContact CE-CE2 4.17Å; M248-F284 HydrophobicContact CE-CZ 3.42Å; M248-F284 VanDerWaalsContact CE-CZ 3.42Å; M248-F284 VanDerWaalsContact O-CD2 3.27Å; M248-F284 WeakPolarHBondContact O-CD2 3.02Å; T249-F284 VanDerWaalsContact OG1-C 3.25Å; T249-F284 PolarHBondContact OG1-O 2.86Å; T249-F284 VanDerWaalsContact OG1-O 3.06Å; F257-F284 HydrophobicContact CB-CE2 4.2Å; F257-F284 HydrophobicContact CD1-CE2 4.32Å; F257-F284 HydrophobicContact CD1-CZ 4.27Å; N280-F284 WeakPolarHBondContact ND2-CE2 3.46Å; N280-F284 PolarHBondContact O-N 3.47Å; A281-F284 PolarHBondContact O-N 3.37Å; F284-Q287 WeakPolarHBondContact O-CB 3.48Å; F284-Q287 PolarHBondContact O-N 2.97Å; F284-T288 WeakPolarHBondContact O-CB 3.21Å; F284-T288 PolarHBondContact O-N 3.16Å; F284-T288 PolarHBondContact O-OG1 3.32Å |
| 285 | T | 98.2 | Very high | 96.7 | Very high | 53 Ų | 53 | 38.7 Ų | 38.7 | 33% | 0.325 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -63.7 | -47.8 | 174.3 | -53.9 | 0 | 0 | 0 | 0 | 110.9 | T249 W260 A281 T282 L283 Q287 T288 A289 | T249-T285 WeakPolarHBondContact CG2-OG1 3.45Å; W260-T285 PolarHBondContact NE1-OG1 3.3Å; A281-T285 WeakPolarHBondContact O-CB 3.42Å; A281-T285 PolarHBondContact O-N 3.23Å; A281-T285 PolarHBondContact O-OG1 3.06Å; T282-T285 WeakPolarHBondContact O-CB 3.46Å; T282-T285 PolarHBondContact O-N 3.14Å; L283-T285 VanDerWaalsContact C-N 3.3Å; L283-T285 PolarHBondContact O-N 3.45Å; T285-Q287 VanDerWaalsContact C-N 3.31Å; T285-Q287 PolarHBondContact O-N 3.39Å; T285-T288 PolarHBondContact O-N 3.14Å; T285-A289 WeakPolarHBondContact O-CB 3.49Å; T285-A289 PolarHBondContact O-N 2.85Å |
| 286 | A | 97.8 | Very high | 96.7 | Very high | 48 Ų | 48 | 42.5 Ų | 42.5 | 40% | 0.397 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -61.1 | -40.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | F171 T282 L283 A289 M290 | F171-A286 HydrophobicContact CZ-CB 4.38Å; T282-A286 PolarHBondContact O-N 3.09Å; L283-A286 PolarHBondContact O-N 2.93Å; A286-A289 PolarHBondContact O-N 3.3Å; A286-M290 VanDerWaalsContact O-CB 3.24Å; A286-M290 WeakPolarHBondContact O-CB 3.43Å; A286-M290 PolarHBondContact O-N 3.24Å |
| 287 | Q | 97.3 | Very high | 96.6 | Very high | 1 Ų | 1 | 43.3 Ų | 43.3 | 1% | 0.005 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -61.7 | -45.3 | 175.7 | -170.8 | 174.9 | -66.2 | 0 | 0 | 111.9 | F168 F171 S175 F245 L283 F284 T285 G291 | F168-Q287 HydrophobicContact CE2-CG 4.1Å; F168-Q287 WeakPolarHBondContact CE2-O 3.46Å; F168-Q287 HydrophobicContact CZ-CG 4.12Å; F168-Q287 WeakPolarHBondContact CZ-O 3.43Å; F171-Q287 HydrophobicContact CD1-CB 4.28Å; F171-Q287 HydrophobicContact CD1-CG 4.34Å; F171-Q287 HydrophobicContact CE1-CB 3.75Å; F171-Q287 HydrophobicContact CE1-CG 4.29Å; S175-Q287 PolarHBondContact OG-OE1 3.39Å; F245-Q287 HydrophobicContact CD1-CG 4.46Å; F245-Q287 HydrophobicContact CD2-CG 4.08Å; F245-Q287 HydrophobicContact CE1-CG 4.43Å; F245-Q287 HydrophobicContact CE2-CG 4.08Å; F245-Q287 HydrophobicContact CG-CG 4.26Å; F245-Q287 HydrophobicContact CZ-CG 4.23Å; L283-Q287 WeakPolarHBondContact O-CB 3.06Å; L283-Q287 PolarHBondContact O-N 2.95Å; F284-Q287 WeakPolarHBondContact O-CB 3.48Å; F284-Q287 PolarHBondContact O-N 2.97Å; T285-Q287 VanDerWaalsContact C-N 3.31Å; T285-Q287 PolarHBondContact O-N 3.39Å; Q287-G291 PolarHBondContact O-N 3.24Å |
| 288 | T | 98.1 | Very high | 96.4 | Very high | 19 Ų | 19 | 43.3 Ų | 43.3 | 12% | 0.117 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -63.8 | -48.3 | 177.5 | -58.5 | 0 | 0 | 0 | 0 | 111.1 | F245 V246 T249 F284 T285 M290 G291 V292 | F245-T288 VanDerWaalsContact C-OG1 3.22Å; F245-T288 WeakPolarHBondContact CB-OG1 3.33Å; F245-T288 PolarHBondContact O-OG1 3.01Å; F245-T288 VanDerWaalsContact O-OG1 3.08Å; V246-T288 HydrophobicContact CG2-CG2 3.56Å; T249-T288 PolarHBondContact OG1-OG1 2.82Å; F284-T288 WeakPolarHBondContact O-CB 3.21Å; F284-T288 PolarHBondContact O-N 3.16Å; F284-T288 PolarHBondContact O-OG1 3.32Å; T285-T288 PolarHBondContact O-N 3.14Å; T288-M290 PolarHBondContact O-N 2.94Å; T288-G291 PolarHBondContact O-N 3.34Å; T288-V292 WeakPolarHBondContact O-CG2 3.44Å; T288-V292 PolarHBondContact O-N 3.45Å |
| 289 | A | 98.1 | Very high | 96.1 | Very high | 61 Ų | 61 | 46.2 Ų | 46.2 | 50% | 0.504 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -60.7 | -46.7 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | T285 A286 V292 F293 | T285-A289 WeakPolarHBondContact O-CB 3.49Å; T285-A289 PolarHBondContact O-N 2.85Å; A286-A289 PolarHBondContact O-N 3.3Å; A289-V292 PolarHBondContact O-N 2.71Å; A289-F293 WeakPolarHBondContact O-CB 3.38Å; A289-F293 PolarHBondContact O-N 3.31Å |
