| 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 | 42.9 | Very low | 45.4 | Very low | 250 Ų | 250 | 155 Ų | 155 | 100% | 1.232 | 86% | 0.86 | S | S | * | * | 0 | 133.3 | 0 | -73.6 | -179.5 | 174.6 | 0 | 0 | 107 | |||||
| 2 | G | 49.6 | Very low | 46 | Very low | 83 Ų | 83 | 159.3 Ų | 159.3 | 86% | 0.856 | 86% | 0.863 | S | S | * | * | trans | 84.4 | 118.4 | -157.1 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 3 | D | 41.4 | Very low | 45.5 | Very low | 163 Ų | 163 | 160.5 Ų | 160.5 | 87% | 0.872 | 86% | 0.86 | S | S | * | * | trans | -149.9 | 161.1 | -165.9 | -161.6 | -2.4 | 0 | 0 | 0 | 110.2 | ||||
| 4 | A | 47.1 | Very low | 45.7 | Very low | 79 Ų | 79 | 157.2 Ų | 157.2 | 65% | 0.653 | 86% | 0.855 | S | S | * | * | trans | 51.4 | 119 | 168.6 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 5 | F | 54.7 | Low | 45.4 | Very low | 204 Ų | 204 | 159.1 Ų | 159.1 | 90% | 0.895 | 86% | 0.855 | S | S | * | * | -152.6 | 142.4 | 96.7 | -139.9 | -101.6 | 0 | 0 | 0 | 112.2 | |||||
| 6 | L | 44.1 | Very low | 45.6 | Very low | 154 Ų | 154 | 160.8 Ų | 160.8 | 81% | 0.806 | 86% | 0.857 | S | S | * | * | trans | -153.7 | 114.2 | -173.5 | -167.1 | 178.3 | 0 | 0 | 0 | 109 | ||||
| 7 | K | 52.9 | Low | 45.1 | Very low | 201 Ų | 201 | 158.6 Ų | 158.6 | 87% | 0.874 | 85% | 0.851 | S | S | * | * | trans | -166 | 136.4 | 150.1 | -117.5 | 167.6 | -174.8 | 176.3 | 0 | 113.8 | ||||
| 8 | E | 37.9 | Very low | 45.4 | Very low | 191 Ų | 191 | 159.4 Ų | 159.4 | 89% | 0.893 | 85% | 0.845 | S | S | * | * | trans | -121.9 | 139.4 | 172.4 | 178.1 | 177.8 | -158.1 | 0 | 0 | 107.1 | ||||
| 9 | A | 50 | Low | 45.5 | Very low | 104 Ų | 104 | 157.2 Ų | 157.2 | 86% | 0.86 | 83% | 0.834 | S | S | * | * | trans | -158.8 | 151.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 10 | S | 40.3 | Very low | 45.5 | Very low | 103 Ų | 103 | 156.3 Ų | 156.3 | 72% | 0.72 | 83% | 0.829 | S | S | * | * | trans | -125.1 | 163.5 | -157.1 | -164.6 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 11 | H | 38.1 | Very low | 45.5 | Very low | 173 Ų | 173 | 152.8 Ų | 152.8 | 80% | 0.801 | 82% | 0.817 | S | S | * | * | trans | 22.3 | 130.5 | 166.9 | -71.6 | -68.4 | 0 | 0 | 0 | 121.1 | ||||
| 12 | K | 52.7 | Low | 45.7 | Very low | 206 Ų | 206 | 149.2 Ų | 149.2 | 90% | 0.896 | 80% | 0.797 | S | S | * | * | -147.7 | 141.5 | 126.7 | -136.8 | 169.7 | -173.5 | 175.9 | 0 | 111.6 | |||||
| 13 | E | 39.7 | Very low | 45.8 | Very low | 176 Ų | 176 | 154.9 Ų | 154.9 | 82% | 0.822 | 80% | 0.798 | S | S | * | * | trans | -127.8 | 141 | -177.2 | -177.3 | 171.7 | -157.6 | 0 | 0 | 109 | ||||
| 14 | S | 48.2 | Very low | 45.8 | Very low | 114 Ų | 114 | 156.4 Ų | 156.4 | 80% | 0.797 | 80% | 0.8 | S | S | * | * | trans | -148.7 | 123.7 | -176.3 | -65.7 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 15 | H | 41.8 | Very low | 45.8 | Very low | 185 Ų | 185 | 157.7 Ų | 157.7 | 86% | 0.856 | 81% | 0.811 | S | S | * | * | trans | -69.8 | 147 | 174.4 | -82.7 | -86.5 | 0 | 0 | 0 | 113.1 | ||||
| 16 | Q | 48.6 | Very low | 45.4 | Very low | 187 Ų | 187 | 156 Ų | 156 | 87% | 0.874 | 80% | 0.803 | S | S | * | * | trans | -150.9 | 132.9 | 139.5 | -155.1 | 161 | 23.9 | 0 | 0 | 111.7 | ||||
| 17 | T | 36.9 | Very low | 45.4 | Very low | 123 Ų | 123 | 155.4 Ų | 155.4 | 76% | 0.755 | 80% | 0.796 | S | S | * | * | trans | -135.4 | 145.8 | 174.2 | 39.7 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 18 | K | 50.4 | Low | 44.9 | Very low | 173 Ų | 173 | 151.3 Ų | 151.3 | 75% | 0.752 | 79% | 0.793 | S | S | * | * | trans | -162.1 | 139.8 | 170.3 | -112.6 | -169.5 | 170.7 | -98.5 | 0 | 112 | ||||
| 19 | D | 46.5 | Very low | 45.1 | Very low | 117 Ų | 117 | 147.5 Ų | 147.5 | 63% | 0.626 | 79% | 0.787 | S | S | * | * | trans | 34.5 | 142.8 | 132 | -47.9 | -2.4 | 0 | 0 | 0 | 120.8 | ||||
| 20 | D | 46.6 | Very low | 44.8 | Very low | 139 Ų | 139 | 147.8 Ų | 147.8 | 74% | 0.743 | 78% | 0.783 | S | S | * | * | cis | -171 | 166.1 | -22.2 | -152.2 | -46 | 0 | 0 | 0 | 109 | ||||
| 21 | S | 44.2 | Very low | 44.9 | Very low | 83 Ų | 83 | 152.6 Ų | 152.6 | 58% | 0.58 | 79% | 0.794 | S | S | * | * | trans | 71.9 | 118.8 | 141.7 | -77.3 | 0 | 0 | 0 | 0 | 123.8 | ||||
| 22 | H | 47.5 | Very low | 45.3 | Very low | 175 Ų | 175 | 149.8 Ų | 149.8 | 81% | 0.81 | 79% | 0.794 | S | S | * | * | trans | 55 | 112 | 134.6 | -72 | -78.2 | 0 | 0 | 0 | 122.2 | ||||
| 23 | K | 51.1 | Low | 45.2 | Very low | 203 Ų | 203 | 145.6 Ų | 145.6 | 88% | 0.883 | 79% | 0.791 | S | S | * | * | -175.7 | 136.4 | 94.2 | -106.3 | 177.4 | 178.5 | 174.1 | 0 | 113.3 | |||||
| 24 | E | 42.4 | Very low | 45.9 | Very low | 194 Ų | 194 | 142.4 Ų | 142.4 | 91% | 0.907 | 79% | 0.788 | S | S | * | * | trans | -87.8 | 146.9 | 158.7 | -66.3 | -173.1 | 127.1 | 0 | 0 | 110.4 | ||||
| 25 | A | 46.2 | Very low | 46.4 | Very low | 106 Ų | 106 | 142.4 Ų | 142.4 | 88% | 0.876 | 79% | 0.788 | S | S | * | * | trans | -142.5 | 143.9 | 169.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 26 | K | 46.2 | Very low | 47.3 | Very low | 169 Ų | 169 | 143.1 Ų | 143.1 | 74% | 0.735 | 79% | 0.788 | S | S | * | * | trans | -87.1 | 162.1 | -162.8 | -120 | 172.4 | 155.5 | -132.4 | 0 | 113.8 | ||||
| 27 | E | 45.6 | Very low | 48.4 | Very low | 142 Ų | 142 | 145.6 Ų | 145.6 | 66% | 0.664 | 79% | 0.79 | S | S | * | * | trans | 67.6 | 100.8 | 142.3 | -75.8 | 156.3 | 170.6 | 0 | 0 | 121.1 | ||||
| 28 | S | 42.4 | Very low | 50.4 | Low | 115 Ų | 115 | 145.2 Ų | 145.2 | 80% | 0.804 | 79% | 0.789 | S | S | * | * | 114.5 | 149.8 | 104.9 | 77.2 | 0 | 0 | 0 | 0 | 120.6 | |||||
| 29 | S | 42 | Very low | 51.9 | Low | 111 Ų | 111 | 144.6 Ų | 144.6 | 78% | 0.776 | 79% | 0.793 | S | S | * | * | trans | 89 | 144.1 | 149.6 | -152.3 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 30 | S | 43.5 | Very low | 53.7 | Low | 109 Ų | 109 | 146 Ų | 146 | 76% | 0.762 | 80% | 0.799 | S | S | * | * | trans | 67.5 | 107 | 166.1 | 69 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 31 | Q | 42.4 | Very low | 55.5 | Low | 204 Ų | 204 | 144.7 Ų | 144.7 | 95% | 0.953 | 80% | 0.796 | S | S | * | * | trans | -70.2 | 138.4 | 154 | -63.7 | 168.1 | -72.9 | 0 | 0 | 109.3 | ||||
| 32 | S | 46.8 | Very low | 57.6 | Low | 115 Ų | 115 | 146.4 Ų | 146.4 | 80% | 0.804 | 80% | 0.803 | S | S | * | * | trans | -120.7 | 117.3 | 165.6 | 55 | 0 | 0 | 0 | 0 | 110.5 | S34 | S32-S34 PolarHBondContact O-N 3.3Š| ||
| 33 | S | 50.1 | Low | 59.3 | Low | 118 Ų | 118 | 143.9 Ų | 143.9 | 83% | 0.825 | 80% | 0.795 | S | S | * | * | trans | -76.7 | 109.7 | 178.2 | 53 | 0 | 0 | 0 | 0 | 110.2 | S35 | S33-S35 PolarHBondContact O-N 2.97Š| ||
| 34 | S | 54.4 | Low | 61.2 | Low | 109 Ų | 109 | 143.8 Ų | 143.8 | 76% | 0.762 | 79% | 0.794 | S | S | * | * | trans | -72.4 | 93.3 | -178.3 | 48.3 | 0 | 0 | 0 | 0 | 112.1 | S32 K36 | S32-S34 PolarHBondContact O-N 3.3Å; S34-K36 PolarHBondContact O-N 3.08Å; S34-K36 VanDerWaalsContact O-N 3.08Å | ||
| 35 | S | 58.9 | Low | 63.5 | Low | 113 Ų | 113 | 139.5 Ų | 139.5 | 79% | 0.79 | 77% | 0.77 | S | S | * | * | trans | -62.2 | 108.8 | 173 | 49.5 | 0 | 0 | 0 | 0 | 110.4 | S33 R37 | S33-S35 PolarHBondContact O-N 2.97Å; S35-R37 PolarHBondContact O-N 3.1Å; S35-R37 VanDerWaalsContact O-N 3.1Å | ||
| 36 | K | 60.4 | Low | 65.8 | Low | 201 Ų | 201 | 142.3 Ų | 142.3 | 87% | 0.874 | 76% | 0.763 | S | S | * | * | trans | -64.1 | 112.9 | -177.7 | -67.7 | 179.3 | 180 | 175.8 | 0 | 110 | S34 | S34-K36 PolarHBondContact O-N 3.08Å; S34-K36 VanDerWaalsContact O-N 3.08Å | ||
| 37 | R | 71.2 | Confident | 67.9 | Low | 238 Ų | 238 | 143.6 Ų | 143.6 | 90% | 0.898 | 77% | 0.769 | S | S | * | * | trans | -56.7 | 134.7 | 173.4 | -69.1 | -177.9 | 176.6 | 179.5 | -1.1 | 109.9 | S35 L39 | S35-R37 PolarHBondContact O-N 3.1Å; S35-R37 VanDerWaalsContact O-N 3.1Å; R37-L39 PolarHBondContact O-N 3.39Å | ||
| 38 | P | 80 | Confident | 70.2 | Confident | 115 Ų | 115 | 145.7 Ų | 145.7 | 75% | 0.747 | 78% | 0.776 | S | S | * | * | trans | -67.9 | 131.4 | 179.4 | 27.3 | -34 | 0 | 0 | 0 | 111.2 | I40 | P38-I40 PolarHBondContact O-N 3.47Š| ||
| 39 | L | 81.9 | Confident | 72.5 | Confident | 160 Ų | 160 | 143.5 Ų | 143.5 | 84% | 0.838 | 76% | 0.755 | S | S | * | * | trans | -83.9 | 105.6 | 178.2 | -173.1 | 72.9 | 0 | 0 | 0 | 110.4 | R37 V41 | R37-L39 PolarHBondContact O-N 3.39Å; L39-V41 HydrophobicContact CD2-CG2 4.27Å; L39-V41 HydrophobicContact CG-CG2 4.3Å; L39-V41 PolarHBondContact O-N 3.44Å | ||
| 40 | I | 84.7 | Confident | 74.8 | Confident | 147 Ų | 147 | 140.8 Ų | 140.8 | 75% | 0.754 | 73% | 0.733 | S | S | * | * | trans | -83.4 | 111.2 | 178.2 | -57.8 | 176.9 | 0 | 0 | 0 | 109.8 | P38 V42 | P38-I40 PolarHBondContact O-N 3.47Å; I40-V42 HydrophobicContact CG2-CG2 4.38Å | ||
| 41 | V | 83.4 | Confident | 77 | Confident | 111 Ų | 111 | 144.3 Ų | 144.3 | 67% | 0.673 | 74% | 0.735 | S | S | * | * | trans | -97.7 | 107.1 | -179.8 | -178.6 | 0 | 0 | 0 | 0 | 110.9 | L39 L43 | L39-V41 HydrophobicContact CD2-CG2 4.27Å; L39-V41 HydrophobicContact CG-CG2 4.3Å; L39-V41 PolarHBondContact O-N 3.44Å; V41-L43 PolarHBondContact O-N 3.24Å | ||
| 42 | V | 87.8 | Confident | 79.2 | Confident | 120 Ų | 120 | 143.5 Ų | 143.5 | 73% | 0.727 | 72% | 0.723 | S | S | * | * | trans | -87.7 | 93 | 179 | -176.8 | 0 | 0 | 0 | 0 | 110.9 | I40 K44 | I40-V42 HydrophobicContact CG2-CG2 4.38Å; V42-K44 PolarHBondContact O-N 2.93Å | ||
| 43 | L | 84.2 | Confident | 81.3 | Confident | 122 Ų | 122 | 139.1 Ų | 139.1 | 64% | 0.639 | 69% | 0.692 | S | S | * | * | trans | -82.2 | 107.5 | -179.5 | -160.5 | 82.2 | 0 | 0 | 0 | 112 | V41 Y45 | V41-L43 PolarHBondContact O-N 3.24Å; L43-Y45 VanDerWaalsContact O-CD1 3.25Å; L43-Y45 WeakPolarHBondContact O-CD1 3.32Å | ||
| 44 | K | 91 | Very high | 83.1 | Confident | 200 Ų | 200 | 138.3 Ų | 138.3 | 87% | 0.87 | 68% | 0.678 | S | S | * | * | trans | -80 | 128.3 | 171.6 | -68 | -178.6 | 179.8 | 176.7 | 0 | 110.9 | V42 | V42-K44 PolarHBondContact O-N 2.93Š| ||
| 45 | Y | 91.1 | Very high | 84.7 | Confident | 104 Ų | 104 | 142.7 Ų | 142.7 | 41% | 0.408 | 68% | 0.677 | S | S | . | * | trans | -138 | 149.8 | 179.1 | 54.8 | -93.7 | 0 | 0 | 0 | 112.8 | L43 N49 V50 V53 | L43-Y45 VanDerWaalsContact O-CD1 3.25Å; L43-Y45 WeakPolarHBondContact O-CD1 3.32Å; Y45-N49 HydrophobicContact CD2-CB 4.31Å; Y45-V50 HydrophobicContact CD2-CG2 4.42Å; Y45-V50 HydrophobicContact CE2-CB 4.27Å; Y45-V50 HydrophobicContact CE2-CG2 3.71Å; Y45-V53 HydrophobicContact CD1-CG1 4.25Å; Y45-V53 HydrophobicContact CD1-CG2 3.95Å; Y45-V53 HydrophobicContact CD2-CG2 4.07Å; Y45-V53 HydrophobicContact CE1-CB 4.27Å; Y45-V53 HydrophobicContact CE1-CG1 3.81Å; Y45-V53 HydrophobicContact CE1-CG2 4.2Å; Y45-V53 HydrophobicContact CE2-CB 4.43Å; Y45-V53 HydrophobicContact CE2-CG2 4.3Å; Y45-V53 HydrophobicContact CG-CG2 3.89Å | ||
| 46 | K | 93.2 | Very high | 86.1 | Confident | 166 Ų | 166 | 142.2 Ų | 142.2 | 72% | 0.722 | 67% | 0.665 | S | S | * | * | trans | -66.7 | 142.4 | 177.9 | -63.2 | -171.4 | 177.5 | -173.3 | 0 | 110.4 | K48 N49 | K46-K48 HydrophobicContact CB-CG 4.5Å; K46-K48 PolarHBondContact O-N 3.3Å; K46-N49 WeakPolarHBondContact O-CB 3.35Å; K46-N49 PolarHBondContact O-N 2.99Å | ||
| 47 | K | 91.1 | Very high | 87.4 | Confident | 196 Ų | 196 | 139.2 Ų | 139.2 | 85% | 0.852 | 66% | 0.658 | S | S | * | * | G | 310 helix | trans | -46.5 | -36.5 | -176.4 | -77.8 | -172.5 | 175.7 | -178.6 | 0 | 114.5 | N49 V50 | K47-N49 PolarHBondContact O-N 3.38Å; K47-N49 VanDerWaalsContact O-N 3.1Å; K47-V50 WeakPolarHBondContact O-CG2 3.39Å; K47-V50 PolarHBondContact O-N 2.87Å |
| 48 | K | 93.3 | Very high | 88.1 | Confident | 186 Ų | 186 | 131.7 Ų | 131.7 | 81% | 0.809 | 65% | 0.647 | S | S | * | * | G | 310 helix | trans | -60.5 | -18.2 | 177 | 68.6 | 174.7 | -174.5 | 175.3 | 0 | 115.1 | K46 | K46-K48 HydrophobicContact CB-CG 4.5Å; K46-K48 PolarHBondContact O-N 3.3Å |
| 49 | N | 91.7 | Very high | 88 | Confident | 68 Ų | 68 | 131.8 Ų | 131.8 | 36% | 0.364 | 64% | 0.64 | S | S | . | * | G | 310 helix | trans | -92.2 | -8.5 | -179.6 | -68.3 | 3.9 | 0 | 0 | 0 | 114 | Y45 K46 K47 K51 R52 V53 | Y45-N49 HydrophobicContact CD2-CB 4.31Å; K46-N49 WeakPolarHBondContact O-CB 3.35Å; K46-N49 PolarHBondContact O-N 2.99Å; K47-N49 PolarHBondContact O-N 3.38Å; K47-N49 VanDerWaalsContact O-N 3.1Å; N49-K51 PolarHBondContact O-N 3.13Å; N49-R52 WeakPolarHBondContact O-CA 3.25Å; N49-R52 WeakPolarHBondContact O-CB 3.32Å; N49-R52 PolarHBondContact O-N 3.05Å; N49-V53 HydrophobicContact CB-CG2 4.42Å; N49-V53 PolarHBondContact O-N 3.14Å |
| 50 | V | 90 | Very high | 86.7 | Confident | 54 Ų | 54 | 133 Ų | 133 | 33% | 0.327 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -47.7 | -53.8 | -174 | 172.6 | 0 | 0 | 0 | 0 | 112.2 | Y45 K47 R52 V53 L54 | Y45-V50 HydrophobicContact CD2-CG2 4.42Å; Y45-V50 HydrophobicContact CE2-CB 4.27Å; Y45-V50 HydrophobicContact CE2-CG2 3.71Å; K47-V50 WeakPolarHBondContact O-CG2 3.39Å; K47-V50 PolarHBondContact O-N 2.87Å; V50-R52 VanDerWaalsContact C-N 3.26Å; V50-R52 PolarHBondContact O-N 3.22Å; V50-V53 PolarHBondContact O-N 3.38Å; V50-L54 HydrophobicContact CG1-CD1 3.84Å; V50-L54 HydrophobicContact CG1-CG 4.4Å; V50-L54 WeakPolarHBondContact O-CG 3.49Å; V50-L54 PolarHBondContact O-N 2.96Å |
| 51 | K | 88.6 | Confident | 85.3 | Confident | 184 Ų | 184 | 135 Ų | 135 | 80% | 0.8 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -61.3 | -31.1 | -179.4 | -66.8 | -171.9 | 177.4 | -174.9 | 0 | 113.2 | N49 R55 | N49-K51 PolarHBondContact O-N 3.13Å; K51-R55 VanDerWaalsContact O-CB 3.29Å; K51-R55 WeakPolarHBondContact O-CB 3.46Å; K51-R55 PolarHBondContact O-N 3.31Å |
| 52 | R | 89.4 | Confident | 83.4 | Confident | 186 Ų | 186 | 135.7 Ų | 135.7 | 70% | 0.702 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -77.1 | -39.5 | 176.8 | -175.8 | 172.4 | 178.7 | 151.2 | 0.1 | 111.7 | N49 V50 R55 L56 | N49-R52 WeakPolarHBondContact O-CA 3.25Å; N49-R52 WeakPolarHBondContact O-CB 3.32Å; N49-R52 PolarHBondContact O-N 3.05Å; V50-R52 VanDerWaalsContact C-N 3.26Å; V50-R52 PolarHBondContact O-N 3.22Å; R52-R55 PolarHBondContact O-N 3.05Å; R52-L56 HydrophobicContact CG-CD1 4.15Å; R52-L56 VanDerWaalsContact O-CG 3.29Å; R52-L56 WeakPolarHBondContact O-CG 3.48Å; R52-L56 PolarHBondContact O-N 3.25Å |
| 53 | V | 90.2 | Very high | 81.2 | Confident | 24 Ų | 24 | 135.6 Ų | 135.6 | 15% | 0.145 | 66% | 0.655 | C | S | . | * | H | α-helix | trans | -65.9 | -47.8 | 176.9 | 176.3 | 0 | 0 | 0 | 0 | 110.5 | Y45 N49 V50 R55 L56 L57 | Y45-V53 HydrophobicContact CD1-CG1 4.25Å; Y45-V53 HydrophobicContact CD1-CG2 3.95Å; Y45-V53 HydrophobicContact CD2-CG2 4.07Å; Y45-V53 HydrophobicContact CE1-CB 4.27Å; Y45-V53 HydrophobicContact CE1-CG1 3.81Å; Y45-V53 HydrophobicContact CE1-CG2 4.2Å; Y45-V53 HydrophobicContact CE2-CB 4.43Å; Y45-V53 HydrophobicContact CE2-CG2 4.3Å; Y45-V53 HydrophobicContact CG-CG2 3.89Å; N49-V53 HydrophobicContact CB-CG2 4.42Å; N49-V53 PolarHBondContact O-N 3.14Å; V50-V53 PolarHBondContact O-N 3.38Å; V53-R55 VanDerWaalsContact C-N 3.32Å; V53-R55 PolarHBondContact O-N 3.43Å; V53-L56 PolarHBondContact O-N 3.02Å; V53-L56 VanDerWaalsContact O-N 3.11Å; V53-L57 HydrophobicContact CG1-CD1 3.88Å; V53-L57 HydrophobicContact CG1-CG 4.37Å; V53-L57 WeakPolarHBondContact O-CG 3.44Å; V53-L57 PolarHBondContact O-N 3.31Å |
| 54 | L | 87.8 | Confident | 79.5 | Confident | 101 Ų | 101 | 137.7 Ų | 137.7 | 53% | 0.529 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -58.2 | -42.9 | 174.8 | -68.7 | 173.4 | 0 | 0 | 0 | 112 | V50 L56 L57 A58 | V50-L54 HydrophobicContact CG1-CD1 3.84Å; V50-L54 HydrophobicContact CG1-CG 4.4Å; V50-L54 WeakPolarHBondContact O-CG 3.49Å; V50-L54 PolarHBondContact O-N 2.96Å; L54-L56 VanDerWaalsContact C-N 3.31Å; L54-L56 PolarHBondContact O-N 2.94Å; L54-L57 PolarHBondContact O-N 2.92Å; L54-A58 WeakPolarHBondContact O-CB 3.13Å; L54-A58 PolarHBondContact O-N 3.41Å |
| 55 | R | 89.1 | Confident | 77 | Confident | 201 Ų | 201 | 137.4 Ų | 137.4 | 76% | 0.758 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -66.4 | -29.6 | 177 | -165.8 | 174.7 | -169.3 | 173.4 | 4.9 | 113.3 | K51 R52 V53 L59 | K51-R55 VanDerWaalsContact O-CB 3.29Å; K51-R55 WeakPolarHBondContact O-CB 3.46Å; K51-R55 PolarHBondContact O-N 3.31Å; R52-R55 PolarHBondContact O-N 3.05Å; V53-R55 VanDerWaalsContact C-N 3.32Å; V53-R55 PolarHBondContact O-N 3.43Å; R55-L59 WeakPolarHBondContact O-CG 3.29Å |
| 56 | L | 88.4 | Confident | 74.4 | Confident | 103 Ų | 103 | 137.1 Ų | 137.1 | 54% | 0.539 | 68% | 0.684 | S | S | . | * | H | α-helix | trans | -76.3 | -37.4 | 174.1 | -73.6 | 167.6 | 0 | 0 | 0 | 112.2 | R52 V53 L54 A58 L59 | R52-L56 HydrophobicContact CG-CD1 4.15Å; R52-L56 VanDerWaalsContact O-CG 3.29Å; R52-L56 WeakPolarHBondContact O-CG 3.48Å; R52-L56 PolarHBondContact O-N 3.25Å; V53-L56 PolarHBondContact O-N 3.02Å; V53-L56 VanDerWaalsContact O-N 3.11Å; L54-L56 VanDerWaalsContact C-N 3.31Å; L54-L56 PolarHBondContact O-N 2.94Å; L56-A58 VanDerWaalsContact C-N 3.34Å; L56-L59 HydrophobicContact CD2-CD1 4.3Å; L56-L59 PolarHBondContact O-N 3.11Å |
| 57 | L | 86.8 | Confident | 71.7 | Confident | 137 Ų | 137 | 134.8 Ų | 134.8 | 72% | 0.717 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -71.3 | -28.8 | 175.9 | -68.1 | 170.6 | 0 | 0 | 0 | 112.7 | V53 L54 L59 | V53-L57 HydrophobicContact CG1-CD1 3.88Å; V53-L57 HydrophobicContact CG1-CG 4.37Å; V53-L57 WeakPolarHBondContact O-CG 3.44Å; V53-L57 PolarHBondContact O-N 3.31Å; L54-L57 PolarHBondContact O-N 2.92Å; L57-L59 VanDerWaalsContact C-N 3.31Å |
| 58 | A | 86.5 | Confident | 69.5 | Low | 81 Ų | 81 | 132.5 Ų | 132.5 | 67% | 0.669 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.7 | -5.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | L54 L56 Q60 | L54-A58 WeakPolarHBondContact O-CB 3.13Å; L54-A58 PolarHBondContact O-N 3.41Å; L56-A58 VanDerWaalsContact C-N 3.34Å; A58-Q60 PolarHBondContact O-N 2.99Å |
| 59 | L | 76.7 | Confident | 67 | Low | 116 Ų | 116 | 131.3 Ų | 131.3 | 61% | 0.607 | 68% | 0.679 | S | S | * | * | S | Bend | trans | -76.4 | 106.2 | 169.2 | -71.5 | 169.9 | 0 | 0 | 0 | 108.6 | R55 L56 L57 Q61 | R55-L59 WeakPolarHBondContact O-CG 3.29Å; L56-L59 HydrophobicContact CD2-CD1 4.3Å; L56-L59 PolarHBondContact O-N 3.11Å; L57-L59 VanDerWaalsContact C-N 3.31Å; L59-Q61 PolarHBondContact O-N 3.38Å |
| 60 | Q | 54.9 | Low | 64.5 | Low | 185 Ų | 185 | 136.8 Ų | 136.8 | 86% | 0.864 | 70% | 0.702 | S | S | * | * | trans | -52.7 | 134 | 166 | -72.7 | -178.4 | -26.3 | 0 | 0 | 109.4 | A58 T62 | A58-Q60 PolarHBondContact O-N 2.99Å; Q60-T62 PolarHBondContact O-N 3.43Å | ||
| 61 | Q | 54.9 | Low | 62.4 | Low | 189 Ų | 189 | 141 Ų | 141 | 88% | 0.883 | 73% | 0.728 | S | S | * | * | trans | -71.9 | 99.3 | 178.4 | -66.6 | -178.6 | -6.4 | 0 | 0 | 109.2 | L59 P63 | L59-Q61 PolarHBondContact O-N 3.38Å; Q61-P63 WeakPolarHBondContact O-CD 3.38Å | ||
| 62 | T | 43.9 | Very low | 60.2 | Low | 126 Ų | 126 | 140.7 Ų | 140.7 | 77% | 0.773 | 73% | 0.73 | S | S | * | * | trans | -60.7 | 118.7 | 173.6 | -33.8 | 0 | 0 | 0 | 0 | 108.9 | Q60 L64 | Q60-T62 PolarHBondContact O-N 3.43Å; T62-L64 PolarHBondContact O-N 3.17Å; T62-L64 VanDerWaalsContact O-N 3.13Å | ||
| 63 | P | 43 | Very low | 57.9 | Low | 118 Ų | 118 | 143.3 Ų | 143.3 | 77% | 0.766 | 74% | 0.74 | S | S | * | * | trans | -69 | 114.3 | -175.5 | 26.2 | -33.3 | 0 | 0 | 0 | 110.3 | Q61 | Q61-P63 WeakPolarHBondContact O-CD 3.38Š| ||
| 64 | L | 47.7 | Very low | 55.6 | Low | 167 Ų | 167 | 147 Ų | 147 | 87% | 0.874 | 77% | 0.766 | S | S | * | * | trans | -76.7 | 125.8 | 172.2 | -76 | 166.8 | 0 | 0 | 0 | 109.7 | T62 | T62-L64 PolarHBondContact O-N 3.17Å; T62-L64 VanDerWaalsContact O-N 3.13Å | ||
| 65 | K | 39.3 | Very low | 53.5 | Low | 193 Ų | 193 | 148.6 Ų | 148.6 | 84% | 0.839 | 78% | 0.78 | S | S | * | * | trans | 79.9 | 107.6 | -179.7 | -52.5 | 177.8 | 179.1 | -177.7 | 0 | 115.9 | ||||
| 66 | A | 36.1 | Very low | 51.3 | Low | 99 Ų | 99 | 144 Ų | 144 | 82% | 0.818 | 78% | 0.779 | S | S | * | * | trans | -120.2 | 120.8 | 144.8 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 67 | P | 36.9 | Very low | 49.2 | Very low | 117 Ų | 117 | 145.9 Ų | 145.9 | 76% | 0.76 | 79% | 0.789 | S | S | * | * | trans | -113.8 | 108.7 | 176.6 | 34.6 | -22.6 | 0 | 0 | 0 | 111.5 | ||||
| 68 | L | 44.7 | Very low | 47 | Very low | 147 Ų | 147 | 146.4 Ų | 146.4 | 77% | 0.77 | 79% | 0.788 | S | S | * | * | trans | -138.1 | 116.2 | 173.7 | -76 | 174 | 0 | 0 | 0 | 111.8 | ||||
| 69 | Q | 39.8 | Very low | 44.9 | Very low | 161 Ų | 161 | 148.7 Ų | 148.7 | 75% | 0.752 | 79% | 0.788 | S | S | * | * | trans | 42.7 | 112.2 | 136.7 | -65 | 165 | -2.3 | 0 | 0 | 118 | ||||
| 70 | Q | 38.9 | Very low | 43.4 | Very low | 183 Ų | 183 | 149.5 Ų | 149.5 | 86% | 0.855 | 80% | 0.799 | S | S | * | * | 57.5 | 110.1 | 89.4 | -87.5 | -173.6 | -46.7 | 0 | 0 | 115.1 | |||||
| 71 | T | 46.1 | Very low | 42.8 | Very low | 142 Ų | 142 | 146.1 Ų | 146.1 | 87% | 0.871 | 79% | 0.793 | S | S | * | * | -172 | 144 | 128.8 | -74 | 0 | 0 | 0 | 0 | 108.6 | |||||
| 72 | E | 42.2 | Very low | 41.8 | Very low | 178 Ų | 178 | 142.6 Ų | 142.6 | 83% | 0.832 | 79% | 0.789 | S | S | * | * | trans | -101 | 142 | -177.4 | -58.8 | 170.1 | 125.5 | 0 | 0 | 112.3 | ||||
| 73 | R | 41.9 | Very low | 42 | Very low | 241 Ų | 241 | 141.9 Ų | 141.9 | 91% | 0.909 | 79% | 0.786 | S | S | * | * | trans | 174.4 | 144.8 | 150.7 | -99.6 | 156.9 | -178.6 | 159.5 | 1.9 | 108.5 | ||||
| 74 | S | 42.4 | Very low | 41.9 | Very low | 101 Ų | 101 | 140.4 Ų | 140.4 | 71% | 0.706 | 78% | 0.784 | S | S | * | * | cis | 156.3 | 124.6 | -24.6 | -92.7 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 75 | V | 44.2 | Very low | 41.8 | Very low | 136 Ų | 136 | 141 Ų | 141 | 82% | 0.824 | 78% | 0.783 | S | S | * | * | trans | 59.9 | 112.7 | 148.8 | -176.5 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 76 | S | 42.4 | Very low | 42 | Very low | 103 Ų | 103 | 139.5 Ų | 139.5 | 72% | 0.72 | 78% | 0.782 | S | S | * | * | 174.9 | 175.8 | 94.2 | -143.6 | 0 | 0 | 0 | 0 | 115 | |||||
| 77 | L | 43.3 | Very low | 42 | Very low | 144 Ų | 144 | 141.1 Ų | 141.1 | 75% | 0.754 | 78% | 0.782 | S | S | * | * | trans | -50.6 | 176.3 | 176 | -79.3 | 73 | 0 | 0 | 0 | 116.7 | ||||
| 78 | E | 41.9 | Very low | 42.8 | Very low | 148 Ų | 148 | 145.2 Ų | 145.2 | 69% | 0.692 | 79% | 0.787 | S | S | * | * | cis | 175.2 | 158.1 | -29.6 | -167.8 | 178.6 | 116.9 | 0 | 0 | 108.6 | ||||
| 79 | N | 42.1 | Very low | 42.6 | Very low | 128 Ų | 128 | 147.4 Ų | 147.4 | 68% | 0.684 | 79% | 0.791 | S | S | * | * | trans | 76 | 140.9 | 159.3 | -76.2 | -39.3 | 0 | 0 | 0 | 123.9 | ||||
| 80 | T | 44 | Very low | 42.6 | Very low | 134 Ų | 134 | 150.8 Ų | 150.8 | 82% | 0.822 | 80% | 0.797 | S | S | * | * | trans | 86.7 | 133 | 157.6 | -36.3 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 81 | P | 42 | Very low | 42.9 | Very low | 114 Ų | 114 | 148 Ų | 148 | 74% | 0.74 | 79% | 0.794 | S | S | * | * | trans | -119.8 | 162.8 | -172.4 | 42.5 | -33.3 | 0 | 0 | 0 | 118.1 | ||||
| 82 | S | 34 | Very low | 42.8 | Very low | 114 Ų | 114 | 144.8 Ų | 144.8 | 80% | 0.797 | 78% | 0.782 | S | S | * | * | trans | 70.9 | 165.7 | 162.3 | -122.8 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 83 | P | 48.4 | Very low | 43.5 | Very low | 111 Ų | 111 | 141.9 Ų | 141.9 | 72% | 0.721 | 78% | 0.779 | S | S | * | * | cis | -135.7 | 159.2 | -3.9 | 41.1 | -24.4 | 0 | 0 | 0 | 117.7 | ||||
| 84 | A | 41.6 | Very low | 43.7 | Very low | 87 Ų | 87 | 135.3 Ų | 135.3 | 72% | 0.719 | 77% | 0.77 | S | S | * | * | trans | 56.2 | 150.5 | 138.2 | 0 | 0 | 0 | 0 | 0 | 125.8 | ||||
| 85 | Q | 44.6 | Very low | 43.8 | Very low | 181 Ų | 181 | 137.1 Ų | 137.1 | 85% | 0.846 | 77% | 0.772 | S | S | * | * | trans | 77.3 | 123.6 | 157.9 | -44.5 | -164.7 | 22.5 | 0 | 0 | 121.5 | ||||
| 86 | I | 44.9 | Very low | 43.8 | Very low | 160 Ų | 160 | 137.3 Ų | 137.3 | 82% | 0.821 | 77% | 0.768 | S | S | * | * | 169.9 | 146.5 | 112.4 | -87 | 163.4 | 0 | 0 | 0 | 110.7 | |||||
| 87 | T | 36.4 | Very low | 43.7 | Very low | 134 Ų | 134 | 137 Ų | 137 | 82% | 0.822 | 77% | 0.766 | S | S | * | * | trans | -123.3 | 138.3 | -178.4 | 41.8 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 88 | K | 52.2 | Low | 43.7 | Very low | 202 Ų | 202 | 135.3 Ų | 135.3 | 88% | 0.878 | 76% | 0.762 | S | S | * | * | trans | -177 | 164.1 | 166.9 | -104.2 | 159 | -178.2 | 178.3 | 0 | 110.5 | ||||
| 89 | K | 42 | Very low | 43.8 | Very low | 194 Ų | 194 | 135.2 Ų | 135.2 | 84% | 0.843 | 77% | 0.766 | S | S | * | * | -171.8 | 119.1 | -58 | -130.8 | -172 | -179.9 | -177 | 0 | 109.9 | |||||
| 90 | R | 39.3 | Very low | 44.6 | Very low | 231 Ų | 231 | 137.5 Ų | 137.5 | 87% | 0.872 | 77% | 0.773 | S | S | * | * | trans | 60.5 | -176.8 | 160.2 | -118 | -171.9 | 177.2 | 179.6 | -1.9 | 116.1 | ||||
| 91 | P | 46 | Very low | 44.8 | Very low | 124 Ų | 124 | 135.2 Ų | 135.2 | 81% | 0.805 | 76% | 0.76 | S | S | * | * | cis | -123.1 | -173.6 | 25.1 | 42.3 | -26.3 | 0 | 0 | 0 | 116.9 | ||||
| 92 | A | 42.4 | Very low | 45.4 | Very low | 75 Ų | 75 | 137.4 Ų | 137.4 | 62% | 0.62 | 77% | 0.765 | S | S | * | * | trans | -161.5 | 155.8 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 93 | P | 56.6 | Low | 46.4 | Very low | 118 Ų | 118 | 137.1 Ų | 137.1 | 77% | 0.766 | 76% | 0.76 | S | S | * | * | trans | -103.1 | 149.6 | 162.2 | 13.4 | 7.9 | 0 | 0 | 0 | 111.7 | ||||
| 94 | S | 47.6 | Very low | 46.5 | Very low | 103 Ų | 103 | 137 Ų | 137 | 72% | 0.72 | 76% | 0.76 | S | S | * | * | 78.7 | 136.6 | 56.6 | -68.3 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 95 | D | 44.2 | Very low | 46.9 | Very low | 139 Ų | 139 | 140.7 Ų | 140.7 | 74% | 0.743 | 77% | 0.766 | S | S | * | * | cis | -165.7 | 171.6 | -11.4 | -112.9 | -51.4 | 0 | 0 | 0 | 113.3 | ||||
