| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 37.2 | Very low | 37.3 | Very low | 235 Ų | 235 | 164.8 Ų | 164.8 | 100% | 1.158 | 79% | 0.793 | S | S | * | * | 0 | 118.4 | 0 | -90 | 162.5 | 169.4 | 0 | 0 | 107.4 | |||||
| 2 | E | 36.1 | Very low | 36.8 | Very low | 176 Ų | 176 | 162.4 Ų | 162.4 | 82% | 0.822 | 79% | 0.788 | S | S | * | * | trans | 56.6 | 106.6 | 159.6 | -67.6 | 160.9 | 120.8 | 0 | 0 | 119.2 | ||||
| 3 | H | 31 | Very low | 36.2 | Very low | 171 Ų | 171 | 162.8 Ų | 162.8 | 79% | 0.792 | 80% | 0.796 | S | S | * | * | 87.4 | 90.3 | 70.1 | -86.7 | -74.2 | 0 | 0 | 0 | 116 | |||||
| 4 | T | 32.8 | Very low | 35.8 | Very low | 103 Ų | 103 | 157.4 Ų | 157.4 | 63% | 0.632 | 79% | 0.791 | S | S | * | * | 53.2 | 116.6 | 105.9 | -40.1 | 0 | 0 | 0 | 0 | 120.4 | |||||
| 5 | I | 32.8 | Very low | 35.6 | Very low | 134 Ų | 134 | 154.1 Ų | 154.1 | 69% | 0.687 | 79% | 0.789 | S | S | * | * | 66.3 | 140.2 | 128.1 | -68.2 | -178.6 | 0 | 0 | 0 | 117.2 | |||||
| 6 | R | 32.9 | Very low | 35.1 | Very low | 217 Ų | 217 | 152.1 Ų | 152.1 | 82% | 0.819 | 79% | 0.792 | S | S | * | * | cis | -175.3 | -178.9 | 9.4 | -118.5 | -170.5 | -139.3 | -153.8 | 5.3 | 108.6 | ||||
| 7 | P | 58.6 | Low | 34.9 | Very low | 109 Ų | 109 | 149.2 Ų | 149.2 | 71% | 0.708 | 80% | 0.796 | S | S | * | * | trans | -94.7 | -178.3 | -166.4 | 41.1 | -39.6 | 0 | 0 | 0 | 114.1 | ||||
| 8 | R | 33.4 | Very low | 34.7 | Very low | 239 Ų | 239 | 147.7 Ų | 147.7 | 90% | 0.902 | 80% | 0.799 | S | S | * | * | trans | -176.8 | 168.3 | 136.8 | -103.6 | -160.8 | -164.2 | -164.3 | 4.5 | 113.4 | ||||
| 9 | P | 55.3 | Low | 34.5 | Very low | 108 Ų | 108 | 144.3 Ų | 144.3 | 70% | 0.701 | 79% | 0.794 | S | S | * | * | trans | -121.9 | -154.9 | -137.7 | 43.6 | -26.4 | 0 | 0 | 0 | 112.8 | ||||
| 10 | S | 29 | Very low | 34.2 | Very low | 91 Ų | 91 | 146.9 Ų | 146.9 | 64% | 0.636 | 80% | 0.797 | S | S | * | * | trans | 111.6 | 142.3 | 157 | 80.7 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 11 | W | 31.3 | Very low | 34 | Very low | 230 Ų | 230 | 147.6 Ų | 147.6 | 87% | 0.871 | 80% | 0.799 | S | S | * | * | cis | -149.8 | 159.3 | 21.2 | -93.4 | 88.9 | 0 | 0 | 0 | 112 | ||||
| 12 | N | 31.2 | Very low | 33.7 | Very low | 136 Ų | 136 | 143.1 Ų | 143.1 | 73% | 0.727 | 78% | 0.78 | S | S | * | * | trans | -59.2 | 155.9 | 169.1 | -62.3 | -36.4 | 0 | 0 | 0 | 113.9 | ||||
| 13 | N | 29.6 | Very low | 33.5 | Very low | 167 Ų | 167 | 139.6 Ų | 139.6 | 89% | 0.893 | 78% | 0.775 | S | S | * | * | -160.7 | 134.4 | 120.7 | -103.5 | -11.6 | 0 | 0 | 0 | 113.1 | |||||
| 14 | A | 30.7 | Very low | 33.5 | Very low | 88 Ų | 88 | 141.7 Ų | 141.7 | 73% | 0.727 | 78% | 0.782 | S | S | * | * | trans | -82.9 | 147.7 | 175 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 15 | S | 31.5 | Very low | 33.6 | Very low | 108 Ų | 108 | 144.8 Ų | 144.8 | 76% | 0.755 | 79% | 0.789 | S | S | * | * | 163.3 | 106.6 | 124.1 | 45 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 16 | S | 28.9 | Very low | 33.7 | Very low | 121 Ų | 121 | 144.2 Ų | 144.2 | 85% | 0.846 | 79% | 0.794 | S | S | * | * | trans | 26.1 | 110.8 | 130.7 | 51 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 17 | A | 31.5 | Very low | 33.6 | Very low | 104 Ų | 104 | 140.9 Ų | 140.9 | 86% | 0.86 | 79% | 0.793 | S | S | * | * | trans | -150.2 | 117.1 | 136.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 18 | S | 30.9 | Very low | 32.9 | Very low | 121 Ų | 121 | 142 Ų | 142 | 85% | 0.846 | 80% | 0.797 | S | S | * | * | trans | -70.7 | 133.5 | 176.4 | 48 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 19 | A | 30.9 | Very low | 33.4 | Very low | 84 Ų | 84 | 134.6 Ų | 134.6 | 69% | 0.694 | 78% | 0.782 | S | S | * | * | trans | 173 | 148.5 | 133.5 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 20 | F | 28.4 | Very low | 32.4 | Very low | 196 Ų | 196 | 136.8 Ų | 136.8 | 86% | 0.86 | 79% | 0.788 | S | S | * | * | trans | 87.7 | 74 | 176.4 | -64.7 | -82.6 | 0 | 0 | 0 | 117.4 | ||||
| 21 | L | 31 | Very low | 33.2 | Very low | 162 Ų | 162 | 140.1 Ų | 140.1 | 85% | 0.848 | 80% | 0.797 | S | S | * | * | trans | -56.1 | 127.8 | 131.9 | -100.6 | 115.9 | 0 | 0 | 0 | 108.6 | ||||
| 22 | N | 30.2 | Very low | 33.3 | Very low | 141 Ų | 141 | 134.9 Ų | 134.9 | 75% | 0.754 | 79% | 0.79 | S | S | * | * | -161.3 | 127.3 | 128.5 | -96.6 | -16.8 | 0 | 0 | 0 | 111.8 | |||||
| 23 | S | 31.8 | Very low | 33.5 | Very low | 101 Ų | 101 | 138.8 Ų | 138.8 | 71% | 0.706 | 80% | 0.795 | S | S | * | * | trans | -51.6 | 126.8 | 170.8 | 47.8 | 0 | 0 | 0 | 0 | 113.1 | Q25 | S23-Q25 PolarHBondContact O-N 3.47Š| ||
| 24 | F | 31.1 | Very low | 33.5 | Very low | 216 Ų | 216 | 139.6 Ų | 139.6 | 95% | 0.947 | 79% | 0.793 | S | S | * | * | trans | -77.2 | 95.4 | 162.5 | -93.6 | -91.3 | 0 | 0 | 0 | 109.7 | ||||
| 25 | Q | 33.7 | Very low | 34 | Very low | 167 Ų | 167 | 142.9 Ų | 142.9 | 78% | 0.78 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -84.1 | 135.6 | 149.5 | -79.2 | -167.4 | -73.8 | 0 | 0 | 108.4 | S23 N27 | S23-Q25 PolarHBondContact O-N 3.47Å; Q25-N27 PolarHBondContact O-N 3.44Å |
| 26 | P | 36.1 | Very low | 34.1 | Very low | 123 Ų | 123 | 140.3 Ų | 140.3 | 80% | 0.799 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -76.4 | 117.9 | 161.8 | 29.4 | -27.6 | 0 | 0 | 0 | 108.8 | V28 | P26-V28 PolarHBondContact O-N 3.36Š|
| 27 | N | 29.8 | Very low | 34.2 | Very low | 147 Ų | 147 | 139.2 Ų | 139.2 | 79% | 0.786 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -73.6 | 118.9 | -178.3 | -147.7 | 16.4 | 0 | 0 | 0 | 110.2 | Q25 S29 | Q25-N27 PolarHBondContact O-N 3.44Å; N27-S29 PolarHBondContact O-N 3.35Å |
| 28 | V | 45.1 | Very low | 34.5 | Very low | 133 Ų | 133 | 139.9 Ų | 139.9 | 81% | 0.806 | 77% | 0.773 | S | S | * | * | trans | -82.8 | 104.4 | 169.4 | 172.4 | 0 | 0 | 0 | 0 | 107.8 | P26 | P26-V28 PolarHBondContact O-N 3.36Š| ||
| 29 | S | 43.9 | Very low | 35 | Very low | 83 Ų | 83 | 141.1 Ų | 141.1 | 58% | 0.58 | 77% | 0.77 | S | S | * | * | trans | -176.5 | 95.3 | 157 | 52.7 | 0 | 0 | 0 | 0 | 111.4 | N27 | N27-S29 PolarHBondContact O-N 3.35Š| ||
| 30 | N | 33.1 | Very low | 35.6 | Very low | 154 Ų | 154 | 143.6 Ų | 143.6 | 82% | 0.824 | 77% | 0.772 | S | S | * | * | trans | 178.7 | 76 | 132.7 | -90.2 | -11.4 | 0 | 0 | 0 | 109.1 | T32 | N30-T32 PolarHBondContact O-N 3.48Š| ||
| 31 | I | 45.7 | Very low | 36.6 | Very low | 161 Ų | 161 | 136.5 Ų | 136.5 | 83% | 0.826 | 75% | 0.754 | S | S | * | * | trans | -72.3 | 84.8 | 155.8 | -62.7 | 170.9 | 0 | 0 | 0 | 105.8 | ||||
| 32 | T | 34.7 | Very low | 37.9 | Very low | 119 Ų | 119 | 135.2 Ų | 135.2 | 73% | 0.73 | 75% | 0.747 | S | S | * | * | trans | -100.5 | 98.1 | 148.6 | -53.6 | 0 | 0 | 0 | 0 | 104.5 | N30 Q34 | N30-T32 PolarHBondContact O-N 3.48Å; T32-Q34 VanDerWaalsContact C-N 3.28Å; T32-Q34 PolarHBondContact O-N 3.22Å | ||
| 33 | R | 34.5 | Very low | 40.1 | Very low | 218 Ų | 218 | 134 Ų | 134 | 82% | 0.823 | 74% | 0.74 | S | S | * | * | trans | -48.9 | 100.5 | 160.7 | -101.7 | 178.6 | -175.3 | 153.8 | 1.7 | 106.5 | I35 | R33-I35 PolarHBondContact O-N 3.47Š| ||
| 34 | Q | 29.7 | Very low | 42.4 | Very low | 184 Ų | 184 | 135 Ų | 135 | 86% | 0.86 | 74% | 0.737 | S | S | * | * | trans | -61.8 | 100.4 | 150 | -93.3 | -176.4 | -37.9 | 0 | 0 | 104.9 | T32 G36 | T32-Q34 VanDerWaalsContact C-N 3.28Å; T32-Q34 PolarHBondContact O-N 3.22Å; Q34-G36 PolarHBondContact O-N 3.5Å | ||
| 35 | I | 42.1 | Very low | 44.9 | Very low | 157 Ų | 157 | 131.1 Ų | 131.1 | 81% | 0.805 | 73% | 0.726 | S | S | * | * | trans | -64.7 | 73.9 | 151.9 | -64.2 | 167.3 | 0 | 0 | 0 | 104.4 | R33 S37 | R33-I35 PolarHBondContact O-N 3.47Å; I35-S37 PolarHBondContact O-N 3.33Å | ||
| 36 | G | 32.3 | Very low | 47.2 | Very low | 54 Ų | 54 | 127.6 Ų | 127.6 | 56% | 0.557 | 71% | 0.71 | S | S | * | * | trans | -79.3 | 103.2 | 164.8 | 0 | 0 | 0 | 0 | 0 | 105.5 | Q34 | Q34-G36 PolarHBondContact O-N 3.5Š| ||
| 37 | S | 31 | Very low | 49.6 | Very low | 98 Ų | 98 | 124.3 Ų | 124.3 | 69% | 0.685 | 69% | 0.687 | S | S | * | * | trans | 39.2 | 106.5 | 157 | 54.4 | 0 | 0 | 0 | 0 | 116.2 | I35 D39 | I35-S37 PolarHBondContact O-N 3.33Å; S37-D39 VanDerWaalsContact C-N 3.28Å; S37-D39 PolarHBondContact O-N 2.93Å | ||
| 38 | T | 37.9 | Very low | 52.4 | Low | 118 Ų | 118 | 122 Ų | 122 | 72% | 0.724 | 68% | 0.675 | S | S | * | * | trans | -39.2 | 100.1 | 141.6 | 14.7 | 0 | 0 | 0 | 0 | 108.9 | N40 | T38-N40 PolarHBondContact O-N 3.42Š| ||
| 39 | D | 41.2 | Very low | 54.5 | Low | 147 Ų | 147 | 117 Ų | 117 | 79% | 0.786 | 65% | 0.65 | S | S | * | * | trans | -71.8 | 76.4 | 165.3 | -153.9 | 1.2 | 0 | 0 | 0 | 105.8 | S37 G41 | S37-D39 VanDerWaalsContact C-N 3.28Å; S37-D39 PolarHBondContact O-N 2.93Å; D39-G41 PolarHBondContact O-N 3.43Å | ||
| 40 | N | 45 | Very low | 56.7 | Low | 136 Ų | 136 | 115.2 Ų | 115.2 | 73% | 0.727 | 63% | 0.634 | S | S | * | * | trans | -78.1 | 23.8 | 171.9 | -72.6 | -13.3 | 0 | 0 | 0 | 110.5 | T38 I42 | T38-N40 PolarHBondContact O-N 3.42Å; N40-I42 PolarHBondContact O-N 3.46Å | ||
| 41 | G | 48.5 | Very low | 59.5 | Low | 47 Ų | 47 | 111.1 Ų | 111.1 | 49% | 0.485 | 62% | 0.616 | S | S | . | * | trans | -79.4 | 93.1 | 159.9 | 0 | 0 | 0 | 0 | 0 | 107.7 | D39 D43 | D39-G41 PolarHBondContact O-N 3.43Å; G41-D43 PolarHBondContact O-N 3.42Å | ||
| 42 | I | 58.6 | Low | 61.7 | Low | 136 Ų | 136 | 105.9 Ų | 105.9 | 70% | 0.697 | 60% | 0.597 | S | S | * | * | trans | -55.6 | 119.7 | 160.9 | -52.7 | 173.3 | 0 | 0 | 0 | 105.6 | N40 L44 T47 | N40-I42 PolarHBondContact O-N 3.46Å; I42-L44 PolarHBondContact O-N 2.84Å; I42-T47 WeakPolarHBondContact CG2-OG1 3.34Å | ||
| 43 | D | 75.8 | Confident | 64.5 | Low | 114 Ų | 114 | 102 Ų | 102 | 61% | 0.61 | 57% | 0.571 | S | S | * | * | trans | -49 | 107.4 | 177.8 | -86.8 | -37.5 | 0 | 0 | 0 | 109.1 | G41 N45 Q46 T47 | G41-D43 PolarHBondContact O-N 3.42Å; D43-N45 PolarHBondContact O-N 2.83Å; D43-N45 VanDerWaalsContact O-N 3.13Å; D43-Q46 HydrophobicContact CB-CB 3.83Å; D43-Q46 WeakPolarHBondContact O-CB 3.43Å; D43-Q46 PolarHBondContact O-N 3.39Å; D43-T47 PolarHBondContact O-N 2.9Å; D43-T47 PolarHBondContact O-OG1 3.36Å | ||
| 44 | L | 81.4 | Confident | 67.4 | Low | 124 Ų | 124 | 95.6 Ų | 95.6 | 65% | 0.649 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -55.1 | -38.3 | -173.2 | 177.5 | 62.9 | 0 | 0 | 0 | 110.8 | I42 T47 L48 | I42-L44 PolarHBondContact O-N 2.84Å; L44-T47 PolarHBondContact O-N 3.31Å; L44-L48 HydrophobicContact CD1-CD1 4.19Å; L44-L48 HydrophobicContact CD1-CG 4.3Å; L44-L48 HydrophobicContact CG-CD1 3.88Å; L44-L48 HydrophobicContact CG-CG 4.44Å; L44-L48 WeakPolarHBondContact O-CB 3.27Å; L44-L48 WeakPolarHBondContact O-CD1 3.32Å; L44-L48 WeakPolarHBondContact O-CG 3.46Å; L44-L48 PolarHBondContact O-N 2.77Å |
| 45 | N | 82.1 | Confident | 70.5 | Confident | 134 Ų | 134 | 90.7 Ų | 90.7 | 72% | 0.717 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -65.6 | -38.8 | 177.3 | -64.8 | -20.5 | 0 | 0 | 0 | 112.6 | D43 G49 | D43-N45 PolarHBondContact O-N 2.83Å; D43-N45 VanDerWaalsContact O-N 3.13Å; N45-G49 PolarHBondContact O-N 2.83Å |
| 46 | Q | 82.4 | Confident | 73.1 | Confident | 92 Ų | 92 | 85.1 Ų | 85.1 | 43% | 0.43 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -69.2 | -40.4 | 177.3 | -167.9 | -178.5 | 23.6 | 0 | 0 | 110.8 | D43 G49 L50 | D43-Q46 HydrophobicContact CB-CB 3.83Å; D43-Q46 WeakPolarHBondContact O-CB 3.43Å; D43-Q46 PolarHBondContact O-N 3.39Å; Q46-G49 PolarHBondContact O-N 3.38Å; Q46-L50 WeakPolarHBondContact O-CG 3.28Å; Q46-L50 PolarHBondContact O-N 2.93Å |
| 47 | T | 86.8 | Confident | 76.2 | Confident | 54 Ų | 54 | 83.6 Ų | 83.6 | 33% | 0.331 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -64 | -48.1 | 175.6 | -53.6 | 0 | 0 | 0 | 0 | 111.4 | I42 D43 L44 G49 L50 C51 | I42-T47 WeakPolarHBondContact CG2-OG1 3.34Å; D43-T47 PolarHBondContact O-N 2.9Å; D43-T47 PolarHBondContact O-OG1 3.36Å; L44-T47 PolarHBondContact O-N 3.31Å; T47-G49 VanDerWaalsContact C-N 3.29Å; T47-G49 PolarHBondContact O-N 2.88Å; T47-L50 PolarHBondContact O-N 3.38Å; T47-C51 PolarHBondContact O-N 2.85Å; T47-C51 PolarHBondContact O-SG 3.36Å; T47-C51 VanDerWaalsContact O-SG 3.32Å |
| 48 | L | 89.3 | Confident | 79.3 | Confident | 100 Ų | 100 | 83.7 Ų | 83.7 | 52% | 0.524 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -59.2 | -41.9 | 175.7 | -74.5 | 167.6 | 0 | 0 | 0 | 111.5 | L44 C51 A52 | L44-L48 HydrophobicContact CD1-CD1 4.19Å; L44-L48 HydrophobicContact CD1-CG 4.3Å; L44-L48 HydrophobicContact CG-CD1 3.88Å; L44-L48 HydrophobicContact CG-CG 4.44Å; L44-L48 WeakPolarHBondContact O-CB 3.27Å; L44-L48 WeakPolarHBondContact O-CD1 3.32Å; L44-L48 WeakPolarHBondContact O-CG 3.46Å; L44-L48 PolarHBondContact O-N 2.77Å; L48-C51 PolarHBondContact O-N 3.43Å; L48-A52 WeakPolarHBondContact O-CB 3.23Å; L48-A52 PolarHBondContact O-N 2.74Å |
| 49 | G | 88.9 | Confident | 82.1 | Confident | 27 Ų | 27 | 82.6 Ų | 82.6 | 28% | 0.278 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -58.4 | -50.8 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | N45 Q46 T47 C51 A52 M53 | N45-G49 PolarHBondContact O-N 2.83Å; Q46-G49 PolarHBondContact O-N 3.38Å; T47-G49 VanDerWaalsContact C-N 3.29Å; T47-G49 PolarHBondContact O-N 2.88Å; G49-C51 PolarHBondContact O-N 3.19Å; G49-A52 PolarHBondContact O-N 2.92Å; G49-M53 VanDerWaalsContact O-CG 3.25Å; G49-M53 WeakPolarHBondContact O-CG 3.3Å; G49-M53 PolarHBondContact O-N 2.66Å |
| 50 | L | 89.1 | Confident | 84.8 | Confident | 46 Ų | 46 | 75.6 Ų | 75.6 | 24% | 0.241 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -62.6 | -40.9 | 178.4 | -71.3 | 168.5 | 0 | 0 | 0 | 112.5 | Q46 T47 M53 L54 M102 | Q46-L50 WeakPolarHBondContact O-CG 3.28Å; Q46-L50 PolarHBondContact O-N 2.93Å; T47-L50 PolarHBondContact O-N 3.38Å; L50-M53 HydrophobicContact CD2-CE 3.83Å; L50-M53 HydrophobicContact CD2-SD 4.41Å; L50-M53 HydrophobicContact CG-CE 4.21Å; L50-M53 WeakPolarHBondContact O-CB 3.2Å; L50-M53 PolarHBondContact O-N 3.11Å; L50-L54 WeakPolarHBondContact O-CG 3.27Å; L50-L54 PolarHBondContact O-N 3.01Å; L50-M102 HydrophobicContact CD2-CE 4.23Å |
| 51 | C | 91.9 | Very high | 87.3 | Confident | 68 Ų | 68 | 70.9 Ų | 70.9 | 46% | 0.459 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -61.4 | -44 | 174 | -71.1 | 0 | 0 | 0 | 0 | 111.6 | T47 L48 G49 L54 V55 | T47-C51 PolarHBondContact O-N 2.85Å; T47-C51 PolarHBondContact O-SG 3.36Å; T47-C51 VanDerWaalsContact O-SG 3.32Å; L48-C51 PolarHBondContact O-N 3.43Å; G49-C51 PolarHBondContact O-N 3.19Å; C51-L54 PolarHBondContact O-N 2.92Å; C51-V55 VanDerWaalsContact O-CG2 3.28Å; C51-V55 WeakPolarHBondContact O-CG2 3.07Å; C51-V55 PolarHBondContact O-N 3.16Å |
| 52 | A | 92.9 | Very high | 89.6 | Confident | 51 Ų | 51 | 73 Ų | 73 | 42% | 0.421 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -63.7 | -42.8 | 177 | 0 | 0 | 0 | 0 | 0 | 112 | L48 G49 V55 M56 | L48-A52 WeakPolarHBondContact O-CB 3.23Å; L48-A52 PolarHBondContact O-N 2.74Å; G49-A52 PolarHBondContact O-N 2.92Å; A52-V55 PolarHBondContact O-N 2.87Å; A52-M56 WeakPolarHBondContact O-CG 3.4Å; A52-M56 PolarHBondContact O-N 3.16Å |
| 53 | M | 93.6 | Very high | 91.3 | Very high | 37 Ų | 37 | 67.4 Ų | 67.4 | 18% | 0.182 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -57.3 | -49.4 | 173.9 | -71.5 | -175.6 | -113 | 0 | 0 | 112 | G49 L50 V55 M56 D57 M102 W338 | G49-M53 VanDerWaalsContact O-CG 3.25Å; G49-M53 WeakPolarHBondContact O-CG 3.3Å; G49-M53 PolarHBondContact O-N 2.66Å; L50-M53 HydrophobicContact CD2-CE 3.83Å; L50-M53 HydrophobicContact CD2-SD 4.41Å; L50-M53 HydrophobicContact CG-CE 4.21Å; L50-M53 WeakPolarHBondContact O-CB 3.2Å; L50-M53 PolarHBondContact O-N 3.11Å; M53-V55 PolarHBondContact O-N 3.37Å; M53-M56 PolarHBondContact O-N 2.92Å; M53-D57 PolarHBondContact O-N 2.96Å; M53-M102 HydrophobicContact CB-CE 4.04Å; M53-M102 HydrophobicContact CB-CG 4.16Å; M53-M102 HydrophobicContact CB-SD 4.25Å; M53-M102 HydrophobicContact SD-CG 4.16Å; M53-W338 HydrophobicContact CB-CD2 4.33Å; M53-W338 HydrophobicContact CB-CE3 4.07Å; M53-W338 HydrophobicContact CB-CH2 3.48Å; M53-W338 VanDerWaalsContact CB-CH2 3.48Å; M53-W338 HydrophobicContact CB-CZ2 3.81Å; M53-W338 HydrophobicContact CB-CZ3 3.6Å; M53-W338 HydrophobicContact CG-CD2 3.52Å; M53-W338 VanDerWaalsContact CG-CE2 3.42Å; M53-W338 HydrophobicContact CG-CE3 3.69Å; M53-W338 HydrophobicContact CG-CG 4.17Å; M53-W338 HydrophobicContact CG-CH2 3.69Å; M53-W338 HydrophobicContact CG-CZ2 3.55Å; M53-W338 HydrophobicContact CG-CZ3 3.74Å; M53-W338 HydrophobicContact SD-CD2 3.9Å; M53-W338 HydrophobicContact SD-CG 4.39Å; M53-W338 HydrophobicContact SD-CH2 4Å; M53-W338 HydrophobicContact SD-CZ2 3.27Å; M53-W338 WeakPolarHBondContact SD-CZ2 3.21Å; M53-W338 PolarHBondContact SD-NE1 2.67Å |
| 54 | L | 94.8 | Very high | 92.3 | Very high | 83 Ų | 83 | 62 Ų | 62 | 44% | 0.435 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -60.3 | -44.7 | 176.9 | -76.9 | 172.5 | 0 | 0 | 0 | 112.4 | L50 C51 M56 D57 I58 M102 | L50-L54 WeakPolarHBondContact O-CG 3.27Å; L50-L54 PolarHBondContact O-N 3.01Å; C51-L54 PolarHBondContact O-N 2.92Å; L54-M56 VanDerWaalsContact C-N 3.34Å; L54-M56 PolarHBondContact O-N 3.06Å; L54-D57 PolarHBondContact O-N 3.47Å; L54-I58 VanDerWaalsContact O-CG1 3.3Å; L54-I58 WeakPolarHBondContact O-CG1 3.29Å; L54-I58 PolarHBondContact O-N 2.98Å; L54-M102 HydrophobicContact CB-CE 4.45Å; L54-M102 HydrophobicContact CD1-CE 4.34Å; L54-M102 HydrophobicContact CD2-CE 3.43Å; L54-M102 VanDerWaalsContact CD2-CE 3.43Å; L54-M102 HydrophobicContact CD2-SD 3.83Å; L54-M102 HydrophobicContact CG-CE 3.41Å; L54-M102 VanDerWaalsContact CG-CE 3.41Å; L54-M102 HydrophobicContact CG-SD 4.28Å |
| 55 | V | 95.9 | Very high | 93 | Very high | 82 Ų | 82 | 59.5 Ų | 59.5 | 50% | 0.497 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -62.8 | -43.6 | 178.6 | 169.7 | 0 | 0 | 0 | 0 | 110.4 | C51 A52 M53 D57 I58 L59 | C51-V55 VanDerWaalsContact O-CG2 3.28Å; C51-V55 WeakPolarHBondContact O-CG2 3.07Å; C51-V55 PolarHBondContact O-N 3.16Å; A52-V55 PolarHBondContact O-N 2.87Å; M53-V55 PolarHBondContact O-N 3.37Å; V55-D57 VanDerWaalsContact C-N 3.32Å; V55-D57 PolarHBondContact O-N 3.12Å; V55-I58 PolarHBondContact O-N 3.28Å; V55-L59 HydrophobicContact CG1-CD1 3.86Å; V55-L59 HydrophobicContact CG1-CG 4.36Å; V55-L59 WeakPolarHBondContact O-CB 3.49Å; V55-L59 WeakPolarHBondContact O-CG 3.31Å; V55-L59 PolarHBondContact O-N 3.31Å |
| 56 | M | 95.6 | Very high | 93.6 | Very high | 39 Ų | 39 | 54.5 Ų | 54.5 | 19% | 0.192 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -61.5 | -40.1 | 176.1 | -74.4 | -172 | -68.9 | 0 | 0 | 112.6 | A52 M53 L54 L59 A60 M98 W338 F342 T345 | A52-M56 WeakPolarHBondContact O-CG 3.4Å; A52-M56 PolarHBondContact O-N 3.16Å; M53-M56 PolarHBondContact O-N 2.92Å; L54-M56 VanDerWaalsContact C-N 3.34Å; L54-M56 PolarHBondContact O-N 3.06Å; M56-L59 PolarHBondContact O-N 3.47Å; M56-A60 WeakPolarHBondContact O-CB 3.38Å; M56-A60 PolarHBondContact O-N 3.48Å; M56-M98 HydrophobicContact CB-CE 4.23Å; M56-W338 HydrophobicContact CE-CB 4.45Å; M56-W338 HydrophobicContact CE-CD2 4.37Å; M56-W338 HydrophobicContact CE-CE3 3.55Å; M56-W338 HydrophobicContact CE-CZ3 4.17Å; M56-F342 HydrophobicContact SD-CD2 4.2Å; M56-T345 PolarHBondContact O-OG1 3.23Å |
| 57 | D | 96.7 | Very high | 94.1 | Very high | 22 Ų | 22 | 50.2 Ų | 50.2 | 12% | 0.118 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -65.8 | -48.9 | 178.1 | -171.9 | 41 | 0 | 0 | 0 | 111.9 | M53 L54 V55 L59 A60 V61 M98 | M53-D57 PolarHBondContact O-N 2.96Å; L54-D57 PolarHBondContact O-N 3.47Å; V55-D57 VanDerWaalsContact C-N 3.32Å; V55-D57 PolarHBondContact O-N 3.12Å; D57-L59 VanDerWaalsContact C-N 3.3Å; D57-L59 PolarHBondContact O-N 2.92Å; D57-A60 WeakPolarHBondContact O-CB 3.32Å; D57-A60 PolarHBondContact O-N 3.08Å; D57-V61 WeakPolarHBondContact O-CG2 3.44Å; D57-V61 PolarHBondContact O-N 3.18Å; D57-M98 HydrophobicContact CB-CE 3.93Å; D57-M98 WeakPolarHBondContact OD1-CB 3.42Å |
| 58 | I | 97.3 | Very high | 94.5 | Very high | 100 Ų | 100 | 49.1 Ų | 49.1 | 51% | 0.513 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -58.1 | -44.5 | 175.7 | -67.2 | 166.4 | 0 | 0 | 0 | 110.7 | L54 V55 A60 V61 V62 | L54-I58 VanDerWaalsContact O-CG1 3.3Å; L54-I58 WeakPolarHBondContact O-CG1 3.29Å; L54-I58 PolarHBondContact O-N 2.98Å; V55-I58 PolarHBondContact O-N 3.28Å; I58-A60 VanDerWaalsContact C-N 3.32Å; I58-A60 PolarHBondContact O-N 2.93Å; I58-V61 PolarHBondContact O-N 2.96Å; I58-V62 HydrophobicContact CG2-CG2 4.23Å; I58-V62 WeakPolarHBondContact O-CB 3.4Å; I58-V62 VanDerWaalsContact O-CG2 3.29Å; I58-V62 WeakPolarHBondContact O-CG2 3.42Å; I58-V62 PolarHBondContact O-N 3.29Å |
| 59 | L | 96.8 | Very high | 94.7 | Very high | 96 Ų | 96 | 48.1 Ų | 48.1 | 50% | 0.503 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -63.3 | -38.4 | 177 | -72.3 | 172.6 | 0 | 0 | 0 | 111.9 | V55 M56 D57 G63 T345 | V55-L59 HydrophobicContact CG1-CD1 3.86Å; V55-L59 HydrophobicContact CG1-CG 4.36Å; V55-L59 WeakPolarHBondContact O-CB 3.49Å; V55-L59 WeakPolarHBondContact O-CG 3.31Å; V55-L59 PolarHBondContact O-N 3.31Å; M56-L59 PolarHBondContact O-N 3.47Å; D57-L59 VanDerWaalsContact C-N 3.3Å; D57-L59 PolarHBondContact O-N 2.92Å; L59-G63 WeakPolarHBondContact O-CA 3.37Å; L59-G63 PolarHBondContact O-N 3.24Å; L59-T345 HydrophobicContact CB-CG2 3.57Å; L59-T345 HydrophobicContact CD1-CG2 4.46Å |
| 60 | A | 96.9 | Very high | 94.8 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -64.2 | -47.5 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | M56 D57 I58 N64 A94 M98 | M56-A60 WeakPolarHBondContact O-CB 3.38Å; M56-A60 PolarHBondContact O-N 3.48Å; D57-A60 WeakPolarHBondContact O-CB 3.32Å; D57-A60 PolarHBondContact O-N 3.08Å; I58-A60 VanDerWaalsContact C-N 3.32Å; I58-A60 PolarHBondContact O-N 2.93Å; A60-N64 VanDerWaalsContact O-CB 3.3Å; A60-N64 WeakPolarHBondContact O-CB 3.47Å; A60-N64 PolarHBondContact O-N 3.21Å; A60-N64 PolarHBondContact O-ND2 3.1Å; A60-A94 HydrophobicContact CB-CB 3.81Å; A60-M98 HydrophobicContact CB-SD 4.23Å |
| 61 | V | 97.9 | Very high | 95 | Very high | 37 Ų | 37 | 45 Ų | 45 | 22% | 0.224 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -60.9 | -53.8 | 177.8 | 174.3 | 0 | 0 | 0 | 0 | 110.8 | D57 I58 L65 L91 A94 L95 | D57-V61 WeakPolarHBondContact O-CG2 3.44Å; D57-V61 PolarHBondContact O-N 3.18Å; I58-V61 PolarHBondContact O-N 2.96Å; V61-L65 WeakPolarHBondContact O-CB 3.25Å; V61-L65 PolarHBondContact O-N 2.97Å; V61-L91 HydrophobicContact CB-CD1 4.42Å; V61-L91 HydrophobicContact CG1-CD1 4.08Å; V61-L91 HydrophobicContact CG2-CD1 4.46Å; V61-A94 HydrophobicContact CG2-CB 3.76Å; V61-L95 HydrophobicContact CG2-CD2 4.13Å |
| 62 | V | 96.6 | Very high | 94.9 | Very high | 90 Ų | 90 | 45 Ų | 45 | 55% | 0.545 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -64 | -45.7 | -176.6 | 173.4 | 0 | 0 | 0 | 0 | 111.1 | I58 A66 | I58-V62 HydrophobicContact CG2-CG2 4.23Å; I58-V62 WeakPolarHBondContact O-CB 3.4Å; I58-V62 VanDerWaalsContact O-CG2 3.29Å; I58-V62 WeakPolarHBondContact O-CG2 3.42Å; I58-V62 PolarHBondContact O-N 3.29Å; V62-A66 WeakPolarHBondContact O-CB 3.26Å; V62-A66 PolarHBondContact O-N 3.08Å |
| 63 | G | 95.3 | Very high | 94.8 | Very high | 20 Ų | 20 | 49.9 Ų | 49.9 | 21% | 0.206 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -64 | -49.4 | -178 | 0 | 0 | 0 | 0 | 0 | 112.7 | L59 A66 V67 P348 | L59-G63 WeakPolarHBondContact O-CA 3.37Å; L59-G63 PolarHBondContact O-N 3.24Å; G63-A66 PolarHBondContact O-N 3.31Å; G63-V67 WeakPolarHBondContact O-CG2 3.27Å; G63-V67 PolarHBondContact O-N 2.87Å; G63-V67 VanDerWaalsContact O-N 3.14Å; G63-P348 VanDerWaalsContact C-CG 3.49Å |
| 64 | N | 96.9 | Very high | 94.5 | Very high | 0 Ų | 0 | 48.5 Ų | 48.5 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -67.3 | -40.5 | -179.6 | -74.9 | -66.5 | 0 | 0 | 0 | 111.7 | A60 V67 M68 C87 D90 L91 F344 P348 | A60-N64 VanDerWaalsContact O-CB 3.3Å; A60-N64 WeakPolarHBondContact O-CB 3.47Å; A60-N64 PolarHBondContact O-N 3.21Å; A60-N64 PolarHBondContact O-ND2 3.1Å; N64-V67 PolarHBondContact O-N 3.1Å; N64-M68 VanDerWaalsContact O-CB 3.25Å; N64-M68 WeakPolarHBondContact O-CB 3.49Å; N64-M68 PolarHBondContact O-N 3.03Å; N64-C87 HydrophobicContact CB-CB 4.24Å; N64-C87 WeakPolarHBondContact OD1-CA 3.32Å; N64-D90 WeakPolarHBondContact OD1-CB 3.31Å; N64-L91 HydrophobicContact CB-CB 4.31Å; N64-F344 PolarHBondContact ND2-O 3.24Å; N64-P348 HydrophobicContact CB-CG 4.29Å; N64-P348 VanDerWaalsContact CG-CG 3.48Å; N64-P348 VanDerWaalsContact OD1-CG 3.25Å; N64-P348 WeakPolarHBondContact OD1-CG 3.33Å |
| 65 | L | 96.1 | Very high | 94.1 | Very high | 72 Ų | 72 | 48.6 Ų | 48.6 | 38% | 0.377 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -63.8 | -43.5 | 175.7 | -176.8 | 60.4 | 0 | 0 | 0 | 111.9 | V61 V67 M68 I69 | V61-L65 WeakPolarHBondContact O-CB 3.25Å; V61-L65 PolarHBondContact O-N 2.97Å; L65-V67 PolarHBondContact O-N 3.5Å; L65-M68 HydrophobicContact CD1-CE 3.6Å; L65-M68 PolarHBondContact O-N 2.76Å; L65-I69 HydrophobicContact CD1-CD1 4Å; L65-I69 HydrophobicContact CD1-CG1 4.17Å; L65-I69 HydrophobicContact CD2-CD1 4.47Å; L65-I69 HydrophobicContact CG-CD1 3.8Å; L65-I69 HydrophobicContact CG-CG1 4.39Å; L65-I69 WeakPolarHBondContact O-CB 3.34Å; L65-I69 VanDerWaalsContact O-CG1 3.27Å; L65-I69 WeakPolarHBondContact O-CG1 3.25Å; L65-I69 PolarHBondContact O-N 3.36Å |
| 66 | A | 93.8 | Very high | 93.6 | Very high | 28 Ų | 28 | 52.2 Ų | 52.2 | 23% | 0.231 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -60.4 | -46.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112 | V62 G63 M68 I69 V70 L362 | V62-A66 WeakPolarHBondContact O-CB 3.26Å; V62-A66 PolarHBondContact O-N 3.08Å; G63-A66 PolarHBondContact O-N 3.31Å; A66-M68 VanDerWaalsContact C-N 3.35Å; A66-I69 PolarHBondContact O-N 3.25Å; A66-V70 WeakPolarHBondContact O-CG2 3.45Å; A66-V70 PolarHBondContact O-N 3.05Å; A66-L362 HydrophobicContact CB-CD1 4.18Å |
| 67 | V | 94.4 | Very high | 93 | Very high | 3 Ų | 3 | 50.6 Ų | 50.6 | 2% | 0.018 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -63.1 | -43.1 | 176.6 | 174.6 | 0 | 0 | 0 | 0 | 110.9 | G63 N64 L65 I69 V70 I71 V83 P348 I358 | G63-V67 WeakPolarHBondContact O-CG2 3.27Å; G63-V67 PolarHBondContact O-N 2.87Å; G63-V67 VanDerWaalsContact O-N 3.14Å; N64-V67 PolarHBondContact O-N 3.1Å; L65-V67 PolarHBondContact O-N 3.5Å; V67-I69 PolarHBondContact O-N 3.31Å; V67-V70 PolarHBondContact O-N 3.05Å; V67-I71 HydrophobicContact CG1-CD1 3.78Å; V67-I71 HydrophobicContact CG1-CG1 4.44Å; V67-I71 WeakPolarHBondContact O-CG1 3.3Å; V67-I71 PolarHBondContact O-N 3.35Å; V67-V83 HydrophobicContact CG1-CG1 4.34Å; V67-P348 HydrophobicContact CG2-CB 3.96Å; V67-I358 HydrophobicContact CG1-CG2 4.42Å |
| 68 | M | 94.6 | Very high | 92.4 | Very high | 30 Ų | 30 | 57.4 Ų | 57.4 | 15% | 0.148 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -61.3 | -43.1 | 177.9 | -168.6 | 172.2 | 57.6 | 0 | 0 | 112.4 | N64 L65 A66 I71 T72 F84 C87 L91 | N64-M68 VanDerWaalsContact O-CB 3.25Å; N64-M68 WeakPolarHBondContact O-CB 3.49Å; N64-M68 PolarHBondContact O-N 3.03Å; L65-M68 HydrophobicContact CD1-CE 3.6Å; L65-M68 PolarHBondContact O-N 2.76Å; A66-M68 VanDerWaalsContact C-N 3.35Å; M68-I71 PolarHBondContact O-N 3.32Å; M68-T72 VanDerWaalsContact O-CG2 3.32Å; M68-T72 WeakPolarHBondContact O-CG2 3.48Å; M68-T72 PolarHBondContact O-N 2.96Å; M68-T72 PolarHBondContact O-OG1 3.03Å; M68-F84 HydrophobicContact CB-CE2 4.5Å; M68-F84 HydrophobicContact CG-CD2 3.75Å; M68-F84 HydrophobicContact CG-CE2 3.25Å; M68-F84 HydrophobicContact CG-CZ 3.97Å; M68-F84 HydrophobicContact SD-CE2 3.98Å; M68-F84 HydrophobicContact SD-CZ 4.08Å; M68-C87 HydrophobicContact CB-CB 4.46Å; M68-L91 HydrophobicContact CE-CD2 3.7Å |
| 69 | I | 92.8 | Very high | 91.8 | Very high | 79 Ų | 79 | 58.6 Ų | 58.6 | 41% | 0.405 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -63.3 | -43.6 | 176 | -70.5 | 168.3 | 0 | 0 | 0 | 111 | L65 A66 V67 I71 T72 K73 | L65-I69 HydrophobicContact CD1-CD1 4Å; L65-I69 HydrophobicContact CD1-CG1 4.17Å; L65-I69 HydrophobicContact CD2-CD1 4.47Å; L65-I69 HydrophobicContact CG-CD1 3.8Å; L65-I69 HydrophobicContact CG-CG1 4.39Å; L65-I69 WeakPolarHBondContact O-CB 3.34Å; L65-I69 VanDerWaalsContact O-CG1 3.27Å; L65-I69 WeakPolarHBondContact O-CG1 3.25Å; L65-I69 PolarHBondContact O-N 3.36Å; A66-I69 PolarHBondContact O-N 3.25Å; V67-I69 PolarHBondContact O-N 3.31Å; I69-I71 PolarHBondContact O-N 3.46Å; I69-T72 WeakPolarHBondContact CA-OG1 3.37Å; I69-T72 PolarHBondContact O-N 3.32Å; I69-T72 PolarHBondContact O-OG1 3.45Å; I69-K73 HydrophobicContact CG2-CG 4.19Å; I69-K73 WeakPolarHBondContact O-CB 3.4Å; I69-K73 VanDerWaalsContact O-CG 3.31Å; I69-K73 WeakPolarHBondContact O-CG 3.35Å; I69-K73 PolarHBondContact O-N 3.38Å |