| 290 | M | 96.9 | Very high | 95.7 | Very high | 65 Ų | 65 | 44.3 Ų | 44.3 | 32% | 0.32 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -65.7 | -38.4 | 176.6 | -178.3 | 165.6 | 36 | 0 | 0 | 111.7 | F168 F171 A286 T288 F293 L294 | F168-M290 HydrophobicContact CD2-CB 4.15Å; F168-M290 HydrophobicContact CD2-CE 3.52Å; F168-M290 HydrophobicContact CD2-CG 3.54Å; F168-M290 HydrophobicContact CD2-SD 3.68Å; F168-M290 HydrophobicContact CE2-CB 3.82Å; F168-M290 HydrophobicContact CE2-CE 3.84Å; F168-M290 HydrophobicContact CE2-CG 3.73Å; F168-M290 HydrophobicContact CE2-SD 4.3Å; F171-M290 HydrophobicContact CD1-CE 3.5Å; F171-M290 VanDerWaalsContact CD1-CE 3.5Å; F171-M290 HydrophobicContact CE1-CE 3.78Å; F171-M290 HydrophobicContact CG-CE 4.15Å; A286-M290 VanDerWaalsContact O-CB 3.24Å; A286-M290 WeakPolarHBondContact O-CB 3.43Å; A286-M290 PolarHBondContact O-N 3.24Å; T288-M290 PolarHBondContact O-N 2.94Å; M290-F293 PolarHBondContact O-N 2.97Å; M290-L294 HydrophobicContact CG-CD1 3.9Å; M290-L294 HydrophobicContact CG-CG 4.29Å; M290-L294 WeakPolarHBondContact O-CB 3.27Å; M290-L294 VanDerWaalsContact O-CG 3.24Å; M290-L294 WeakPolarHBondContact O-CG 3.37Å; M290-L294 PolarHBondContact O-N 2.84Å |
| 291 | G | 96.8 | Very high | 95.2 | Very high | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -59.8 | -47.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q287 T288 L294 L295 | Q287-G291 PolarHBondContact O-N 3.24Å; T288-G291 PolarHBondContact O-N 3.34Å; G291-L294 PolarHBondContact O-N 3.42Å; G291-L295 WeakPolarHBondContact O-CB 3.45Å; G291-L295 PolarHBondContact O-N 3.41Å |
| 292 | V | 97.7 | Very high | 94.4 | Very high | 61 Ų | 61 | 48.6 Ų | 48.6 | 37% | 0.37 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -61.7 | -44.9 | 175.1 | 173.3 | 0 | 0 | 0 | 0 | 111.1 | V242 T288 A289 L294 L295 K296 | V242-V292 HydrophobicContact CG1-CG2 3.65Å; T288-V292 WeakPolarHBondContact O-CG2 3.44Å; T288-V292 PolarHBondContact O-N 3.45Å; A289-V292 PolarHBondContact O-N 2.71Å; V292-L294 PolarHBondContact O-N 2.85Å; V292-L295 PolarHBondContact O-N 2.96Å; V292-K296 HydrophobicContact CG1-CD 4.41Å; V292-K296 WeakPolarHBondContact O-CG 3.35Å; V292-K296 PolarHBondContact O-N 3.4Å |
| 293 | F | 96.9 | Very high | 93.6 | Very high | 126 Ų | 126 | 54 Ų | 54 | 55% | 0.553 | 27% | 0.274 | S | S | * | . | H | α-helix | trans | -59.1 | -46.9 | 177.2 | 171.1 | -99.6 | 0 | 0 | 0 | 111.9 | A289 M290 K296 K297 | A289-F293 WeakPolarHBondContact O-CB 3.38Å; A289-F293 PolarHBondContact O-N 3.31Å; M290-F293 PolarHBondContact O-N 2.97Å; F293-K296 PolarHBondContact O-N 2.8Å; F293-K297 HydrophobicContact CE1-CD 4.05Å; F293-K297 HydrophobicContact CZ-CD 4.18Å; F293-K297 WeakPolarHBondContact O-CB 3.15Å; F293-K297 PolarHBondContact O-N 3.31Å |
| 294 | L | 95.1 | Very high | 92.5 | Very high | 2 Ų | 2 | 58.9 Ų | 58.9 | 1% | 0.01 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -67.9 | -38.8 | -179.6 | -70.2 | 172.4 | 0 | 0 | 0 | 112.4 | I164 M165 F168 F238 M290 G291 V292 K297 I298 | I164-L294 HydrophobicContact CG2-CD1 4.36Å; I164-L294 HydrophobicContact CG2-CD2 3.62Å; M165-L294 HydrophobicContact CE-CB 3.67Å; M165-L294 HydrophobicContact CE-CD1 3.94Å; M165-L294 HydrophobicContact CE-CD2 4.5Å; M165-L294 HydrophobicContact CE-CG 4.24Å; M165-L294 HydrophobicContact SD-CD1 4.03Å; F168-L294 HydrophobicContact CB-CD1 3.69Å; F168-L294 HydrophobicContact CD1-CD1 3.85Å; F168-L294 HydrophobicContact CD2-CD1 3.87Å; F168-L294 HydrophobicContact CE1-CD1 4.49Å; F168-L294 HydrophobicContact CG-CD1 3.5Å; F168-L294 VanDerWaalsContact CG-CD1 3.5Å; F238-L294 HydrophobicContact CE1-CB 4.49Å; M290-L294 HydrophobicContact CG-CD1 3.9Å; M290-L294 HydrophobicContact CG-CG 4.29Å; M290-L294 WeakPolarHBondContact O-CB 3.27Å; M290-L294 VanDerWaalsContact O-CG 3.24Å; M290-L294 WeakPolarHBondContact O-CG 3.37Å; M290-L294 PolarHBondContact O-N 2.84Å; G291-L294 PolarHBondContact O-N 3.42Å; V292-L294 PolarHBondContact O-N 2.85Å; L294-K297 PolarHBondContact O-N 2.94Å; L294-I298 WeakPolarHBondContact O-CB 3.48Å; L294-I298 WeakPolarHBondContact O-CG1 3.45Å; L294-I298 PolarHBondContact O-N 3.42Å |