| 96 | N | 42.9 | Very low | 46.9 | Very low | 139 Ų | 139 | 137.7 Ų | 137.7 | 74% | 0.743 | 77% | 0.765 | S | S | * | * | trans | 66.5 | 127.4 | 157.1 | -97 | 3.9 | 0 | 0 | 0 | 124.7 | ||||
| 97 | S | 41.1 | Very low | 46.6 | Very low | 97 Ų | 97 | 134.9 Ų | 134.9 | 68% | 0.678 | 77% | 0.766 | S | S | * | * | 55.4 | 154.3 | 128 | -65.9 | 0 | 0 | 0 | 0 | 124.1 | |||||
| 98 | T | 43.1 | Very low | 46.8 | Very low | 108 Ų | 108 | 135.1 Ų | 135.1 | 66% | 0.663 | 77% | 0.767 | S | S | * | * | cis | -171.7 | 155.3 | -17.4 | -88.2 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 99 | N | 44.1 | Very low | 46.4 | Very low | 147 Ų | 147 | 131.6 Ų | 131.6 | 79% | 0.786 | 77% | 0.768 | S | S | * | * | trans | 81.7 | 111.3 | 171.5 | -65.8 | -15.1 | 0 | 0 | 0 | 121.2 | ||||
| 100 | E | 58.3 | Low | 46.4 | Very low | 175 Ų | 175 | 127.5 Ų | 127.5 | 82% | 0.818 | 76% | 0.764 | S | S | * | * | 23.9 | 155.1 | 120.4 | -76.4 | -117.3 | 115.2 | 0 | 0 | 123.5 | |||||
| 101 | P | 48.6 | Very low | 46.7 | Very low | 86 Ų | 86 | 122.1 Ų | 122.1 | 56% | 0.558 | 76% | 0.762 | S | S | * | * | cis | -151.7 | -173.5 | -32.6 | 44 | -25.3 | 0 | 0 | 0 | 117.7 | ||||
| 102 | L | 54.4 | Low | 46.6 | Very low | 161 Ų | 161 | 125.8 Ų | 125.8 | 84% | 0.843 | 77% | 0.765 | S | S | * | * | trans | 77.3 | 150.2 | 157.2 | -67.7 | 174.2 | 0 | 0 | 0 | 120.4 | ||||
| 103 | P | 54.9 | Low | 47.2 | Very low | 107 Ų | 107 | 131.9 Ų | 131.9 | 70% | 0.695 | 78% | 0.778 | S | S | * | * | trans | -144.8 | -140.9 | -142.5 | 41.1 | -15.8 | 0 | 0 | 0 | 113 | ||||
| 104 | P | 52.3 | Low | 46.6 | Very low | 110 Ų | 110 | 135.3 Ų | 135.3 | 71% | 0.714 | 78% | 0.783 | S | S | * | * | -119.2 | -179.1 | -59.5 | 27.3 | -9 | 0 | 0 | 0 | 112.2 | |||||
| 105 | L | 48.7 | Very low | 46.9 | Very low | 164 Ų | 164 | 136.4 Ų | 136.4 | 86% | 0.859 | 79% | 0.788 | S | S | * | * | trans | -164.8 | 161.2 | 134.5 | -111.9 | 172.2 | 0 | 0 | 0 | 113.1 | ||||
| 106 | S | 46.2 | Very low | 46.7 | Very low | 117 Ų | 117 | 138.9 Ų | 138.9 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | trans | 67.1 | 109.5 | 168.3 | -58.4 | 0 | 0 | 0 | 0 | 118 | ||||
| 107 | A | 38.4 | Very low | 46.5 | Very low | 101 Ų | 101 | 138.3 Ų | 138.3 | 84% | 0.835 | 79% | 0.794 | S | S | * | * | trans | -124.5 | 150.2 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 108 | T | 39.2 | Very low | 46.8 | Very low | 140 Ų | 140 | 141 Ų | 141 | 86% | 0.859 | 81% | 0.806 | S | S | * | * | trans | -142 | 110.2 | 169.9 | 56.4 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 109 | S | 45.3 | Very low | 46.7 | Very low | 127 Ų | 127 | 139.9 Ų | 139.9 | 89% | 0.888 | 81% | 0.807 | S | S | * | * | trans | -175 | 136.8 | 138.3 | -166.1 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 110 | S | 41.4 | Very low | 46.6 | Very low | 108 Ų | 108 | 141.6 Ų | 141.6 | 76% | 0.755 | 81% | 0.811 | S | S | * | * | trans | -98.6 | 132.9 | 178.8 | 57.3 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 111 | S | 44.9 | Very low | 46 | Very low | 119 Ų | 119 | 142.8 Ų | 142.8 | 83% | 0.832 | 81% | 0.813 | S | S | * | * | trans | -134.4 | 143.9 | 166.3 | -167.5 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 112 | F | 44.9 | Very low | 45.5 | Very low | 200 Ų | 200 | 143.3 Ų | 143.3 | 88% | 0.877 | 82% | 0.819 | S | S | * | * | trans | -79.8 | 135.2 | -166.5 | -75 | -103.3 | 0 | 0 | 0 | 113 | ||||
| 113 | K | 53.5 | Low | 45 | Very low | 203 Ų | 203 | 142 Ų | 142 | 88% | 0.883 | 82% | 0.817 | S | S | * | * | trans | -139.4 | 146.6 | 158.8 | -72.5 | -169.4 | 176.6 | -178.9 | 0 | 110.3 | ||||
| 114 | H | 45.1 | Very low | 44.5 | Very low | 190 Ų | 190 | 143 Ų | 143 | 88% | 0.88 | 83% | 0.827 | S | S | * | * | trans | -71.7 | 142.1 | 175.3 | -75.3 | -101.5 | 0 | 0 | 0 | 111.7 | ||||
| 115 | P | 53.1 | Low | 44 | Very low | 126 Ų | 126 | 142.6 Ų | 142.6 | 82% | 0.818 | 83% | 0.833 | S | S | * | * | trans | -87.1 | 149.3 | 155.7 | 34.7 | -30.8 | 0 | 0 | 0 | 111.1 | ||||
| 116 | K | 41 | Very low | 44 | Very low | 192 Ų | 192 | 139.7 Ų | 139.7 | 84% | 0.835 | 83% | 0.826 | S | S | * | * | trans | -142.5 | 148.6 | 165.6 | -151.1 | -176.9 | -176.9 | -176.7 | 0 | 107.4 | ||||
| 117 | T | 37.7 | Very low | 44.2 | Very low | 127 Ų | 127 | 145.4 Ų | 145.4 | 78% | 0.779 | 83% | 0.83 | S | S | * | * | trans | 52.9 | 108 | 171.3 | 56.1 | 0 | 0 | 0 | 0 | 119 | ||||
| 118 | V | 47.5 | Very low | 44.6 | Very low | 152 Ų | 152 | 147 Ų | 147 | 92% | 0.921 | 83% | 0.83 | S | S | * | * | trans | -139.7 | 157.3 | 130.1 | -175.7 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 119 | A | 40.6 | Very low | 45 | Very low | 85 Ų | 85 | 145.7 Ų | 145.7 | 70% | 0.702 | 82% | 0.823 | S | S | * | * | trans | -135.2 | 177.8 | -174.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 120 | E | 43.4 | Very low | 45.1 | Very low | 184 Ų | 184 | 146.5 Ų | 146.5 | 86% | 0.86 | 82% | 0.823 | S | S | * | * | trans | 84.4 | 155.6 | 164 | -54.5 | -167.2 | 176.6 | 0 | 0 | 120.6 | ||||
| 121 | K | 44.2 | Very low | 45.4 | Very low | 200 Ų | 200 | 144.4 Ų | 144.4 | 87% | 0.87 | 82% | 0.818 | S | S | * | * | trans | 67.4 | 134.8 | -178 | -69.4 | -172.7 | 175.5 | 177.6 | 0 | 116.7 | ||||
| 122 | S | 40.1 | Very low | 45.5 | Very low | 97 Ų | 97 | 144.9 Ų | 144.9 | 68% | 0.678 | 82% | 0.818 | S | S | * | * | cis | -157.4 | 142 | -2.8 | -91.5 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 123 | V | 42.5 | Very low | 45.6 | Very low | 132 Ų | 132 | 139.6 Ų | 139.6 | 80% | 0.8 | 81% | 0.811 | S | S | * | * | trans | 46.2 | 115.8 | 139.2 | -174.6 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 124 | S | 45.1 | Very low | 45.5 | Very low | 128 Ų | 128 | 136.5 Ų | 136.5 | 90% | 0.895 | 81% | 0.81 | S | S | * | * | -161.1 | 156 | 123.5 | -83.5 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 125 | A | 42.4 | Very low | 45.4 | Very low | 103 Ų | 103 | 132.8 Ų | 132.8 | 85% | 0.851 | 80% | 0.803 | S | S | * | * | trans | -104.3 | 156.6 | -158.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 126 | S | 47.1 | Very low | 45.2 | Very low | 102 Ų | 102 | 133.5 Ų | 133.5 | 71% | 0.713 | 80% | 0.804 | S | S | * | * | -176.6 | 127.3 | 120.1 | -164.4 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 127 | R | 51.3 | Low | 45.3 | Very low | 237 Ų | 237 | 133.5 Ų | 133.5 | 89% | 0.894 | 80% | 0.804 | S | S | * | * | trans | 65.3 | 145.2 | 153.9 | -69.9 | 174.9 | 175.9 | -159 | -4 | 122 | ||||
| 128 | T | 46.4 | Very low | 45.7 | Very low | 136 Ų | 136 | 132.1 Ų | 132.1 | 83% | 0.834 | 80% | 0.8 | S | S | * | * | trans | -165.3 | 177.6 | -167.5 | 41.6 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 129 | P | 48.5 | Very low | 45.7 | Very low | 111 Ų | 111 | 131 Ų | 131 | 72% | 0.721 | 79% | 0.793 | S | S | * | * | cis | -134.5 | -153.2 | -22.9 | 29.7 | -5 | 0 | 0 | 0 | 113.1 | ||||
| 130 | V | 46.8 | Very low | 46.2 | Very low | 145 Ų | 145 | 132.6 Ų | 132.6 | 88% | 0.879 | 80% | 0.797 | S | S | * | * | trans | 83.7 | 134.7 | 166.2 | -166.3 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 131 | G | 46.7 | Very low | 46.4 | Very low | 64 Ų | 64 | 132.6 Ų | 132.6 | 66% | 0.66 | 80% | 0.799 | S | S | * | * | cis | -151.3 | -173.2 | 5.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 132 | P | 47.5 | Very low | 46.8 | Very low | 128 Ų | 128 | 127.4 Ų | 127.4 | 83% | 0.831 | 79% | 0.793 | S | S | * | * | trans | -129.4 | -176.7 | -143.2 | 43.9 | -31.9 | 0 | 0 | 0 | 119.5 | ||||
| 133 | A | 46.4 | Very low | 47.2 | Very low | 89 Ų | 89 | 133.9 Ų | 133.9 | 74% | 0.736 | 80% | 0.803 | S | S | * | * | trans | 83.3 | 147.8 | 158.4 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 134 | T | 51.6 | Low | 47.5 | Very low | 139 Ų | 139 | 134.2 Ų | 134.2 | 85% | 0.853 | 81% | 0.805 | S | S | * | * | cis | -160 | 164.6 | -14.5 | 15.3 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 135 | P | 43.9 | Very low | 47.2 | Very low | 112 Ų | 112 | 134.4 Ų | 134.4 | 73% | 0.727 | 80% | 0.801 | S | S | * | * | trans | -120.9 | 161.5 | -165.8 | 42.1 | -32.2 | 0 | 0 | 0 | 118.5 | ||||
| 136 | V | 48.7 | Very low | 47.4 | Very low | 140 Ų | 140 | 135.4 Ų | 135.4 | 85% | 0.848 | 80% | 0.801 | S | S | * | * | trans | -173.8 | 164.3 | 155.8 | -97 | 0 | 0 | 0 | 0 | 109 | ||||
| 137 | K | 43.3 | Very low | 47.3 | Very low | 193 Ų | 193 | 137.3 Ų | 137.3 | 84% | 0.839 | 80% | 0.804 | S | S | * | * | cis | -154.5 | 169.9 | -1.9 | -134 | 171.9 | 179.1 | 176.8 | 0 | 113 | ||||
| 138 | S | 44.9 | Very low | 46.9 | Very low | 98 Ų | 98 | 131.3 Ų | 131.3 | 69% | 0.685 | 79% | 0.794 | S | S | * | * | trans | -37.4 | 158.3 | 156.9 | -121.2 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 139 | T | 47.8 | Very low | 47 | Very low | 127 Ų | 127 | 129.2 Ų | 129.2 | 78% | 0.779 | 79% | 0.785 | S | S | * | * | cis | 180 | 177.4 | 2.4 | 12.1 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 140 | P | 50.9 | Low | 46.9 | Very low | 119 Ų | 119 | 132.4 Ų | 132.4 | 77% | 0.773 | 79% | 0.79 | S | S | * | * | trans | -114 | -169.7 | -157.5 | 44.6 | -38.9 | 0 | 0 | 0 | 117.6 | ||||
| 141 | M | 47.9 | Very low | 47 | Very low | 184 Ų | 184 | 131 Ų | 131 | 91% | 0.906 | 78% | 0.781 | S | S | * | * | trans | 120.9 | 148.8 | 175.9 | -72.3 | 178 | 67.3 | 0 | 0 | 110.9 | ||||
| 142 | A | 54 | Low | 47.1 | Very low | 91 Ų | 91 | 135 Ų | 135 | 75% | 0.752 | 79% | 0.787 | S | S | * | * | cis | -141.1 | 178.6 | 6.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 143 | R | 48.1 | Very low | 47.2 | Very low | 233 Ų | 233 | 135.9 Ų | 135.9 | 88% | 0.879 | 79% | 0.79 | S | S | * | * | trans | -74.3 | 143.1 | 169.3 | -70.8 | 174.6 | 169 | 137.4 | -9.3 | 111.7 | ||||
| 144 | V | 47.3 | Very low | 46.7 | Very low | 140 Ų | 140 | 137.5 Ų | 137.5 | 85% | 0.848 | 79% | 0.793 | S | S | * | * | trans | -139.4 | 142.2 | 139.1 | 179.8 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 145 | T | 40.1 | Very low | 46.2 | Very low | 132 Ų | 132 | 134.8 Ų | 134.8 | 81% | 0.81 | 79% | 0.793 | S | S | * | * | trans | -117.6 | 131.4 | 172 | 47.7 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 146 | S | 47.4 | Very low | 46.2 | Very low | 123 Ų | 123 | 137 Ų | 137 | 86% | 0.86 | 80% | 0.798 | S | S | * | * | trans | -145.4 | 147.2 | 161.8 | 44.6 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 147 | N | 43.9 | Very low | 45.9 | Very low | 143 Ų | 143 | 135.3 Ų | 135.3 | 77% | 0.765 | 79% | 0.793 | S | S | * | * | trans | -132.7 | 148 | -165.3 | 174.3 | 51.1 | 0 | 0 | 0 | 109.3 | ||||
| 148 | T | 43.1 | Very low | 45.9 | Very low | 111 Ų | 111 | 131.7 Ų | 131.7 | 68% | 0.681 | 79% | 0.792 | S | S | * | * | trans | 65.4 | 125.9 | 164.1 | -71.5 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 149 | S | 47.5 | Very low | 45.8 | Very low | 92 Ų | 92 | 137.4 Ų | 137.4 | 64% | 0.643 | 80% | 0.8 | S | S | * | * | -168.2 | 163.1 | 59.4 | -41.9 | 0 | 0 | 0 | 0 | 114.8 | |||||
| 150 | Q | 48.1 | Very low | 45.7 | Very low | 177 Ų | 177 | 137 Ų | 137 | 83% | 0.827 | 80% | 0.797 | S | S | * | * | trans | 78.9 | 125.3 | 138.1 | -80.5 | 175.1 | 19.7 | 0 | 0 | 123.7 | ||||
| 151 | V | 47.2 | Very low | 45.2 | Very low | 115 Ų | 115 | 137.9 Ų | 137.9 | 70% | 0.697 | 80% | 0.803 | S | S | * | * | trans | 84.3 | 95.1 | 131.4 | 178.1 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 152 | L | 49.2 | Very low | 44.9 | Very low | 149 Ų | 149 | 139.8 Ų | 139.8 | 78% | 0.78 | 80% | 0.8 | S | S | * | * | 37 | 119.2 | 122.5 | -61.5 | 157.5 | 0 | 0 | 0 | 120.7 | |||||
| 153 | T | 50.6 | Low | 44.3 | Very low | 146 Ų | 146 | 141.7 Ų | 141.7 | 90% | 0.896 | 81% | 0.808 | S | S | * | * | -167.1 | 151.7 | 109.6 | 15.4 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 154 | P | 36.2 | Very low | 44.1 | Very low | 123 Ų | 123 | 136 Ų | 136 | 80% | 0.799 | 80% | 0.804 | S | S | * | * | trans | -110.7 | 151.6 | -176.5 | 39.2 | -31.7 | 0 | 0 | 0 | 115.4 | ||||
| 155 | G | 40.9 | Very low | 43.5 | Very low | 83 Ų | 83 | 138.2 Ų | 138.2 | 86% | 0.856 | 81% | 0.805 | S | S | * | * | trans | 92.5 | 127.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 156 | D | 43.6 | Very low | 43.6 | Very low | 157 Ų | 157 | 142.2 Ų | 142.2 | 84% | 0.84 | 81% | 0.805 | S | S | * | * | -152.9 | -173.1 | 55.3 | -152.4 | -17.5 | 0 | 0 | 0 | 113.8 | |||||
| 157 | S | 41.9 | Very low | 43.5 | Very low | 105 Ų | 105 | 140.7 Ų | 140.7 | 73% | 0.734 | 79% | 0.793 | S | S | * | * | trans | -84.3 | 121.2 | -161.6 | -46.5 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 158 | S | 43.6 | Very low | 43.5 | Very low | 117 Ų | 117 | 139.3 Ų | 139.3 | 82% | 0.818 | 79% | 0.791 | S | S | * | * | trans | -162 | 163.6 | 147.6 | -147.6 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 159 | Y | 43.5 | Very low | 43.4 | Very low | 219 Ų | 219 | 139.6 Ų | 139.6 | 86% | 0.859 | 79% | 0.793 | S | S | * | * | trans | -91.9 | 118.9 | -169.6 | -66.9 | -103.6 | 0 | 0 | 0 | 112.8 | ||||
| 160 | T | 44.7 | Very low | 43 | Very low | 118 Ų | 118 | 139 Ų | 139 | 72% | 0.724 | 79% | 0.789 | S | S | * | * | trans | -172.9 | 120 | 140.1 | 11.7 | 0 | 0 | 0 | 0 | 111.3 | R162 | T160-R162 VanDerWaalsContact C-N 3.29Å; T160-R162 PolarHBondContact O-N 2.95Å | ||
| 161 | P | 40 | Very low | 42.3 | Very low | 138 Ų | 138 | 139.4 Ų | 139.4 | 90% | 0.896 | 79% | 0.791 | S | S | * | * | trans | -75.9 | 80.3 | 171.9 | 31.6 | -33.7 | 0 | 0 | 0 | 110.3 | S163 | P161-S163 PolarHBondContact O-N 3.25Š| ||
| 162 | R | 41.4 | Very low | 41.7 | Very low | 223 Ų | 223 | 137.9 Ų | 137.9 | 84% | 0.842 | 79% | 0.786 | S | S | * | * | trans | -66.8 | 128.6 | 172.9 | -95 | -176.7 | 164.1 | 179.9 | -3.9 | 110.1 | T160 S164 | T160-R162 VanDerWaalsContact C-N 3.29Å; T160-R162 PolarHBondContact O-N 2.95Å; R162-S164 VanDerWaalsContact C-N 3.32Å; R162-S164 PolarHBondContact O-N 3.19Å | ||
| 163 | S | 41.3 | Very low | 41 | Very low | 132 Ų | 132 | 136.8 Ų | 136.8 | 92% | 0.923 | 78% | 0.781 | S | S | * | * | S | Bend | trans | -69.7 | 77.4 | -178.7 | 173.3 | 0 | 0 | 0 | 0 | 112.7 | P161 | P161-S163 PolarHBondContact O-N 3.25Š|
| 164 | S | 44.1 | Very low | 40.4 | Very low | 112 Ų | 112 | 138.8 Ų | 138.8 | 78% | 0.783 | 78% | 0.779 | S | S | * | * | trans | -151.3 | 21.6 | 174.5 | -165.8 | 0 | 0 | 0 | 0 | 115.2 | R162 | R162-S164 VanDerWaalsContact C-N 3.32Å; R162-S164 PolarHBondContact O-N 3.19Å | ||
| 165 | E | 36.4 | Very low | 40.9 | Very low | 188 Ų | 188 | 138.1 Ų | 138.1 | 88% | 0.879 | 77% | 0.773 | S | S | * | * | trans | -134.7 | 65.5 | -177.1 | -143.4 | 157.9 | -128.9 | 0 | 0 | 112.4 | P167 | E165-P167 WeakPolarHBondContact O-CD 3.37Š| ||
| 166 | R | 41.1 | Very low | 41.6 | Very low | 215 Ų | 215 | 137.5 Ų | 137.5 | 81% | 0.811 | 76% | 0.756 | S | S | * | * | trans | -70.7 | 114.8 | 160.6 | -178.9 | 177.4 | -174.8 | 154.8 | 4.4 | 106.7 | ||||
| 167 | P | 44.3 | Very low | 42.9 | Very low | 92 Ų | 92 | 138 Ų | 138 | 60% | 0.597 | 76% | 0.759 | S | S | * | * | trans | -58.9 | 143.5 | 176.4 | 26.1 | -34.3 | 0 | 0 | 0 | 108.7 | E165 T169 | E165-P167 WeakPolarHBondContact O-CD 3.37Å; P167-T169 PolarHBondContact O-N 2.95Å | ||
| 168 | P | 45.4 | Very low | 45 | Very low | 113 Ų | 113 | 134.9 Ų | 134.9 | 73% | 0.734 | 73% | 0.733 | S | S | * | * | trans | -63.9 | 103.7 | 178 | 26.9 | -33.4 | 0 | 0 | 0 | 108.3 | S170 | P168-S170 PolarHBondContact O-N 3.03Š| ||
| 169 | T | 41 | Very low | 47.4 | Very low | 118 Ų | 118 | 132.3 Ų | 132.3 | 72% | 0.724 | 71% | 0.713 | S | S | * | * | trans | -73.1 | 55.4 | 168.2 | 44.7 | 0 | 0 | 0 | 0 | 109.8 | P167 | P167-T169 PolarHBondContact O-N 2.95Š| ||
| 170 | S | 38.6 | Very low | 49.9 | Very low | 80 Ų | 80 | 123.8 Ų | 123.8 | 56% | 0.559 | 68% | 0.684 | S | S | * | * | trans | -117.8 | 58.8 | 168.2 | 63.8 | 0 | 0 | 0 | 0 | 107.9 | P168 S172 | P168-S170 PolarHBondContact O-N 3.03Å; S170-S172 PolarHBondContact O-N 3.21Å | ||
| 171 | Q | 34.2 | Very low | 52.3 | Low | 184 Ų | 184 | 122 Ų | 122 | 86% | 0.86 | 68% | 0.675 | S | S | * | * | trans | -62.3 | 81.9 | 134.4 | -78.8 | -175.1 | -30 | 0 | 0 | 105.9 | D173 | Q171-D173 PolarHBondContact O-N 2.89Š| ||
| 172 | S | 33.3 | Very low | 55 | Low | 84 Ų | 84 | 118.1 Ų | 118.1 | 59% | 0.587 | 65% | 0.647 | S | S | * | * | trans | -73.6 | 85.7 | 169.6 | 55 | 0 | 0 | 0 | 0 | 106.2 | S170 H174 | S170-S172 PolarHBondContact O-N 3.21Å; S172-H174 PolarHBondContact O-N 3.48Å; S172-H174 VanDerWaalsContact O-N 3.16Å | ||
| 173 | D | 34.2 | Very low | 57.7 | Low | 126 Ų | 126 | 108.9 Ų | 108.9 | 67% | 0.674 | 61% | 0.613 | S | S | * | * | trans | -46 | 126.1 | 170.8 | -75.9 | -44.5 | 0 | 0 | 0 | 108.3 | Q171 T175 | Q171-D173 PolarHBondContact O-N 2.89Å; D173-T175 WeakPolarHBondContact CB-OG1 3.2Å; D173-T175 PolarHBondContact O-N 2.74Å | ||
| 174 | H | 38.1 | Very low | 60.3 | Low | 188 Ų | 188 | 109.4 Ų | 109.4 | 87% | 0.87 | 60% | 0.595 | S | S | * | * | S | Bend | trans | -67.9 | 5.5 | -177.6 | -60.3 | -62.8 | 0 | 0 | 0 | 112.7 | S172 S176 | S172-H174 PolarHBondContact O-N 3.48Å; S172-H174 VanDerWaalsContact O-N 3.16Å; H174-S176 PolarHBondContact O-N 3.38Å |
| 175 | T | 47.9 | Very low | 62.9 | Low | 108 Ų | 108 | 112.7 Ų | 112.7 | 66% | 0.663 | 59% | 0.59 | S | S | * | * | S | Bend | trans | -75.2 | 56.5 | 173.9 | 60.1 | 0 | 0 | 0 | 0 | 113.2 | D173 | D173-T175 WeakPolarHBondContact CB-OG1 3.2Å; D173-T175 PolarHBondContact O-N 2.74Å |
| 176 | S | 56.2 | Low | 65.8 | Low | 71 Ų | 71 | 105.7 Ų | 105.7 | 50% | 0.497 | 56% | 0.555 | S | S | . | * | trans | 61.7 | 138.2 | 142.2 | 62.5 | 0 | 0 | 0 | 0 | 120.6 | H174 L178 | H174-S176 PolarHBondContact O-N 3.38Å; S176-L178 PolarHBondContact O-N 2.71Å; S176-L178 WeakPolarHBondContact OG-CD1 3.49Å; S176-L178 VanDerWaalsContact OG-CG 3.25Å; S176-L178 WeakPolarHBondContact OG-CG 3.29Å | ||
| 177 | N | 70.4 | Confident | 68.5 | Low | 168 Ų | 168 | 98.4 Ų | 98.4 | 90% | 0.898 | 53% | 0.528 | S | S | * | . | trans | -72 | 51.2 | 166.8 | -65.5 | -41.1 | 0 | 0 | 0 | 112.7 | T179 | N177-T179 PolarHBondContact O-N 2.8Š| ||
| 178 | L | 86.1 | Confident | 71.1 | Confident | 39 Ų | 39 | 98.1 Ų | 98.1 | 20% | 0.204 | 52% | 0.521 | C | S | . | . | trans | -67.1 | 119.6 | 178.9 | -77.5 | 167.2 | 0 | 0 | 0 | 110.7 | S176 D182 Y183 L258 | S176-L178 PolarHBondContact O-N 2.71Å; S176-L178 WeakPolarHBondContact OG-CD1 3.49Å; S176-L178 VanDerWaalsContact OG-CG 3.25Å; S176-L178 WeakPolarHBondContact OG-CG 3.29Å; L178-D182 HydrophobicContact CB-CB 4.45Å; L178-D182 HydrophobicContact CD2-CB 3.49Å; L178-D182 VanDerWaalsContact CD2-CB 3.49Å; L178-Y183 HydrophobicContact CB-CD2 4.18Å; L178-Y183 HydrophobicContact CB-CE2 3.52Å; L178-Y183 HydrophobicContact CD1-CE1 4.2Å; L178-Y183 HydrophobicContact CD1-CE2 4.38Å; L178-L258 WeakPolarHBondContact O-CD1 3.42Å | ||
| 179 | T | 93.7 | Very high | 73.6 | Confident | 62 Ų | 62 | 96.3 Ų | 96.3 | 38% | 0.38 | 51% | 0.508 | S | S | . | . | trans | -80.4 | 165.2 | 178 | 68.4 | 0 | 0 | 0 | 0 | 111.5 | N177 S181 D182 Y183 | N177-T179 PolarHBondContact O-N 2.8Å; T179-S181 WeakPolarHBondContact CB-OG 3.11Å; T179-S181 PolarHBondContact O-N 2.71Å; T179-S181 WeakPolarHBondContact OG1-CB 3.46Å; T179-S181 PolarHBondContact OG1-N 2.97Å; T179-S181 PolarHBondContact OG1-OG 3.03Å; T179-D182 WeakPolarHBondContact CB-OD2 3.44Å; T179-D182 PolarHBondContact N-OD2 3.24Å; T179-D182 PolarHBondContact O-N 2.81Å; T179-D182 PolarHBondContact OG1-N 2.91Å; T179-D182 PolarHBondContact OG1-OD2 2.82Å; T179-Y183 WeakPolarHBondContact O-CD2 3.39Å; T179-Y183 PolarHBondContact O-N 3.33Å; T179-Y183 VanDerWaalsContact O-N 3.12Å | ||
| 180 | V | 95.2 | Very high | 76.4 | Confident | 41 Ų | 41 | 91.8 Ų | 91.8 | 25% | 0.248 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -53.2 | -35 | 168.6 | 177.2 | 0 | 0 | 0 | 0 | 111.4 | R184 L258 E259 | V180-R184 WeakPolarHBondContact O-CB 3.24Å; V180-R184 PolarHBondContact O-N 2.94Å; V180-L258 HydrophobicContact CG2-CB 3.73Å; V180-L258 HydrophobicContact CG2-CD1 4.31Å; V180-E259 HydrophobicContact CB-CG 4.44Å; V180-E259 HydrophobicContact CG1-CG 3.7Å; V180-E259 HydrophobicContact CG2-CG 3.83Å |
| 181 | S | 95.8 | Very high | 79.2 | Confident | 79 Ų | 79 | 89.6 Ų | 89.6 | 55% | 0.552 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -63.8 | -40.2 | 174.6 | 8.8 | 0 | 0 | 0 | 0 | 113.1 | T179 R184 R185 | T179-S181 WeakPolarHBondContact CB-OG 3.11Å; T179-S181 PolarHBondContact O-N 2.71Å; T179-S181 WeakPolarHBondContact OG1-CB 3.46Å; T179-S181 PolarHBondContact OG1-N 2.97Å; T179-S181 PolarHBondContact OG1-OG 3.03Å; S181-R184 PolarHBondContact O-N 3.46Å; S181-R185 WeakPolarHBondContact O-CB 3.25Å; S181-R185 PolarHBondContact O-N 3.2Å |
| 182 | D | 96.9 | Very high | 82.3 | Confident | 58 Ų | 58 | 88.8 Ų | 88.8 | 31% | 0.31 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -68.8 | -43.2 | 178 | -60.1 | -63 | 0 | 0 | 0 | 111.3 | L178 T179 R184 R185 R186 | L178-D182 HydrophobicContact CB-CB 4.45Å; L178-D182 HydrophobicContact CD2-CB 3.49Å; L178-D182 VanDerWaalsContact CD2-CB 3.49Å; T179-D182 WeakPolarHBondContact CB-OD2 3.44Å; T179-D182 PolarHBondContact N-OD2 3.24Å; T179-D182 PolarHBondContact O-N 2.81Å; T179-D182 PolarHBondContact OG1-N 2.91Å; T179-D182 PolarHBondContact OG1-OD2 2.82Å; D182-R184 VanDerWaalsContact C-N 3.32Å; D182-R184 PolarHBondContact O-N 3.19Å; D182-R185 PolarHBondContact O-N 3.1Å; D182-R186 VanDerWaalsContact O-CB 3.25Å; D182-R186 WeakPolarHBondContact O-CB 3.28Å; D182-R186 PolarHBondContact O-N 2.85Å |
| 183 | Y | 97.2 | Very high | 85.4 | Confident | 29 Ų | 29 | 86 Ų | 86 | 11% | 0.114 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -62.3 | -37.5 | 173.8 | -77.5 | -64.7 | 0 | 0 | 0 | 112.6 | L178 T179 R186 Y187 Q254 L258 | L178-Y183 HydrophobicContact CB-CD2 4.18Å; L178-Y183 HydrophobicContact CB-CE2 3.52Å; L178-Y183 HydrophobicContact CD1-CE1 4.2Å; L178-Y183 HydrophobicContact CD1-CE2 4.38Å; T179-Y183 WeakPolarHBondContact O-CD2 3.39Å; T179-Y183 PolarHBondContact O-N 3.33Å; T179-Y183 VanDerWaalsContact O-N 3.12Å; Y183-R186 PolarHBondContact O-N 3Å; Y183-Y187 WeakPolarHBondContact O-CB 3.34Å; Y183-Y187 PolarHBondContact O-N 3.26Å; Y183-Q254 HydrophobicContact CD1-CB 3.67Å; Y183-Q254 HydrophobicContact CD2-CB 4.48Å; Y183-Q254 HydrophobicContact CE1-CB 3.5Å; Y183-Q254 VanDerWaalsContact CE1-CD 3.44Å; Y183-Q254 HydrophobicContact CE1-CG 4.1Å; Y183-Q254 VanDerWaalsContact CE1-OE1 3.29Å; Y183-Q254 HydrophobicContact CE2-CB 4.33Å; Y183-Q254 HydrophobicContact CG-CB 4.17Å; Y183-Q254 PolarHBondContact OH-NE2 2.79Å; Y183-L258 HydrophobicContact CD2-CD1 3.77Å; Y183-L258 HydrophobicContact CE2-CD1 3.71Å |
| 184 | R | 97.3 | Very high | 88.4 | Confident | 143 Ų | 143 | 80 Ų | 80 | 54% | 0.54 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -64.8 | -50.3 | 173.3 | -169.8 | 178.5 | -60.4 | 173.8 | 3.3 | 111.6 | V180 S181 D182 R186 Y187 D188 E259 | V180-R184 WeakPolarHBondContact O-CB 3.24Å; V180-R184 PolarHBondContact O-N 2.94Å; S181-R184 PolarHBondContact O-N 3.46Å; D182-R184 VanDerWaalsContact C-N 3.32Å; D182-R184 PolarHBondContact O-N 3.19Å; R184-R186 VanDerWaalsContact C-N 3.27Å; R184-R186 PolarHBondContact O-N 3.24Å; R184-Y187 WeakPolarHBondContact O-CB 3.49Å; R184-Y187 PolarHBondContact O-N 3.02Å; R184-Y187 VanDerWaalsContact O-N 3.16Å; R184-D188 VanDerWaalsContact O-CG 3.3Å; R184-D188 PolarHBondContact O-N 3.34Å; R184-E259 IonicContact NH2-OE1 3.01Å |
| 185 | R | 97.6 | Very high | 91.3 | Very high | 180 Ų | 180 | 73.5 Ų | 73.5 | 68% | 0.679 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -57.9 | -39.2 | 175.7 | -178.5 | -176.2 | 175.2 | -157.8 | -0.6 | 112.1 | S181 D182 T189 | S181-R185 WeakPolarHBondContact O-CB 3.25Å; S181-R185 PolarHBondContact O-N 3.2Å; D182-R185 PolarHBondContact O-N 3.1Å; R185-T189 WeakPolarHBondContact O-CB 3.23Å; R185-T189 PolarHBondContact O-N 3.45Å; R185-T189 PolarHBondContact O-OG1 3.01Å |
| 186 | R | 97.6 | Very high | 93.7 | Very high | 42 Ų | 42 | 72.7 Ų | 72.7 | 16% | 0.158 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -63.8 | -49.7 | 175.8 | -166 | -175.7 | -82.3 | -158 | -4.3 | 110.3 | D182 Y183 R184 T189 Y190 S251 E356 | D182-R186 VanDerWaalsContact O-CB 3.25Å; D182-R186 WeakPolarHBondContact O-CB 3.28Å; D182-R186 PolarHBondContact O-N 2.85Å; Y183-R186 PolarHBondContact O-N 3Å; R184-R186 VanDerWaalsContact C-N 3.27Å; R184-R186 PolarHBondContact O-N 3.24Å; R186-T189 PolarHBondContact O-N 3.33Å; R186-Y190 HydrophobicContact CG-CD2 3.88Å; R186-Y190 HydrophobicContact CG-CE2 3.68Å; R186-Y190 WeakPolarHBondContact O-CD2 3.38Å; R186-Y190 PolarHBondContact O-N 2.66Å; R186-Y190 VanDerWaalsContact O-N 3.13Å; R186-S251 WeakPolarHBondContact CD-OG 3.5Å; R186-S251 VanDerWaalsContact CG-OG 3.27Å; R186-S251 WeakPolarHBondContact CG-OG 3.26Å; R186-E356 IonicContact NH1-OE1 2.75Å |
| 187 | Y | 98.1 | Very high | 95.7 | Very high | 62 Ų | 62 | 69.3 Ų | 69.3 | 24% | 0.243 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -54.5 | -53.5 | 172.4 | 167 | -98.3 | 0 | 0 | 0 | 112.2 | Y183 R184 T189 Y190 V191 A248 F249 L252 | Y183-Y187 WeakPolarHBondContact O-CB 3.34Å; Y183-Y187 PolarHBondContact O-N 3.26Å; R184-Y187 WeakPolarHBondContact O-CB 3.49Å; R184-Y187 PolarHBondContact O-N 3.02Å; R184-Y187 VanDerWaalsContact O-N 3.16Å; Y187-T189 VanDerWaalsContact C-N 3.26Å; Y187-T189 PolarHBondContact O-N 2.95Å; Y187-Y190 PolarHBondContact O-N 3.22Å; Y187-V191 HydrophobicContact CD1-CG2 4.43Å; Y187-V191 HydrophobicContact CD2-CG2 3.71Å; Y187-V191 HydrophobicContact CE1-CG2 4.15Å; Y187-V191 HydrophobicContact CE2-CG2 3.41Å; Y187-V191 VanDerWaalsContact CE2-CG2 3.41Å; Y187-V191 HydrophobicContact CG-CG2 4.24Å; Y187-V191 WeakPolarHBondContact O-CB 3.4Å; Y187-V191 WeakPolarHBondContact O-CG2 3.37Å; Y187-V191 PolarHBondContact O-N 2.84Å; Y187-A248 HydrophobicContact CD2-CB 4.14Å; Y187-A248 WeakPolarHBondContact CD2-O 3.36Å; Y187-F249 HydrophobicContact CD2-CD1 4.5Å; Y187-F249 HydrophobicContact CE2-CD1 4.07Å; Y187-F249 HydrophobicContact CE2-CE1 4.26Å; Y187-L252 HydrophobicContact CD2-CB 3.67Å; Y187-L252 HydrophobicContact CD2-CD1 4.49Å; Y187-L252 HydrophobicContact CD2-CD2 4.36Å; Y187-L252 HydrophobicContact CD2-CG 4.39Å; Y187-L252 HydrophobicContact CE2-CB 4.08Å; Y187-L252 HydrophobicContact CE2-CD1 4.49Å; Y187-L252 HydrophobicContact CE2-CD2 3.9Å; Y187-L252 HydrophobicContact CE2-CG 4.38Å; Y187-L252 HydrophobicContact CG-CB 4.26Å |