| 70 | V | 92 | Very high | 91.4 | Very high | 3 Ų | 3 | 55.6 Ų | 55.6 | 2% | 0.018 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -62.2 | -45.1 | 178.7 | 169.3 | 0 | 0 | 0 | 0 | 111.1 | A66 V67 T72 K73 T74 L77 I358 E361 L362 | A66-V70 WeakPolarHBondContact O-CG2 3.45Å; A66-V70 PolarHBondContact O-N 3.05Å; V67-V70 PolarHBondContact O-N 3.05Å; V70-T72 PolarHBondContact O-N 3.3Å; V70-K73 PolarHBondContact O-N 3.47Å; V70-T74 WeakPolarHBondContact O-CB 3.33Å; V70-T74 PolarHBondContact O-N 3.44Å; V70-T74 PolarHBondContact O-OG1 3.28Å; V70-L77 HydrophobicContact CG1-CD1 3.63Å; V70-I358 HydrophobicContact CG1-CG2 4.42Å; V70-E361 HydrophobicContact CG1-CB 3.64Å; V70-L362 HydrophobicContact CG2-CB 4.1Å; V70-L362 HydrophobicContact CG2-CD1 3.69Å |
| 71 | I | 91.8 | Very high | 91.1 | Very high | 5 Ų | 5 | 57 Ų | 57 | 3% | 0.026 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -64.3 | -39.9 | 179.2 | -66.1 | 169.1 | 0 | 0 | 0 | 111.5 | V67 M68 I69 L77 V83 F84 | V67-I71 HydrophobicContact CG1-CD1 3.78Å; V67-I71 HydrophobicContact CG1-CG1 4.44Å; V67-I71 WeakPolarHBondContact O-CG1 3.3Å; V67-I71 PolarHBondContact O-N 3.35Å; M68-I71 PolarHBondContact O-N 3.32Å; I69-I71 PolarHBondContact O-N 3.46Å; I71-L77 HydrophobicContact CG1-CB 4.46Å; I71-L77 HydrophobicContact CG2-CB 4.49Å; I71-V83 HydrophobicContact CD1-CB 4.35Å; I71-V83 HydrophobicContact CD1-CG1 4.05Å; I71-F84 HydrophobicContact CB-CD2 4.43Å; I71-F84 HydrophobicContact CD1-CB 4.31Å; I71-F84 HydrophobicContact CG2-CB 4.23Å; I71-F84 HydrophobicContact CG2-CD2 4.15Å |
| 72 | T | 91.1 | Very high | 91 | Very high | 67 Ų | 67 | 55.4 Ų | 55.4 | 41% | 0.411 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -71.2 | -38.6 | -179.6 | 50.5 | 0 | 0 | 0 | 0 | 112.8 | M68 I69 V70 F84 | M68-T72 VanDerWaalsContact O-CG2 3.32Å; M68-T72 WeakPolarHBondContact O-CG2 3.48Å; M68-T72 PolarHBondContact O-N 2.96Å; M68-T72 PolarHBondContact O-OG1 3.03Å; I69-T72 WeakPolarHBondContact CA-OG1 3.37Å; I69-T72 PolarHBondContact O-N 3.32Å; I69-T72 PolarHBondContact O-OG1 3.45Å; V70-T72 PolarHBondContact O-N 3.3Å; T72-F84 HydrophobicContact CG2-CD2 4.23Å; T72-F84 HydrophobicContact CG2-CE2 3.5Å; T72-F84 VanDerWaalsContact CG2-CE2 3.5Å; T72-F84 HydrophobicContact CG2-CZ 4.34Å |
| 73 | K | 89.4 | Confident | 90.9 | Very high | 155 Ų | 155 | 51.3 Ų | 51.3 | 67% | 0.674 | 26% | 0.26 | S | S | * | . | H | α-helix | trans | -77.4 | -24.1 | -179.5 | -67.7 | -59.1 | -176.4 | 91.3 | 0 | 113.8 | I69 V70 P75 | I69-K73 HydrophobicContact CG2-CG 4.19Å; I69-K73 WeakPolarHBondContact O-CB 3.4Å; I69-K73 VanDerWaalsContact O-CG 3.31Å; I69-K73 WeakPolarHBondContact O-CG 3.35Å; I69-K73 PolarHBondContact O-N 3.38Å; V70-K73 PolarHBondContact O-N 3.47Å; K73-P75 WeakPolarHBondContact O-CD 3.34Å |
| 74 | T | 88.6 | Confident | 90.9 | Very high | 8 Ų | 8 | 53.5 Ų | 53.5 | 5% | 0.049 | 26% | 0.264 | C | S | . | . | trans | -106.9 | 105.4 | -178.5 | -56.6 | 0 | 0 | 0 | 0 | 111.1 | V70 Q76 L77 E361 | V70-T74 WeakPolarHBondContact O-CB 3.33Å; V70-T74 PolarHBondContact O-N 3.44Å; V70-T74 PolarHBondContact O-OG1 3.28Å; T74-Q76 HydrophobicContact CG2-CB 4.27Å; T74-Q76 PolarHBondContact O-N 3.49Å; T74-Q76 VanDerWaalsContact O-N 3.12Å; T74-L77 HydrophobicContact CG2-CD1 4.19Å; T74-L77 HydrophobicContact CG2-CG 3.88Å; T74-L77 PolarHBondContact O-N 3Å; T74-E361 HydrophobicContact CG2-CG 4.03Å; T74-E361 WeakPolarHBondContact CG2-OE2 3.35Å; T74-E361 PolarHBondContact OG1-OE2 2.91Å | ||
| 75 | P | 85.9 | Confident | 90.8 | Very high | 85 Ų | 85 | 54 Ų | 54 | 55% | 0.552 | 27% | 0.267 | S | S | * | . | G | 310 helix | trans | -55.6 | -34.4 | -177.2 | -26.6 | 34.6 | 0 | 0 | 0 | 114.2 | K73 L77 R78 | K73-P75 WeakPolarHBondContact O-CD 3.34Å; P75-L77 PolarHBondContact O-N 3.1Å; P75-R78 WeakPolarHBondContact O-CB 3.29Å; P75-R78 WeakPolarHBondContact O-CG 3.27Å; P75-R78 PolarHBondContact O-N 3.1Å; P75-R78 VanDerWaalsContact O-N 3.16Å |
| 76 | Q | 84.4 | Confident | 90.8 | Very high | 158 Ų | 158 | 50.6 Ų | 50.6 | 74% | 0.738 | 25% | 0.249 | S | C | * | . | G | 310 helix | trans | -65 | -21.3 | 179.3 | -58.3 | -177.1 | 12.7 | 0 | 0 | 113.4 | T74 K79 | T74-Q76 HydrophobicContact CG2-CB 4.27Å; T74-Q76 PolarHBondContact O-N 3.49Å; T74-Q76 VanDerWaalsContact O-N 3.12Å; Q76-K79 WeakPolarHBondContact O-CE 3.19Å |
| 77 | L | 84.2 | Confident | 91 | Very high | 4 Ų | 4 | 49.5 Ų | 49.5 | 2% | 0.021 | 24% | 0.239 | C | C | . | . | G | 310 helix | trans | -91.4 | -6.3 | 178.8 | -61.6 | -177.3 | 0 | 0 | 0 | 113.1 | V70 I71 T74 P75 K79 F80 Q357 I358 E361 | V70-L77 HydrophobicContact CG1-CD1 3.63Å; I71-L77 HydrophobicContact CG1-CB 4.46Å; I71-L77 HydrophobicContact CG2-CB 4.49Å; T74-L77 HydrophobicContact CG2-CD1 4.19Å; T74-L77 HydrophobicContact CG2-CG 3.88Å; T74-L77 PolarHBondContact O-N 3Å; P75-L77 PolarHBondContact O-N 3.1Å; L77-K79 PolarHBondContact O-N 3.34Å; L77-K79 VanDerWaalsContact O-N 3.1Å; L77-F80 HydrophobicContact CB-CD2 4.15Å; L77-F80 HydrophobicContact CD2-CD2 3.86Å; L77-F80 HydrophobicContact CD2-CE2 3.63Å; L77-F80 WeakPolarHBondContact O-CB 3.48Å; L77-F80 WeakPolarHBondContact O-CD2 3.46Å; L77-F80 PolarHBondContact O-N 2.93Å; L77-Q357 HydrophobicContact CD2-CB 3.88Å; L77-I358 HydrophobicContact CD1-CG1 4.28Å; L77-I358 HydrophobicContact CD2-CG1 4.12Å; L77-E361 HydrophobicContact CD1-CB 4.05Å; L77-E361 HydrophobicContact CD1-CG 4.04Å |
| 78 | R | 83.1 | Confident | 91.1 | Very high | 166 Ų | 166 | 52.3 Ų | 52.3 | 63% | 0.626 | 25% | 0.254 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62 | -20.7 | -179.7 | -68.4 | -179.5 | -176.5 | 177.1 | 1.9 | 113.8 | P75 F80 | P75-R78 WeakPolarHBondContact O-CB 3.29Å; P75-R78 WeakPolarHBondContact O-CG 3.27Å; P75-R78 PolarHBondContact O-N 3.1Å; P75-R78 VanDerWaalsContact O-N 3.16Å; R78-F80 PolarHBondContact O-N 3.13Å |
| 79 | K | 84.3 | Confident | 91.3 | Very high | 124 Ų | 124 | 50.9 Ų | 50.9 | 54% | 0.539 | 25% | 0.247 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -62.3 | -21.1 | 170.6 | 66.3 | -175 | 177.6 | -175.4 | 0 | 113.4 | Q76 L77 A81 Q357 | Q76-K79 WeakPolarHBondContact O-CE 3.19Å; L77-K79 PolarHBondContact O-N 3.34Å; L77-K79 VanDerWaalsContact O-N 3.1Å; K79-A81 PolarHBondContact O-N 2.88Å; K79-A81 VanDerWaalsContact O-N 3.1Å; K79-Q357 VanDerWaalsContact CE-OE1 3.26Å |
| 80 | F | 88.9 | Confident | 91.5 | Very high | 33 Ų | 33 | 47.1 Ų | 47.1 | 15% | 0.145 | 23% | 0.228 | C | C | . | . | trans | -85.3 | 47.8 | 177.2 | -61.3 | -70.4 | 0 | 0 | 0 | 112.5 | L77 R78 F82 V83 F84 N355 Q357 I358 | L77-F80 HydrophobicContact CB-CD2 4.15Å; L77-F80 HydrophobicContact CD2-CD2 3.86Å; L77-F80 HydrophobicContact CD2-CE2 3.63Å; L77-F80 WeakPolarHBondContact O-CB 3.48Å; L77-F80 WeakPolarHBondContact O-CD2 3.46Å; L77-F80 PolarHBondContact O-N 2.93Å; R78-F80 PolarHBondContact O-N 3.13Å; F80-F82 VanDerWaalsContact C-N 3.34Å; F80-F82 PolarHBondContact O-N 2.94Å; F80-V83 HydrophobicContact CB-CB 4.2Å; F80-V83 HydrophobicContact CB-CG2 4.23Å; F80-V83 PolarHBondContact O-N 3.5Å; F80-V83 VanDerWaalsContact O-N 3.13Å; F80-F84 PolarHBondContact O-N 3.19Å; F80-F84 VanDerWaalsContact O-N 3.1Å; F80-N355 WeakPolarHBondContact CE1-ND2 3.27Å; F80-Q357 HydrophobicContact CE2-CB 4.32Å; F80-Q357 VanDerWaalsContact CZ-OE1 3.25Å; F80-I358 HydrophobicContact CD2-CD1 4.36Å; F80-I358 HydrophobicContact CD2-CG1 4.37Å; F80-I358 HydrophobicContact CE2-CG1 4.5Å; F80-I358 HydrophobicContact CG-CD1 4.4Å | ||
| 81 | A | 92 | Very high | 91.8 | Very high | 30 Ų | 30 | 48 Ų | 48 | 25% | 0.248 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -61.1 | -37 | -174.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | K79 F84 H85 V158 | K79-A81 PolarHBondContact O-N 2.88Å; K79-A81 VanDerWaalsContact O-N 3.1Å; A81-F84 WeakPolarHBondContact O-CB 3.27Å; A81-F84 PolarHBondContact O-N 3.4Å; A81-H85 PolarHBondContact O-N 3.23Å; A81-V158 HydrophobicContact CB-CG1 3.8Å |
| 82 | F | 94.3 | Very high | 92.1 | Very high | 4 Ų | 4 | 50.5 Ų | 50.5 | 2% | 0.018 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -68.4 | -33.2 | 175.9 | -64.1 | -64.1 | 0 | 0 | 0 | 113.2 | F80 H85 L86 T131 A134 I135 E138 M153 V158 V161 L162 | F80-F82 VanDerWaalsContact C-N 3.34Å; F80-F82 PolarHBondContact O-N 2.94Å; F82-H85 PolarHBondContact O-N 2.92Å; F82-L86 WeakPolarHBondContact O-CB 3.48Å; F82-L86 PolarHBondContact O-N 3.3Å; F82-T131 HydrophobicContact CB-CG2 4.41Å; F82-T131 VanDerWaalsContact O-CG2 3.26Å; F82-T131 WeakPolarHBondContact O-CG2 3.45Å; F82-A134 HydrophobicContact CD1-CB 4.14Å; F82-A134 HydrophobicContact CE1-CB 4.16Å; F82-I135 HydrophobicContact CB-CD1 4.31Å; F82-I135 HydrophobicContact CB-CG1 3.53Å; F82-E138 HydrophobicContact CD2-CB 4.41Å; F82-E138 WeakPolarHBondContact CD2-OE2 3.1Å; F82-E138 HydrophobicContact CE2-CB 4.38Å; F82-M153 HydrophobicContact CE2-CE 3.42Å; F82-M153 VanDerWaalsContact CE2-CE 3.42Å; F82-M153 HydrophobicContact CZ-CE 3.94Å; F82-V158 HydrophobicContact CE1-CG1 4.3Å; F82-V158 HydrophobicContact CE2-CG2 4.46Å; F82-V158 HydrophobicContact CZ-CG1 4.21Å; F82-V158 HydrophobicContact CZ-CG2 4.39Å; F82-V161 HydrophobicContact CE1-CB 3.98Å; F82-V161 HydrophobicContact CE1-CG1 3.61Å; F82-V161 HydrophobicContact CZ-CB 4.11Å; F82-V161 HydrophobicContact CZ-CG1 3.96Å; F82-L162 HydrophobicContact CD1-CD2 3.74Å; F82-L162 HydrophobicContact CE1-CD2 3.93Å; F82-L162 HydrophobicContact CE1-CG 4.34Å |
| 83 | V | 94.1 | Very high | 92.3 | Very high | 3 Ų | 3 | 47.3 Ų | 47.3 | 2% | 0.018 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -68.3 | -41 | 175.2 | -178.9 | 0 | 0 | 0 | 0 | 110 | V67 I71 F80 L86 C87 I135 I358 | V67-V83 HydrophobicContact CG1-CG1 4.34Å; I71-V83 HydrophobicContact CD1-CB 4.35Å; I71-V83 HydrophobicContact CD1-CG1 4.05Å; F80-V83 HydrophobicContact CB-CB 4.2Å; F80-V83 HydrophobicContact CB-CG2 4.23Å; F80-V83 PolarHBondContact O-N 3.5Å; F80-V83 VanDerWaalsContact O-N 3.13Å; V83-L86 PolarHBondContact O-N 3.43Å; V83-C87 PolarHBondContact O-N 3.49Å; V83-C87 PolarHBondContact O-SG 3.35Å; V83-I135 HydrophobicContact CG2-CD1 4.29Å; V83-I358 HydrophobicContact CG1-CD1 4.28Å |
| 84 | F | 95.3 | Very high | 92.7 | Very high | 66 Ų | 66 | 40 Ų | 40 | 29% | 0.289 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -59.2 | -46.4 | 172.3 | 178.6 | -88.2 | 0 | 0 | 0 | 111.7 | M68 I71 T72 F80 A81 L86 C87 L88 | M68-F84 HydrophobicContact CB-CE2 4.5Å; M68-F84 HydrophobicContact CG-CD2 3.75Å; M68-F84 HydrophobicContact CG-CE2 3.25Å; M68-F84 HydrophobicContact CG-CZ 3.97Å; M68-F84 HydrophobicContact SD-CE2 3.98Å; M68-F84 HydrophobicContact SD-CZ 4.08Å; I71-F84 HydrophobicContact CB-CD2 4.43Å; I71-F84 HydrophobicContact CD1-CB 4.31Å; I71-F84 HydrophobicContact CG2-CB 4.23Å; I71-F84 HydrophobicContact CG2-CD2 4.15Å; T72-F84 HydrophobicContact CG2-CD2 4.23Å; T72-F84 HydrophobicContact CG2-CE2 3.5Å; T72-F84 VanDerWaalsContact CG2-CE2 3.5Å; T72-F84 HydrophobicContact CG2-CZ 4.34Å; F80-F84 PolarHBondContact O-N 3.19Å; F80-F84 VanDerWaalsContact O-N 3.1Å; A81-F84 WeakPolarHBondContact O-CB 3.27Å; A81-F84 PolarHBondContact O-N 3.4Å; F84-L86 VanDerWaalsContact C-N 3.34Å; F84-L86 PolarHBondContact O-N 3.22Å; F84-C87 PolarHBondContact O-N 3.36Å; F84-L88 PolarHBondContact O-N 3.26Å |
| 85 | H | 96.8 | Very high | 93.1 | Very high | 11 Ų | 11 | 44 Ų | 44 | 5% | 0.051 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -60.7 | -41.8 | 176.3 | -176.8 | -97.5 | 0 | 0 | 0 | 112.4 | A81 F82 L88 V89 T131 L162 W166 | A81-H85 PolarHBondContact O-N 3.23Å; F82-H85 PolarHBondContact O-N 2.92Å; H85-L88 WeakPolarHBondContact O-CB 3.37Å; H85-L88 PolarHBondContact O-N 2.99Å; H85-V89 WeakPolarHBondContact O-CG2 3.23Å; H85-V89 PolarHBondContact O-N 3.24Å; H85-T131 HydrophobicContact CB-CG2 4.4Å; H85-T131 PolarHBondContact CE1-OG1 2.95Å; H85-T131 PolarHBondContact ND1-OG1 3.38Å; H85-L162 HydrophobicContact CB-CD2 3.79Å; H85-W166 AromaticContact CD2-NE1 3.94Å; H85-W166 AromaticContact CE1-NE1 3.75Å; H85-W166 AromaticContact NE2-CD1 3.8Å; H85-W166 AromaticContact NE2-CE2 3.57Å; H85-W166 AromaticContact NE2-CZ2 3.86Å; H85-W166 AromaticContact NE2-NE1 2.87Å; H85-W166 PolarHBondContact NE2-NE1 3.29Å |
| 86 | L | 96 | Very high | 93.5 | Very high | 1 Ų | 1 | 43.5 Ų | 43.5 | 1% | 0.005 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -59 | -48.8 | 175.9 | -176.7 | 61.1 | 0 | 0 | 0 | 110.7 | F82 V83 F84 L88 V89 D90 A128 T131 I132 I135 N347 Y351 | F82-L86 WeakPolarHBondContact O-CB 3.48Å; F82-L86 PolarHBondContact O-N 3.3Å; V83-L86 PolarHBondContact O-N 3.43Å; F84-L86 VanDerWaalsContact C-N 3.34Å; F84-L86 PolarHBondContact O-N 3.22Å; L86-L88 VanDerWaalsContact C-N 3.27Å; L86-L88 PolarHBondContact O-N 3.02Å; L86-V89 PolarHBondContact O-N 3.05Å; L86-D90 WeakPolarHBondContact O-CB 3.24Å; L86-D90 PolarHBondContact O-N 2.72Å; L86-A128 HydrophobicContact CD1-CB 4.25Å; L86-T131 HydrophobicContact CB-CG2 3.79Å; L86-T131 HydrophobicContact CD1-CG2 4.36Å; L86-I132 HydrophobicContact CD1-CD1 4.46Å; L86-I132 HydrophobicContact CD1-CG1 4.03Å; L86-I132 HydrophobicContact CD2-CG1 4.11Å; L86-I135 HydrophobicContact CB-CD1 4.24Å; L86-I135 HydrophobicContact CD2-CD1 3.79Å; L86-N347 HydrophobicContact CD2-CB 4.13Å; L86-N347 HydrophobicContact CG-CB 4.48Å; L86-Y351 HydrophobicContact CD2-CD2 3.53Å; L86-Y351 HydrophobicContact CD2-CE2 3.85Å; L86-Y351 HydrophobicContact CD2-CG 3.97Å |
| 87 | C | 97.1 | Very high | 93.9 | Very high | 4 Ų | 4 | 36 Ų | 36 | 3% | 0.027 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -61.6 | -34.6 | 176.9 | -68.5 | 0 | 0 | 0 | 0 | 113 | N64 M68 V83 F84 L91 | N64-C87 HydrophobicContact CB-CB 4.24Å; N64-C87 WeakPolarHBondContact OD1-CA 3.32Å; M68-C87 HydrophobicContact CB-CB 4.46Å; V83-C87 PolarHBondContact O-N 3.49Å; V83-C87 PolarHBondContact O-SG 3.35Å; F84-C87 PolarHBondContact O-N 3.36Å; C87-L91 WeakPolarHBondContact O-CB 3.31Å; C87-L91 PolarHBondContact O-N 2.87Å |
| 88 | L | 97.6 | Very high | 94.3 | Very high | 63 Ų | 63 | 35.9 Ų | 35.9 | 33% | 0.33 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -64.9 | -48.1 | 174.6 | 176.7 | 65.4 | 0 | 0 | 0 | 111.5 | F84 H85 L86 L91 L92 | F84-L88 PolarHBondContact O-N 3.26Å; H85-L88 WeakPolarHBondContact O-CB 3.37Å; H85-L88 PolarHBondContact O-N 2.99Å; L86-L88 VanDerWaalsContact C-N 3.27Å; L86-L88 PolarHBondContact O-N 3.02Å; L88-L91 PolarHBondContact O-N 3.4Å; L88-L92 HydrophobicContact CG-CD1 4.45Å; L88-L92 WeakPolarHBondContact O-CG 3.34Å; L88-L92 PolarHBondContact O-N 3.42Å |
| 89 | V | 97.8 | Very high | 94.7 | Very high | 0 Ų | 0 | 30.1 Ų | 30.1 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -64.2 | -44.5 | 179 | 174.2 | 0 | 0 | 0 | 0 | 111 | H85 L86 L91 L92 A93 L124 A127 A128 W166 | H85-V89 WeakPolarHBondContact O-CG2 3.23Å; H85-V89 PolarHBondContact O-N 3.24Å; L86-V89 PolarHBondContact O-N 3.05Å; V89-L91 VanDerWaalsContact C-N 3.34Å; V89-L91 PolarHBondContact O-N 3.05Å; V89-L92 WeakPolarHBondContact O-CB 3.14Å; V89-L92 PolarHBondContact O-N 3.28Å; V89-A93 PolarHBondContact O-N 2.87Å; V89-L124 HydrophobicContact CG1-CB 4.43Å; V89-L124 HydrophobicContact CG1-CD2 4.22Å; V89-L124 WeakPolarHBondContact CG1-O 3.4Å; V89-A127 HydrophobicContact CG1-CB 3.94Å; V89-A127 HydrophobicContact CG2-CB 4.16Å; V89-A128 HydrophobicContact CG1-CB 4.02Å; V89-W166 HydrophobicContact CG2-CH2 4.33Å; V89-W166 HydrophobicContact CG2-CZ2 3.98Å |
| 90 | D | 97.3 | Very high | 94.9 | Very high | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -65.7 | -37.5 | 179 | -66.6 | -12.5 | 0 | 0 | 0 | 111.4 | N64 L86 A93 A94 F344 N347 | N64-D90 WeakPolarHBondContact OD1-CB 3.31Å; L86-D90 WeakPolarHBondContact O-CB 3.24Å; L86-D90 PolarHBondContact O-N 2.72Å; D90-A93 PolarHBondContact O-N 3.28Å; D90-A94 WeakPolarHBondContact O-CB 3.06Å; D90-A94 PolarHBondContact O-N 3.46Å; D90-F344 HydrophobicContact CB-CB 4.27Å; D90-F344 HydrophobicContact CB-CD1 4.39Å; D90-F344 VanDerWaalsContact OD1-CD1 3.28Å; D90-F344 WeakPolarHBondContact OD1-CD1 3.14Å; D90-N347 PolarHBondContact OD1-ND2 2.87Å; D90-N347 WeakPolarHBondContact OD2-CB 3.22Å; D90-N347 PolarHBondContact OD2-ND2 2.89Å |
| 91 | L | 97.7 | Very high | 94.8 | Very high | 22 Ų | 22 | 25.5 Ų | 25.5 | 12% | 0.115 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -65.6 | -41.3 | 173.6 | -178.7 | 64.6 | 0 | 0 | 0 | 111.5 | V61 N64 M68 C87 L88 V89 A93 A94 L95 | V61-L91 HydrophobicContact CB-CD1 4.42Å; V61-L91 HydrophobicContact CG1-CD1 4.08Å; V61-L91 HydrophobicContact CG2-CD1 4.46Å; N64-L91 HydrophobicContact CB-CB 4.31Å; M68-L91 HydrophobicContact CE-CD2 3.7Å; C87-L91 WeakPolarHBondContact O-CB 3.31Å; C87-L91 PolarHBondContact O-N 2.87Å; L88-L91 PolarHBondContact O-N 3.4Å; V89-L91 VanDerWaalsContact C-N 3.34Å; V89-L91 PolarHBondContact O-N 3.05Å; L91-A93 VanDerWaalsContact C-N 3.3Å; L91-A93 PolarHBondContact O-N 2.92Å; L91-A94 PolarHBondContact O-N 3.01Å; L91-L95 HydrophobicContact CD1-CD1 4.07Å; L91-L95 HydrophobicContact CD1-CG 4.12Å; L91-L95 HydrophobicContact CG-CD1 3.94Å; L91-L95 HydrophobicContact CG-CG 4.37Å; L91-L95 WeakPolarHBondContact O-CB 3.48Å; L91-L95 VanDerWaalsContact O-CG 3.24Å; L91-L95 WeakPolarHBondContact O-CG 3.33Å; L91-L95 PolarHBondContact O-N 2.88Å |
| 92 | L | 97.5 | Very high | 94.6 | Very high | 57 Ų | 57 | 25.6 Ų | 25.6 | 30% | 0.298 | 14% | 0.135 | S | C | . | . | H | α-helix | trans | -61.9 | -39.3 | 173.4 | -71.7 | 170.7 | 0 | 0 | 0 | 111.4 | L88 V89 L95 L96 L124 W166 | L88-L92 HydrophobicContact CG-CD1 4.45Å; L88-L92 WeakPolarHBondContact O-CG 3.34Å; L88-L92 PolarHBondContact O-N 3.42Å; V89-L92 WeakPolarHBondContact O-CB 3.14Å; V89-L92 PolarHBondContact O-N 3.28Å; L92-L95 PolarHBondContact O-N 3.48Å; L92-L96 VanDerWaalsContact O-CB 3.31Å; L92-L96 WeakPolarHBondContact O-CB 3.49Å; L92-L96 WeakPolarHBondContact O-CG 3.44Å; L92-L96 PolarHBondContact O-N 3.42Å; L92-L124 HydrophobicContact CB-CD1 4.2Å; L92-L124 HydrophobicContact CB-CD2 4.12Å; L92-L124 HydrophobicContact CD1-CD2 4.4Å; L92-W166 HydrophobicContact CD1-CH2 4.4Å |
| 93 | A | 96.8 | Very high | 94 | Very high | 0 Ų | 0 | 28.6 Ų | 28.6 | 0% | 0 | 15% | 0.151 | C | C | . | . | I | π-helix | trans | -67.4 | -41.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | V89 D90 L91 V97 M98 L124 F344 | V89-A93 PolarHBondContact O-N 2.87Å; D90-A93 PolarHBondContact O-N 3.28Å; L91-A93 VanDerWaalsContact C-N 3.3Å; L91-A93 PolarHBondContact O-N 2.92Å; A93-V97 HydrophobicContact CB-CB 4.47Å; A93-V97 CarbonylContact O-C 3.59Å; A93-V97 WeakPolarHBondContact O-CA 3.42Å; A93-V97 WeakPolarHBondContact O-CB 3.45Å; A93-V97 PolarHBondContact O-N 3.44Å; A93-M98 PolarHBondContact O-N 3.24Å; A93-L124 HydrophobicContact CB-CB 4.39Å; A93-L124 HydrophobicContact CB-CD1 4.26Å; A93-F344 HydrophobicContact CB-CD1 4.29Å; A93-F344 HydrophobicContact CB-CD2 3.87Å; A93-F344 HydrophobicContact CB-CE1 4.11Å; A93-F344 HydrophobicContact CB-CE2 3.67Å; A93-F344 HydrophobicContact CB-CG 4.16Å; A93-F344 HydrophobicContact CB-CZ 3.78Å |
| 94 | A | 96.9 | Very high | 93.1 | Very high | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 15% | 0.152 | C | C | . | . | I | π-helix | trans | -65.3 | -39.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112 | A60 V61 D90 L91 M98 P99 | A60-A94 HydrophobicContact CB-CB 3.81Å; V61-A94 HydrophobicContact CG2-CB 3.76Å; D90-A94 WeakPolarHBondContact O-CB 3.06Å; D90-A94 PolarHBondContact O-N 3.46Å; L91-A94 PolarHBondContact O-N 3.01Å; A94-M98 HydrophobicContact CB-SD 4.16Å; A94-P99 WeakPolarHBondContact O-CD 3.29Å; A94-P99 WeakPolarHBondContact O-CG 3.36Å |
| 95 | L | 96.5 | Very high | 91.7 | Very high | 94 Ų | 94 | 30.1 Ų | 30.1 | 49% | 0.492 | 16% | 0.162 | S | C | . | . | I | π-helix | trans | -77 | -27.9 | -179.3 | -68.1 | 175.1 | 0 | 0 | 0 | 114 | V61 L91 L92 | V61-L95 HydrophobicContact CG2-CD2 4.13Å; L91-L95 HydrophobicContact CD1-CD1 4.07Å; L91-L95 HydrophobicContact CD1-CG 4.12Å; L91-L95 HydrophobicContact CG-CD1 3.94Å; L91-L95 HydrophobicContact CG-CG 4.37Å; L91-L95 WeakPolarHBondContact O-CB 3.48Å; L91-L95 VanDerWaalsContact O-CG 3.24Å; L91-L95 WeakPolarHBondContact O-CG 3.33Å; L91-L95 PolarHBondContact O-N 2.88Å; L92-L95 PolarHBondContact O-N 3.48Å |
| 96 | L | 94.1 | Very high | 90.2 | Very high | 74 Ų | 74 | 36.5 Ų | 36.5 | 39% | 0.387 | 19% | 0.186 | S | C | . | . | I | π-helix | trans | -113.8 | -60.8 | -173.7 | -54.7 | 175.6 | 0 | 0 | 0 | 111.5 | L92 L100 L120 | L92-L96 VanDerWaalsContact O-CB 3.31Å; L92-L96 WeakPolarHBondContact O-CB 3.49Å; L92-L96 WeakPolarHBondContact O-CG 3.44Å; L92-L96 PolarHBondContact O-N 3.42Å; L96-L100 WeakPolarHBondContact O-CB 3.29Å; L96-L100 WeakPolarHBondContact O-CD1 3.26Å; L96-L100 PolarHBondContact O-N 2.86Å; L96-L120 HydrophobicContact CB-CD2 3.8Å; L96-L120 HydrophobicContact CD1-CD2 4.05Å |
| 97 | V | 93 | Very high | 88.5 | Confident | 1 Ų | 1 | 41.2 Ų | 41.2 | 1% | 0.006 | 21% | 0.21 | C | C | . | . | I | π-helix | trans | -70.6 | -46.4 | -169.4 | 177.5 | 0 | 0 | 0 | 0 | 111.9 | A93 L100 G101 Y117 L120 L124 Y341 | A93-V97 HydrophobicContact CB-CB 4.47Å; A93-V97 CarbonylContact O-C 3.59Å; A93-V97 WeakPolarHBondContact O-CA 3.42Å; A93-V97 WeakPolarHBondContact O-CB 3.45Å; A93-V97 PolarHBondContact O-N 3.44Å; V97-L100 PolarHBondContact O-N 3.46Å; V97-G101 PolarHBondContact O-N 2.86Å; V97-Y117 HydrophobicContact CG1-CE2 4.03Å; V97-L120 HydrophobicContact CG2-CD2 4.25Å; V97-L120 HydrophobicContact CG2-CG 4.03Å; V97-L124 HydrophobicContact CG2-CD1 3.71Å; V97-Y341 HydrophobicContact CG1-CE1 4.02Å; V97-Y341 HydrophobicContact CG1-CE2 4.05Å; V97-Y341 WeakPolarHBondContact CG1-OH 3.26Å |
| 98 | M | 93.6 | Very high | 86.9 | Confident | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -63.8 | -48.5 | -176.7 | -65.8 | 178 | 69.9 | 0 | 0 | 112.1 | M56 D57 A60 A93 A94 L100 G101 M102 W338 Y341 F344 | M56-M98 HydrophobicContact CB-CE 4.23Å; D57-M98 HydrophobicContact CB-CE 3.93Å; D57-M98 WeakPolarHBondContact OD1-CB 3.42Å; A60-M98 HydrophobicContact CB-SD 4.23Å; A93-M98 PolarHBondContact O-N 3.24Å; A94-M98 HydrophobicContact CB-SD 4.16Å; M98-L100 PolarHBondContact O-N 3.47Å; M98-G101 PolarHBondContact O-N 2.98Å; M98-G101 VanDerWaalsContact O-N 3.16Å; M98-M102 WeakPolarHBondContact O-CG 3.46Å; M98-M102 PolarHBondContact O-N 2.98Å; M98-W338 HydrophobicContact CB-CH2 4.3Å; M98-W338 HydrophobicContact CE-CE3 4.35Å; M98-W338 HydrophobicContact CE-CH2 4.36Å; M98-W338 HydrophobicContact CE-CZ3 3.61Å; M98-Y341 HydrophobicContact CG-CD2 4.18Å; M98-Y341 HydrophobicContact CG-CG 4.47Å; M98-F344 HydrophobicContact SD-CD2 4.35Å |
| 99 | P | 91.9 | Very high | 85.1 | Confident | 46 Ų | 46 | 46.2 Ų | 46.2 | 30% | 0.299 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -61.2 | -42.7 | 174.4 | -27.5 | 33.8 | 0 | 0 | 0 | 113.6 | A94 G101 M102 L103 | A94-P99 WeakPolarHBondContact O-CD 3.29Å; A94-P99 WeakPolarHBondContact O-CG 3.36Å; P99-G101 VanDerWaalsContact C-N 3.28Å; P99-G101 PolarHBondContact O-N 3.5Å; P99-M102 WeakPolarHBondContact O-CB 3.4Å; P99-M102 PolarHBondContact O-N 3.14Å; P99-L103 WeakPolarHBondContact O-CB 3.42Å; P99-L103 PolarHBondContact O-N 3.37Å; P99-L103 VanDerWaalsContact O-N 3.16Å |
| 100 | L | 88.1 | Confident | 83.9 | Confident | 53 Ų | 53 | 50.4 Ų | 50.4 | 28% | 0.277 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -64.2 | -36.4 | 174.9 | -88.3 | 83.4 | 0 | 0 | 0 | 111.3 | L96 V97 M98 L103 S104 Y117 | L96-L100 WeakPolarHBondContact O-CB 3.29Å; L96-L100 WeakPolarHBondContact O-CD1 3.26Å; L96-L100 PolarHBondContact O-N 2.86Å; V97-L100 PolarHBondContact O-N 3.46Å; M98-L100 PolarHBondContact O-N 3.47Å; L100-L103 CarbonylContact O-C 3.53Å; L100-L103 PolarHBondContact O-N 3.05Å; L100-S104 PolarHBondContact O-N 3.33Å; L100-Y117 HydrophobicContact CB-CD2 3.57Å; L100-Y117 HydrophobicContact CB-CE2 3.99Å; L100-Y117 HydrophobicContact CB-CG 4.42Å; L100-Y117 HydrophobicContact CD2-CD2 4.16Å; L100-Y117 HydrophobicContact CD2-CG 4.5Å |
| 101 | G | 86.7 | Confident | 82.8 | Confident | 6 Ų | 6 | 54.2 Ų | 54.2 | 6% | 0.062 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -63.9 | -42.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | V97 M98 P99 L103 S104 Y117 | V97-G101 PolarHBondContact O-N 2.86Å; M98-G101 PolarHBondContact O-N 2.98Å; M98-G101 VanDerWaalsContact O-N 3.16Å; P99-G101 VanDerWaalsContact C-N 3.28Å; P99-G101 PolarHBondContact O-N 3.5Å; G101-L103 PolarHBondContact O-N 3.21Å; G101-S104 PolarHBondContact O-N 3.21Å; G101-S104 PolarHBondContact O-OG 3.29Å; G101-Y117 WeakPolarHBondContact CA-OH 3.42Å |
| 102 | M | 87.4 | Confident | 81.8 | Confident | 33 Ų | 33 | 55.9 Ų | 55.9 | 16% | 0.163 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -60.7 | -32.6 | 173.8 | -70.1 | -177.2 | 72.3 | 0 | 0 | 112.9 | L50 M53 L54 M98 P99 W338 | L50-M102 HydrophobicContact CD2-CE 4.23Å; M53-M102 HydrophobicContact CB-CE 4.04Å; M53-M102 HydrophobicContact CB-CG 4.16Å; M53-M102 HydrophobicContact CB-SD 4.25Å; M53-M102 HydrophobicContact SD-CG 4.16Å; L54-M102 HydrophobicContact CB-CE 4.45Å; L54-M102 HydrophobicContact CD1-CE 4.34Å; L54-M102 HydrophobicContact CD2-CE 3.43Å; L54-M102 VanDerWaalsContact CD2-CE 3.43Å; L54-M102 HydrophobicContact CD2-SD 3.83Å; L54-M102 HydrophobicContact CG-CE 3.41Å; L54-M102 VanDerWaalsContact CG-CE 3.41Å; L54-M102 HydrophobicContact CG-SD 4.28Å; M98-M102 WeakPolarHBondContact O-CG 3.46Å; M98-M102 PolarHBondContact O-N 2.98Å; P99-M102 WeakPolarHBondContact O-CB 3.4Å; P99-M102 PolarHBondContact O-N 3.14Å; M102-W338 HydrophobicContact CB-CZ2 4.37Å; M102-W338 HydrophobicContact CG-CH2 3.42Å; M102-W338 VanDerWaalsContact CG-CH2 3.42Å; M102-W338 HydrophobicContact CG-CZ2 3.36Å; M102-W338 HydrophobicContact SD-CH2 4.16Å |
| 103 | L | 82.2 | Confident | 81 | Confident | 67 Ų | 67 | 57.1 Ų | 57.1 | 35% | 0.351 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -95.3 | -7.8 | -173.7 | -158.6 | 66.9 | 0 | 0 | 0 | 113 | P99 L100 G101 D105 R106 I107 | P99-L103 WeakPolarHBondContact O-CB 3.42Å; P99-L103 PolarHBondContact O-N 3.37Å; P99-L103 VanDerWaalsContact O-N 3.16Å; L100-L103 CarbonylContact O-C 3.53Å; L100-L103 PolarHBondContact O-N 3.05Å; G101-L103 PolarHBondContact O-N 3.21Å; L103-D105 PolarHBondContact O-N 2.97Å; L103-R106 PolarHBondContact O-N 2.98Å; L103-I107 HydrophobicContact CD1-CB 4.28Å; L103-I107 HydrophobicContact CD1-CD1 3.51Å; L103-I107 HydrophobicContact CD1-CG1 3.6Å; L103-I107 HydrophobicContact CD2-CB 3.81Å; L103-I107 HydrophobicContact CD2-CD1 3.79Å; L103-I107 HydrophobicContact CD2-CG1 3.95Å; L103-I107 HydrophobicContact CD2-CG2 4.19Å; L103-I107 HydrophobicContact CG-CB 3.66Å; L103-I107 HydrophobicContact CG-CD1 3.79Å; L103-I107 HydrophobicContact CG-CG1 3.57Å; L103-I107 PolarHBondContact O-N 3.46Å |
| 104 | S | 74.7 | Confident | 80.2 | Confident | 7 Ų | 7 | 58 Ų | 58 | 5% | 0.049 | 30% | 0.301 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -58.1 | -35 | -174.7 | 67.8 | 0 | 0 | 0 | 0 | 113.2 | L100 G101 R106 | L100-S104 PolarHBondContact O-N 3.33Å; G101-S104 PolarHBondContact O-N 3.21Å; G101-S104 PolarHBondContact O-OG 3.29Å; S104-R106 VanDerWaalsContact C-N 3.29Å; S104-R106 PolarHBondContact O-N 3.02Å |
| 105 | D | 66.3 | Low | 79.4 | Confident | 93 Ų | 93 | 61.6 Ų | 61.6 | 50% | 0.497 | 32% | 0.315 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.5 | -16.4 | 177.6 | -70.8 | -31.5 | 0 | 0 | 0 | 114.6 | L103 H200 | L103-D105 PolarHBondContact O-N 2.97Å; D105-H200 IonicContact OD1-CE1 3.33Å; D105-H200 PolarHBondContact OD1-CE1 2.79Å; D105-H200 IonicContact OD1-CG 3.8Å; D105-H200 IonicContact OD1-ND1 2.66Å; D105-H200 PolarHBondContact OD1-ND1 3.05Å |
| 106 | R | 64.7 | Low | 78.8 | Confident | 145 Ų | 145 | 60 Ų | 60 | 55% | 0.547 | 31% | 0.312 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -119.1 | -32.2 | -168.8 | -61.3 | -172.2 | -165.3 | -96.6 | 0.8 | 114.8 | L103 S104 | L103-R106 PolarHBondContact O-N 2.98Å; S104-R106 VanDerWaalsContact C-N 3.29Å; S104-R106 PolarHBondContact O-N 3.02Å |