| 295 | L | 94.9 | Very high | 90.9 | Very high | 31 Ų | 31 | 60.3 Ų | 60.3 | 16% | 0.162 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -57.3 | -50.5 | 173 | -177.1 | 73.7 | 0 | 0 | 0 | 110.2 | F235 F238 F239 G291 V292 K297 H299 | F235-L295 HydrophobicContact CD1-CD1 3.85Å; F235-L295 HydrophobicContact CE1-CD1 4.5Å; F238-L295 HydrophobicContact CD1-CB 4.12Å; F238-L295 HydrophobicContact CD1-CD1 3.75Å; F238-L295 HydrophobicContact CE1-CB 4.07Å; F239-L295 HydrophobicContact CD2-CD2 4.19Å; G291-L295 WeakPolarHBondContact O-CB 3.45Å; G291-L295 PolarHBondContact O-N 3.41Å; V292-L295 PolarHBondContact O-N 2.96Å; L295-K297 PolarHBondContact O-N 3.22Å; L295-H299 WeakPolarHBondContact O-CB 3.45Å; L295-H299 PolarHBondContact O-N 3.46Å |
| 296 | K | 93.9 | Very high | 88.5 | Confident | 153 Ų | 153 | 62.2 Ų | 62.2 | 67% | 0.665 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -63.1 | -41.7 | 177.5 | -69.1 | -174.7 | 78.2 | 170.9 | 0 | 112.2 | V292 F293 H299 S300 | V292-K296 HydrophobicContact CG1-CD 4.41Å; V292-K296 WeakPolarHBondContact O-CG 3.35Å; V292-K296 PolarHBondContact O-N 3.4Å; F293-K296 PolarHBondContact O-N 2.8Å; K296-H299 PolarHBondContact O-N 2.9Å; K296-S300 WeakPolarHBondContact O-CB 3.47Å; K296-S300 PolarHBondContact O-N 3.41Å |
| 297 | K | 92.1 | Very high | 86.3 | Confident | 65 Ų | 65 | 63.9 Ų | 63.9 | 28% | 0.283 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -62.3 | -49.5 | 179.7 | -178.3 | 175 | 177.1 | 166.4 | 0 | 111.4 | F293 L294 L295 S300 M301 | F293-K297 HydrophobicContact CE1-CD 4.05Å; F293-K297 HydrophobicContact CZ-CD 4.18Å; F293-K297 WeakPolarHBondContact O-CB 3.15Å; F293-K297 PolarHBondContact O-N 3.31Å; L294-K297 PolarHBondContact O-N 2.94Å; L295-K297 PolarHBondContact O-N 3.22Å; K297-S300 WeakPolarHBondContact O-CB 3.44Å; K297-S300 PolarHBondContact O-N 3.27Å; K297-M301 HydrophobicContact CG-CE 3.85Å; K297-M301 PolarHBondContact O-N 2.9Å |
| 298 | I | 91.1 | Very high | 84.1 | Confident | 0 Ų | 0 | 64.4 Ų | 64.4 | 0% | 0 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -68 | -39.7 | 179.9 | -65.8 | 169.5 | 0 | 0 | 0 | 110.8 | T161 M165 V219 F223 F231 F234 F235 L294 S300 M301 Y302 | T161-I298 HydrophobicContact CG2-CD1 4.2Å; T161-I298 HydrophobicContact CG2-CG1 3.85Å; M165-I298 HydrophobicContact CE-CD1 3.17Å; M165-I298 HydrophobicContact CE-CG1 4.49Å; V219-I298 HydrophobicContact CG2-CD1 4.18Å; F223-I298 HydrophobicContact CE2-CD1 4.35Å; F223-I298 HydrophobicContact CE2-CG1 4.43Å; F223-I298 HydrophobicContact CE2-CG2 4.21Å; F223-I298 HydrophobicContact CZ-CG1 4.29Å; F223-I298 HydrophobicContact CZ-CG2 3.92Å; F231-I298 HydrophobicContact CD1-CG2 4.41Å; F231-I298 HydrophobicContact CE1-CG2 4.22Å; F234-I298 HydrophobicContact CD1-CG2 4.36Å; F234-I298 HydrophobicContact CE1-CB 4.23Å; F234-I298 HydrophobicContact CE1-CD1 3.83Å; F234-I298 HydrophobicContact CE1-CG2 3.78Å; F234-I298 HydrophobicContact CZ-CD1 3.74Å; F235-I298 HydrophobicContact CE1-CB 4.25Å; F235-I298 HydrophobicContact CE1-CG2 3.87Å; F235-I298 HydrophobicContact CZ-CB 4.5Å; F235-I298 HydrophobicContact CZ-CG2 3.75Å; L294-I298 WeakPolarHBondContact O-CB 3.48Å; L294-I298 WeakPolarHBondContact O-CG1 3.45Å; L294-I298 PolarHBondContact O-N 3.42Å; I298-S300 VanDerWaalsContact C-N 3.32Å; I298-S300 PolarHBondContact O-N 3.11Å; I298-M301 HydrophobicContact CB-CE 4.31Å; I298-M301 HydrophobicContact CG1-CE 3.82Å; I298-M301 PolarHBondContact O-N 3.25Å; I298-Y302 WeakPolarHBondContact O-CB 3.38Å; I298-Y302 PolarHBondContact O-N 2.93Å |
| 299 | H | 90.5 | Very high | 81.8 | Confident | 102 Ų | 102 | 68.8 Ų | 68.8 | 47% | 0.472 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -60.9 | -41.5 | 173.7 | -173 | -91.4 | 0 | 0 | 0 | 112.2 | F235 L295 K296 Y302 R303 | F235-H299 HydrophobicContact CE1-CB 3.78Å; F235-H299 HydrophobicContact CZ-CB 4.07Å; L295-H299 WeakPolarHBondContact O-CB 3.45Å; L295-H299 PolarHBondContact O-N 3.46Å; K296-H299 PolarHBondContact O-N 2.9Å; H299-Y302 PolarHBondContact O-N 2.81Å; H299-R303 WeakPolarHBondContact O-CB 3.04Å; H299-R303 PolarHBondContact O-N 2.83Å |
| 300 | S | 87.8 | Confident | 79.8 | Confident | 51 Ų | 51 | 72.9 Ų | 72.9 | 36% | 0.357 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -62.6 | -42.2 | 174.1 | -172.7 | 0 | 0 | 0 | 0 | 112.1 | K296 K297 I298 R303 Q304 | K296-S300 WeakPolarHBondContact O-CB 3.47Å; K296-S300 PolarHBondContact O-N 3.41Å; K297-S300 WeakPolarHBondContact O-CB 3.44Å; K297-S300 PolarHBondContact O-N 3.27Å; I298-S300 VanDerWaalsContact C-N 3.32Å; I298-S300 PolarHBondContact O-N 3.11Å; S300-R303 PolarHBondContact O-N 3.2Å; S300-Q304 WeakPolarHBondContact O-CB 3.33Å; S300-Q304 WeakPolarHBondContact O-CG 3.13Å; S300-Q304 PolarHBondContact O-N 2.97Å; S300-Q304 PolarHBondContact OG-NE2 3.16Å |