| 188 | D | 98.3 | Very high | 97 | Very high | 85 Ų | 85 | 63.4 Ų | 63.4 | 46% | 0.455 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -59.6 | -38.2 | -176.9 | -65.6 | -36.2 | 0 | 0 | 0 | 112.1 | R184 K192 | R184-D188 VanDerWaalsContact O-CG 3.3Å; R184-D188 PolarHBondContact O-N 3.34Å; D188-K192 VanDerWaalsContact O-CB 3.27Å; D188-K192 WeakPolarHBondContact O-CB 3.5Å; D188-K192 PolarHBondContact O-N 3.27Å |
| 189 | T | 98.4 | Very high | 97.6 | Very high | 75 Ų | 75 | 66.6 Ų | 66.6 | 46% | 0.46 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -65.7 | -50.7 | 179 | -61.8 | 0 | 0 | 0 | 0 | 111.4 | R185 R186 Y187 K192 L193 | R185-T189 WeakPolarHBondContact O-CB 3.23Å; R185-T189 PolarHBondContact O-N 3.45Å; R185-T189 PolarHBondContact O-OG1 3.01Å; R186-T189 PolarHBondContact O-N 3.33Å; Y187-T189 VanDerWaalsContact C-N 3.26Å; Y187-T189 PolarHBondContact O-N 2.95Å; T189-K192 PolarHBondContact O-N 3.27Å; T189-L193 PolarHBondContact O-N 3.05Å |
| 190 | Y | 98.6 | Very high | 97.8 | Very high | 24 Ų | 24 | 66.4 Ų | 66.4 | 9% | 0.094 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -78.2 | -28.9 | -177.4 | -67.6 | -66.2 | 0 | 0 | 0 | 113.2 | R186 Y187 L193 G194 S244 I247 L381 Q382 P384 | R186-Y190 HydrophobicContact CG-CD2 3.88Å; R186-Y190 HydrophobicContact CG-CE2 3.68Å; R186-Y190 WeakPolarHBondContact O-CD2 3.38Å; R186-Y190 PolarHBondContact O-N 2.66Å; R186-Y190 VanDerWaalsContact O-N 3.13Å; Y187-Y190 PolarHBondContact O-N 3.22Å; Y190-L193 HydrophobicContact CD1-CD2 4.46Å; Y190-L193 PolarHBondContact O-N 2.67Å; Y190-G194 PolarHBondContact O-N 3.13Å; Y190-S244 WeakPolarHBondContact CB-O 3.38Å; Y190-S244 PolarHBondContact O-OG 2.86Å; Y190-S244 VanDerWaalsContact O-OG 3.07Å; Y190-I247 HydrophobicContact CD2-CB 4.18Å; Y190-I247 HydrophobicContact CD2-CG2 3.44Å; Y190-I247 VanDerWaalsContact CD2-CG2 3.44Å; Y190-I247 HydrophobicContact CE2-CG2 3.5Å; Y190-I247 VanDerWaalsContact CE2-CG2 3.5Å; Y190-I247 HydrophobicContact CG-CB 4.27Å; Y190-I247 HydrophobicContact CG-CG2 4.03Å; Y190-L381 HydrophobicContact CD1-CD1 3.7Å; Y190-L381 HydrophobicContact CE1-CD1 3.63Å; Y190-Q382 VanDerWaalsContact CE1-O 3.31Å; Y190-Q382 WeakPolarHBondContact CE1-O 3.44Å; Y190-Q382 PolarHBondContact OH-O 3.22Å; Y190-P384 WeakPolarHBondContact OH-CD 3.36Å; Y190-P384 VanDerWaalsContact OH-N 3.16Å |
| 191 | V | 98.5 | Very high | 97.8 | Very high | 34 Ų | 34 | 64.5 Ų | 64.5 | 21% | 0.206 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -62.2 | -44 | 166.8 | 171.4 | 0 | 0 | 0 | 0 | 110.6 | Y187 T195 A248 F249 | Y187-V191 HydrophobicContact CD1-CG2 4.43Å; Y187-V191 HydrophobicContact CD2-CG2 3.71Å; Y187-V191 HydrophobicContact CE1-CG2 4.15Å; Y187-V191 HydrophobicContact CE2-CG2 3.41Å; Y187-V191 VanDerWaalsContact CE2-CG2 3.41Å; Y187-V191 HydrophobicContact CG-CG2 4.24Å; Y187-V191 WeakPolarHBondContact O-CB 3.4Å; Y187-V191 WeakPolarHBondContact O-CG2 3.37Å; Y187-V191 PolarHBondContact O-N 2.84Å; V191-T195 VanDerWaalsContact O-CB 3.26Å; V191-T195 WeakPolarHBondContact O-CB 3.24Å; V191-T195 PolarHBondContact O-N 2.86Å; V191-T195 PolarHBondContact O-OG1 3.49Å; V191-A248 HydrophobicContact CG2-CB 3.79Å; V191-F249 HydrophobicContact CG2-CE1 4.25Å |
| 192 | K | 98.6 | Very high | 97.7 | Very high | 166 Ų | 166 | 61.8 Ų | 61.8 | 72% | 0.722 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -61.5 | -45.5 | 177.6 | -175.6 | -179.7 | 178 | -175.8 | 0 | 111.5 | D188 T189 T195 K196 | D188-K192 VanDerWaalsContact O-CB 3.27Å; D188-K192 WeakPolarHBondContact O-CB 3.5Å; D188-K192 PolarHBondContact O-N 3.27Å; T189-K192 PolarHBondContact O-N 3.27Å; K192-T195 PolarHBondContact O-N 2.89Å; K192-K196 PolarHBondContact O-N 2.91Å |
| 193 | L | 98.6 | Very high | 97.6 | Very high | 27 Ų | 27 | 61.8 Ų | 61.8 | 14% | 0.141 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -64.6 | -50.1 | 177.6 | 176.1 | 59.2 | 0 | 0 | 0 | 112.1 | T189 Y190 T195 K196 L197 E380 L381 | T189-L193 PolarHBondContact O-N 3.05Å; Y190-L193 HydrophobicContact CD1-CD2 4.46Å; Y190-L193 PolarHBondContact O-N 2.67Å; L193-T195 PolarHBondContact O-N 3.27Å; L193-K196 WeakPolarHBondContact O-CB 3.21Å; L193-K196 PolarHBondContact O-N 3.21Å; L193-L197 HydrophobicContact CD1-CD1 3.85Å; L193-L197 HydrophobicContact CD1-CD2 4.49Å; L193-L197 HydrophobicContact CD1-CG 3.93Å; L193-L197 HydrophobicContact CG-CD1 3.9Å; L193-L197 HydrophobicContact CG-CG 4.42Å; L193-L197 WeakPolarHBondContact O-CG 3.49Å; L193-L197 PolarHBondContact O-N 3.49Å; L193-E380 HydrophobicContact CD1-CB 3.82Å; L193-L381 HydrophobicContact CD2-CB 4.18Å; L193-L381 HydrophobicContact CD2-CD1 3.68Å |
| 194 | G | 98.3 | Very high | 97.4 | Very high | 0 Ų | 0 | 61.9 Ų | 61.9 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -57.7 | -36.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y190 K198 M241 S244 Y245 | Y190-G194 PolarHBondContact O-N 3.13Å; G194-K198 VanDerWaalsContact O-CB 3.25Å; G194-K198 WeakPolarHBondContact O-CB 3.44Å; G194-K198 PolarHBondContact O-N 2.83Å; G194-M241 WeakPolarHBondContact O-CG 3.17Å; G194-S244 PolarHBondContact N-OG 2.77Å; G194-Y245 VanDerWaalsContact C-CZ 3.49Å; G194-Y245 VanDerWaalsContact C-OH 3.29Å; G194-Y245 PolarHBondContact O-OH 3.06Å |
| 195 | T | 98.4 | Very high | 97.1 | Very high | 50 Ų | 50 | 56 Ų | 56 | 31% | 0.307 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -70 | -36.4 | 175.8 | -56.5 | 0 | 0 | 0 | 0 | 112.2 | V191 K192 L193 H199 Y245 | V191-T195 VanDerWaalsContact O-CB 3.26Å; V191-T195 WeakPolarHBondContact O-CB 3.24Å; V191-T195 PolarHBondContact O-N 2.86Å; V191-T195 PolarHBondContact O-OG1 3.49Å; K192-T195 PolarHBondContact O-N 2.89Å; L193-T195 PolarHBondContact O-N 3.27Å; T195-H199 PolarHBondContact O-N 3.4Å; T195-H199 PolarHBondContact O-ND1 3.11Å; T195-H199 VanDerWaalsContact O-ND1 3.15Å; T195-Y245 WeakPolarHBondContact CA-OH 3.01Å; T195-Y245 PolarHBondContact N-OH 3.37Å; T195-Y245 PolarHBondContact OG1-OH 3.4Å |
| 196 | K | 98.5 | Very high | 96.7 | Very high | 91 Ų | 91 | 53.3 Ų | 53.3 | 40% | 0.396 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -64.3 | -58.6 | 174.1 | -170.1 | -148.5 | 159.2 | -172.4 | 0 | 110.8 | K192 L193 K198 H199 D200 E380 | K192-K196 PolarHBondContact O-N 2.91Å; L193-K196 WeakPolarHBondContact O-CB 3.21Å; L193-K196 PolarHBondContact O-N 3.21Å; K196-K198 PolarHBondContact O-N 3.41Å; K196-K198 VanDerWaalsContact O-N 3.14Å; K196-H199 WeakPolarHBondContact O-CA 3.28Å; K196-H199 WeakPolarHBondContact O-CB 3.42Å; K196-H199 PolarHBondContact O-N 3.26Å; K196-D200 WeakPolarHBondContact CE-OD2 3.42Å; K196-D200 WeakPolarHBondContact CG-OD2 3.22Å; K196-D200 VanDerWaalsContact O-CG 3.31Å; K196-D200 PolarHBondContact O-N 3.24Å; K196-D200 VanDerWaalsContact O-OD2 3.13Å; K196-E380 WeakPolarHBondContact CD-OE2 3.34Å; K196-E380 IonicContact NZ-OE1 3.9Å; K196-E380 PolarHBondContact NZ-OE1 3.34Å; K196-E380 IonicContact NZ-OE2 2.83Å; K196-E380 PolarHBondContact NZ-OE2 3.47Å |
| 197 | L | 98.3 | Very high | 96.2 | Very high | 0 Ų | 0 | 55 Ų | 55 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -54.8 | -37.6 | 179.8 | -65.4 | 168.7 | 0 | 0 | 0 | 112.2 | L193 R201 L237 E240 M241 E380 | L193-L197 HydrophobicContact CD1-CD1 3.85Å; L193-L197 HydrophobicContact CD1-CD2 4.49Å; L193-L197 HydrophobicContact CD1-CG 3.93Å; L193-L197 HydrophobicContact CG-CD1 3.9Å; L193-L197 HydrophobicContact CG-CG 4.42Å; L193-L197 WeakPolarHBondContact O-CG 3.49Å; L193-L197 PolarHBondContact O-N 3.49Å; L197-R201 VanDerWaalsContact O-CB 3.24Å; L197-R201 WeakPolarHBondContact O-CB 3.28Å; L197-R201 PolarHBondContact O-N 2.68Å; L197-L237 HydrophobicContact CD2-CD2 3.83Å; L197-E240 HydrophobicContact CD1-CB 4.07Å; L197-E240 HydrophobicContact CD1-CG 3.7Å; L197-M241 HydrophobicContact CB-CB 4.04Å; L197-E380 HydrophobicContact CD2-CB 4.5Å |
| 198 | K | 97.6 | Very high | 95.3 | Very high | 45 Ų | 45 | 57.6 Ų | 57.6 | 20% | 0.196 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -59.8 | -46.1 | 171.6 | -172.6 | -176.1 | 174.5 | -63 | 0 | 112.3 | G194 K196 D202 M241 | G194-K198 VanDerWaalsContact O-CB 3.25Å; G194-K198 WeakPolarHBondContact O-CB 3.44Å; G194-K198 PolarHBondContact O-N 2.83Å; K196-K198 PolarHBondContact O-N 3.41Å; K196-K198 VanDerWaalsContact O-N 3.14Å; K198-D202 IonicContact NZ-OD1 2.58Å; K198-D202 IonicContact NZ-OD2 2.75Å; K198-D202 PolarHBondContact NZ-OD2 2.63Å; K198-D202 VanDerWaalsContact O-CB 3.23Å; K198-D202 WeakPolarHBondContact O-CB 3.1Å; K198-D202 PolarHBondContact O-N 2.73Å; K198-M241 HydrophobicContact CB-CG 4.13Å; K198-M241 HydrophobicContact CB-SD 3.5Å; K198-M241 VanDerWaalsContact CB-SD 3.5Å; K198-M241 HydrophobicContact CD-SD 4.33Å; K198-M241 HydrophobicContact CG-SD 3.68Å |
| 199 | H | 97.8 | Very high | 94.2 | Very high | 105 Ų | 105 | 57.8 Ų | 57.8 | 49% | 0.486 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -68.9 | -38.8 | 179.8 | -70 | 146.2 | 0 | 0 | 0 | 112.8 | T195 K196 D202 A203 | T195-H199 PolarHBondContact O-N 3.4Å; T195-H199 PolarHBondContact O-ND1 3.11Å; T195-H199 VanDerWaalsContact O-ND1 3.15Å; K196-H199 WeakPolarHBondContact O-CA 3.28Å; K196-H199 WeakPolarHBondContact O-CB 3.42Å; K196-H199 PolarHBondContact O-N 3.26Å; H199-D202 CarbonylContact O-C 3.55Å; H199-D202 PolarHBondContact O-N 2.74Å; H199-A203 WeakPolarHBondContact O-CB 3.31Å; H199-A203 PolarHBondContact O-N 3.01Å |
| 200 | D | 97.1 | Very high | 92.7 | Very high | 59 Ų | 59 | 58.1 Ų | 58.1 | 32% | 0.316 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -64.2 | -46.9 | 178.5 | -54.9 | -36.9 | 0 | 0 | 0 | 110.4 | K196 A203 I204 | K196-D200 WeakPolarHBondContact CE-OD2 3.42Å; K196-D200 WeakPolarHBondContact CG-OD2 3.22Å; K196-D200 VanDerWaalsContact O-CG 3.31Å; K196-D200 PolarHBondContact O-N 3.24Å; K196-D200 VanDerWaalsContact O-OD2 3.13Å; D200-A203 WeakPolarHBondContact O-CB 3.36Å; D200-A203 PolarHBondContact O-N 3.12Å; D200-I204 WeakPolarHBondContact O-CG1 3.41Å; D200-I204 PolarHBondContact O-N 3.28Å |
| 201 | R | 95.5 | Very high | 90.8 | Very high | 1 Ų | 1 | 64.6 Ų | 64.6 | 0% | 0.004 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -57.2 | -50.1 | 169.5 | -178.9 | -154.3 | 67.6 | 164.2 | 11.8 | 112.4 | L197 A203 I204 V205 V234 L237 S238 E277 | L197-R201 VanDerWaalsContact O-CB 3.24Å; L197-R201 WeakPolarHBondContact O-CB 3.28Å; L197-R201 PolarHBondContact O-N 2.68Å; R201-A203 PolarHBondContact O-N 3.48Å; R201-I204 PolarHBondContact O-N 3.48Å; R201-V205 WeakPolarHBondContact O-CG2 3.44Å; R201-V205 PolarHBondContact O-N 3.09Å; R201-V234 HydrophobicContact CG-CB 4.42Å; R201-V234 HydrophobicContact CG-CG1 3.94Å; R201-V234 HydrophobicContact CG-CG2 4.31Å; R201-L237 HydrophobicContact CB-CB 4.09Å; R201-L237 HydrophobicContact CB-CD1 4.3Å; R201-S238 WeakPolarHBondContact CD-OG 3.32Å; R201-E277 VanDerWaalsContact CZ-CD 3.48Å; R201-E277 IonicContact CZ-OE1 3.78Å; R201-E277 IonicContact CZ-OE2 2.67Å; R201-E277 IonicContact NH1-OE1 2.64Å; R201-E277 PolarHBondContact NH1-OE1 3.01Å; R201-E277 IonicContact NH1-OE2 3.05Å; R201-E277 PolarHBondContact NH1-OE2 3.36Å; R201-E277 IonicContact NH2-OE1 3.37Å; R201-E277 PolarHBondContact NH2-OE1 3.1Å; R201-E277 IonicContact NH2-OE2 3.37Å; R201-E277 PolarHBondContact NH2-OE2 3.11Å; R201-E277 VanDerWaalsContact NH2-OE2 3.13Å |
| 202 | D | 95 | Very high | 88.7 | Confident | 22 Ų | 22 | 66.6 Ų | 66.6 | 12% | 0.118 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -60.9 | -29.9 | 179.3 | -77.9 | 4 | 0 | 0 | 0 | 111.7 | K198 H199 K206 | K198-D202 IonicContact NZ-OD1 2.58Å; K198-D202 IonicContact NZ-OD2 2.75Å; K198-D202 PolarHBondContact NZ-OD2 2.63Å; K198-D202 VanDerWaalsContact O-CB 3.23Å; K198-D202 WeakPolarHBondContact O-CB 3.1Å; K198-D202 PolarHBondContact O-N 2.73Å; H199-D202 CarbonylContact O-C 3.55Å; H199-D202 PolarHBondContact O-N 2.74Å; D202-K206 VanDerWaalsContact O-CB 3.28Å; D202-K206 WeakPolarHBondContact O-CB 3.39Å; D202-K206 VanDerWaalsContact O-CD 3.25Å; D202-K206 WeakPolarHBondContact O-CD 3.08Å; D202-K206 WeakPolarHBondContact O-CG 3.48Å; D202-K206 PolarHBondContact O-N 3.31Å; D202-K206 IonicContact OD2-NZ 3.89Å |
| 203 | A | 94.6 | Very high | 86.1 | Confident | 57 Ų | 57 | 62 Ų | 62 | 47% | 0.471 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -70.8 | -43.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | H199 D200 R201 V205 K206 S207 | H199-A203 WeakPolarHBondContact O-CB 3.31Å; H199-A203 PolarHBondContact O-N 3.01Å; D200-A203 WeakPolarHBondContact O-CB 3.36Å; D200-A203 PolarHBondContact O-N 3.12Å; R201-A203 PolarHBondContact O-N 3.48Å; A203-V205 VanDerWaalsContact C-N 3.34Å; A203-K206 PolarHBondContact O-N 3.29Å; A203-S207 WeakPolarHBondContact O-CB 3.34Å; A203-S207 PolarHBondContact O-N 3.08Å |
| 204 | I | 93.4 | Very high | 83.5 | Confident | 31 Ų | 31 | 67.2 Ų | 67.2 | 16% | 0.159 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -60 | -45.6 | 172.4 | -60 | 161 | 0 | 0 | 0 | 110.3 | D200 R201 K206 S207 L226 E230 L233 V234 L237 | D200-I204 WeakPolarHBondContact O-CG1 3.41Å; D200-I204 PolarHBondContact O-N 3.28Å; R201-I204 PolarHBondContact O-N 3.48Å; I204-K206 PolarHBondContact O-N 3.3Å; I204-S207 PolarHBondContact O-N 3.41Å; I204-S207 PolarHBondContact O-OG 2.96Å; I204-L226 HydrophobicContact CG2-CD2 3.9Å; I204-E230 HydrophobicContact CG2-CB 3.98Å; I204-E230 HydrophobicContact CG2-CG 3.99Å; I204-L233 HydrophobicContact CD1-CD2 3.7Å; I204-L233 HydrophobicContact CD1-CG 3.98Å; I204-V234 HydrophobicContact CB-CG2 4.05Å; I204-V234 HydrophobicContact CD1-CG2 4.38Å; I204-V234 HydrophobicContact CG2-CG2 3.73Å; I204-L237 HydrophobicContact CD1-CD1 3.74Å |
| 205 | V | 90.9 | Very high | 81.1 | Confident | 20 Ų | 20 | 75.5 Ų | 75.5 | 12% | 0.121 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -63 | -41.2 | 178.5 | 169.9 | 0 | 0 | 0 | 0 | 111.6 | R201 A203 M209 L224 V234 | R201-V205 WeakPolarHBondContact O-CG2 3.44Å; R201-V205 PolarHBondContact O-N 3.09Å; A203-V205 VanDerWaalsContact C-N 3.34Å; V205-M209 HydrophobicContact CG1-CE 4.07Å; V205-L224 HydrophobicContact CG1-CD1 4.08Å; V205-L224 HydrophobicContact CG1-CD2 3.87Å; V205-V234 HydrophobicContact CG2-CG1 4.11Å; V205-V234 HydrophobicContact CG2-CG2 4.08Å |
| 206 | K | 88.7 | Confident | 78.3 | Confident | 123 Ų | 123 | 79.3 Ų | 79.3 | 54% | 0.535 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -74.6 | -33.6 | 179.5 | -73.2 | 163.1 | -166.5 | 160.9 | 0 | 113.6 | D202 A203 I204 R208 M209 | D202-K206 VanDerWaalsContact O-CB 3.28Å; D202-K206 WeakPolarHBondContact O-CB 3.39Å; D202-K206 VanDerWaalsContact O-CD 3.25Å; D202-K206 WeakPolarHBondContact O-CD 3.08Å; D202-K206 WeakPolarHBondContact O-CG 3.48Å; D202-K206 PolarHBondContact O-N 3.31Å; D202-K206 IonicContact OD2-NZ 3.89Å; A203-K206 PolarHBondContact O-N 3.29Å; I204-K206 PolarHBondContact O-N 3.3Å; K206-R208 PolarHBondContact O-N 2.82Å; K206-M209 WeakPolarHBondContact O-CB 3.25Å; K206-M209 PolarHBondContact O-N 3.3Å |
| 207 | S | 86.1 | Confident | 75.9 | Confident | 77 Ų | 77 | 81.7 Ų | 81.7 | 54% | 0.538 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -64.8 | -21.7 | -180 | 73.7 | 0 | 0 | 0 | 0 | 113 | A203 I204 | A203-S207 WeakPolarHBondContact O-CB 3.34Å; A203-S207 PolarHBondContact O-N 3.08Å; I204-S207 PolarHBondContact O-N 3.41Å; I204-S207 PolarHBondContact O-OG 2.96Å |
| 208 | R | 80.8 | Confident | 73.5 | Confident | 118 Ų | 118 | 85.6 Ų | 85.6 | 45% | 0.445 | 50% | 0.501 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.9 | 2.4 | 173.3 | -55.8 | -54.4 | -178.5 | -164.6 | -4.1 | 114.6 | K206 L226 E230 | K206-R208 PolarHBondContact O-N 2.82Å; R208-L226 HydrophobicContact CB-CD2 4.23Å; R208-L226 HydrophobicContact CG-CD2 3.86Å; R208-E230 IonicContact CZ-OE1 3.15Å; R208-E230 IonicContact NE-OE1 2.74Å; R208-E230 PolarHBondContact NE-OE1 2.86Å; R208-E230 IonicContact NE-OE2 3.38Å; R208-E230 PolarHBondContact NE-OE2 2.92Å; R208-E230 IonicContact NH2-OE1 2.71Å; R208-E230 PolarHBondContact NH2-OE1 2.84Å; R208-E230 IonicContact NH2-OE2 3.86Å |
| 209 | M | 74.1 | Confident | 71 | Confident | 89 Ų | 89 | 87.9 Ų | 87.9 | 44% | 0.438 | 52% | 0.522 | S | S | . | . | S | Bend | trans | -77.4 | 133.5 | 168.7 | -72.2 | -175.7 | 171.5 | 0 | 0 | 110 | V205 K206 N211 L224 | V205-M209 HydrophobicContact CG1-CE 4.07Å; K206-M209 WeakPolarHBondContact O-CB 3.25Å; K206-M209 PolarHBondContact O-N 3.3Å; M209-N211 PolarHBondContact O-N 3.03Å; M209-N211 VanDerWaalsContact O-N 3.14Å; M209-L224 HydrophobicContact CE-CD2 4.21Å; M209-L224 HydrophobicContact CG-CD2 4.29Å |
| 210 | P | 67.2 | Low | 68.3 | Low | 82 Ų | 82 | 88.3 Ų | 88.3 | 53% | 0.532 | 54% | 0.537 | S | S | . | . | trans | -65 | 116.7 | 178.3 | 25.8 | -33.2 | 0 | 0 | 0 | 110.5 | G212 | P210-G212 PolarHBondContact O-N 2.94Š| ||
| 211 | N | 58.5 | Low | 65.9 | Low | 160 Ų | 160 | 89.7 Ų | 89.7 | 86% | 0.856 | 56% | 0.557 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.8 | 111.1 | -176.2 | -83.3 | -58.7 | 0 | 0 | 0 | 112.3 | M209 S213 | M209-N211 PolarHBondContact O-N 3.03Å; M209-N211 VanDerWaalsContact O-N 3.14Å; N211-S213 VanDerWaalsContact C-N 3.32Å; N211-S213 PolarHBondContact O-N 2.74Å |
| 212 | G | 53.7 | Low | 63.7 | Low | 76 Ų | 76 | 94.2 Ų | 94.2 | 78% | 0.784 | 59% | 0.587 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 74.6 | 4.2 | 163.2 | 0 | 0 | 0 | 0 | 0 | 117.2 | P210 T214 | P210-G212 PolarHBondContact O-N 2.94Å; G212-T214 PolarHBondContact O-N 3.39Å |
| 213 | S | 45.7 | Very low | 61.8 | Low | 70 Ų | 70 | 98.8 Ų | 98.8 | 49% | 0.49 | 62% | 0.615 | S | S | . | * | trans | -76 | 86.8 | 177.5 | 68.6 | 0 | 0 | 0 | 0 | 111.7 | N211 K215 | N211-S213 VanDerWaalsContact C-N 3.32Å; N211-S213 PolarHBondContact O-N 2.74Å; S213-K215 PolarHBondContact O-N 3.15Å | ||
| 214 | T | 43.7 | Very low | 60.6 | Low | 136 Ų | 136 | 98.9 Ų | 98.9 | 83% | 0.834 | 61% | 0.607 | S | S | * | * | trans | -65.6 | 81.7 | 159.3 | 51.7 | 0 | 0 | 0 | 0 | 108.9 | G212 P216 | G212-T214 PolarHBondContact O-N 3.39Å; T214-P216 WeakPolarHBondContact O-CD 3.43Å | ||
| 215 | K | 47.4 | Very low | 60.1 | Low | 174 Ų | 174 | 103.1 Ų | 103.1 | 76% | 0.757 | 63% | 0.63 | S | S | * | * | trans | -75.6 | 117.4 | 169.3 | -85.1 | -162.9 | 170 | -168.6 | 0 | 108.8 | S213 D217 | S213-K215 PolarHBondContact O-N 3.15Å; K215-D217 VanDerWaalsContact C-N 3.34Å; K215-D217 PolarHBondContact O-N 3.2Å | ||
| 216 | P | 40.2 | Very low | 59.9 | Low | 130 Ų | 130 | 102.6 Ų | 102.6 | 84% | 0.844 | 63% | 0.627 | S | S | * | * | trans | -91.4 | 69.7 | 179.1 | 37.1 | -31 | 0 | 0 | 0 | 109.4 | T214 | T214-P216 WeakPolarHBondContact O-CD 3.43Š| ||
| 217 | D | 48.2 | Very low | 60.1 | Low | 141 Ų | 141 | 100.2 Ų | 100.2 | 75% | 0.754 | 62% | 0.623 | S | S | * | * | S | Bend | trans | -151.1 | 152.2 | 172.2 | -135.9 | -32.5 | 0 | 0 | 0 | 113 | K215 S219 | K215-D217 VanDerWaalsContact C-N 3.34Å; K215-D217 PolarHBondContact O-N 3.2Å; D217-S219 PolarHBondContact O-N 2.8Å |
| 218 | G | 47.2 | Very low | 60.4 | Low | 81 Ų | 81 | 101.8 Ų | 101.8 | 84% | 0.835 | 63% | 0.625 | S | S | * | * | trans | -73.7 | 12.9 | -167.5 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 219 | S | 44.6 | Very low | 61.1 | Low | 93 Ų | 93 | 98.8 Ų | 98.8 | 65% | 0.65 | 63% | 0.625 | S | S | * | * | trans | -71.2 | 147.5 | -179.7 | 60.3 | 0 | 0 | 0 | 0 | 112.6 | D217 | D217-S219 PolarHBondContact O-N 2.8Š| ||
| 220 | S | 42 | Very low | 62 | Low | 114 Ų | 114 | 95.8 Ų | 95.8 | 80% | 0.797 | 61% | 0.61 | S | S | * | * | trans | -41 | 146.4 | -175.9 | -55.9 | 0 | 0 | 0 | 0 | 116 | ||||
| 221 | A | 46.9 | Very low | 63.4 | Low | 89 Ų | 89 | 95.9 Ų | 95.9 | 74% | 0.736 | 60% | 0.602 | S | S | * | * | S | Bend | trans | -45.3 | 138.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | T223 | A221-T223 PolarHBondContact O-N 2.96Š|
| 222 | P | 48.9 | Very low | 65.2 | Low | 96 Ų | 96 | 89.4 Ų | 89.4 | 62% | 0.623 | 57% | 0.566 | S | S | * | * | trans | -56.4 | 116.2 | -165.3 | 21.8 | -34 | 0 | 0 | 0 | 111.1 | L224 | P222-L224 PolarHBondContact O-N 2.93Š| ||
| 223 | T | 55.2 | Low | 67.2 | Low | 117 Ų | 117 | 87.6 Ų | 87.6 | 72% | 0.718 | 54% | 0.539 | S | S | * | . | trans | -57.3 | 113.1 | 173 | 38.2 | 0 | 0 | 0 | 0 | 108.7 | A221 N225 | A221-T223 PolarHBondContact O-N 2.96Å; T223-N225 PolarHBondContact O-N 2.95Å; T223-N225 PolarHBondContact O-OD1 3.14Å | ||
| 224 | L | 68.8 | Low | 69.6 | Low | 59 Ų | 59 | 84.3 Ų | 84.3 | 31% | 0.309 | 52% | 0.516 | S | S | . | . | trans | -62.9 | 106 | 178.3 | -80.7 | 167.2 | 0 | 0 | 0 | 109.1 | V205 M209 P222 L226 | V205-L224 HydrophobicContact CG1-CD1 4.08Å; V205-L224 HydrophobicContact CG1-CD2 3.87Å; M209-L224 HydrophobicContact CE-CD2 4.21Å; M209-L224 HydrophobicContact CG-CD2 4.29Å; P222-L224 PolarHBondContact O-N 2.93Å; L224-L226 HydrophobicContact CB-CD1 3.88Å; L224-L226 HydrophobicContact CB-CG 4.12Å; L224-L226 HydrophobicContact CD1-CD1 4.28Å; L224-L226 PolarHBondContact O-N 3.04Å | ||
| 225 | N | 82.8 | Confident | 72.2 | Confident | 120 Ų | 120 | 77.9 Ų | 77.9 | 64% | 0.642 | 48% | 0.476 | S | S | * | . | trans | -75.3 | 50.2 | 178.7 | -68.9 | -26.8 | 0 | 0 | 0 | 111.2 | T223 | T223-N225 PolarHBondContact O-N 2.95Å; T223-N225 PolarHBondContact O-OD1 3.14Å | ||
| 226 | L | 88.2 | Confident | 74.6 | Confident | 9 Ų | 9 | 69.6 Ų | 69.6 | 5% | 0.047 | 44% | 0.44 | C | S | . | . | trans | -78.4 | 133 | 171.1 | -65.5 | 162.4 | 0 | 0 | 0 | 108.8 | I204 R208 L224 E230 K231 | I204-L226 HydrophobicContact CG2-CD2 3.9Å; R208-L226 HydrophobicContact CB-CD2 4.23Å; R208-L226 HydrophobicContact CG-CD2 3.86Å; L224-L226 HydrophobicContact CB-CD1 3.88Å; L224-L226 HydrophobicContact CB-CG 4.12Å; L224-L226 HydrophobicContact CD1-CD1 4.28Å; L224-L226 PolarHBondContact O-N 3.04Å; L226-E230 HydrophobicContact CB-CB 4.09Å; L226-E230 HydrophobicContact CD2-CB 3.82Å; L226-K231 HydrophobicContact CB-CG 3.8Å; L226-K231 WeakPolarHBondContact O-CE 3.1Å; L226-K231 PolarHBondContact O-NZ 3.05Å | ||
| 227 | T | 92.2 | Very high | 77.3 | Confident | 73 Ų | 73 | 64.1 Ų | 64.1 | 45% | 0.448 | 40% | 0.404 | S | S | . | . | trans | -60.9 | 167.4 | 167.6 | 60.9 | 0 | 0 | 0 | 0 | 111 | A229 E230 K231 | T227-A229 VanDerWaalsContact C-N 3.32Å; T227-A229 PolarHBondContact O-N 3.16Å; T227-E230 WeakPolarHBondContact CB-OE2 3.49Å; T227-E230 WeakPolarHBondContact CG2-OE2 3.41Å; T227-E230 PolarHBondContact N-OE2 2.87Å; T227-E230 PolarHBondContact O-N 2.99Å; T227-E230 WeakPolarHBondContact OG1-CB 3.5Å; T227-E230 VanDerWaalsContact OG1-CD 3.24Å; T227-E230 VanDerWaalsContact OG1-CG 3.24Å; T227-E230 WeakPolarHBondContact OG1-CG 3.42Å; T227-E230 PolarHBondContact OG1-N 3.05Å; T227-E230 PolarHBondContact OG1-OE2 3.45Å; T227-K231 WeakPolarHBondContact O-CG 3.49Å; T227-K231 PolarHBondContact O-N 2.87Å | ||
| 228 | L | 92.9 | Very high | 79.7 | Confident | 110 Ų | 110 | 57.4 Ų | 57.4 | 58% | 0.576 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -62.1 | -40.1 | 177.3 | -177.8 | 59 | 0 | 0 | 0 | 111.9 | K231 K232 F285 | L228-K231 PolarHBondContact O-N 3.48Å; L228-K232 HydrophobicContact CG-CD 4.49Å; L228-K232 WeakPolarHBondContact O-CG 3.46Å; L228-K232 PolarHBondContact O-N 3.25Å; L228-F285 HydrophobicContact CD1-CE1 4.23Å; L228-F285 HydrophobicContact CD1-CZ 4.29Å |
| 229 | A | 93.9 | Very high | 82.1 | Confident | 55 Ų | 55 | 53.6 Ų | 53.6 | 46% | 0.455 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -60.7 | -47.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | T227 K231 K232 L233 | T227-A229 VanDerWaalsContact C-N 3.32Å; T227-A229 PolarHBondContact O-N 3.16Å; A229-K231 VanDerWaalsContact C-N 3.34Å; A229-K231 PolarHBondContact O-N 3.28Å; A229-K232 WeakPolarHBondContact O-CB 3.34Å; A229-K232 PolarHBondContact O-N 3.4Å; A229-L233 WeakPolarHBondContact O-CB 3.33Å; A229-L233 PolarHBondContact O-N 3.22Å |
| 230 | E | 94.8 | Very high | 84.7 | Confident | 26 Ų | 26 | 49.2 Ų | 49.2 | 12% | 0.121 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -65.3 | -35.4 | 177.6 | -68.9 | 163.5 | 139.2 | 0 | 0 | 112.6 | I204 R208 L226 T227 L233 V234 | I204-E230 HydrophobicContact CG2-CB 3.98Å; I204-E230 HydrophobicContact CG2-CG 3.99Å; R208-E230 IonicContact CZ-OE1 3.15Å; R208-E230 IonicContact NE-OE1 2.74Å; R208-E230 PolarHBondContact NE-OE1 2.86Å; R208-E230 IonicContact NE-OE2 3.38Å; R208-E230 PolarHBondContact NE-OE2 2.92Å; R208-E230 IonicContact NH2-OE1 2.71Å; R208-E230 PolarHBondContact NH2-OE1 2.84Å; R208-E230 IonicContact NH2-OE2 3.86Å; L226-E230 HydrophobicContact CB-CB 4.09Å; L226-E230 HydrophobicContact CD2-CB 3.82Å; T227-E230 WeakPolarHBondContact CB-OE2 3.49Å; T227-E230 WeakPolarHBondContact CG2-OE2 3.41Å; T227-E230 PolarHBondContact N-OE2 2.87Å; T227-E230 PolarHBondContact O-N 2.99Å; T227-E230 WeakPolarHBondContact OG1-CB 3.5Å; T227-E230 VanDerWaalsContact OG1-CD 3.24Å; T227-E230 VanDerWaalsContact OG1-CG 3.24Å; T227-E230 WeakPolarHBondContact OG1-CG 3.42Å; T227-E230 PolarHBondContact OG1-N 3.05Å; T227-E230 PolarHBondContact OG1-OE2 3.45Å; E230-L233 PolarHBondContact O-N 2.89Å; E230-V234 WeakPolarHBondContact O-CB 3.17Å; E230-V234 WeakPolarHBondContact O-CG2 3.33Å; E230-V234 PolarHBondContact O-N 3.35Å |
| 231 | K | 94.9 | Very high | 87.3 | Confident | 84 Ų | 84 | 43.8 Ų | 43.8 | 37% | 0.365 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -62.6 | -42.7 | 173.2 | -76.5 | 164.6 | 174.4 | 143.2 | 0 | 111.8 | L226 T227 L228 A229 A235 F285 | L226-K231 HydrophobicContact CB-CG 3.8Å; L226-K231 WeakPolarHBondContact O-CE 3.1Å; L226-K231 PolarHBondContact O-NZ 3.05Å; T227-K231 WeakPolarHBondContact O-CG 3.49Å; T227-K231 PolarHBondContact O-N 2.87Å; L228-K231 PolarHBondContact O-N 3.48Å; A229-K231 VanDerWaalsContact C-N 3.34Å; A229-K231 PolarHBondContact O-N 3.28Å; K231-A235 WeakPolarHBondContact O-CB 3.45Å; K231-A235 PolarHBondContact O-N 2.69Å; K231-A235 VanDerWaalsContact O-N 3.11Å; K231-F285 HydrophobicContact CB-CZ 4.24Å |