| 107 | I | 59.8 | Low | 78.4 | Confident | 100 Ų | 100 | 57 Ų | 57 | 51% | 0.513 | 30% | 0.295 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -128.9 | -15.8 | -168.3 | -53.5 | -159.4 | 0 | 0 | 0 | 113.5 | L103 E109 | L103-I107 HydrophobicContact CD1-CB 4.28Å; L103-I107 HydrophobicContact CD1-CD1 3.51Å; L103-I107 HydrophobicContact CD1-CG1 3.6Å; L103-I107 HydrophobicContact CD2-CB 3.81Å; L103-I107 HydrophobicContact CD2-CD1 3.79Å; L103-I107 HydrophobicContact CD2-CG1 3.95Å; L103-I107 HydrophobicContact CD2-CG2 4.19Å; L103-I107 HydrophobicContact CG-CB 3.66Å; L103-I107 HydrophobicContact CG-CD1 3.79Å; L103-I107 HydrophobicContact CG-CG1 3.57Å; L103-I107 PolarHBondContact O-N 3.46Å; I107-E109 PolarHBondContact O-N 3.45Å |
| 108 | L | 63.8 | Low | 78.1 | Confident | 12 Ų | 12 | 58.5 Ų | 58.5 | 6% | 0.063 | 30% | 0.303 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -81.5 | 56.5 | 176.9 | -85.5 | 84.3 | 0 | 0 | 0 | 111.9 | D110 L113 C114 Y117 | L108-D110 VanDerWaalsContact C-N 3.32Å; L108-L113 HydrophobicContact CD2-CB 4.43Å; L108-L113 HydrophobicContact CG-CB 4.28Å; L108-C114 HydrophobicContact CD2-CB 4.32Å; L108-Y117 HydrophobicContact CD2-CD1 4.36Å; L108-Y117 HydrophobicContact CD2-CG 4.27Å |
| 109 | E | 61.1 | Low | 77.8 | Confident | 160 Ų | 160 | 59.8 Ų | 59.8 | 75% | 0.748 | 31% | 0.312 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75 | -26.4 | 170 | -62.7 | -168 | 169.5 | 0 | 0 | 111.6 | I107 | I107-E109 PolarHBondContact O-N 3.45Š|
| 110 | D | 71.1 | Confident | 77.8 | Confident | 89 Ų | 89 | 60.3 Ų | 60.3 | 48% | 0.476 | 31% | 0.312 | S | S | . | . | S | Bend | trans | -79.6 | 119.5 | 175.2 | -171.6 | -2.1 | 0 | 0 | 0 | 111.2 | L108 A112 L113 C114 | L108-D110 VanDerWaalsContact C-N 3.32Å; D110-A112 PolarHBondContact O-N 3.35Å; D110-A112 PolarHBondContact OD1-N 3.11Å; D110-L113 HydrophobicContact CB-CB 4.28Å; D110-L113 HydrophobicContact CB-CD1 4.02Å; D110-L113 HydrophobicContact CB-CG 4.05Å; D110-L113 PolarHBondContact O-N 3.1Å; D110-L113 VanDerWaalsContact O-N 3.12Å; D110-C114 PolarHBondContact O-N 3.3Å |
| 111 | E | 75.1 | Confident | 77.9 | Confident | 79 Ų | 79 | 58.4 Ų | 58.4 | 37% | 0.369 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -56.3 | -35 | 176.5 | -179.8 | 64.2 | -153.7 | 0 | 0 | 112.3 | R115 | E111-R115 VanDerWaalsContact CD-NH2 3.34Å; E111-R115 VanDerWaalsContact CG-CZ 3.43Å; E111-R115 WeakPolarHBondContact O-CD 3.48Å; E111-R115 WeakPolarHBondContact O-CG 3.27Å; E111-R115 PolarHBondContact O-N 3.26Å; E111-R115 IonicContact OE1-CZ 3.24Å; E111-R115 VanDerWaalsContact OE1-CZ 3.24Å; E111-R115 IonicContact OE1-NE 2.81Å; E111-R115 PolarHBondContact OE1-NE 3.38Å; E111-R115 IonicContact OE1-NH2 2.8Å; E111-R115 PolarHBondContact OE1-NH2 2.95Å |
| 112 | A | 77.3 | Confident | 78 | Confident | 57 Ų | 57 | 58.6 Ų | 58.6 | 47% | 0.471 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -68.1 | -40.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | D110 R115 S116 | D110-A112 PolarHBondContact O-N 3.35Å; D110-A112 PolarHBondContact OD1-N 3.11Å; A112-R115 PolarHBondContact O-N 3.19Å; A112-S116 WeakPolarHBondContact O-CB 3.35Å; A112-S116 PolarHBondContact O-N 2.87Å; A112-S116 PolarHBondContact O-OG 3.14Å |
| 113 | L | 80.1 | Confident | 78.3 | Confident | 84 Ų | 84 | 57.5 Ų | 57.5 | 44% | 0.44 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -66 | -42.8 | 176.5 | -67.1 | 178.4 | 0 | 0 | 0 | 110.9 | L108 D110 R115 S116 Y117 | L108-L113 HydrophobicContact CD2-CB 4.43Å; L108-L113 HydrophobicContact CG-CB 4.28Å; D110-L113 HydrophobicContact CB-CB 4.28Å; D110-L113 HydrophobicContact CB-CD1 4.02Å; D110-L113 HydrophobicContact CB-CG 4.05Å; D110-L113 PolarHBondContact O-N 3.1Å; D110-L113 VanDerWaalsContact O-N 3.12Å; L113-R115 VanDerWaalsContact C-N 3.35Å; L113-R115 PolarHBondContact O-N 3.41Å; L113-S116 WeakPolarHBondContact CA-OG 3.48Å; L113-S116 PolarHBondContact O-N 2.89Å; L113-S116 PolarHBondContact O-OG 3.25Å; L113-Y117 WeakPolarHBondContact O-CB 3.46Å; L113-Y117 PolarHBondContact O-N 2.85Å |
| 114 | C | 79.9 | Confident | 78.9 | Confident | 17 Ų | 17 | 54.5 Ų | 54.5 | 12% | 0.115 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -55.3 | -47.2 | 173.3 | -165.2 | 0 | 0 | 0 | 0 | 112.7 | L108 D110 Y117 L118 C201 | L108-C114 HydrophobicContact CD2-CB 4.32Å; D110-C114 PolarHBondContact O-N 3.3Å; C114-Y117 PolarHBondContact O-N 3.44Å; C114-L118 WeakPolarHBondContact O-CG 3.39Å; C114-L118 PolarHBondContact O-N 2.88Å; C114-C201 VanDerWaalsContact CA-SG 3.56Å; C114-C201 HydrophobicContact CB-CB 4.36Å; C114-C201 WeakPolarHBondContact CB-SG 3.48Å; C114-C201 VanDerWaalsContact SG-CA 3.53Å; C114-C201 WeakPolarHBondContact SG-CB 3.27Å; C114-C201 CovalentContact SG-SG 2.03Å; C114-C201 PolarHBondContact SG-SG 3.17Å |
| 115 | R | 80.1 | Confident | 79.8 | Confident | 76 Ų | 76 | 54.8 Ų | 54.8 | 29% | 0.287 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -64.3 | -45.9 | 177 | -70.2 | 167.4 | -170.4 | -176.1 | 6.3 | 112.3 | E111 A112 L113 Y117 L118 C119 Y180 | E111-R115 VanDerWaalsContact CD-NH2 3.34Å; E111-R115 VanDerWaalsContact CG-CZ 3.43Å; E111-R115 WeakPolarHBondContact O-CD 3.48Å; E111-R115 WeakPolarHBondContact O-CG 3.27Å; E111-R115 PolarHBondContact O-N 3.26Å; E111-R115 IonicContact OE1-CZ 3.24Å; E111-R115 VanDerWaalsContact OE1-CZ 3.24Å; E111-R115 IonicContact OE1-NE 2.81Å; E111-R115 PolarHBondContact OE1-NE 3.38Å; E111-R115 IonicContact OE1-NH2 2.8Å; E111-R115 PolarHBondContact OE1-NH2 2.95Å; A112-R115 PolarHBondContact O-N 3.19Å; L113-R115 VanDerWaalsContact C-N 3.35Å; L113-R115 PolarHBondContact O-N 3.41Å; R115-Y117 VanDerWaalsContact C-N 3.3Å; R115-Y117 PolarHBondContact O-N 3.2Å; R115-L118 PolarHBondContact O-N 2.87Å; R115-C119 WeakPolarHBondContact O-CB 3.28Å; R115-C119 PolarHBondContact O-N 2.97Å; R115-C119 PolarHBondContact O-SG 3.3Å; R115-Y180 PolarHBondContact NH2-OH 3.21Å |
| 116 | S | 83.8 | Confident | 81 | Confident | 61 Ų | 61 | 50.5 Ų | 50.5 | 43% | 0.427 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -61.5 | -41.7 | 179.4 | 75.1 | 0 | 0 | 0 | 0 | 111.4 | A112 L113 C119 L120 | A112-S116 WeakPolarHBondContact O-CB 3.35Å; A112-S116 PolarHBondContact O-N 2.87Å; A112-S116 PolarHBondContact O-OG 3.14Å; L113-S116 WeakPolarHBondContact CA-OG 3.48Å; L113-S116 PolarHBondContact O-N 2.89Å; L113-S116 PolarHBondContact O-OG 3.25Å; S116-C119 PolarHBondContact O-N 3.24Å; S116-L120 WeakPolarHBondContact O-CB 3.47Å; S116-L120 PolarHBondContact O-N 3.42Å |
| 117 | Y | 86.8 | Confident | 82.5 | Confident | 12 Ų | 12 | 43.6 Ų | 43.6 | 5% | 0.047 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -61.2 | -49.7 | 176 | 162.9 | -108 | 0 | 0 | 0 | 111.7 | V97 L100 G101 L108 L113 C114 R115 C119 L120 S121 C201 Y341 | V97-Y117 HydrophobicContact CG1-CE2 4.03Å; L100-Y117 HydrophobicContact CB-CD2 3.57Å; L100-Y117 HydrophobicContact CB-CE2 3.99Å; L100-Y117 HydrophobicContact CB-CG 4.42Å; L100-Y117 HydrophobicContact CD2-CD2 4.16Å; L100-Y117 HydrophobicContact CD2-CG 4.5Å; G101-Y117 WeakPolarHBondContact CA-OH 3.42Å; L108-Y117 HydrophobicContact CD2-CD1 4.36Å; L108-Y117 HydrophobicContact CD2-CG 4.27Å; L113-Y117 WeakPolarHBondContact O-CB 3.46Å; L113-Y117 PolarHBondContact O-N 2.85Å; C114-Y117 PolarHBondContact O-N 3.44Å; R115-Y117 VanDerWaalsContact C-N 3.3Å; R115-Y117 PolarHBondContact O-N 3.2Å; Y117-C119 PolarHBondContact O-N 3.47Å; Y117-L120 PolarHBondContact O-N 2.96Å; Y117-S121 WeakPolarHBondContact O-CB 3.34Å; Y117-S121 PolarHBondContact O-N 2.99Å; Y117-C201 HydrophobicContact CD1-CB 4.25Å; Y117-C201 HydrophobicContact CE1-CB 4.39Å; Y117-Y341 PolarHBondContact OH-OH 3.31Å; Y117-Y341 VanDerWaalsContact OH-OH 3.1Å |
| 118 | L | 85.1 | Confident | 84.1 | Confident | 32 Ų | 32 | 38.9 Ų | 38.9 | 17% | 0.168 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -62.3 | -43.7 | 178.8 | -70.5 | 173.3 | 0 | 0 | 0 | 111.8 | C114 R115 S121 V122 | C114-L118 WeakPolarHBondContact O-CG 3.39Å; C114-L118 PolarHBondContact O-N 2.88Å; R115-L118 PolarHBondContact O-N 2.87Å; L118-S121 PolarHBondContact O-N 3.43Å; L118-V122 WeakPolarHBondContact O-CB 3.29Å; L118-V122 WeakPolarHBondContact O-CG2 3.39Å; L118-V122 PolarHBondContact O-N 3.31Å |
| 119 | C | 88.5 | Confident | 85.5 | Confident | 26 Ų | 26 | 38.5 Ų | 38.5 | 18% | 0.176 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -63.8 | -44.8 | 177.5 | -64.9 | 0 | 0 | 0 | 0 | 111.5 | R115 S116 Y117 V122 C123 S173 | R115-C119 WeakPolarHBondContact O-CB 3.28Å; R115-C119 PolarHBondContact O-N 2.97Å; R115-C119 PolarHBondContact O-SG 3.3Å; S116-C119 PolarHBondContact O-N 3.24Å; Y117-C119 PolarHBondContact O-N 3.47Å; C119-V122 PolarHBondContact O-N 2.89Å; C119-C123 VanDerWaalsContact O-CB 3.27Å; C119-C123 WeakPolarHBondContact O-CB 2.92Å; C119-C123 PolarHBondContact O-N 3.13Å; C119-S173 WeakPolarHBondContact O-CB 3.39Å |
| 120 | L | 90.9 | Very high | 87 | Confident | 57 Ų | 57 | 32.2 Ų | 32.2 | 30% | 0.298 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -63.5 | -46 | 178.2 | -178.2 | 64.2 | 0 | 0 | 0 | 111.6 | L96 V97 S116 Y117 C123 L124 | L96-L120 HydrophobicContact CB-CD2 3.8Å; L96-L120 HydrophobicContact CD1-CD2 4.05Å; V97-L120 HydrophobicContact CG2-CD2 4.25Å; V97-L120 HydrophobicContact CG2-CG 4.03Å; S116-L120 WeakPolarHBondContact O-CB 3.47Å; S116-L120 PolarHBondContact O-N 3.42Å; Y117-L120 PolarHBondContact O-N 2.96Å; L120-C123 PolarHBondContact O-N 2.98Å; L120-L124 HydrophobicContact CD1-CD1 3.79Å; L120-L124 HydrophobicContact CD1-CG 4.08Å; L120-L124 HydrophobicContact CG-CD1 3.96Å; L120-L124 WeakPolarHBondContact O-CG 3.47Å; L120-L124 PolarHBondContact O-N 3.01Å |
| 121 | S | 90.9 | Very high | 88.1 | Confident | 14 Ų | 14 | 28 Ų | 28 | 10% | 0.098 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -56 | -53.1 | 175.6 | 178.3 | 0 | 0 | 0 | 0 | 110.5 | Y117 L118 C123 L124 V125 Y341 | Y117-S121 WeakPolarHBondContact O-CB 3.34Å; Y117-S121 PolarHBondContact O-N 2.99Å; L118-S121 PolarHBondContact O-N 3.43Å; S121-C123 VanDerWaalsContact C-N 3.33Å; S121-C123 PolarHBondContact O-N 2.87Å; S121-L124 PolarHBondContact O-N 3.38Å; S121-V125 VanDerWaalsContact O-CB 3.28Å; S121-V125 WeakPolarHBondContact O-CB 3.4Å; S121-V125 WeakPolarHBondContact O-CG2 3.49Å; S121-V125 PolarHBondContact O-N 3.44Å; S121-Y341 PolarHBondContact OG-OH 2.89Å |
| 122 | V | 89.3 | Confident | 88.9 | Confident | 9 Ų | 9 | 24.5 Ų | 24.5 | 6% | 0.055 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -61.4 | -40.7 | 178.9 | 171.8 | 0 | 0 | 0 | 0 | 111.8 | L118 C119 S126 P176 L203 F219 Y223 | L118-V122 WeakPolarHBondContact O-CB 3.29Å; L118-V122 WeakPolarHBondContact O-CG2 3.39Å; L118-V122 PolarHBondContact O-N 3.31Å; C119-V122 PolarHBondContact O-N 2.89Å; V122-S126 VanDerWaalsContact O-CB 3.26Å; V122-S126 WeakPolarHBondContact O-CB 2.94Å; V122-S126 PolarHBondContact O-N 3.01Å; V122-P176 HydrophobicContact CG1-CG 4.35Å; V122-P176 HydrophobicContact CG2-CG 4.09Å; V122-L203 HydrophobicContact CG2-CD1 3.97Å; V122-F219 HydrophobicContact CG1-CE2 4.27Å; V122-F219 HydrophobicContact CG2-CE2 4.44Å; V122-F219 HydrophobicContact CG2-CZ 4.38Å; V122-Y223 HydrophobicContact CG1-CE1 4.14Å; V122-Y223 WeakPolarHBondContact CG1-OH 3.31Å |
| 123 | C | 93.7 | Very high | 89.6 | Confident | 10 Ų | 10 | 22.2 Ų | 22.2 | 7% | 0.068 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -62.7 | -53.6 | 177.6 | -173.4 | 0 | 0 | 0 | 0 | 112 | C119 L120 S121 S126 A127 | C119-C123 VanDerWaalsContact O-CB 3.27Å; C119-C123 WeakPolarHBondContact O-CB 2.92Å; C119-C123 PolarHBondContact O-N 3.13Å; L120-C123 PolarHBondContact O-N 2.98Å; S121-C123 VanDerWaalsContact C-N 3.33Å; S121-C123 PolarHBondContact O-N 2.87Å; C123-S126 WeakPolarHBondContact O-CB 3.31Å; C123-S126 PolarHBondContact O-N 2.91Å; C123-A127 PolarHBondContact O-N 2.92Å |
| 124 | L | 95 | Very high | 90.1 | Very high | 5 Ų | 5 | 19 Ų | 19 | 3% | 0.026 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -68.7 | -38.9 | -175.8 | -68 | 175.3 | 0 | 0 | 0 | 111.7 | V89 L92 A93 V97 L120 S121 S126 A127 A128 W166 | V89-L124 HydrophobicContact CG1-CB 4.43Å; V89-L124 HydrophobicContact CG1-CD2 4.22Å; V89-L124 WeakPolarHBondContact CG1-O 3.4Å; L92-L124 HydrophobicContact CB-CD1 4.2Å; L92-L124 HydrophobicContact CB-CD2 4.12Å; L92-L124 HydrophobicContact CD1-CD2 4.4Å; A93-L124 HydrophobicContact CB-CB 4.39Å; A93-L124 HydrophobicContact CB-CD1 4.26Å; V97-L124 HydrophobicContact CG2-CD1 3.71Å; L120-L124 HydrophobicContact CD1-CD1 3.79Å; L120-L124 HydrophobicContact CD1-CG 4.08Å; L120-L124 HydrophobicContact CG-CD1 3.96Å; L120-L124 WeakPolarHBondContact O-CG 3.47Å; L120-L124 PolarHBondContact O-N 3.01Å; S121-L124 PolarHBondContact O-N 3.38Å; L124-S126 PolarHBondContact O-N 2.9Å; L124-A127 PolarHBondContact O-N 3.46Å; L124-A128 WeakPolarHBondContact O-CB 3.41Å; L124-A128 PolarHBondContact O-N 3.35Å; L124-W166 HydrophobicContact CD2-CH2 4.2Å; L124-W166 HydrophobicContact CD2-CZ3 4.45Å |
| 125 | V | 91.7 | Very high | 90.6 | Very high | 12 Ų | 12 | 18.2 Ų | 18.2 | 7% | 0.073 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -58.9 | -47.1 | 170.4 | 168.6 | 0 | 0 | 0 | 0 | 110.7 | S121 A127 A128 I129 W309 F344 | S121-V125 VanDerWaalsContact O-CB 3.28Å; S121-V125 WeakPolarHBondContact O-CB 3.4Å; S121-V125 WeakPolarHBondContact O-CG2 3.49Å; S121-V125 PolarHBondContact O-N 3.44Å; V125-A127 VanDerWaalsContact C-N 3.34Å; V125-A127 PolarHBondContact O-N 2.89Å; V125-A128 PolarHBondContact O-N 2.85Å; V125-I129 HydrophobicContact CG1-CD1 3.73Å; V125-I129 HydrophobicContact CG1-CG1 4.31Å; V125-I129 VanDerWaalsContact O-CG1 3.26Å; V125-I129 WeakPolarHBondContact O-CG1 3.46Å; V125-I129 PolarHBondContact O-N 3.01Å; V125-W309 HydrophobicContact CB-CH2 4.07Å; V125-W309 HydrophobicContact CG1-CH2 3.24Å; V125-W309 HydrophobicContact CG1-CZ2 3.68Å; V125-W309 HydrophobicContact CG1-CZ3 3.79Å; V125-W309 HydrophobicContact CG2-CH2 3.63Å; V125-W309 HydrophobicContact CG2-CZ2 4.37Å; V125-W309 HydrophobicContact CG2-CZ3 4.48Å; V125-F344 HydrophobicContact CG2-CE2 4.45Å; V125-F344 HydrophobicContact CG2-CZ 3.69Å |
| 126 | S | 92.4 | Very high | 90.9 | Very high | 3 Ų | 3 | 14.7 Ų | 14.7 | 2% | 0.021 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -57.7 | -47.7 | 177.3 | -156 | 0 | 0 | 0 | 0 | 111.6 | V122 C123 L124 A128 I129 L130 | V122-S126 VanDerWaalsContact O-CB 3.26Å; V122-S126 WeakPolarHBondContact O-CB 2.94Å; V122-S126 PolarHBondContact O-N 3.01Å; C123-S126 WeakPolarHBondContact O-CB 3.31Å; C123-S126 PolarHBondContact O-N 2.91Å; L124-S126 PolarHBondContact O-N 2.9Å; S126-A128 PolarHBondContact O-N 3.47Å; S126-I129 PolarHBondContact O-N 3.41Å; S126-L130 WeakPolarHBondContact O-CB 3.25Å; S126-L130 WeakPolarHBondContact O-CD1 3.27Å; S126-L130 WeakPolarHBondContact O-CG 3.4Å; S126-L130 PolarHBondContact O-N 3.49Å |
| 127 | A | 95.7 | Very high | 91.1 | Very high | 0 Ų | 0 | 14.2 Ų | 14.2 | 0% | 0 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -62 | -42.1 | 179.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | V89 C123 L124 V125 T131 I165 A169 | V89-A127 HydrophobicContact CG1-CB 3.94Å; V89-A127 HydrophobicContact CG2-CB 4.16Å; C123-A127 PolarHBondContact O-N 2.92Å; L124-A127 PolarHBondContact O-N 3.46Å; V125-A127 VanDerWaalsContact C-N 3.34Å; V125-A127 PolarHBondContact O-N 2.89Å; A127-T131 WeakPolarHBondContact O-CB 3.4Å; A127-T131 PolarHBondContact O-N 2.88Å; A127-T131 PolarHBondContact O-OG1 3.17Å; A127-I165 HydrophobicContact CB-CG2 4.14Å; A127-A169 HydrophobicContact CB-CB 4.03Å |
| 128 | A | 94.9 | Very high | 91.1 | Very high | 1 Ų | 1 | 14.9 Ų | 14.9 | 1% | 0.008 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -63.3 | -49 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | L86 V89 L124 V125 S126 L130 T131 I132 F344 | L86-A128 HydrophobicContact CD1-CB 4.25Å; V89-A128 HydrophobicContact CG1-CB 4.02Å; L124-A128 WeakPolarHBondContact O-CB 3.41Å; L124-A128 PolarHBondContact O-N 3.35Å; V125-A128 PolarHBondContact O-N 2.85Å; S126-A128 PolarHBondContact O-N 3.47Å; A128-L130 PolarHBondContact O-N 3.3Å; A128-T131 PolarHBondContact O-N 2.93Å; A128-I132 WeakPolarHBondContact O-CG1 3.3Å; A128-I132 PolarHBondContact O-N 3.48Å; A128-F344 HydrophobicContact CB-CE1 3.93Å |
| 129 | I | 91.9 | Very high | 90.9 | Very high | 4 Ų | 4 | 15.5 Ų | 15.5 | 2% | 0.021 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -61.1 | -45.1 | 179.3 | -64.4 | 178 | 0 | 0 | 0 | 111.3 | V125 S126 T131 I132 C133 P227 F305 W309 | V125-I129 HydrophobicContact CG1-CD1 3.73Å; V125-I129 HydrophobicContact CG1-CG1 4.31Å; V125-I129 VanDerWaalsContact O-CG1 3.26Å; V125-I129 WeakPolarHBondContact O-CG1 3.46Å; V125-I129 PolarHBondContact O-N 3.01Å; S126-I129 PolarHBondContact O-N 3.41Å; I129-T131 VanDerWaalsContact C-N 3.33Å; I129-T131 PolarHBondContact O-N 2.94Å; I129-I132 WeakPolarHBondContact O-CB 3.08Å; I129-I132 PolarHBondContact O-N 2.93Å; I129-C133 PolarHBondContact O-N 3.44Å; I129-C133 PolarHBondContact O-SG 2.82Å; I129-C133 VanDerWaalsContact O-SG 3.39Å; I129-P227 HydrophobicContact CG2-CB 3.49Å; I129-P227 VanDerWaalsContact CG2-CB 3.49Å; I129-P227 HydrophobicContact CG2-CG 3.53Å; I129-F305 HydrophobicContact CB-CE2 4.36Å; I129-F305 HydrophobicContact CD1-CE2 4.09Å; I129-F305 HydrophobicContact CG1-CE2 3.9Å; I129-F305 HydrophobicContact CG2-CE2 3.73Å; I129-F305 HydrophobicContact CG2-CZ 4.12Å; I129-W309 HydrophobicContact CD1-CD2 4.38Å; I129-W309 HydrophobicContact CD1-CZ2 4.28Å; I129-W309 HydrophobicContact CG1-CZ2 4.46Å |
| 130 | L | 92.9 | Very high | 90.6 | Very high | 28 Ų | 28 | 16.2 Ų | 16.2 | 15% | 0.147 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -66.9 | -36.1 | 178.5 | -65.9 | 165.8 | 0 | 0 | 0 | 112.1 | S126 A128 C133 A134 I165 K168 | S126-L130 WeakPolarHBondContact O-CB 3.25Å; S126-L130 WeakPolarHBondContact O-CD1 3.27Å; S126-L130 WeakPolarHBondContact O-CG 3.4Å; S126-L130 PolarHBondContact O-N 3.49Å; A128-L130 PolarHBondContact O-N 3.3Å; L130-C133 WeakPolarHBondContact O-CB 3.39Å; L130-C133 PolarHBondContact O-N 3.02Å; L130-A134 WeakPolarHBondContact O-CB 3.21Å; L130-A134 PolarHBondContact O-N 3.04Å; L130-I165 HydrophobicContact CB-CB 4.5Å; L130-I165 HydrophobicContact CB-CG1 3.99Å; L130-I165 HydrophobicContact CB-CG2 4.01Å; L130-I165 HydrophobicContact CD1-CG2 4.35Å; L130-K168 HydrophobicContact CD1-CB 4.02Å; L130-K168 HydrophobicContact CD1-CD 3.56Å; L130-K168 HydrophobicContact CD1-CG 3.76Å; L130-K168 HydrophobicContact CD2-CD 3.75Å; L130-K168 VanDerWaalsContact CD2-CE 3.48Å; L130-K168 HydrophobicContact CG-CD 4.29Å |
| 131 | T | 94.8 | Very high | 90.1 | Very high | 0 Ų | 0 | 19 Ų | 19 | 0% | 0 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -64.8 | -42.1 | 173.8 | -55 | 0 | 0 | 0 | 0 | 110.7 | F82 H85 L86 A127 A128 I129 C133 A134 I135 | F82-T131 HydrophobicContact CB-CG2 4.41Å; F82-T131 VanDerWaalsContact O-CG2 3.26Å; F82-T131 WeakPolarHBondContact O-CG2 3.45Å; H85-T131 HydrophobicContact CB-CG2 4.4Å; H85-T131 PolarHBondContact CE1-OG1 2.95Å; H85-T131 PolarHBondContact ND1-OG1 3.38Å; L86-T131 HydrophobicContact CB-CG2 3.79Å; L86-T131 HydrophobicContact CD1-CG2 4.36Å; A127-T131 WeakPolarHBondContact O-CB 3.4Å; A127-T131 PolarHBondContact O-N 2.88Å; A127-T131 PolarHBondContact O-OG1 3.17Å; A128-T131 PolarHBondContact O-N 2.93Å; I129-T131 VanDerWaalsContact C-N 3.33Å; I129-T131 PolarHBondContact O-N 2.94Å; T131-C133 VanDerWaalsContact C-N 3.35Å; T131-C133 PolarHBondContact O-N 2.89Å; T131-A134 WeakPolarHBondContact O-CB 3.46Å; T131-A134 PolarHBondContact O-N 2.74Å; T131-I135 HydrophobicContact CG2-CD1 4.18Å; T131-I135 VanDerWaalsContact O-CG1 3.31Å; T131-I135 WeakPolarHBondContact O-CG1 3.28Å; T131-I135 PolarHBondContact O-N 3.02Å |
| 132 | I | 91.5 | Very high | 89.6 | Confident | 6 Ų | 6 | 24.7 Ų | 24.7 | 3% | 0.031 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -58.9 | -45.5 | 172.9 | -72.7 | 166.4 | 0 | 0 | 0 | 110.9 | L86 A128 I129 A134 I135 N136 I231 Y351 | L86-I132 HydrophobicContact CD1-CD1 4.46Å; L86-I132 HydrophobicContact CD1-CG1 4.03Å; L86-I132 HydrophobicContact CD2-CG1 4.11Å; A128-I132 WeakPolarHBondContact O-CG1 3.3Å; A128-I132 PolarHBondContact O-N 3.48Å; I129-I132 WeakPolarHBondContact O-CB 3.08Å; I129-I132 PolarHBondContact O-N 2.93Å; I132-A134 VanDerWaalsContact C-N 3.34Å; I132-A134 PolarHBondContact O-N 3.43Å; I132-I135 PolarHBondContact O-N 3.39Å; I132-N136 WeakPolarHBondContact CG2-ND2 3.38Å; I132-N136 PolarHBondContact O-N 2.79Å; I132-N136 PolarHBondContact O-ND2 3.5Å; I132-I231 HydrophobicContact CG2-CD1 4.09Å; I132-Y351 HydrophobicContact CG1-CE2 4.18Å; I132-Y351 WeakPolarHBondContact CG2-OH 3.49Å |
| 133 | C | 91.1 | Very high | 88.8 | Confident | 9 Ų | 9 | 27.6 Ų | 27.6 | 6% | 0.061 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -59.4 | -44.7 | 174.4 | -69.5 | 0 | 0 | 0 | 0 | 111.7 | I129 L130 T131 N136 V137 I230 | I129-C133 PolarHBondContact O-N 3.44Å; I129-C133 PolarHBondContact O-SG 2.82Å; I129-C133 VanDerWaalsContact O-SG 3.39Å; L130-C133 WeakPolarHBondContact O-CB 3.39Å; L130-C133 PolarHBondContact O-N 3.02Å; T131-C133 VanDerWaalsContact C-N 3.35Å; T131-C133 PolarHBondContact O-N 2.89Å; C133-N136 PolarHBondContact O-N 2.94Å; C133-V137 WeakPolarHBondContact O-CG2 3.38Å; C133-V137 PolarHBondContact O-N 2.93Å; C133-I230 HydrophobicContact CB-CG2 4.35Å |
| 134 | A | 91.8 | Very high | 87.9 | Confident | 16 Ų | 16 | 28.3 Ų | 28.3 | 13% | 0.132 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -61.5 | -44.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112 | F82 L130 T131 I132 N136 V137 E138 V161 I165 | F82-A134 HydrophobicContact CD1-CB 4.14Å; F82-A134 HydrophobicContact CE1-CB 4.16Å; L130-A134 WeakPolarHBondContact O-CB 3.21Å; L130-A134 PolarHBondContact O-N 3.04Å; T131-A134 WeakPolarHBondContact O-CB 3.46Å; T131-A134 PolarHBondContact O-N 2.74Å; I132-A134 VanDerWaalsContact C-N 3.34Å; I132-A134 PolarHBondContact O-N 3.43Å; A134-N136 VanDerWaalsContact C-N 3.31Å; A134-N136 PolarHBondContact O-N 2.87Å; A134-V137 PolarHBondContact O-N 3.19Å; A134-E138 WeakPolarHBondContact O-CB 3.48Å; A134-E138 PolarHBondContact O-N 2.86Å; A134-V161 HydrophobicContact CB-CG1 4.14Å; A134-I165 HydrophobicContact CB-CD1 4.3Å |
| 135 | I | 90.1 | Very high | 86.9 | Confident | 1 Ų | 1 | 33.1 Ų | 33.1 | 1% | 0.005 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -59.5 | -42.9 | 174.9 | -67.1 | 164.6 | 0 | 0 | 0 | 110.8 | F82 V83 L86 T131 I132 E138 R139 Y351 | F82-I135 HydrophobicContact CB-CD1 4.31Å; F82-I135 HydrophobicContact CB-CG1 3.53Å; V83-I135 HydrophobicContact CG2-CD1 4.29Å; L86-I135 HydrophobicContact CB-CD1 4.24Å; L86-I135 HydrophobicContact CD2-CD1 3.79Å; T131-I135 HydrophobicContact CG2-CD1 4.18Å; T131-I135 VanDerWaalsContact O-CG1 3.31Å; T131-I135 WeakPolarHBondContact O-CG1 3.28Å; T131-I135 PolarHBondContact O-N 3.02Å; I132-I135 PolarHBondContact O-N 3.39Å; I135-E138 PolarHBondContact O-N 3.36Å; I135-R139 HydrophobicContact CG2-CG 4.43Å; I135-R139 WeakPolarHBondContact O-CB 3.14Å; I135-R139 VanDerWaalsContact O-CG 3.26Å; I135-R139 WeakPolarHBondContact O-CG 3.37Å; I135-R139 PolarHBondContact O-N 2.92Å; I135-Y351 HydrophobicContact CB-CE1 4.4Å; I135-Y351 HydrophobicContact CD1-CD1 4.08Å; I135-Y351 HydrophobicContact CD1-CE1 4.25Å; I135-Y351 HydrophobicContact CG2-CD1 3.84Å; I135-Y351 HydrophobicContact CG2-CE1 3.78Å |
| 136 | N | 86.5 | Confident | 85.9 | Confident | 3 Ų | 3 | 36 Ų | 36 | 2% | 0.016 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -64.4 | -44.4 | 178.1 | -73.8 | -52.7 | 0 | 0 | 0 | 111.3 | I132 C133 A134 R139 Y140 V234 Y235 | I132-N136 WeakPolarHBondContact CG2-ND2 3.38Å; I132-N136 PolarHBondContact O-N 2.79Å; I132-N136 PolarHBondContact O-ND2 3.5Å; C133-N136 PolarHBondContact O-N 2.94Å; A134-N136 VanDerWaalsContact C-N 3.31Å; A134-N136 PolarHBondContact O-N 2.87Å; N136-R139 PolarHBondContact O-N 3.29Å; N136-Y140 WeakPolarHBondContact O-CB 3.34Å; N136-Y140 PolarHBondContact O-N 2.88Å; N136-V234 HydrophobicContact CB-CG1 4.03Å; N136-V234 WeakPolarHBondContact O-CG1 3.4Å; N136-Y235 VanDerWaalsContact OD1-CZ 3.27Å; N136-Y235 PolarHBondContact OD1-OH 3.42Å |
| 137 | V | 87.3 | Confident | 84.5 | Confident | 51 Ų | 51 | 43.6 Ų | 43.6 | 31% | 0.309 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -63.9 | -43.3 | 176.8 | 172.1 | 0 | 0 | 0 | 0 | 111.5 | C133 A134 Y140 Y141 I230 V234 | C133-V137 WeakPolarHBondContact O-CG2 3.38Å; C133-V137 PolarHBondContact O-N 2.93Å; A134-V137 PolarHBondContact O-N 3.19Å; V137-Y140 WeakPolarHBondContact O-CB 3.42Å; V137-Y140 PolarHBondContact O-N 3.46Å; V137-Y141 HydrophobicContact CG1-CD2 3.8Å; V137-Y141 HydrophobicContact CG1-CE2 3.72Å; V137-Y141 VanDerWaalsContact O-CD2 3.29Å; V137-Y141 WeakPolarHBondContact O-CD2 3.47Å; V137-Y141 PolarHBondContact O-N 3.29Å; V137-I230 HydrophobicContact CG2-CG2 4.16Å; V137-V234 HydrophobicContact CG2-CG2 4.07Å |
| 138 | E | 86.2 | Confident | 83.2 | Confident | 25 Ų | 25 | 51.2 Ų | 51.2 | 12% | 0.117 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -58 | -50.1 | 174.3 | 178.2 | -174.3 | -131.8 | 0 | 0 | 110.9 | F82 A134 I135 Y140 Y141 Y142 M153 | F82-E138 HydrophobicContact CD2-CB 4.41Å; F82-E138 WeakPolarHBondContact CD2-OE2 3.1Å; F82-E138 HydrophobicContact CE2-CB 4.38Å; A134-E138 WeakPolarHBondContact O-CB 3.48Å; A134-E138 PolarHBondContact O-N 2.86Å; I135-E138 PolarHBondContact O-N 3.36Å; E138-Y140 VanDerWaalsContact C-N 3.27Å; E138-Y140 PolarHBondContact O-N 2.92Å; E138-Y141 PolarHBondContact O-N 3.41Å; E138-Y141 VanDerWaalsContact O-N 3.13Å; E138-Y142 PolarHBondContact O-N 3.22Å; E138-M153 HydrophobicContact CG-CE 4.22Å |
| 139 | R | 82.1 | Confident | 81.8 | Confident | 46 Ų | 46 | 52.7 Ų | 52.7 | 17% | 0.174 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -58.7 | -39 | 176.9 | -75.5 | 175.8 | 178 | -177.1 | -1.4 | 112.2 | I135 N136 Y142 I143 | I135-R139 HydrophobicContact CG2-CG 4.43Å; I135-R139 WeakPolarHBondContact O-CB 3.14Å; I135-R139 VanDerWaalsContact O-CG 3.26Å; I135-R139 WeakPolarHBondContact O-CG 3.37Å; I135-R139 PolarHBondContact O-N 2.92Å; N136-R139 PolarHBondContact O-N 3.29Å; R139-Y142 PolarHBondContact O-N 3.49Å; R139-I143 WeakPolarHBondContact O-CB 3.27Å; R139-I143 VanDerWaalsContact O-CG1 3.29Å; R139-I143 WeakPolarHBondContact O-CG1 3.44Å; R139-I143 PolarHBondContact O-N 2.69Å |
| 140 | Y | 82.2 | Confident | 80.5 | Confident | 41 Ų | 41 | 60.1 Ų | 60.1 | 16% | 0.161 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -59.6 | -51 | 174.1 | 171.6 | -101.2 | 0 | 0 | 0 | 111.7 | N136 V137 E138 Y142 I143 V144 Y145 N237 | N136-Y140 WeakPolarHBondContact O-CB 3.34Å; N136-Y140 PolarHBondContact O-N 2.88Å; V137-Y140 WeakPolarHBondContact O-CB 3.42Å; V137-Y140 PolarHBondContact O-N 3.46Å; E138-Y140 VanDerWaalsContact C-N 3.27Å; E138-Y140 PolarHBondContact O-N 2.92Å; Y140-Y142 VanDerWaalsContact C-N 3.33Å; Y140-Y142 PolarHBondContact O-N 3.32Å; Y140-I143 PolarHBondContact O-N 3.22Å; Y140-V144 HydrophobicContact CD2-CG2 3.68Å; Y140-V144 HydrophobicContact CE2-CB 4.15Å; Y140-V144 HydrophobicContact CE2-CG1 4.48Å; Y140-V144 HydrophobicContact CE2-CG2 3.41Å; Y140-V144 VanDerWaalsContact CE2-CG2 3.41Å; Y140-V144 HydrophobicContact CG-CG2 4.45Å; Y140-V144 WeakPolarHBondContact O-CB 3.33Å; Y140-V144 WeakPolarHBondContact O-CG2 3.36Å; Y140-V144 PolarHBondContact O-N 2.91Å; Y140-Y145 HydrophobicContact CE1-CE2 4.44Å; Y140-N237 HydrophobicContact CD2-CB 4.2Å; Y140-N237 HydrophobicContact CE2-CB 3.5Å; Y140-N237 VanDerWaalsContact CE2-CB 3.5Å |
| 141 | Y | 80.6 | Confident | 79.1 | Confident | 116 Ų | 116 | 64.5 Ų | 64.5 | 46% | 0.455 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -62.2 | -40.5 | 178.4 | -84.3 | -73.8 | 0 | 0 | 0 | 112.2 | V137 E138 Y145 | V137-Y141 HydrophobicContact CG1-CD2 3.8Å; V137-Y141 HydrophobicContact CG1-CE2 3.72Å; V137-Y141 VanDerWaalsContact O-CD2 3.29Å; V137-Y141 WeakPolarHBondContact O-CD2 3.47Å; V137-Y141 PolarHBondContact O-N 3.29Å; E138-Y141 PolarHBondContact O-N 3.41Å; E138-Y141 VanDerWaalsContact O-N 3.13Å; Y141-Y145 HydrophobicContact CD1-CD2 4.09Å; Y141-Y145 HydrophobicContact CE1-CD2 4.41Å; Y141-Y145 CarbonylContact O-C 3.59Å; Y141-Y145 WeakPolarHBondContact O-CA 3.31Å; Y141-Y145 PolarHBondContact O-N 3.46Å |