| 301 | M | 85.1 | Confident | 78.1 | Confident | 34 Ų | 34 | 74.6 Ų | 74.6 | 17% | 0.167 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -65.1 | -41.3 | 175.6 | -74.2 | -179 | -67.5 | 0 | 0 | 111.5 | T161 F223 K297 I298 Q304 T305 | T161-M301 HydrophobicContact CG2-CE 3.4Å; T161-M301 HydrophobicContact CG2-SD 4.44Å; T161-M301 WeakPolarHBondContact OG1-CE 3.12Å; T161-M301 PolarHBondContact OG1-SD 3.16Å; F223-M301 HydrophobicContact CZ-CE 4.39Å; K297-M301 HydrophobicContact CG-CE 3.85Å; K297-M301 PolarHBondContact O-N 2.9Å; I298-M301 HydrophobicContact CB-CE 4.31Å; I298-M301 HydrophobicContact CG1-CE 3.82Å; I298-M301 PolarHBondContact O-N 3.25Å; M301-Q304 PolarHBondContact O-N 3.46Å; M301-T305 PolarHBondContact O-N 3.45Å; M301-T305 VanDerWaalsContact O-N 3.15Å; M301-T305 PolarHBondContact O-OG1 3.43Å |
| 302 | Y | 82.3 | Confident | 76.1 | Confident | 56 Ų | 56 | 75.3 Ų | 75.3 | 22% | 0.22 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -59.4 | -47.4 | 176.1 | -179.6 | -108.5 | 0 | 0 | 0 | 111.3 | F231 F235 I298 H299 T305 | F231-Y302 HydrophobicContact CB-CD2 4.07Å; F231-Y302 HydrophobicContact CB-CE2 4.01Å; F231-Y302 HydrophobicContact CD1-CD2 4.4Å; F231-Y302 HydrophobicContact CD2-CD2 4.06Å; F231-Y302 HydrophobicContact CD2-CE2 4.23Å; F231-Y302 AromaticContact CG-CD2 3.93Å; F231-Y302 HydrophobicContact CG-CD2 3.93Å; F231-Y302 HydrophobicContact CG-CE2 4.23Å; F235-Y302 HydrophobicContact CE2-CD1 4.02Å; F235-Y302 HydrophobicContact CE2-CD2 4.48Å; F235-Y302 AromaticContact CE2-CG 3.93Å; F235-Y302 HydrophobicContact CE2-CG 3.93Å; F235-Y302 HydrophobicContact CZ-CG 4.33Å; I298-Y302 WeakPolarHBondContact O-CB 3.38Å; I298-Y302 PolarHBondContact O-N 2.93Å; H299-Y302 PolarHBondContact O-N 2.81Å; Y302-T305 WeakPolarHBondContact O-CB 3.27Å; Y302-T305 PolarHBondContact O-N 2.9Å; Y302-T305 VanDerWaalsContact O-N 3.16Å |
| 303 | R | 80.2 | Confident | 74.3 | Confident | 169 Ų | 169 | 78.3 Ų | 78.3 | 64% | 0.638 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -68.2 | -39.8 | 177.4 | -169.8 | -179 | 176.4 | -157.5 | -0.2 | 113.5 | H299 S300 T305 D306 | H299-R303 WeakPolarHBondContact O-CB 3.04Å; H299-R303 PolarHBondContact O-N 2.83Å; S300-R303 PolarHBondContact O-N 3.2Å; R303-T305 PolarHBondContact O-N 3.17Å; R303-T305 VanDerWaalsContact O-N 3.1Å; R303-D306 WeakPolarHBondContact O-CB 3.5Å; R303-D306 PolarHBondContact O-N 3.38Å |
| 304 | Q | 74.1 | Confident | 72.7 | Confident | 139 Ų | 139 | 74.8 Ų | 74.8 | 65% | 0.65 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -63.4 | -18.1 | 174.3 | -74.4 | 170.3 | 12.6 | 0 | 0 | 112.6 | S300 M301 D306 | S300-Q304 WeakPolarHBondContact O-CB 3.33Å; S300-Q304 WeakPolarHBondContact O-CG 3.13Å; S300-Q304 PolarHBondContact O-N 2.97Å; S300-Q304 PolarHBondContact OG-NE2 3.16Å; M301-Q304 PolarHBondContact O-N 3.46Å; Q304-D306 VanDerWaalsContact C-N 3.28Å; Q304-D306 PolarHBondContact O-N 2.8Å |
| 305 | T | 63.6 | Low | 71.2 | Confident | 31 Ų | 31 | 78.8 Ų | 78.8 | 19% | 0.19 | 39% | 0.391 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -89.7 | 24.8 | 173 | -39.6 | 0 | 0 | 0 | 0 | 110.6 | M301 Y302 R303 A307 S308 | M301-T305 PolarHBondContact O-N 3.45Å; M301-T305 VanDerWaalsContact O-N 3.15Å; M301-T305 PolarHBondContact O-OG1 3.43Å; Y302-T305 WeakPolarHBondContact O-CB 3.27Å; Y302-T305 PolarHBondContact O-N 2.9Å; Y302-T305 VanDerWaalsContact O-N 3.16Å; R303-T305 PolarHBondContact O-N 3.17Å; R303-T305 VanDerWaalsContact O-N 3.1Å; T305-A307 PolarHBondContact O-N 3.2Å; T305-S308 WeakPolarHBondContact CB-OG 3.29Å; T305-S308 WeakPolarHBondContact CG2-OG 3.16Å; T305-S308 WeakPolarHBondContact O-CA 3.19Å; T305-S308 WeakPolarHBondContact O-CB 3.34Å; T305-S308 PolarHBondContact O-N 3.16Å; T305-S308 PolarHBondContact O-OG 2.97Å |
| 306 | D | 48.7 | Very low | 69.8 | Low | 93 Ų | 93 | 84.6 Ų | 84.6 | 50% | 0.497 | 42% | 0.416 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -53.5 | -20.4 | -178.4 | -83.5 | -35.1 | 0 | 0 | 0 | 115 | R303 Q304 S308 F309 | R303-D306 WeakPolarHBondContact O-CB 3.5Å; R303-D306 PolarHBondContact O-N 3.38Å; Q304-D306 VanDerWaalsContact C-N 3.28Å; Q304-D306 PolarHBondContact O-N 2.8Å; D306-S308 PolarHBondContact O-N 3.3Å; D306-F309 PolarHBondContact O-N 3.04Å |