| 232 | K | 96.5 | Very high | 89.8 | Confident | 24 Ų | 24 | 39.5 Ų | 39.5 | 10% | 0.104 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -62.2 | -51.7 | 175.1 | -72.3 | 175 | 168.9 | -175.4 | 0 | 111 | L228 A229 A235 V236 F285 W369 E373 A375 | L228-K232 HydrophobicContact CG-CD 4.49Å; L228-K232 WeakPolarHBondContact O-CG 3.46Å; L228-K232 PolarHBondContact O-N 3.25Å; A229-K232 WeakPolarHBondContact O-CB 3.34Å; A229-K232 PolarHBondContact O-N 3.4Å; K232-A235 PolarHBondContact O-N 2.89Å; K232-V236 PolarHBondContact O-N 2.9Å; K232-V236 VanDerWaalsContact O-N 3.11Å; K232-F285 HydrophobicContact CB-CZ 4.32Å; K232-F285 HydrophobicContact CG-CE1 3.69Å; K232-F285 HydrophobicContact CG-CE2 4.27Å; K232-F285 HydrophobicContact CG-CZ 3.51Å; K232-W369 HydrophobicContact CB-CH2 3.76Å; K232-W369 HydrophobicContact CB-CZ3 4.43Å; K232-W369 HydrophobicContact CD-CH2 4.44Å; K232-W369 HydrophobicContact CG-CH2 3.81Å; K232-W369 HydrophobicContact CG-CZ2 4.36Å; K232-E373 HydrophobicContact CD-CB 4.24Å; K232-E373 WeakPolarHBondContact CE-OE2 3.36Å; K232-E373 PolarHBondContact NZ-O 3.47Å; K232-E373 IonicContact NZ-OE2 3.13Å; K232-E373 PolarHBondContact NZ-OE2 2.88Å; K232-A375 HydrophobicContact CB-CB 3.64Å; K232-A375 HydrophobicContact CD-CB 4.48Å |
| 233 | L | 96.8 | Very high | 92.2 | Very high | 39 Ų | 39 | 35 Ų | 35 | 20% | 0.204 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -61.3 | -46.2 | 179.9 | -175.5 | 55.7 | 0 | 0 | 0 | 112.5 | I204 A229 E230 A235 V236 L237 W377 | I204-L233 HydrophobicContact CD1-CD2 3.7Å; I204-L233 HydrophobicContact CD1-CG 3.98Å; A229-L233 WeakPolarHBondContact O-CB 3.33Å; A229-L233 PolarHBondContact O-N 3.22Å; E230-L233 PolarHBondContact O-N 2.89Å; L233-A235 VanDerWaalsContact C-N 3.3Å; L233-A235 PolarHBondContact O-N 3.37Å; L233-V236 PolarHBondContact O-N 3.36Å; L233-L237 HydrophobicContact CD1-CD1 3.99Å; L233-L237 HydrophobicContact CD1-CG 4.01Å; L233-L237 HydrophobicContact CG-CD1 3.87Å; L233-L237 HydrophobicContact CG-CG 4.33Å; L233-L237 WeakPolarHBondContact O-CB 3.48Å; L233-L237 WeakPolarHBondContact O-CG 3.39Å; L233-L237 PolarHBondContact O-N 3.2Å; L233-W377 HydrophobicContact CD1-CB 3.98Å |
| 234 | V | 96.2 | Very high | 94.2 | Very high | 1 Ų | 1 | 29.4 Ų | 29.4 | 1% | 0.006 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -62.2 | -35.3 | 177 | 164.5 | 0 | 0 | 0 | 0 | 112.1 | R201 I204 V205 E230 S238 H281 | R201-V234 HydrophobicContact CG-CB 4.42Å; R201-V234 HydrophobicContact CG-CG1 3.94Å; R201-V234 HydrophobicContact CG-CG2 4.31Å; I204-V234 HydrophobicContact CB-CG2 4.05Å; I204-V234 HydrophobicContact CD1-CG2 4.38Å; I204-V234 HydrophobicContact CG2-CG2 3.73Å; V205-V234 HydrophobicContact CG2-CG1 4.11Å; V205-V234 HydrophobicContact CG2-CG2 4.08Å; E230-V234 WeakPolarHBondContact O-CB 3.17Å; E230-V234 WeakPolarHBondContact O-CG2 3.33Å; E230-V234 PolarHBondContact O-N 3.35Å; V234-S238 VanDerWaalsContact O-CB 3.28Å; V234-S238 WeakPolarHBondContact O-CB 3.44Å; V234-S238 PolarHBondContact O-N 3.37Å; V234-S238 VanDerWaalsContact O-N 3.1Å; V234-S238 PolarHBondContact O-OG 3Å; V234-H281 HydrophobicContact CG1-CB 4.43Å |
| 235 | A | 97 | Very high | 95.6 | Very high | 0 Ų | 0 | 27.6 Ų | 27.6 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -66.8 | -45.7 | 175 | 0 | 0 | 0 | 0 | 0 | 111.9 | K231 K232 L233 S238 L239 H281 F285 L288 | K231-A235 WeakPolarHBondContact O-CB 3.45Å; K231-A235 PolarHBondContact O-N 2.69Å; K231-A235 VanDerWaalsContact O-N 3.11Å; K232-A235 PolarHBondContact O-N 2.89Å; L233-A235 VanDerWaalsContact C-N 3.3Å; L233-A235 PolarHBondContact O-N 3.37Å; A235-S238 WeakPolarHBondContact O-CB 3.19Å; A235-S238 PolarHBondContact O-N 2.87Å; A235-L239 PolarHBondContact O-N 3.08Å; A235-H281 HydrophobicContact CB-CB 4.08Å; A235-F285 HydrophobicContact CB-CD2 4.05Å; A235-F285 HydrophobicContact CB-CE2 4.12Å; A235-L288 HydrophobicContact CB-CD1 3.92Å |
| 236 | V | 97.7 | Very high | 96.4 | Very high | 0 Ų | 0 | 22 Ų | 22 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -71.2 | -43.7 | -179.9 | -176.8 | 0 | 0 | 0 | 0 | 112.4 | K232 L233 S238 L239 E240 L288 V366 W369 W377 | K232-V236 PolarHBondContact O-N 2.9Å; K232-V236 VanDerWaalsContact O-N 3.11Å; L233-V236 PolarHBondContact O-N 3.36Å; V236-S238 PolarHBondContact O-N 3.47Å; V236-L239 WeakPolarHBondContact O-CB 3.47Å; V236-L239 PolarHBondContact O-N 3.42Å; V236-E240 PolarHBondContact O-N 3.5Å; V236-L288 HydrophobicContact CG2-CD1 3.9Å; V236-V366 HydrophobicContact CG1-CG1 3.49Å; V236-V366 VanDerWaalsContact CG1-CG1 3.49Å; V236-V366 HydrophobicContact CG2-CG1 4.46Å; V236-W369 HydrophobicContact CG2-CE3 3.73Å; V236-W369 HydrophobicContact CG2-CH2 4.12Å; V236-W369 HydrophobicContact CG2-CZ3 3.28Å; V236-W377 HydrophobicContact CB-CB 4.37Å; V236-W377 HydrophobicContact CB-CG 4.16Å; V236-W377 HydrophobicContact CG1-CB 4.1Å; V236-W377 HydrophobicContact CG1-CD2 3.38Å; V236-W377 HydrophobicContact CG1-CE3 3.95Å; V236-W377 HydrophobicContact CG1-CG 3.45Å; V236-W377 VanDerWaalsContact CG1-CG 3.45Å; V236-W377 HydrophobicContact CG1-CZ2 4.16Å |
| 237 | L | 97.9 | Very high | 96.9 | Very high | 16 Ų | 16 | 21.5 Ų | 21.5 | 8% | 0.084 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -58.5 | -37 | 173.8 | -70.5 | 173 | 0 | 0 | 0 | 111.6 | L197 R201 I204 L233 M241 | L197-L237 HydrophobicContact CD2-CD2 3.83Å; R201-L237 HydrophobicContact CB-CB 4.09Å; R201-L237 HydrophobicContact CB-CD1 4.3Å; I204-L237 HydrophobicContact CD1-CD1 3.74Å; L233-L237 HydrophobicContact CD1-CD1 3.99Å; L233-L237 HydrophobicContact CD1-CG 4.01Å; L233-L237 HydrophobicContact CG-CD1 3.87Å; L233-L237 HydrophobicContact CG-CG 4.33Å; L233-L237 WeakPolarHBondContact O-CB 3.48Å; L233-L237 WeakPolarHBondContact O-CG 3.39Å; L233-L237 PolarHBondContact O-N 3.2Å; L237-M241 WeakPolarHBondContact O-CB 3.33Å; L237-M241 PolarHBondContact O-N 3.41Å |
| 238 | S | 97.7 | Very high | 97.2 | Very high | 0 Ų | 0 | 18 Ų | 18 | 0% | 0 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -66 | -37.6 | 173.4 | -62.1 | 0 | 0 | 0 | 0 | 112.7 | R201 V234 A235 V236 V242 | R201-S238 WeakPolarHBondContact CD-OG 3.32Å; V234-S238 VanDerWaalsContact O-CB 3.28Å; V234-S238 WeakPolarHBondContact O-CB 3.44Å; V234-S238 PolarHBondContact O-N 3.37Å; V234-S238 VanDerWaalsContact O-N 3.1Å; V234-S238 PolarHBondContact O-OG 3Å; A235-S238 WeakPolarHBondContact O-CB 3.19Å; A235-S238 PolarHBondContact O-N 2.87Å; V236-S238 PolarHBondContact O-N 3.47Å; S238-V242 WeakPolarHBondContact O-CG2 3.46Å; S238-V242 PolarHBondContact O-N 2.92Å; S238-V242 VanDerWaalsContact O-N 3.16Å |
| 239 | L | 98.3 | Very high | 97.4 | Very high | 0 Ų | 0 | 13.7 Ų | 13.7 | 0% | 0 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -69.8 | -46.3 | -179.7 | -173.3 | 66.1 | 0 | 0 | 0 | 110.5 | A235 V236 V242 M243 L278 L288 M291 L295 V366 | A235-L239 PolarHBondContact O-N 3.08Å; V236-L239 WeakPolarHBondContact O-CB 3.47Å; V236-L239 PolarHBondContact O-N 3.42Å; L239-V242 PolarHBondContact O-N 3.17Å; L239-M243 HydrophobicContact CG-CE 4.22Å; L239-M243 WeakPolarHBondContact O-CG 3.46Å; L239-M243 PolarHBondContact O-N 3.2Å; L239-L278 HydrophobicContact CB-CD1 4.04Å; L239-L278 HydrophobicContact CD1-CD1 4.41Å; L239-L278 HydrophobicContact CD1-CD2 3.91Å; L239-L288 HydrophobicContact CD2-CD2 3.96Å; L239-M291 HydrophobicContact CD1-CB 4.16Å; L239-M291 HydrophobicContact CD2-CB 4.26Å; L239-M291 HydrophobicContact CD2-SD 3.98Å; L239-L295 HydrophobicContact CD1-CD1 3.57Å; L239-L295 HydrophobicContact CG-CD1 4.48Å; L239-V366 HydrophobicContact CD2-CG2 3.66Å |
| 240 | E | 98.2 | Very high | 97.6 | Very high | 1 Ų | 1 | 12.7 Ų | 12.7 | 1% | 0.005 | 6% | 0.058 | C | C | . | . | H | α-helix | trans | -66.4 | -41.3 | 177.6 | -166.5 | 178 | -144.5 | 0 | 0 | 112.4 | L197 V236 V242 M243 S244 W377 E380 L381 | L197-E240 HydrophobicContact CD1-CB 4.07Å; L197-E240 HydrophobicContact CD1-CG 3.7Å; V236-E240 PolarHBondContact O-N 3.5Å; E240-V242 VanDerWaalsContact C-N 3.32Å; E240-V242 PolarHBondContact O-N 3.04Å; E240-M243 HydrophobicContact CB-CE 4.4Å; E240-M243 PolarHBondContact O-N 3.28Å; E240-S244 WeakPolarHBondContact O-CB 3.26Å; E240-S244 PolarHBondContact O-N 3.04Å; E240-W377 WeakPolarHBondContact OE1-CZ2 3.34Å; E240-W377 PolarHBondContact OE2-NE1 2.75Å; E240-E380 PolarHBondContact OE1-N 2.89Å; E240-L381 HydrophobicContact CG-CB 3.5Å; E240-L381 VanDerWaalsContact CG-CB 3.5Å; E240-L381 HydrophobicContact CG-CD2 4.11Å; E240-L381 HydrophobicContact CG-CG 4.44Å; E240-L381 VanDerWaalsContact OE1-CB 3.26Å; E240-L381 WeakPolarHBondContact OE1-CB 3.44Å; E240-L381 PolarHBondContact OE1-N 3.01Å |
| 241 | M | 98.4 | Very high | 97.7 | Very high | 0 Ų | 0 | 11.5 Ų | 11.5 | 0% | 0 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -52 | -49.4 | 170.1 | 172.8 | -165 | 76 | 0 | 0 | 111.4 | G194 L197 K198 L237 S244 Y245 H274 | G194-M241 WeakPolarHBondContact O-CG 3.17Å; L197-M241 HydrophobicContact CB-CB 4.04Å; K198-M241 HydrophobicContact CB-CG 4.13Å; K198-M241 HydrophobicContact CB-SD 3.5Å; K198-M241 VanDerWaalsContact CB-SD 3.5Å; K198-M241 HydrophobicContact CD-SD 4.33Å; K198-M241 HydrophobicContact CG-SD 3.68Å; L237-M241 WeakPolarHBondContact O-CB 3.33Å; L237-M241 PolarHBondContact O-N 3.41Å; M241-S244 WeakPolarHBondContact O-CB 3.45Å; M241-S244 PolarHBondContact O-N 2.79Å; M241-Y245 HydrophobicContact CG-CD2 3.87Å; M241-Y245 HydrophobicContact CG-CE2 3.52Å; M241-Y245 WeakPolarHBondContact O-CD2 3.26Å; M241-Y245 PolarHBondContact O-N 2.91Å; M241-Y245 HydrophobicContact SD-CE2 4.23Å; M241-H274 HydrophobicContact CE-CB 3.82Å |
| 242 | V | 98.4 | Very high | 97.8 | Very high | 0 Ų | 0 | 9.3 Ų | 9.3 | 0% | 0 | 4% | 0.044 | C | C | . | . | H | α-helix | trans | -67.3 | -45.2 | -179.9 | 167.8 | 0 | 0 | 0 | 0 | 111.3 | S238 L239 E240 S244 Y245 L246 H274 F275 L278 L295 | S238-V242 WeakPolarHBondContact O-CG2 3.46Å; S238-V242 PolarHBondContact O-N 2.92Å; S238-V242 VanDerWaalsContact O-N 3.16Å; L239-V242 PolarHBondContact O-N 3.17Å; E240-V242 VanDerWaalsContact C-N 3.32Å; E240-V242 PolarHBondContact O-N 3.04Å; V242-S244 VanDerWaalsContact C-N 3.25Å; V242-S244 PolarHBondContact O-N 3.19Å; V242-Y245 PolarHBondContact O-N 3.42Å; V242-L246 HydrophobicContact CG1-CD1 4.23Å; V242-L246 HydrophobicContact CG1-CG 4.36Å; V242-L246 WeakPolarHBondContact O-CG 3.46Å; V242-L246 PolarHBondContact O-N 3.32Å; V242-H274 HydrophobicContact CG2-CB 4.17Å; V242-F275 HydrophobicContact CG1-CD1 4.21Å; V242-F275 HydrophobicContact CG1-CE1 3.43Å; V242-F275 VanDerWaalsContact CG1-CE1 3.43Å; V242-F275 HydrophobicContact CG1-CE2 4.11Å; V242-F275 HydrophobicContact CG1-CZ 3.38Å; V242-L278 HydrophobicContact CB-CD2 4.29Å; V242-L278 HydrophobicContact CG2-CD2 4.05Å; V242-L295 HydrophobicContact CG1-CD1 4.35Å |
| 243 | M | 98.6 | Very high | 97.9 | Very high | 0 Ų | 0 | 8.4 Ų | 8.4 | 0% | 0 | 4% | 0.04 | C | C | . | . | H | α-helix | trans | -57.2 | -39.6 | 175.4 | -73.1 | -169.9 | -65.7 | 0 | 0 | 112.1 | L239 E240 L246 I247 L295 V359 M362 L363 L381 | L239-M243 HydrophobicContact CG-CE 4.22Å; L239-M243 WeakPolarHBondContact O-CG 3.46Å; L239-M243 PolarHBondContact O-N 3.2Å; E240-M243 HydrophobicContact CB-CE 4.4Å; E240-M243 PolarHBondContact O-N 3.28Å; M243-L246 PolarHBondContact O-N 3.4Å; M243-I247 PolarHBondContact O-N 2.75Å; M243-L295 HydrophobicContact CG-CD1 3.49Å; M243-L295 VanDerWaalsContact CG-CD1 3.49Å; M243-L295 HydrophobicContact CG-CD2 4.23Å; M243-L295 HydrophobicContact SD-CD1 4.34Å; M243-V359 HydrophobicContact CB-CG1 4.3Å; M243-V359 HydrophobicContact CB-CG2 3.73Å; M243-V359 HydrophobicContact CG-CG2 3.87Å; M243-V359 HydrophobicContact SD-CB 4.45Å; M243-V359 HydrophobicContact SD-CG1 4.12Å; M243-V359 HydrophobicContact SD-CG2 4.1Å; M243-M362 HydrophobicContact SD-CB 3.92Å; M243-M362 HydrophobicContact SD-SD 4.49Å; M243-L363 HydrophobicContact CE-CD2 3.59Å; M243-L363 HydrophobicContact CE-CG 4.17Å; M243-L363 HydrophobicContact SD-CG 4.47Å; M243-L381 HydrophobicContact CB-CD2 3.42Å; M243-L381 VanDerWaalsContact CB-CD2 3.42Å; M243-L381 HydrophobicContact CE-CD2 4.32Å |
| 244 | S | 98.5 | Very high | 97.9 | Very high | 0 Ų | 0 | 8.7 Ų | 8.7 | 0% | 0 | 4% | 0.041 | C | C | . | . | H | α-helix | trans | -62.5 | -50.5 | 174.5 | -154.8 | 0 | 0 | 0 | 0 | 111.8 | Y190 G194 E240 M241 V242 L246 I247 A248 | Y190-S244 WeakPolarHBondContact CB-O 3.38Å; Y190-S244 PolarHBondContact O-OG 2.86Å; Y190-S244 VanDerWaalsContact O-OG 3.07Å; G194-S244 PolarHBondContact N-OG 2.77Å; E240-S244 WeakPolarHBondContact O-CB 3.26Å; E240-S244 PolarHBondContact O-N 3.04Å; M241-S244 WeakPolarHBondContact O-CB 3.45Å; M241-S244 PolarHBondContact O-N 2.79Å; V242-S244 VanDerWaalsContact C-N 3.25Å; V242-S244 PolarHBondContact O-N 3.19Å; S244-L246 VanDerWaalsContact C-N 3.32Å; S244-L246 PolarHBondContact O-N 3.31Å; S244-I247 PolarHBondContact O-N 3.24Å; S244-A248 PolarHBondContact O-N 3.3Å |
| 245 | Y | 98.6 | Very high | 97.9 | Very high | 22 Ų | 22 | 9 Ų | 9 | 9% | 0.086 | 4% | 0.044 | C | C | . | . | H | α-helix | trans | -62 | -35 | 176.8 | -73.9 | -55.4 | 0 | 0 | 0 | 113.5 | G194 T195 M241 V242 A248 F249 L271 | G194-Y245 VanDerWaalsContact C-CZ 3.49Å; G194-Y245 VanDerWaalsContact C-OH 3.29Å; G194-Y245 PolarHBondContact O-OH 3.06Å; T195-Y245 WeakPolarHBondContact CA-OH 3.01Å; T195-Y245 PolarHBondContact N-OH 3.37Å; T195-Y245 PolarHBondContact OG1-OH 3.4Å; M241-Y245 HydrophobicContact CG-CD2 3.87Å; M241-Y245 HydrophobicContact CG-CE2 3.52Å; M241-Y245 WeakPolarHBondContact O-CD2 3.26Å; M241-Y245 PolarHBondContact O-N 2.91Å; M241-Y245 HydrophobicContact SD-CE2 4.23Å; V242-Y245 PolarHBondContact O-N 3.42Å; Y245-A248 WeakPolarHBondContact O-CB 3.45Å; Y245-A248 PolarHBondContact O-N 2.58Å; Y245-F249 HydrophobicContact CD1-CE1 4.11Å; Y245-F249 HydrophobicContact CD1-CE2 4.45Å; Y245-F249 AromaticContact CD1-CZ 3.75Å; Y245-F249 HydrophobicContact CD1-CZ 3.75Å; Y245-F249 HydrophobicContact CG-CE2 4.44Å; Y245-F249 HydrophobicContact CG-CZ 4.17Å; Y245-F249 WeakPolarHBondContact O-CB 3.39Å; Y245-F249 WeakPolarHBondContact O-CD2 3.39Å; Y245-F249 WeakPolarHBondContact O-CG 3.35Å; Y245-F249 PolarHBondContact O-N 3.42Å; Y245-L271 HydrophobicContact CD2-CD1 3.95Å; Y245-L271 HydrophobicContact CG-CD1 4.12Å |
| 246 | L | 98.5 | Very high | 97.9 | Very high | 1 Ų | 1 | 12.4 Ų | 12.4 | 1% | 0.005 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -61.3 | -48 | 175.5 | -69.8 | 173 | 0 | 0 | 0 | 111.5 | V242 M243 S244 A248 F249 K250 W268 L271 F275 L295 C299 V355 | V242-L246 HydrophobicContact CG1-CD1 4.23Å; V242-L246 HydrophobicContact CG1-CG 4.36Å; V242-L246 WeakPolarHBondContact O-CG 3.46Å; V242-L246 PolarHBondContact O-N 3.32Å; M243-L246 PolarHBondContact O-N 3.4Å; S244-L246 VanDerWaalsContact C-N 3.32Å; S244-L246 PolarHBondContact O-N 3.31Å; L246-A248 VanDerWaalsContact C-N 3.31Å; L246-A248 PolarHBondContact O-N 2.95Å; L246-F249 PolarHBondContact O-N 3.32Å; L246-K250 PolarHBondContact O-N 3.38Å; L246-W268 HydrophobicContact CD2-CE3 4.26Å; L246-W268 HydrophobicContact CD2-CZ3 3.76Å; L246-L271 HydrophobicContact CD2-CD2 3.62Å; L246-L271 HydrophobicContact CG-CD2 4.08Å; L246-F275 HydrophobicContact CD1-CZ 4.44Å; L246-F275 HydrophobicContact CD2-CZ 4.28Å; L246-L295 HydrophobicContact CD1-CB 4.15Å; L246-L295 HydrophobicContact CD1-CD2 3.8Å; L246-L295 HydrophobicContact CD1-CG 4.39Å; L246-C299 HydrophobicContact CD2-CB 3.88Å; L246-V355 HydrophobicContact CB-CG1 3.61Å |
| 247 | I | 98.4 | Very high | 97.7 | Very high | 0 Ų | 0 | 16.6 Ų | 16.6 | 0% | 0 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -62.3 | -42.2 | 176.9 | -63 | 166.2 | 0 | 0 | 0 | 110.1 | Y190 M243 S244 S251 V355 V359 L381 P383 P384 | Y190-I247 HydrophobicContact CD2-CB 4.18Å; Y190-I247 HydrophobicContact CD2-CG2 3.44Å; Y190-I247 VanDerWaalsContact CD2-CG2 3.44Å; Y190-I247 HydrophobicContact CE2-CG2 3.5Å; Y190-I247 VanDerWaalsContact CE2-CG2 3.5Å; Y190-I247 HydrophobicContact CG-CB 4.27Å; Y190-I247 HydrophobicContact CG-CG2 4.03Å; M243-I247 PolarHBondContact O-N 2.75Å; S244-I247 PolarHBondContact O-N 3.24Å; I247-S251 WeakPolarHBondContact O-CB 3.48Å; I247-S251 PolarHBondContact O-N 2.9Å; I247-S251 PolarHBondContact O-OG 3.46Å; I247-V355 HydrophobicContact CG1-CG1 3.96Å; I247-V359 HydrophobicContact CD1-CB 4.16Å; I247-V359 HydrophobicContact CD1-CG1 4Å; I247-V359 HydrophobicContact CD1-CG2 4.04Å; I247-V359 HydrophobicContact CG1-CG2 4.24Å; I247-L381 HydrophobicContact CD1-CD1 4.37Å; I247-P383 HydrophobicContact CD1-CB 4.45Å; I247-P384 HydrophobicContact CG2-CG 4.23Å |
| 248 | A | 98.4 | Very high | 97.6 | Very high | 0 Ų | 0 | 20.4 Ų | 20.4 | 0% | 0 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -57.8 | -53 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y187 V191 S244 Y245 L246 K250 S251 L252 | Y187-A248 HydrophobicContact CD2-CB 4.14Å; Y187-A248 WeakPolarHBondContact CD2-O 3.36Å; V191-A248 HydrophobicContact CG2-CB 3.79Å; S244-A248 PolarHBondContact O-N 3.3Å; Y245-A248 WeakPolarHBondContact O-CB 3.45Å; Y245-A248 PolarHBondContact O-N 2.58Å; L246-A248 VanDerWaalsContact C-N 3.31Å; L246-A248 PolarHBondContact O-N 2.95Å; A248-K250 PolarHBondContact O-N 3.07Å; A248-S251 WeakPolarHBondContact O-CB 3.13Å; A248-S251 PolarHBondContact O-N 2.7Å; A248-S251 VanDerWaalsContact O-N 3.11Å; A248-L252 PolarHBondContact O-N 2.98Å |
| 249 | F | 98.2 | Very high | 97.5 | Very high | 19 Ų | 19 | 23.8 Ų | 23.8 | 8% | 0.083 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -72.9 | -28 | -173.3 | -60.9 | -14.5 | 0 | 0 | 0 | 112.6 | Y187 V191 Y245 L246 N253 V267 W268 L271 | Y187-F249 HydrophobicContact CD2-CD1 4.5Å; Y187-F249 HydrophobicContact CE2-CD1 4.07Å; Y187-F249 HydrophobicContact CE2-CE1 4.26Å; V191-F249 HydrophobicContact CG2-CE1 4.25Å; Y245-F249 HydrophobicContact CD1-CE1 4.11Å; Y245-F249 HydrophobicContact CD1-CE2 4.45Å; Y245-F249 AromaticContact CD1-CZ 3.75Å; Y245-F249 HydrophobicContact CD1-CZ 3.75Å; Y245-F249 HydrophobicContact CG-CE2 4.44Å; Y245-F249 HydrophobicContact CG-CZ 4.17Å; Y245-F249 WeakPolarHBondContact O-CB 3.39Å; Y245-F249 WeakPolarHBondContact O-CD2 3.39Å; Y245-F249 WeakPolarHBondContact O-CG 3.35Å; Y245-F249 PolarHBondContact O-N 3.42Å; L246-F249 PolarHBondContact O-N 3.32Å; F249-N253 PolarHBondContact O-N 3.41Å; F249-N253 PolarHBondContact O-ND2 3.31Å; F249-V267 HydrophobicContact CB-CB 4.35Å; F249-V267 HydrophobicContact CB-CG2 3.81Å; F249-V267 HydrophobicContact CD1-CB 3.91Å; F249-V267 HydrophobicContact CD1-CG1 4.35Å; F249-V267 HydrophobicContact CD1-CG2 4.21Å; F249-V267 HydrophobicContact CD2-CB 3.83Å; F249-V267 HydrophobicContact CD2-CG2 4.14Å; F249-V267 HydrophobicContact CE1-CB 4.15Å; F249-V267 HydrophobicContact CE1-CG1 4.42Å; F249-V267 HydrophobicContact CE2-CB 4.07Å; F249-V267 VanDerWaalsContact CE2-O 3.27Å; F249-V267 WeakPolarHBondContact CE2-O 3.47Å; F249-V267 HydrophobicContact CG-CB 3.76Å; F249-V267 HydrophobicContact CG-CG2 3.79Å; F249-V267 HydrophobicContact CZ-CB 4.24Å; F249-W268 VanDerWaalsContact C-CH2 3.47Å; F249-W268 VanDerWaalsContact C-CZ2 3.41Å; F249-W268 HydrophobicContact CB-CD2 4.17Å; F249-W268 HydrophobicContact CB-CE3 3.92Å; F249-W268 HydrophobicContact CB-CH2 3.54Å; F249-W268 HydrophobicContact CB-CZ2 3.75Å; F249-W268 HydrophobicContact CB-CZ3 3.61Å; F249-W268 HydrophobicContact CD2-CE3 4.17Å; F249-W268 HydrophobicContact CD2-CZ3 4.42Å; F249-W268 WeakPolarHBondContact O-CZ2 3.27Å; F249-L271 HydrophobicContact CD2-CD2 4.17Å; F249-L271 HydrophobicContact CE2-CB 4.14Å; F249-L271 HydrophobicContact CE2-CD1 4.29Å; F249-L271 HydrophobicContact CE2-CD2 4.21Å; F249-L271 HydrophobicContact CE2-CG 4.45Å |
| 250 | K | 97.3 | Very high | 97.3 | Very high | 34 Ų | 34 | 35.1 Ų | 35.1 | 15% | 0.148 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -64.8 | -47.4 | 166.1 | -174 | -174.1 | 161.6 | -169.3 | 0 | 110.5 | L246 A248 L252 N253 Q254 W268 V355 E356 | L246-K250 PolarHBondContact O-N 3.38Å; A248-K250 PolarHBondContact O-N 3.07Å; K250-L252 VanDerWaalsContact C-N 3.33Å; K250-L252 PolarHBondContact O-N 3.23Å; K250-N253 PolarHBondContact O-N 3.06Å; K250-N253 VanDerWaalsContact O-N 3.07Å; K250-Q254 VanDerWaalsContact CE-CD 3.46Å; K250-Q254 HydrophobicContact CG-CG 4.32Å; K250-Q254 WeakPolarHBondContact O-CG 3.49Å; K250-Q254 PolarHBondContact O-N 2.79Å; K250-W268 HydrophobicContact CB-CH2 4.14Å; K250-W268 VanDerWaalsContact N-CH2 3.26Å; K250-V355 HydrophobicContact CB-CG2 4.33Å; K250-V355 HydrophobicContact CD-CB 3.92Å; K250-V355 HydrophobicContact CD-CG2 3.98Å; K250-E356 VanDerWaalsContact CD-OE2 3.26Å; K250-E356 WeakPolarHBondContact CD-OE2 3.41Å; K250-E356 WeakPolarHBondContact CE-OE2 3.35Å; K250-E356 IonicContact NZ-OE1 2.69Å; K250-E356 PolarHBondContact NZ-OE1 2.69Å; K250-E356 VanDerWaalsContact NZ-OE1 3.12Å; K250-E356 IonicContact NZ-OE2 3.09Å; K250-E356 PolarHBondContact NZ-OE2 3.34Å |
| 251 | S | 97.6 | Very high | 97.2 | Very high | 0 Ų | 0 | 39.3 Ų | 39.3 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -58.1 | -43.5 | 179.4 | -54.6 | 0 | 0 | 0 | 0 | 112.2 | R186 I247 A248 N253 Q254 G255 | R186-S251 WeakPolarHBondContact CD-OG 3.5Å; R186-S251 VanDerWaalsContact CG-OG 3.27Å; R186-S251 WeakPolarHBondContact CG-OG 3.26Å; I247-S251 WeakPolarHBondContact O-CB 3.48Å; I247-S251 PolarHBondContact O-N 2.9Å; I247-S251 PolarHBondContact O-OG 3.46Å; A248-S251 WeakPolarHBondContact O-CB 3.13Å; A248-S251 PolarHBondContact O-N 2.7Å; A248-S251 VanDerWaalsContact O-N 3.11Å; S251-N253 VanDerWaalsContact C-N 3.34Å; S251-N253 PolarHBondContact O-N 3.24Å; S251-Q254 PolarHBondContact O-N 3.27Å; S251-G255 PolarHBondContact O-N 2.87Å |
| 252 | L | 97.6 | Very high | 97 | Very high | 38 Ų | 38 | 41.7 Ų | 41.7 | 20% | 0.199 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -55.8 | -48.1 | 173.9 | 177.3 | 63.2 | 0 | 0 | 0 | 111.6 | Y187 A248 K250 G255 R256 D264 V267 | Y187-L252 HydrophobicContact CD2-CB 3.67Å; Y187-L252 HydrophobicContact CD2-CD1 4.49Å; Y187-L252 HydrophobicContact CD2-CD2 4.36Å; Y187-L252 HydrophobicContact CD2-CG 4.39Å; Y187-L252 HydrophobicContact CE2-CB 4.08Å; Y187-L252 HydrophobicContact CE2-CD1 4.49Å; Y187-L252 HydrophobicContact CE2-CD2 3.9Å; Y187-L252 HydrophobicContact CE2-CG 4.38Å; Y187-L252 HydrophobicContact CG-CB 4.26Å; A248-L252 PolarHBondContact O-N 2.98Å; K250-L252 VanDerWaalsContact C-N 3.33Å; K250-L252 PolarHBondContact O-N 3.23Å; L252-G255 PolarHBondContact O-N 3.37Å; L252-R256 WeakPolarHBondContact O-CG 3.35Å; L252-R256 PolarHBondContact O-N 3.15Å; L252-D264 HydrophobicContact CD2-CB 4.46Å; L252-V267 HydrophobicContact CD2-CG1 3.94Å; L252-V267 HydrophobicContact CD2-CG2 4.28Å |
| 253 | N | 97.4 | Very high | 96.8 | Very high | 5 Ų | 5 | 41.7 Ų | 41.7 | 3% | 0.027 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -70.7 | -39 | -177 | -78 | -56.5 | 0 | 0 | 0 | 112.6 | F249 K250 S251 G255 R256 Y257 G263 D264 W268 | F249-N253 PolarHBondContact O-N 3.41Å; F249-N253 PolarHBondContact O-ND2 3.31Å; K250-N253 PolarHBondContact O-N 3.06Å; K250-N253 VanDerWaalsContact O-N 3.07Å; S251-N253 VanDerWaalsContact C-N 3.34Å; S251-N253 PolarHBondContact O-N 3.24Å; N253-G255 PolarHBondContact O-N 2.9Å; N253-R256 PolarHBondContact O-N 3.04Å; N253-Y257 HydrophobicContact CB-CE2 4.3Å; N253-Y257 WeakPolarHBondContact O-CD2 3.3Å; N253-Y257 PolarHBondContact O-N 3.46Å; N253-G263 WeakPolarHBondContact OD1-CA 3.32Å; N253-D264 PolarHBondContact OD1-N 2.68Å; N253-W268 PolarHBondContact ND2-NE1 3.39Å; N253-W268 VanDerWaalsContact ND2-NE1 3.18Å |
| 254 | Q | 96.4 | Very high | 96.7 | Very high | 46 Ų | 46 | 43.5 Ų | 43.5 | 22% | 0.215 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -59.6 | -44.3 | 170.7 | -70 | 175.1 | -71.7 | 0 | 0 | 112 | Y183 K250 S251 R256 Y257 L258 | Y183-Q254 HydrophobicContact CD1-CB 3.67Å; Y183-Q254 HydrophobicContact CD2-CB 4.48Å; Y183-Q254 HydrophobicContact CE1-CB 3.5Å; Y183-Q254 VanDerWaalsContact CE1-CD 3.44Å; Y183-Q254 HydrophobicContact CE1-CG 4.1Å; Y183-Q254 VanDerWaalsContact CE1-OE1 3.29Å; Y183-Q254 HydrophobicContact CE2-CB 4.33Å; Y183-Q254 HydrophobicContact CG-CB 4.17Å; Y183-Q254 PolarHBondContact OH-NE2 2.79Å; K250-Q254 VanDerWaalsContact CE-CD 3.46Å; K250-Q254 HydrophobicContact CG-CG 4.32Å; K250-Q254 WeakPolarHBondContact O-CG 3.49Å; K250-Q254 PolarHBondContact O-N 2.79Å; S251-Q254 PolarHBondContact O-N 3.27Å; Q254-R256 VanDerWaalsContact C-N 3.34Å; Q254-R256 PolarHBondContact O-N 3.22Å; Q254-Y257 PolarHBondContact O-N 2.94Å; Q254-L258 PolarHBondContact O-N 2.91Å; Q254-L258 VanDerWaalsContact O-N 3.08Å |
| 255 | G | 96.4 | Very high | 96.6 | Very high | 7 Ų | 7 | 43.9 Ų | 43.9 | 7% | 0.072 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -59.5 | -41.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | S251 L252 N253 L258 E259 | S251-G255 PolarHBondContact O-N 2.87Å; L252-G255 PolarHBondContact O-N 3.37Å; N253-G255 PolarHBondContact O-N 2.9Å; G255-L258 PolarHBondContact O-N 2.85Å; G255-E259 WeakPolarHBondContact O-CG 3.41Å; G255-E259 PolarHBondContact O-N 3.01Å; G255-E259 VanDerWaalsContact O-N 3.09Å |
| 256 | R | 96.7 | Very high | 96.4 | Very high | 71 Ų | 71 | 44.9 Ų | 44.9 | 27% | 0.268 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -65.1 | -40.1 | 175.8 | -72.3 | 175.4 | 68.1 | 90.2 | 2.6 | 112.7 | L252 N253 Q254 E259 R260 K261 P262 | L252-R256 WeakPolarHBondContact O-CG 3.35Å; L252-R256 PolarHBondContact O-N 3.15Å; N253-R256 PolarHBondContact O-N 3.04Å; Q254-R256 VanDerWaalsContact C-N 3.34Å; Q254-R256 PolarHBondContact O-N 3.22Å; R256-E259 CarbonylContact O-C 3.35Å; R256-E259 WeakPolarHBondContact O-CA 3.3Å; R256-E259 WeakPolarHBondContact O-CB 3.44Å; R256-E259 PolarHBondContact O-N 3.29Å; R256-E259 VanDerWaalsContact O-N 3.13Å; R256-R260 PolarHBondContact O-N 2.97Å; R256-R260 VanDerWaalsContact O-N 3.11Å; R256-K261 CarbonylContact C-O 3.48Å; R256-K261 HydrophobicContact CB-CB 4.22Å; R256-K261 PolarHBondContact O-N 2.93Å; R256-P262 PolarHBondContact NE-O 3.02Å; R256-P262 PolarHBondContact NH2-O 3.42Å |