| 142 | Y | 79 | Confident | 77.7 | Confident | 133 Ų | 133 | 70.6 Ų | 70.6 | 52% | 0.522 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -61.8 | -42.5 | 176.5 | -179.7 | -95.6 | 0 | 0 | 0 | 112.6 | E138 R139 Y140 P146 H149 | E138-Y142 PolarHBondContact O-N 3.22Å; R139-Y142 PolarHBondContact O-N 3.49Å; Y140-Y142 VanDerWaalsContact C-N 3.33Å; Y140-Y142 PolarHBondContact O-N 3.32Å; Y142-P146 WeakPolarHBondContact O-CA 3.47Å; Y142-H149 AromaticContact CD2-ND1 3.94Å |
| 143 | I | 74.3 | Confident | 76.9 | Confident | 69 Ų | 69 | 73 Ų | 73 | 35% | 0.354 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -78.9 | -42.3 | -176.8 | -68.5 | 166 | 0 | 0 | 0 | 112 | R139 Y140 M238 | R139-I143 WeakPolarHBondContact O-CB 3.27Å; R139-I143 VanDerWaalsContact O-CG1 3.29Å; R139-I143 WeakPolarHBondContact O-CG1 3.44Å; R139-I143 PolarHBondContact O-N 2.69Å; Y140-I143 PolarHBondContact O-N 3.22Å; I143-M238 HydrophobicContact CB-CG 4.43Å; I143-M238 HydrophobicContact CD1-CG 3.85Å; I143-M238 HydrophobicContact CD1-SD 3.3Å; I143-M238 WeakPolarHBondContact CD1-SD 3.42Å; I143-M238 HydrophobicContact CG2-CG 4.03Å |
| 144 | V | 74.2 | Confident | 76.7 | Confident | 26 Ų | 26 | 76.1 Ų | 76.1 | 16% | 0.158 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -85.5 | -34.5 | -174.1 | -178.2 | 0 | 0 | 0 | 0 | 112 | Y140 V241 | Y140-V144 HydrophobicContact CD2-CG2 3.68Å; Y140-V144 HydrophobicContact CE2-CB 4.15Å; Y140-V144 HydrophobicContact CE2-CG1 4.48Å; Y140-V144 HydrophobicContact CE2-CG2 3.41Å; Y140-V144 VanDerWaalsContact CE2-CG2 3.41Å; Y140-V144 HydrophobicContact CG-CG2 4.45Å; Y140-V144 WeakPolarHBondContact O-CB 3.33Å; Y140-V144 WeakPolarHBondContact O-CG2 3.36Å; Y140-V144 PolarHBondContact O-N 2.91Å; V144-V241 HydrophobicContact CG1-CG2 4.15Å; V144-V241 HydrophobicContact CG2-CB 4.24Å; V144-V241 HydrophobicContact CG2-CG1 4.34Å; V144-V241 HydrophobicContact CG2-CG2 3.88Å |
| 145 | Y | 72.9 | Confident | 76.4 | Confident | 106 Ų | 106 | 81 Ų | 81 | 42% | 0.416 | 39% | 0.39 | S | S | . | . | trans | -133.7 | 61 | -175.7 | -56.5 | -69.4 | 0 | 0 | 0 | 112.2 | Y140 Y141 M147 R148 H149 | Y140-Y145 HydrophobicContact CE1-CE2 4.44Å; Y141-Y145 HydrophobicContact CD1-CD2 4.09Å; Y141-Y145 HydrophobicContact CE1-CD2 4.41Å; Y141-Y145 CarbonylContact O-C 3.59Å; Y141-Y145 WeakPolarHBondContact O-CA 3.31Å; Y141-Y145 PolarHBondContact O-N 3.46Å; Y145-M147 VanDerWaalsContact C-N 3.32Å; Y145-M147 PolarHBondContact O-N 2.93Å; Y145-R148 PolarHBondContact O-N 3.24Å; Y145-H149 PolarHBondContact O-N 3.47Å | ||
| 146 | P | 71.2 | Confident | 76.4 | Confident | 72 Ų | 72 | 83.3 Ų | 83.3 | 47% | 0.468 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -55 | -44.5 | -174 | 20.9 | -32.8 | 0 | 0 | 0 | 112.9 | Y142 R148 H149 E150 | Y142-P146 WeakPolarHBondContact O-CA 3.47Å; P146-R148 VanDerWaalsContact C-N 3.33Å; P146-R148 PolarHBondContact O-N 3.44Å; P146-H149 WeakPolarHBondContact O-CB 3.22Å; P146-H149 PolarHBondContact O-N 2.88Å; P146-E150 PolarHBondContact O-N 2.67Å |
| 147 | M | 64.3 | Low | 76.6 | Confident | 162 Ų | 162 | 86.2 Ų | 86.2 | 80% | 0.798 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -66.4 | -28.2 | 179.7 | -65.4 | -75.4 | -70.7 | 0 | 0 | 113.9 | Y145 | Y145-M147 VanDerWaalsContact C-N 3.32Å; Y145-M147 PolarHBondContact O-N 2.93Å |
| 148 | R | 67.3 | Low | 76.7 | Confident | 160 Ų | 160 | 84.7 Ų | 84.7 | 60% | 0.604 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -87.5 | -24.3 | 176.9 | -71.2 | -176.9 | 174.1 | -161.9 | -3.6 | 112 | Y145 P146 K152 | Y145-R148 PolarHBondContact O-N 3.24Å; P146-R148 VanDerWaalsContact C-N 3.33Å; P146-R148 PolarHBondContact O-N 3.44Å; R148-K152 VanDerWaalsContact O-CB 3.27Å; R148-K152 WeakPolarHBondContact O-CB 3.45Å; R148-K152 VanDerWaalsContact O-CG 3.29Å; R148-K152 WeakPolarHBondContact O-CG 3.48Å; R148-K152 PolarHBondContact O-N 2.89Å; R148-K152 VanDerWaalsContact O-N 3.1Å |
| 149 | H | 65.8 | Low | 77.1 | Confident | 32 Ų | 32 | 87.1 Ų | 87.1 | 15% | 0.148 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -64.1 | -46.8 | 178.2 | 179.1 | -84.4 | 0 | 0 | 0 | 111.1 | Y142 Y145 P146 V151 K152 M153 | Y142-H149 AromaticContact CD2-ND1 3.94Å; Y145-H149 PolarHBondContact O-N 3.47Å; P146-H149 WeakPolarHBondContact O-CB 3.22Å; P146-H149 PolarHBondContact O-N 2.88Å; H149-V151 VanDerWaalsContact C-N 3.28Å; H149-V151 PolarHBondContact O-N 3.13Å; H149-K152 PolarHBondContact O-N 3.28Å; H149-M153 WeakPolarHBondContact O-CB 3.26Å; H149-M153 PolarHBondContact O-N 3.27Å |
| 150 | E | 64.5 | Low | 77.7 | Confident | 161 Ų | 161 | 88 Ų | 88 | 75% | 0.752 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -63.5 | -31.4 | -178.6 | -64.4 | -168.2 | 161.7 | 0 | 0 | 113.5 | P146 | P146-E150 PolarHBondContact O-N 2.67Å |
| 151 | V | 62.6 | Low | 78.3 | Confident | 119 Ų | 119 | 88.7 Ų | 88.7 | 72% | 0.721 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -88.2 | -26.6 | -178.7 | -170.9 | 0 | 0 | 0 | 0 | 112.6 | H149 | H149-V151 VanDerWaalsContact C-N 3.28Å; H149-V151 PolarHBondContact O-N 3.13Å |
| 152 | K | 67.1 | Low | 79.1 | Confident | 129 Ų | 129 | 84.8 Ų | 84.8 | 56% | 0.561 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -97.2 | -27.1 | -176 | -68.8 | -174.3 | 175.9 | -165.9 | 0 | 114.2 | R148 H149 T154 | R148-K152 VanDerWaalsContact O-CB 3.27Å; R148-K152 WeakPolarHBondContact O-CB 3.45Å; R148-K152 VanDerWaalsContact O-CG 3.29Å; R148-K152 WeakPolarHBondContact O-CG 3.48Å; R148-K152 PolarHBondContact O-N 2.89Å; R148-K152 VanDerWaalsContact O-N 3.1Å; H149-K152 PolarHBondContact O-N 3.28Å; K152-T154 VanDerWaalsContact C-N 3.27Å; K152-T154 PolarHBondContact O-N 3.39Å |
| 153 | M | 74.2 | Confident | 79.9 | Confident | 57 Ų | 57 | 82.1 Ų | 82.1 | 28% | 0.281 | 45% | 0.448 | S | S | . | . | trans | -84 | 72.2 | -173.9 | -150.7 | 65.6 | 176.6 | 0 | 0 | 111.1 | F82 E138 H149 V157 V158 | F82-M153 HydrophobicContact CE2-CE 3.42Å; F82-M153 VanDerWaalsContact CE2-CE 3.42Å; F82-M153 HydrophobicContact CZ-CE 3.94Å; E138-M153 HydrophobicContact CG-CE 4.22Å; H149-M153 WeakPolarHBondContact O-CB 3.26Å; H149-M153 PolarHBondContact O-N 3.27Å; M153-V157 HydrophobicContact SD-CG1 4.48Å; M153-V158 HydrophobicContact CE-CG2 4Å | ||
| 154 | T | 86.1 | Confident | 81 | Confident | 74 Ų | 74 | 80.6 Ų | 80.6 | 45% | 0.454 | 45% | 0.45 | S | S | . | . | trans | -84 | 157.6 | 176.6 | 64.2 | 0 | 0 | 0 | 0 | 111.3 | K152 G156 V157 V158 | K152-T154 VanDerWaalsContact C-N 3.27Å; K152-T154 PolarHBondContact O-N 3.39Å; T154-G156 PolarHBondContact O-N 3.48Å; T154-V157 PolarHBondContact O-N 3.31Å; T154-V157 VanDerWaalsContact O-N 3.08Å; T154-V157 PolarHBondContact OG1-N 3.37Å; T154-V158 PolarHBondContact O-N 3.43Å | ||
| 155 | V | 86.2 | Confident | 82 | Confident | 117 Ų | 117 | 79.8 Ų | 79.8 | 71% | 0.709 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -54.9 | -37.1 | 175.2 | -179.9 | 0 | 0 | 0 | 0 | 111.2 | V157 V158 V159 | V155-V157 PolarHBondContact O-N 3.36Å; V155-V158 PolarHBondContact O-N 2.97Å; V155-V159 HydrophobicContact CG1-CG2 4.24Å; V155-V159 VanDerWaalsContact O-CG2 3.32Å; V155-V159 WeakPolarHBondContact O-CG2 3.3Å; V155-V159 PolarHBondContact O-N 2.82Å |
| 156 | G | 89.5 | Confident | 83.2 | Confident | 50 Ų | 50 | 78.5 Ų | 78.5 | 52% | 0.515 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -61.8 | -41.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | T154 A160 | T154-G156 PolarHBondContact O-N 3.48Å; G156-A160 VanDerWaalsContact O-CB 3.31Å; G156-A160 WeakPolarHBondContact O-CB 3.39Å; G156-A160 PolarHBondContact O-N 2.88Å |
| 157 | V | 90.4 | Very high | 84.4 | Confident | 64 Ų | 64 | 79.8 Ų | 79.8 | 39% | 0.388 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -65.6 | -44.6 | 176.1 | 173.8 | 0 | 0 | 0 | 0 | 110.7 | M153 T154 V155 A160 V161 | M153-V157 HydrophobicContact SD-CG1 4.48Å; T154-V157 PolarHBondContact O-N 3.31Å; T154-V157 VanDerWaalsContact O-N 3.08Å; T154-V157 PolarHBondContact OG1-N 3.37Å; V155-V157 PolarHBondContact O-N 3.36Å; V157-A160 PolarHBondContact O-N 3.47Å; V157-V161 HydrophobicContact CG1-CG2 4.48Å; V157-V161 WeakPolarHBondContact O-CG2 3.29Å; V157-V161 PolarHBondContact O-N 3.17Å |
| 158 | V | 91.2 | Very high | 85.6 | Confident | 19 Ų | 19 | 75.8 Ų | 75.8 | 12% | 0.115 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -58.5 | -51.3 | 177.2 | 175.2 | 0 | 0 | 0 | 0 | 110.4 | A81 F82 M153 T154 V155 A160 V161 L162 | A81-V158 HydrophobicContact CB-CG1 3.8Å; F82-V158 HydrophobicContact CE1-CG1 4.3Å; F82-V158 HydrophobicContact CE2-CG2 4.46Å; F82-V158 HydrophobicContact CZ-CG1 4.21Å; F82-V158 HydrophobicContact CZ-CG2 4.39Å; M153-V158 HydrophobicContact CE-CG2 4Å; T154-V158 PolarHBondContact O-N 3.43Å; V155-V158 PolarHBondContact O-N 2.97Å; V158-A160 VanDerWaalsContact C-N 3.32Å; V158-A160 PolarHBondContact O-N 2.87Å; V158-V161 PolarHBondContact O-N 3.24Å; V158-L162 HydrophobicContact CG1-CD1 4.2Å; V158-L162 HydrophobicContact CG1-CG 4.4Å; V158-L162 WeakPolarHBondContact O-CG 3.08Å; V158-L162 PolarHBondContact O-N 3.46Å |
| 159 | V | 93.6 | Very high | 86.9 | Confident | 77 Ų | 77 | 68.2 Ų | 68.2 | 47% | 0.467 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -59.1 | -43.9 | 178.6 | 171.8 | 0 | 0 | 0 | 0 | 111.1 | V155 V161 L162 V163 | V155-V159 HydrophobicContact CG1-CG2 4.24Å; V155-V159 VanDerWaalsContact O-CG2 3.32Å; V155-V159 WeakPolarHBondContact O-CG2 3.3Å; V155-V159 PolarHBondContact O-N 2.82Å; V159-V161 VanDerWaalsContact C-N 3.35Å; V159-V161 PolarHBondContact O-N 3.41Å; V159-L162 PolarHBondContact O-N 2.93Å; V159-V163 HydrophobicContact CG1-CG2 4.31Å; V159-V163 WeakPolarHBondContact O-CG2 3.23Å; V159-V163 PolarHBondContact O-N 3.26Å |
| 160 | A | 94.9 | Very high | 88.2 | Confident | 64 Ų | 64 | 70.9 Ų | 70.9 | 53% | 0.529 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -60.9 | -41.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | G156 V157 V158 G164 | G156-A160 VanDerWaalsContact O-CB 3.31Å; G156-A160 WeakPolarHBondContact O-CB 3.39Å; G156-A160 PolarHBondContact O-N 2.88Å; V157-A160 PolarHBondContact O-N 3.47Å; V158-A160 VanDerWaalsContact C-N 3.32Å; V158-A160 PolarHBondContact O-N 2.87Å; A160-G164 PolarHBondContact O-N 3.22Å |
| 161 | V | 95.2 | Very high | 89.5 | Confident | 56 Ų | 56 | 67.5 Ų | 67.5 | 34% | 0.339 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -63.9 | -45.1 | 175 | 174.1 | 0 | 0 | 0 | 0 | 110.7 | F82 A134 V157 V158 V159 V163 G164 I165 | F82-V161 HydrophobicContact CE1-CB 3.98Å; F82-V161 HydrophobicContact CE1-CG1 3.61Å; F82-V161 HydrophobicContact CZ-CB 4.11Å; F82-V161 HydrophobicContact CZ-CG1 3.96Å; A134-V161 HydrophobicContact CB-CG1 4.14Å; V157-V161 HydrophobicContact CG1-CG2 4.48Å; V157-V161 WeakPolarHBondContact O-CG2 3.29Å; V157-V161 PolarHBondContact O-N 3.17Å; V158-V161 PolarHBondContact O-N 3.24Å; V159-V161 VanDerWaalsContact C-N 3.35Å; V159-V161 PolarHBondContact O-N 3.41Å; V161-V163 PolarHBondContact O-N 2.94Å; V161-G164 PolarHBondContact O-N 3.48Å; V161-I165 HydrophobicContact CG1-CD1 3.97Å; V161-I165 HydrophobicContact CG1-CG1 4.42Å; V161-I165 VanDerWaalsContact O-CG1 3.27Å; V161-I165 WeakPolarHBondContact O-CG1 3.29Å; V161-I165 PolarHBondContact O-N 3.3Å |
| 162 | L | 95.9 | Very high | 90.6 | Very high | 34 Ų | 34 | 62.6 Ų | 62.6 | 18% | 0.178 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -61.1 | -45.3 | 178 | -66.6 | -177.9 | 0 | 0 | 0 | 112.1 | F82 H85 V158 V159 G164 I165 W166 | F82-L162 HydrophobicContact CD1-CD2 3.74Å; F82-L162 HydrophobicContact CE1-CD2 3.93Å; F82-L162 HydrophobicContact CE1-CG 4.34Å; H85-L162 HydrophobicContact CB-CD2 3.79Å; V158-L162 HydrophobicContact CG1-CD1 4.2Å; V158-L162 HydrophobicContact CG1-CG 4.4Å; V158-L162 WeakPolarHBondContact O-CG 3.08Å; V158-L162 PolarHBondContact O-N 3.46Å; V159-L162 PolarHBondContact O-N 2.93Å; L162-G164 VanDerWaalsContact C-N 3.33Å; L162-G164 PolarHBondContact O-N 2.86Å; L162-I165 HydrophobicContact CD2-CD1 4.31Å; L162-I165 WeakPolarHBondContact O-CB 3.34Å; L162-I165 PolarHBondContact O-N 3Å; L162-W166 VanDerWaalsContact O-CD1 3.26Å; L162-W166 PolarHBondContact O-N 3.24Å; L162-W166 VanDerWaalsContact O-N 3.14Å |
| 163 | V | 96.9 | Very high | 91.6 | Very high | 76 Ų | 76 | 56.6 Ų | 56.6 | 46% | 0.461 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -60.4 | -44.5 | 174.8 | 170.2 | 0 | 0 | 0 | 0 | 110.6 | V159 V161 I165 W166 I167 | V159-V163 HydrophobicContact CG1-CG2 4.31Å; V159-V163 WeakPolarHBondContact O-CG2 3.23Å; V159-V163 PolarHBondContact O-N 3.26Å; V161-V163 PolarHBondContact O-N 2.94Å; V163-I165 VanDerWaalsContact C-N 3.3Å; V163-I165 PolarHBondContact O-N 3.37Å; V163-W166 PolarHBondContact O-N 2.92Å; V163-I167 HydrophobicContact CG1-CD1 3.67Å; V163-I167 HydrophobicContact CG1-CG1 4.31Å; V163-I167 WeakPolarHBondContact O-CG1 3.4Å; V163-I167 PolarHBondContact O-N 3.43Å |
| 164 | G | 96.4 | Very high | 92.1 | Very high | 37 Ų | 37 | 58.6 Ų | 58.6 | 38% | 0.381 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -60.2 | -37.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | A160 V161 L162 K168 | A160-G164 PolarHBondContact O-N 3.22Å; V161-G164 PolarHBondContact O-N 3.48Å; L162-G164 VanDerWaalsContact C-N 3.33Å; L162-G164 PolarHBondContact O-N 2.86Å; G164-K168 WeakPolarHBondContact O-CB 3.36Å; G164-K168 PolarHBondContact O-N 3.49Å |
| 165 | I | 96.4 | Very high | 91.7 | Very high | 10 Ų | 10 | 56.8 Ų | 56.8 | 5% | 0.051 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -60.6 | -49.8 | 175 | -71.6 | 166.1 | 0 | 0 | 0 | 110.4 | A127 L130 A134 V161 L162 V163 K168 A169 | A127-I165 HydrophobicContact CB-CG2 4.14Å; L130-I165 HydrophobicContact CB-CB 4.5Å; L130-I165 HydrophobicContact CB-CG1 3.99Å; L130-I165 HydrophobicContact CB-CG2 4.01Å; L130-I165 HydrophobicContact CD1-CG2 4.35Å; A134-I165 HydrophobicContact CB-CD1 4.3Å; V161-I165 HydrophobicContact CG1-CD1 3.97Å; V161-I165 HydrophobicContact CG1-CG1 4.42Å; V161-I165 VanDerWaalsContact O-CG1 3.27Å; V161-I165 WeakPolarHBondContact O-CG1 3.29Å; V161-I165 PolarHBondContact O-N 3.3Å; L162-I165 HydrophobicContact CD2-CD1 4.31Å; L162-I165 WeakPolarHBondContact O-CB 3.34Å; L162-I165 PolarHBondContact O-N 3Å; V163-I165 VanDerWaalsContact C-N 3.3Å; V163-I165 PolarHBondContact O-N 3.37Å; I165-K168 PolarHBondContact O-N 2.91Å; I165-A169 VanDerWaalsContact O-CB 3.26Å; I165-A169 WeakPolarHBondContact O-CB 3.49Å; I165-A169 PolarHBondContact O-N 2.93Å |
| 166 | W | 97.1 | Very high | 91 | Very high | 78 Ų | 78 | 52.2 Ų | 52.2 | 30% | 0.295 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -65.2 | -44.8 | 179.4 | -77.2 | 104.1 | 0 | 0 | 0 | 112.8 | H85 V89 L92 L124 L162 V163 K168 A169 L170 | H85-W166 AromaticContact CD2-NE1 3.94Å; H85-W166 AromaticContact CE1-NE1 3.75Å; H85-W166 AromaticContact NE2-CD1 3.8Å; H85-W166 AromaticContact NE2-CE2 3.57Å; H85-W166 AromaticContact NE2-CZ2 3.86Å; H85-W166 AromaticContact NE2-NE1 2.87Å; H85-W166 PolarHBondContact NE2-NE1 3.29Å; V89-W166 HydrophobicContact CG2-CH2 4.33Å; V89-W166 HydrophobicContact CG2-CZ2 3.98Å; L92-W166 HydrophobicContact CD1-CH2 4.4Å; L124-W166 HydrophobicContact CD2-CH2 4.2Å; L124-W166 HydrophobicContact CD2-CZ3 4.45Å; L162-W166 VanDerWaalsContact O-CD1 3.26Å; L162-W166 PolarHBondContact O-N 3.24Å; L162-W166 VanDerWaalsContact O-N 3.14Å; V163-W166 PolarHBondContact O-N 2.92Å; W166-K168 VanDerWaalsContact C-N 3.33Å; W166-K168 PolarHBondContact O-N 2.88Å; W166-A169 PolarHBondContact O-N 3.49Å; W166-L170 WeakPolarHBondContact O-CB 3.11Å; W166-L170 VanDerWaalsContact O-CG 3.29Å; W166-L170 WeakPolarHBondContact O-CG 3.3Å; W166-L170 PolarHBondContact O-N 2.93Å |
| 167 | I | 95.9 | Very high | 90.2 | Very high | 100 Ų | 100 | 52.9 Ų | 52.9 | 51% | 0.513 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -57.5 | -49.8 | 177 | -68.4 | 169.9 | 0 | 0 | 0 | 109.8 | V163 L170 V171 | V163-I167 HydrophobicContact CG1-CD1 3.67Å; V163-I167 HydrophobicContact CG1-CG1 4.31Å; V163-I167 WeakPolarHBondContact O-CG1 3.4Å; V163-I167 PolarHBondContact O-N 3.43Å; I167-L170 PolarHBondContact O-N 3.45Å; I167-V171 HydrophobicContact CG2-CG2 4.5Å; I167-V171 VanDerWaalsContact O-CG2 3.28Å; I167-V171 WeakPolarHBondContact O-CG2 3.35Å; I167-V171 PolarHBondContact O-N 3.19Å |
| 168 | K | 91 | Very high | 89.2 | Confident | 78 Ų | 78 | 53.8 Ų | 53.8 | 34% | 0.339 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -61.7 | -46.7 | 177.7 | 174.8 | 174.3 | 158 | 156.4 | 0 | 111.3 | L130 G164 I165 W166 L170 V171 M172 | L130-K168 HydrophobicContact CD1-CB 4.02Å; L130-K168 HydrophobicContact CD1-CD 3.56Å; L130-K168 HydrophobicContact CD1-CG 3.76Å; L130-K168 HydrophobicContact CD2-CD 3.75Å; L130-K168 VanDerWaalsContact CD2-CE 3.48Å; L130-K168 HydrophobicContact CG-CD 4.29Å; G164-K168 WeakPolarHBondContact O-CB 3.36Å; G164-K168 PolarHBondContact O-N 3.49Å; I165-K168 PolarHBondContact O-N 2.91Å; W166-K168 VanDerWaalsContact C-N 3.33Å; W166-K168 PolarHBondContact O-N 2.88Å; K168-L170 VanDerWaalsContact C-N 3.31Å; K168-L170 PolarHBondContact O-N 3.36Å; K168-V171 PolarHBondContact O-N 3.16Å; K168-M172 HydrophobicContact CG-CG 3.95Å; K168-M172 VanDerWaalsContact O-CB 3.23Å; K168-M172 WeakPolarHBondContact O-CB 3.38Å; K168-M172 WeakPolarHBondContact O-CG 3.44Å; K168-M172 PolarHBondContact O-N 3.05Å |
| 169 | A | 94.3 | Very high | 88 | Confident | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -58.4 | -43.7 | -179.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | A127 I165 W166 M172 S173 | A127-A169 HydrophobicContact CB-CB 4.03Å; I165-A169 VanDerWaalsContact O-CB 3.26Å; I165-A169 WeakPolarHBondContact O-CB 3.49Å; I165-A169 PolarHBondContact O-N 2.93Å; W166-A169 PolarHBondContact O-N 3.49Å; A169-M172 PolarHBondContact O-N 3.16Å; A169-S173 WeakPolarHBondContact O-CB 3.5Å; A169-S173 PolarHBondContact O-N 3.33Å |
| 170 | L | 93.5 | Very high | 86.7 | Confident | 88 Ų | 88 | 54 Ų | 54 | 46% | 0.461 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -64.4 | -48.7 | 176.5 | -71 | 170.4 | 0 | 0 | 0 | 111.8 | W166 I167 K168 M172 S173 M174 | W166-L170 WeakPolarHBondContact O-CB 3.11Å; W166-L170 VanDerWaalsContact O-CG 3.29Å; W166-L170 WeakPolarHBondContact O-CG 3.3Å; W166-L170 PolarHBondContact O-N 2.93Å; I167-L170 PolarHBondContact O-N 3.45Å; K168-L170 VanDerWaalsContact C-N 3.31Å; K168-L170 PolarHBondContact O-N 3.36Å; L170-M172 PolarHBondContact O-N 2.96Å; L170-S173 PolarHBondContact O-N 3.49Å; L170-S173 VanDerWaalsContact O-N 3.13Å; L170-S173 PolarHBondContact O-OG 2.97Å; L170-M174 WeakPolarHBondContact O-CG 3.48Å; L170-M174 PolarHBondContact O-N 3.48Å |
| 171 | V | 90.8 | Very high | 85.3 | Confident | 90 Ų | 90 | 56.6 Ų | 56.6 | 55% | 0.545 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -55.2 | -43.7 | 176.1 | 168.2 | 0 | 0 | 0 | 0 | 110.8 | I167 K168 M174 | I167-V171 HydrophobicContact CG2-CG2 4.5Å; I167-V171 VanDerWaalsContact O-CG2 3.28Å; I167-V171 WeakPolarHBondContact O-CG2 3.35Å; I167-V171 PolarHBondContact O-N 3.19Å; K168-V171 PolarHBondContact O-N 3.16Å; V171-M174 PolarHBondContact O-N 3.45Å |
| 172 | M | 85.4 | Confident | 83.7 | Confident | 16 Ų | 16 | 61.3 Ų | 61.3 | 8% | 0.079 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -73 | -29 | -177.4 | -69.5 | -62.8 | -54.8 | 0 | 0 | 112.4 | K168 A169 L170 M174 L175 I222 Y223 | K168-M172 HydrophobicContact CG-CG 3.95Å; K168-M172 VanDerWaalsContact O-CB 3.23Å; K168-M172 WeakPolarHBondContact O-CB 3.38Å; K168-M172 WeakPolarHBondContact O-CG 3.44Å; K168-M172 PolarHBondContact O-N 3.05Å; A169-M172 PolarHBondContact O-N 3.16Å; L170-M172 PolarHBondContact O-N 2.96Å; M172-M174 VanDerWaalsContact C-N 3.29Å; M172-M174 PolarHBondContact O-N 2.97Å; M172-L175 HydrophobicContact CE-CD1 3.42Å; M172-L175 VanDerWaalsContact CE-CD1 3.42Å; M172-L175 WeakPolarHBondContact O-CB 3.34Å; M172-L175 PolarHBondContact O-N 3.01Å; M172-L175 HydrophobicContact SD-CD1 3.71Å; M172-I222 HydrophobicContact CE-CB 3.74Å; M172-I222 HydrophobicContact CE-CD1 3.75Å; M172-I222 HydrophobicContact CE-CG1 4.34Å; M172-I222 HydrophobicContact CE-CG2 3.22Å; M172-I222 HydrophobicContact SD-CD1 4.2Å; M172-I222 HydrophobicContact SD-CG2 3.93Å; M172-Y223 VanDerWaalsContact C-OH 3.26Å; M172-Y223 HydrophobicContact CB-CE1 4.45Å; M172-Y223 WeakPolarHBondContact CB-OH 3.41Å; M172-Y223 HydrophobicContact CE-CD2 3.96Å; M172-Y223 HydrophobicContact CE-CE1 4.48Å; M172-Y223 HydrophobicContact CE-CE2 3.23Å; M172-Y223 PolarHBondContact O-OH 2.92Å |
| 173 | S | 88.3 | Confident | 82.1 | Confident | 4 Ų | 4 | 62.4 Ų | 62.4 | 3% | 0.028 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -71.3 | -18.6 | 172.4 | 76.8 | 0 | 0 | 0 | 0 | 114.4 | C119 A169 L170 L175 P176 | C119-S173 WeakPolarHBondContact O-CB 3.39Å; A169-S173 WeakPolarHBondContact O-CB 3.5Å; A169-S173 PolarHBondContact O-N 3.33Å; L170-S173 PolarHBondContact O-N 3.49Å; L170-S173 VanDerWaalsContact O-N 3.13Å; L170-S173 PolarHBondContact O-OG 2.97Å; S173-L175 VanDerWaalsContact C-N 3.31Å; S173-P176 WeakPolarHBondContact O-CD 3.41Å |
| 174 | M | 84.4 | Confident | 79.7 | Confident | 98 Ų | 98 | 61.2 Ų | 61.2 | 48% | 0.483 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -78.1 | -16.5 | 174.5 | -62.2 | -61.6 | 144.6 | 0 | 0 | 112.5 | L170 V171 M172 L177 L178 | L170-M174 WeakPolarHBondContact O-CG 3.48Å; L170-M174 PolarHBondContact O-N 3.48Å; V171-M174 PolarHBondContact O-N 3.45Å; M172-M174 VanDerWaalsContact C-N 3.29Å; M172-M174 PolarHBondContact O-N 2.97Å; M174-L177 PolarHBondContact O-N 3.28Å; M174-L177 VanDerWaalsContact O-N 3.15Å; M174-L177 HydrophobicContact SD-CD2 4.37Å; M174-L178 WeakPolarHBondContact O-CB 3.4Å; M174-L178 PolarHBondContact O-N 3.25Å |
| 175 | L | 77.9 | Confident | 77.2 | Confident | 36 Ų | 36 | 64.5 Ų | 64.5 | 19% | 0.188 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -64.3 | -44.1 | -177.3 | -66.8 | 168.8 | 0 | 0 | 0 | 113.6 | M172 S173 L177 G179 F215 F218 | M172-L175 HydrophobicContact CE-CD1 3.42Å; M172-L175 VanDerWaalsContact CE-CD1 3.42Å; M172-L175 WeakPolarHBondContact O-CB 3.34Å; M172-L175 PolarHBondContact O-N 3.01Å; M172-L175 HydrophobicContact SD-CD1 3.71Å; S173-L175 VanDerWaalsContact C-N 3.31Å; L175-L177 VanDerWaalsContact C-N 3.26Å; L175-L177 PolarHBondContact O-N 3.06Å; L175-G179 PolarHBondContact O-N 2.96Å; L175-F215 HydrophobicContact CB-CE2 4.43Å; L175-F218 HydrophobicContact CD1-CD1 4.5Å; L175-F218 HydrophobicContact CD1-CE1 3.76Å; L175-F218 HydrophobicContact CD2-CE1 4.2Å |
| 176 | P | 71.4 | Confident | 74.8 | Confident | 22 Ų | 22 | 69.3 Ų | 69.3 | 14% | 0.143 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -55.8 | -39.5 | 169.4 | -25.2 | 32.9 | 0 | 0 | 0 | 113.3 | V122 S173 G179 Y180 L203 | V122-P176 HydrophobicContact CG1-CG 4.35Å; V122-P176 HydrophobicContact CG2-CG 4.09Å; S173-P176 WeakPolarHBondContact O-CD 3.41Å; P176-G179 PolarHBondContact O-N 3.12Å; P176-Y180 PolarHBondContact O-N 2.96Å; P176-L203 HydrophobicContact CG-CD1 4.26Å |
| 177 | L | 73.4 | Confident | 72 | Confident | 64 Ų | 64 | 71.6 Ų | 71.6 | 34% | 0.335 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -73.2 | -47 | -177.4 | -175.9 | 66.6 | 0 | 0 | 0 | 112.7 | M174 L175 G179 Y180 L181 | M174-L177 PolarHBondContact O-N 3.28Å; M174-L177 VanDerWaalsContact O-N 3.15Å; M174-L177 HydrophobicContact SD-CD2 4.37Å; L175-L177 VanDerWaalsContact C-N 3.26Å; L175-L177 PolarHBondContact O-N 3.06Å; L177-G179 PolarHBondContact O-N 2.93Å; L177-G179 VanDerWaalsContact O-N 3.17Å; L177-Y180 WeakPolarHBondContact O-CB 3.41Å; L177-Y180 PolarHBondContact O-N 2.83Å; L177-L181 WeakPolarHBondContact O-CG 3.36Å; L177-L181 PolarHBondContact O-N 2.83Å |
| 178 | L | 70.3 | Confident | 69.5 | Low | 82 Ų | 82 | 74.1 Ų | 74.1 | 43% | 0.429 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -55.4 | -33.6 | 172.3 | -176.2 | 59.6 | 0 | 0 | 0 | 110.4 | M174 L181 F182 | M174-L178 WeakPolarHBondContact O-CB 3.4Å; M174-L178 PolarHBondContact O-N 3.25Å; L178-L181 PolarHBondContact O-N 2.74Å; L178-F182 HydrophobicContact CD1-CD2 3.83Å; L178-F182 HydrophobicContact CD1-CE2 3.26Å; L178-F182 HydrophobicContact CD1-CZ 3.91Å; L178-F182 HydrophobicContact CD2-CE2 3.88Å; L178-F182 HydrophobicContact CG-CD2 3.72Å; L178-F182 HydrophobicContact CG-CE2 3.37Å; L178-F182 HydrophobicContact CG-CZ 4.44Å; L178-F182 WeakPolarHBondContact O-CD2 3.19Å; L178-F182 PolarHBondContact O-N 3.39Å; L178-F182 VanDerWaalsContact O-N 3.08Å |
| 179 | G | 65.3 | Low | 66.9 | Low | 2 Ų | 2 | 74.1 Ų | 74.1 | 2% | 0.021 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -64.4 | -46 | 178.5 | 0 | 0 | 0 | 0 | 0 | 116.4 | L175 P176 L177 L181 F182 Q183 W205 | L175-G179 PolarHBondContact O-N 2.96Å; P176-G179 PolarHBondContact O-N 3.12Å; L177-G179 PolarHBondContact O-N 2.93Å; L177-G179 VanDerWaalsContact O-N 3.17Å; G179-L181 VanDerWaalsContact C-N 3.34Å; G179-F182 PolarHBondContact O-N 3.4Å; G179-Q183 PolarHBondContact O-N 3.06Å; G179-W205 VanDerWaalsContact O-CH2 3.23Å; G179-W205 WeakPolarHBondContact O-CH2 3.36Å; G179-W205 WeakPolarHBondContact O-CZ2 3.49Å |
| 180 | Y | 65.6 | Low | 63.9 | Low | 98 Ų | 98 | 77.8 Ų | 77.8 | 38% | 0.384 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -61.3 | -42.3 | 170.9 | 175.9 | -98.2 | 0 | 0 | 0 | 111.9 | R115 P176 L177 F182 Q183 | R115-Y180 PolarHBondContact NH2-OH 3.21Å; P176-Y180 PolarHBondContact O-N 2.96Å; L177-Y180 WeakPolarHBondContact O-CB 3.41Å; L177-Y180 PolarHBondContact O-N 2.83Å; Y180-F182 VanDerWaalsContact C-N 3.33Å; Y180-F182 PolarHBondContact O-N 3.16Å; Y180-Q183 WeakPolarHBondContact O-CB 3.4Å; Y180-Q183 PolarHBondContact O-N 2.93Å |
| 181 | L | 65 | Low | 61.2 | Low | 119 Ų | 119 | 79.2 Ų | 79.2 | 62% | 0.623 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -61.6 | -39.3 | 179.9 | -70.6 | 176.1 | 0 | 0 | 0 | 112.9 | L177 L178 G179 Q183 | L177-L181 WeakPolarHBondContact O-CG 3.36Å; L177-L181 PolarHBondContact O-N 2.83Å; L178-L181 PolarHBondContact O-N 2.74Å; G179-L181 VanDerWaalsContact C-N 3.34Å; L181-Q183 PolarHBondContact O-N 2.94Å |
| 182 | F | 62.8 | Low | 58.6 | Low | 155 Ų | 155 | 83.7 Ų | 83.7 | 68% | 0.68 | 50% | 0.496 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.2 | -7.8 | 176 | -74.7 | -58.8 | 0 | 0 | 0 | 114.2 | L178 G179 Y180 G184 | L178-F182 HydrophobicContact CD1-CD2 3.83Å; L178-F182 HydrophobicContact CD1-CE2 3.26Å; L178-F182 HydrophobicContact CD1-CZ 3.91Å; L178-F182 HydrophobicContact CD2-CE2 3.88Å; L178-F182 HydrophobicContact CG-CD2 3.72Å; L178-F182 HydrophobicContact CG-CE2 3.37Å; L178-F182 HydrophobicContact CG-CZ 4.44Å; L178-F182 WeakPolarHBondContact O-CD2 3.19Å; L178-F182 PolarHBondContact O-N 3.39Å; L178-F182 VanDerWaalsContact O-N 3.08Å; G179-F182 PolarHBondContact O-N 3.4Å; Y180-F182 VanDerWaalsContact C-N 3.33Å; Y180-F182 PolarHBondContact O-N 3.16Å; F182-G184 VanDerWaalsContact C-N 3.27Å; F182-G184 PolarHBondContact O-N 3.43Å |
| 183 | Q | 62.6 | Low | 56.1 | Low | 57 Ų | 57 | 88.5 Ų | 88.5 | 27% | 0.266 | 53% | 0.527 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.5 | -17.1 | -178.5 | -149.4 | 148.4 | 63 | 0 | 0 | 112.9 | G179 Y180 L181 T206 | G179-Q183 PolarHBondContact O-N 3.06Å; Y180-Q183 WeakPolarHBondContact O-CB 3.4Å; Y180-Q183 PolarHBondContact O-N 2.93Å; L181-Q183 PolarHBondContact O-N 2.94Å; Q183-T206 PolarHBondContact NE2-OG1 2.69Å; Q183-T206 PolarHBondContact OE1-OG1 2.68Å |
| 184 | G | 46.8 | Very low | 53.6 | Low | 52 Ų | 52 | 95.8 Ų | 95.8 | 54% | 0.536 | 56% | 0.564 | S | S | . | * | trans | 68.6 | 142.5 | -178.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | F182 | F182-G184 VanDerWaalsContact C-N 3.27Å; F182-G184 PolarHBondContact O-N 3.43Å | ||
| 185 | S | 42.3 | Very low | 51.1 | Low | 105 Ų | 105 | 95.9 Ų | 95.9 | 73% | 0.734 | 57% | 0.57 | S | S | * | * | P | Polyproline II helix | trans | -48.9 | 137.2 | 171.9 | -169.8 | 0 | 0 | 0 | 0 | 109.8 | T187 | S185-T187 PolarHBondContact O-N 2.89Š|
| 186 | P | 47.6 | Very low | 49.1 | Very low | 111 Ų | 111 | 100 Ų | 100 | 72% | 0.721 | 60% | 0.599 | S | S | * | * | P | Polyproline II helix | trans | -52.6 | 123.2 | 172.1 | 21.8 | -30.1 | 0 | 0 | 0 | 107.3 | V188 | P186-V188 PolarHBondContact O-N 3.45Š|
| 187 | T | 36.9 | Very low | 47.5 | Very low | 126 Ų | 126 | 102.6 Ų | 102.6 | 77% | 0.773 | 62% | 0.617 | S | S | * | * | P | Polyproline II helix | trans | -53.1 | 118 | -179.4 | 45.2 | 0 | 0 | 0 | 0 | 108.7 | S185 G189 | S185-T187 PolarHBondContact O-N 2.89Å; T187-G189 PolarHBondContact O-N 3.26Å |