| 307 | A | 50.7 | Low | 68.3 | Low | 82 Ų | 82 | 79.5 Ų | 79.5 | 68% | 0.678 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -58.1 | -25.4 | 164.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | T305 K311 | T305-A307 PolarHBondContact O-N 3.2Å; A307-K311 PolarHBondContact O-N 2.91Å |
| 308 | S | 52.7 | Low | 67 | Low | 13 Ų | 13 | 80.6 Ų | 80.6 | 9% | 0.091 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -83.1 | -11.3 | 174.6 | 69.1 | 0 | 0 | 0 | 0 | 114.4 | T305 D306 K311 A312 | T305-S308 WeakPolarHBondContact CB-OG 3.29Å; T305-S308 WeakPolarHBondContact CG2-OG 3.16Å; T305-S308 WeakPolarHBondContact O-CA 3.19Å; T305-S308 WeakPolarHBondContact O-CB 3.34Å; T305-S308 PolarHBondContact O-N 3.16Å; T305-S308 PolarHBondContact O-OG 2.97Å; D306-S308 PolarHBondContact O-N 3.3Å; S308-K311 CarbonylContact O-C 3.55Å; S308-K311 PolarHBondContact O-N 2.98Å; S308-A312 WeakPolarHBondContact O-CA 3.24Å; S308-A312 WeakPolarHBondContact O-CB 3.16Å; S308-A312 PolarHBondContact O-N 2.94Å |
| 309 | F | 49.5 | Very low | 65.5 | Low | 111 Ų | 111 | 82.3 Ų | 82.3 | 49% | 0.487 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -72.4 | -39 | 170 | -163.6 | -94 | 0 | 0 | 0 | 111.1 | D306 A312 Q313 | D306-F309 PolarHBondContact O-N 3.04Å; F309-A312 PolarHBondContact O-N 2.84Å; F309-Q313 HydrophobicContact CE1-CG 4.45Å; F309-Q313 PolarHBondContact O-N 2.63Å |
| 310 | Q | 54.9 | Low | 64.1 | Low | 147 Ų | 147 | 80.2 Ų | 80.2 | 69% | 0.687 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -65.4 | -41.4 | 169.6 | -78.2 | 163.8 | -21.1 | 0 | 0 | 111.4 | A312 Q313 A314 | Q310-A312 VanDerWaalsContact C-N 3.33Å; Q310-A312 PolarHBondContact O-N 2.98Å; Q310-Q313 PolarHBondContact O-N 3.26Å; Q310-A314 WeakPolarHBondContact O-CB 3.41Å; Q310-A314 PolarHBondContact O-N 3.33Å |
| 311 | K | 61.1 | Low | 62.7 | Low | 100 Ų | 100 | 84.5 Ų | 84.5 | 44% | 0.435 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -63.2 | -35.8 | 171 | -165 | -176.1 | 166.8 | -160.9 | 0 | 112.4 | D226 A307 S308 A314 E315 | D226-K311 IonicContact OD2-NZ 3.27Å; D226-K311 PolarHBondContact OD2-NZ 3.41Å; A307-K311 PolarHBondContact O-N 2.91Å; S308-K311 CarbonylContact O-C 3.55Å; S308-K311 PolarHBondContact O-N 2.98Å; K311-A314 CarbonylContact O-C 3.52Å; K311-A314 WeakPolarHBondContact O-CB 2.96Å; K311-A314 PolarHBondContact O-N 3.5Å; K311-E315 VanDerWaalsContact CE-OE1 3.32Å; K311-E315 WeakPolarHBondContact CE-OE1 3.27Å; K311-E315 IonicContact NZ-OE1 4Å; K311-E315 WeakPolarHBondContact O-CB 3.05Å; K311-E315 WeakPolarHBondContact O-CG 3.08Å; K311-E315 PolarHBondContact O-N 3.04Å |
| 312 | A | 56.1 | Low | 61.5 | Low | 16 Ų | 16 | 86.1 Ų | 86.1 | 13% | 0.132 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -74.9 | -35.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | S228 S308 F309 Q310 A314 E315 F316 | S228-A312 VanDerWaalsContact OG-CB 3.3Å; S228-A312 WeakPolarHBondContact OG-CB 3.3Å; S308-A312 WeakPolarHBondContact O-CA 3.24Å; S308-A312 WeakPolarHBondContact O-CB 3.16Å; S308-A312 PolarHBondContact O-N 2.94Å; F309-A312 PolarHBondContact O-N 2.84Å; Q310-A312 VanDerWaalsContact C-N 3.33Å; Q310-A312 PolarHBondContact O-N 2.98Å; A312-A314 VanDerWaalsContact C-N 3.3Å; A312-E315 PolarHBondContact O-N 3.38Å; A312-F316 VanDerWaalsContact O-CB 3.23Å; A312-F316 WeakPolarHBondContact O-CB 3.4Å; A312-F316 PolarHBondContact O-N 3.2Å |
| 313 | Q | 58.6 | Low | 60.5 | Low | 124 Ų | 124 | 87.5 Ų | 87.5 | 58% | 0.579 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -62.1 | -41.2 | 166 | -82.9 | -172.5 | -11.1 | 0 | 0 | 110.7 | F309 Q310 A317 | F309-Q313 HydrophobicContact CE1-CG 4.45Å; F309-Q313 PolarHBondContact O-N 2.63Å; Q310-Q313 PolarHBondContact O-N 3.26Å; Q313-A317 WeakPolarHBondContact O-CB 3.39Å; Q313-A317 PolarHBondContact O-N 3.07Å |
| 314 | A | 62.9 | Low | 59.5 | Low | 52 Ų | 52 | 86.3 Ų | 86.3 | 43% | 0.43 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -65.2 | -42 | 175 | 0 | 0 | 0 | 0 | 0 | 112 | Q310 K311 A312 T318 | Q310-A314 WeakPolarHBondContact O-CB 3.41Å; Q310-A314 PolarHBondContact O-N 3.33Å; K311-A314 CarbonylContact O-C 3.52Å; K311-A314 WeakPolarHBondContact O-CB 2.96Å; K311-A314 PolarHBondContact O-N 3.5Å; A312-A314 VanDerWaalsContact C-N 3.3Å; A314-T318 WeakPolarHBondContact O-CB 3.41Å; A314-T318 PolarHBondContact O-N 3.36Å; A314-T318 PolarHBondContact O-OG1 3.33Å |