| 257 | Y | 95.2 | Very high | 96.3 | Very high | 88 Ų | 88 | 45.2 Ų | 45.2 | 35% | 0.345 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -65.7 | -38.1 | 176.8 | -67.5 | -45.6 | 0 | 0 | 0 | 112.6 | N253 Q254 E259 R260 A305 S306 | N253-Y257 HydrophobicContact CB-CE2 4.3Å; N253-Y257 WeakPolarHBondContact O-CD2 3.3Å; N253-Y257 PolarHBondContact O-N 3.46Å; Q254-Y257 PolarHBondContact O-N 2.94Å; Y257-E259 VanDerWaalsContact C-N 3.31Å; Y257-E259 PolarHBondContact O-N 3.29Å; Y257-R260 WeakPolarHBondContact O-CA 3.29Å; Y257-R260 PolarHBondContact O-N 3.22Å; Y257-A305 PolarHBondContact OH-O 3.32Å; Y257-S306 WeakPolarHBondContact OH-CA 3.45Å |
| 258 | L | 95 | Very high | 96.3 | Very high | 97 Ų | 97 | 45.2 Ų | 45.2 | 51% | 0.508 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -62.8 | -36.8 | 169.8 | -69.7 | -176.1 | 0 | 0 | 0 | 112.4 | L178 V180 Y183 Q254 G255 R260 | L178-L258 WeakPolarHBondContact O-CD1 3.42Å; V180-L258 HydrophobicContact CG2-CB 3.73Å; V180-L258 HydrophobicContact CG2-CD1 4.31Å; Y183-L258 HydrophobicContact CD2-CD1 3.77Å; Y183-L258 HydrophobicContact CE2-CD1 3.71Å; Q254-L258 PolarHBondContact O-N 2.91Å; Q254-L258 VanDerWaalsContact O-N 3.08Å; G255-L258 PolarHBondContact O-N 2.85Å; L258-R260 PolarHBondContact O-N 3.34Å |
| 259 | E | 94.9 | Very high | 96.1 | Very high | 71 Ų | 71 | 48.7 Ų | 48.7 | 33% | 0.332 | 22% | 0.224 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -74.4 | 4.2 | 170.8 | -65.8 | -175.6 | 136.5 | 0 | 0 | 114 | V180 R184 G255 R256 Y257 K261 | V180-E259 HydrophobicContact CB-CG 4.44Å; V180-E259 HydrophobicContact CG1-CG 3.7Å; V180-E259 HydrophobicContact CG2-CG 3.83Å; R184-E259 IonicContact NH2-OE1 3.01Å; G255-E259 WeakPolarHBondContact O-CG 3.41Å; G255-E259 PolarHBondContact O-N 3.01Å; G255-E259 VanDerWaalsContact O-N 3.09Å; R256-E259 CarbonylContact O-C 3.35Å; R256-E259 WeakPolarHBondContact O-CA 3.3Å; R256-E259 WeakPolarHBondContact O-CB 3.44Å; R256-E259 PolarHBondContact O-N 3.29Å; R256-E259 VanDerWaalsContact O-N 3.13Å; Y257-E259 VanDerWaalsContact C-N 3.31Å; Y257-E259 PolarHBondContact O-N 3.29Å; E259-K261 VanDerWaalsContact C-N 3.25Å; E259-K261 HydrophobicContact CB-CD 3.92Å; E259-K261 HydrophobicContact CB-CG 4.17Å; E259-K261 PolarHBondContact O-N 3.25Å; E259-K261 IonicContact OE1-NZ 3.98Å; E259-K261 PolarHBondContact OE1-NZ 3.47Å; E259-K261 WeakPolarHBondContact OE2-CD 3.43Å; E259-K261 WeakPolarHBondContact OE2-CE 3.46Å; E259-K261 IonicContact OE2-NZ 3.76Å; E259-K261 PolarHBondContact OE2-NZ 2.95Å |
| 260 | R | 94.3 | Very high | 96 | Very high | 237 Ų | 237 | 55.5 Ų | 55.5 | 89% | 0.894 | 25% | 0.249 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 55.3 | 32.8 | -174.4 | -57.3 | -177 | 179.7 | -179.7 | -0.8 | 114.4 | R256 Y257 L258 | R256-R260 PolarHBondContact O-N 2.97Å; R256-R260 VanDerWaalsContact O-N 3.11Å; Y257-R260 WeakPolarHBondContact O-CA 3.29Å; Y257-R260 PolarHBondContact O-N 3.22Å; L258-R260 PolarHBondContact O-N 3.34Å |
| 261 | K | 95.5 | Very high | 96 | Very high | 90 Ų | 90 | 54 Ų | 54 | 39% | 0.391 | 24% | 0.243 | S | C | . | . | P | Polyproline II helix | trans | -102 | 143.3 | 176.6 | -64.1 | 168.3 | -168.4 | 166 | 0 | 110 | R256 E259 | R256-K261 CarbonylContact C-O 3.48Å; R256-K261 HydrophobicContact CB-CB 4.22Å; R256-K261 PolarHBondContact O-N 2.93Å; E259-K261 VanDerWaalsContact C-N 3.25Å; E259-K261 HydrophobicContact CB-CD 3.92Å; E259-K261 HydrophobicContact CB-CG 4.17Å; E259-K261 PolarHBondContact O-N 3.25Å; E259-K261 IonicContact OE1-NZ 3.98Å; E259-K261 PolarHBondContact OE1-NZ 3.47Å; E259-K261 WeakPolarHBondContact OE2-CD 3.43Å; E259-K261 WeakPolarHBondContact OE2-CE 3.46Å; E259-K261 IonicContact OE2-NZ 3.76Å; E259-K261 PolarHBondContact OE2-NZ 2.95Å |
| 262 | P | 94.9 | Very high | 96 | Very high | 50 Ų | 50 | 56 Ų | 56 | 33% | 0.325 | 25% | 0.253 | S | S | . | . | P | Polyproline II helix | trans | -58.8 | 153 | 173.4 | -21.8 | 33 | 0 | 0 | 0 | 111.7 | R256 G309 | R256-P262 PolarHBondContact NE-O 3.02Å; R256-P262 PolarHBondContact NH2-O 3.42Å; P262-G309 VanDerWaalsContact CG-O 3.29Å; P262-G309 WeakPolarHBondContact CG-O 3.43Å |
| 263 | G | 95.4 | Very high | 95.9 | Very high | 0 Ų | 0 | 58 Ų | 58 | 0% | 0 | 27% | 0.268 | C | S | . | . | P | Polyproline II helix | trans | -59.4 | 146.9 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | N253 V265 S306 H310 | N253-G263 WeakPolarHBondContact OD1-CA 3.32Å; G263-V265 PolarHBondContact O-N 3.45Å; G263-S306 WeakPolarHBondContact CA-O 3.28Å; G263-H310 PolarHBondContact O-CE1 3.24Å; G263-H310 VanDerWaalsContact O-CE1 3.28Å; G263-H310 PolarHBondContact O-NE2 2.85Å |
| 264 | D | 95.9 | Very high | 95.9 | Very high | 38 Ų | 38 | 59.6 Ų | 59.6 | 20% | 0.203 | 28% | 0.275 | C | S | . | . | trans | -82.7 | 103.7 | 165.8 | -170.2 | -10.7 | 0 | 0 | 0 | 108.9 | L252 N253 T266 V267 | L252-D264 HydrophobicContact CD2-CB 4.46Å; N253-D264 PolarHBondContact OD1-N 2.68Å; D264-T266 VanDerWaalsContact C-N 3.29Å; D264-T266 WeakPolarHBondContact OD1-CA 3.25Å; D264-T266 VanDerWaalsContact OD1-CB 3.29Å; D264-T266 WeakPolarHBondContact OD1-CB 3.46Å; D264-T266 PolarHBondContact OD1-N 3.34Å; D264-T266 PolarHBondContact OD1-OG1 3.05Å; D264-V267 WeakPolarHBondContact O-CG2 3.43Å | ||
| 265 | V | 95.4 | Very high | 95.9 | Very high | 8 Ų | 8 | 57.6 Ų | 57.6 | 5% | 0.048 | 27% | 0.266 | C | S | . | . | trans | -71.1 | -27.9 | 174.7 | -178.3 | 0 | 0 | 0 | 0 | 111.1 | G263 V267 W268 E269 M303 S306 F307 | G263-V265 PolarHBondContact O-N 3.45Å; V265-V267 VanDerWaalsContact C-N 3.3Å; V265-V267 PolarHBondContact O-N 2.64Å; V265-W268 PolarHBondContact O-N 3.16Å; V265-W268 VanDerWaalsContact O-N 3.13Å; V265-E269 HydrophobicContact CG1-CG 4.2Å; V265-E269 PolarHBondContact O-N 2.94Å; V265-E269 VanDerWaalsContact O-N 3.16Å; V265-M303 HydrophobicContact CG1-CG 3.95Å; V265-S306 WeakPolarHBondContact CG2-O 3.43Å; V265-F307 HydrophobicContact CB-CE1 4.33Å; V265-F307 HydrophobicContact CG1-CD1 4.47Å; V265-F307 HydrophobicContact CG1-CE1 3.75Å; V265-F307 HydrophobicContact CG1-CE2 4.43Å; V265-F307 HydrophobicContact CG1-CZ 3.72Å; V265-F307 HydrophobicContact CG2-CD1 3.69Å; V265-F307 HydrophobicContact CG2-CE1 3.77Å; V265-F307 HydrophobicContact CG2-CG 4.27Å; V265-F307 HydrophobicContact CG2-CZ 4.39Å | ||
| 266 | T | 95.6 | Very high | 95.9 | Very high | 42 Ų | 42 | 60.6 Ų | 60.6 | 26% | 0.258 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -71.7 | -21.3 | -168.5 | 75.1 | 0 | 0 | 0 | 0 | 113.5 | D264 R270 | D264-T266 VanDerWaalsContact C-N 3.29Å; D264-T266 WeakPolarHBondContact OD1-CA 3.25Å; D264-T266 VanDerWaalsContact OD1-CB 3.29Å; D264-T266 WeakPolarHBondContact OD1-CB 3.46Å; D264-T266 PolarHBondContact OD1-N 3.34Å; D264-T266 PolarHBondContact OD1-OG1 3.05Å; T266-R270 WeakPolarHBondContact O-CB 3.44Å; T266-R270 WeakPolarHBondContact O-CD 3.33Å; T266-R270 WeakPolarHBondContact O-CG 3.21Å; T266-R270 PolarHBondContact O-N 3.38Å; T266-R270 VanDerWaalsContact OG1-CZ 3.24Å; T266-R270 PolarHBondContact OG1-NH1 3.04Å; T266-R270 VanDerWaalsContact OG1-NH1 3.15Å; T266-R270 PolarHBondContact OG1-NH2 3.33Å |
| 267 | V | 96.9 | Very high | 95.8 | Very high | 8 Ų | 8 | 60.1 Ų | 60.1 | 5% | 0.048 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -70.2 | -35.9 | 172.4 | -66.3 | 0 | 0 | 0 | 0 | 112.1 | F249 L252 D264 V265 R270 L271 | F249-V267 HydrophobicContact CB-CB 4.35Å; F249-V267 HydrophobicContact CB-CG2 3.81Å; F249-V267 HydrophobicContact CD1-CB 3.91Å; F249-V267 HydrophobicContact CD1-CG1 4.35Å; F249-V267 HydrophobicContact CD1-CG2 4.21Å; F249-V267 HydrophobicContact CD2-CB 3.83Å; F249-V267 HydrophobicContact CD2-CG2 4.14Å; F249-V267 HydrophobicContact CE1-CB 4.15Å; F249-V267 HydrophobicContact CE1-CG1 4.42Å; F249-V267 HydrophobicContact CE2-CB 4.07Å; F249-V267 VanDerWaalsContact CE2-O 3.27Å; F249-V267 WeakPolarHBondContact CE2-O 3.47Å; F249-V267 HydrophobicContact CG-CB 3.76Å; F249-V267 HydrophobicContact CG-CG2 3.79Å; F249-V267 HydrophobicContact CZ-CB 4.24Å; L252-V267 HydrophobicContact CD2-CG1 3.94Å; L252-V267 HydrophobicContact CD2-CG2 4.28Å; D264-V267 WeakPolarHBondContact O-CG2 3.43Å; V265-V267 VanDerWaalsContact C-N 3.3Å; V265-V267 PolarHBondContact O-N 2.64Å; V267-R270 PolarHBondContact O-N 3.18Å; V267-L271 PolarHBondContact O-N 2.9Å |
| 268 | W | 96.9 | Very high | 95.9 | Very high | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -73.4 | -41 | 174.7 | -48.9 | 110.1 | 0 | 0 | 0 | 111.5 | L246 F249 K250 N253 V265 R270 L271 M272 Q302 M303 S306 | L246-W268 HydrophobicContact CD2-CE3 4.26Å; L246-W268 HydrophobicContact CD2-CZ3 3.76Å; F249-W268 VanDerWaalsContact C-CH2 3.47Å; F249-W268 VanDerWaalsContact C-CZ2 3.41Å; F249-W268 HydrophobicContact CB-CD2 4.17Å; F249-W268 HydrophobicContact CB-CE3 3.92Å; F249-W268 HydrophobicContact CB-CH2 3.54Å; F249-W268 HydrophobicContact CB-CZ2 3.75Å; F249-W268 HydrophobicContact CB-CZ3 3.61Å; F249-W268 HydrophobicContact CD2-CE3 4.17Å; F249-W268 HydrophobicContact CD2-CZ3 4.42Å; F249-W268 WeakPolarHBondContact O-CZ2 3.27Å; K250-W268 HydrophobicContact CB-CH2 4.14Å; K250-W268 VanDerWaalsContact N-CH2 3.26Å; N253-W268 PolarHBondContact ND2-NE1 3.39Å; N253-W268 VanDerWaalsContact ND2-NE1 3.18Å; V265-W268 PolarHBondContact O-N 3.16Å; V265-W268 VanDerWaalsContact O-N 3.13Å; W268-R270 VanDerWaalsContact C-N 3.26Å; W268-R270 PolarHBondContact O-N 3.3Å; W268-L271 WeakPolarHBondContact O-CB 3.45Å; W268-L271 PolarHBondContact O-N 3.29Å; W268-M272 PolarHBondContact O-N 3.03Å; W268-Q302 HydrophobicContact CD2-CB 4.05Å; W268-Q302 HydrophobicContact CE3-CB 4.07Å; W268-Q302 HydrophobicContact CH2-CB 3.48Å; W268-Q302 VanDerWaalsContact CH2-CB 3.48Å; W268-Q302 HydrophobicContact CH2-CG 3.77Å; W268-Q302 HydrophobicContact CZ2-CB 3.49Å; W268-Q302 VanDerWaalsContact CZ2-CB 3.49Å; W268-Q302 HydrophobicContact CZ2-CG 4.2Å; W268-Q302 HydrophobicContact CZ3-CB 3.79Å; W268-Q302 HydrophobicContact CZ3-CG 4.12Å; W268-M303 HydrophobicContact CB-CB 4.12Å; W268-M303 HydrophobicContact CB-CE 4.19Å; W268-M303 HydrophobicContact CB-CG 4.19Å; W268-M303 HydrophobicContact CG-CB 4.41Å; W268-S306 PolarHBondContact NE1-OG 3.41Å |
| 269 | E | 95.6 | Very high | 95.9 | Very high | 74 Ų | 74 | 54.8 Ų | 54.8 | 35% | 0.346 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -55.3 | -41.8 | 171.5 | -67 | 175.4 | 155.6 | 0 | 0 | 111.2 | V265 L271 M272 K318 | V265-E269 HydrophobicContact CG1-CG 4.2Å; V265-E269 PolarHBondContact O-N 2.94Å; V265-E269 VanDerWaalsContact O-N 3.16Å; E269-L271 VanDerWaalsContact C-N 3.3Å; E269-L271 PolarHBondContact O-N 3.3Å; E269-M272 PolarHBondContact O-N 3.16Å; E269-K318 IonicContact OE1-NZ 3.12Å; E269-K318 PolarHBondContact OE1-NZ 3.26Å; E269-K318 IonicContact OE2-NZ 3.69Å |
| 270 | R | 96.2 | Very high | 95.9 | Very high | 162 Ų | 162 | 54 Ų | 54 | 61% | 0.611 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -70.4 | -18.5 | 176.2 | -72.9 | 167.7 | -164.7 | 137.5 | 13 | 114.3 | T266 V267 W268 P273 | T266-R270 WeakPolarHBondContact O-CB 3.44Å; T266-R270 WeakPolarHBondContact O-CD 3.33Å; T266-R270 WeakPolarHBondContact O-CG 3.21Å; T266-R270 PolarHBondContact O-N 3.38Å; T266-R270 VanDerWaalsContact OG1-CZ 3.24Å; T266-R270 PolarHBondContact OG1-NH1 3.04Å; T266-R270 VanDerWaalsContact OG1-NH1 3.15Å; T266-R270 PolarHBondContact OG1-NH2 3.33Å; V267-R270 PolarHBondContact O-N 3.18Å; W268-R270 VanDerWaalsContact C-N 3.26Å; W268-R270 PolarHBondContact O-N 3.3Å; R270-P273 WeakPolarHBondContact O-CD 3.33Å |
| 271 | L | 97 | Very high | 95.8 | Very high | 2 Ų | 2 | 44 Ų | 44 | 1% | 0.01 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -83.4 | -23.7 | 177.4 | -164.2 | 57.3 | 0 | 0 | 0 | 112.5 | Y245 L246 F249 V267 W268 E269 P273 H274 F275 | Y245-L271 HydrophobicContact CD2-CD1 3.95Å; Y245-L271 HydrophobicContact CG-CD1 4.12Å; L246-L271 HydrophobicContact CD2-CD2 3.62Å; L246-L271 HydrophobicContact CG-CD2 4.08Å; F249-L271 HydrophobicContact CD2-CD2 4.17Å; F249-L271 HydrophobicContact CE2-CB 4.14Å; F249-L271 HydrophobicContact CE2-CD1 4.29Å; F249-L271 HydrophobicContact CE2-CD2 4.21Å; F249-L271 HydrophobicContact CE2-CG 4.45Å; V267-L271 PolarHBondContact O-N 2.9Å; W268-L271 WeakPolarHBondContact O-CB 3.45Å; W268-L271 PolarHBondContact O-N 3.29Å; E269-L271 VanDerWaalsContact C-N 3.3Å; E269-L271 PolarHBondContact O-N 3.3Å; L271-P273 VanDerWaalsContact C-CD 3.49Å; L271-H274 HydrophobicContact CD1-CB 4.28Å; L271-H274 WeakPolarHBondContact O-CB 3.34Å; L271-H274 PolarHBondContact O-N 3.49Å; L271-F275 HydrophobicContact CB-CE2 4.47Å; L271-F275 HydrophobicContact CD2-CE2 3.84Å; L271-F275 HydrophobicContact CD2-CZ 4.4Å; L271-F275 HydrophobicContact CG-CD2 4.2Å; L271-F275 HydrophobicContact CG-CE2 3.74Å; L271-F275 PolarHBondContact O-N 2.95Å |
| 272 | M | 96.2 | Very high | 95.8 | Very high | 41 Ų | 41 | 39.8 Ų | 39.8 | 20% | 0.202 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -53 | -41.5 | -178.4 | -67.6 | -62.5 | 106.2 | 0 | 0 | 115 | W268 E269 H274 F275 A276 C299 F300 M303 | W268-M272 PolarHBondContact O-N 3.03Å; E269-M272 PolarHBondContact O-N 3.16Å; M272-H274 VanDerWaalsContact C-N 3.28Å; M272-H274 PolarHBondContact O-N 3Å; M272-F275 HydrophobicContact CE-CD2 3.74Å; M272-F275 HydrophobicContact CE-CE2 3.89Å; M272-F275 PolarHBondContact O-N 2.86Å; M272-A276 PolarHBondContact O-N 2.88Å; M272-C299 HydrophobicContact CE-CB 3.86Å; M272-C299 WeakPolarHBondContact CE-SG 3.31Å; M272-F300 HydrophobicContact SD-CE1 3.97Å; M272-F300 HydrophobicContact SD-CE2 4.31Å; M272-F300 HydrophobicContact SD-CZ 3.68Å; M272-M303 HydrophobicContact CE-CE 4.04Å; M272-M303 HydrophobicContact CG-CE 4.27Å; M272-M303 HydrophobicContact SD-CE 4.19Å |
| 273 | P | 96.5 | Very high | 95.8 | Very high | 82 Ų | 82 | 43.8 Ų | 43.8 | 53% | 0.532 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -61.3 | -34.4 | 175.7 | -24.4 | 36 | 0 | 0 | 0 | 113.4 | R270 L271 F275 A276 E277 | R270-P273 WeakPolarHBondContact O-CD 3.33Å; L271-P273 VanDerWaalsContact C-CD 3.49Å; P273-F275 VanDerWaalsContact C-N 3.32Å; P273-F275 PolarHBondContact O-N 3.38Å; P273-A276 PolarHBondContact O-N 3.14Å; P273-E277 WeakPolarHBondContact O-CB 3.27Å; P273-E277 PolarHBondContact O-N 2.85Å |
| 274 | H | 96.8 | Very high | 95.6 | Very high | 37 Ų | 37 | 50.4 Ų | 50.4 | 17% | 0.171 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -70.9 | -27.1 | 178.2 | -68.3 | -50.2 | 0 | 0 | 0 | 112.7 | M241 V242 L271 M272 E277 L278 | M241-H274 HydrophobicContact CE-CB 3.82Å; V242-H274 HydrophobicContact CG2-CB 4.17Å; L271-H274 HydrophobicContact CD1-CB 4.28Å; L271-H274 WeakPolarHBondContact O-CB 3.34Å; L271-H274 PolarHBondContact O-N 3.49Å; M272-H274 VanDerWaalsContact C-N 3.28Å; M272-H274 PolarHBondContact O-N 3Å; H274-E277 IonicContact CE1-OE2 3.71Å; H274-E277 IonicContact CG-OE2 3.89Å; H274-E277 IonicContact ND1-OE2 2.68Å; H274-E277 PolarHBondContact ND1-OE2 3.27Å; H274-L278 WeakPolarHBondContact O-CB 3.12Å; H274-L278 PolarHBondContact O-N 2.84Å |
| 275 | F | 97.4 | Very high | 95.6 | Very high | 5 Ų | 5 | 49.4 Ų | 49.4 | 2% | 0.022 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -68.4 | -39.3 | 170 | -78.6 | -72.1 | 0 | 0 | 0 | 112.9 | V242 L246 L271 M272 P273 R279 L295 R296 C299 | V242-F275 HydrophobicContact CG1-CD1 4.21Å; V242-F275 HydrophobicContact CG1-CE1 3.43Å; V242-F275 VanDerWaalsContact CG1-CE1 3.43Å; V242-F275 HydrophobicContact CG1-CE2 4.11Å; V242-F275 HydrophobicContact CG1-CZ 3.38Å; L246-F275 HydrophobicContact CD1-CZ 4.44Å; L246-F275 HydrophobicContact CD2-CZ 4.28Å; L271-F275 HydrophobicContact CB-CE2 4.47Å; L271-F275 HydrophobicContact CD2-CE2 3.84Å; L271-F275 HydrophobicContact CD2-CZ 4.4Å; L271-F275 HydrophobicContact CG-CD2 4.2Å; L271-F275 HydrophobicContact CG-CE2 3.74Å; L271-F275 PolarHBondContact O-N 2.95Å; M272-F275 HydrophobicContact CE-CD2 3.74Å; M272-F275 HydrophobicContact CE-CE2 3.89Å; M272-F275 PolarHBondContact O-N 2.86Å; P273-F275 VanDerWaalsContact C-N 3.32Å; P273-F275 PolarHBondContact O-N 3.38Å; F275-R279 PolarHBondContact O-N 3.26Å; F275-L295 HydrophobicContact CE1-CB 3.63Å; F275-L295 HydrophobicContact CZ-CB 4.19Å; F275-L295 WeakPolarHBondContact CZ-O 3.47Å; F275-R296 HydrophobicContact CB-CG 4.43Å; F275-R296 HydrophobicContact CD1-CB 3.65Å; F275-R296 HydrophobicContact CD1-CG 4.38Å; F275-R296 VanDerWaalsContact CE1-CA 3.49Å; F275-R296 HydrophobicContact CE1-CB 3.95Å; F275-R296 HydrophobicContact CG-CB 4.05Å; F275-R296 HydrophobicContact CG-CG 4.29Å; F275-C299 HydrophobicContact CE2-CB 3.61Å; F275-C299 HydrophobicContact CZ-CB 3.78Å |
| 276 | A | 95.5 | Very high | 95.6 | Very high | 69 Ų | 69 | 55.3 Ų | 55.3 | 57% | 0.57 | 27% | 0.265 | S | S | * | . | H | α-helix | trans | -67.1 | -42.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | M272 P273 R279 S280 | M272-A276 PolarHBondContact O-N 2.88Å; P273-A276 PolarHBondContact O-N 3.14Å; A276-R279 PolarHBondContact O-N 3.09Å; A276-S280 PolarHBondContact O-N 3.22Å; A276-S280 VanDerWaalsContact O-N 3.12Å |
| 277 | E | 94.5 | Very high | 95.7 | Very high | 62 Ų | 62 | 54 Ų | 54 | 29% | 0.29 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -60.2 | -52.6 | 173.7 | -174 | -179.9 | -143.2 | 0 | 0 | 111.5 | R201 P273 H274 R279 S280 H281 | R201-E277 VanDerWaalsContact CZ-CD 3.48Å; R201-E277 IonicContact CZ-OE1 3.78Å; R201-E277 IonicContact CZ-OE2 2.67Å; R201-E277 IonicContact NH1-OE1 2.64Å; R201-E277 PolarHBondContact NH1-OE1 3.01Å; R201-E277 IonicContact NH1-OE2 3.05Å; R201-E277 PolarHBondContact NH1-OE2 3.36Å; R201-E277 IonicContact NH2-OE1 3.37Å; R201-E277 PolarHBondContact NH2-OE1 3.1Å; R201-E277 IonicContact NH2-OE2 3.37Å; R201-E277 PolarHBondContact NH2-OE2 3.11Å; R201-E277 VanDerWaalsContact NH2-OE2 3.13Å; P273-E277 WeakPolarHBondContact O-CB 3.27Å; P273-E277 PolarHBondContact O-N 2.85Å; H274-E277 IonicContact CE1-OE2 3.71Å; H274-E277 IonicContact CG-OE2 3.89Å; H274-E277 IonicContact ND1-OE2 2.68Å; H274-E277 PolarHBondContact ND1-OE2 3.27Å; E277-R279 PolarHBondContact O-N 3.09Å; E277-S280 WeakPolarHBondContact O-CB 3.29Å; E277-S280 PolarHBondContact O-N 3.19Å; E277-S280 VanDerWaalsContact O-N 3.08Å; E277-S280 PolarHBondContact O-OG 3.42Å; E277-H281 PolarHBondContact O-CD2 3.39Å; E277-H281 VanDerWaalsContact O-CD2 3.26Å; E277-H281 PolarHBondContact O-N 3.4Å |
| 278 | L | 96.7 | Very high | 95.8 | Very high | 0 Ų | 0 | 53.7 Ų | 53.7 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -55 | -47.7 | 175.3 | 168 | 58.3 | 0 | 0 | 0 | 111.9 | L239 V242 H274 S280 H281 A282 T292 | L239-L278 HydrophobicContact CB-CD1 4.04Å; L239-L278 HydrophobicContact CD1-CD1 4.41Å; L239-L278 HydrophobicContact CD1-CD2 3.91Å; V242-L278 HydrophobicContact CB-CD2 4.29Å; V242-L278 HydrophobicContact CG2-CD2 4.05Å; H274-L278 WeakPolarHBondContact O-CB 3.12Å; H274-L278 PolarHBondContact O-N 2.84Å; L278-S280 VanDerWaalsContact C-N 3.26Å; L278-S280 PolarHBondContact O-N 2.93Å; L278-H281 PolarHBondContact O-N 2.89Å; L278-H281 VanDerWaalsContact O-N 3.09Å; L278-A282 HydrophobicContact CD1-CB 4.28Å; L278-A282 VanDerWaalsContact O-CB 3.31Å; L278-A282 WeakPolarHBondContact O-CB 3.47Å; L278-A282 PolarHBondContact O-N 3.47Å; L278-T292 HydrophobicContact CB-CG2 4.35Å; L278-T292 HydrophobicContact CD2-CG2 3.8Å; L278-T292 HydrophobicContact CG-CG2 3.63Å; L278-T292 WeakPolarHBondContact CG-OG1 3.43Å |
| 279 | R | 95.7 | Very high | 95.8 | Very high | 72 Ų | 72 | 54.4 Ų | 54.4 | 27% | 0.272 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -61.3 | -35.8 | 177.8 | -164.7 | -179.9 | -170.7 | 155.4 | 8.5 | 112.1 | F275 A276 E277 H281 A282 R283 E289 T292 D332 C336 | F275-R279 PolarHBondContact O-N 3.26Å; A276-R279 PolarHBondContact O-N 3.09Å; E277-R279 PolarHBondContact O-N 3.09Å; R279-H281 PolarHBondContact O-N 3.26Å; R279-A282 PolarHBondContact O-N 3.42Å; R279-R283 WeakPolarHBondContact O-CB 3.43Å; R279-R283 PolarHBondContact O-N 3.08Å; R279-E289 IonicContact CZ-OE1 2.73Å; R279-E289 IonicContact NE-OE1 2.77Å; R279-E289 PolarHBondContact NE-OE1 2.95Å; R279-E289 IonicContact NH2-OE1 2.78Å; R279-E289 PolarHBondContact NH2-OE1 2.68Å; R279-T292 HydrophobicContact CB-CG2 3.91Å; R279-T292 HydrophobicContact CG-CG2 4.44Å; R279-D332 IonicContact CZ-OD1 3.69Å; R279-D332 VanDerWaalsContact CZ-OD1 3.3Å; R279-D332 IonicContact CZ-OD2 2.91Å; R279-D332 IonicContact NH1-OD1 3.34Å; R279-D332 PolarHBondContact NH1-OD1 2.97Å; R279-D332 IonicContact NH1-OD2 3.15Å; R279-D332 PolarHBondContact NH1-OD2 3.4Å; R279-D332 IonicContact NH2-OD1 2.69Å; R279-D332 PolarHBondContact NH2-OD1 3.43Å; R279-D332 IonicContact NH2-OD2 3.45Å; R279-C336 PolarHBondContact NH2-SG 3.38Å |
| 280 | S | 94.2 | Very high | 95.9 | Very high | 55 Ų | 55 | 51 Ų | 51 | 39% | 0.385 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -62.4 | -30.2 | 177.5 | 85.6 | 0 | 0 | 0 | 0 | 113.3 | A276 E277 L278 R283 | A276-S280 PolarHBondContact O-N 3.22Å; A276-S280 VanDerWaalsContact O-N 3.12Å; E277-S280 WeakPolarHBondContact O-CB 3.29Å; E277-S280 PolarHBondContact O-N 3.19Å; E277-S280 VanDerWaalsContact O-N 3.08Å; E277-S280 PolarHBondContact O-OG 3.42Å; L278-S280 VanDerWaalsContact C-N 3.26Å; L278-S280 PolarHBondContact O-N 2.93Å; S280-R283 PolarHBondContact O-NE 3.45Å |
| 281 | H | 93.5 | Very high | 96 | Very high | 28 Ų | 28 | 43.4 Ų | 43.4 | 13% | 0.13 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -84 | -43.6 | 173.3 | -56.6 | -46.4 | 0 | 0 | 0 | 112 | V234 A235 E277 L278 R279 | V234-H281 HydrophobicContact CG1-CB 4.43Å; A235-H281 HydrophobicContact CB-CB 4.08Å; E277-H281 PolarHBondContact O-CD2 3.39Å; E277-H281 VanDerWaalsContact O-CD2 3.26Å; E277-H281 PolarHBondContact O-N 3.4Å; L278-H281 PolarHBondContact O-N 2.89Å; L278-H281 VanDerWaalsContact O-N 3.09Å; R279-H281 PolarHBondContact O-N 3.26Å |
| 282 | A | 95.4 | Very high | 96 | Very high | 0 Ų | 0 | 43.4 Ų | 43.4 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -77.1 | -22.4 | -172.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | L278 R279 H284 F285 L288 | L278-A282 HydrophobicContact CD1-CB 4.28Å; L278-A282 VanDerWaalsContact O-CB 3.31Å; L278-A282 WeakPolarHBondContact O-CB 3.47Å; L278-A282 PolarHBondContact O-N 3.47Å; R279-A282 PolarHBondContact O-N 3.42Å; A282-H284 PolarHBondContact O-N 3.23Å; A282-F285 CarbonylContact O-C 3.6Å; A282-F285 PolarHBondContact O-N 3.08Å; A282-L288 HydrophobicContact CB-CB 4.01Å |
| 283 | R | 93.7 | Very high | 96.1 | Very high | 135 Ų | 135 | 41.5 Ų | 41.5 | 51% | 0.509 | 21% | 0.206 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -53.8 | -17.3 | -178.6 | 66.4 | 179.8 | 177.2 | 151 | 5.7 | 116.5 | R279 S280 | R279-R283 WeakPolarHBondContact O-CB 3.43Å; R279-R283 PolarHBondContact O-N 3.08Å; S280-R283 PolarHBondContact O-NE 3.45Å |
| 284 | H | 92.3 | Very high | 96.2 | Very high | 139 Ų | 139 | 37.6 Ų | 37.6 | 64% | 0.644 | 18% | 0.181 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -90.3 | -7.3 | 177.5 | -62.3 | -65.7 | 0 | 0 | 0 | 113 | A282 | A282-H284 PolarHBondContact O-N 3.23Š|
| 285 | F | 95.7 | Very high | 96.3 | Very high | 17 Ų | 17 | 35.8 Ų | 35.8 | 8% | 0.075 | 17% | 0.172 | C | C | . | . | S | Bend | trans | -132.4 | 88.5 | -173.4 | -47.6 | -63.1 | 0 | 0 | 0 | 108.9 | L228 K231 K232 A235 A282 P287 L288 E289 W369 | L228-F285 HydrophobicContact CD1-CE1 4.23Å; L228-F285 HydrophobicContact CD1-CZ 4.29Å; K231-F285 HydrophobicContact CB-CZ 4.24Å; K232-F285 HydrophobicContact CB-CZ 4.32Å; K232-F285 HydrophobicContact CG-CE1 3.69Å; K232-F285 HydrophobicContact CG-CE2 4.27Å; K232-F285 HydrophobicContact CG-CZ 3.51Å; A235-F285 HydrophobicContact CB-CD2 4.05Å; A235-F285 HydrophobicContact CB-CE2 4.12Å; A282-F285 CarbonylContact O-C 3.6Å; A282-F285 PolarHBondContact O-N 3.08Å; F285-P287 VanDerWaalsContact C-CD 3.47Å; F285-P287 VanDerWaalsContact O-N 3.11Å; F285-L288 HydrophobicContact CB-CB 4.23Å; F285-L288 HydrophobicContact CB-CD1 4.06Å; F285-L288 HydrophobicContact CB-CG 4.1Å; F285-L288 HydrophobicContact CD2-CD1 4.2Å; F285-L288 HydrophobicContact CG-CD1 4.42Å; F285-L288 WeakPolarHBondContact O-CA 3.35Å; F285-L288 PolarHBondContact O-N 3.05Å; F285-E289 PolarHBondContact O-N 3.09Å; F285-W369 HydrophobicContact CB-CZ2 3.84Å; F285-W369 AromaticContact CD1-CZ2 3.82Å; F285-W369 HydrophobicContact CD1-CZ2 3.82Å; F285-W369 HydrophobicContact CD2-CZ2 4.23Å; F285-W369 HydrophobicContact CE1-CZ2 4.44Å; F285-W369 HydrophobicContact CG-CH2 4.43Å; F285-W369 AromaticContact CG-CZ2 3.7Å; F285-W369 HydrophobicContact CG-CZ2 3.7Å |
| 286 | R | 96.4 | Very high | 96.3 | Very high | 131 Ų | 131 | 38.8 Ų | 38.8 | 49% | 0.494 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -48.5 | -42.3 | -168.7 | -68.6 | -58.8 | -164.1 | -171.3 | 6.6 | 115.6 | L288 E289 A290 V340 | R286-L288 VanDerWaalsContact C-N 3.34Å; R286-L288 PolarHBondContact O-N 2.93Å; R286-E289 IonicContact CZ-OE2 3.23Å; R286-E289 IonicContact NH1-OE2 2.68Å; R286-E289 PolarHBondContact NH1-OE2 3.03Å; R286-E289 PolarHBondContact O-N 3.4Å; R286-A290 WeakPolarHBondContact O-CB 3.42Å; R286-A290 PolarHBondContact O-N 3.46Å; R286-V340 HydrophobicContact CB-CG2 4.44Å |
| 287 | P | 97.4 | Very high | 96.4 | Very high | 16 Ų | 16 | 35.5 Ų | 35.5 | 10% | 0.104 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -59.7 | -40.9 | 174.9 | -24.9 | 35.4 | 0 | 0 | 0 | 113.4 | F285 A290 M291 V340 L345 | F285-P287 VanDerWaalsContact C-CD 3.47Å; F285-P287 VanDerWaalsContact O-N 3.11Å; P287-A290 PolarHBondContact O-N 3.37Å; P287-M291 HydrophobicContact CB-CE 4.38Å; P287-M291 VanDerWaalsContact O-CG 3.3Å; P287-M291 WeakPolarHBondContact O-CG 3.38Å; P287-M291 PolarHBondContact O-N 3.06Å; P287-V340 HydrophobicContact CG-CG1 4.12Å; P287-L345 HydrophobicContact CB-CB 4.03Å; P287-L345 HydrophobicContact CG-CB 3.87Å; P287-L345 HydrophobicContact CG-CD1 4.05Å |