| 188 | V | 44.2 | Very low | 46 | Very low | 153 Ų | 153 | 107.5 Ų | 107.5 | 93% | 0.927 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -47.4 | 102.4 | 168.8 | 178.2 | 0 | 0 | 0 | 0 | 108 | P186 | P186-V188 PolarHBondContact O-N 3.45Š|
| 189 | G | 36.8 | Very low | 45.2 | Very low | 78 Ų | 78 | 111.9 Ų | 111.9 | 80% | 0.804 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 153.3 | -1.1 | 179.3 | 0 | 0 | 0 | 0 | 0 | 119.3 | T187 | T187-G189 PolarHBondContact O-N 3.26Š|
| 190 | A | 31.3 | Very low | 45 | Very low | 78 Ų | 78 | 113.9 Ų | 113.9 | 65% | 0.645 | 66% | 0.658 | S | S | * | * | S | Bend | trans | -101.3 | 131.6 | 168.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | E192 | A190-E192 PolarHBondContact O-N 3.42Š|
| 191 | P | 36.3 | Very low | 45.2 | Very low | 118 Ų | 118 | 109.7 Ų | 109.7 | 77% | 0.766 | 64% | 0.643 | S | S | * | * | trans | -61.5 | 128.9 | 179 | -3.2 | 13.9 | 0 | 0 | 0 | 108.9 | V193 | P191-V193 PolarHBondContact O-N 3.02Š| ||
| 192 | E | 35.7 | Very low | 45.4 | Very low | 183 Ų | 183 | 105.4 Ų | 105.4 | 86% | 0.855 | 62% | 0.623 | S | S | * | * | trans | -60.6 | 88.5 | 167.7 | -72.2 | -170.2 | 148.9 | 0 | 0 | 108.8 | A190 L194 | A190-E192 PolarHBondContact O-N 3.42Å; E192-L194 VanDerWaalsContact C-N 3.27Å; E192-L194 PolarHBondContact O-N 3.36Å | ||
| 193 | V | 32.7 | Very low | 45.4 | Very low | 118 Ų | 118 | 98.7 Ų | 98.7 | 72% | 0.715 | 59% | 0.594 | S | S | * | * | trans | -69 | 101.2 | 157 | -177.2 | 0 | 0 | 0 | 0 | 104.7 | P191 V195 | P191-V193 PolarHBondContact O-N 3.02Å; V193-V195 HydrophobicContact CG1-CG2 3.78Å; V193-V195 PolarHBondContact O-N 3.47Å | ||
| 194 | L | 36.1 | Very low | 45.4 | Very low | 157 Ų | 157 | 99 Ų | 99 | 82% | 0.822 | 60% | 0.595 | S | S | * | * | trans | -61.1 | 72.3 | 171.8 | -154.3 | 89.2 | 0 | 0 | 0 | 109.2 | E192 P196 | E192-L194 VanDerWaalsContact C-N 3.27Å; E192-L194 PolarHBondContact O-N 3.36Å; L194-P196 WeakPolarHBondContact O-CD 3.34Å | ||
| 195 | V | 32.1 | Very low | 46 | Very low | 99 Ų | 99 | 98.1 Ų | 98.1 | 60% | 0.6 | 58% | 0.576 | S | S | * | * | trans | -84.5 | 115.7 | 161.4 | -174.2 | 0 | 0 | 0 | 0 | 104.9 | V193 S197 | V193-V195 HydrophobicContact CG1-CG2 3.78Å; V193-V195 PolarHBondContact O-N 3.47Å; V195-S197 PolarHBondContact O-N 3.35Å | ||
| 196 | P | 36 | Very low | 46.6 | Very low | 124 Ų | 124 | 97.7 Ų | 97.7 | 81% | 0.805 | 57% | 0.569 | S | S | * | * | trans | -70.7 | 73.7 | 166 | 29.2 | -27.7 | 0 | 0 | 0 | 107 | L194 Q198 | L194-P196 WeakPolarHBondContact O-CD 3.34Å; P196-Q198 PolarHBondContact O-N 2.82Å | ||
| 197 | S | 38.9 | Very low | 47.3 | Very low | 75 Ų | 75 | 93.6 Ų | 93.6 | 52% | 0.524 | 55% | 0.547 | S | S | . | . | trans | -69.5 | 116.1 | 167.9 | 61.8 | 0 | 0 | 0 | 0 | 105.5 | V195 R199 | V195-S197 PolarHBondContact O-N 3.35Å; S197-R199 PolarHBondContact O-N 3.03Å | ||
| 198 | Q | 40.8 | Very low | 48.8 | Very low | 167 Ų | 167 | 90 Ų | 90 | 78% | 0.78 | 54% | 0.535 | S | S | * | . | trans | -38.7 | 107.7 | 162 | -87.6 | 173.2 | -45.2 | 0 | 0 | 108.2 | P196 H200 | P196-Q198 PolarHBondContact O-N 2.82Å; Q198-H200 PolarHBondContact O-N 3.35Å | ||
| 199 | R | 53.2 | Low | 50.2 | Low | 174 Ų | 174 | 90.6 Ų | 90.6 | 66% | 0.657 | 52% | 0.52 | S | S | * | . | trans | -78.4 | 80 | 179.6 | -75.6 | -174.7 | 179.6 | 164.9 | -0.2 | 107.1 | S197 C201 | S197-R199 PolarHBondContact O-N 3.03Å; R199-C201 PolarHBondContact O-N 3.49Å | ||
| 200 | H | 61.6 | Low | 52.2 | Low | 45 Ų | 45 | 91.3 Ų | 91.3 | 21% | 0.208 | 51% | 0.513 | C | S | . | . | trans | -68.4 | 127 | 169.2 | -168.9 | 66.9 | 0 | 0 | 0 | 108.6 | D105 Q198 S202 E333 | D105-H200 IonicContact OD1-CE1 3.33Å; D105-H200 PolarHBondContact OD1-CE1 2.79Å; D105-H200 IonicContact OD1-CG 3.8Å; D105-H200 IonicContact OD1-ND1 2.66Å; D105-H200 PolarHBondContact OD1-ND1 3.05Å; Q198-H200 PolarHBondContact O-N 3.35Å; H200-S202 VanDerWaalsContact C-N 3.26Å; H200-S202 PolarHBondContact O-N 3Å; H200-E333 IonicContact CD2-OE2 3.36Å | ||
| 201 | C | 70.5 | Confident | 54.4 | Low | 9 Ų | 9 | 91 Ų | 91 | 6% | 0.061 | 50% | 0.503 | C | S | . | . | trans | -73.3 | 80.1 | 178.1 | -74.7 | 0 | 0 | 0 | 0 | 110.9 | C114 Y117 R199 | C114-C201 VanDerWaalsContact CA-SG 3.56Å; C114-C201 HydrophobicContact CB-CB 4.36Å; C114-C201 WeakPolarHBondContact CB-SG 3.48Å; C114-C201 VanDerWaalsContact SG-CA 3.53Å; C114-C201 WeakPolarHBondContact SG-CB 3.27Å; C114-C201 CovalentContact SG-SG 2.03Å; C114-C201 PolarHBondContact SG-SG 3.17Å; Y117-C201 HydrophobicContact CD1-CB 4.25Å; Y117-C201 HydrophobicContact CE1-CB 4.39Å; R199-C201 PolarHBondContact O-N 3.49Å | ||
| 202 | S | 68.4 | Low | 56.3 | Low | 29 Ų | 29 | 86.4 Ų | 86.4 | 20% | 0.203 | 47% | 0.47 | C | S | . | . | trans | -92.1 | 145.6 | 178 | 175.9 | 0 | 0 | 0 | 0 | 111.5 | H200 H204 E333 | H200-S202 VanDerWaalsContact C-N 3.26Å; H200-S202 PolarHBondContact O-N 3Å; S202-H204 PolarHBondContact O-N 3.25Å; S202-E333 WeakPolarHBondContact CB-OE1 3.34Å; S202-E333 VanDerWaalsContact OG-CD 3.27Å; S202-E333 PolarHBondContact OG-OE1 2.97Å; S202-E333 PolarHBondContact OG-OE2 2.87Å | ||
| 203 | L | 63.2 | Low | 58.5 | Low | 14 Ų | 14 | 80.2 Ų | 80.2 | 7% | 0.073 | 44% | 0.442 | C | S | . | . | trans | -73 | 63.3 | 164 | -165.9 | 99.3 | 0 | 0 | 0 | 109.2 | V122 P176 M216 F219 | V122-L203 HydrophobicContact CG2-CD1 3.97Å; P176-L203 HydrophobicContact CG-CD1 4.26Å; L203-M216 HydrophobicContact CD2-CE 4.31Å; L203-M216 HydrophobicContact CD2-SD 4.45Å; L203-M216 WeakPolarHBondContact O-CE 3.42Å; L203-F219 HydrophobicContact CD2-CD1 4.31Å; L203-F219 HydrophobicContact CD2-CE1 3.92Å; L203-F219 HydrophobicContact CD2-CE2 4.28Å; L203-F219 HydrophobicContact CD2-CZ 3.92Å | ||
| 204 | H | 62.3 | Low | 61 | Low | 63 Ų | 63 | 79.4 Ų | 79.4 | 29% | 0.292 | 44% | 0.438 | S | S | . | . | trans | -112 | 126 | 179 | -167.2 | -91.5 | 0 | 0 | 0 | 110.8 | S202 | S202-H204 PolarHBondContact O-N 3.25Š| ||
| 205 | W | 59 | Low | 63.2 | Low | 34 Ų | 34 | 73.1 Ų | 73.1 | 13% | 0.129 | 40% | 0.404 | C | S | . | . | trans | -91.2 | 112.3 | 173.6 | -179.6 | -76.6 | 0 | 0 | 0 | 109.8 | G179 G207 T211 R212 F215 M216 | G179-W205 VanDerWaalsContact O-CH2 3.23Å; G179-W205 WeakPolarHBondContact O-CH2 3.36Å; G179-W205 WeakPolarHBondContact O-CZ2 3.49Å; W205-G207 VanDerWaalsContact C-N 3.31Å; W205-G207 VanDerWaalsContact NE1-CA 3.34Å; W205-G207 PolarHBondContact O-N 2.81Å; W205-T211 PolarHBondContact NE1-OG1 2.94Å; W205-R212 HydrophobicContact CB-CG 4.15Å; W205-R212 WeakPolarHBondContact O-CD 3.18Å; W205-R212 WeakPolarHBondContact O-CG 3.36Å; W205-F215 HydrophobicContact CB-CD1 4.31Å; W205-F215 HydrophobicContact CD2-CG 4.4Å; W205-F215 HydrophobicContact CE3-CB 4.34Å; W205-F215 AromaticContact CE3-CD1 3.97Å; W205-F215 HydrophobicContact CE3-CD1 3.97Å; W205-F215 AromaticContact CE3-CD2 3.79Å; W205-F215 HydrophobicContact CE3-CD2 3.79Å; W205-F215 HydrophobicContact CE3-CE1 4.2Å; W205-F215 HydrophobicContact CE3-CE2 4.02Å; W205-F215 AromaticContact CE3-CG 3.76Å; W205-F215 HydrophobicContact CE3-CG 3.76Å; W205-F215 HydrophobicContact CE3-CZ 4.22Å; W205-F215 AromaticContact CZ3-CD2 3.55Å; W205-F215 HydrophobicContact CZ3-CD2 3.55Å; W205-F215 AromaticContact CZ3-CE2 3.81Å; W205-F215 HydrophobicContact CZ3-CE2 3.81Å; W205-F215 AromaticContact CZ3-CG 3.96Å; W205-F215 HydrophobicContact CZ3-CG 3.96Å; W205-F215 HydrophobicContact CZ3-CZ 4.43Å; W205-M216 HydrophobicContact CB-CE 4.4Å | ||
| 206 | T | 55.7 | Low | 65.6 | Low | 97 Ų | 97 | 68.7 Ų | 68.7 | 60% | 0.595 | 38% | 0.376 | S | S | * | . | trans | -87.1 | 16.5 | -179 | 57.2 | 0 | 0 | 0 | 0 | 114.6 | Q183 | Q183-T206 PolarHBondContact NE2-OG1 2.69Å; Q183-T206 PolarHBondContact OE1-OG1 2.68Å | ||
| 207 | G | 61.5 | Low | 68.1 | Low | 24 Ų | 24 | 66 Ų | 66 | 25% | 0.247 | 36% | 0.357 | C | S | . | . | S | Bend | trans | -77.6 | -176.6 | 172.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | W205 | W205-G207 VanDerWaalsContact C-N 3.31Å; W205-G207 VanDerWaalsContact NE1-CA 3.34Å; W205-G207 PolarHBondContact O-N 2.81Å |
| 208 | G | 67.9 | Low | 70.4 | Confident | 50 Ų | 50 | 67.1 Ų | 67.1 | 52% | 0.515 | 35% | 0.353 | S | S | . | . | trans | -55.3 | 146.9 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | S210 T211 R212 | G208-S210 VanDerWaalsContact C-N 3.26Å; G208-S210 PolarHBondContact O-N 2.81Å; G208-T211 PolarHBondContact N-OG1 3.42Å; G208-T211 PolarHBondContact O-N 3.18Å; G208-T211 PolarHBondContact O-OG1 2.98Å; G208-R212 PolarHBondContact O-N 3.39Å; G208-R212 VanDerWaalsContact O-N 3.09Å | ||
| 209 | R | 74.3 | Confident | 72.4 | Confident | 167 Ų | 167 | 59.8 Ų | 59.8 | 63% | 0.63 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -45.3 | -45.3 | -173.4 | -175.4 | 179.1 | -70.2 | 136.1 | -1 | 113.6 | I213 S323 | R209-I213 HydrophobicContact CG-CD1 4.19Å; R209-I213 WeakPolarHBondContact O-CG1 3.19Å; R209-I213 PolarHBondContact O-N 2.97Å; R209-S323 PolarHBondContact NE-OG 3.43Å |
| 210 | S | 78 | Confident | 74.1 | Confident | 92 Ų | 92 | 52.1 Ų | 52.1 | 64% | 0.643 | 29% | 0.291 | S | S | * | . | H | α-helix | trans | -67.2 | -42.4 | 179.5 | -54.1 | 0 | 0 | 0 | 0 | 113 | G208 R212 I213 V214 | G208-S210 VanDerWaalsContact C-N 3.26Å; G208-S210 PolarHBondContact O-N 2.81Å; S210-R212 VanDerWaalsContact C-N 3.34Å; S210-R212 PolarHBondContact O-N 3.39Å; S210-I213 PolarHBondContact O-N 3.31Å; S210-V214 VanDerWaalsContact O-CG2 3.29Å; S210-V214 WeakPolarHBondContact O-CG2 3.47Å; S210-V214 PolarHBondContact O-N 2.94Å |
| 211 | T | 77.6 | Confident | 75.4 | Confident | 71 Ų | 71 | 52.6 Ų | 52.6 | 44% | 0.436 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -65.1 | -38.4 | 179 | 63.2 | 0 | 0 | 0 | 0 | 111.9 | W205 G208 V214 F215 | W205-T211 PolarHBondContact NE1-OG1 2.94Å; G208-T211 PolarHBondContact N-OG1 3.42Å; G208-T211 PolarHBondContact O-N 3.18Å; G208-T211 PolarHBondContact O-OG1 2.98Å; T211-V214 PolarHBondContact O-N 3.37Å; T211-F215 VanDerWaalsContact O-CB 3.31Å; T211-F215 WeakPolarHBondContact O-CB 3.37Å; T211-F215 PolarHBondContact O-N 2.95Å |
| 212 | R | 77.4 | Confident | 76.1 | Confident | 22 Ų | 22 | 53.6 Ų | 53.6 | 8% | 0.083 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -61.9 | -46.3 | 175.1 | -176 | 178.1 | 72.1 | -159.2 | -3.5 | 111.9 | W205 G208 S210 F215 M216 A320 S323 | W205-R212 HydrophobicContact CB-CG 4.15Å; W205-R212 WeakPolarHBondContact O-CD 3.18Å; W205-R212 WeakPolarHBondContact O-CG 3.36Å; G208-R212 PolarHBondContact O-N 3.39Å; G208-R212 VanDerWaalsContact O-N 3.09Å; S210-R212 VanDerWaalsContact C-N 3.34Å; S210-R212 PolarHBondContact O-N 3.39Å; R212-F215 PolarHBondContact O-N 2.94Å; R212-M216 WeakPolarHBondContact O-CB 3.38Å; R212-M216 VanDerWaalsContact O-CG 3.27Å; R212-M216 WeakPolarHBondContact O-CG 3.21Å; R212-M216 PolarHBondContact O-N 3.36Å; R212-A320 HydrophobicContact CG-CB 4.4Å; R212-A320 PolarHBondContact NE-O 3.25Å; R212-A320 PolarHBondContact NH2-O 3.08Å; R212-S323 PolarHBondContact NH2-OG 2.92Å |
| 213 | I | 82.3 | Confident | 76.9 | Confident | 53 Ų | 53 | 52.6 Ų | 52.6 | 27% | 0.272 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -64.9 | -46.8 | 179.2 | -66.7 | 168 | 0 | 0 | 0 | 110.4 | R209 S210 F215 M216 V217 A320 | R209-I213 HydrophobicContact CG-CD1 4.19Å; R209-I213 WeakPolarHBondContact O-CG1 3.19Å; R209-I213 PolarHBondContact O-N 2.97Å; S210-I213 PolarHBondContact O-N 3.31Å; I213-F215 VanDerWaalsContact C-N 3.33Å; I213-F215 PolarHBondContact O-N 2.97Å; I213-M216 PolarHBondContact O-N 3.06Å; I213-V217 HydrophobicContact CG2-CG2 4.18Å; I213-V217 WeakPolarHBondContact O-CB 3.17Å; I213-V217 VanDerWaalsContact O-CG2 3.28Å; I213-V217 WeakPolarHBondContact O-CG2 3.39Å; I213-V217 PolarHBondContact O-N 3.42Å; I213-A320 WeakPolarHBondContact CG1-O 3.35Å |
| 214 | V | 84.6 | Confident | 78 | Confident | 101 Ų | 101 | 52.5 Ų | 52.5 | 61% | 0.612 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -59.1 | -45.6 | 178.7 | 171.4 | 0 | 0 | 0 | 0 | 111.1 | S210 T211 F218 | S210-V214 VanDerWaalsContact O-CG2 3.29Å; S210-V214 WeakPolarHBondContact O-CG2 3.47Å; S210-V214 PolarHBondContact O-N 2.94Å; T211-V214 PolarHBondContact O-N 3.37Å; V214-F218 VanDerWaalsContact O-CB 3.31Å; V214-F218 WeakPolarHBondContact O-CB 3.26Å; V214-F218 PolarHBondContact O-N 2.9Å |
| 215 | F | 81.5 | Confident | 79.3 | Confident | 25 Ų | 25 | 53.4 Ų | 53.4 | 11% | 0.11 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -60.8 | -47.9 | 176.7 | 177.1 | -96.4 | 0 | 0 | 0 | 112.1 | L175 W205 T211 R212 I213 V217 F218 F219 | L175-F215 HydrophobicContact CB-CE2 4.43Å; W205-F215 HydrophobicContact CB-CD1 4.31Å; W205-F215 HydrophobicContact CD2-CG 4.4Å; W205-F215 HydrophobicContact CE3-CB 4.34Å; W205-F215 AromaticContact CE3-CD1 3.97Å; W205-F215 HydrophobicContact CE3-CD1 3.97Å; W205-F215 AromaticContact CE3-CD2 3.79Å; W205-F215 HydrophobicContact CE3-CD2 3.79Å; W205-F215 HydrophobicContact CE3-CE1 4.2Å; W205-F215 HydrophobicContact CE3-CE2 4.02Å; W205-F215 AromaticContact CE3-CG 3.76Å; W205-F215 HydrophobicContact CE3-CG 3.76Å; W205-F215 HydrophobicContact CE3-CZ 4.22Å; W205-F215 AromaticContact CZ3-CD2 3.55Å; W205-F215 HydrophobicContact CZ3-CD2 3.55Å; W205-F215 AromaticContact CZ3-CE2 3.81Å; W205-F215 HydrophobicContact CZ3-CE2 3.81Å; W205-F215 AromaticContact CZ3-CG 3.96Å; W205-F215 HydrophobicContact CZ3-CG 3.96Å; W205-F215 HydrophobicContact CZ3-CZ 4.43Å; T211-F215 VanDerWaalsContact O-CB 3.31Å; T211-F215 WeakPolarHBondContact O-CB 3.37Å; T211-F215 PolarHBondContact O-N 2.95Å; R212-F215 PolarHBondContact O-N 2.94Å; I213-F215 VanDerWaalsContact C-N 3.33Å; I213-F215 PolarHBondContact O-N 2.97Å; F215-V217 PolarHBondContact O-N 3.25Å; F215-F218 PolarHBondContact O-N 3.4Å; F215-F219 WeakPolarHBondContact O-CB 3.28Å; F215-F219 PolarHBondContact O-N 3.06Å |
| 216 | M | 83.5 | Confident | 80.7 | Confident | 6 Ų | 6 | 54.4 Ų | 54.4 | 3% | 0.03 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -69.1 | -34.7 | -178 | -69.7 | -62.5 | 170.5 | 0 | 0 | 112.9 | L203 W205 R212 I213 T220 A320 | L203-M216 HydrophobicContact CD2-CE 4.31Å; L203-M216 HydrophobicContact CD2-SD 4.45Å; L203-M216 WeakPolarHBondContact O-CE 3.42Å; W205-M216 HydrophobicContact CB-CE 4.4Å; R212-M216 WeakPolarHBondContact O-CB 3.38Å; R212-M216 VanDerWaalsContact O-CG 3.27Å; R212-M216 WeakPolarHBondContact O-CG 3.21Å; R212-M216 PolarHBondContact O-N 3.36Å; I213-M216 PolarHBondContact O-N 3.06Å; M216-T220 VanDerWaalsContact O-CB 3.3Å; M216-T220 WeakPolarHBondContact O-CB 3.48Å; M216-T220 PolarHBondContact O-N 3.39Å; M216-T220 PolarHBondContact O-OG1 2.98Å; M216-A320 HydrophobicContact CB-CB 3.82Å; M216-A320 HydrophobicContact CG-CB 3.75Å |
| 217 | V | 88.2 | Confident | 82.2 | Confident | 67 Ų | 67 | 50 Ų | 50 | 41% | 0.406 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -65.2 | -47.6 | 171.7 | 170.2 | 0 | 0 | 0 | 0 | 110.2 | I213 F215 F219 T220 V221 L317 | I213-V217 HydrophobicContact CG2-CG2 4.18Å; I213-V217 WeakPolarHBondContact O-CB 3.17Å; I213-V217 VanDerWaalsContact O-CG2 3.28Å; I213-V217 WeakPolarHBondContact O-CG2 3.39Å; I213-V217 PolarHBondContact O-N 3.42Å; F215-V217 PolarHBondContact O-N 3.25Å; V217-F219 VanDerWaalsContact C-N 3.33Å; V217-F219 PolarHBondContact O-N 3.19Å; V217-T220 PolarHBondContact O-N 3.35Å; V217-V221 HydrophobicContact CG1-CG2 4.33Å; V217-V221 VanDerWaalsContact O-CG2 3.26Å; V217-V221 WeakPolarHBondContact O-CG2 3.35Å; V217-V221 PolarHBondContact O-N 2.64Å; V217-L317 HydrophobicContact CG2-CD1 3.99Å |
| 218 | F | 86.2 | Confident | 83.5 | Confident | 100 Ų | 100 | 52 Ų | 52 | 44% | 0.439 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -58.6 | -45.2 | 176.9 | 179.2 | -102.7 | 0 | 0 | 0 | 112 | L175 V214 F215 V221 I222 | L175-F218 HydrophobicContact CD1-CD1 4.5Å; L175-F218 HydrophobicContact CD1-CE1 3.76Å; L175-F218 HydrophobicContact CD2-CE1 4.2Å; V214-F218 VanDerWaalsContact O-CB 3.31Å; V214-F218 WeakPolarHBondContact O-CB 3.26Å; V214-F218 PolarHBondContact O-N 2.9Å; F215-F218 PolarHBondContact O-N 3.4Å; F218-V221 PolarHBondContact O-N 2.8Å; F218-I222 HydrophobicContact CD1-CD1 3.94Å; F218-I222 HydrophobicContact CD2-CD1 3.98Å; F218-I222 HydrophobicContact CE1-CD1 3.42Å; F218-I222 VanDerWaalsContact CE1-CD1 3.42Å; F218-I222 HydrophobicContact CE2-CD1 3.47Å; F218-I222 VanDerWaalsContact CE2-CD1 3.47Å; F218-I222 HydrophobicContact CE2-CG1 4.47Å; F218-I222 HydrophobicContact CG-CD1 4.21Å; F218-I222 HydrophobicContact CZ-CD1 3.16Å; F218-I222 HydrophobicContact CZ-CG1 4.5Å; F218-I222 WeakPolarHBondContact O-CG1 3.18Å; F218-I222 PolarHBondContact O-N 2.71Å; F218-I222 VanDerWaalsContact O-N 3.08Å |
| 219 | F | 84 | Confident | 84.5 | Confident | 12 Ų | 12 | 54.4 Ų | 54.4 | 5% | 0.053 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -60.3 | -49.1 | 175 | -168.9 | -92 | 0 | 0 | 0 | 111.2 | V122 L203 F215 V217 V221 I222 Y223 F313 | V122-F219 HydrophobicContact CG1-CE2 4.27Å; V122-F219 HydrophobicContact CG2-CE2 4.44Å; V122-F219 HydrophobicContact CG2-CZ 4.38Å; L203-F219 HydrophobicContact CD2-CD1 4.31Å; L203-F219 HydrophobicContact CD2-CE1 3.92Å; L203-F219 HydrophobicContact CD2-CE2 4.28Å; L203-F219 HydrophobicContact CD2-CZ 3.92Å; F215-F219 WeakPolarHBondContact O-CB 3.28Å; F215-F219 PolarHBondContact O-N 3.06Å; V217-F219 VanDerWaalsContact C-N 3.33Å; V217-F219 PolarHBondContact O-N 3.19Å; F219-V221 VanDerWaalsContact C-N 3.32Å; F219-V221 PolarHBondContact O-N 3.17Å; F219-I222 PolarHBondContact O-N 2.83Å; F219-Y223 HydrophobicContact CD1-CD2 4.05Å; F219-Y223 AromaticContact CD2-CD2 3.58Å; F219-Y223 HydrophobicContact CD2-CD2 3.58Å; F219-Y223 AromaticContact CD2-CE2 3.34Å; F219-Y223 HydrophobicContact CD2-CE2 3.34Å; F219-Y223 HydrophobicContact CE1-CD2 4.05Å; F219-Y223 HydrophobicContact CE1-CE2 4.48Å; F219-Y223 HydrophobicContact CE1-CG 4.38Å; F219-Y223 AromaticContact CE2-CD2 3.57Å; F219-Y223 HydrophobicContact CE2-CD2 3.57Å; F219-Y223 AromaticContact CE2-CE2 3.19Å; F219-Y223 HydrophobicContact CE2-CE2 3.19Å; F219-Y223 HydrophobicContact CE2-CG 4.4Å; F219-Y223 AromaticContact CE2-CZ 3.73Å; F219-Y223 AromaticContact CG-CD2 3.81Å; F219-Y223 HydrophobicContact CG-CD2 3.81Å; F219-Y223 HydrophobicContact CG-CE2 4.06Å; F219-Y223 AromaticContact CZ-CD2 3.81Å; F219-Y223 HydrophobicContact CZ-CD2 3.81Å; F219-Y223 AromaticContact CZ-CE2 3.82Å; F219-Y223 HydrophobicContact CZ-CE2 3.82Å; F219-Y223 HydrophobicContact CZ-CG 4.23Å; F219-Y223 WeakPolarHBondContact O-CB 3.18Å; F219-Y223 VanDerWaalsContact O-CD2 3.28Å; F219-Y223 WeakPolarHBondContact O-CD2 3.12Å; F219-Y223 PolarHBondContact O-N 3.15Å; F219-F313 HydrophobicContact CD1-CD1 4.37Å; F219-F313 AromaticContact CD1-CE1 3.76Å; F219-F313 HydrophobicContact CD1-CE1 3.76Å; F219-F313 HydrophobicContact CE1-CD1 4.49Å; F219-F313 AromaticContact CE1-CE1 3.62Å; F219-F313 HydrophobicContact CE1-CE1 3.62Å; F219-F313 HydrophobicContact CE1-CZ 4.36Å |
| 220 | T | 88.5 | Confident | 85.1 | Confident | 13 Ų | 13 | 50.1 Ų | 50.1 | 8% | 0.08 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -60.5 | -41.2 | 177.9 | -58.9 | 0 | 0 | 0 | 0 | 111.8 | M216 V217 F224 L225 F313 | M216-T220 VanDerWaalsContact O-CB 3.3Å; M216-T220 WeakPolarHBondContact O-CB 3.48Å; M216-T220 PolarHBondContact O-N 3.39Å; M216-T220 PolarHBondContact O-OG1 2.98Å; V217-T220 PolarHBondContact O-N 3.35Å; T220-F224 HydrophobicContact CG2-CB 4.34Å; T220-F224 HydrophobicContact CG2-CD1 4.4Å; T220-F224 WeakPolarHBondContact O-CA 3.21Å; T220-F224 VanDerWaalsContact O-CB 3.27Å; T220-F224 WeakPolarHBondContact O-CB 3.43Å; T220-F224 PolarHBondContact O-N 3.04Å; T220-L225 HydrophobicContact CG2-CG 4.41Å; T220-L225 PolarHBondContact O-N 3.36Å; T220-F313 HydrophobicContact CG2-CB 4.34Å; T220-F313 HydrophobicContact CG2-CD1 4.39Å |
| 221 | V | 89.4 | Confident | 85.4 | Confident | 56 Ų | 56 | 46.1 Ų | 46.1 | 34% | 0.339 | 25% | 0.248 | S | C | . | . | I | π-helix | trans | -60.7 | -50.3 | 178 | 169.1 | 0 | 0 | 0 | 0 | 110.6 | V217 F218 F219 L225 C226 | V217-V221 HydrophobicContact CG1-CG2 4.33Å; V217-V221 VanDerWaalsContact O-CG2 3.26Å; V217-V221 WeakPolarHBondContact O-CG2 3.35Å; V217-V221 PolarHBondContact O-N 2.64Å; F218-V221 PolarHBondContact O-N 2.8Å; F219-V221 VanDerWaalsContact C-N 3.32Å; F219-V221 PolarHBondContact O-N 3.17Å; V221-L225 HydrophobicContact CG2-CD1 3.96Å; V221-L225 PolarHBondContact O-N 3.39Å; V221-C226 WeakPolarHBondContact O-CB 3.26Å; V221-C226 PolarHBondContact O-N 2.67Å; V221-C226 PolarHBondContact O-SG 3.08Å; V221-C226 VanDerWaalsContact O-SG 3.41Å |
| 222 | I | 85.5 | Confident | 85.8 | Confident | 30 Ų | 30 | 46.8 Ų | 46.8 | 15% | 0.154 | 25% | 0.249 | C | C | . | . | I | π-helix | trans | -75.4 | -38.2 | -172.4 | -61.8 | 172.3 | 0 | 0 | 0 | 112.5 | M172 F218 F219 P227 | M172-I222 HydrophobicContact CE-CB 3.74Å; M172-I222 HydrophobicContact CE-CD1 3.75Å; M172-I222 HydrophobicContact CE-CG1 4.34Å; M172-I222 HydrophobicContact CE-CG2 3.22Å; M172-I222 HydrophobicContact SD-CD1 4.2Å; M172-I222 HydrophobicContact SD-CG2 3.93Å; F218-I222 HydrophobicContact CD1-CD1 3.94Å; F218-I222 HydrophobicContact CD2-CD1 3.98Å; F218-I222 HydrophobicContact CE1-CD1 3.42Å; F218-I222 VanDerWaalsContact CE1-CD1 3.42Å; F218-I222 HydrophobicContact CE2-CD1 3.47Å; F218-I222 VanDerWaalsContact CE2-CD1 3.47Å; F218-I222 HydrophobicContact CE2-CG1 4.47Å; F218-I222 HydrophobicContact CG-CD1 4.21Å; F218-I222 HydrophobicContact CZ-CD1 3.16Å; F218-I222 HydrophobicContact CZ-CG1 4.5Å; F218-I222 WeakPolarHBondContact O-CG1 3.18Å; F218-I222 PolarHBondContact O-N 2.71Å; F218-I222 VanDerWaalsContact O-N 3.08Å; F219-I222 PolarHBondContact O-N 2.83Å; I222-P227 WeakPolarHBondContact O-CD 3.21Å |
| 223 | Y | 84.1 | Confident | 86.2 | Confident | 7 Ų | 7 | 49.2 Ų | 49.2 | 3% | 0.027 | 27% | 0.266 | C | S | . | . | I | π-helix | trans | -93.4 | -23.7 | -173.8 | -71.1 | -88.4 | 0 | 0 | 0 | 114 | V122 M172 F219 P227 | V122-Y223 HydrophobicContact CG1-CE1 4.14Å; V122-Y223 WeakPolarHBondContact CG1-OH 3.31Å; M172-Y223 VanDerWaalsContact C-OH 3.26Å; M172-Y223 HydrophobicContact CB-CE1 4.45Å; M172-Y223 WeakPolarHBondContact CB-OH 3.41Å; M172-Y223 HydrophobicContact CE-CD2 3.96Å; M172-Y223 HydrophobicContact CE-CE1 4.48Å; M172-Y223 HydrophobicContact CE-CE2 3.23Å; M172-Y223 PolarHBondContact O-OH 2.92Å; F219-Y223 HydrophobicContact CD1-CD2 4.05Å; F219-Y223 AromaticContact CD2-CD2 3.58Å; F219-Y223 HydrophobicContact CD2-CD2 3.58Å; F219-Y223 AromaticContact CD2-CE2 3.34Å; F219-Y223 HydrophobicContact CD2-CE2 3.34Å; F219-Y223 HydrophobicContact CE1-CD2 4.05Å; F219-Y223 HydrophobicContact CE1-CE2 4.48Å; F219-Y223 HydrophobicContact CE1-CG 4.38Å; F219-Y223 AromaticContact CE2-CD2 3.57Å; F219-Y223 HydrophobicContact CE2-CD2 3.57Å; F219-Y223 AromaticContact CE2-CE2 3.19Å; F219-Y223 HydrophobicContact CE2-CE2 3.19Å; F219-Y223 HydrophobicContact CE2-CG 4.4Å; F219-Y223 AromaticContact CE2-CZ 3.73Å; F219-Y223 AromaticContact CG-CD2 3.81Å; F219-Y223 HydrophobicContact CG-CD2 3.81Å; F219-Y223 HydrophobicContact CG-CE2 4.06Å; F219-Y223 AromaticContact CZ-CD2 3.81Å; F219-Y223 HydrophobicContact CZ-CD2 3.81Å; F219-Y223 AromaticContact CZ-CE2 3.82Å; F219-Y223 HydrophobicContact CZ-CE2 3.82Å; F219-Y223 HydrophobicContact CZ-CG 4.23Å; F219-Y223 WeakPolarHBondContact O-CB 3.18Å; F219-Y223 VanDerWaalsContact O-CD2 3.28Å; F219-Y223 WeakPolarHBondContact O-CD2 3.12Å; F219-Y223 PolarHBondContact O-N 3.15Å; Y223-P227 WeakPolarHBondContact O-CG 3.18Å |
| 224 | F | 86.8 | Confident | 86.1 | Confident | 13 Ų | 13 | 47.3 Ų | 47.3 | 6% | 0.057 | 26% | 0.256 | C | S | . | . | I | π-helix | trans | -115.2 | -61.1 | -179.4 | -177.2 | -115.3 | 0 | 0 | 0 | 112.5 | T220 M228 F305 F306 W309 L310 F313 | T220-F224 HydrophobicContact CG2-CB 4.34Å; T220-F224 HydrophobicContact CG2-CD1 4.4Å; T220-F224 WeakPolarHBondContact O-CA 3.21Å; T220-F224 VanDerWaalsContact O-CB 3.27Å; T220-F224 WeakPolarHBondContact O-CB 3.43Å; T220-F224 PolarHBondContact O-N 3.04Å; F224-M228 WeakPolarHBondContact O-CB 3.5Å; F224-M228 PolarHBondContact O-N 3.43Å; F224-F305 HydrophobicContact CD2-CE1 4.06Å; F224-F305 HydrophobicContact CD2-CZ 4.44Å; F224-F305 HydrophobicContact CE2-CE1 4.23Å; F224-F306 HydrophobicContact CZ-CD2 4.07Å; F224-F306 HydrophobicContact CZ-CE2 4.23Å; F224-W309 HydrophobicContact CD2-CB 4.11Å; F224-W309 HydrophobicContact CE2-CB 4.3Å; F224-L310 HydrophobicContact CE1-CD1 3.84Å; F224-L310 HydrophobicContact CE2-CB 4.28Å; F224-L310 HydrophobicContact CE2-CD1 4.5Å; F224-L310 HydrophobicContact CZ-CB 4.06Å; F224-L310 HydrophobicContact CZ-CD1 3.52Å; F224-L310 HydrophobicContact CZ-CG 4.43Å; F224-F313 HydrophobicContact CB-CB 4.35Å; F224-F313 HydrophobicContact CB-CD1 4.04Å; F224-F313 HydrophobicContact CB-CD2 3.49Å; F224-F313 VanDerWaalsContact CB-CD2 3.49Å; F224-F313 HydrophobicContact CB-CE1 4.22Å; F224-F313 HydrophobicContact CB-CE2 3.73Å; F224-F313 HydrophobicContact CB-CG 3.69Å; F224-F313 HydrophobicContact CB-CZ 4.11Å; F224-F313 AromaticContact CD2-CD2 3.69Å; F224-F313 HydrophobicContact CD2-CD2 3.69Å; F224-F313 HydrophobicContact CD2-CE2 4.17Å; F224-F313 HydrophobicContact CD2-CG 4.44Å; F224-F313 HydrophobicContact CG-CB 4.3Å; F224-F313 AromaticContact CG-CD2 3.71Å; F224-F313 HydrophobicContact CG-CD2 3.71Å; F224-F313 HydrophobicContact CG-CE2 4.29Å; F224-F313 HydrophobicContact CG-CG 4.04Å |
| 225 | L | 89.3 | Confident | 85.9 | Confident | 82 Ų | 82 | 43.8 Ų | 43.8 | 43% | 0.429 | 23% | 0.233 | S | C | . | . | I | π-helix | trans | -68.7 | -43.5 | -169.1 | -60.8 | 175.7 | 0 | 0 | 0 | 112.9 | T220 V221 M228 L229 | T220-L225 HydrophobicContact CG2-CG 4.41Å; T220-L225 PolarHBondContact O-N 3.36Å; V221-L225 HydrophobicContact CG2-CD1 3.96Å; V221-L225 PolarHBondContact O-N 3.39Å; L225-M228 PolarHBondContact O-N 2.98Å; L225-L229 WeakPolarHBondContact O-CB 3.49Å; L225-L229 PolarHBondContact O-N 2.92Å |
| 226 | C | 89.6 | Confident | 85.9 | Confident | 55 Ų | 55 | 46 Ų | 46 | 37% | 0.372 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -64.3 | -51.5 | 178.1 | -73.8 | 0 | 0 | 0 | 0 | 112 | V221 M228 L229 I230 | V221-C226 WeakPolarHBondContact O-CB 3.26Å; V221-C226 PolarHBondContact O-N 2.67Å; V221-C226 PolarHBondContact O-SG 3.08Å; V221-C226 VanDerWaalsContact O-SG 3.41Å; C226-M228 VanDerWaalsContact C-N 3.33Å; C226-M228 PolarHBondContact O-N 2.91Å; C226-L229 PolarHBondContact O-N 3.49Å; C226-I230 WeakPolarHBondContact O-CG1 3.4Å; C226-I230 PolarHBondContact O-N 3.49Å |
| 227 | P | 87.2 | Confident | 85.8 | Confident | 5 Ų | 5 | 48.8 Ų | 48.8 | 3% | 0.032 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -56.7 | -44 | 172.6 | -30.3 | 38.9 | 0 | 0 | 0 | 113.1 | I129 I222 Y223 L229 I230 I231 F305 | I129-P227 HydrophobicContact CG2-CB 3.49Å; I129-P227 VanDerWaalsContact CG2-CB 3.49Å; I129-P227 HydrophobicContact CG2-CG 3.53Å; I222-P227 WeakPolarHBondContact O-CD 3.21Å; Y223-P227 WeakPolarHBondContact O-CG 3.18Å; P227-L229 PolarHBondContact O-N 3.49Å; P227-I230 PolarHBondContact O-N 3.46Å; P227-I231 WeakPolarHBondContact O-CB 3.45Å; P227-I231 WeakPolarHBondContact O-CG1 3.49Å; P227-I231 PolarHBondContact O-N 2.9Å; P227-F305 HydrophobicContact CB-CE1 4.4Å; P227-F305 HydrophobicContact CB-CE2 4.46Å; P227-F305 HydrophobicContact CB-CZ 3.84Å |
| 228 | M | 87.9 | Confident | 85.3 | Confident | 64 Ų | 64 | 45.8 Ų | 45.8 | 32% | 0.315 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -59.2 | -45.1 | 177.1 | -176.3 | -80.7 | -139.1 | 0 | 0 | 111.4 | F224 L225 C226 I231 L232 F305 | F224-M228 WeakPolarHBondContact O-CB 3.5Å; F224-M228 PolarHBondContact O-N 3.43Å; L225-M228 PolarHBondContact O-N 2.98Å; C226-M228 VanDerWaalsContact C-N 3.33Å; C226-M228 PolarHBondContact O-N 2.91Å; M228-I231 PolarHBondContact O-N 3.38Å; M228-L232 WeakPolarHBondContact O-CB 3.38Å; M228-L232 PolarHBondContact O-N 3.25Å; M228-L232 HydrophobicContact SD-CB 4.38Å; M228-L232 HydrophobicContact SD-CD2 4.32Å; M228-F305 HydrophobicContact CB-CE1 4.18Å |
| 229 | L | 88.6 | Confident | 84.9 | Confident | 102 Ų | 102 | 46.4 Ų | 46.4 | 53% | 0.534 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -62.3 | -45.3 | 177.5 | -179 | 66.7 | 0 | 0 | 0 | 111.7 | L225 C226 P227 I231 L232 V233 | L225-L229 WeakPolarHBondContact O-CB 3.49Å; L225-L229 PolarHBondContact O-N 2.92Å; C226-L229 PolarHBondContact O-N 3.49Å; P227-L229 PolarHBondContact O-N 3.49Å; L229-I231 VanDerWaalsContact C-N 3.34Å; L229-I231 PolarHBondContact O-N 2.84Å; L229-L232 PolarHBondContact O-N 3.45Å; L229-V233 HydrophobicContact CD1-CG2 4.06Å; L229-V233 HydrophobicContact CG-CG2 4.34Å; L229-V233 WeakPolarHBondContact O-CB 3.46Å; L229-V233 VanDerWaalsContact O-CG2 3.24Å; L229-V233 WeakPolarHBondContact O-CG2 3.44Å; L229-V233 PolarHBondContact O-N 3.42Å |