| 315 | E | 64.2 | Low | 59.1 | Low | 86 Ų | 86 | 82.6 Ų | 82.6 | 40% | 0.402 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -71 | -34.8 | 177.9 | -77.1 | 177.5 | -169.4 | 0 | 0 | 112.8 | K311 A312 G319 | K311-E315 VanDerWaalsContact CE-OE1 3.32Å; K311-E315 WeakPolarHBondContact CE-OE1 3.27Å; K311-E315 IonicContact NZ-OE1 4Å; K311-E315 WeakPolarHBondContact O-CB 3.05Å; K311-E315 WeakPolarHBondContact O-CG 3.08Å; K311-E315 PolarHBondContact O-N 3.04Å; A312-E315 PolarHBondContact O-N 3.38Å; E315-G319 WeakPolarHBondContact O-CA 3.44Å; E315-G319 PolarHBondContact O-N 3.15Å |
| 316 | F | 65.6 | Low | 59.3 | Low | 152 Ų | 152 | 84 Ų | 84 | 67% | 0.667 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -69.4 | -46 | 172.7 | -174.6 | -98 | 0 | 0 | 0 | 111 | A312 T318 G319 V320 | A312-F316 VanDerWaalsContact O-CB 3.23Å; A312-F316 WeakPolarHBondContact O-CB 3.4Å; A312-F316 PolarHBondContact O-N 3.2Å; F316-T318 VanDerWaalsContact C-N 3.33Å; F316-T318 PolarHBondContact O-N 3.1Å; F316-G319 PolarHBondContact O-N 3.38Å; F316-V320 HydrophobicContact CD1-CG2 4.21Å; F316-V320 HydrophobicContact CD2-CG2 4.44Å; F316-V320 HydrophobicContact CE1-CG2 3.94Å; F316-V320 HydrophobicContact CE2-CG2 4.19Å; F316-V320 HydrophobicContact CG-CG2 4.46Å; F316-V320 HydrophobicContact CZ-CG2 3.93Å; F316-V320 VanDerWaalsContact O-CB 3.31Å; F316-V320 WeakPolarHBondContact O-CB 3.41Å; F316-V320 WeakPolarHBondContact O-CG2 3.49Å; F316-V320 PolarHBondContact O-N 3.39Å |
| 317 | A | 63.1 | Low | 60.2 | Low | 46 Ų | 46 | 86.1 Ų | 86.1 | 38% | 0.38 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -60.6 | -43.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | Q313 M321 | Q313-A317 WeakPolarHBondContact O-CB 3.39Å; Q313-A317 PolarHBondContact O-N 3.07Å; A317-M321 VanDerWaalsContact O-CB 3.28Å; A317-M321 WeakPolarHBondContact O-CB 3.33Å; A317-M321 VanDerWaalsContact O-CG 3.27Å; A317-M321 WeakPolarHBondContact O-CG 3.43Å; A317-M321 PolarHBondContact O-N 2.99Å |
| 318 | T | 63.7 | Low | 61 | Low | 89 Ų | 89 | 88.5 Ų | 88.5 | 55% | 0.546 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -71.7 | -36.6 | 178.9 | -51.2 | 0 | 0 | 0 | 0 | 111.7 | A314 F316 M321 S322 | A314-T318 WeakPolarHBondContact O-CB 3.41Å; A314-T318 PolarHBondContact O-N 3.36Å; A314-T318 PolarHBondContact O-OG1 3.33Å; F316-T318 VanDerWaalsContact C-N 3.33Å; F316-T318 PolarHBondContact O-N 3.1Å; T318-M321 PolarHBondContact O-N 3.35Å; T318-S322 WeakPolarHBondContact O-CB 3.47Å; T318-S322 PolarHBondContact O-N 3.42Å; T318-S322 PolarHBondContact O-OG 3.34Å |
| 319 | G | 59.4 | Low | 61.7 | Low | 35 Ų | 35 | 90.9 Ų | 90.9 | 36% | 0.361 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -70.9 | -35.9 | 177 | 0 | 0 | 0 | 0 | 0 | 113.2 | E315 F316 S322 N323 | E315-G319 WeakPolarHBondContact O-CA 3.44Å; E315-G319 PolarHBondContact O-N 3.15Å; F316-G319 PolarHBondContact O-N 3.38Å; G319-S322 WeakPolarHBondContact CA-OG 3.41Å; G319-S322 PolarHBondContact O-OG 3.37Å; G319-N323 PolarHBondContact O-N 3.49Å |
| 320 | V | 61.3 | Low | 62.6 | Low | 59 Ų | 59 | 88.3 Ų | 88.3 | 36% | 0.358 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -72.4 | -38.8 | 172.2 | 174.4 | 0 | 0 | 0 | 0 | 110.5 | F316 V326 | F316-V320 HydrophobicContact CD1-CG2 4.21Å; F316-V320 HydrophobicContact CD2-CG2 4.44Å; F316-V320 HydrophobicContact CE1-CG2 3.94Å; F316-V320 HydrophobicContact CE2-CG2 4.19Å; F316-V320 HydrophobicContact CG-CG2 4.46Å; F316-V320 HydrophobicContact CZ-CG2 3.93Å; F316-V320 VanDerWaalsContact O-CB 3.31Å; F316-V320 WeakPolarHBondContact O-CB 3.41Å; F316-V320 WeakPolarHBondContact O-CG2 3.49Å; F316-V320 PolarHBondContact O-N 3.39Å; V320-V326 HydrophobicContact CG1-CG1 3.91Å; V320-V326 WeakPolarHBondContact O-CB 3.35Å; V320-V326 WeakPolarHBondContact O-CG1 3.1Å |
| 321 | M | 59 | Low | 63.1 | Low | 141 Ų | 141 | 83.8 Ų | 83.8 | 70% | 0.695 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -71.9 | -31.4 | 174.4 | -77.6 | -168.5 | -166.2 | 0 | 0 | 114 | A317 T318 N323 R327 | A317-M321 VanDerWaalsContact O-CB 3.28Å; A317-M321 WeakPolarHBondContact O-CB 3.33Å; A317-M321 VanDerWaalsContact O-CG 3.27Å; A317-M321 WeakPolarHBondContact O-CG 3.43Å; A317-M321 PolarHBondContact O-N 2.99Å; T318-M321 PolarHBondContact O-N 3.35Å; M321-N323 VanDerWaalsContact C-N 3.34Å; M321-R327 WeakPolarHBondContact O-CD 3.4Å; M321-R327 WeakPolarHBondContact O-CG 3.46Å; M321-R327 PolarHBondContact O-NE 3.05Å |