| 288 | L | 97.7 | Very high | 96.5 | Very high | 1 Ų | 1 | 32.7 Ų | 32.7 | 1% | 0.005 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -72.7 | -34 | 178.4 | -54.4 | -173.1 | 0 | 0 | 0 | 111.8 | A235 V236 L239 A282 F285 R286 M291 T292 W369 | A235-L288 HydrophobicContact CB-CD1 3.92Å; V236-L288 HydrophobicContact CG2-CD1 3.9Å; L239-L288 HydrophobicContact CD2-CD2 3.96Å; A282-L288 HydrophobicContact CB-CB 4.01Å; F285-L288 HydrophobicContact CB-CB 4.23Å; F285-L288 HydrophobicContact CB-CD1 4.06Å; F285-L288 HydrophobicContact CB-CG 4.1Å; F285-L288 HydrophobicContact CD2-CD1 4.2Å; F285-L288 HydrophobicContact CG-CD1 4.42Å; F285-L288 WeakPolarHBondContact O-CA 3.35Å; F285-L288 PolarHBondContact O-N 3.05Å; R286-L288 VanDerWaalsContact C-N 3.34Å; R286-L288 PolarHBondContact O-N 2.93Å; L288-M291 HydrophobicContact CD2-SD 4.49Å; L288-M291 PolarHBondContact O-N 3.07Å; L288-T292 WeakPolarHBondContact O-CB 3.43Å; L288-T292 PolarHBondContact O-N 3.36Å; L288-T292 PolarHBondContact O-OG1 2.85Å; L288-W369 HydrophobicContact CD1-CD2 4.1Å; L288-W369 HydrophobicContact CD1-CE3 4.1Å; L288-W369 HydrophobicContact CD1-CH2 3.63Å; L288-W369 HydrophobicContact CD1-CZ2 3.62Å; L288-W369 HydrophobicContact CD1-CZ3 3.89Å; L288-W369 HydrophobicContact CD2-CD2 3.98Å; L288-W369 HydrophobicContact CD2-CE3 4.25Å; L288-W369 HydrophobicContact CD2-CG 4.19Å; L288-W369 HydrophobicContact CG-CD2 4.1Å; L288-W369 HydrophobicContact CG-CE3 4.5Å; L288-W369 HydrophobicContact CG-CZ2 4.18Å |
| 289 | E | 97.6 | Very high | 96.6 | Very high | 14 Ų | 14 | 32.7 Ų | 32.7 | 7% | 0.065 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -64.3 | -46.2 | 172 | -178.7 | 168.4 | -145.7 | 0 | 0 | 111.1 | R279 F285 R286 M291 T292 V293 | R279-E289 IonicContact CZ-OE1 2.73Å; R279-E289 IonicContact NE-OE1 2.77Å; R279-E289 PolarHBondContact NE-OE1 2.95Å; R279-E289 IonicContact NH2-OE1 2.78Å; R279-E289 PolarHBondContact NH2-OE1 2.68Å; F285-E289 PolarHBondContact O-N 3.09Å; R286-E289 IonicContact CZ-OE2 3.23Å; R286-E289 IonicContact NH1-OE2 2.68Å; R286-E289 PolarHBondContact NH1-OE2 3.03Å; R286-E289 PolarHBondContact O-N 3.4Å; E289-M291 VanDerWaalsContact C-N 3.33Å; E289-M291 PolarHBondContact O-N 3.39Å; E289-T292 WeakPolarHBondContact O-CB 3.06Å; E289-T292 PolarHBondContact O-N 3.27Å; E289-T292 VanDerWaalsContact O-N 3.08Å; E289-V293 PolarHBondContact O-N 3.01Å |
| 290 | A | 97.8 | Very high | 96.6 | Very high | 4 Ų | 4 | 29.3 Ų | 29.3 | 3% | 0.033 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -60.7 | -39.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | R286 P287 V293 Q294 C336 V337 V340 | R286-A290 WeakPolarHBondContact O-CB 3.42Å; R286-A290 PolarHBondContact O-N 3.46Å; P287-A290 PolarHBondContact O-N 3.37Å; A290-V293 WeakPolarHBondContact O-CG2 3.16Å; A290-Q294 WeakPolarHBondContact O-CB 3.4Å; A290-Q294 VanDerWaalsContact O-CG 3.25Å; A290-Q294 WeakPolarHBondContact O-CG 3.34Å; A290-Q294 PolarHBondContact O-N 3.13Å; A290-Q294 PolarHBondContact O-NE2 3.47Å; A290-C336 HydrophobicContact CB-CB 4.39Å; A290-V337 HydrophobicContact CB-CG2 4.28Å; A290-V340 HydrophobicContact CB-CG2 3.61Å |
| 291 | M | 98 | Very high | 96.7 | Very high | 1 Ų | 1 | 28.1 Ų | 28.1 | 1% | 0.005 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -65.8 | -41.1 | 171.4 | -70.4 | 177.3 | -149 | 0 | 0 | 112 | L239 P287 L288 E289 V293 Q294 L295 I347 M362 T365 V366 | L239-M291 HydrophobicContact CD1-CB 4.16Å; L239-M291 HydrophobicContact CD2-CB 4.26Å; L239-M291 HydrophobicContact CD2-SD 3.98Å; P287-M291 HydrophobicContact CB-CE 4.38Å; P287-M291 VanDerWaalsContact O-CG 3.3Å; P287-M291 WeakPolarHBondContact O-CG 3.38Å; P287-M291 PolarHBondContact O-N 3.06Å; L288-M291 HydrophobicContact CD2-SD 4.49Å; L288-M291 PolarHBondContact O-N 3.07Å; E289-M291 VanDerWaalsContact C-N 3.33Å; E289-M291 PolarHBondContact O-N 3.39Å; M291-V293 PolarHBondContact O-N 3.28Å; M291-Q294 PolarHBondContact O-N 3.1Å; M291-L295 WeakPolarHBondContact O-CG 3.48Å; M291-L295 PolarHBondContact O-N 3.27Å; M291-I347 HydrophobicContact CE-CD1 3.93Å; M291-I347 HydrophobicContact CE-CG1 4.27Å; M291-I347 HydrophobicContact CG-CD1 4.02Å; M291-I347 HydrophobicContact CG-CG1 4.34Å; M291-I347 HydrophobicContact SD-CD1 4.22Å; M291-M362 HydrophobicContact CB-CE 4.18Å; M291-M362 HydrophobicContact CB-SD 3.79Å; M291-M362 HydrophobicContact CG-CE 4.33Å; M291-M362 HydrophobicContact CG-CG 4.44Å; M291-M362 HydrophobicContact CG-SD 3.92Å; M291-M362 HydrophobicContact SD-SD 4.48Å; M291-T365 HydrophobicContact CE-CG2 3.48Å; M291-T365 VanDerWaalsContact CE-CG2 3.48Å; M291-V366 HydrophobicContact SD-CG2 3.68Å |
| 292 | T | 98 | Very high | 96.9 | Very high | 2 Ų | 2 | 28.5 Ų | 28.5 | 1% | 0.012 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -59.3 | -48.5 | -179.6 | -64.4 | 0 | 0 | 0 | 0 | 112.3 | L278 R279 L288 E289 Q294 R296 | L278-T292 HydrophobicContact CB-CG2 4.35Å; L278-T292 HydrophobicContact CD2-CG2 3.8Å; L278-T292 HydrophobicContact CG-CG2 3.63Å; L278-T292 WeakPolarHBondContact CG-OG1 3.43Å; R279-T292 HydrophobicContact CB-CG2 3.91Å; R279-T292 HydrophobicContact CG-CG2 4.44Å; L288-T292 WeakPolarHBondContact O-CB 3.43Å; L288-T292 PolarHBondContact O-N 3.36Å; L288-T292 PolarHBondContact O-OG1 2.85Å; E289-T292 WeakPolarHBondContact O-CB 3.06Å; E289-T292 PolarHBondContact O-N 3.27Å; E289-T292 VanDerWaalsContact O-N 3.08Å; T292-Q294 VanDerWaalsContact C-N 3.34Å; T292-R296 WeakPolarHBondContact O-CB 3.37Å; T292-R296 PolarHBondContact O-N 3.34Å |
| 293 | V | 97.7 | Very high | 96.9 | Very high | 1 Ų | 1 | 29 Ų | 29 | 1% | 0.006 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -70.1 | -32.8 | 179.8 | -63.3 | 0 | 0 | 0 | 0 | 112 | E289 A290 M291 R296 A297 D332 V333 C336 | E289-V293 PolarHBondContact O-N 3.01Å; A290-V293 WeakPolarHBondContact O-CG2 3.16Å; M291-V293 PolarHBondContact O-N 3.28Å; V293-R296 WeakPolarHBondContact O-CB 3.39Å; V293-R296 PolarHBondContact O-N 3.07Å; V293-A297 PolarHBondContact O-N 3.24Å; V293-D332 WeakPolarHBondContact CG1-OD2 3.29Å; V293-V333 HydrophobicContact CB-CG2 4.21Å; V293-V333 HydrophobicContact CG2-CB 4.48Å; V293-V333 HydrophobicContact CG2-CG2 3.99Å; V293-V333 WeakPolarHBondContact O-CG2 3.49Å; V293-C336 HydrophobicContact CG2-CB 3.6Å |
| 294 | Q | 98 | Very high | 96.9 | Very high | 0 Ų | 0 | 24.7 Ų | 24.7 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -65.6 | -47.6 | 174.5 | -77.8 | 178.8 | 97.8 | 0 | 0 | 112 | A290 M291 T292 R296 A297 I298 V333 V337 I347 V349 M362 | A290-Q294 WeakPolarHBondContact O-CB 3.4Å; A290-Q294 VanDerWaalsContact O-CG 3.25Å; A290-Q294 WeakPolarHBondContact O-CG 3.34Å; A290-Q294 PolarHBondContact O-N 3.13Å; A290-Q294 PolarHBondContact O-NE2 3.47Å; M291-Q294 PolarHBondContact O-N 3.1Å; T292-Q294 VanDerWaalsContact C-N 3.34Å; Q294-R296 PolarHBondContact O-N 2.84Å; Q294-A297 PolarHBondContact O-N 3.44Å; Q294-I298 WeakPolarHBondContact O-CG1 3.38Å; Q294-I298 PolarHBondContact O-N 2.88Å; Q294-V333 HydrophobicContact CB-CG2 4.32Å; Q294-V333 HydrophobicContact CG-CB 4.29Å; Q294-V333 HydrophobicContact CG-CG1 3.58Å; Q294-V333 HydrophobicContact CG-CG2 3.75Å; Q294-V337 HydrophobicContact CG-CG2 4.23Å; Q294-I347 PolarHBondContact NE2-O 3.19Å; Q294-I347 PolarHBondContact OE1-O 2.99Å; Q294-V349 HydrophobicContact CB-CG2 3.67Å; Q294-V349 HydrophobicContact CG-CG2 4.1Å; Q294-M362 HydrophobicContact CB-CE 3.73Å |
| 295 | L | 98.2 | Very high | 97 | Very high | 0 Ų | 0 | 20.3 Ų | 20.3 | 0% | 0 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -61.4 | -33.9 | 173.7 | -69 | -178.7 | 0 | 0 | 0 | 112.2 | L239 V242 M243 L246 F275 M291 C299 T358 M362 | L239-L295 HydrophobicContact CD1-CD1 3.57Å; L239-L295 HydrophobicContact CG-CD1 4.48Å; V242-L295 HydrophobicContact CG1-CD1 4.35Å; M243-L295 HydrophobicContact CG-CD1 3.49Å; M243-L295 VanDerWaalsContact CG-CD1 3.49Å; M243-L295 HydrophobicContact CG-CD2 4.23Å; M243-L295 HydrophobicContact SD-CD1 4.34Å; L246-L295 HydrophobicContact CD1-CB 4.15Å; L246-L295 HydrophobicContact CD1-CD2 3.8Å; L246-L295 HydrophobicContact CD1-CG 4.39Å; F275-L295 HydrophobicContact CE1-CB 3.63Å; F275-L295 HydrophobicContact CZ-CB 4.19Å; F275-L295 WeakPolarHBondContact CZ-O 3.47Å; M291-L295 WeakPolarHBondContact O-CG 3.48Å; M291-L295 PolarHBondContact O-N 3.27Å; L295-C299 WeakPolarHBondContact O-CB 3.4Å; L295-C299 PolarHBondContact O-N 2.99Å; L295-T358 HydrophobicContact CD2-CG2 3.61Å; L295-M362 HydrophobicContact CD1-SD 3.94Å; L295-M362 HydrophobicContact CD2-CE 3.79Å; L295-M362 HydrophobicContact CD2-SD 3.56Å; L295-M362 VanDerWaalsContact CD2-SD 3.56Å; L295-M362 HydrophobicContact CG-CE 3.82Å; L295-M362 HydrophobicContact CG-SD 3.56Å; L295-M362 VanDerWaalsContact CG-SD 3.56Å |
| 296 | R | 97.7 | Very high | 96.9 | Very high | 68 Ų | 68 | 19.7 Ų | 19.7 | 26% | 0.257 | 10% | 0.095 | S | C | . | . | H | α-helix | trans | -65.2 | -44.1 | 174.3 | 179.6 | -176 | 168.6 | -123.9 | -8.9 | 111.4 | F275 T292 V293 Q294 C299 F300 D332 | F275-R296 HydrophobicContact CB-CG 4.43Å; F275-R296 HydrophobicContact CD1-CB 3.65Å; F275-R296 HydrophobicContact CD1-CG 4.38Å; F275-R296 VanDerWaalsContact CE1-CA 3.49Å; F275-R296 HydrophobicContact CE1-CB 3.95Å; F275-R296 HydrophobicContact CG-CB 4.05Å; F275-R296 HydrophobicContact CG-CG 4.29Å; T292-R296 WeakPolarHBondContact O-CB 3.37Å; T292-R296 PolarHBondContact O-N 3.34Å; V293-R296 WeakPolarHBondContact O-CB 3.39Å; V293-R296 PolarHBondContact O-N 3.07Å; Q294-R296 PolarHBondContact O-N 2.84Å; R296-C299 WeakPolarHBondContact O-CB 3.43Å; R296-C299 PolarHBondContact O-N 2.62Å; R296-F300 HydrophobicContact CG-CD2 4.39Å; R296-F300 HydrophobicContact CG-CE2 3.95Å; R296-F300 VanDerWaalsContact O-CD2 3.29Å; R296-F300 WeakPolarHBondContact O-CD2 3.44Å; R296-F300 PolarHBondContact O-N 2.81Å; R296-F300 VanDerWaalsContact O-N 3.16Å; R296-D332 IonicContact NH1-OD2 3.67Å; R296-D332 PolarHBondContact NH1-OD2 3.27Å |
| 297 | A | 97.9 | Very high | 96.8 | Very high | 0 Ų | 0 | 14 Ų | 14 | 0% | 0 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -64.4 | -45.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | V293 Q294 C299 F300 E301 A329 W330 V333 | V293-A297 PolarHBondContact O-N 3.24Å; Q294-A297 PolarHBondContact O-N 3.44Å; A297-C299 VanDerWaalsContact C-N 3.27Å; A297-C299 PolarHBondContact O-N 3.11Å; A297-F300 WeakPolarHBondContact O-CA 3.41Å; A297-F300 WeakPolarHBondContact O-CB 3.38Å; A297-F300 PolarHBondContact O-N 3.38Å; A297-E301 PolarHBondContact O-N 3.14Å; A297-E301 VanDerWaalsContact O-N 3.12Å; A297-A329 HydrophobicContact CB-CB 4.01Å; A297-W330 HydrophobicContact CB-CD2 3.72Å; A297-W330 HydrophobicContact CB-CE3 3.95Å; A297-W330 HydrophobicContact CB-CG 4.28Å; A297-W330 HydrophobicContact CB-CH2 3.93Å; A297-W330 HydrophobicContact CB-CZ2 3.71Å; A297-W330 HydrophobicContact CB-CZ3 4.06Å; A297-V333 HydrophobicContact CB-CG2 3.88Å |
| 298 | I | 97.6 | Very high | 96.5 | Very high | 2 Ų | 2 | 17.9 Ų | 17.9 | 1% | 0.01 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -58.5 | -37.3 | 172.2 | -65.4 | -67 | 0 | 0 | 0 | 111.6 | Q294 F300 E301 Q302 W330 V349 G350 V355 T358 | Q294-I298 WeakPolarHBondContact O-CG1 3.38Å; Q294-I298 PolarHBondContact O-N 2.88Å; I298-F300 VanDerWaalsContact C-N 3.3Å; I298-F300 PolarHBondContact O-N 2.86Å; I298-E301 WeakPolarHBondContact O-CB 3.33Å; I298-E301 PolarHBondContact O-N 2.96Å; I298-E301 VanDerWaalsContact O-N 3.13Å; I298-Q302 WeakPolarHBondContact O-CG 3.49Å; I298-Q302 PolarHBondContact O-N 3.23Å; I298-W330 HydrophobicContact CD1-CH2 3.94Å; I298-W330 HydrophobicContact CD1-CZ2 4.11Å; I298-W330 HydrophobicContact CG1-CH2 4.29Å; I298-V349 HydrophobicContact CG1-CG2 4.48Å; I298-G350 WeakPolarHBondContact CD1-O 3.29Å; I298-V355 HydrophobicContact CG2-CG2 4.22Å; I298-T358 HydrophobicContact CG1-CG2 4.37Å |
| 299 | C | 97.5 | Very high | 96.2 | Very high | 0 Ų | 0 | 20.6 Ų | 20.6 | 0% | 0 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -64.3 | -33.2 | 174.8 | -165.6 | 0 | 0 | 0 | 0 | 112.8 | L246 M272 F275 L295 R296 A297 Q302 M303 | L246-C299 HydrophobicContact CD2-CB 3.88Å; M272-C299 HydrophobicContact CE-CB 3.86Å; M272-C299 WeakPolarHBondContact CE-SG 3.31Å; F275-C299 HydrophobicContact CE2-CB 3.61Å; F275-C299 HydrophobicContact CZ-CB 3.78Å; L295-C299 WeakPolarHBondContact O-CB 3.4Å; L295-C299 PolarHBondContact O-N 2.99Å; R296-C299 WeakPolarHBondContact O-CB 3.43Å; R296-C299 PolarHBondContact O-N 2.62Å; A297-C299 VanDerWaalsContact C-N 3.27Å; A297-C299 PolarHBondContact O-N 3.11Å; C299-Q302 PolarHBondContact O-N 3.13Å; C299-M303 WeakPolarHBondContact O-CB 3.38Å; C299-M303 PolarHBondContact O-N 3.29Å |
| 300 | F | 96.9 | Very high | 96 | Very high | 2 Ų | 2 | 23 Ų | 23 | 1% | 0.009 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -69.1 | -35.5 | 170.9 | -74.4 | -63.9 | 0 | 0 | 0 | 112.2 | M272 R296 A297 I298 Q302 M303 M304 Q325 R326 A329 | M272-F300 HydrophobicContact SD-CE1 3.97Å; M272-F300 HydrophobicContact SD-CE2 4.31Å; M272-F300 HydrophobicContact SD-CZ 3.68Å; R296-F300 HydrophobicContact CG-CD2 4.39Å; R296-F300 HydrophobicContact CG-CE2 3.95Å; R296-F300 VanDerWaalsContact O-CD2 3.29Å; R296-F300 WeakPolarHBondContact O-CD2 3.44Å; R296-F300 PolarHBondContact O-N 2.81Å; R296-F300 VanDerWaalsContact O-N 3.16Å; A297-F300 WeakPolarHBondContact O-CA 3.41Å; A297-F300 WeakPolarHBondContact O-CB 3.38Å; A297-F300 PolarHBondContact O-N 3.38Å; I298-F300 VanDerWaalsContact C-N 3.3Å; I298-F300 PolarHBondContact O-N 2.86Å; F300-Q302 PolarHBondContact O-N 2.94Å; F300-M303 HydrophobicContact CD1-CE 3.74Å; F300-M303 HydrophobicContact CD1-SD 4.19Å; F300-M303 HydrophobicContact CE1-CE 3.78Å; F300-M303 HydrophobicContact CE1-SD 4.4Å; F300-M303 PolarHBondContact O-N 2.98Å; F300-M304 WeakPolarHBondContact O-CB 3.27Å; F300-M304 VanDerWaalsContact O-CG 3.27Å; F300-M304 WeakPolarHBondContact O-CG 3.45Å; F300-M304 PolarHBondContact O-N 2.87Å; F300-Q325 HydrophobicContact CD1-CB 4.23Å; F300-Q325 HydrophobicContact CE1-CB 3.64Å; F300-Q325 VanDerWaalsContact CE1-OE1 3.31Å; F300-Q325 HydrophobicContact CE2-CB 4.2Å; F300-Q325 HydrophobicContact CZ-CB 3.62Å; F300-Q325 HydrophobicContact CZ-CG 4.49Å; F300-R326 HydrophobicContact CB-CB 3.94Å; F300-R326 HydrophobicContact CB-CG 4.27Å; F300-R326 HydrophobicContact CG-CB 4.48Å; F300-A329 HydrophobicContact CD2-CB 3.81Å; F300-A329 HydrophobicContact CE2-CB 4.05Å |
| 301 | E | 96.4 | Very high | 95.8 | Very high | 29 Ų | 29 | 27.3 Ų | 27.3 | 14% | 0.136 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -59.5 | -46.3 | 171.5 | -55.6 | -58.8 | 168.6 | 0 | 0 | 111.8 | A297 I298 M303 M304 A305 R326 W330 P351 | A297-E301 PolarHBondContact O-N 3.14Å; A297-E301 VanDerWaalsContact O-N 3.12Å; I298-E301 WeakPolarHBondContact O-CB 3.33Å; I298-E301 PolarHBondContact O-N 2.96Å; I298-E301 VanDerWaalsContact O-N 3.13Å; E301-M303 VanDerWaalsContact C-N 3.32Å; E301-M303 PolarHBondContact O-N 3.45Å; E301-M304 PolarHBondContact O-N 2.86Å; E301-A305 WeakPolarHBondContact O-CB 3.49Å; E301-A305 PolarHBondContact O-N 3.49Å; E301-R326 IonicContact OE1-CZ 3.3Å; E301-R326 IonicContact OE1-NE 3.39Å; E301-R326 PolarHBondContact OE1-NE 3.07Å; E301-R326 IonicContact OE1-NH2 3.85Å; E301-R326 PolarHBondContact OE1-NH2 3.39Å; E301-R326 IonicContact OE2-CZ 2.62Å; E301-R326 IonicContact OE2-NE 3.64Å; E301-R326 PolarHBondContact OE2-NE 2.98Å; E301-R326 IonicContact OE2-NH2 2.74Å; E301-R326 PolarHBondContact OE2-NH2 2.99Å; E301-W330 HydrophobicContact CG-CZ2 4.24Å; E301-W330 PolarHBondContact OE1-NE1 2.68Å; E301-P351 HydrophobicContact CG-CB 3.96Å |
| 302 | Q | 96.2 | Very high | 95.5 | Very high | 37 Ų | 37 | 30.7 Ų | 30.7 | 17% | 0.173 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -67.7 | -33 | 178.5 | -58.2 | -53.8 | -74.9 | 0 | 0 | 112.4 | W268 I298 C299 F300 S306 V355 | W268-Q302 HydrophobicContact CD2-CB 4.05Å; W268-Q302 HydrophobicContact CE3-CB 4.07Å; W268-Q302 HydrophobicContact CH2-CB 3.48Å; W268-Q302 VanDerWaalsContact CH2-CB 3.48Å; W268-Q302 HydrophobicContact CH2-CG 3.77Å; W268-Q302 HydrophobicContact CZ2-CB 3.49Å; W268-Q302 VanDerWaalsContact CZ2-CB 3.49Å; W268-Q302 HydrophobicContact CZ2-CG 4.2Å; W268-Q302 HydrophobicContact CZ3-CB 3.79Å; W268-Q302 HydrophobicContact CZ3-CG 4.12Å; I298-Q302 WeakPolarHBondContact O-CG 3.49Å; I298-Q302 PolarHBondContact O-N 3.23Å; C299-Q302 PolarHBondContact O-N 3.13Å; F300-Q302 PolarHBondContact O-N 2.94Å; Q302-S306 WeakPolarHBondContact O-CB 3.4Å; Q302-S306 PolarHBondContact O-N 3.49Å; Q302-S306 PolarHBondContact O-OG 3.01Å; Q302-V355 HydrophobicContact CG-CG2 3.62Å |
| 303 | M | 95.4 | Very high | 95.3 | Very high | 11 Ų | 11 | 39.1 Ų | 39.1 | 5% | 0.054 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -65.7 | -45.8 | 172.7 | -167.1 | -170.6 | -53.4 | 0 | 0 | 111.4 | V265 W268 M272 C299 F300 E301 S306 F307 A322 | V265-M303 HydrophobicContact CG1-CG 3.95Å; W268-M303 HydrophobicContact CB-CB 4.12Å; W268-M303 HydrophobicContact CB-CE 4.19Å; W268-M303 HydrophobicContact CB-CG 4.19Å; W268-M303 HydrophobicContact CG-CB 4.41Å; M272-M303 HydrophobicContact CE-CE 4.04Å; M272-M303 HydrophobicContact CG-CE 4.27Å; M272-M303 HydrophobicContact SD-CE 4.19Å; C299-M303 WeakPolarHBondContact O-CB 3.38Å; C299-M303 PolarHBondContact O-N 3.29Å; F300-M303 HydrophobicContact CD1-CE 3.74Å; F300-M303 HydrophobicContact CD1-SD 4.19Å; F300-M303 HydrophobicContact CE1-CE 3.78Å; F300-M303 HydrophobicContact CE1-SD 4.4Å; F300-M303 PolarHBondContact O-N 2.98Å; E301-M303 VanDerWaalsContact C-N 3.32Å; E301-M303 PolarHBondContact O-N 3.45Å; M303-S306 WeakPolarHBondContact O-CB 3.34Å; M303-S306 PolarHBondContact O-N 3.13Å; M303-S306 VanDerWaalsContact O-N 3.09Å; M303-F307 HydrophobicContact CG-CE2 4.25Å; M303-F307 VanDerWaalsContact O-CD2 3.29Å; M303-F307 WeakPolarHBondContact O-CD2 3.25Å; M303-F307 PolarHBondContact O-N 3.32Å; M303-A322 HydrophobicContact SD-CB 4.21Å |
| 304 | M | 94.1 | Very high | 95 | Very high | 43 Ų | 43 | 42.7 Ų | 42.7 | 21% | 0.212 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -59.8 | -47.5 | 175.1 | -72.1 | -62.2 | -69 | 0 | 0 | 111.4 | F300 E301 S306 F307 L319 A322 T323 | F300-M304 WeakPolarHBondContact O-CB 3.27Å; F300-M304 VanDerWaalsContact O-CG 3.27Å; F300-M304 WeakPolarHBondContact O-CG 3.45Å; F300-M304 PolarHBondContact O-N 2.87Å; E301-M304 PolarHBondContact O-N 2.86Å; M304-S306 PolarHBondContact O-N 3.12Å; M304-F307 PolarHBondContact O-N 2.91Å; M304-F307 HydrophobicContact SD-CD2 4.5Å; M304-L319 HydrophobicContact CE-CD1 3.48Å; M304-L319 VanDerWaalsContact CE-CD1 3.48Å; M304-L319 HydrophobicContact CE-CG 4.09Å; M304-L319 HydrophobicContact SD-CD1 3.79Å; M304-A322 HydrophobicContact SD-CB 3.7Å; M304-T323 WeakPolarHBondContact CE-OG1 3.36Å |
| 305 | A | 93.7 | Very high | 94.8 | Very high | 48 Ų | 48 | 43.4 Ų | 43.4 | 40% | 0.397 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -61.7 | -27.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113 | Y257 E301 F307 V308 | Y257-A305 PolarHBondContact OH-O 3.32Å; E301-A305 WeakPolarHBondContact O-CB 3.49Å; E301-A305 PolarHBondContact O-N 3.49Å; A305-F307 VanDerWaalsContact C-N 3.32Å; A305-F307 PolarHBondContact O-N 3.04Å; A305-V308 WeakPolarHBondContact O-CB 3.48Å; A305-V308 WeakPolarHBondContact O-CG2 3.49Å; A305-V308 PolarHBondContact O-N 2.91Å |
| 306 | S | 94.9 | Very high | 94.6 | Very high | 3 Ų | 3 | 45.8 Ų | 45.8 | 2% | 0.021 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -78.3 | -11.3 | -179.9 | -61.8 | 0 | 0 | 0 | 0 | 114.5 | Y257 G263 V265 W268 Q302 M303 M304 V308 H310 | Y257-S306 WeakPolarHBondContact OH-CA 3.45Å; G263-S306 WeakPolarHBondContact CA-O 3.28Å; V265-S306 WeakPolarHBondContact CG2-O 3.43Å; W268-S306 PolarHBondContact NE1-OG 3.41Å; Q302-S306 WeakPolarHBondContact O-CB 3.4Å; Q302-S306 PolarHBondContact O-N 3.49Å; Q302-S306 PolarHBondContact O-OG 3.01Å; M303-S306 WeakPolarHBondContact O-CB 3.34Å; M303-S306 PolarHBondContact O-N 3.13Å; M303-S306 VanDerWaalsContact O-N 3.09Å; M304-S306 PolarHBondContact O-N 3.12Å; S306-V308 VanDerWaalsContact C-N 3.28Å; S306-H310 PolarHBondContact O-CD2 3.26Å; S306-H310 VanDerWaalsContact O-CD2 3.29Å; S306-H310 PolarHBondContact O-NE2 3.46Å |
| 307 | F | 94.4 | Very high | 94.4 | Very high | 13 Ų | 13 | 47 Ų | 47 | 6% | 0.057 | 29% | 0.294 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.6 | -12 | 168.8 | -67.2 | -66 | 0 | 0 | 0 | 113 | V265 M303 M304 A305 G309 H310 V315 K318 L319 A322 | V265-F307 HydrophobicContact CB-CE1 4.33Å; V265-F307 HydrophobicContact CG1-CD1 4.47Å; V265-F307 HydrophobicContact CG1-CE1 3.75Å; V265-F307 HydrophobicContact CG1-CE2 4.43Å; V265-F307 HydrophobicContact CG1-CZ 3.72Å; V265-F307 HydrophobicContact CG2-CD1 3.69Å; V265-F307 HydrophobicContact CG2-CE1 3.77Å; V265-F307 HydrophobicContact CG2-CG 4.27Å; V265-F307 HydrophobicContact CG2-CZ 4.39Å; M303-F307 HydrophobicContact CG-CE2 4.25Å; M303-F307 VanDerWaalsContact O-CD2 3.29Å; M303-F307 WeakPolarHBondContact O-CD2 3.25Å; M303-F307 PolarHBondContact O-N 3.32Å; M304-F307 PolarHBondContact O-N 2.91Å; M304-F307 HydrophobicContact SD-CD2 4.5Å; A305-F307 VanDerWaalsContact C-N 3.32Å; A305-F307 PolarHBondContact O-N 3.04Å; F307-G309 PolarHBondContact O-N 2.94Å; F307-H310 PolarHBondContact O-CD2 3.3Å; F307-H310 PolarHBondContact O-N 3.31Å; F307-H310 VanDerWaalsContact O-N 3.15Å; F307-V315 HydrophobicContact CD1-CB 3.74Å; F307-V315 HydrophobicContact CD1-CG1 3.78Å; F307-V315 HydrophobicContact CD1-CG2 4.28Å; F307-V315 HydrophobicContact CE1-CB 4.15Å; F307-V315 HydrophobicContact CE1-CG1 4.27Å; F307-K318 HydrophobicContact CE1-CB 3.81Å; F307-K318 HydrophobicContact CE1-CD 4.04Å; F307-K318 HydrophobicContact CZ-CB 3.74Å; F307-K318 HydrophobicContact CZ-CD 4.4Å; F307-L319 HydrophobicContact CB-CD1 4.04Å; F307-L319 HydrophobicContact CD2-CD1 3.47Å; F307-L319 VanDerWaalsContact CD2-CD1 3.47Å; F307-L319 HydrophobicContact CE2-CD1 4.15Å; F307-L319 HydrophobicContact CG-CD1 3.94Å; F307-A322 HydrophobicContact CE2-CB 4.04Å |
| 308 | V | 91.2 | Very high | 94.2 | Very high | 96 Ų | 96 | 51.5 Ų | 51.5 | 58% | 0.582 | 31% | 0.314 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.7 | 128.7 | 177.5 | 178.4 | 0 | 0 | 0 | 0 | 110.3 | A305 S306 | A305-V308 WeakPolarHBondContact O-CB 3.48Å; A305-V308 WeakPolarHBondContact O-CG2 3.49Å; A305-V308 PolarHBondContact O-N 2.91Å; S306-V308 VanDerWaalsContact C-N 3.28Å |
| 309 | G | 90.2 | Very high | 94 | Very high | 59 Ų | 59 | 54.3 Ų | 54.3 | 61% | 0.608 | 33% | 0.329 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 85.3 | -0.2 | -178 | 0 | 0 | 0 | 0 | 0 | 115.3 | P262 F307 | P262-G309 VanDerWaalsContact CG-O 3.29Å; P262-G309 WeakPolarHBondContact CG-O 3.43Å; F307-G309 PolarHBondContact O-N 2.94Å |
| 310 | H | 94.4 | Very high | 93.8 | Very high | 64 Ų | 64 | 61.1 Ų | 61.1 | 30% | 0.296 | 36% | 0.362 | S | S | . | . | S | Bend | trans | -80 | 158.9 | 165.2 | -67.9 | -102.6 | 0 | 0 | 0 | 110.8 | G263 S306 F307 V315 | G263-H310 PolarHBondContact O-CE1 3.24Å; G263-H310 VanDerWaalsContact O-CE1 3.28Å; G263-H310 PolarHBondContact O-NE2 2.85Å; S306-H310 PolarHBondContact O-CD2 3.26Å; S306-H310 VanDerWaalsContact O-CD2 3.29Å; S306-H310 PolarHBondContact O-NE2 3.46Å; F307-H310 PolarHBondContact O-CD2 3.3Å; F307-H310 PolarHBondContact O-N 3.31Å; F307-H310 VanDerWaalsContact O-N 3.15Å; H310-V315 HydrophobicContact CB-CG1 3.55Å; H310-V315 HydrophobicContact CB-CG2 4.38Å |
| 311 | D | 92.9 | Very high | 93.7 | Very high | 95 Ų | 95 | 64.7 Ų | 64.7 | 51% | 0.508 | 38% | 0.384 | S | S | . | . | trans | -66 | 139.1 | 169.6 | 166.8 | 69.6 | 0 | 0 | 0 | 111 | E313 S314 V315 | D311-E313 WeakPolarHBondContact OD2-CB 3.42Å; D311-E313 PolarHBondContact OD2-N 2.99Å; D311-S314 PolarHBondContact O-N 2.93Å; D311-S314 PolarHBondContact O-OG 2.68Å; D311-S314 PolarHBondContact OD2-N 2.85Å; D311-V315 WeakPolarHBondContact O-CG2 3.39Å; D311-V315 PolarHBondContact O-N 3.16Å | ||
| 312 | A | 92.1 | Very high | 93.6 | Very high | 72 Ų | 72 | 63.5 Ų | 63.5 | 60% | 0.595 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -65.8 | -43 | -172.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | S314 V315 A316 | A312-S314 VanDerWaalsContact C-N 3.3Å; A312-S314 PolarHBondContact O-N 3.39Å; A312-V315 PolarHBondContact O-N 3.49Å; A312-A316 WeakPolarHBondContact O-CB 3.33Å; A312-A316 PolarHBondContact O-N 2.72Å |
| 313 | E | 93 | Very high | 93.5 | Very high | 179 Ų | 179 | 64.2 Ų | 64.2 | 84% | 0.836 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -64.5 | -39.4 | 178.9 | -58.3 | -173.1 | 175.9 | 0 | 0 | 110.6 | D311 V315 | D311-E313 WeakPolarHBondContact OD2-CB 3.42Å; D311-E313 PolarHBondContact OD2-N 2.99Å; E313-V315 VanDerWaalsContact C-N 3.25Å; E313-V315 PolarHBondContact O-N 3.33Å |
| 314 | S | 92.2 | Very high | 93.6 | Very high | 76 Ų | 76 | 70.1 Ų | 70.1 | 53% | 0.531 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -65.4 | -21.4 | 179.7 | 80.5 | 0 | 0 | 0 | 0 | 114.8 | D311 A312 | D311-S314 PolarHBondContact O-N 2.93Å; D311-S314 PolarHBondContact O-OG 2.68Å; D311-S314 PolarHBondContact OD2-N 2.85Å; A312-S314 VanDerWaalsContact C-N 3.3Å; A312-S314 PolarHBondContact O-N 3.39Å |
| 315 | V | 94.1 | Very high | 93.7 | Very high | 15 Ų | 15 | 71.8 Ų | 71.8 | 9% | 0.091 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -122.1 | -14.1 | -176 | -55.1 | 0 | 0 | 0 | 0 | 115.8 | F307 H310 D311 A312 E313 S317 K318 L319 | F307-V315 HydrophobicContact CD1-CB 3.74Å; F307-V315 HydrophobicContact CD1-CG1 3.78Å; F307-V315 HydrophobicContact CD1-CG2 4.28Å; F307-V315 HydrophobicContact CE1-CB 4.15Å; F307-V315 HydrophobicContact CE1-CG1 4.27Å; H310-V315 HydrophobicContact CB-CG1 3.55Å; H310-V315 HydrophobicContact CB-CG2 4.38Å; D311-V315 WeakPolarHBondContact O-CG2 3.39Å; D311-V315 PolarHBondContact O-N 3.16Å; A312-V315 PolarHBondContact O-N 3.49Å; E313-V315 VanDerWaalsContact C-N 3.25Å; E313-V315 PolarHBondContact O-N 3.33Å; V315-S317 VanDerWaalsContact C-N 3.34Å; V315-S317 PolarHBondContact O-N 2.87Å; V315-S317 VanDerWaalsContact O-N 3.16Å; V315-K318 WeakPolarHBondContact O-CA 3.17Å; V315-K318 WeakPolarHBondContact O-CB 3.42Å; V315-K318 PolarHBondContact O-N 3.16Å; V315-L319 PolarHBondContact O-N 3.38Å |