| 230 | I | 87.3 | Confident | 84.7 | Confident | 76 Ų | 76 | 52.7 Ų | 52.7 | 39% | 0.39 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -58.9 | -50.1 | 177.4 | -67.8 | 167 | 0 | 0 | 0 | 109.8 | C133 V137 C226 P227 L232 V233 V234 | C133-I230 HydrophobicContact CB-CG2 4.35Å; V137-I230 HydrophobicContact CG2-CG2 4.16Å; C226-I230 WeakPolarHBondContact O-CG1 3.4Å; C226-I230 PolarHBondContact O-N 3.49Å; P227-I230 PolarHBondContact O-N 3.46Å; I230-L232 PolarHBondContact O-N 2.96Å; I230-V233 PolarHBondContact O-N 3.35Å; I230-V234 WeakPolarHBondContact O-CB 2.89Å; I230-V234 VanDerWaalsContact O-CG2 3.31Å; I230-V234 WeakPolarHBondContact O-CG2 3.19Å; I230-V234 PolarHBondContact O-N 3.42Å |
| 231 | I | 84.7 | Confident | 84.1 | Confident | 9 Ų | 9 | 54.7 Ų | 54.7 | 5% | 0.046 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -57.9 | -50.2 | 179.1 | -72.3 | 173.3 | 0 | 0 | 0 | 110 | I132 P227 M228 L229 V234 Y235 F305 | I132-I231 HydrophobicContact CG2-CD1 4.09Å; P227-I231 WeakPolarHBondContact O-CB 3.45Å; P227-I231 WeakPolarHBondContact O-CG1 3.49Å; P227-I231 PolarHBondContact O-N 2.9Å; M228-I231 PolarHBondContact O-N 3.38Å; L229-I231 VanDerWaalsContact C-N 3.34Å; L229-I231 PolarHBondContact O-N 2.84Å; I231-V234 PolarHBondContact O-N 3.4Å; I231-Y235 HydrophobicContact CG2-CD2 3.45Å; I231-Y235 VanDerWaalsContact CG2-CD2 3.45Å; I231-Y235 HydrophobicContact CG2-CE2 3.47Å; I231-Y235 VanDerWaalsContact CG2-CE2 3.47Å; I231-Y235 WeakPolarHBondContact O-CB 3.17Å; I231-Y235 WeakPolarHBondContact O-CD2 3.13Å; I231-Y235 PolarHBondContact O-N 2.94Å; I231-F305 HydrophobicContact CD1-CB 4.27Å; I231-F305 HydrophobicContact CD1-CD1 3.98Å; I231-F305 HydrophobicContact CD1-CD2 4.13Å; I231-F305 HydrophobicContact CD1-CE1 4.4Å; I231-F305 HydrophobicContact CD1-CG 3.84Å |
| 232 | L | 85.6 | Confident | 83.2 | Confident | 85 Ų | 85 | 54.4 Ų | 54.4 | 45% | 0.445 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -60.2 | -49.4 | 179.8 | -178.7 | 66.9 | 0 | 0 | 0 | 112 | M228 L229 I230 V234 Y235 C236 | M228-L232 WeakPolarHBondContact O-CB 3.38Å; M228-L232 PolarHBondContact O-N 3.25Å; M228-L232 HydrophobicContact SD-CB 4.38Å; M228-L232 HydrophobicContact SD-CD2 4.32Å; L229-L232 PolarHBondContact O-N 3.45Å; I230-L232 PolarHBondContact O-N 2.96Å; L232-V234 VanDerWaalsContact C-N 3.35Å; L232-V234 PolarHBondContact O-N 3.4Å; L232-Y235 PolarHBondContact O-N 3.22Å; L232-C236 VanDerWaalsContact O-CB 3.31Å; L232-C236 WeakPolarHBondContact O-CB 3.46Å; L232-C236 PolarHBondContact O-N 3.34Å; L232-C236 PolarHBondContact O-SG 3.45Å |
| 233 | V | 85.1 | Confident | 82.7 | Confident | 72 Ų | 72 | 60.7 Ų | 60.7 | 44% | 0.436 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -60.8 | -46.1 | -179.7 | 168.5 | 0 | 0 | 0 | 0 | 110.7 | L229 I230 Y235 C236 N237 | L229-V233 HydrophobicContact CD1-CG2 4.06Å; L229-V233 HydrophobicContact CG-CG2 4.34Å; L229-V233 WeakPolarHBondContact O-CB 3.46Å; L229-V233 VanDerWaalsContact O-CG2 3.24Å; L229-V233 WeakPolarHBondContact O-CG2 3.44Å; L229-V233 PolarHBondContact O-N 3.42Å; I230-V233 PolarHBondContact O-N 3.35Å; V233-Y235 PolarHBondContact O-N 2.97Å; V233-C236 PolarHBondContact O-N 3.21Å; V233-N237 WeakPolarHBondContact O-CB 3.09Å; V233-N237 VanDerWaalsContact O-CG 3.26Å; V233-N237 PolarHBondContact O-N 2.86Å; V233-N237 PolarHBondContact O-ND2 3.03Å; V233-N237 VanDerWaalsContact O-ND2 3.14Å |
| 234 | V | 81.1 | Confident | 82.3 | Confident | 13 Ų | 13 | 63.8 Ų | 63.8 | 8% | 0.079 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -58.2 | -48.6 | 175.7 | 158.9 | 0 | 0 | 0 | 0 | 111 | N136 V137 I230 I231 L232 N237 M238 | N136-V234 HydrophobicContact CB-CG1 4.03Å; N136-V234 WeakPolarHBondContact O-CG1 3.4Å; V137-V234 HydrophobicContact CG2-CG2 4.07Å; I230-V234 WeakPolarHBondContact O-CB 2.89Å; I230-V234 VanDerWaalsContact O-CG2 3.31Å; I230-V234 WeakPolarHBondContact O-CG2 3.19Å; I230-V234 PolarHBondContact O-N 3.42Å; I231-V234 PolarHBondContact O-N 3.4Å; L232-V234 VanDerWaalsContact C-N 3.35Å; L232-V234 PolarHBondContact O-N 3.4Å; V234-N237 PolarHBondContact O-N 3.43Å; V234-M238 VanDerWaalsContact O-CB 3.3Å; V234-M238 WeakPolarHBondContact O-CB 3.42Å; V234-M238 PolarHBondContact O-N 3.14Å |
| 235 | Y | 80.4 | Confident | 81.5 | Confident | 28 Ų | 28 | 66 Ų | 66 | 11% | 0.11 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -65.4 | -44.4 | -179.3 | -83.5 | -60.9 | 0 | 0 | 0 | 112.8 | N136 I231 L232 V233 N237 M238 F239 L298 V301 | N136-Y235 VanDerWaalsContact OD1-CZ 3.27Å; N136-Y235 PolarHBondContact OD1-OH 3.42Å; I231-Y235 HydrophobicContact CG2-CD2 3.45Å; I231-Y235 VanDerWaalsContact CG2-CD2 3.45Å; I231-Y235 HydrophobicContact CG2-CE2 3.47Å; I231-Y235 VanDerWaalsContact CG2-CE2 3.47Å; I231-Y235 WeakPolarHBondContact O-CB 3.17Å; I231-Y235 WeakPolarHBondContact O-CD2 3.13Å; I231-Y235 PolarHBondContact O-N 2.94Å; L232-Y235 PolarHBondContact O-N 3.22Å; V233-Y235 PolarHBondContact O-N 2.97Å; Y235-N237 VanDerWaalsContact C-N 3.35Å; Y235-N237 PolarHBondContact O-N 3.24Å; Y235-M238 HydrophobicContact CD1-CE 3.26Å; Y235-M238 HydrophobicContact CE1-CE 3.58Å; Y235-M238 HydrophobicContact CG-CE 4.39Å; Y235-M238 PolarHBondContact O-N 3Å; Y235-F239 WeakPolarHBondContact O-CB 3.43Å; Y235-F239 PolarHBondContact O-N 2.98Å; Y235-L298 HydrophobicContact CD1-CB 4.05Å; Y235-L298 HydrophobicContact CE1-CB 3.65Å; Y235-L298 HydrophobicContact CE1-CD2 3.96Å; Y235-L298 HydrophobicContact CE1-CG 4.35Å; Y235-L298 WeakPolarHBondContact CE1-O 3.18Å; Y235-L298 VanDerWaalsContact CZ-O 3.28Å; Y235-V301 VanDerWaalsContact OH-CB 3.31Å; Y235-V301 WeakPolarHBondContact OH-CB 2.98Å; Y235-V301 WeakPolarHBondContact OH-CG1 2.98Å |
| 236 | C | 81.8 | Confident | 80.4 | Confident | 71 Ų | 71 | 65.7 Ų | 65.7 | 48% | 0.48 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -58.2 | -47.1 | 176.1 | -74.9 | 0 | 0 | 0 | 0 | 111.4 | L232 V233 F239 K240 | L232-C236 VanDerWaalsContact O-CB 3.31Å; L232-C236 WeakPolarHBondContact O-CB 3.46Å; L232-C236 PolarHBondContact O-N 3.34Å; L232-C236 PolarHBondContact O-SG 3.45Å; V233-C236 PolarHBondContact O-N 3.21Å; C236-F239 PolarHBondContact O-N 3.36Å; C236-K240 WeakPolarHBondContact O-CB 3.31Å; C236-K240 PolarHBondContact O-N 3.17Å |
| 237 | N | 81.1 | Confident | 79.3 | Confident | 64 Ų | 64 | 69.5 Ų | 69.5 | 34% | 0.342 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -66.5 | -42 | 179.8 | -71.1 | -33.2 | 0 | 0 | 0 | 112 | Y140 V233 V234 Y235 K240 V241 | Y140-N237 HydrophobicContact CD2-CB 4.2Å; Y140-N237 HydrophobicContact CE2-CB 3.5Å; Y140-N237 VanDerWaalsContact CE2-CB 3.5Å; V233-N237 WeakPolarHBondContact O-CB 3.09Å; V233-N237 VanDerWaalsContact O-CG 3.26Å; V233-N237 PolarHBondContact O-N 2.86Å; V233-N237 PolarHBondContact O-ND2 3.03Å; V233-N237 VanDerWaalsContact O-ND2 3.14Å; V234-N237 PolarHBondContact O-N 3.43Å; Y235-N237 VanDerWaalsContact C-N 3.35Å; Y235-N237 PolarHBondContact O-N 3.24Å; N237-K240 WeakPolarHBondContact O-CB 3.32Å; N237-K240 PolarHBondContact O-N 3.31Å; N237-V241 WeakPolarHBondContact O-CG2 3.4Å; N237-V241 PolarHBondContact O-N 2.8Å |
| 238 | M | 77.8 | Confident | 77.9 | Confident | 5 Ų | 5 | 76.8 Ų | 76.8 | 3% | 0.025 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -65.9 | -40.7 | 177.4 | -177.4 | -171.3 | 55.1 | 0 | 0 | 112 | I143 V234 Y235 K240 V241 A242 L298 | I143-M238 HydrophobicContact CB-CG 4.43Å; I143-M238 HydrophobicContact CD1-CG 3.85Å; I143-M238 HydrophobicContact CD1-SD 3.3Å; I143-M238 WeakPolarHBondContact CD1-SD 3.42Å; I143-M238 HydrophobicContact CG2-CG 4.03Å; V234-M238 VanDerWaalsContact O-CB 3.3Å; V234-M238 WeakPolarHBondContact O-CB 3.42Å; V234-M238 PolarHBondContact O-N 3.14Å; Y235-M238 HydrophobicContact CD1-CE 3.26Å; Y235-M238 HydrophobicContact CE1-CE 3.58Å; Y235-M238 HydrophobicContact CG-CE 4.39Å; Y235-M238 PolarHBondContact O-N 3Å; M238-K240 VanDerWaalsContact C-N 3.35Å; M238-V241 PolarHBondContact O-N 3.04Å; M238-A242 WeakPolarHBondContact O-CB 3.41Å; M238-A242 PolarHBondContact O-N 3.2Å; M238-L298 HydrophobicContact CE-CB 3.68Å; M238-L298 HydrophobicContact CE-CD1 3.22Å; M238-L298 HydrophobicContact CE-CD2 3.58Å; M238-L298 HydrophobicContact CE-CG 3.58Å; M238-L298 HydrophobicContact CG-CD1 4.44Å; M238-L298 HydrophobicContact SD-CD1 3.46Å; M238-L298 WeakPolarHBondContact SD-CD1 3.4Å; M238-L298 HydrophobicContact SD-CD2 3.72Å; M238-L298 HydrophobicContact SD-CG 4.08Å |
| 239 | F | 76.4 | Confident | 76.1 | Confident | 113 Ų | 113 | 82.9 Ų | 82.9 | 50% | 0.496 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -64.5 | -40 | 175.1 | -174.5 | -97.8 | 0 | 0 | 0 | 111.7 | Y235 C236 V241 A242 R243 | Y235-F239 WeakPolarHBondContact O-CB 3.43Å; Y235-F239 PolarHBondContact O-N 2.98Å; C236-F239 PolarHBondContact O-N 3.36Å; F239-V241 PolarHBondContact O-N 2.91Å; F239-A242 PolarHBondContact O-N 2.76Å; F239-R243 VanDerWaalsContact O-CB 3.3Å; F239-R243 WeakPolarHBondContact O-CB 3.3Å; F239-R243 PolarHBondContact O-N 3.37Å |
| 240 | K | 80.9 | Confident | 74.1 | Confident | 144 Ų | 144 | 80.1 Ų | 80.1 | 63% | 0.626 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -57.9 | -49.2 | 174.1 | -176.7 | 178.3 | 176.7 | 175.2 | 0 | 111 | C236 N237 M238 R243 V244 | C236-K240 WeakPolarHBondContact O-CB 3.31Å; C236-K240 PolarHBondContact O-N 3.17Å; N237-K240 WeakPolarHBondContact O-CB 3.32Å; N237-K240 PolarHBondContact O-N 3.31Å; M238-K240 VanDerWaalsContact C-N 3.35Å; K240-R243 PolarHBondContact O-N 3.36Å; K240-V244 VanDerWaalsContact O-CG2 3.26Å; K240-V244 WeakPolarHBondContact O-CG2 3.38Å; K240-V244 PolarHBondContact O-N 3.35Å |
| 241 | V | 75.8 | Confident | 72.1 | Confident | 54 Ų | 54 | 82.6 Ų | 82.6 | 33% | 0.327 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -64.1 | -44.2 | 179.1 | 173.5 | 0 | 0 | 0 | 0 | 111.4 | V144 N237 M238 F239 R243 V244 A245 | V144-V241 HydrophobicContact CG1-CG2 4.15Å; V144-V241 HydrophobicContact CG2-CB 4.24Å; V144-V241 HydrophobicContact CG2-CG1 4.34Å; V144-V241 HydrophobicContact CG2-CG2 3.88Å; N237-V241 WeakPolarHBondContact O-CG2 3.4Å; N237-V241 PolarHBondContact O-N 2.8Å; M238-V241 PolarHBondContact O-N 3.04Å; F239-V241 PolarHBondContact O-N 2.91Å; V241-R243 PolarHBondContact O-N 3.48Å; V241-V244 PolarHBondContact O-N 2.96Å; V241-A245 WeakPolarHBondContact O-CB 3.26Å; V241-A245 PolarHBondContact O-N 3.21Å |
| 242 | A | 71 | Confident | 70.2 | Confident | 50 Ų | 50 | 89.2 Ų | 89.2 | 41% | 0.413 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -61.9 | -42.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | M238 F239 A245 S246 | M238-A242 WeakPolarHBondContact O-CB 3.41Å; M238-A242 PolarHBondContact O-N 3.2Å; F239-A242 PolarHBondContact O-N 2.76Å; A242-A245 PolarHBondContact O-N 3.4Å; A242-S246 PolarHBondContact O-N 2.93Å; A242-S246 PolarHBondContact O-OG 2.96Å |
| 243 | R | 74.4 | Confident | 68 | Low | 162 Ų | 162 | 89.9 Ų | 89.9 | 61% | 0.611 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -64.4 | -45.8 | 177.1 | -172.5 | 178.9 | -179 | -171.6 | 1.1 | 111.1 | F239 K240 V241 A245 S246 M247 | F239-R243 VanDerWaalsContact O-CB 3.3Å; F239-R243 WeakPolarHBondContact O-CB 3.3Å; F239-R243 PolarHBondContact O-N 3.37Å; K240-R243 PolarHBondContact O-N 3.36Å; V241-R243 PolarHBondContact O-N 3.48Å; R243-A245 VanDerWaalsContact C-N 3.35Å; R243-A245 PolarHBondContact O-N 2.87Å; R243-S246 WeakPolarHBondContact CA-OG 3.38Å; R243-S246 PolarHBondContact O-N 3.35Å; R243-S246 PolarHBondContact O-OG 2.95Å; R243-M247 VanDerWaalsContact O-CG 3.25Å; R243-M247 WeakPolarHBondContact O-CG 3.38Å; R243-M247 PolarHBondContact O-N 3.22Å |
| 244 | V | 75.1 | Confident | 66.2 | Low | 73 Ų | 73 | 93.2 Ų | 93.2 | 44% | 0.442 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.5 | -43.6 | 176.9 | 173.4 | 0 | 0 | 0 | 0 | 110.8 | K240 V241 S246 M247 H248 | K240-V244 VanDerWaalsContact O-CG2 3.26Å; K240-V244 WeakPolarHBondContact O-CG2 3.38Å; K240-V244 PolarHBondContact O-N 3.35Å; V241-V244 PolarHBondContact O-N 2.96Å; V244-S246 VanDerWaalsContact C-N 3.33Å; V244-S246 PolarHBondContact O-N 2.91Å; V244-M247 PolarHBondContact O-N 3.29Å; V244-H248 PolarHBondContact O-N 2.9Å; V244-H248 PolarHBondContact O-ND1 2.95Å |
| 245 | A | 69.5 | Low | 64.8 | Low | 60 Ų | 60 | 102.2 Ų | 102.2 | 50% | 0.496 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -64.4 | -33.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | V241 A242 R243 | V241-A245 WeakPolarHBondContact O-CB 3.26Å; V241-A245 PolarHBondContact O-N 3.21Å; A242-A245 PolarHBondContact O-N 3.4Å; R243-A245 VanDerWaalsContact C-N 3.35Å; R243-A245 PolarHBondContact O-N 2.87Å |
| 246 | S | 67.4 | Low | 63.2 | Low | 74 Ų | 74 | 107.2 Ų | 107.2 | 52% | 0.517 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -72.2 | -32.8 | 173.5 | 65.9 | 0 | 0 | 0 | 0 | 113.4 | A242 R243 V244 R249 | A242-S246 PolarHBondContact O-N 2.93Å; A242-S246 PolarHBondContact O-OG 2.96Å; R243-S246 WeakPolarHBondContact CA-OG 3.38Å; R243-S246 PolarHBondContact O-N 3.35Å; R243-S246 PolarHBondContact O-OG 2.95Å; V244-S246 VanDerWaalsContact C-N 3.33Å; V244-S246 PolarHBondContact O-N 2.91Å; S246-R249 PolarHBondContact O-N 3.32Å |
| 247 | M | 65.3 | Low | 61.4 | Low | 136 Ų | 136 | 111.7 Ų | 111.7 | 67% | 0.67 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -71.4 | -32 | 179.4 | -70.7 | -67 | -65.9 | 0 | 0 | 112.2 | R243 V244 R249 G250 | R243-M247 VanDerWaalsContact O-CG 3.25Å; R243-M247 WeakPolarHBondContact O-CG 3.38Å; R243-M247 PolarHBondContact O-N 3.22Å; V244-M247 PolarHBondContact O-N 3.29Å; M247-R249 PolarHBondContact O-N 2.88Å; M247-G250 PolarHBondContact O-N 3.46Å; M247-G250 VanDerWaalsContact O-N 3.17Å |
| 248 | H | 58.3 | Low | 59.5 | Low | 157 Ų | 157 | 112.4 Ų | 112.4 | 73% | 0.727 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.8 | -6.9 | 174.1 | -70.8 | 80.7 | 0 | 0 | 0 | 113.6 | V244 | V244-H248 PolarHBondContact O-N 2.9Å; V244-H248 PolarHBondContact O-ND1 2.95Å |
| 249 | R | 50.8 | Low | 57.7 | Low | 193 Ų | 193 | 116.9 Ų | 116.9 | 73% | 0.728 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.3 | 24 | 168.6 | -75 | -178.2 | 173.3 | 153.2 | -0.3 | 112.4 | S246 M247 | S246-R249 PolarHBondContact O-N 3.32Å; M247-R249 PolarHBondContact O-N 2.88Å |
| 250 | G | 46.2 | Very low | 55.9 | Low | 44 Ų | 44 | 123 Ų | 123 | 45% | 0.454 | 65% | 0.652 | S | S | . | * | trans | -62.1 | 161.8 | 164.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | M247 | M247-G250 PolarHBondContact O-N 3.46Å; M247-G250 VanDerWaalsContact O-N 3.17Å | ||
| 251 | P | 45.1 | Very low | 54 | Low | 127 Ų | 127 | 125 Ų | 125 | 83% | 0.825 | 66% | 0.664 | S | S | * | * | trans | -55.8 | 142.4 | -152.2 | 25.2 | -34.2 | 0 | 0 | 0 | 112.8 | ||||
| 252 | N | 44.9 | Very low | 52.4 | Low | 149 Ų | 149 | 133 Ų | 133 | 80% | 0.797 | 69% | 0.688 | S | S | * | * | trans | -35.4 | 123.8 | 172 | -121 | 4.1 | 0 | 0 | 0 | 109.7 | T254 | N252-T254 PolarHBondContact O-N 3.23Š| ||
| 253 | P | 40.5 | Very low | 50.9 | Low | 99 Ų | 99 | 136 Ų | 136 | 64% | 0.643 | 71% | 0.706 | S | S | * | * | trans | -59.6 | 119.6 | 170.6 | 23.4 | -29.3 | 0 | 0 | 0 | 107.2 | W255 | P253-W255 PolarHBondContact O-N 2.92Š| ||
| 254 | T | 47.3 | Very low | 49.1 | Very low | 141 Ų | 141 | 135.7 Ų | 135.7 | 87% | 0.865 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -67.7 | 52.9 | 170.8 | -36.9 | 0 | 0 | 0 | 0 | 110.2 | N252 | N252-T254 PolarHBondContact O-N 3.23Š|
| 255 | W | 50.5 | Low | 47.5 | Very low | 202 Ų | 202 | 137.7 Ų | 137.7 | 77% | 0.765 | 73% | 0.734 | S | S | * | * | trans | -146.5 | 41 | -176.4 | -105.7 | 99.7 | 0 | 0 | 0 | 112 | P253 T258 | P253-W255 PolarHBondContact O-N 2.92Å; W255-T258 VanDerWaalsContact CE3-OG1 3.3Å; W255-T258 HydrophobicContact CZ3-CG2 4.42Å; W255-T258 WeakPolarHBondContact CZ3-OG1 3.49Å | ||
| 256 | V | 48.1 | Very low | 46.4 | Very low | 134 Ų | 134 | 141.5 Ų | 141.5 | 81% | 0.812 | 75% | 0.75 | S | S | * | * | trans | -132.6 | 52.7 | 156.9 | -158.4 | 0 | 0 | 0 | 0 | 109 | ||||
| 257 | D | 42.8 | Very low | 45.1 | Very low | 165 Ų | 165 | 142.9 Ų | 142.9 | 88% | 0.882 | 76% | 0.76 | S | S | * | * | trans | -121.8 | 59.7 | 146.7 | -150.4 | 6.3 | 0 | 0 | 0 | 107 | ||||
| 258 | T | 42.4 | Very low | 43.9 | Very low | 79 Ų | 79 | 141.8 Ų | 141.8 | 49% | 0.485 | 77% | 0.766 | S | S | . | * | S | Bend | trans | -116.9 | 99.8 | 157.9 | -31 | 0 | 0 | 0 | 0 | 103.8 | W255 R260 | W255-T258 VanDerWaalsContact CE3-OG1 3.3Å; W255-T258 HydrophobicContact CZ3-CG2 4.42Å; W255-T258 WeakPolarHBondContact CZ3-OG1 3.49Å; T258-R260 PolarHBondContact O-N 3.36Å |
| 259 | S | 39.8 | Very low | 43 | Very low | 99 Ų | 99 | 143.2 Ų | 143.2 | 69% | 0.692 | 77% | 0.772 | S | S | * | * | trans | -30.8 | 102.9 | 162.1 | 44.1 | 0 | 0 | 0 | 0 | 109.8 | Q261 | S259-Q261 PolarHBondContact O-N 3.23Š| ||
| 260 | R | 38.8 | Very low | 42.3 | Very low | 240 Ų | 240 | 139.4 Ų | 139.4 | 91% | 0.906 | 78% | 0.775 | S | S | * | * | trans | -60.4 | 104.3 | 150.9 | -91 | -176.8 | 170.8 | 176.7 | -2.7 | 104.1 | T258 R262 | T258-R260 PolarHBondContact O-N 3.36Å; R260-R262 PolarHBondContact O-N 3.27Å | ||
| 261 | Q | 40.9 | Very low | 41.9 | Very low | 188 Ų | 188 | 143.4 Ų | 143.4 | 88% | 0.879 | 79% | 0.791 | S | S | * | * | trans | -59.1 | 84.1 | 169.5 | -167.9 | 164.2 | -10.8 | 0 | 0 | 107.4 | S259 | S259-Q261 PolarHBondContact O-N 3.23Š| ||
| 262 | R | 40.9 | Very low | 41.7 | Very low | 221 Ų | 221 | 146 Ų | 146 | 83% | 0.834 | 80% | 0.795 | S | S | * | * | trans | -84.3 | 116.5 | 168.8 | -169.5 | 168.5 | -172 | 95.3 | 0 | 104.2 | R260 D264 | R260-R262 PolarHBondContact O-N 3.27Å; R262-D264 PolarHBondContact O-N 3.01Å | ||
| 263 | S | 39.8 | Very low | 41.3 | Very low | 114 Ų | 114 | 143.5 Ų | 143.5 | 80% | 0.797 | 79% | 0.794 | S | S | * | * | trans | -46.4 | 112.3 | -177.6 | -48.8 | 0 | 0 | 0 | 0 | 111 | S265 | S263-S265 PolarHBondContact O-N 2.97Š| ||
| 264 | D | 37.7 | Very low | 41.4 | Very low | 155 Ų | 155 | 143.3 Ų | 143.3 | 83% | 0.829 | 80% | 0.801 | S | S | * | * | trans | -72 | 106.2 | 172.6 | -72.6 | -41 | 0 | 0 | 0 | 108.9 | R262 V266 | R262-D264 PolarHBondContact O-N 3.01Å; D264-V266 PolarHBondContact O-N 2.03Å | ||
| 265 | S | 41 | Very low | 40.8 | Very low | 115 Ų | 115 | 142.1 Ų | 142.1 | 80% | 0.804 | 80% | 0.798 | S | S | * | * | trans | -79.8 | 110.4 | 154.3 | 55.2 | 0 | 0 | 0 | 0 | 107.9 | S263 S267 | S263-S265 PolarHBondContact O-N 2.97Å; S265-S267 PolarHBondContact O-N 2.87Å | ||
| 266 | V | 47 | Very low | 40.4 | Very low | 140 Ų | 140 | 141.2 Ų | 141.2 | 85% | 0.848 | 81% | 0.807 | S | S | * | * | trans | -58.6 | 111.1 | 174.6 | 173.1 | 0 | 0 | 0 | 0 | 110.3 | D264 | D264-V266 PolarHBondContact O-N 2.03Š| ||
| 267 | S | 39.2 | Very low | 39.6 | Very low | 102 Ų | 102 | 138.4 Ų | 138.4 | 71% | 0.713 | 81% | 0.806 | S | S | * | * | trans | 179.2 | 116.1 | 138.7 | 59 | 0 | 0 | 0 | 0 | 111 | S265 | S265-S267 PolarHBondContact O-N 2.87Š| ||
| 268 | S | 39.3 | Very low | 39.3 | Very low | 114 Ų | 114 | 134 Ų | 134 | 80% | 0.797 | 80% | 0.799 | S | S | * | * | trans | 141.9 | 114.7 | 133 | -62.9 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 269 | H | 39.4 | Very low | 38.8 | Very low | 186 Ų | 186 | 137.4 Ų | 137.4 | 86% | 0.861 | 82% | 0.82 | S | S | * | * | trans | -48.1 | 168.1 | 172.2 | -77.3 | -108.2 | 0 | 0 | 0 | 115.7 | ||||
| 270 | S | 37.2 | Very low | 38.6 | Very low | 114 Ų | 114 | 136 Ų | 136 | 80% | 0.797 | 82% | 0.821 | S | S | * | * | trans | 111.6 | 124 | 154.3 | 73.8 | 0 | 0 | 0 | 0 | 113 | ||||
| 271 | T | 37.1 | Very low | 38.7 | Very low | 127 Ų | 127 | 129.1 Ų | 129.1 | 78% | 0.779 | 82% | 0.816 | S | S | * | * | cis | -156.2 | 134.6 | 1.7 | -78 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 272 | M | 40.3 | Very low | 38.3 | Very low | 183 Ų | 183 | 131.6 Ų | 131.6 | 90% | 0.901 | 82% | 0.817 | S | S | * | * | trans | -70.8 | 128.3 | 166 | -72.1 | -134.4 | -61.9 | 0 | 0 | 109.7 | ||||
| 273 | A | 38.3 | Very low | 38.2 | Very low | 95 Ų | 95 | 126.7 Ų | 126.7 | 79% | 0.785 | 81% | 0.812 | S | S | * | * | trans | -136.7 | 95.7 | 149.3 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 274 | A | 40.8 | Very low | 38 | Very low | 95 Ų | 95 | 126.7 Ų | 126.7 | 79% | 0.785 | 81% | 0.807 | S | S | * | * | trans | -77.2 | 130 | 158 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 275 | S | 36.6 | Very low | 38 | Very low | 116 Ų | 116 | 125 Ų | 125 | 81% | 0.811 | 80% | 0.804 | S | S | * | * | trans | -155.7 | 133.7 | 143.4 | 36.3 | 0 | 0 | 0 | 0 | 110 | ||||
| 276 | L | 40.4 | Very low | 37.8 | Very low | 183 Ų | 183 | 127.8 Ų | 127.8 | 96% | 0.958 | 81% | 0.805 | S | S | * | * | trans | -69 | 149 | -178.5 | -68.7 | 92.7 | 0 | 0 | 0 | 111.1 | ||||
| 277 | G | 31.9 | Very low | 37.4 | Very low | 76 Ų | 76 | 132 Ų | 132 | 78% | 0.784 | 81% | 0.805 | S | S | * | * | trans | 178.9 | 81.6 | 167.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 278 | G | 35.9 | Very low | 37.2 | Very low | 71 Ų | 71 | 133.7 Ų | 133.7 | 73% | 0.732 | 81% | 0.812 | S | S | * | * | trans | -63.3 | 144.1 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 279 | T | 32.5 | Very low | 37.3 | Very low | 151 Ų | 151 | 136 Ų | 136 | 93% | 0.926 | 81% | 0.808 | S | S | * | * | trans | -179.2 | 132.7 | 132 | 19.3 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 280 | G | 35.7 | Very low | 37.7 | Very low | 69 Ų | 69 | 130.8 Ų | 130.8 | 71% | 0.711 | 79% | 0.792 | S | S | * | * | trans | 82.1 | 90.3 | 164.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | R282 | G280-R282 PolarHBondContact O-N 2.9Š| ||
| 281 | A | 40.9 | Very low | 38.4 | Very low | 96 Ų | 96 | 127.2 Ų | 127.2 | 79% | 0.793 | 77% | 0.773 | S | S | * | * | trans | -49.4 | 91.4 | 139.4 | 0 | 0 | 0 | 0 | 0 | 107.9 | T283 | A281-T283 PolarHBondContact O-N 3.1Š| ||
| 282 | R | 32.1 | Very low | 39.5 | Very low | 240 Ų | 240 | 123.9 Ų | 123.9 | 91% | 0.906 | 76% | 0.764 | S | S | * | * | trans | -69.7 | 82.8 | 156.1 | -105.6 | 178.9 | 165.8 | 145.6 | -3.9 | 104.5 | G280 T284 | G280-R282 PolarHBondContact O-N 2.9Å; R282-T284 PolarHBondContact O-N 3.04Å | ||
| 283 | T | 38.9 | Very low | 40.7 | Very low | 118 Ų | 118 | 123.1 Ų | 123.1 | 72% | 0.724 | 76% | 0.756 | S | S | * | * | trans | -48.2 | 97.4 | 144.4 | 44.9 | 0 | 0 | 0 | 0 | 104.9 | A281 P285 | A281-T283 PolarHBondContact O-N 3.1Å; T283-P285 VanDerWaalsContact O-N 3.17Å | ||
| 284 | T | 35.3 | Very low | 41.9 | Very low | 115 Ų | 115 | 121.1 Ų | 121.1 | 71% | 0.706 | 74% | 0.739 | S | S | * | * | trans | -43.1 | 128.1 | 153.4 | 38.1 | 0 | 0 | 0 | 0 | 104.8 | R282 Q286 | R282-T284 PolarHBondContact O-N 3.04Å; T284-Q286 PolarHBondContact O-N 3.05Å | ||
| 285 | P | 37.6 | Very low | 43 | Very low | 118 Ų | 118 | 117.9 Ų | 117.9 | 77% | 0.766 | 71% | 0.712 | S | S | * | * | trans | -57.9 | 105.7 | 173.2 | -5.3 | 16.3 | 0 | 0 | 0 | 103.7 | T283 R287 | T283-P285 VanDerWaalsContact O-N 3.17Å; P285-R287 PolarHBondContact O-N 2.73Å | ||
| 286 | Q | 37.2 | Very low | 44.6 | Very low | 175 Ų | 175 | 115.1 Ų | 115.1 | 82% | 0.818 | 70% | 0.697 | S | S | * | * | trans | -60.6 | 94 | 166.3 | -175.2 | 171.9 | -0.3 | 0 | 0 | 101.6 | T284 T288 | T284-Q286 PolarHBondContact O-N 3.05Å; Q286-T288 PolarHBondContact O-N 3.13Å | ||
| 287 | R | 38.3 | Very low | 46 | Very low | 228 Ų | 228 | 108.4 Ų | 108.4 | 86% | 0.86 | 66% | 0.663 | S | S | * | * | trans | -53.1 | 99.3 | 171.9 | -83.7 | -179.5 | 179.5 | 154.5 | -0.3 | 102.9 | P285 F289 | P285-R287 PolarHBondContact O-N 2.73Å; R287-F289 VanDerWaalsContact C-N 3.27Å; R287-F289 WeakPolarHBondContact O-CA 3.39Å; R287-F289 PolarHBondContact O-N 3.2Å | ||
| 288 | T | 36 | Very low | 47.9 | Very low | 137 Ų | 137 | 106.2 Ų | 106.2 | 84% | 0.84 | 63% | 0.633 | S | S | * | * | trans | -50.4 | 106 | 167.5 | 37.5 | 0 | 0 | 0 | 0 | 104 | Q286 S290 | Q286-T288 PolarHBondContact O-N 3.13Å; T288-S290 PolarHBondContact O-N 2.84Å | ||
| 289 | F | 40.8 | Very low | 49.7 | Very low | 163 Ų | 163 | 107.7 Ų | 107.7 | 72% | 0.715 | 63% | 0.628 | S | S | * | * | trans | -60.8 | 111.6 | -163 | -170.6 | -93.7 | 0 | 0 | 0 | 107.1 | R287 G291 | R287-F289 VanDerWaalsContact C-N 3.27Å; R287-F289 WeakPolarHBondContact O-CA 3.39Å; R287-F289 PolarHBondContact O-N 3.2Å; F289-G291 PolarHBondContact O-N 2.8Å | ||
| 290 | S | 48.7 | Very low | 51.9 | Low | 76 Ų | 76 | 102.3 Ų | 102.3 | 53% | 0.531 | 60% | 0.599 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 13.6 | 7.7 | 139.6 | -163.6 | 0 | 0 | 0 | 0 | 122 | T288 | T288-S290 PolarHBondContact O-N 2.84Š|
| 291 | G | 51.8 | Low | 53.9 | Low | 39 Ų | 39 | 99.1 Ų | 99.1 | 40% | 0.402 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -80 | -39.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | F289 K293 A294 A295 | F289-G291 PolarHBondContact O-N 2.8Å; G291-K293 VanDerWaalsContact C-N 3.32Å; G291-K293 PolarHBondContact O-N 3.12Å; G291-A294 PolarHBondContact O-N 3.39Å; G291-A295 WeakPolarHBondContact O-CB 3.28Å; G291-A295 PolarHBondContact O-N 3.06Å |
| 292 | G | 59.3 | Low | 55.6 | Low | 57 Ų | 57 | 95.3 Ų | 95.3 | 59% | 0.588 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -63.7 | -34.8 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | A296 | G292-A296 WeakPolarHBondContact O-CB 3.37Å; G292-A296 PolarHBondContact O-N 3.48Å |
| 293 | K | 65.3 | Low | 58 | Low | 167 Ų | 167 | 85.4 Ų | 85.4 | 73% | 0.726 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -69 | -42.7 | 177.8 | -65.6 | -177.6 | 180 | -178 | 0 | 112.1 | G291 A296 V297 | G291-K293 VanDerWaalsContact C-N 3.32Å; G291-K293 PolarHBondContact O-N 3.12Å; K293-A296 PolarHBondContact O-N 3.41Å; K293-V297 WeakPolarHBondContact O-CG2 3.43Å; K293-V297 PolarHBondContact O-N 3.17Å |
| 294 | A | 63.2 | Low | 60.4 | Low | 54 Ų | 54 | 81 Ų | 81 | 45% | 0.446 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -66.5 | -45.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111 | G291 A296 V297 L298 | G291-A294 PolarHBondContact O-N 3.39Å; A294-A296 VanDerWaalsContact C-N 3.31Å; A294-A296 PolarHBondContact O-N 3.48Å; A294-V297 PolarHBondContact O-N 3.37Å; A294-L298 WeakPolarHBondContact O-CD1 3.27Å; A294-L298 WeakPolarHBondContact O-CG 3.49Å; A294-L298 PolarHBondContact O-N 2.83Å; A294-L298 VanDerWaalsContact O-N 3.08Å |
| 295 | A | 65.4 | Low | 62.9 | Low | 26 Ų | 26 | 76 Ų | 76 | 22% | 0.215 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -60.7 | -38.7 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | G291 L298 V299 | G291-A295 WeakPolarHBondContact O-CB 3.28Å; G291-A295 PolarHBondContact O-N 3.06Å; A295-L298 WeakPolarHBondContact O-CB 3.34Å; A295-L298 PolarHBondContact O-N 3.45Å; A295-V299 WeakPolarHBondContact O-CG2 3.44Å; A295-V299 PolarHBondContact O-N 3.41Å |
| 296 | A | 68.4 | Low | 65.3 | Low | 58 Ų | 58 | 74.7 Ų | 74.7 | 48% | 0.479 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -64 | -42.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | G292 K293 A294 L298 V299 A300 | G292-A296 WeakPolarHBondContact O-CB 3.37Å; G292-A296 PolarHBondContact O-N 3.48Å; K293-A296 PolarHBondContact O-N 3.41Å; A294-A296 VanDerWaalsContact C-N 3.31Å; A294-A296 PolarHBondContact O-N 3.48Å; A296-L298 VanDerWaalsContact C-N 3.26Å; A296-L298 PolarHBondContact O-N 3.12Å; A296-V299 PolarHBondContact O-N 2.96Å; A296-A300 VanDerWaalsContact O-CB 3.23Å; A296-A300 WeakPolarHBondContact O-CB 3.48Å; A296-A300 PolarHBondContact O-N 2.85Å |
| 297 | V | 70.9 | Confident | 67.8 | Low | 42 Ų | 42 | 70.1 Ų | 70.1 | 26% | 0.255 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -59.8 | -40.7 | 174 | 168.8 | 0 | 0 | 0 | 0 | 110.9 | K293 A294 A300 V301 L354 | K293-V297 WeakPolarHBondContact O-CG2 3.43Å; K293-V297 PolarHBondContact O-N 3.17Å; A294-V297 PolarHBondContact O-N 3.37Å; V297-A300 PolarHBondContact O-N 3.46Å; V297-V301 HydrophobicContact CG1-CG2 4.4Å; V297-V301 WeakPolarHBondContact O-CG2 3.32Å; V297-V301 PolarHBondContact O-N 3.46Å; V297-L354 HydrophobicContact CG1-CB 3.88Å; V297-L354 HydrophobicContact CG1-CD1 3.96Å; V297-L354 HydrophobicContact CG2-CB 4.35Å; V297-L354 HydrophobicContact CG2-CD1 4.32Å; V297-L354 HydrophobicContact CG2-CD2 4.38Å |