| 322 | S | 59.9 | Low | 63.4 | Low | 67 Ų | 67 | 82.6 Ų | 82.6 | 47% | 0.469 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -81.8 | -15.1 | -178.5 | 68.8 | 0 | 0 | 0 | 0 | 112.6 | T318 G319 Q324 R327 | T318-S322 WeakPolarHBondContact O-CB 3.47Å; T318-S322 PolarHBondContact O-N 3.42Å; T318-S322 PolarHBondContact O-OG 3.34Å; G319-S322 WeakPolarHBondContact CA-OG 3.41Å; G319-S322 PolarHBondContact O-OG 3.37Å; S322-Q324 PolarHBondContact O-N 2.81Å; S322-R327 PolarHBondContact O-NH2 2.94Å |
| 323 | N | 61.8 | Low | 64 | Low | 85 Ų | 85 | 85 Ų | 85 | 46% | 0.455 | 50% | 0.501 | S | S | . | . | trans | -70.9 | 114.1 | 178 | -155.5 | -34 | 0 | 0 | 0 | 110.9 | G319 M321 A325 V326 R327 | G319-N323 PolarHBondContact O-N 3.49Å; M321-N323 VanDerWaalsContact C-N 3.34Å; N323-A325 PolarHBondContact O-N 2.93Å; N323-A325 PolarHBondContact OD1-N 2.93Å; N323-V326 HydrophobicContact CB-CB 4.17Å; N323-V326 HydrophobicContact CB-CG2 3.92Å; N323-V326 PolarHBondContact O-N 3.38Å; N323-V326 VanDerWaalsContact O-N 3.11Å; N323-R327 PolarHBondContact O-N 3.05Å | ||
| 324 | Q | 57.7 | Low | 64.3 | Low | 145 Ų | 145 | 81.5 Ų | 81.5 | 68% | 0.678 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -57 | -34.4 | -179.3 | -89.3 | -179.9 | -44.4 | 0 | 0 | 112.5 | S322 R327 Q328 | S322-Q324 PolarHBondContact O-N 2.81Å; Q324-R327 PolarHBondContact O-N 3.15Å; Q324-Q328 WeakPolarHBondContact O-CB 3.5Å; Q324-Q328 PolarHBondContact O-N 2.89Å |
| 325 | A | 67.5 | Low | 64.3 | Low | 61 Ų | 61 | 85.7 Ų | 85.7 | 50% | 0.504 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -67.4 | -38.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | N323 A329 | N323-A325 PolarHBondContact O-N 2.93Å; N323-A325 PolarHBondContact OD1-N 2.93Å; A325-A329 WeakPolarHBondContact O-CB 3.5Å; A325-A329 PolarHBondContact O-N 3.14Å |
| 326 | V | 67.3 | Low | 64.1 | Low | 60 Ų | 60 | 83.8 Ų | 83.8 | 36% | 0.364 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -73.1 | -38 | 176.5 | 179.7 | 0 | 0 | 0 | 0 | 110.5 | V320 N323 A329 A330 | V320-V326 HydrophobicContact CG1-CG1 3.91Å; V320-V326 WeakPolarHBondContact O-CB 3.35Å; V320-V326 WeakPolarHBondContact O-CG1 3.1Å; N323-V326 HydrophobicContact CB-CB 4.17Å; N323-V326 HydrophobicContact CB-CG2 3.92Å; N323-V326 PolarHBondContact O-N 3.38Å; N323-V326 VanDerWaalsContact O-N 3.11Å; V326-A329 PolarHBondContact O-N 3.18Å; V326-A330 VanDerWaalsContact O-CB 3.24Å; V326-A330 WeakPolarHBondContact O-CB 3.32Å; V326-A330 PolarHBondContact O-N 2.64Å |
| 327 | R | 67.1 | Low | 63.6 | Low | 138 Ų | 138 | 80 Ų | 80 | 52% | 0.521 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.6 | -41.6 | 172.4 | -78.8 | -172.7 | -85.1 | 178.2 | -6.5 | 112.4 | M321 S322 N323 Q324 A331 | M321-R327 WeakPolarHBondContact O-CD 3.4Å; M321-R327 WeakPolarHBondContact O-CG 3.46Å; M321-R327 PolarHBondContact O-NE 3.05Å; S322-R327 PolarHBondContact O-NH2 2.94Å; N323-R327 PolarHBondContact O-N 3.05Å; Q324-R327 PolarHBondContact O-N 3.15Å; R327-A331 WeakPolarHBondContact O-CB 3.41Å; R327-A331 PolarHBondContact O-N 2.93Å |
| 328 | Q | 68.4 | Low | 63.4 | Low | 131 Ų | 131 | 86.9 Ų | 86.9 | 61% | 0.612 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -66.2 | -45.4 | 174.5 | -84.6 | 167.6 | -32.3 | 0 | 0 | 111.5 | Q324 A330 A331 S332 | Q324-Q328 WeakPolarHBondContact O-CB 3.5Å; Q324-Q328 PolarHBondContact O-N 2.89Å; Q328-A330 PolarHBondContact O-N 3.29Å; Q328-A331 PolarHBondContact O-N 3.28Å; Q328-S332 WeakPolarHBondContact O-CB 3.39Å; Q328-S332 PolarHBondContact O-N 3.25Å; Q328-S332 PolarHBondContact O-OG 3.21Å |
| 329 | A | 67.4 | Low | 63.1 | Low | 63 Ų | 63 | 87.9 Ų | 87.9 | 52% | 0.521 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.9 | -42.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | A325 V326 A333 | A325-A329 WeakPolarHBondContact O-CB 3.5Å; A325-A329 PolarHBondContact O-N 3.14Å; V326-A329 PolarHBondContact O-N 3.18Å; A329-A333 WeakPolarHBondContact O-CB 3.36Å; A329-A333 PolarHBondContact O-N 2.91Å |
| 330 | A | 68 | Low | 62.5 | Low | 58 Ų | 58 | 89.7 Ų | 89.7 | 48% | 0.479 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -68.4 | -39.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | V326 Q328 A333 A334 | V326-A330 VanDerWaalsContact O-CB 3.24Å; V326-A330 WeakPolarHBondContact O-CB 3.32Å; V326-A330 PolarHBondContact O-N 2.64Å; Q328-A330 PolarHBondContact O-N 3.29Å; A330-A333 PolarHBondContact O-N 3.34Å; A330-A334 WeakPolarHBondContact O-CB 3.49Å; A330-A334 PolarHBondContact O-N 3.47Å |