| 316 | A | 93.6 | Very high | 93.8 | Very high | 50 Ų | 50 | 72.9 Ų | 72.9 | 41% | 0.413 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -48.3 | -49.4 | -172.3 | 0 | 0 | 0 | 0 | 0 | 114 | A312 K318 L319 M320 | A312-A316 WeakPolarHBondContact O-CB 3.33Å; A312-A316 PolarHBondContact O-N 2.72Å; A316-K318 PolarHBondContact O-N 2.73Å; A316-L319 WeakPolarHBondContact O-CB 3.33Å; A316-L319 PolarHBondContact O-N 3.06Å; A316-M320 WeakPolarHBondContact O-CG 3.38Å; A316-M320 PolarHBondContact O-N 3.18Å |
| 317 | S | 94 | Very high | 93.9 | Very high | 93 Ų | 93 | 77 Ų | 77 | 65% | 0.65 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -62.7 | -41 | 178.1 | -179.5 | 0 | 0 | 0 | 0 | 112.8 | V315 V321 | V315-S317 VanDerWaalsContact C-N 3.34Å; V315-S317 PolarHBondContact O-N 2.87Å; V315-S317 VanDerWaalsContact O-N 3.16Å; S317-V321 WeakPolarHBondContact O-CG2 3.27Å; S317-V321 PolarHBondContact O-N 3.3Å |
| 318 | K | 92.8 | Very high | 94 | Very high | 94 Ų | 94 | 80.1 Ų | 80.1 | 41% | 0.409 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -64.8 | -42.2 | 174.6 | -69.9 | -167 | 169.7 | -157.3 | 0 | 111.5 | E269 F307 V315 A316 M320 V321 A322 | E269-K318 IonicContact OE1-NZ 3.12Å; E269-K318 PolarHBondContact OE1-NZ 3.26Å; E269-K318 IonicContact OE2-NZ 3.69Å; F307-K318 HydrophobicContact CE1-CB 3.81Å; F307-K318 HydrophobicContact CE1-CD 4.04Å; F307-K318 HydrophobicContact CZ-CB 3.74Å; F307-K318 HydrophobicContact CZ-CD 4.4Å; V315-K318 WeakPolarHBondContact O-CA 3.17Å; V315-K318 WeakPolarHBondContact O-CB 3.42Å; V315-K318 PolarHBondContact O-N 3.16Å; A316-K318 PolarHBondContact O-N 2.73Å; K318-M320 PolarHBondContact O-N 3.26Å; K318-V321 PolarHBondContact O-N 3.47Å; K318-A322 WeakPolarHBondContact O-CB 3.4Å; K318-A322 PolarHBondContact O-N 3.46Å |
| 319 | L | 93.6 | Very high | 94.3 | Very high | 62 Ų | 62 | 75.6 Ų | 75.6 | 33% | 0.325 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -62.7 | -41.7 | -179.6 | -167.1 | 72.4 | 0 | 0 | 0 | 111.2 | M304 F307 V315 A316 T323 | M304-L319 HydrophobicContact CE-CD1 3.48Å; M304-L319 VanDerWaalsContact CE-CD1 3.48Å; M304-L319 HydrophobicContact CE-CG 4.09Å; M304-L319 HydrophobicContact SD-CD1 3.79Å; F307-L319 HydrophobicContact CB-CD1 4.04Å; F307-L319 HydrophobicContact CD2-CD1 3.47Å; F307-L319 VanDerWaalsContact CD2-CD1 3.47Å; F307-L319 HydrophobicContact CE2-CD1 4.15Å; F307-L319 HydrophobicContact CG-CD1 3.94Å; V315-L319 PolarHBondContact O-N 3.38Å; A316-L319 WeakPolarHBondContact O-CB 3.33Å; A316-L319 PolarHBondContact O-N 3.06Å; L319-T323 VanDerWaalsContact O-CB 3.28Å; L319-T323 WeakPolarHBondContact O-CB 3.47Å; L319-T323 PolarHBondContact O-N 2.93Å; L319-T323 PolarHBondContact O-OG1 2.92Å |
| 320 | M | 94.1 | Very high | 94.6 | Very high | 143 Ų | 143 | 75.2 Ų | 75.2 | 70% | 0.704 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -61.4 | -46.5 | 173.9 | -69.3 | 176.7 | 75.7 | 0 | 0 | 112.1 | A316 K318 T323 K324 | A316-M320 WeakPolarHBondContact O-CG 3.38Å; A316-M320 PolarHBondContact O-N 3.18Å; K318-M320 PolarHBondContact O-N 3.26Å; M320-T323 PolarHBondContact O-N 2.66Å; M320-K324 PolarHBondContact O-N 3.36Å; M320-K324 VanDerWaalsContact O-N 3.08Å |
| 321 | V | 94.5 | Very high | 94.7 | Very high | 77 Ų | 77 | 76.2 Ų | 76.2 | 47% | 0.467 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -64.7 | -45.1 | 178.7 | 173.2 | 0 | 0 | 0 | 0 | 111.4 | S317 K318 K324 Q325 | S317-V321 WeakPolarHBondContact O-CG2 3.27Å; S317-V321 PolarHBondContact O-N 3.3Å; K318-V321 PolarHBondContact O-N 3.47Å; V321-K324 PolarHBondContact O-N 3.11Å; V321-Q325 WeakPolarHBondContact O-CG 3.02Å; V321-Q325 PolarHBondContact O-N 2.68Å |
| 322 | A | 93.6 | Very high | 94.9 | Very high | 3 Ų | 3 | 73 Ų | 73 | 3% | 0.025 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -64 | -38.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112 | M303 M304 F307 K318 Q325 R326 | M303-A322 HydrophobicContact SD-CB 4.21Å; M304-A322 HydrophobicContact SD-CB 3.7Å; F307-A322 HydrophobicContact CE2-CB 4.04Å; K318-A322 WeakPolarHBondContact O-CB 3.4Å; K318-A322 PolarHBondContact O-N 3.46Å; A322-Q325 PolarHBondContact O-N 3.33Å; A322-R326 VanDerWaalsContact O-CB 3.25Å; A322-R326 WeakPolarHBondContact O-CB 3.38Å; A322-R326 PolarHBondContact O-N 2.88Å |
| 323 | T | 95.4 | Very high | 95.2 | Very high | 52 Ų | 52 | 70 Ų | 70 | 32% | 0.319 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -61.7 | -44.4 | 175.8 | -59.8 | 0 | 0 | 0 | 0 | 111.5 | M304 L319 M320 R326 I327 | M304-T323 WeakPolarHBondContact CE-OG1 3.36Å; L319-T323 VanDerWaalsContact O-CB 3.28Å; L319-T323 WeakPolarHBondContact O-CB 3.47Å; L319-T323 PolarHBondContact O-N 2.93Å; L319-T323 PolarHBondContact O-OG1 2.92Å; M320-T323 PolarHBondContact O-N 2.66Å; T323-R326 WeakPolarHBondContact O-CB 3.31Å; T323-R326 PolarHBondContact O-N 3.18Å; T323-I327 HydrophobicContact CG2-CD1 4.34Å; T323-I327 WeakPolarHBondContact O-CG1 3.18Å; T323-I327 PolarHBondContact O-N 2.76Å |
| 324 | K | 96.8 | Very high | 95.3 | Very high | 136 Ų | 136 | 63.8 Ų | 63.8 | 59% | 0.591 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -62.1 | -50.6 | 174.3 | -179.1 | 175.2 | 176.8 | 176.7 | 0 | 111.3 | M320 V321 R326 I327 D328 | M320-K324 PolarHBondContact O-N 3.36Å; M320-K324 VanDerWaalsContact O-N 3.08Å; V321-K324 PolarHBondContact O-N 3.11Å; K324-R326 PolarHBondContact O-N 3.25Å; K324-I327 PolarHBondContact O-N 2.83Å; K324-D328 VanDerWaalsContact O-CG 3.3Å; K324-D328 PolarHBondContact O-N 2.74Å |
| 325 | Q | 95.9 | Very high | 95.5 | Very high | 77 Ų | 77 | 65.5 Ų | 65.5 | 36% | 0.36 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -62.8 | -30.6 | -178.2 | -69.4 | 176.7 | 2.6 | 0 | 0 | 113.1 | F300 V321 A322 A329 | F300-Q325 HydrophobicContact CD1-CB 4.23Å; F300-Q325 HydrophobicContact CE1-CB 3.64Å; F300-Q325 VanDerWaalsContact CE1-OE1 3.31Å; F300-Q325 HydrophobicContact CE2-CB 4.2Å; F300-Q325 HydrophobicContact CZ-CB 3.62Å; F300-Q325 HydrophobicContact CZ-CG 4.49Å; V321-Q325 WeakPolarHBondContact O-CG 3.02Å; V321-Q325 PolarHBondContact O-N 2.68Å; A322-Q325 PolarHBondContact O-N 3.33Å; Q325-A329 WeakPolarHBondContact O-CB 3.44Å; Q325-A329 PolarHBondContact O-N 3.29Å |
| 326 | R | 96 | Very high | 95.6 | Very high | 71 Ų | 71 | 65.3 Ų | 65.3 | 27% | 0.268 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -63.5 | -46.4 | 170.7 | 177.8 | -172.9 | 175.5 | -78 | -14.4 | 112 | F300 E301 A322 T323 K324 A329 W330 | F300-R326 HydrophobicContact CB-CB 3.94Å; F300-R326 HydrophobicContact CB-CG 4.27Å; F300-R326 HydrophobicContact CG-CB 4.48Å; E301-R326 IonicContact OE1-CZ 3.3Å; E301-R326 IonicContact OE1-NE 3.39Å; E301-R326 PolarHBondContact OE1-NE 3.07Å; E301-R326 IonicContact OE1-NH2 3.85Å; E301-R326 PolarHBondContact OE1-NH2 3.39Å; E301-R326 IonicContact OE2-CZ 2.62Å; E301-R326 IonicContact OE2-NE 3.64Å; E301-R326 PolarHBondContact OE2-NE 2.98Å; E301-R326 IonicContact OE2-NH2 2.74Å; E301-R326 PolarHBondContact OE2-NH2 2.99Å; A322-R326 VanDerWaalsContact O-CB 3.25Å; A322-R326 WeakPolarHBondContact O-CB 3.38Å; A322-R326 PolarHBondContact O-N 2.88Å; T323-R326 WeakPolarHBondContact O-CB 3.31Å; T323-R326 PolarHBondContact O-N 3.18Å; K324-R326 PolarHBondContact O-N 3.25Å; R326-A329 PolarHBondContact O-N 3.33Å; R326-W330 VanDerWaalsContact O-CD1 3.24Å; R326-W330 PolarHBondContact O-N 3.28Å; R326-W330 VanDerWaalsContact O-N 3.09Å |
| 327 | I | 96.6 | Very high | 95.7 | Very high | 91 Ų | 91 | 63.4 Ų | 63.4 | 47% | 0.467 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -63.4 | -51.7 | 177 | -65.5 | 163.8 | 0 | 0 | 0 | 109.6 | T323 K324 A329 W330 T331 | T323-I327 HydrophobicContact CG2-CD1 4.34Å; T323-I327 WeakPolarHBondContact O-CG1 3.18Å; T323-I327 PolarHBondContact O-N 2.76Å; K324-I327 PolarHBondContact O-N 2.83Å; I327-A329 PolarHBondContact O-N 2.76Å; I327-W330 PolarHBondContact O-N 3.4Å; I327-W330 VanDerWaalsContact O-N 3.08Å; I327-T331 PolarHBondContact O-N 2.85Å; I327-T331 VanDerWaalsContact O-N 3.09Å; I327-T331 PolarHBondContact O-OG1 3.15Å |
| 328 | D | 97.1 | Very high | 95.8 | Very high | 78 Ų | 78 | 64.3 Ų | 64.3 | 42% | 0.417 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -54.2 | -38.9 | 177.3 | -62 | -23.2 | 0 | 0 | 0 | 111.4 | K324 D332 | K324-D328 VanDerWaalsContact O-CG 3.3Å; K324-D328 PolarHBondContact O-N 2.74Å; D328-D332 WeakPolarHBondContact O-CB 3.43Å; D328-D332 PolarHBondContact O-N 3.41Å; D328-D332 VanDerWaalsContact O-N 3.07Å |
| 329 | A | 97.2 | Very high | 95.9 | Very high | 0 Ų | 0 | 61.6 Ų | 61.6 | 0% | 0 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -70.5 | -37 | 178 | 0 | 0 | 0 | 0 | 0 | 113.8 | A297 F300 Q325 R326 I327 D332 V333 | A297-A329 HydrophobicContact CB-CB 4.01Å; F300-A329 HydrophobicContact CD2-CB 3.81Å; F300-A329 HydrophobicContact CE2-CB 4.05Å; Q325-A329 WeakPolarHBondContact O-CB 3.44Å; Q325-A329 PolarHBondContact O-N 3.29Å; R326-A329 PolarHBondContact O-N 3.33Å; I327-A329 PolarHBondContact O-N 2.76Å; A329-D332 WeakPolarHBondContact O-CB 3.4Å; A329-D332 PolarHBondContact O-N 3.18Å; A329-V333 WeakPolarHBondContact O-CG2 3.33Å; A329-V333 PolarHBondContact O-N 2.86Å |
| 330 | W | 97.4 | Very high | 96.1 | Very high | 52 Ų | 52 | 59 Ų | 59 | 20% | 0.197 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -72.7 | -30.3 | 175.7 | -76.5 | 116.2 | 0 | 0 | 0 | 112.9 | A297 I298 E301 R326 I327 V333 A334 V349 P351 | A297-W330 HydrophobicContact CB-CD2 3.72Å; A297-W330 HydrophobicContact CB-CE3 3.95Å; A297-W330 HydrophobicContact CB-CG 4.28Å; A297-W330 HydrophobicContact CB-CH2 3.93Å; A297-W330 HydrophobicContact CB-CZ2 3.71Å; A297-W330 HydrophobicContact CB-CZ3 4.06Å; I298-W330 HydrophobicContact CD1-CH2 3.94Å; I298-W330 HydrophobicContact CD1-CZ2 4.11Å; I298-W330 HydrophobicContact CG1-CH2 4.29Å; E301-W330 HydrophobicContact CG-CZ2 4.24Å; E301-W330 PolarHBondContact OE1-NE1 2.68Å; R326-W330 VanDerWaalsContact O-CD1 3.24Å; R326-W330 PolarHBondContact O-N 3.28Å; R326-W330 VanDerWaalsContact O-N 3.09Å; I327-W330 PolarHBondContact O-N 3.4Å; I327-W330 VanDerWaalsContact O-N 3.08Å; W330-V333 HydrophobicContact CE3-CB 4.01Å; W330-V333 HydrophobicContact CE3-CG1 3.98Å; W330-V333 HydrophobicContact CE3-CG2 3.98Å; W330-V333 HydrophobicContact CZ3-CB 4.46Å; W330-V333 HydrophobicContact CZ3-CG1 4.08Å; W330-V333 HydrophobicContact CZ3-CG2 4.19Å; W330-V333 WeakPolarHBondContact O-CB 3.49Å; W330-V333 PolarHBondContact O-N 3.38Å; W330-A334 PolarHBondContact O-N 3.29Å; W330-V349 WeakPolarHBondContact CZ3-O 3.27Å; W330-P351 HydrophobicContact CZ2-CB 4.22Å; W330-P351 HydrophobicContact CZ2-CG 4.34Å |
| 331 | T | 96.7 | Very high | 96.2 | Very high | 84 Ų | 84 | 59.8 Ų | 59.8 | 52% | 0.515 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -66.8 | -42 | 169.2 | -54.7 | 0 | 0 | 0 | 0 | 111.6 | I327 V333 A334 N335 | I327-T331 PolarHBondContact O-N 2.85Å; I327-T331 VanDerWaalsContact O-N 3.09Å; I327-T331 PolarHBondContact O-OG1 3.15Å; T331-V333 VanDerWaalsContact C-N 3.31Å; T331-V333 PolarHBondContact O-N 3.32Å; T331-A334 PolarHBondContact O-N 2.82Å; T331-N335 PolarHBondContact O-N 2.79Å; T331-N335 PolarHBondContact O-ND2 3.06Å |
| 332 | D | 96.3 | Very high | 96.2 | Very high | 29 Ų | 29 | 58.9 Ų | 58.9 | 16% | 0.155 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -61.2 | -36.1 | 173.6 | -174.8 | 28.9 | 0 | 0 | 0 | 112 | R279 V293 R296 D328 A329 C336 | R279-D332 IonicContact CZ-OD1 3.69Å; R279-D332 VanDerWaalsContact CZ-OD1 3.3Å; R279-D332 IonicContact CZ-OD2 2.91Å; R279-D332 IonicContact NH1-OD1 3.34Å; R279-D332 PolarHBondContact NH1-OD1 2.97Å; R279-D332 IonicContact NH1-OD2 3.15Å; R279-D332 PolarHBondContact NH1-OD2 3.4Å; R279-D332 IonicContact NH2-OD1 2.69Å; R279-D332 PolarHBondContact NH2-OD1 3.43Å; R279-D332 IonicContact NH2-OD2 3.45Å; V293-D332 WeakPolarHBondContact CG1-OD2 3.29Å; R296-D332 IonicContact NH1-OD2 3.67Å; R296-D332 PolarHBondContact NH1-OD2 3.27Å; D328-D332 WeakPolarHBondContact O-CB 3.43Å; D328-D332 PolarHBondContact O-N 3.41Å; D328-D332 VanDerWaalsContact O-N 3.07Å; A329-D332 WeakPolarHBondContact O-CB 3.4Å; A329-D332 PolarHBondContact O-N 3.18Å; D332-C336 PolarHBondContact O-N 3.49Å; D332-C336 PolarHBondContact O-SG 3.4Å |
| 333 | V | 97.6 | Very high | 96.3 | Very high | 9 Ų | 9 | 63.8 Ų | 63.8 | 6% | 0.055 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -58.9 | -54.1 | 172.4 | 163 | 0 | 0 | 0 | 0 | 112.5 | V293 Q294 A297 A329 W330 T331 N335 C336 V337 | V293-V333 HydrophobicContact CB-CG2 4.21Å; V293-V333 HydrophobicContact CG2-CB 4.48Å; V293-V333 HydrophobicContact CG2-CG2 3.99Å; V293-V333 WeakPolarHBondContact O-CG2 3.49Å; Q294-V333 HydrophobicContact CB-CG2 4.32Å; Q294-V333 HydrophobicContact CG-CB 4.29Å; Q294-V333 HydrophobicContact CG-CG1 3.58Å; Q294-V333 HydrophobicContact CG-CG2 3.75Å; A297-V333 HydrophobicContact CB-CG2 3.88Å; A329-V333 WeakPolarHBondContact O-CG2 3.33Å; A329-V333 PolarHBondContact O-N 2.86Å; W330-V333 HydrophobicContact CE3-CB 4.01Å; W330-V333 HydrophobicContact CE3-CG1 3.98Å; W330-V333 HydrophobicContact CE3-CG2 3.98Å; W330-V333 HydrophobicContact CZ3-CB 4.46Å; W330-V333 HydrophobicContact CZ3-CG1 4.08Å; W330-V333 HydrophobicContact CZ3-CG2 4.19Å; W330-V333 WeakPolarHBondContact O-CB 3.49Å; W330-V333 PolarHBondContact O-N 3.38Å; T331-V333 VanDerWaalsContact C-N 3.31Å; T331-V333 PolarHBondContact O-N 3.32Å; V333-N335 PolarHBondContact O-N 3.12Å; V333-C336 PolarHBondContact O-N 2.71Å; V333-V337 HydrophobicContact CG1-CG2 4.04Å; V333-V337 WeakPolarHBondContact O-CB 3.48Å; V333-V337 VanDerWaalsContact O-CG2 3.31Å; V333-V337 WeakPolarHBondContact O-CG2 3.45Å; V333-V337 PolarHBondContact O-N 3.15Å |
| 334 | A | 95.6 | Very high | 96.3 | Very high | 47 Ų | 47 | 62.9 Ų | 62.9 | 39% | 0.388 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -56.1 | -50.8 | -176.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | W330 T331 C336 V337 D338 | W330-A334 PolarHBondContact O-N 3.29Å; T331-A334 PolarHBondContact O-N 2.82Å; A334-C336 VanDerWaalsContact C-N 3.33Å; A334-C336 PolarHBondContact O-N 3.34Å; A334-V337 PolarHBondContact O-N 3.34Å; A334-D338 PolarHBondContact O-N 2.82Å |
| 335 | N | 95.8 | Very high | 96.3 | Very high | 112 Ų | 112 | 56.9 Ų | 56.9 | 60% | 0.599 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -57.3 | -41.1 | 178.8 | -66.9 | -40.3 | 0 | 0 | 0 | 113.2 | T331 V333 A339 | T331-N335 PolarHBondContact O-N 2.79Å; T331-N335 PolarHBondContact O-ND2 3.06Å; V333-N335 PolarHBondContact O-N 3.12Å; N335-A339 PolarHBondContact O-N 2.9Å |
| 336 | C | 96.5 | Very high | 96.3 | Very high | 12 Ų | 12 | 56.5 Ų | 56.5 | 8% | 0.081 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -78.2 | -34.5 | -179.5 | -62.3 | 0 | 0 | 0 | 0 | 112.8 | R279 A290 V293 D332 V333 A334 A339 | R279-C336 PolarHBondContact NH2-SG 3.38Å; A290-C336 HydrophobicContact CB-CB 4.39Å; V293-C336 HydrophobicContact CG2-CB 3.6Å; D332-C336 PolarHBondContact O-N 3.49Å; D332-C336 PolarHBondContact O-SG 3.4Å; V333-C336 PolarHBondContact O-N 2.71Å; A334-C336 VanDerWaalsContact C-N 3.33Å; A334-C336 PolarHBondContact O-N 3.34Å; C336-A339 PolarHBondContact O-N 3.38Å |
| 337 | V | 96.7 | Very high | 96.4 | Very high | 10 Ų | 10 | 54.3 Ų | 54.3 | 6% | 0.061 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -67.2 | -40.1 | 177.9 | 162.5 | 0 | 0 | 0 | 0 | 111 | A290 Q294 V333 A334 A339 V340 K346 V348 | A290-V337 HydrophobicContact CB-CG2 4.28Å; Q294-V337 HydrophobicContact CG-CG2 4.23Å; V333-V337 HydrophobicContact CG1-CG2 4.04Å; V333-V337 WeakPolarHBondContact O-CB 3.48Å; V333-V337 VanDerWaalsContact O-CG2 3.31Å; V333-V337 WeakPolarHBondContact O-CG2 3.45Å; V333-V337 PolarHBondContact O-N 3.15Å; A334-V337 PolarHBondContact O-N 3.34Å; V337-A339 VanDerWaalsContact C-N 3.32Å; V337-V340 PolarHBondContact O-N 3.43Å; V337-K346 VanDerWaalsContact CG1-CE 3.5Å; V337-K346 HydrophobicContact CG1-CG 4.4Å; V337-K346 WeakPolarHBondContact O-CE 3.49Å; V337-K346 PolarHBondContact O-NZ 3.24Å; V337-V348 HydrophobicContact CG1-CG2 3.98Å |
| 338 | D | 95.6 | Very high | 96.3 | Very high | 112 Ų | 112 | 54.2 Ų | 54.2 | 60% | 0.599 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -76 | -18.9 | 177.8 | -70.5 | -31.4 | 0 | 0 | 0 | 113.8 | A334 V340 K346 | A334-D338 PolarHBondContact O-N 2.82Å; D338-V340 PolarHBondContact O-N 3.48Å; D338-K346 IonicContact OD1-NZ 3.03Å; D338-K346 PolarHBondContact OD1-NZ 3.45Å |
| 339 | A | 95.8 | Very high | 96.2 | Very high | 36 Ų | 36 | 50.5 Ų | 50.5 | 30% | 0.298 | 30% | 0.295 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.5 | 3.4 | 167.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | N335 C336 V337 | N335-A339 PolarHBondContact O-N 2.9Å; C336-A339 PolarHBondContact O-N 3.38Å; V337-A339 VanDerWaalsContact C-N 3.32Å |
| 340 | V | 97.2 | Very high | 96 | Very high | 8 Ų | 8 | 50.6 Ų | 50.6 | 5% | 0.048 | 30% | 0.296 | C | S | . | . | trans | -95.5 | 94.9 | 174.4 | -173.1 | 0 | 0 | 0 | 0 | 110.5 | R286 P287 A290 V337 D338 D342 K346 | R286-V340 HydrophobicContact CB-CG2 4.44Å; P287-V340 HydrophobicContact CG-CG1 4.12Å; A290-V340 HydrophobicContact CB-CG2 3.61Å; V337-V340 PolarHBondContact O-N 3.43Å; D338-V340 PolarHBondContact O-N 3.48Å; V340-D342 VanDerWaalsContact C-N 3.31Å; V340-D342 PolarHBondContact O-N 3.27Å; V340-K346 HydrophobicContact CB-CB 4.11Å; V340-K346 HydrophobicContact CB-CG 4.24Å; V340-K346 HydrophobicContact CG1-CB 3.86Å | ||
| 341 | N | 95.4 | Very high | 95.8 | Very high | 159 Ų | 159 | 51.2 Ų | 51.2 | 85% | 0.85 | 31% | 0.306 | S | S | * | . | trans | -65.2 | -30.5 | 178.8 | -60.8 | -9.5 | 0 | 0 | 0 | 113.5 | S343 | N341-S343 PolarHBondContact O-N 2.98Š| ||
| 342 | D | 95 | Very high | 95.7 | Very high | 58 Ų | 58 | 56.2 Ų | 56.2 | 31% | 0.31 | 32% | 0.316 | S | S | . | . | trans | -82.2 | 98 | -177 | -174.7 | -14.1 | 0 | 0 | 0 | 110.5 | V340 A344 L345 K346 R372 | V340-D342 VanDerWaalsContact C-N 3.31Å; V340-D342 PolarHBondContact O-N 3.27Å; D342-A344 PolarHBondContact O-N 3.09Å; D342-A344 VanDerWaalsContact O-N 3.14Å; D342-A344 WeakPolarHBondContact OD1-CB 3.48Å; D342-A344 PolarHBondContact OD1-N 2.89Å; D342-A344 VanDerWaalsContact OD1-N 3.09Å; D342-L345 HydrophobicContact CB-CB 4.24Å; D342-L345 HydrophobicContact CB-CD1 4.43Å; D342-L345 HydrophobicContact CB-CG 4.42Å; D342-L345 CarbonylContact O-C 3.57Å; D342-L345 WeakPolarHBondContact O-CA 3.44Å; D342-L345 PolarHBondContact O-N 3.31Å; D342-L345 WeakPolarHBondContact OD2-CD1 3.47Å; D342-L345 WeakPolarHBondContact OD2-CG 3.3Å; D342-K346 PolarHBondContact O-N 3Å; D342-R372 IonicContact OD1-NH1 3.4Å; D342-R372 PolarHBondContact OD1-NH1 2.98Å; D342-R372 IonicContact OD2-CZ 2.73Å; D342-R372 IonicContact OD2-NH1 2.63Å; D342-R372 PolarHBondContact OD2-NH1 3.11Å | ||
| 343 | S | 95.1 | Very high | 95.6 | Very high | 106 Ų | 106 | 57.1 Ų | 57.1 | 74% | 0.741 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.8 | -28.7 | -179.6 | -170.7 | 0 | 0 | 0 | 0 | 113.6 | N341 L345 | N341-S343 PolarHBondContact O-N 2.98Å; S343-L345 PolarHBondContact O-N 2.99Å |
| 344 | A | 95.4 | Very high | 95.5 | Very high | 34 Ų | 34 | 58.1 Ų | 58.1 | 28% | 0.281 | 33% | 0.328 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.6 | -18.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113 | D342 R368 | D342-A344 PolarHBondContact O-N 3.09Å; D342-A344 VanDerWaalsContact O-N 3.14Å; D342-A344 WeakPolarHBondContact OD1-CB 3.48Å; D342-A344 PolarHBondContact OD1-N 2.89Å; D342-A344 VanDerWaalsContact OD1-N 3.09Å; A344-R368 PolarHBondContact O-NH1 3.31Å; A344-R368 PolarHBondContact O-NH2 3.2Å; A344-R368 VanDerWaalsContact O-NH2 3.14Å |
| 345 | L | 97 | Very high | 95.6 | Very high | 10 Ų | 10 | 56 Ų | 56 | 5% | 0.052 | 31% | 0.31 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -112 | -9.7 | 179.1 | -57.2 | -178.5 | 0 | 0 | 0 | 113.5 | P287 D342 S343 T365 R368 W369 | P287-L345 HydrophobicContact CB-CB 4.03Å; P287-L345 HydrophobicContact CG-CB 3.87Å; P287-L345 HydrophobicContact CG-CD1 4.05Å; D342-L345 HydrophobicContact CB-CB 4.24Å; D342-L345 HydrophobicContact CB-CD1 4.43Å; D342-L345 HydrophobicContact CB-CG 4.42Å; D342-L345 CarbonylContact O-C 3.57Å; D342-L345 WeakPolarHBondContact O-CA 3.44Å; D342-L345 PolarHBondContact O-N 3.31Å; D342-L345 WeakPolarHBondContact OD2-CD1 3.47Å; D342-L345 WeakPolarHBondContact OD2-CG 3.3Å; S343-L345 PolarHBondContact O-N 2.99Å; L345-T365 HydrophobicContact CB-CG2 4.39Å; L345-T365 HydrophobicContact CD2-CG2 4.14Å; L345-T365 WeakPolarHBondContact O-CG2 3.33Å; L345-R368 HydrophobicContact CD2-CB 3.83Å; L345-W369 HydrophobicContact CD1-CB 4.46Å; L345-W369 HydrophobicContact CD2-CB 4.28Å |
| 346 | K | 97.1 | Very high | 95.7 | Very high | 69 Ų | 69 | 51.1 Ų | 51.1 | 30% | 0.3 | 28% | 0.284 | S | S | . | . | trans | -73.5 | 122.7 | 170.1 | -172.8 | 169.7 | -178.1 | 166.5 | 0 | 109.6 | V337 D338 V340 D342 | V337-K346 VanDerWaalsContact CG1-CE 3.5Å; V337-K346 HydrophobicContact CG1-CG 4.4Å; V337-K346 WeakPolarHBondContact O-CE 3.49Å; V337-K346 PolarHBondContact O-NZ 3.24Å; D338-K346 IonicContact OD1-NZ 3.03Å; D338-K346 PolarHBondContact OD1-NZ 3.45Å; V340-K346 HydrophobicContact CB-CB 4.11Å; V340-K346 HydrophobicContact CB-CG 4.24Å; V340-K346 HydrophobicContact CG1-CB 3.86Å; D342-K346 PolarHBondContact O-N 3Å | ||
| 347 | I | 96.5 | Very high | 95.7 | Very high | 25 Ų | 25 | 53.2 Ų | 53.2 | 13% | 0.128 | 29% | 0.294 | C | S | . | . | trans | -135.3 | 146 | 173.2 | 53.9 | 172.1 | 0 | 0 | 0 | 110.7 | M291 Q294 M362 T365 | M291-I347 HydrophobicContact CE-CD1 3.93Å; M291-I347 HydrophobicContact CE-CG1 4.27Å; M291-I347 HydrophobicContact CG-CD1 4.02Å; M291-I347 HydrophobicContact CG-CG1 4.34Å; M291-I347 HydrophobicContact SD-CD1 4.22Å; Q294-I347 PolarHBondContact NE2-O 3.19Å; Q294-I347 PolarHBondContact OE1-O 2.99Å; I347-M362 HydrophobicContact CD1-CB 4.22Å; I347-M362 HydrophobicContact CD1-CG 3.73Å; I347-T365 HydrophobicContact CD1-CG2 4.3Å; I347-T365 HydrophobicContact CG1-CG2 4.46Å; I347-T365 HydrophobicContact CG2-CG2 4.04Å; I347-T365 WeakPolarHBondContact CG2-OG1 3.39Å | ||
| 348 | V | 95.7 | Very high | 95.7 | Very high | 88 Ų | 88 | 52.8 Ų | 52.8 | 53% | 0.533 | 29% | 0.292 | S | S | . | . | trans | -119.5 | 121.1 | 178.3 | -172 | 0 | 0 | 0 | 0 | 108.6 | V337 | V337-V348 HydrophobicContact CG1-CG2 3.98Š| ||
| 349 | V | 95.4 | Very high | 95.8 | Very high | 1 Ų | 1 | 47.4 Ų | 47.4 | 1% | 0.006 | 26% | 0.263 | C | S | . | . | trans | -117.5 | 149.8 | 167.1 | -61.6 | 0 | 0 | 0 | 0 | 108.6 | Q294 I298 W330 L353 T358 T361 M362 | Q294-V349 HydrophobicContact CB-CG2 3.67Å; Q294-V349 HydrophobicContact CG-CG2 4.1Å; I298-V349 HydrophobicContact CG1-CG2 4.48Å; W330-V349 WeakPolarHBondContact CZ3-O 3.27Å; V349-L353 HydrophobicContact CB-CD1 3.88Å; V349-L353 HydrophobicContact CG1-CD1 3.78Å; V349-T358 HydrophobicContact CB-CG2 4.32Å; V349-T358 HydrophobicContact CG1-CG2 4.26Å; V349-T358 HydrophobicContact CG2-CG2 4.06Å; V349-T361 HydrophobicContact CG1-CG2 3.98Å; V349-M362 HydrophobicContact CG1-CE 4.38Å; V349-M362 HydrophobicContact CG2-CE 3.63Å | ||
| 350 | G | 92.4 | Very high | 95.9 | Very high | 1 Ų | 1 | 50.1 Ų | 50.1 | 1% | 0.01 | 27% | 0.266 | C | S | . | . | trans | -138.9 | 174.8 | -176.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | I298 W352 L353 | I298-G350 WeakPolarHBondContact CD1-O 3.29Å; G350-W352 PolarHBondContact O-N 3.23Å; G350-L353 PolarHBondContact O-N 2.73Å | ||
| 351 | P | 93.9 | Very high | 95.9 | Very high | 65 Ų | 65 | 52.4 Ų | 52.4 | 42% | 0.422 | 28% | 0.279 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.1 | -9 | -178.4 | 28.9 | -37 | 0 | 0 | 0 | 114.2 | E301 W330 | E301-P351 HydrophobicContact CG-CB 3.96Å; W330-P351 HydrophobicContact CZ2-CB 4.22Å; W330-P351 HydrophobicContact CZ2-CG 4.34Å |
| 352 | W | 94 | Very high | 96 | Very high | 190 Ų | 190 | 44.8 Ų | 44.8 | 72% | 0.72 | 24% | 0.239 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -79.3 | -13.5 | 172.5 | 59 | 83.7 | 0 | 0 | 0 | 114 | G350 | G350-W352 PolarHBondContact O-N 3.23Š|
| 353 | L | 94.9 | Very high | 96.2 | Very high | 47 Ų | 47 | 42.2 Ų | 42.2 | 25% | 0.246 | 23% | 0.225 | C | C | . | . | S | Bend | trans | -92.2 | 145.9 | 175.6 | -65.1 | -176 | 0 | 0 | 0 | 111.5 | V349 G350 D357 | V349-L353 HydrophobicContact CB-CD1 3.88Å; V349-L353 HydrophobicContact CG1-CD1 3.78Å; G350-L353 PolarHBondContact O-N 2.73Å; L353-D357 HydrophobicContact CB-CB 4.41Å; L353-D357 HydrophobicContact CD2-CB 4.4Å |
| 354 | S | 94.9 | Very high | 96.2 | Very high | 31 Ų | 31 | 39.5 Ų | 39.5 | 22% | 0.217 | 21% | 0.205 | C | C | . | . | trans | -69.5 | 166.3 | 166.3 | 84.3 | 0 | 0 | 0 | 0 | 111.2 | E356 D357 T358 | S354-E356 VanDerWaalsContact C-N 3.3Å; S354-E356 PolarHBondContact O-N 3.45Å; S354-E356 PolarHBondContact OG-N 2.85Å; S354-E356 PolarHBondContact OG-OE2 2.98Å; S354-D357 VanDerWaalsContact CB-OD2 3.32Å; S354-D357 WeakPolarHBondContact CB-OD2 3.41Å; S354-D357 PolarHBondContact O-N 2.78Å; S354-D357 PolarHBondContact OG-N 2.91Å; S354-D357 PolarHBondContact OG-OD2 3.34Å; S354-T358 VanDerWaalsContact O-CB 3.3Å; S354-T358 WeakPolarHBondContact O-CB 3.2Å; S354-T358 PolarHBondContact O-N 2.91Å; S354-T358 PolarHBondContact O-OG1 2.79Å | ||
| 355 | V | 97.4 | Very high | 96.3 | Very high | 2 Ų | 2 | 38 Ų | 38 | 1% | 0.012 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -61.9 | -41.6 | 174 | 171.6 | 0 | 0 | 0 | 0 | 110.8 | L246 I247 K250 I298 Q302 T358 V359 | L246-V355 HydrophobicContact CB-CG1 3.61Å; I247-V355 HydrophobicContact CG1-CG1 3.96Å; K250-V355 HydrophobicContact CB-CG2 4.33Å; K250-V355 HydrophobicContact CD-CB 3.92Å; K250-V355 HydrophobicContact CD-CG2 3.98Å; I298-V355 HydrophobicContact CG2-CG2 4.22Å; Q302-V355 HydrophobicContact CG-CG2 3.62Å; V355-T358 WeakPolarHBondContact O-CB 3.38Å; V355-T358 PolarHBondContact O-N 3.39Å; V355-V359 WeakPolarHBondContact O-CG2 3.43Å; V355-V359 PolarHBondContact O-N 2.96Å |