| 298 | L | 70.9 | Confident | 70.4 | Confident | 30 Ų | 30 | 59.3 Ų | 59.3 | 16% | 0.157 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -67.6 | -44 | 179.8 | -67.7 | 165.2 | 0 | 0 | 0 | 112.2 | Y235 M238 A294 A295 A296 A300 V301 G302 | Y235-L298 HydrophobicContact CD1-CB 4.05Å; Y235-L298 HydrophobicContact CE1-CB 3.65Å; Y235-L298 HydrophobicContact CE1-CD2 3.96Å; Y235-L298 HydrophobicContact CE1-CG 4.35Å; Y235-L298 WeakPolarHBondContact CE1-O 3.18Å; Y235-L298 VanDerWaalsContact CZ-O 3.28Å; M238-L298 HydrophobicContact CE-CB 3.68Å; M238-L298 HydrophobicContact CE-CD1 3.22Å; M238-L298 HydrophobicContact CE-CD2 3.58Å; M238-L298 HydrophobicContact CE-CG 3.58Å; M238-L298 HydrophobicContact CG-CD1 4.44Å; M238-L298 HydrophobicContact SD-CD1 3.46Å; M238-L298 WeakPolarHBondContact SD-CD1 3.4Å; M238-L298 HydrophobicContact SD-CD2 3.72Å; M238-L298 HydrophobicContact SD-CG 4.08Å; A294-L298 WeakPolarHBondContact O-CD1 3.27Å; A294-L298 WeakPolarHBondContact O-CG 3.49Å; A294-L298 PolarHBondContact O-N 2.83Å; A294-L298 VanDerWaalsContact O-N 3.08Å; A295-L298 WeakPolarHBondContact O-CB 3.34Å; A295-L298 PolarHBondContact O-N 3.45Å; A296-L298 VanDerWaalsContact C-N 3.26Å; A296-L298 PolarHBondContact O-N 3.12Å; L298-A300 VanDerWaalsContact C-N 3.3Å; L298-A300 PolarHBondContact O-N 3.47Å; L298-V301 PolarHBondContact O-N 3.38Å; L298-G302 PolarHBondContact O-N 2.85Å; L298-G302 VanDerWaalsContact O-N 3.12Å |
| 299 | V | 74.8 | Confident | 73 | Confident | 102 Ų | 102 | 53.2 Ų | 53.2 | 62% | 0.618 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -61.9 | -40.4 | 172.1 | 171.3 | 0 | 0 | 0 | 0 | 110.9 | A295 A296 G302 G303 | A295-V299 WeakPolarHBondContact O-CG2 3.44Å; A295-V299 PolarHBondContact O-N 3.41Å; A296-V299 PolarHBondContact O-N 2.96Å; V299-G302 PolarHBondContact O-N 3.39Å; V299-G303 PolarHBondContact O-N 3.31Å |
| 300 | A | 77.3 | Confident | 75.4 | Confident | 39 Ų | 39 | 48 Ų | 48 | 32% | 0.322 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -65.1 | -41.6 | 179.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | A296 V297 L298 G303 Q304 F350 | A296-A300 VanDerWaalsContact O-CB 3.23Å; A296-A300 WeakPolarHBondContact O-CB 3.48Å; A296-A300 PolarHBondContact O-N 2.85Å; V297-A300 PolarHBondContact O-N 3.46Å; L298-A300 VanDerWaalsContact C-N 3.3Å; L298-A300 PolarHBondContact O-N 3.47Å; A300-G303 PolarHBondContact O-N 3.03Å; A300-Q304 WeakPolarHBondContact O-CB 3.41Å; A300-Q304 PolarHBondContact O-N 3.38Å; A300-F350 HydrophobicContact CB-CD1 4.44Å; A300-F350 HydrophobicContact CB-CE1 3.82Å; A300-F350 VanDerWaalsContact O-CE1 3.3Å; A300-F350 WeakPolarHBondContact O-CE1 3.12Å |
| 301 | V | 77.8 | Confident | 77.5 | Confident | 2 Ų | 2 | 46.4 Ų | 46.4 | 1% | 0.012 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -65.2 | -44.7 | 176.8 | 175.7 | 0 | 0 | 0 | 0 | 111.5 | Y235 V297 L298 Q304 F350 Y351 | Y235-V301 VanDerWaalsContact OH-CB 3.31Å; Y235-V301 WeakPolarHBondContact OH-CB 2.98Å; Y235-V301 WeakPolarHBondContact OH-CG1 2.98Å; V297-V301 HydrophobicContact CG1-CG2 4.4Å; V297-V301 WeakPolarHBondContact O-CG2 3.32Å; V297-V301 PolarHBondContact O-N 3.46Å; L298-V301 PolarHBondContact O-N 3.38Å; V301-Q304 PolarHBondContact O-N 3.19Å; V301-F350 HydrophobicContact CB-CD1 4.49Å; V301-F350 HydrophobicContact CG2-CB 4.16Å; V301-F350 HydrophobicContact CG2-CD1 3.93Å; V301-F350 HydrophobicContact CG2-CG 4.49Å; V301-Y351 HydrophobicContact CG1-CE1 3.68Å; V301-Y351 HydrophobicContact CG1-CE2 4.47Å; V301-Y351 WeakPolarHBondContact CG1-OH 3.19Å |
| 302 | G | 77.3 | Confident | 79.3 | Confident | 16 Ų | 16 | 46 Ų | 46 | 17% | 0.165 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -66.2 | -40.6 | 176 | 0 | 0 | 0 | 0 | 0 | 113 | L298 V299 Q304 F305 | L298-G302 PolarHBondContact O-N 2.85Å; L298-G302 VanDerWaalsContact O-N 3.12Å; V299-G302 PolarHBondContact O-N 3.39Å; G302-Q304 VanDerWaalsContact C-N 3.32Å; G302-Q304 PolarHBondContact O-N 3.33Å; G302-F305 PolarHBondContact O-N 3.33Å |
| 303 | G | 83.4 | Confident | 80.7 | Confident | 31 Ų | 31 | 43.5 Ų | 43.5 | 32% | 0.32 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -63.6 | -36.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | V299 A300 F305 F306 C307 | V299-G303 PolarHBondContact O-N 3.31Å; A300-G303 PolarHBondContact O-N 3.03Å; G303-F305 VanDerWaalsContact C-N 3.35Å; G303-F305 PolarHBondContact O-N 3.41Å; G303-F306 PolarHBondContact O-N 3.35Å; G303-C307 PolarHBondContact O-N 3.28Å; G303-C307 PolarHBondContact O-SG 3.43Å |
| 304 | Q | 88.6 | Confident | 81.8 | Confident | 26 Ų | 26 | 38.3 Ų | 38.3 | 12% | 0.121 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -59.4 | -44.6 | 179.4 | -178.3 | 61.3 | 2.8 | 0 | 0 | 112.8 | A300 V301 G302 F306 C307 C308 S346 F350 | A300-Q304 WeakPolarHBondContact O-CB 3.41Å; A300-Q304 PolarHBondContact O-N 3.38Å; V301-Q304 PolarHBondContact O-N 3.19Å; G302-Q304 VanDerWaalsContact C-N 3.32Å; G302-Q304 PolarHBondContact O-N 3.33Å; Q304-F306 VanDerWaalsContact C-N 3.3Å; Q304-F306 PolarHBondContact O-N 2.96Å; Q304-C307 PolarHBondContact O-N 2.92Å; Q304-C308 VanDerWaalsContact CD-SG 3.57Å; Q304-C308 PolarHBondContact NE2-SG 3.08Å; Q304-C308 PolarHBondContact O-N 3.45Å; Q304-C308 PolarHBondContact O-SG 3.36Å; Q304-S346 PolarHBondContact NE2-OG 3.29Å; Q304-F350 HydrophobicContact CB-CD1 4.47Å; Q304-F350 HydrophobicContact CB-CD2 4.16Å; Q304-F350 HydrophobicContact CB-CE1 4.08Å; Q304-F350 HydrophobicContact CB-CE2 3.76Å; Q304-F350 HydrophobicContact CB-CZ 3.71Å; Q304-F350 HydrophobicContact CG-CD2 3.74Å; Q304-F350 HydrophobicContact CG-CE2 3.39Å; Q304-F350 HydrophobicContact CG-CG 4.5Å; Q304-F350 HydrophobicContact CG-CZ 3.87Å |
| 305 | F | 87.4 | Confident | 83.1 | Confident | 10 Ų | 10 | 36.6 Ų | 36.6 | 4% | 0.044 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -58.1 | -45.8 | 176.9 | 178.6 | -94.9 | 0 | 0 | 0 | 111.1 | I129 F224 P227 M228 I231 G302 G303 W309 | I129-F305 HydrophobicContact CB-CE2 4.36Å; I129-F305 HydrophobicContact CD1-CE2 4.09Å; I129-F305 HydrophobicContact CG1-CE2 3.9Å; I129-F305 HydrophobicContact CG2-CE2 3.73Å; I129-F305 HydrophobicContact CG2-CZ 4.12Å; F224-F305 HydrophobicContact CD2-CE1 4.06Å; F224-F305 HydrophobicContact CD2-CZ 4.44Å; F224-F305 HydrophobicContact CE2-CE1 4.23Å; P227-F305 HydrophobicContact CB-CE1 4.4Å; P227-F305 HydrophobicContact CB-CE2 4.46Å; P227-F305 HydrophobicContact CB-CZ 3.84Å; M228-F305 HydrophobicContact CB-CE1 4.18Å; I231-F305 HydrophobicContact CD1-CB 4.27Å; I231-F305 HydrophobicContact CD1-CD1 3.98Å; I231-F305 HydrophobicContact CD1-CD2 4.13Å; I231-F305 HydrophobicContact CD1-CE1 4.4Å; I231-F305 HydrophobicContact CD1-CG 3.84Å; G302-F305 PolarHBondContact O-N 3.33Å; G303-F305 VanDerWaalsContact C-N 3.35Å; G303-F305 PolarHBondContact O-N 3.41Å; F305-W309 AromaticContact CD2-CD1 3.49Å; F305-W309 VanDerWaalsContact CD2-CD1 3.49Å; F305-W309 HydrophobicContact CD2-CG 4.49Å; F305-W309 AromaticContact CE2-CD1 3.49Å; F305-W309 VanDerWaalsContact CE2-CD1 3.49Å; F305-W309 HydrophobicContact CE2-CG 4.19Å; F305-W309 AromaticContact CE2-NE1 3.96Å; F305-W309 HydrophobicContact CZ-CG 4.47Å; F305-W309 WeakPolarHBondContact O-CB 3.29Å; F305-W309 VanDerWaalsContact O-CD1 3.29Å; F305-W309 PolarHBondContact O-N 3.48Å; F305-W309 VanDerWaalsContact O-N 3.12Å |
| 306 | F | 88.3 | Confident | 83.9 | Confident | 90 Ų | 90 | 35.9 Ų | 35.9 | 40% | 0.395 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -64.3 | -47.2 | 179.4 | -175.5 | -102.5 | 0 | 0 | 0 | 112 | F224 G303 Q304 C308 W309 L310 | F224-F306 HydrophobicContact CZ-CD2 4.07Å; F224-F306 HydrophobicContact CZ-CE2 4.23Å; G303-F306 PolarHBondContact O-N 3.35Å; Q304-F306 VanDerWaalsContact C-N 3.3Å; Q304-F306 PolarHBondContact O-N 2.96Å; F306-C308 VanDerWaalsContact C-N 3.35Å; F306-C308 PolarHBondContact O-N 2.85Å; F306-W309 PolarHBondContact O-N 2.94Å; F306-L310 HydrophobicContact CD1-CD2 4.3Å; F306-L310 HydrophobicContact CD2-CB 4.28Å; F306-L310 HydrophobicContact CD2-CD1 4.49Å; F306-L310 HydrophobicContact CE1-CD2 3.55Å; F306-L310 HydrophobicContact CE2-CB 4.24Å; F306-L310 HydrophobicContact CE2-CD1 3.79Å; F306-L310 HydrophobicContact CE2-CD2 3.82Å; F306-L310 HydrophobicContact CE2-CG 4.15Å; F306-L310 HydrophobicContact CZ-CB 4.43Å; F306-L310 HydrophobicContact CZ-CD1 4.08Å; F306-L310 HydrophobicContact CZ-CD2 3.27Å; F306-L310 HydrophobicContact CZ-CG 4.11Å; F306-L310 WeakPolarHBondContact O-CB 3.3Å; F306-L310 PolarHBondContact O-N 3.41Å |
| 307 | C | 90.2 | Very high | 84.8 | Confident | 79 Ų | 79 | 36.2 Ų | 36.2 | 53% | 0.534 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -63.8 | -36.6 | -178.1 | -68.3 | 0 | 0 | 0 | 0 | 113.2 | G303 Q304 P311 | G303-C307 PolarHBondContact O-N 3.28Å; G303-C307 PolarHBondContact O-SG 3.43Å; Q304-C307 PolarHBondContact O-N 2.92Å; C307-P311 WeakPolarHBondContact O-CD 3.47Å |
| 308 | C | 91.6 | Very high | 85.5 | Confident | 2 Ų | 2 | 40.7 Ų | 40.7 | 1% | 0.014 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -77.8 | -41.4 | 179.9 | -59.3 | 0 | 0 | 0 | 0 | 112.2 | Q304 F306 G340 C343 | Q304-C308 VanDerWaalsContact CD-SG 3.57Å; Q304-C308 PolarHBondContact NE2-SG 3.08Å; Q304-C308 PolarHBondContact O-N 3.45Å; Q304-C308 PolarHBondContact O-SG 3.36Å; F306-C308 VanDerWaalsContact C-N 3.35Å; F306-C308 PolarHBondContact O-N 2.85Å; C308-G340 WeakPolarHBondContact O-CA 3.31Å; C308-G340 PolarHBondContact O-N 3.26Å; C308-C343 HydrophobicContact CB-CB 3.95Å |
| 309 | W | 90.9 | Very high | 86 | Confident | 8 Ų | 8 | 39.9 Ų | 39.9 | 3% | 0.03 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -97 | -31.5 | -167.7 | -69.5 | 108.7 | 0 | 0 | 0 | 114.2 | V125 I129 F224 F305 F306 P311 Y312 F313 C343 | V125-W309 HydrophobicContact CB-CH2 4.07Å; V125-W309 HydrophobicContact CG1-CH2 3.24Å; V125-W309 HydrophobicContact CG1-CZ2 3.68Å; V125-W309 HydrophobicContact CG1-CZ3 3.79Å; V125-W309 HydrophobicContact CG2-CH2 3.63Å; V125-W309 HydrophobicContact CG2-CZ2 4.37Å; V125-W309 HydrophobicContact CG2-CZ3 4.48Å; I129-W309 HydrophobicContact CD1-CD2 4.38Å; I129-W309 HydrophobicContact CD1-CZ2 4.28Å; I129-W309 HydrophobicContact CG1-CZ2 4.46Å; F224-W309 HydrophobicContact CD2-CB 4.11Å; F224-W309 HydrophobicContact CE2-CB 4.3Å; F305-W309 AromaticContact CD2-CD1 3.49Å; F305-W309 VanDerWaalsContact CD2-CD1 3.49Å; F305-W309 HydrophobicContact CD2-CG 4.49Å; F305-W309 AromaticContact CE2-CD1 3.49Å; F305-W309 VanDerWaalsContact CE2-CD1 3.49Å; F305-W309 HydrophobicContact CE2-CG 4.19Å; F305-W309 AromaticContact CE2-NE1 3.96Å; F305-W309 HydrophobicContact CZ-CG 4.47Å; F305-W309 WeakPolarHBondContact O-CB 3.29Å; F305-W309 VanDerWaalsContact O-CD1 3.29Å; F305-W309 PolarHBondContact O-N 3.48Å; F305-W309 VanDerWaalsContact O-N 3.12Å; F306-W309 PolarHBondContact O-N 2.94Å; W309-P311 VanDerWaalsContact C-CD 3.48Å; W309-Y312 HydrophobicContact CE3-CD1 4.47Å; W309-Y312 PolarHBondContact O-N 3.43Å; W309-F313 HydrophobicContact CB-CD2 4.04Å; W309-F313 HydrophobicContact CB-CE2 3.95Å; W309-F313 HydrophobicContact CD2-CE2 4.25Å; W309-F313 AromaticContact CE3-CE2 3.75Å; W309-F313 HydrophobicContact CE3-CE2 3.75Å; W309-F313 HydrophobicContact CE3-CZ 4.42Å; W309-F313 HydrophobicContact CG-CE2 4.37Å; W309-F313 WeakPolarHBondContact O-CD2 3.48Å; W309-F313 PolarHBondContact O-N 2.86Å; W309-F313 VanDerWaalsContact O-N 3.13Å; W309-C343 HydrophobicContact CZ2-CB 4.41Å; W309-C343 WeakPolarHBondContact CZ2-SG 3.39Å |
| 310 | L | 91.5 | Very high | 86.3 | Confident | 54 Ų | 54 | 35.2 Ų | 35.2 | 28% | 0.283 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -55 | -45.7 | -178.9 | 179.7 | 78.1 | 0 | 0 | 0 | 112.9 | F224 F306 Y312 F313 S314 | F224-L310 HydrophobicContact CE1-CD1 3.84Å; F224-L310 HydrophobicContact CE2-CB 4.28Å; F224-L310 HydrophobicContact CE2-CD1 4.5Å; F224-L310 HydrophobicContact CZ-CB 4.06Å; F224-L310 HydrophobicContact CZ-CD1 3.52Å; F224-L310 HydrophobicContact CZ-CG 4.43Å; F306-L310 HydrophobicContact CD1-CD2 4.3Å; F306-L310 HydrophobicContact CD2-CB 4.28Å; F306-L310 HydrophobicContact CD2-CD1 4.49Å; F306-L310 HydrophobicContact CE1-CD2 3.55Å; F306-L310 HydrophobicContact CE2-CB 4.24Å; F306-L310 HydrophobicContact CE2-CD1 3.79Å; F306-L310 HydrophobicContact CE2-CD2 3.82Å; F306-L310 HydrophobicContact CE2-CG 4.15Å; F306-L310 HydrophobicContact CZ-CB 4.43Å; F306-L310 HydrophobicContact CZ-CD1 4.08Å; F306-L310 HydrophobicContact CZ-CD2 3.27Å; F306-L310 HydrophobicContact CZ-CG 4.11Å; F306-L310 WeakPolarHBondContact O-CB 3.3Å; F306-L310 PolarHBondContact O-N 3.41Å; L310-Y312 VanDerWaalsContact C-N 3.32Å; L310-Y312 PolarHBondContact O-N 3.44Å; L310-F313 PolarHBondContact O-N 3.05Å; L310-S314 WeakPolarHBondContact O-CB 3.39Å; L310-S314 PolarHBondContact O-N 2.85Å; L310-S314 PolarHBondContact O-OG 3.35Å |
| 311 | P | 92.8 | Very high | 86.6 | Confident | 43 Ų | 43 | 37.3 Ų | 37.3 | 28% | 0.279 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -60.8 | -42.6 | -178 | -24.4 | 36.8 | 0 | 0 | 0 | 112.2 | C307 W309 F315 V336 I339 | C307-P311 WeakPolarHBondContact O-CD 3.47Å; W309-P311 VanDerWaalsContact C-CD 3.48Å; P311-F315 WeakPolarHBondContact O-CB 3.21Å; P311-F315 PolarHBondContact O-N 3.44Å; P311-V336 HydrophobicContact CB-CG1 4.24Å; P311-I339 HydrophobicContact CG-CG2 4.09Å |
| 312 | Y | 89.1 | Confident | 86.7 | Confident | 30 Ų | 30 | 41 Ų | 41 | 12% | 0.118 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -61.1 | -55.8 | 178.6 | -179.3 | -96 | 0 | 0 | 0 | 111.8 | W309 L310 S314 F315 H316 V336 | W309-Y312 HydrophobicContact CE3-CD1 4.47Å; W309-Y312 PolarHBondContact O-N 3.43Å; L310-Y312 VanDerWaalsContact C-N 3.32Å; L310-Y312 PolarHBondContact O-N 3.44Å; Y312-S314 VanDerWaalsContact C-N 3.32Å; Y312-S314 PolarHBondContact O-N 2.89Å; Y312-F315 PolarHBondContact O-N 3.03Å; Y312-H316 AromaticContact CD1-CD2 3.95Å; Y312-H316 AromaticContact CD2-CD2 3.8Å; Y312-H316 AromaticContact CD2-NE2 3.73Å; Y312-H316 AromaticContact CE1-CD2 3.64Å; Y312-H316 AromaticContact CE2-CD2 3.49Å; Y312-H316 VanDerWaalsContact CE2-CD2 3.49Å; Y312-H316 WeakPolarHBondContact CE2-CD2 3.12Å; Y312-H316 AromaticContact CE2-NE2 3.09Å; Y312-H316 WeakPolarHBondContact CE2-NE2 3.28Å; Y312-H316 AromaticContact CZ-CD2 3.39Å; Y312-H316 AromaticContact CZ-NE2 3.24Å; Y312-H316 PolarHBondContact O-CD2 3.36Å; Y312-H316 VanDerWaalsContact O-CD2 3.25Å; Y312-H316 PolarHBondContact O-N 3.27Å; Y312-H316 VanDerWaalsContact O-N 3.07Å; Y312-H316 PolarHBondContact OH-NE2 3.49Å; Y312-V336 HydrophobicContact CD2-CG2 4.31Å |
| 313 | F | 88.9 | Confident | 86.3 | Confident | 5 Ų | 5 | 42.2 Ų | 42.2 | 2% | 0.022 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -65.3 | -36.1 | -178.9 | -72.5 | -73.7 | 0 | 0 | 0 | 112.5 | F219 T220 F224 W309 L310 L317 | F219-F313 HydrophobicContact CD1-CD1 4.37Å; F219-F313 AromaticContact CD1-CE1 3.76Å; F219-F313 HydrophobicContact CD1-CE1 3.76Å; F219-F313 HydrophobicContact CE1-CD1 4.49Å; F219-F313 AromaticContact CE1-CE1 3.62Å; F219-F313 HydrophobicContact CE1-CE1 3.62Å; F219-F313 HydrophobicContact CE1-CZ 4.36Å; T220-F313 HydrophobicContact CG2-CB 4.34Å; T220-F313 HydrophobicContact CG2-CD1 4.39Å; F224-F313 HydrophobicContact CB-CB 4.35Å; F224-F313 HydrophobicContact CB-CD1 4.04Å; F224-F313 HydrophobicContact CB-CD2 3.49Å; F224-F313 VanDerWaalsContact CB-CD2 3.49Å; F224-F313 HydrophobicContact CB-CE1 4.22Å; F224-F313 HydrophobicContact CB-CE2 3.73Å; F224-F313 HydrophobicContact CB-CG 3.69Å; F224-F313 HydrophobicContact CB-CZ 4.11Å; F224-F313 AromaticContact CD2-CD2 3.69Å; F224-F313 HydrophobicContact CD2-CD2 3.69Å; F224-F313 HydrophobicContact CD2-CE2 4.17Å; F224-F313 HydrophobicContact CD2-CG 4.44Å; F224-F313 HydrophobicContact CG-CB 4.3Å; F224-F313 AromaticContact CG-CD2 3.71Å; F224-F313 HydrophobicContact CG-CD2 3.71Å; F224-F313 HydrophobicContact CG-CE2 4.29Å; F224-F313 HydrophobicContact CG-CG 4.04Å; W309-F313 HydrophobicContact CB-CD2 4.04Å; W309-F313 HydrophobicContact CB-CE2 3.95Å; W309-F313 HydrophobicContact CD2-CE2 4.25Å; W309-F313 AromaticContact CE3-CE2 3.75Å; W309-F313 HydrophobicContact CE3-CE2 3.75Å; W309-F313 HydrophobicContact CE3-CZ 4.42Å; W309-F313 HydrophobicContact CG-CE2 4.37Å; W309-F313 WeakPolarHBondContact O-CD2 3.48Å; W309-F313 PolarHBondContact O-N 2.86Å; W309-F313 VanDerWaalsContact O-N 3.13Å; L310-F313 PolarHBondContact O-N 3.05Å; F313-L317 VanDerWaalsContact O-CB 3.22Å; F313-L317 WeakPolarHBondContact O-CB 3.41Å; F313-L317 PolarHBondContact O-N 3.46Å |
| 314 | S | 89.8 | Confident | 85.4 | Confident | 57 Ų | 57 | 42.4 Ų | 42.4 | 40% | 0.399 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -64.7 | -43.1 | 176.8 | -58 | 0 | 0 | 0 | 0 | 111.5 | L310 Y312 Y318 | L310-S314 WeakPolarHBondContact O-CB 3.39Å; L310-S314 PolarHBondContact O-N 2.85Å; L310-S314 PolarHBondContact O-OG 3.35Å; Y312-S314 VanDerWaalsContact C-N 3.32Å; Y312-S314 PolarHBondContact O-N 2.89Å; S314-Y318 VanDerWaalsContact O-CB 3.23Å; S314-Y318 WeakPolarHBondContact O-CB 3.23Å; S314-Y318 PolarHBondContact O-N 3.28Å |
| 315 | F | 88.8 | Confident | 83.9 | Confident | 18 Ų | 18 | 44.4 Ų | 44.4 | 8% | 0.079 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -62.3 | -49.6 | 177 | 173.3 | -96.3 | 0 | 0 | 0 | 112 | P311 Y312 L317 Y318 S319 L329 L332 E333 V336 | P311-F315 WeakPolarHBondContact O-CB 3.21Å; P311-F315 PolarHBondContact O-N 3.44Å; Y312-F315 PolarHBondContact O-N 3.03Å; F315-L317 PolarHBondContact O-N 2.8Å; F315-Y318 PolarHBondContact O-N 3.23Å; F315-S319 WeakPolarHBondContact O-CB 3.07Å; F315-S319 PolarHBondContact O-N 2.83Å; F315-L329 HydrophobicContact CE2-CB 4.18Å; F315-L329 HydrophobicContact CE2-CD1 4.36Å; F315-L329 HydrophobicContact CZ-CB 4.08Å; F315-L332 HydrophobicContact CD2-CD2 3.9Å; F315-L332 HydrophobicContact CD2-CG 3.98Å; F315-L332 HydrophobicContact CE2-CB 4.14Å; F315-L332 HydrophobicContact CE2-CD2 3.8Å; F315-L332 HydrophobicContact CE2-CG 3.85Å; F315-E333 HydrophobicContact CE1-CB 3.56Å; F315-E333 HydrophobicContact CE1-CG 3.76Å; F315-E333 HydrophobicContact CZ-CB 3.73Å; F315-E333 HydrophobicContact CZ-CG 4.41Å; F315-V336 HydrophobicContact CB-CG1 4.26Å; F315-V336 HydrophobicContact CB-CG2 3.98Å; F315-V336 HydrophobicContact CD1-CG2 3.83Å; F315-V336 HydrophobicContact CG-CG2 3.91Å |
| 316 | H | 83.4 | Confident | 82.5 | Confident | 12 Ų | 12 | 48.2 Ų | 48.2 | 6% | 0.056 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -66.2 | -37.2 | -179.8 | -76.5 | -72.1 | 0 | 0 | 0 | 112.5 | Y312 A320 E333 | Y312-H316 AromaticContact CD1-CD2 3.95Å; Y312-H316 AromaticContact CD2-CD2 3.8Å; Y312-H316 AromaticContact CD2-NE2 3.73Å; Y312-H316 AromaticContact CE1-CD2 3.64Å; Y312-H316 AromaticContact CE2-CD2 3.49Å; Y312-H316 VanDerWaalsContact CE2-CD2 3.49Å; Y312-H316 WeakPolarHBondContact CE2-CD2 3.12Å; Y312-H316 AromaticContact CE2-NE2 3.09Å; Y312-H316 WeakPolarHBondContact CE2-NE2 3.28Å; Y312-H316 AromaticContact CZ-CD2 3.39Å; Y312-H316 AromaticContact CZ-NE2 3.24Å; Y312-H316 PolarHBondContact O-CD2 3.36Å; Y312-H316 VanDerWaalsContact O-CD2 3.25Å; Y312-H316 PolarHBondContact O-N 3.27Å; Y312-H316 VanDerWaalsContact O-N 3.07Å; Y312-H316 PolarHBondContact OH-NE2 3.49Å; H316-A320 VanDerWaalsContact O-CB 3.31Å; H316-A320 WeakPolarHBondContact O-CB 3.4Å; H316-A320 PolarHBondContact O-N 3.46Å; H316-E333 IonicContact CE1-OE1 3.96Å; H316-E333 PolarHBondContact CE1-OE1 3.42Å |
| 317 | L | 86.7 | Confident | 81.1 | Confident | 64 Ų | 64 | 48.2 Ų | 48.2 | 34% | 0.335 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -64.9 | -44.5 | 174.2 | -175 | 63.1 | 0 | 0 | 0 | 111.4 | V217 F313 F315 A320 V321 | V217-L317 HydrophobicContact CG2-CD1 3.99Å; F313-L317 VanDerWaalsContact O-CB 3.22Å; F313-L317 WeakPolarHBondContact O-CB 3.41Å; F313-L317 PolarHBondContact O-N 3.46Å; F315-L317 PolarHBondContact O-N 2.8Å; L317-A320 WeakPolarHBondContact O-CB 3.42Å; L317-A320 PolarHBondContact O-N 2.73Å; L317-V321 WeakPolarHBondContact O-CG2 3.48Å; L317-V321 PolarHBondContact O-N 3.49Å; L317-V321 VanDerWaalsContact O-N 3.13Å |
| 318 | Y | 86.4 | Confident | 79.8 | Confident | 137 Ų | 137 | 49 Ų | 49 | 54% | 0.537 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -61.4 | -47.8 | 176.6 | 176.9 | -93.7 | 0 | 0 | 0 | 112.1 | S314 F315 A320 V321 I322 | S314-Y318 VanDerWaalsContact O-CB 3.23Å; S314-Y318 WeakPolarHBondContact O-CB 3.23Å; S314-Y318 PolarHBondContact O-N 3.28Å; F315-Y318 PolarHBondContact O-N 3.23Å; Y318-A320 VanDerWaalsContact C-N 3.29Å; Y318-A320 PolarHBondContact O-N 2.87Å; Y318-V321 PolarHBondContact O-N 2.96Å; Y318-V321 VanDerWaalsContact O-N 3.17Å; Y318-I322 HydrophobicContact CD1-CD1 4.15Å; Y318-I322 HydrophobicContact CD2-CD1 3.65Å; Y318-I322 HydrophobicContact CE1-CD1 3.63Å; Y318-I322 HydrophobicContact CE2-CD1 3.08Å; Y318-I322 HydrophobicContact CE2-CG1 4.5Å; Y318-I322 HydrophobicContact CG-CD1 4.15Å; Y318-I322 PolarHBondContact O-N 2.92Å; Y318-I322 VanDerWaalsContact OH-CD1 3.29Å; Y318-I322 WeakPolarHBondContact OH-CD1 3.45Å |
| 319 | S | 80.9 | Confident | 78.9 | Confident | 13 Ų | 13 | 50.8 Ų | 50.8 | 9% | 0.091 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -58.6 | -40.8 | 176.2 | 179.5 | 0 | 0 | 0 | 0 | 111.7 | F315 V321 S323 | F315-S319 WeakPolarHBondContact O-CB 3.07Å; F315-S319 PolarHBondContact O-N 2.83Å; S319-V321 VanDerWaalsContact C-N 3.34Å; S319-V321 PolarHBondContact O-N 3.32Å; S319-S323 PolarHBondContact O-N 3.21Å; S319-S323 VanDerWaalsContact O-N 3.12Å |
| 320 | A | 80.5 | Confident | 78.1 | Confident | 3 Ų | 3 | 52.7 Ų | 52.7 | 3% | 0.025 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -63.4 | -37.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | R212 I213 M216 H316 L317 Y318 | R212-A320 HydrophobicContact CG-CB 4.4Å; R212-A320 PolarHBondContact NE-O 3.25Å; R212-A320 PolarHBondContact NH2-O 3.08Å; I213-A320 WeakPolarHBondContact CG1-O 3.35Å; M216-A320 HydrophobicContact CB-CB 3.82Å; M216-A320 HydrophobicContact CG-CB 3.75Å; H316-A320 VanDerWaalsContact O-CB 3.31Å; H316-A320 WeakPolarHBondContact O-CB 3.4Å; H316-A320 PolarHBondContact O-N 3.46Å; L317-A320 WeakPolarHBondContact O-CB 3.42Å; L317-A320 PolarHBondContact O-N 2.73Å; Y318-A320 VanDerWaalsContact C-N 3.29Å; Y318-A320 PolarHBondContact O-N 2.87Å |
| 321 | V | 83.4 | Confident | 77.5 | Confident | 84 Ų | 84 | 58.3 Ų | 58.3 | 51% | 0.509 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -73.3 | -48.1 | -179.8 | 172.7 | 0 | 0 | 0 | 0 | 111.4 | L317 Y318 S319 | L317-V321 WeakPolarHBondContact O-CG2 3.48Å; L317-V321 PolarHBondContact O-N 3.49Å; L317-V321 VanDerWaalsContact O-N 3.13Å; Y318-V321 PolarHBondContact O-N 2.96Å; Y318-V321 VanDerWaalsContact O-N 3.17Å; S319-V321 VanDerWaalsContact C-N 3.34Å; S319-V321 PolarHBondContact O-N 3.32Å |
| 322 | I | 79.9 | Confident | 77.1 | Confident | 80 Ų | 80 | 60.4 Ų | 60.4 | 41% | 0.41 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -84.8 | -13.4 | -170.6 | -70.4 | 161.4 | 0 | 0 | 0 | 113 | Y318 T324 | Y318-I322 HydrophobicContact CD1-CD1 4.15Å; Y318-I322 HydrophobicContact CD2-CD1 3.65Å; Y318-I322 HydrophobicContact CE1-CD1 3.63Å; Y318-I322 HydrophobicContact CE2-CD1 3.08Å; Y318-I322 HydrophobicContact CE2-CG1 4.5Å; Y318-I322 HydrophobicContact CG-CD1 4.15Å; Y318-I322 PolarHBondContact O-N 2.92Å; Y318-I322 VanDerWaalsContact OH-CD1 3.29Å; Y318-I322 WeakPolarHBondContact OH-CD1 3.45Å; I322-T324 HydrophobicContact CB-CG2 4.19Å; I322-T324 HydrophobicContact CG2-CG2 3.48Å; I322-T324 VanDerWaalsContact CG2-CG2 3.48Å; I322-T324 PolarHBondContact O-N 3.46Å |
| 323 | S | 70.9 | Confident | 76.8 | Confident | 40 Ų | 40 | 59.7 Ų | 59.7 | 28% | 0.28 | 35% | 0.35 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 59.2 | 33 | -177.4 | -40.2 | 0 | 0 | 0 | 0 | 112.9 | R209 R212 S319 | R209-S323 PolarHBondContact NE-OG 3.43Å; R212-S323 PolarHBondContact NH2-OG 2.92Å; S319-S323 PolarHBondContact O-N 3.21Å; S319-S323 VanDerWaalsContact O-N 3.12Å |
| 324 | T | 64.5 | Low | 76.6 | Confident | 35 Ų | 35 | 60.4 Ų | 60.4 | 22% | 0.215 | 36% | 0.359 | C | S | . | . | trans | -59.8 | 140 | 178.6 | 41.9 | 0 | 0 | 0 | 0 | 111 | I322 L329 | I322-T324 HydrophobicContact CB-CG2 4.19Å; I322-T324 HydrophobicContact CG2-CG2 3.48Å; I322-T324 VanDerWaalsContact CG2-CG2 3.48Å; I322-T324 PolarHBondContact O-N 3.46Å; T324-L329 HydrophobicContact CG2-CD1 4.12Å; T324-L329 WeakPolarHBondContact OG1-CD1 3.23Å | ||
| 325 | A | 56.9 | Low | 76.5 | Confident | 68 Ų | 68 | 61.7 Ų | 61.7 | 56% | 0.562 | 36% | 0.364 | S | S | * | . | trans | -68.1 | 137.2 | 173.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | A327 S328 | A325-A327 VanDerWaalsContact C-N 3.28Å; A325-A327 PolarHBondContact O-N 2.97Å; A325-S328 PolarHBondContact O-OG 3.26Å | ||
| 326 | P | 56.6 | Low | 76.6 | Confident | 91 Ų | 91 | 61.3 Ų | 61.3 | 59% | 0.591 | 36% | 0.363 | S | S | * | . | G | 310 helix | trans | -63 | -28.5 | -168.7 | 18.6 | -29.6 | 0 | 0 | 0 | 114.3 | S328 L329 T330 | P326-S328 VanDerWaalsContact C-N 3.3Å; P326-S328 PolarHBondContact O-N 3.41Å; P326-L329 PolarHBondContact O-N 3.4Å; P326-T330 VanDerWaalsContact O-CG2 3.23Å; P326-T330 WeakPolarHBondContact O-CG2 3.34Å; P326-T330 PolarHBondContact O-N 3.28Å |
| 327 | A | 59.1 | Low | 76.8 | Confident | 89 Ų | 89 | 61.7 Ų | 61.7 | 74% | 0.736 | 37% | 0.366 | S | S | * | . | G | 310 helix | trans | -64.6 | -24.6 | -172 | 0 | 0 | 0 | 0 | 0 | 115.2 | A325 | A325-A327 VanDerWaalsContact C-N 3.28Å; A325-A327 PolarHBondContact O-N 2.97Å |
| 328 | S | 62.5 | Low | 77.1 | Confident | 96 Ų | 96 | 60 Ų | 60 | 67% | 0.671 | 36% | 0.356 | S | S | * | . | G | 310 helix | trans | -90.5 | -8.7 | -178.3 | 59.1 | 0 | 0 | 0 | 0 | 114.5 | A325 P326 | A325-S328 PolarHBondContact O-OG 3.26Å; P326-S328 VanDerWaalsContact C-N 3.3Å; P326-S328 PolarHBondContact O-N 3.41Å |
| 329 | L | 73.4 | Confident | 77.4 | Confident | 40 Ų | 40 | 56.6 Ų | 56.6 | 21% | 0.209 | 35% | 0.346 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -127.1 | 4.8 | -172.4 | -67.1 | 173 | 0 | 0 | 0 | 114.5 | F315 T324 P326 Q331 L332 E333 | F315-L329 HydrophobicContact CE2-CB 4.18Å; F315-L329 HydrophobicContact CE2-CD1 4.36Å; F315-L329 HydrophobicContact CZ-CB 4.08Å; T324-L329 HydrophobicContact CG2-CD1 4.12Å; T324-L329 WeakPolarHBondContact OG1-CD1 3.23Å; P326-L329 PolarHBondContact O-N 3.4Å; L329-Q331 VanDerWaalsContact C-N 3.33Å; L329-Q331 PolarHBondContact O-N 3.33Å; L329-L332 HydrophobicContact CD2-CD2 4.18Å; L329-L332 PolarHBondContact O-N 2.66Å; L329-L332 VanDerWaalsContact O-N 3.08Å; L329-E333 PolarHBondContact O-N 3.21Å |
| 330 | T | 74.4 | Confident | 78 | Confident | 48 Ų | 48 | 56 Ų | 56 | 29% | 0.294 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -55.9 | -43.3 | -179.3 | 52.5 | 0 | 0 | 0 | 0 | 113.1 | P326 L332 E333 G334 | P326-T330 VanDerWaalsContact O-CG2 3.23Å; P326-T330 WeakPolarHBondContact O-CG2 3.34Å; P326-T330 PolarHBondContact O-N 3.28Å; T330-L332 VanDerWaalsContact C-N 3.32Å; T330-L332 PolarHBondContact O-N 2.84Å; T330-E333 PolarHBondContact O-N 2.91Å; T330-G334 PolarHBondContact O-N 3.47Å |
| 331 | Q | 78.4 | Confident | 78.6 | Confident | 171 Ų | 171 | 56.2 Ų | 56.2 | 80% | 0.799 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -63.4 | -38.8 | 177.3 | -67.2 | -165.9 | -5.3 | 0 | 0 | 112.3 | L329 G334 V335 | L329-Q331 VanDerWaalsContact C-N 3.33Å; L329-Q331 PolarHBondContact O-N 3.33Å; Q331-G334 PolarHBondContact O-N 2.52Å; Q331-V335 WeakPolarHBondContact O-CG2 3.46Å; Q331-V335 PolarHBondContact O-N 2.97Å; Q331-V335 VanDerWaalsContact O-N 3.1Å |
| 332 | L | 83.9 | Confident | 79.1 | Confident | 87 Ų | 87 | 56.3 Ų | 56.3 | 46% | 0.455 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -69.8 | -39.2 | 178.4 | -175.2 | 58.9 | 0 | 0 | 0 | 111.2 | F315 L329 T330 V335 V336 | F315-L332 HydrophobicContact CD2-CD2 3.9Å; F315-L332 HydrophobicContact CD2-CG 3.98Å; F315-L332 HydrophobicContact CE2-CB 4.14Å; F315-L332 HydrophobicContact CE2-CD2 3.8Å; F315-L332 HydrophobicContact CE2-CG 3.85Å; L329-L332 HydrophobicContact CD2-CD2 4.18Å; L329-L332 PolarHBondContact O-N 2.66Å; L329-L332 VanDerWaalsContact O-N 3.08Å; T330-L332 VanDerWaalsContact C-N 3.32Å; T330-L332 PolarHBondContact O-N 2.84Å; L332-V335 PolarHBondContact O-N 3.04Å; L332-V336 HydrophobicContact CD1-CG1 4.43Å; L332-V336 WeakPolarHBondContact O-CG2 3.41Å; L332-V336 PolarHBondContact O-N 3.41Å |