| 331 | A | 65.1 | Low | 62 | Low | 51 Ų | 51 | 93 Ų | 93 | 42% | 0.421 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -65.4 | -40.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | R327 Q328 A334 Q335 | R327-A331 WeakPolarHBondContact O-CB 3.41Å; R327-A331 PolarHBondContact O-N 2.93Å; Q328-A331 PolarHBondContact O-N 3.28Å; A331-A334 PolarHBondContact O-N 3.23Å; A331-Q335 WeakPolarHBondContact O-CG 3.42Å; A331-Q335 PolarHBondContact O-N 3.22Å |
| 332 | S | 68.1 | Low | 61.4 | Low | 76 Ų | 76 | 101.6 Ų | 101.6 | 53% | 0.531 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -66.8 | -38.9 | 175.3 | -61.4 | 0 | 0 | 0 | 0 | 112.4 | Q328 Q335 G336 | Q328-S332 WeakPolarHBondContact O-CB 3.39Å; Q328-S332 PolarHBondContact O-N 3.25Å; Q328-S332 PolarHBondContact O-OG 3.21Å; S332-Q335 PolarHBondContact O-N 3.46Å; S332-G336 PolarHBondContact O-N 3.43Å; S332-G336 VanDerWaalsContact O-N 3.08Å |
| 333 | A | 68.1 | Low | 61.4 | Low | 67 Ų | 67 | 103.3 Ų | 103.3 | 55% | 0.554 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -66.9 | -40 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | A329 A330 G336 A337 | A329-A333 WeakPolarHBondContact O-CB 3.36Å; A329-A333 PolarHBondContact O-N 2.91Å; A330-A333 PolarHBondContact O-N 3.34Å; A333-G336 PolarHBondContact O-N 3.1Å; A333-A337 PolarHBondContact O-N 2.88Å; A333-A337 VanDerWaalsContact O-N 3.15Å |
| 334 | A | 64.4 | Low | 61.4 | Low | 49 Ų | 49 | 104.3 Ų | 104.3 | 41% | 0.405 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -64.7 | -41.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112 | A330 A331 G336 A337 F338 | A330-A334 WeakPolarHBondContact O-CB 3.49Å; A330-A334 PolarHBondContact O-N 3.47Å; A331-A334 PolarHBondContact O-N 3.23Å; A334-G336 VanDerWaalsContact C-N 3.31Å; A334-G336 PolarHBondContact O-N 3.09Å; A334-A337 PolarHBondContact O-N 3.38Å; A334-F338 WeakPolarHBondContact O-CD2 3.38Å; A334-F338 PolarHBondContact O-N 3.04Å |
| 335 | Q | 62.7 | Low | 61.6 | Low | 140 Ų | 140 | 102 Ų | 102 | 65% | 0.654 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -65.6 | -31.4 | 175.1 | -74 | -177.5 | -17.9 | 0 | 0 | 113.1 | A331 S332 T339 | A331-Q335 WeakPolarHBondContact O-CG 3.42Å; A331-Q335 PolarHBondContact O-N 3.22Å; S332-Q335 PolarHBondContact O-N 3.46Å; Q335-T339 PolarHBondContact O-OG1 3.32Å |
| 336 | G | 59.8 | Low | 61.3 | Low | 46 Ų | 46 | 104.4 Ų | 104.4 | 47% | 0.474 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -69.7 | -29.2 | 172.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | S332 A333 A334 T339 | S332-G336 PolarHBondContact O-N 3.43Å; S332-G336 VanDerWaalsContact O-N 3.08Å; A333-G336 PolarHBondContact O-N 3.1Å; A334-G336 VanDerWaalsContact C-N 3.31Å; A334-G336 PolarHBondContact O-N 3.09Å; G336-T339 PolarHBondContact O-OG1 3.14Å |
| 337 | A | 56.5 | Low | 60.9 | Low | 74 Ų | 74 | 107.2 Ų | 107.2 | 61% | 0.612 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -78.1 | -27.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | A333 A334 T339 | A333-A337 PolarHBondContact O-N 2.88Å; A333-A337 VanDerWaalsContact O-N 3.15Å; A334-A337 PolarHBondContact O-N 3.38Å; A337-T339 VanDerWaalsContact C-N 3.34Å |
| 338 | F | 58.5 | Low | 60.5 | Low | 190 Ų | 190 | 105.1 Ų | 105.1 | 83% | 0.833 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.1 | -10.7 | 175 | -84.2 | -80.3 | 0 | 0 | 0 | 114.1 | A334 | A334-F338 WeakPolarHBondContact O-CD2 3.38Å; A334-F338 PolarHBondContact O-N 3.04Å |
| 339 | T | 57 | Low | 59.9 | Low | 110 Ų | 110 | 103.3 Ų | 103.3 | 68% | 0.675 | 63% | 0.629 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.8 | 6.2 | 179.5 | 47.2 | 0 | 0 | 0 | 0 | 113.4 | Q335 G336 A337 P341 | Q335-T339 PolarHBondContact O-OG1 3.32Å; G336-T339 PolarHBondContact O-OG1 3.14Å; A337-T339 VanDerWaalsContact C-N 3.34Å; T339-P341 WeakPolarHBondContact O-CD 3.4Å |
| 340 | A | 47.8 | Very low | 59.3 | Low | 72 Ų | 72 | 106.4 Ų | 106.4 | 60% | 0.595 | 64% | 0.637 | S | S | * | * | trans | -64.6 | 118.8 | 173.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 341 | P | 50.9 | Low | 58.6 | Low | 128 Ų | 128 | 110.4 Ų | 110.4 | 83% | 0.831 | 65% | 0.65 | S | S | * | * | trans | -68.8 | 138.4 | 177.8 | 28.2 | -30.5 | 0 | 0 | 0 | 109.6 | T339 | T339-P341 WeakPolarHBondContact O-CD 3.4Š| ||
| 342 | R | 44.5 | Very low | 58 | Low | 322 Ų | 322 | 115.8 Ų | 115.8 | 100% | 1.215 | 67% | 0.671 | S | S | * | * | trans | -65.1 | 0 | 170.2 | -95.6 | -174 | 177.9 | 147.4 | -0.3 | 112 |
Retrieved 342 of 342 residues in 493.9 ms
(Link to these results)