| 356 | E | 96.9 | Very high | 96.4 | Very high | 10 Ų | 10 | 37.5 Ų | 37.5 | 5% | 0.047 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -63.3 | -44.8 | 178.3 | -62.1 | 85.1 | 154.5 | 0 | 0 | 110.6 | R186 K250 S354 V359 R360 P384 | R186-E356 IonicContact NH1-OE1 2.75Å; K250-E356 VanDerWaalsContact CD-OE2 3.26Å; K250-E356 WeakPolarHBondContact CD-OE2 3.41Å; K250-E356 WeakPolarHBondContact CE-OE2 3.35Å; K250-E356 IonicContact NZ-OE1 2.69Å; K250-E356 PolarHBondContact NZ-OE1 2.69Å; K250-E356 VanDerWaalsContact NZ-OE1 3.12Å; K250-E356 IonicContact NZ-OE2 3.09Å; K250-E356 PolarHBondContact NZ-OE2 3.34Å; S354-E356 VanDerWaalsContact C-N 3.3Å; S354-E356 PolarHBondContact O-N 3.45Å; S354-E356 PolarHBondContact OG-N 2.85Å; S354-E356 PolarHBondContact OG-OE2 2.98Å; E356-V359 PolarHBondContact O-N 3.48Å; E356-R360 WeakPolarHBondContact O-CB 3.25Å; E356-R360 VanDerWaalsContact O-CG 3.27Å; E356-R360 WeakPolarHBondContact O-CG 3.4Å; E356-R360 PolarHBondContact O-N 2.96Å; E356-P384 HydrophobicContact CB-CG 4.2Å; E356-P384 HydrophobicContact CG-CG 3.45Å; E356-P384 VanDerWaalsContact CG-CG 3.45Å |
| 357 | D | 97.1 | Very high | 96.4 | Very high | 55 Ų | 55 | 39.5 Ų | 39.5 | 29% | 0.294 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -69 | -40.2 | 177.6 | -59.1 | -45.8 | 0 | 0 | 0 | 111.8 | L353 S354 V359 R360 T361 | L353-D357 HydrophobicContact CB-CB 4.41Å; L353-D357 HydrophobicContact CD2-CB 4.4Å; S354-D357 VanDerWaalsContact CB-OD2 3.32Å; S354-D357 WeakPolarHBondContact CB-OD2 3.41Å; S354-D357 PolarHBondContact O-N 2.78Å; S354-D357 PolarHBondContact OG-N 2.91Å; S354-D357 PolarHBondContact OG-OD2 3.34Å; D357-V359 VanDerWaalsContact C-N 3.31Å; D357-V359 PolarHBondContact O-N 2.9Å; D357-R360 CarbonylContact O-C 3.51Å; D357-R360 PolarHBondContact O-N 3.44Å; D357-R360 VanDerWaalsContact O-N 3.15Å; D357-R360 IonicContact OD1-CZ 3.3Å; D357-R360 VanDerWaalsContact OD1-CZ 3.3Å; D357-R360 IonicContact OD1-NE 2.91Å; D357-R360 PolarHBondContact OD1-NE 3.47Å; D357-R360 VanDerWaalsContact OD1-NE 3.09Å; D357-R360 IonicContact OD1-NH2 2.79Å; D357-R360 PolarHBondContact OD1-NH2 2.89Å; D357-T361 PolarHBondContact O-N 3.45Å; D357-T361 PolarHBondContact O-OG1 3.44Å; D357-T361 VanDerWaalsContact O-OG1 3.12Å |
| 358 | T | 97.8 | Very high | 96.4 | Very high | 1 Ų | 1 | 42.7 Ų | 42.7 | 1% | 0.006 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -53.6 | -48.8 | 171 | -64 | 0 | 0 | 0 | 0 | 110.9 | L295 I298 V349 S354 V355 T361 M362 | L295-T358 HydrophobicContact CD2-CG2 3.61Å; I298-T358 HydrophobicContact CG1-CG2 4.37Å; V349-T358 HydrophobicContact CB-CG2 4.32Å; V349-T358 HydrophobicContact CG1-CG2 4.26Å; V349-T358 HydrophobicContact CG2-CG2 4.06Å; S354-T358 VanDerWaalsContact O-CB 3.3Å; S354-T358 WeakPolarHBondContact O-CB 3.2Å; S354-T358 PolarHBondContact O-N 2.91Å; S354-T358 PolarHBondContact O-OG1 2.79Å; V355-T358 WeakPolarHBondContact O-CB 3.38Å; V355-T358 PolarHBondContact O-N 3.39Å; T358-T361 PolarHBondContact O-N 3.12Å; T358-M362 HydrophobicContact CG2-CE 4.12Å; T358-M362 WeakPolarHBondContact O-CG 3.33Å; T358-M362 PolarHBondContact O-N 3.12Å |
| 359 | V | 97.9 | Very high | 96.5 | Very high | 0 Ų | 0 | 38.6 Ų | 38.6 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -67.5 | -39.1 | 177.5 | 173.7 | 0 | 0 | 0 | 0 | 111.8 | M243 I247 V355 E356 D357 T361 M362 L363 L381 P383 | M243-V359 HydrophobicContact CB-CG1 4.3Å; M243-V359 HydrophobicContact CB-CG2 3.73Å; M243-V359 HydrophobicContact CG-CG2 3.87Å; M243-V359 HydrophobicContact SD-CB 4.45Å; M243-V359 HydrophobicContact SD-CG1 4.12Å; M243-V359 HydrophobicContact SD-CG2 4.1Å; I247-V359 HydrophobicContact CD1-CB 4.16Å; I247-V359 HydrophobicContact CD1-CG1 4Å; I247-V359 HydrophobicContact CD1-CG2 4.04Å; I247-V359 HydrophobicContact CG1-CG2 4.24Å; V355-V359 WeakPolarHBondContact O-CG2 3.43Å; V355-V359 PolarHBondContact O-N 2.96Å; E356-V359 PolarHBondContact O-N 3.48Å; D357-V359 VanDerWaalsContact C-N 3.31Å; D357-V359 PolarHBondContact O-N 2.9Å; V359-T361 VanDerWaalsContact C-N 3.3Å; V359-T361 PolarHBondContact O-N 3.29Å; V359-M362 PolarHBondContact O-N 3.2Å; V359-L363 HydrophobicContact CG1-CD1 3.48Å; V359-L363 VanDerWaalsContact CG1-CD1 3.48Å; V359-L363 HydrophobicContact CG1-CG 3.94Å; V359-L363 WeakPolarHBondContact O-CB 3.11Å; V359-L363 WeakPolarHBondContact O-CG 3.48Å; V359-L363 PolarHBondContact O-N 3.36Å; V359-L381 HydrophobicContact CG1-CD2 3.78Å; V359-L381 HydrophobicContact CG1-CG 4.44Å; V359-P383 HydrophobicContact CG1-CB 4.19Å |
| 360 | R | 97.2 | Very high | 96.6 | Very high | 93 Ų | 93 | 39.8 Ų | 39.8 | 35% | 0.351 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -61.6 | -33.8 | 173.8 | -74.4 | -174.2 | -82.3 | -139.2 | 19.8 | 112.5 | E356 D357 P364 P383 P384 K385 | E356-R360 WeakPolarHBondContact O-CB 3.25Å; E356-R360 VanDerWaalsContact O-CG 3.27Å; E356-R360 WeakPolarHBondContact O-CG 3.4Å; E356-R360 PolarHBondContact O-N 2.96Å; D357-R360 CarbonylContact O-C 3.51Å; D357-R360 PolarHBondContact O-N 3.44Å; D357-R360 VanDerWaalsContact O-N 3.15Å; D357-R360 IonicContact OD1-CZ 3.3Å; D357-R360 VanDerWaalsContact OD1-CZ 3.3Å; D357-R360 IonicContact OD1-NE 2.91Å; D357-R360 PolarHBondContact OD1-NE 3.47Å; D357-R360 VanDerWaalsContact OD1-NE 3.09Å; D357-R360 IonicContact OD1-NH2 2.79Å; D357-R360 PolarHBondContact OD1-NH2 2.89Å; R360-P364 WeakPolarHBondContact O-CD 3.29Å; R360-P364 WeakPolarHBondContact O-CG 3.26Å; R360-P383 HydrophobicContact CG-CB 3.9Å; R360-P383 HydrophobicContact CG-CG 3.67Å; R360-P384 PolarHBondContact NH1-O 2.89Å; R360-K385 PolarHBondContact NH1-OXT 3.38Å |
| 361 | T | 97 | Very high | 96.8 | Very high | 55 Ų | 55 | 46 Ų | 46 | 34% | 0.337 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -77.2 | -37.2 | 173.9 | -60 | 0 | 0 | 0 | 0 | 112.7 | V349 D357 T358 V359 | V349-T361 HydrophobicContact CG1-CG2 3.98Å; D357-T361 PolarHBondContact O-N 3.45Å; D357-T361 PolarHBondContact O-OG1 3.44Å; D357-T361 VanDerWaalsContact O-OG1 3.12Å; T358-T361 PolarHBondContact O-N 3.12Å; V359-T361 VanDerWaalsContact C-N 3.3Å; V359-T361 PolarHBondContact O-N 3.29Å |
| 362 | M | 97.9 | Very high | 96.8 | Very high | 0 Ų | 0 | 49.7 Ų | 49.7 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -74.7 | -46.9 | -178.4 | -70.3 | -158.9 | 178.9 | 0 | 0 | 113.5 | M243 M291 Q294 L295 I347 V349 T358 V359 T365 V366 | M243-M362 HydrophobicContact SD-CB 3.92Å; M243-M362 HydrophobicContact SD-SD 4.49Å; M291-M362 HydrophobicContact CB-CE 4.18Å; M291-M362 HydrophobicContact CB-SD 3.79Å; M291-M362 HydrophobicContact CG-CE 4.33Å; M291-M362 HydrophobicContact CG-CG 4.44Å; M291-M362 HydrophobicContact CG-SD 3.92Å; M291-M362 HydrophobicContact SD-SD 4.48Å; Q294-M362 HydrophobicContact CB-CE 3.73Å; L295-M362 HydrophobicContact CD1-SD 3.94Å; L295-M362 HydrophobicContact CD2-CE 3.79Å; L295-M362 HydrophobicContact CD2-SD 3.56Å; L295-M362 VanDerWaalsContact CD2-SD 3.56Å; L295-M362 HydrophobicContact CG-CE 3.82Å; L295-M362 HydrophobicContact CG-SD 3.56Å; L295-M362 VanDerWaalsContact CG-SD 3.56Å; I347-M362 HydrophobicContact CD1-CB 4.22Å; I347-M362 HydrophobicContact CD1-CG 3.73Å; V349-M362 HydrophobicContact CG1-CE 4.38Å; V349-M362 HydrophobicContact CG2-CE 3.63Å; T358-M362 HydrophobicContact CG2-CE 4.12Å; T358-M362 WeakPolarHBondContact O-CG 3.33Å; T358-M362 PolarHBondContact O-N 3.12Å; V359-M362 PolarHBondContact O-N 3.2Å; M362-T365 WeakPolarHBondContact O-CA 3.42Å; M362-T365 WeakPolarHBondContact O-CB 3.32Å; M362-T365 PolarHBondContact O-N 3.46Å; M362-V366 PolarHBondContact O-N 2.75Å |
| 363 | L | 97.7 | Very high | 96.9 | Very high | 4 Ų | 4 | 44.2 Ų | 44.2 | 2% | 0.021 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -55.4 | -42.3 | -172.2 | -75.6 | 169.4 | 0 | 0 | 0 | 115.2 | M243 V359 T365 V366 R367 W377 Q379 L381 P383 | M243-L363 HydrophobicContact CE-CD2 3.59Å; M243-L363 HydrophobicContact CE-CG 4.17Å; M243-L363 HydrophobicContact SD-CG 4.47Å; V359-L363 HydrophobicContact CG1-CD1 3.48Å; V359-L363 VanDerWaalsContact CG1-CD1 3.48Å; V359-L363 HydrophobicContact CG1-CG 3.94Å; V359-L363 WeakPolarHBondContact O-CB 3.11Å; V359-L363 WeakPolarHBondContact O-CG 3.48Å; V359-L363 PolarHBondContact O-N 3.36Å; L363-T365 PolarHBondContact O-N 2.62Å; L363-V366 PolarHBondContact O-N 3.09Å; L363-R367 PolarHBondContact O-N 2.79Å; L363-W377 HydrophobicContact CD2-CH2 4.32Å; L363-W377 HydrophobicContact CD2-CZ2 4.46Å; L363-Q379 HydrophobicContact CD2-CG 4.04Å; L363-L381 HydrophobicContact CD1-CD2 4.35Å; L363-L381 HydrophobicContact CD1-CG 4.31Å; L363-L381 WeakPolarHBondContact CD1-O 3.46Å; L363-L381 HydrophobicContact CD2-CD2 4.5Å; L363-P383 HydrophobicContact CD1-CG 4.19Å |
| 364 | P | 97.2 | Very high | 96.8 | Very high | 49 Ų | 49 | 48.4 Ų | 48.4 | 32% | 0.318 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -61.8 | -24.1 | 173.5 | -23 | 34.4 | 0 | 0 | 0 | 113.8 | R360 R368 | R360-P364 WeakPolarHBondContact O-CD 3.29Å; R360-P364 WeakPolarHBondContact O-CG 3.26Å; P364-R368 VanDerWaalsContact O-CG 3.29Å; P364-R368 WeakPolarHBondContact O-CG 3.44Å; P364-R368 PolarHBondContact O-N 2.55Å; P364-R368 PolarHBondContact O-NE 2.69Å; P364-R368 VanDerWaalsContact O-NE 3.11Å |
| 365 | T | 97.4 | Very high | 96.8 | Very high | 2 Ų | 2 | 47.1 Ų | 47.1 | 1% | 0.012 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -88.3 | -33.4 | 178.9 | -47.7 | 0 | 0 | 0 | 0 | 111.3 | M291 L345 I347 M362 L363 R367 R368 W369 | M291-T365 HydrophobicContact CE-CG2 3.48Å; M291-T365 VanDerWaalsContact CE-CG2 3.48Å; L345-T365 HydrophobicContact CB-CG2 4.39Å; L345-T365 HydrophobicContact CD2-CG2 4.14Å; L345-T365 WeakPolarHBondContact O-CG2 3.33Å; I347-T365 HydrophobicContact CD1-CG2 4.3Å; I347-T365 HydrophobicContact CG1-CG2 4.46Å; I347-T365 HydrophobicContact CG2-CG2 4.04Å; I347-T365 WeakPolarHBondContact CG2-OG1 3.39Å; M362-T365 WeakPolarHBondContact O-CA 3.42Å; M362-T365 WeakPolarHBondContact O-CB 3.32Å; M362-T365 PolarHBondContact O-N 3.46Å; L363-T365 PolarHBondContact O-N 2.62Å; T365-R367 VanDerWaalsContact C-N 3.34Å; T365-R368 PolarHBondContact O-N 3.03Å; T365-R368 PolarHBondContact OG1-NH2 3Å; T365-W369 WeakPolarHBondContact O-CB 3.43Å; T365-W369 PolarHBondContact O-N 2.7Å |
| 366 | V | 97.7 | Very high | 96.6 | Very high | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -62.8 | -41.1 | 168 | -176.2 | 0 | 0 | 0 | 0 | 110.8 | V236 L239 M291 M362 L363 W369 N370 W377 | V236-V366 HydrophobicContact CG1-CG1 3.49Å; V236-V366 VanDerWaalsContact CG1-CG1 3.49Å; V236-V366 HydrophobicContact CG2-CG1 4.46Å; L239-V366 HydrophobicContact CD2-CG2 3.66Å; M291-V366 HydrophobicContact SD-CG2 3.68Å; M362-V366 PolarHBondContact O-N 2.75Å; L363-V366 PolarHBondContact O-N 3.09Å; V366-W369 PolarHBondContact O-N 3.35Å; V366-N370 WeakPolarHBondContact O-CB 3.48Å; V366-N370 PolarHBondContact O-N 3.09Å; V366-W377 HydrophobicContact CB-CH2 4.14Å; V366-W377 HydrophobicContact CB-CZ3 4.23Å; V366-W377 HydrophobicContact CG1-CE3 4.1Å; V366-W377 HydrophobicContact CG1-CH2 3.63Å; V366-W377 HydrophobicContact CG1-CZ2 4.17Å; V366-W377 HydrophobicContact CG1-CZ3 3.6Å |
| 367 | R | 97.6 | Very high | 96.6 | Very high | 110 Ų | 110 | 49.8 Ų | 49.8 | 42% | 0.415 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -59.8 | -53.2 | 172.6 | -79.4 | -169 | -78.7 | 136.3 | -2.4 | 112.4 | L363 T365 W369 N370 E371 W377 Q379 | L363-R367 PolarHBondContact O-N 2.79Å; T365-R367 VanDerWaalsContact C-N 3.34Å; R367-W369 PolarHBondContact O-N 3.18Å; R367-N370 WeakPolarHBondContact O-CB 3.34Å; R367-N370 PolarHBondContact O-N 3.44Å; R367-E371 WeakPolarHBondContact O-CB 3.5Å; R367-E371 VanDerWaalsContact O-CG 3.26Å; R367-E371 WeakPolarHBondContact O-CG 3.44Å; R367-E371 PolarHBondContact O-N 3.32Å; R367-W377 HydrophobicContact CB-CZ3 4.5Å; R367-W377 HydrophobicContact CG-CH2 4.12Å; R367-W377 HydrophobicContact CG-CZ3 3.71Å; R367-Q379 VanDerWaalsContact CD-OE1 3.3Å |
| 368 | R | 97.2 | Very high | 96.6 | Very high | 92 Ų | 92 | 55.2 Ų | 55.2 | 35% | 0.347 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -58.6 | -31.8 | 175.7 | -71.1 | 178.6 | -63.6 | 157.9 | 8.2 | 113.8 | A344 L345 P364 T365 E371 R372 | A344-R368 PolarHBondContact O-NH1 3.31Å; A344-R368 PolarHBondContact O-NH2 3.2Å; A344-R368 VanDerWaalsContact O-NH2 3.14Å; L345-R368 HydrophobicContact CD2-CB 3.83Å; P364-R368 VanDerWaalsContact O-CG 3.29Å; P364-R368 WeakPolarHBondContact O-CG 3.44Å; P364-R368 PolarHBondContact O-N 2.55Å; P364-R368 PolarHBondContact O-NE 2.69Å; P364-R368 VanDerWaalsContact O-NE 3.11Å; T365-R368 PolarHBondContact O-N 3.03Å; T365-R368 PolarHBondContact OG1-NH2 3Å; R368-E371 WeakPolarHBondContact CA-OE2 3.36Å; R368-R372 VanDerWaalsContact O-CG 3.3Å; R368-R372 WeakPolarHBondContact O-CG 3.48Å; R368-R372 PolarHBondContact O-N 3.26Å |
| 369 | W | 97.7 | Very high | 96.5 | Very high | 2 Ų | 2 | 57.2 Ų | 57.2 | 1% | 0.008 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -70.4 | -47.1 | 172.4 | -178.6 | 89.4 | 0 | 0 | 0 | 111.5 | K232 V236 F285 L288 L345 T365 V366 R367 E371 R372 E373 A375 | K232-W369 HydrophobicContact CB-CH2 3.76Å; K232-W369 HydrophobicContact CB-CZ3 4.43Å; K232-W369 HydrophobicContact CD-CH2 4.44Å; K232-W369 HydrophobicContact CG-CH2 3.81Å; K232-W369 HydrophobicContact CG-CZ2 4.36Å; V236-W369 HydrophobicContact CG2-CE3 3.73Å; V236-W369 HydrophobicContact CG2-CH2 4.12Å; V236-W369 HydrophobicContact CG2-CZ3 3.28Å; F285-W369 HydrophobicContact CB-CZ2 3.84Å; F285-W369 AromaticContact CD1-CZ2 3.82Å; F285-W369 HydrophobicContact CD1-CZ2 3.82Å; F285-W369 HydrophobicContact CD2-CZ2 4.23Å; F285-W369 HydrophobicContact CE1-CZ2 4.44Å; F285-W369 HydrophobicContact CG-CH2 4.43Å; F285-W369 AromaticContact CG-CZ2 3.7Å; F285-W369 HydrophobicContact CG-CZ2 3.7Å; L288-W369 HydrophobicContact CD1-CD2 4.1Å; L288-W369 HydrophobicContact CD1-CE3 4.1Å; L288-W369 HydrophobicContact CD1-CH2 3.63Å; L288-W369 HydrophobicContact CD1-CZ2 3.62Å; L288-W369 HydrophobicContact CD1-CZ3 3.89Å; L288-W369 HydrophobicContact CD2-CD2 3.98Å; L288-W369 HydrophobicContact CD2-CE3 4.25Å; L288-W369 HydrophobicContact CD2-CG 4.19Å; L288-W369 HydrophobicContact CG-CD2 4.1Å; L288-W369 HydrophobicContact CG-CE3 4.5Å; L288-W369 HydrophobicContact CG-CZ2 4.18Å; L345-W369 HydrophobicContact CD1-CB 4.46Å; L345-W369 HydrophobicContact CD2-CB 4.28Å; T365-W369 WeakPolarHBondContact O-CB 3.43Å; T365-W369 PolarHBondContact O-N 2.7Å; V366-W369 PolarHBondContact O-N 3.35Å; R367-W369 PolarHBondContact O-N 3.18Å; W369-E371 PolarHBondContact O-N 2.85Å; W369-R372 PolarHBondContact O-N 2.6Å; W369-E373 HydrophobicContact CD2-CB 4.34Å; W369-E373 HydrophobicContact CD2-CG 4.11Å; W369-E373 HydrophobicContact CE3-CB 4.46Å; W369-E373 HydrophobicContact CG-CG 4.43Å; W369-E373 HydrophobicContact CH2-CB 4.26Å; W369-E373 HydrophobicContact CZ2-CB 4.11Å; W369-E373 HydrophobicContact CZ2-CG 3.92Å; W369-E373 HydrophobicContact CZ3-CB 4.4Å; W369-E373 VanDerWaalsContact O-CB 3.32Å; W369-E373 WeakPolarHBondContact O-CB 3.21Å; W369-E373 WeakPolarHBondContact O-CG 3.44Å; W369-E373 PolarHBondContact O-N 2.85Å; W369-A375 HydrophobicContact CH2-CB 4.14Å; W369-A375 HydrophobicContact CZ3-CB 3.57Å |
| 370 | N | 97 | Very high | 96.5 | Very high | 27 Ų | 27 | 61 Ų | 61 | 14% | 0.144 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -61.7 | -40.2 | 178 | 176.8 | 58.9 | 0 | 0 | 0 | 112.7 | V366 R367 R372 N374 A375 W377 | V366-N370 WeakPolarHBondContact O-CB 3.48Å; V366-N370 PolarHBondContact O-N 3.09Å; R367-N370 WeakPolarHBondContact O-CB 3.34Å; R367-N370 PolarHBondContact O-N 3.44Å; N370-R372 VanDerWaalsContact C-N 3.34Å; N370-R372 PolarHBondContact O-N 3.29Å; N370-N374 VanDerWaalsContact O-CA 3.28Å; N370-N374 WeakPolarHBondContact O-CA 3.25Å; N370-N374 PolarHBondContact O-N 3.13Å; N370-A375 WeakPolarHBondContact OD1-CB 3.44Å; N370-A375 PolarHBondContact OD1-N 2.81Å; N370-W377 HydrophobicContact CB-CE3 3.87Å; N370-W377 HydrophobicContact CB-CZ3 4.46Å; N370-W377 PolarHBondContact ND2-O 2.98Å; N370-W377 PolarHBondContact OD1-N 3.16Å |
| 371 | E | 95.7 | Very high | 96.5 | Very high | 130 Ų | 130 | 56.5 Ų | 56.5 | 61% | 0.607 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -60.5 | -39.9 | 174.9 | -71.4 | 154.7 | -157.8 | 0 | 0 | 112.1 | R367 R368 W369 | R367-E371 WeakPolarHBondContact O-CB 3.5Å; R367-E371 VanDerWaalsContact O-CG 3.26Å; R367-E371 WeakPolarHBondContact O-CG 3.44Å; R367-E371 PolarHBondContact O-N 3.32Å; R368-E371 WeakPolarHBondContact CA-OE2 3.36Å; W369-E371 PolarHBondContact O-N 2.85Å |
| 372 | R | 95.5 | Very high | 96.5 | Very high | 143 Ų | 143 | 59.4 Ų | 59.4 | 54% | 0.54 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -78.2 | -39.1 | 178.7 | -71.6 | 173.8 | -179.3 | -162.4 | -2.5 | 113.1 | D342 R368 W369 N370 | D342-R372 IonicContact OD1-NH1 3.4Å; D342-R372 PolarHBondContact OD1-NH1 2.98Å; D342-R372 IonicContact OD2-CZ 2.73Å; D342-R372 IonicContact OD2-NH1 2.63Å; D342-R372 PolarHBondContact OD2-NH1 3.11Å; R368-R372 VanDerWaalsContact O-CG 3.3Å; R368-R372 WeakPolarHBondContact O-CG 3.48Å; R368-R372 PolarHBondContact O-N 3.26Å; W369-R372 PolarHBondContact O-N 2.6Å; N370-R372 VanDerWaalsContact C-N 3.34Å; N370-R372 PolarHBondContact O-N 3.29Å |
| 373 | E | 94.9 | Very high | 96.3 | Very high | 76 Ų | 76 | 61 Ų | 61 | 36% | 0.355 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -95.4 | -7 | -171.8 | -69.6 | -79.9 | -168.3 | 0 | 0 | 113.5 | K232 W369 A375 | K232-E373 HydrophobicContact CD-CB 4.24Å; K232-E373 WeakPolarHBondContact CE-OE2 3.36Å; K232-E373 PolarHBondContact NZ-O 3.47Å; K232-E373 IonicContact NZ-OE2 3.13Å; K232-E373 PolarHBondContact NZ-OE2 2.88Å; W369-E373 HydrophobicContact CD2-CB 4.34Å; W369-E373 HydrophobicContact CD2-CG 4.11Å; W369-E373 HydrophobicContact CE3-CB 4.46Å; W369-E373 HydrophobicContact CG-CG 4.43Å; W369-E373 HydrophobicContact CH2-CB 4.26Å; W369-E373 HydrophobicContact CZ2-CB 4.11Å; W369-E373 HydrophobicContact CZ2-CG 3.92Å; W369-E373 HydrophobicContact CZ3-CB 4.4Å; W369-E373 VanDerWaalsContact O-CB 3.32Å; W369-E373 WeakPolarHBondContact O-CB 3.21Å; W369-E373 WeakPolarHBondContact O-CG 3.44Å; W369-E373 PolarHBondContact O-N 2.85Å; E373-A375 PolarHBondContact O-N 2.91Å |
| 374 | N | 93.8 | Very high | 96.1 | Very high | 134 Ų | 134 | 61.4 Ų | 61.4 | 72% | 0.717 | 30% | 0.301 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 44.5 | 61 | -174.4 | -168.4 | 13.3 | 0 | 0 | 0 | 112.4 | N370 G376 | N370-N374 VanDerWaalsContact O-CA 3.28Å; N370-N374 WeakPolarHBondContact O-CA 3.25Å; N370-N374 PolarHBondContact O-N 3.13Å; N374-G376 VanDerWaalsContact C-N 3.3Å; N374-G376 PolarHBondContact O-N 3.08Å |
| 375 | A | 93.6 | Very high | 95.4 | Very high | 4 Ų | 4 | 70.6 Ų | 70.6 | 3% | 0.033 | 34% | 0.336 | C | S | . | . | trans | -82 | -5.5 | -175.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | K232 W369 N370 E373 W377 | K232-A375 HydrophobicContact CB-CB 3.64Å; K232-A375 HydrophobicContact CD-CB 4.48Å; W369-A375 HydrophobicContact CH2-CB 4.14Å; W369-A375 HydrophobicContact CZ3-CB 3.57Å; N370-A375 WeakPolarHBondContact OD1-CB 3.44Å; N370-A375 PolarHBondContact OD1-N 2.81Å; E373-A375 PolarHBondContact O-N 2.91Å; A375-W377 VanDerWaalsContact C-N 3.26Å; A375-W377 PolarHBondContact O-N 2.85Å | ||
| 376 | G | 93.5 | Very high | 95.3 | Very high | 58 Ų | 58 | 74 Ų | 74 | 60% | 0.598 | 35% | 0.352 | S | S | * | . | trans | 66.6 | 24.6 | -177.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | N374 | N374-G376 VanDerWaalsContact C-N 3.3Å; N374-G376 PolarHBondContact O-N 3.08Å | ||
| 377 | W | 97.3 | Very high | 95.1 | Very high | 10 Ų | 10 | 77.9 Ų | 77.9 | 4% | 0.038 | 37% | 0.371 | C | S | . | . | trans | -93.3 | 141.9 | 176 | 168.9 | 74.4 | 0 | 0 | 0 | 111.4 | L233 V236 E240 L363 V366 R367 N370 A375 Q379 | L233-W377 HydrophobicContact CD1-CB 3.98Å; V236-W377 HydrophobicContact CB-CB 4.37Å; V236-W377 HydrophobicContact CB-CG 4.16Å; V236-W377 HydrophobicContact CG1-CB 4.1Å; V236-W377 HydrophobicContact CG1-CD2 3.38Å; V236-W377 HydrophobicContact CG1-CE3 3.95Å; V236-W377 HydrophobicContact CG1-CG 3.45Å; V236-W377 VanDerWaalsContact CG1-CG 3.45Å; V236-W377 HydrophobicContact CG1-CZ2 4.16Å; E240-W377 WeakPolarHBondContact OE1-CZ2 3.34Å; E240-W377 PolarHBondContact OE2-NE1 2.75Å; L363-W377 HydrophobicContact CD2-CH2 4.32Å; L363-W377 HydrophobicContact CD2-CZ2 4.46Å; V366-W377 HydrophobicContact CB-CH2 4.14Å; V366-W377 HydrophobicContact CB-CZ3 4.23Å; V366-W377 HydrophobicContact CG1-CE3 4.1Å; V366-W377 HydrophobicContact CG1-CH2 3.63Å; V366-W377 HydrophobicContact CG1-CZ2 4.17Å; V366-W377 HydrophobicContact CG1-CZ3 3.6Å; R367-W377 HydrophobicContact CB-CZ3 4.5Å; R367-W377 HydrophobicContact CG-CH2 4.12Å; R367-W377 HydrophobicContact CG-CZ3 3.71Å; N370-W377 HydrophobicContact CB-CE3 3.87Å; N370-W377 HydrophobicContact CB-CZ3 4.46Å; N370-W377 PolarHBondContact ND2-O 2.98Å; N370-W377 PolarHBondContact OD1-N 3.16Å; A375-W377 VanDerWaalsContact C-N 3.26Å; A375-W377 PolarHBondContact O-N 2.85Å; W377-Q379 HydrophobicContact CH2-CB 3.6Å; W377-Q379 HydrophobicContact CH2-CG 3.75Å; W377-Q379 HydrophobicContact CZ2-CB 3.67Å; W377-Q379 HydrophobicContact CZ2-CG 3.77Å; W377-Q379 HydrophobicContact CZ3-CB 4.27Å | ||
| 378 | E | 96.4 | Very high | 95 | Very high | 169 Ų | 169 | 76.1 Ų | 76.1 | 79% | 0.79 | 37% | 0.369 | S | S | * | . | trans | -120.2 | 138.9 | 170 | -64.2 | -173.7 | 169 | 0 | 0 | 109.4 | E380 | E378-E380 PolarHBondContact O-N 2.77Š| ||
| 379 | Q | 97.3 | Very high | 94.9 | Very high | 44 Ų | 44 | 75.2 Ų | 75.2 | 21% | 0.206 | 37% | 0.37 | C | S | . | . | trans | -79.4 | 103.5 | -172.9 | -172 | -167.9 | -50.1 | 0 | 0 | 112.1 | L363 R367 W377 L381 Q382 | L363-Q379 HydrophobicContact CD2-CG 4.04Å; R367-Q379 VanDerWaalsContact CD-OE1 3.3Å; W377-Q379 HydrophobicContact CH2-CB 3.6Å; W377-Q379 HydrophobicContact CH2-CG 3.75Å; W377-Q379 HydrophobicContact CZ2-CB 3.67Å; W377-Q379 HydrophobicContact CZ2-CG 3.77Å; W377-Q379 HydrophobicContact CZ3-CB 4.27Å; Q379-L381 PolarHBondContact NE2-O 2.83Å; Q379-Q382 PolarHBondContact O-NE2 3.44Å | ||
| 380 | E | 97.7 | Very high | 94.7 | Very high | 78 Ų | 78 | 79.8 Ų | 79.8 | 36% | 0.364 | 39% | 0.393 | S | S | . | . | trans | -83.8 | -30 | 172.3 | -63.7 | -166 | -158.2 | 0 | 0 | 112.6 | L193 K196 L197 E240 E378 Q382 | L193-E380 HydrophobicContact CD1-CB 3.82Å; K196-E380 WeakPolarHBondContact CD-OE2 3.34Å; K196-E380 IonicContact NZ-OE1 3.9Å; K196-E380 PolarHBondContact NZ-OE1 3.34Å; K196-E380 IonicContact NZ-OE2 2.83Å; K196-E380 PolarHBondContact NZ-OE2 3.47Å; L197-E380 HydrophobicContact CD2-CB 4.5Å; E240-E380 PolarHBondContact OE1-N 2.89Å; E378-E380 PolarHBondContact O-N 2.77Å; E380-Q382 PolarHBondContact O-N 2.85Å; E380-Q382 VanDerWaalsContact O-N 3.1Å | ||
| 381 | L | 97.4 | Very high | 94.5 | Very high | 0 Ų | 0 | 83.3 Ų | 83.3 | 0% | 0 | 41% | 0.409 | C | S | . | . | trans | -75.3 | 103 | -176.8 | -176.3 | 63.6 | 0 | 0 | 0 | 111.2 | Y190 L193 E240 M243 I247 V359 L363 Q379 | Y190-L381 HydrophobicContact CD1-CD1 3.7Å; Y190-L381 HydrophobicContact CE1-CD1 3.63Å; L193-L381 HydrophobicContact CD2-CB 4.18Å; L193-L381 HydrophobicContact CD2-CD1 3.68Å; E240-L381 HydrophobicContact CG-CB 3.5Å; E240-L381 VanDerWaalsContact CG-CB 3.5Å; E240-L381 HydrophobicContact CG-CD2 4.11Å; E240-L381 HydrophobicContact CG-CG 4.44Å; E240-L381 VanDerWaalsContact OE1-CB 3.26Å; E240-L381 WeakPolarHBondContact OE1-CB 3.44Å; E240-L381 PolarHBondContact OE1-N 3.01Å; M243-L381 HydrophobicContact CB-CD2 3.42Å; M243-L381 VanDerWaalsContact CB-CD2 3.42Å; M243-L381 HydrophobicContact CE-CD2 4.32Å; I247-L381 HydrophobicContact CD1-CD1 4.37Å; V359-L381 HydrophobicContact CG1-CD2 3.78Å; V359-L381 HydrophobicContact CG1-CG 4.44Å; L363-L381 HydrophobicContact CD1-CD2 4.35Å; L363-L381 HydrophobicContact CD1-CG 4.31Å; L363-L381 WeakPolarHBondContact CD1-O 3.46Å; L363-L381 HydrophobicContact CD2-CD2 4.5Å; Q379-L381 PolarHBondContact NE2-O 2.83Å | ||
| 382 | Q | 96.6 | Very high | 94.4 | Very high | 115 Ų | 115 | 79.9 Ų | 79.9 | 54% | 0.537 | 40% | 0.395 | S | S | . | . | trans | -92.9 | 113.4 | 164.4 | -57 | -52.4 | -41.3 | 0 | 0 | 108.5 | Y190 Q379 E380 | Y190-Q382 VanDerWaalsContact CE1-O 3.31Å; Y190-Q382 WeakPolarHBondContact CE1-O 3.44Å; Y190-Q382 PolarHBondContact OH-O 3.22Å; Q379-Q382 PolarHBondContact O-NE2 3.44Å; E380-Q382 PolarHBondContact O-N 2.85Å; E380-Q382 VanDerWaalsContact O-N 3.1Å | ||
| 383 | P | 93.2 | Very high | 94.4 | Very high | 33 Ų | 33 | 75.1 Ų | 75.1 | 21% | 0.214 | 38% | 0.384 | C | S | . | . | trans | -63.8 | 154.8 | 174.6 | 27.5 | -32.5 | 0 | 0 | 0 | 109.8 | I247 V359 R360 L363 | I247-P383 HydrophobicContact CD1-CB 4.45Å; V359-P383 HydrophobicContact CG1-CB 4.19Å; R360-P383 HydrophobicContact CG-CB 3.9Å; R360-P383 HydrophobicContact CG-CG 3.67Å; L363-P383 HydrophobicContact CD1-CG 4.19Å | ||
| 384 | P | 92.5 | Very high | 94.3 | Very high | 13 Ų | 13 | 75 Ų | 75 | 8% | 0.084 | 39% | 0.386 | C | S | . | . | trans | -63.5 | 159.3 | 175.8 | 30.5 | -36.8 | 0 | 0 | 0 | 110.1 | Y190 I247 E356 R360 | Y190-P384 WeakPolarHBondContact OH-CD 3.36Å; Y190-P384 VanDerWaalsContact OH-N 3.16Å; I247-P384 HydrophobicContact CG2-CG 4.23Å; E356-P384 HydrophobicContact CB-CG 4.2Å; E356-P384 HydrophobicContact CG-CG 3.45Å; E356-P384 VanDerWaalsContact CG-CG 3.45Å; R360-P384 PolarHBondContact NH1-O 2.89Å | ||
| 385 | K | 82.5 | Confident | 94.4 | Very high | 242 Ų | 242 | 69.6 Ų | 69.6 | 100% | 1.052 | 36% | 0.356 | S | S | * | . | trans | -72.3 | 0 | 163.4 | -60.5 | -174.4 | 179.7 | -174.7 | 0 | 108 | R360 | R360-K385 PolarHBondContact NH1-OXT 3.38Š|
Retrieved 385 of 385 residues in 154.5 ms
(Link to these results)