| 333 | E | 83.2 | Confident | 79.8 | Confident | 15 Ų | 15 | 52.7 Ų | 52.7 | 7% | 0.07 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -58.9 | -45.8 | 173.9 | -175.6 | 171 | -168.9 | 0 | 0 | 111.9 | H200 S202 F315 H316 L329 T330 V335 V336 T337 | H200-E333 IonicContact CD2-OE2 3.36Å; S202-E333 WeakPolarHBondContact CB-OE1 3.34Å; S202-E333 VanDerWaalsContact OG-CD 3.27Å; S202-E333 PolarHBondContact OG-OE1 2.97Å; S202-E333 PolarHBondContact OG-OE2 2.87Å; F315-E333 HydrophobicContact CE1-CB 3.56Å; F315-E333 HydrophobicContact CE1-CG 3.76Å; F315-E333 HydrophobicContact CZ-CB 3.73Å; F315-E333 HydrophobicContact CZ-CG 4.41Å; H316-E333 IonicContact CE1-OE1 3.96Å; H316-E333 PolarHBondContact CE1-OE1 3.42Å; L329-E333 PolarHBondContact O-N 3.21Å; T330-E333 PolarHBondContact O-N 2.91Å; E333-V335 PolarHBondContact O-N 3.49Å; E333-V336 VanDerWaalsContact O-CG2 3.25Å; E333-V336 WeakPolarHBondContact O-CG2 3.38Å; E333-V336 PolarHBondContact O-N 2.99Å; E333-T337 WeakPolarHBondContact O-CB 3.32Å; E333-T337 PolarHBondContact O-N 3.35Å; E333-T337 PolarHBondContact O-OG1 3.25Å |
| 334 | G | 84.3 | Confident | 80.9 | Confident | 20 Ų | 20 | 50.8 Ų | 50.8 | 21% | 0.206 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -57.2 | -50.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | T330 Q331 V336 T337 W338 | T330-G334 PolarHBondContact O-N 3.47Å; Q331-G334 PolarHBondContact O-N 2.52Å; G334-V336 PolarHBondContact O-N 3.36Å; G334-T337 PolarHBondContact O-N 2.75Å; G334-W338 PolarHBondContact O-N 3.44Å |
| 335 | V | 88.2 | Confident | 82.3 | Confident | 84 Ų | 84 | 50 Ų | 50 | 51% | 0.509 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -58 | -48.6 | 179.8 | 171.8 | 0 | 0 | 0 | 0 | 111.9 | Q331 L332 E333 T337 W338 I339 | Q331-V335 WeakPolarHBondContact O-CG2 3.46Å; Q331-V335 PolarHBondContact O-N 2.97Å; Q331-V335 VanDerWaalsContact O-N 3.1Å; L332-V335 PolarHBondContact O-N 3.04Å; E333-V335 PolarHBondContact O-N 3.49Å; V335-T337 VanDerWaalsContact C-N 3.31Å; V335-T337 PolarHBondContact O-N 3.49Å; V335-W338 PolarHBondContact O-N 3.13Å; V335-I339 HydrophobicContact CG1-CD1 3.88Å; V335-I339 VanDerWaalsContact O-CG1 3.29Å; V335-I339 WeakPolarHBondContact O-CG1 3.07Å; V335-I339 PolarHBondContact O-N 2.84Å |
| 336 | V | 90.6 | Very high | 84.1 | Confident | 11 Ų | 11 | 47.1 Ų | 47.1 | 7% | 0.067 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -68.1 | -31.3 | -179.7 | -60.9 | 0 | 0 | 0 | 0 | 112.7 | P311 Y312 F315 L332 E333 G334 I339 G340 | P311-V336 HydrophobicContact CB-CG1 4.24Å; Y312-V336 HydrophobicContact CD2-CG2 4.31Å; F315-V336 HydrophobicContact CB-CG1 4.26Å; F315-V336 HydrophobicContact CB-CG2 3.98Å; F315-V336 HydrophobicContact CD1-CG2 3.83Å; F315-V336 HydrophobicContact CG-CG2 3.91Å; L332-V336 HydrophobicContact CD1-CG1 4.43Å; L332-V336 WeakPolarHBondContact O-CG2 3.41Å; L332-V336 PolarHBondContact O-N 3.41Å; E333-V336 VanDerWaalsContact O-CG2 3.25Å; E333-V336 WeakPolarHBondContact O-CG2 3.38Å; E333-V336 PolarHBondContact O-N 2.99Å; G334-V336 PolarHBondContact O-N 3.36Å; V336-I339 PolarHBondContact O-N 3.07Å; V336-G340 PolarHBondContact O-N 3.4Å |
| 337 | T | 89 | Confident | 85.8 | Confident | 20 Ų | 20 | 43 Ų | 43 | 12% | 0.123 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -65.6 | -45 | 175 | -59.1 | 0 | 0 | 0 | 0 | 111 | E333 G334 V335 G340 Y341 | E333-T337 WeakPolarHBondContact O-CB 3.32Å; E333-T337 PolarHBondContact O-N 3.35Å; E333-T337 PolarHBondContact O-OG1 3.25Å; G334-T337 PolarHBondContact O-N 2.75Å; V335-T337 VanDerWaalsContact C-N 3.31Å; V335-T337 PolarHBondContact O-N 3.49Å; T337-G340 CarbonylContact O-C 3.55Å; T337-G340 WeakPolarHBondContact O-CA 3.37Å; T337-G340 PolarHBondContact O-N 3.41Å; T337-Y341 HydrophobicContact CG2-CD2 4.38Å; T337-Y341 HydrophobicContact CG2-CE1 4.24Å; T337-Y341 HydrophobicContact CG2-CE2 3.87Å; T337-Y341 PolarHBondContact O-N 2.95Å |
| 338 | W | 92.3 | Very high | 87.4 | Confident | 28 Ų | 28 | 39.1 Ų | 39.1 | 11% | 0.106 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -70.1 | -31.9 | 177.6 | -80.3 | 94.2 | 0 | 0 | 0 | 113.3 | M53 M56 M98 M102 G334 V335 G340 Y341 F342 | M53-W338 HydrophobicContact CB-CD2 4.33Å; M53-W338 HydrophobicContact CB-CE3 4.07Å; M53-W338 HydrophobicContact CB-CH2 3.48Å; M53-W338 VanDerWaalsContact CB-CH2 3.48Å; M53-W338 HydrophobicContact CB-CZ2 3.81Å; M53-W338 HydrophobicContact CB-CZ3 3.6Å; M53-W338 HydrophobicContact CG-CD2 3.52Å; M53-W338 VanDerWaalsContact CG-CE2 3.42Å; M53-W338 HydrophobicContact CG-CE3 3.69Å; M53-W338 HydrophobicContact CG-CG 4.17Å; M53-W338 HydrophobicContact CG-CH2 3.69Å; M53-W338 HydrophobicContact CG-CZ2 3.55Å; M53-W338 HydrophobicContact CG-CZ3 3.74Å; M53-W338 HydrophobicContact SD-CD2 3.9Å; M53-W338 HydrophobicContact SD-CG 4.39Å; M53-W338 HydrophobicContact SD-CH2 4Å; M53-W338 HydrophobicContact SD-CZ2 3.27Å; M53-W338 WeakPolarHBondContact SD-CZ2 3.21Å; M53-W338 PolarHBondContact SD-NE1 2.67Å; M56-W338 HydrophobicContact CE-CB 4.45Å; M56-W338 HydrophobicContact CE-CD2 4.37Å; M56-W338 HydrophobicContact CE-CE3 3.55Å; M56-W338 HydrophobicContact CE-CZ3 4.17Å; M98-W338 HydrophobicContact CB-CH2 4.3Å; M98-W338 HydrophobicContact CE-CE3 4.35Å; M98-W338 HydrophobicContact CE-CH2 4.36Å; M98-W338 HydrophobicContact CE-CZ3 3.61Å; M102-W338 HydrophobicContact CB-CZ2 4.37Å; M102-W338 HydrophobicContact CG-CH2 3.42Å; M102-W338 VanDerWaalsContact CG-CH2 3.42Å; M102-W338 HydrophobicContact CG-CZ2 3.36Å; M102-W338 HydrophobicContact SD-CH2 4.16Å; G334-W338 PolarHBondContact O-N 3.44Å; V335-W338 PolarHBondContact O-N 3.13Å; W338-G340 VanDerWaalsContact C-N 3.25Å; W338-G340 PolarHBondContact O-N 3.49Å; W338-Y341 HydrophobicContact CD2-CD2 4.34Å; W338-Y341 HydrophobicContact CE3-CD2 4.42Å; W338-Y341 PolarHBondContact O-N 3.28Å; W338-F342 PolarHBondContact O-N 3.38Å |
| 339 | I | 93.4 | Very high | 88.7 | Confident | 66 Ų | 66 | 39.8 Ų | 39.8 | 34% | 0.338 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -61.5 | -37.3 | 167.2 | -68.3 | 166.6 | 0 | 0 | 0 | 110.7 | P311 V335 V336 F342 | P311-I339 HydrophobicContact CG-CG2 4.09Å; V335-I339 HydrophobicContact CG1-CD1 3.88Å; V335-I339 VanDerWaalsContact O-CG1 3.29Å; V335-I339 WeakPolarHBondContact O-CG1 3.07Å; V335-I339 PolarHBondContact O-N 2.84Å; V336-I339 PolarHBondContact O-N 3.07Å; I339-F342 WeakPolarHBondContact O-CB 3.48Å |
| 340 | G | 92.1 | Very high | 89.4 | Confident | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -61.3 | -50.2 | 170 | 0 | 0 | 0 | 0 | 0 | 112.2 | C308 V336 T337 W338 F342 C343 | C308-G340 WeakPolarHBondContact O-CA 3.31Å; C308-G340 PolarHBondContact O-N 3.26Å; V336-G340 PolarHBondContact O-N 3.4Å; T337-G340 CarbonylContact O-C 3.55Å; T337-G340 WeakPolarHBondContact O-CA 3.37Å; T337-G340 PolarHBondContact O-N 3.41Å; W338-G340 VanDerWaalsContact C-N 3.25Å; W338-G340 PolarHBondContact O-N 3.49Å; G340-F342 PolarHBondContact O-N 2.91Å; G340-C343 VanDerWaalsContact O-CB 3.29Å; G340-C343 WeakPolarHBondContact O-CB 3.42Å; G340-C343 PolarHBondContact O-N 3.4Å; G340-C343 PolarHBondContact O-SG 2.72Å |
| 341 | Y | 93.5 | Very high | 90 | Very high | 8 Ų | 8 | 37.1 Ų | 37.1 | 3% | 0.031 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -65.4 | -23.4 | -179.6 | -67.2 | -12.2 | 0 | 0 | 0 | 114.3 | V97 M98 Y117 S121 T337 W338 C343 F344 | V97-Y341 HydrophobicContact CG1-CE1 4.02Å; V97-Y341 HydrophobicContact CG1-CE2 4.05Å; V97-Y341 WeakPolarHBondContact CG1-OH 3.26Å; M98-Y341 HydrophobicContact CG-CD2 4.18Å; M98-Y341 HydrophobicContact CG-CG 4.47Å; Y117-Y341 PolarHBondContact OH-OH 3.31Å; Y117-Y341 VanDerWaalsContact OH-OH 3.1Å; S121-Y341 PolarHBondContact OG-OH 2.89Å; T337-Y341 HydrophobicContact CG2-CD2 4.38Å; T337-Y341 HydrophobicContact CG2-CE1 4.24Å; T337-Y341 HydrophobicContact CG2-CE2 3.87Å; T337-Y341 PolarHBondContact O-N 2.95Å; W338-Y341 HydrophobicContact CD2-CD2 4.34Å; W338-Y341 HydrophobicContact CE3-CD2 4.42Å; W338-Y341 PolarHBondContact O-N 3.28Å; Y341-C343 PolarHBondContact O-N 3.5Å; Y341-F344 HydrophobicContact CD1-CD2 4.22Å; Y341-F344 AromaticContact CD1-CE2 3.63Å; Y341-F344 HydrophobicContact CD1-CE2 3.63Å; Y341-F344 HydrophobicContact CE1-CE2 4.17Å; Y341-F344 HydrophobicContact CG-CD2 4.44Å; Y341-F344 HydrophobicContact CG-CE2 4.26Å; Y341-F344 WeakPolarHBondContact O-CB 3.3Å; Y341-F344 WeakPolarHBondContact O-CD2 3.25Å; Y341-F344 PolarHBondContact O-N 3.41Å |
| 342 | F | 94.2 | Very high | 90.3 | Very high | 86 Ų | 86 | 29 Ų | 29 | 38% | 0.377 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -54.7 | -23.1 | 170.3 | -179.6 | -110.8 | 0 | 0 | 0 | 112.7 | M56 W338 I339 G340 F344 T345 S346 | M56-F342 HydrophobicContact SD-CD2 4.2Å; W338-F342 PolarHBondContact O-N 3.38Å; I339-F342 WeakPolarHBondContact O-CB 3.48Å; G340-F342 PolarHBondContact O-N 2.91Å; F342-F344 VanDerWaalsContact C-N 3.29Å; F342-F344 PolarHBondContact O-N 3.07Å; F342-T345 PolarHBondContact O-N 3.25Å; F342-S346 WeakPolarHBondContact O-CB 3.31Å; F342-S346 PolarHBondContact O-N 2.93Å; F342-S346 PolarHBondContact O-OG 3.03Å |
| 343 | C | 93.7 | Very high | 90.2 | Very high | 4 Ų | 4 | 26.7 Ų | 26.7 | 3% | 0.027 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -55.3 | -44.6 | 172.8 | 76.9 | 0 | 0 | 0 | 0 | 111.9 | C308 W309 G340 Y341 T345 S346 N347 | C308-C343 HydrophobicContact CB-CB 3.95Å; W309-C343 HydrophobicContact CZ2-CB 4.41Å; W309-C343 WeakPolarHBondContact CZ2-SG 3.39Å; G340-C343 VanDerWaalsContact O-CB 3.29Å; G340-C343 WeakPolarHBondContact O-CB 3.42Å; G340-C343 PolarHBondContact O-N 3.4Å; G340-C343 PolarHBondContact O-SG 2.72Å; Y341-C343 PolarHBondContact O-N 3.5Å; C343-T345 VanDerWaalsContact C-N 3.33Å; C343-T345 PolarHBondContact O-N 3.46Å; C343-S346 WeakPolarHBondContact CA-OG 3.24Å; C343-S346 PolarHBondContact O-N 3.27Å; C343-S346 VanDerWaalsContact O-N 3.16Å; C343-S346 PolarHBondContact O-OG 2.99Å; C343-N347 PolarHBondContact O-N 3.19Å; C343-N347 PolarHBondContact O-ND2 3.49Å; C343-N347 PolarHBondContact O-OD1 3.32Å |
| 344 | F | 94.4 | Very high | 90 | Very high | 0 Ų | 0 | 28.2 Ų | 28.2 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -64.5 | -37.1 | -179.1 | -54.4 | -45.1 | 0 | 0 | 0 | 112.2 | N64 D90 A93 M98 V125 A128 Y341 F342 | N64-F344 PolarHBondContact ND2-O 3.24Å; D90-F344 HydrophobicContact CB-CB 4.27Å; D90-F344 HydrophobicContact CB-CD1 4.39Å; D90-F344 VanDerWaalsContact OD1-CD1 3.28Å; D90-F344 WeakPolarHBondContact OD1-CD1 3.14Å; A93-F344 HydrophobicContact CB-CD1 4.29Å; A93-F344 HydrophobicContact CB-CD2 3.87Å; A93-F344 HydrophobicContact CB-CE1 4.11Å; A93-F344 HydrophobicContact CB-CE2 3.67Å; A93-F344 HydrophobicContact CB-CG 4.16Å; A93-F344 HydrophobicContact CB-CZ 3.78Å; M98-F344 HydrophobicContact SD-CD2 4.35Å; V125-F344 HydrophobicContact CG2-CE2 4.45Å; V125-F344 HydrophobicContact CG2-CZ 3.69Å; A128-F344 HydrophobicContact CB-CE1 3.93Å; Y341-F344 HydrophobicContact CD1-CD2 4.22Å; Y341-F344 AromaticContact CD1-CE2 3.63Å; Y341-F344 HydrophobicContact CD1-CE2 3.63Å; Y341-F344 HydrophobicContact CE1-CE2 4.17Å; Y341-F344 HydrophobicContact CG-CD2 4.44Å; Y341-F344 HydrophobicContact CG-CE2 4.26Å; Y341-F344 WeakPolarHBondContact O-CB 3.3Å; Y341-F344 WeakPolarHBondContact O-CD2 3.25Å; Y341-F344 PolarHBondContact O-N 3.41Å; F342-F344 VanDerWaalsContact C-N 3.29Å; F342-F344 PolarHBondContact O-N 3.07Å |
| 345 | T | 95 | Very high | 89.8 | Confident | 18 Ų | 18 | 28.6 Ų | 28.6 | 11% | 0.11 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -69.7 | -38 | 175.7 | -50 | 0 | 0 | 0 | 0 | 111.9 | M56 L59 F342 C343 | M56-T345 PolarHBondContact O-OG1 3.23Å; L59-T345 HydrophobicContact CB-CG2 3.57Å; L59-T345 HydrophobicContact CD1-CG2 4.46Å; F342-T345 PolarHBondContact O-N 3.25Å; C343-T345 VanDerWaalsContact C-N 3.33Å; C343-T345 PolarHBondContact O-N 3.46Å |
| 346 | S | 93.7 | Very high | 89.4 | Confident | 8 Ų | 8 | 32.3 Ų | 32.3 | 6% | 0.056 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -82.3 | -25.9 | -173.7 | 72.9 | 0 | 0 | 0 | 0 | 114.3 | Q304 F342 C343 F349 F350 | Q304-S346 PolarHBondContact NE2-OG 3.29Å; F342-S346 WeakPolarHBondContact O-CB 3.31Å; F342-S346 PolarHBondContact O-N 2.93Å; F342-S346 PolarHBondContact O-OG 3.03Å; C343-S346 WeakPolarHBondContact CA-OG 3.24Å; C343-S346 PolarHBondContact O-N 3.27Å; C343-S346 VanDerWaalsContact O-N 3.16Å; C343-S346 PolarHBondContact O-OG 2.99Å; S346-F349 WeakPolarHBondContact O-CA 3.16Å; S346-F349 VanDerWaalsContact O-CB 3.27Å; S346-F349 WeakPolarHBondContact O-CB 3.34Å; S346-F349 PolarHBondContact O-N 3.24Å; S346-F350 WeakPolarHBondContact O-CD2 3.42Å; S346-F350 PolarHBondContact O-N 2.98Å |
| 347 | N | 92.3 | Very high | 89 | Confident | 4 Ų | 4 | 35.2 Ų | 35.2 | 2% | 0.021 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -55.7 | -43 | -174 | -76.8 | -17.6 | 0 | 0 | 0 | 113.7 | L86 D90 C343 F349 F350 Y351 | L86-N347 HydrophobicContact CD2-CB 4.13Å; L86-N347 HydrophobicContact CG-CB 4.48Å; D90-N347 PolarHBondContact OD1-ND2 2.87Å; D90-N347 WeakPolarHBondContact OD2-CB 3.22Å; D90-N347 PolarHBondContact OD2-ND2 2.89Å; C343-N347 PolarHBondContact O-N 3.19Å; C343-N347 PolarHBondContact O-ND2 3.49Å; C343-N347 PolarHBondContact O-OD1 3.32Å; N347-F349 PolarHBondContact O-N 2.87Å; N347-F350 PolarHBondContact O-N 3.49Å; N347-Y351 HydrophobicContact CB-CD2 4.14Å; N347-Y351 WeakPolarHBondContact O-CD2 3.25Å; N347-Y351 PolarHBondContact O-N 3.41Å |
| 348 | P | 92.3 | Very high | 88.5 | Confident | 7 Ų | 7 | 34.2 Ų | 34.2 | 5% | 0.045 | 16% | 0.159 | C | C | . | . | I | π-helix | trans | -53.6 | -36.1 | 171.9 | -30.7 | 36.6 | 0 | 0 | 0 | 114.3 | G63 N64 V67 G352 C353 | G63-P348 VanDerWaalsContact C-CG 3.49Å; N64-P348 HydrophobicContact CB-CG 4.29Å; N64-P348 VanDerWaalsContact CG-CG 3.48Å; N64-P348 VanDerWaalsContact OD1-CG 3.25Å; N64-P348 WeakPolarHBondContact OD1-CG 3.33Å; V67-P348 HydrophobicContact CG2-CB 3.96Å; P348-G352 CarbonylContact O-C 3.19Å; P348-G352 WeakPolarHBondContact O-CA 3.29Å; P348-G352 PolarHBondContact O-N 2.75Å; P348-C353 PolarHBondContact O-N 2.94Å |
| 349 | F | 89.9 | Confident | 88.3 | Confident | 111 Ų | 111 | 39 Ų | 39 | 49% | 0.487 | 18% | 0.177 | S | C | . | . | I | π-helix | trans | -68.5 | -50.3 | 177.6 | 179.3 | -99.8 | 0 | 0 | 0 | 111 | S346 N347 C353 L354 | S346-F349 WeakPolarHBondContact O-CA 3.16Å; S346-F349 VanDerWaalsContact O-CB 3.27Å; S346-F349 WeakPolarHBondContact O-CB 3.34Å; S346-F349 PolarHBondContact O-N 3.24Å; N347-F349 PolarHBondContact O-N 2.87Å; F349-C353 HydrophobicContact CD2-CB 4.11Å; F349-C353 WeakPolarHBondContact O-CB 3.38Å; F349-C353 PolarHBondContact O-N 2.84Å; F349-C353 VanDerWaalsContact O-N 3.17Å; F349-L354 HydrophobicContact CE1-CD1 4.26Å; F349-L354 HydrophobicContact CE1-CD2 4.31Å; F349-L354 HydrophobicContact CE1-CG 4.3Å; F349-L354 HydrophobicContact CZ-CD2 4.25Å; F349-L354 WeakPolarHBondContact O-CG 3.25Å; F349-L354 PolarHBondContact O-N 2.87Å |
| 350 | F | 88.6 | Confident | 87.9 | Confident | 23 Ų | 23 | 40.8 Ų | 40.8 | 10% | 0.101 | 18% | 0.184 | C | C | . | . | I | π-helix | trans | -72.6 | -40.5 | -175.6 | -75.7 | -79.3 | 0 | 0 | 0 | 114.1 | A300 V301 Q304 S346 N347 L354 | A300-F350 HydrophobicContact CB-CD1 4.44Å; A300-F350 HydrophobicContact CB-CE1 3.82Å; A300-F350 VanDerWaalsContact O-CE1 3.3Å; A300-F350 WeakPolarHBondContact O-CE1 3.12Å; V301-F350 HydrophobicContact CB-CD1 4.49Å; V301-F350 HydrophobicContact CG2-CB 4.16Å; V301-F350 HydrophobicContact CG2-CD1 3.93Å; V301-F350 HydrophobicContact CG2-CG 4.49Å; Q304-F350 HydrophobicContact CB-CD1 4.47Å; Q304-F350 HydrophobicContact CB-CD2 4.16Å; Q304-F350 HydrophobicContact CB-CE1 4.08Å; Q304-F350 HydrophobicContact CB-CE2 3.76Å; Q304-F350 HydrophobicContact CB-CZ 3.71Å; Q304-F350 HydrophobicContact CG-CD2 3.74Å; Q304-F350 HydrophobicContact CG-CE2 3.39Å; Q304-F350 HydrophobicContact CG-CG 4.5Å; Q304-F350 HydrophobicContact CG-CZ 3.87Å; S346-F350 WeakPolarHBondContact O-CD2 3.42Å; S346-F350 PolarHBondContact O-N 2.98Å; N347-F350 PolarHBondContact O-N 3.49Å; F350-L354 HydrophobicContact CD1-CD1 3.8Å; F350-L354 HydrophobicContact CE1-CD1 4.38Å |
| 351 | Y | 86.5 | Confident | 87.7 | Confident | 8 Ų | 8 | 42.5 Ų | 42.5 | 3% | 0.031 | 19% | 0.192 | C | C | . | . | I | π-helix | trans | -99.1 | -24.9 | -174.8 | -61.3 | -78.8 | 0 | 0 | 0 | 113 | L86 I132 I135 V301 N347 N355 | L86-Y351 HydrophobicContact CD2-CD2 3.53Å; L86-Y351 HydrophobicContact CD2-CE2 3.85Å; L86-Y351 HydrophobicContact CD2-CG 3.97Å; I132-Y351 HydrophobicContact CG1-CE2 4.18Å; I132-Y351 WeakPolarHBondContact CG2-OH 3.49Å; I135-Y351 HydrophobicContact CB-CE1 4.4Å; I135-Y351 HydrophobicContact CD1-CD1 4.08Å; I135-Y351 HydrophobicContact CD1-CE1 4.25Å; I135-Y351 HydrophobicContact CG2-CD1 3.84Å; I135-Y351 HydrophobicContact CG2-CE1 3.78Å; V301-Y351 HydrophobicContact CG1-CE1 3.68Å; V301-Y351 HydrophobicContact CG1-CE2 4.47Å; V301-Y351 WeakPolarHBondContact CG1-OH 3.19Å; N347-Y351 HydrophobicContact CB-CD2 4.14Å; N347-Y351 WeakPolarHBondContact O-CD2 3.25Å; N347-Y351 PolarHBondContact O-N 3.41Å; Y351-N355 WeakPolarHBondContact O-CB 3.09Å |
| 352 | G | 85.2 | Confident | 87.2 | Confident | 0 Ų | 0 | 43.2 Ų | 43.2 | 0% | 0 | 20% | 0.196 | C | C | . | . | I | π-helix | trans | -95.5 | -71.6 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | P348 L354 N355 | P348-G352 CarbonylContact O-C 3.19Å; P348-G352 WeakPolarHBondContact O-CA 3.29Å; P348-G352 PolarHBondContact O-N 2.75Å; G352-L354 PolarHBondContact O-N 3.31Å; G352-N355 WeakPolarHBondContact O-CB 3.27Å; G352-N355 PolarHBondContact O-N 3Å |
| 353 | C | 81.1 | Confident | 86.7 | Confident | 39 Ų | 39 | 41 Ų | 41 | 26% | 0.264 | 20% | 0.198 | S | C | . | . | I | π-helix | trans | -65.9 | -33.1 | -170.1 | -61.9 | 0 | 0 | 0 | 0 | 114.5 | P348 F349 N355 R359 | P348-C353 PolarHBondContact O-N 2.94Å; F349-C353 HydrophobicContact CD2-CB 4.11Å; F349-C353 WeakPolarHBondContact O-CB 3.38Å; F349-C353 PolarHBondContact O-N 2.84Å; F349-C353 VanDerWaalsContact O-N 3.17Å; C353-N355 VanDerWaalsContact C-N 3.28Å; C353-R359 WeakPolarHBondContact O-CB 3.31Å; C353-R359 VanDerWaalsContact O-CD 3.27Å; C353-R359 WeakPolarHBondContact O-CD 3.06Å |
| 354 | L | 79.8 | Confident | 86.3 | Confident | 47 Ų | 47 | 47 Ų | 47 | 25% | 0.246 | 22% | 0.22 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -77.2 | -16.2 | 174.6 | -63.3 | -178.9 | 0 | 0 | 0 | 112.7 | V297 F349 F350 G352 R356 | V297-L354 HydrophobicContact CG1-CB 3.88Å; V297-L354 HydrophobicContact CG1-CD1 3.96Å; V297-L354 HydrophobicContact CG2-CB 4.35Å; V297-L354 HydrophobicContact CG2-CD1 4.32Å; V297-L354 HydrophobicContact CG2-CD2 4.38Å; F349-L354 HydrophobicContact CE1-CD1 4.26Å; F349-L354 HydrophobicContact CE1-CD2 4.31Å; F349-L354 HydrophobicContact CE1-CG 4.3Å; F349-L354 HydrophobicContact CZ-CD2 4.25Å; F349-L354 WeakPolarHBondContact O-CG 3.25Å; F349-L354 PolarHBondContact O-N 2.87Å; F350-L354 HydrophobicContact CD1-CD1 3.8Å; F350-L354 HydrophobicContact CE1-CD1 4.38Å; G352-L354 PolarHBondContact O-N 3.31Å; L354-R356 PolarHBondContact O-N 3.28Å |
| 355 | N | 79.9 | Confident | 85.8 | Confident | 29 Ų | 29 | 49 Ų | 49 | 16% | 0.155 | 23% | 0.229 | C | C | . | . | S | Bend | trans | -81.2 | 111.6 | 173.4 | -173 | -22.3 | 0 | 0 | 0 | 109.6 | F80 Y351 G352 C353 Q357 I358 R359 | F80-N355 WeakPolarHBondContact CE1-ND2 3.27Å; Y351-N355 WeakPolarHBondContact O-CB 3.09Å; G352-N355 WeakPolarHBondContact O-CB 3.27Å; G352-N355 PolarHBondContact O-N 3Å; C353-N355 VanDerWaalsContact C-N 3.28Å; N355-Q357 VanDerWaalsContact C-N 3.27Å; N355-Q357 PolarHBondContact O-N 2.93Å; N355-Q357 PolarHBondContact OD1-N 3.13Å; N355-I358 HydrophobicContact CB-CB 4.23Å; N355-I358 HydrophobicContact CB-CD1 4.08Å; N355-I358 HydrophobicContact CB-CG1 4.22Å; N355-I358 PolarHBondContact O-N 2.88Å; N355-I358 VanDerWaalsContact O-N 3.11Å; N355-R359 WeakPolarHBondContact O-CB 3.43Å; N355-R359 PolarHBondContact O-N 3.38Å |
| 356 | R | 79.8 | Confident | 85.2 | Confident | 162 Ų | 162 | 51.6 Ų | 51.6 | 61% | 0.611 | 24% | 0.242 | S | C | * | . | H | α-helix | trans | -52.1 | -43.6 | -175.7 | -176.2 | 174.7 | 73 | 144.7 | 1.7 | 112.9 | L354 R359 E360 | L354-R356 PolarHBondContact O-N 3.28Å; R356-R359 PolarHBondContact O-N 2.91Å; R356-E360 WeakPolarHBondContact CD-OE1 3.01Å; R356-E360 HydrophobicContact CG-CG 4.38Å; R356-E360 WeakPolarHBondContact CG-OE1 3.29Å; R356-E360 WeakPolarHBondContact O-CB 3.26Å; R356-E360 VanDerWaalsContact O-CG 3.29Å; R356-E360 WeakPolarHBondContact O-CG 3.3Å; R356-E360 PolarHBondContact O-N 3.02Å |
| 357 | Q | 81.5 | Confident | 84.6 | Confident | 71 Ų | 71 | 53.5 Ų | 53.5 | 33% | 0.332 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -65.9 | -40.7 | -177.6 | -67 | 179.1 | 4.3 | 0 | 0 | 111.7 | L77 K79 F80 N355 E361 | L77-Q357 HydrophobicContact CD2-CB 3.88Å; K79-Q357 VanDerWaalsContact CE-OE1 3.26Å; F80-Q357 HydrophobicContact CE2-CB 4.32Å; F80-Q357 VanDerWaalsContact CZ-OE1 3.25Å; N355-Q357 VanDerWaalsContact C-N 3.27Å; N355-Q357 PolarHBondContact O-N 2.93Å; N355-Q357 PolarHBondContact OD1-N 3.13Å; Q357-E361 WeakPolarHBondContact O-CG 3.44Å |
| 358 | I | 80.1 | Confident | 83.9 | Confident | 0 Ų | 0 | 57 Ų | 57 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -74.5 | -41.3 | 179.2 | -60.1 | 175.7 | 0 | 0 | 0 | 110.3 | V67 V70 L77 F80 V83 N355 E360 E361 L362 | V67-I358 HydrophobicContact CG1-CG2 4.42Å; V70-I358 HydrophobicContact CG1-CG2 4.42Å; L77-I358 HydrophobicContact CD1-CG1 4.28Å; L77-I358 HydrophobicContact CD2-CG1 4.12Å; F80-I358 HydrophobicContact CD2-CD1 4.36Å; F80-I358 HydrophobicContact CD2-CG1 4.37Å; F80-I358 HydrophobicContact CE2-CG1 4.5Å; F80-I358 HydrophobicContact CG-CD1 4.4Å; V83-I358 HydrophobicContact CG1-CD1 4.28Å; N355-I358 HydrophobicContact CB-CB 4.23Å; N355-I358 HydrophobicContact CB-CD1 4.08Å; N355-I358 HydrophobicContact CB-CG1 4.22Å; N355-I358 PolarHBondContact O-N 2.88Å; N355-I358 VanDerWaalsContact O-N 3.11Å; I358-E360 PolarHBondContact O-N 3.39Å; I358-E361 PolarHBondContact O-N 2.75Å; I358-L362 VanDerWaalsContact O-CB 3.31Å; I358-L362 WeakPolarHBondContact O-CB 3.5Å; I358-L362 PolarHBondContact O-N 3.33Å |
| 359 | R | 86.5 | Confident | 83.1 | Confident | 127 Ų | 127 | 61.8 Ų | 61.8 | 48% | 0.479 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -61.3 | -43.1 | 179.5 | -176.5 | -178 | 58.9 | -157.8 | 2.7 | 112.9 | C353 N355 R356 E361 L362 G363 | C353-R359 WeakPolarHBondContact O-CB 3.31Å; C353-R359 VanDerWaalsContact O-CD 3.27Å; C353-R359 WeakPolarHBondContact O-CD 3.06Å; N355-R359 WeakPolarHBondContact O-CB 3.43Å; N355-R359 PolarHBondContact O-N 3.38Å; R356-R359 PolarHBondContact O-N 2.91Å; R359-E361 VanDerWaalsContact C-N 3.34Å; R359-L362 PolarHBondContact O-N 3.32Å; R359-G363 PolarHBondContact O-N 3Å |
| 360 | E | 85.9 | Confident | 82.3 | Confident | 104 Ų | 104 | 63.6 Ų | 63.6 | 49% | 0.486 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -62.2 | -44.1 | 179.6 | -75.6 | 166.8 | -176.4 | 0 | 0 | 110.9 | R356 I358 G363 R364 | R356-E360 WeakPolarHBondContact CD-OE1 3.01Å; R356-E360 HydrophobicContact CG-CG 4.38Å; R356-E360 WeakPolarHBondContact CG-OE1 3.29Å; R356-E360 WeakPolarHBondContact O-CB 3.26Å; R356-E360 VanDerWaalsContact O-CG 3.29Å; R356-E360 WeakPolarHBondContact O-CG 3.3Å; R356-E360 PolarHBondContact O-N 3.02Å; I358-E360 PolarHBondContact O-N 3.39Å; E360-G363 PolarHBondContact O-N 3.42Å; E360-R364 PolarHBondContact O-N 3.1Å |
| 361 | E | 86.9 | Confident | 81.3 | Confident | 37 Ų | 37 | 71.2 Ų | 71.2 | 17% | 0.173 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -69.6 | -39.3 | 177.3 | -67.5 | -68 | 127.1 | 0 | 0 | 112.7 | V70 T74 L77 Q357 I358 R359 R364 H365 | V70-E361 HydrophobicContact CG1-CB 3.64Å; T74-E361 HydrophobicContact CG2-CG 4.03Å; T74-E361 WeakPolarHBondContact CG2-OE2 3.35Å; T74-E361 PolarHBondContact OG1-OE2 2.91Å; L77-E361 HydrophobicContact CD1-CB 4.05Å; L77-E361 HydrophobicContact CD1-CG 4.04Å; Q357-E361 WeakPolarHBondContact O-CG 3.44Å; I358-E361 PolarHBondContact O-N 2.75Å; R359-E361 VanDerWaalsContact C-N 3.34Å; E361-R364 PolarHBondContact O-N 3.26Å; E361-R364 IonicContact OE1-CZ 3.83Å; E361-R364 IonicContact OE1-NH2 3.91Å; E361-R364 IonicContact OE2-CZ 3.29Å; E361-R364 VanDerWaalsContact OE2-CZ 3.29Å; E361-R364 IonicContact OE2-NE 3.67Å; E361-R364 IonicContact OE2-NH2 2.67Å; E361-R364 PolarHBondContact OE2-NH2 3.48Å; E361-H365 PolarHBondContact O-N 3.08Å |
| 362 | L | 84.4 | Confident | 79.9 | Confident | 23 Ų | 23 | 81.8 Ų | 81.8 | 12% | 0.12 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -61.1 | -45.1 | 173.2 | -178.7 | 65.9 | 0 | 0 | 0 | 111 | A66 V70 I358 R359 R364 H365 L366 | A66-L362 HydrophobicContact CB-CD1 4.18Å; V70-L362 HydrophobicContact CG2-CB 4.1Å; V70-L362 HydrophobicContact CG2-CD1 3.69Å; I358-L362 VanDerWaalsContact O-CB 3.31Å; I358-L362 WeakPolarHBondContact O-CB 3.5Å; I358-L362 PolarHBondContact O-N 3.33Å; R359-L362 PolarHBondContact O-N 3.32Å; L362-R364 VanDerWaalsContact C-N 3.34Å; L362-R364 PolarHBondContact O-N 3.29Å; L362-H365 PolarHBondContact O-N 3.27Å; L362-L366 HydrophobicContact CD1-CD1 4.13Å; L362-L366 HydrophobicContact CD1-CG 4.25Å; L362-L366 HydrophobicContact CG-CD1 3.88Å; L362-L366 HydrophobicContact CG-CG 4.4Å; L362-L366 WeakPolarHBondContact O-CB 3.34Å; L362-L366 VanDerWaalsContact O-CG 3.27Å; L362-L366 WeakPolarHBondContact O-CG 3.4Å; L362-L366 PolarHBondContact O-N 3.27Å |
| 363 | G | 83.4 | Confident | 78.5 | Confident | 39 Ų | 39 | 85.6 Ų | 85.6 | 40% | 0.402 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -61 | -41.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | R359 E360 A367 | R359-G363 PolarHBondContact O-N 3Å; E360-G363 PolarHBondContact O-N 3.42Å; G363-A367 VanDerWaalsContact O-CB 3.23Å; G363-A367 WeakPolarHBondContact O-CB 3.2Å; G363-A367 PolarHBondContact O-N 2.94Å |
| 364 | R | 85.4 | Confident | 76.8 | Confident | 130 Ų | 130 | 85.3 Ų | 85.3 | 49% | 0.491 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -63 | -45.7 | 175.6 | -170.3 | -176.8 | 66.9 | 163.1 | -0.5 | 111.9 | E360 E361 L362 A367 C368 | E360-R364 PolarHBondContact O-N 3.1Å; E361-R364 PolarHBondContact O-N 3.26Å; E361-R364 IonicContact OE1-CZ 3.83Å; E361-R364 IonicContact OE1-NH2 3.91Å; E361-R364 IonicContact OE2-CZ 3.29Å; E361-R364 VanDerWaalsContact OE2-CZ 3.29Å; E361-R364 IonicContact OE2-NE 3.67Å; E361-R364 IonicContact OE2-NH2 2.67Å; E361-R364 PolarHBondContact OE2-NH2 3.48Å; L362-R364 VanDerWaalsContact C-N 3.34Å; L362-R364 PolarHBondContact O-N 3.29Å; R364-A367 PolarHBondContact O-N 3.5Å; R364-C368 PolarHBondContact O-N 2.98Å; R364-C368 PolarHBondContact O-SG 3.46Å; R364-C368 VanDerWaalsContact O-SG 3.32Å |
| 365 | H | 82.6 | Confident | 74.9 | Confident | 42 Ų | 42 | 88.4 Ų | 88.4 | 19% | 0.194 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -68.9 | -41.3 | -180 | -69.7 | -179 | 0 | 0 | 0 | 112.1 | E361 L362 C368 I369 | E361-H365 PolarHBondContact O-N 3.08Å; L362-H365 PolarHBondContact O-N 3.27Å; H365-C368 PolarHBondContact O-N 2.87Å; H365-I369 VanDerWaalsContact O-CG1 3.3Å; H365-I369 WeakPolarHBondContact O-CG1 3.34Å; H365-I369 PolarHBondContact O-N 2.98Å |
| 366 | L | 82.6 | Confident | 73.3 | Confident | 73 Ų | 73 | 94.3 Ų | 94.3 | 38% | 0.382 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -61.9 | -45.5 | 173.6 | -72 | 171.8 | 0 | 0 | 0 | 111.1 | L362 C368 I369 F370 | L362-L366 HydrophobicContact CD1-CD1 4.13Å; L362-L366 HydrophobicContact CD1-CG 4.25Å; L362-L366 HydrophobicContact CG-CD1 3.88Å; L362-L366 HydrophobicContact CG-CG 4.4Å; L362-L366 WeakPolarHBondContact O-CB 3.34Å; L362-L366 VanDerWaalsContact O-CG 3.27Å; L362-L366 WeakPolarHBondContact O-CG 3.4Å; L362-L366 PolarHBondContact O-N 3.27Å; L366-C368 VanDerWaalsContact C-N 3.3Å; L366-C368 PolarHBondContact O-N 3.29Å; L366-I369 PolarHBondContact O-N 2.7Å; L366-I369 VanDerWaalsContact O-N 3.1Å; L366-F370 HydrophobicContact CB-CD2 4.29Å; L366-F370 HydrophobicContact CB-CE2 4.27Å; L366-F370 HydrophobicContact CD2-CE2 4.24Å; L366-F370 WeakPolarHBondContact O-CD2 3.45Å; L366-F370 PolarHBondContact O-N 2.91Å |
| 367 | A | 81.4 | Confident | 71.4 | Confident | 47 Ų | 47 | 94.9 Ų | 94.9 | 39% | 0.388 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -60 | -38.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | G363 R364 K371 | G363-A367 VanDerWaalsContact O-CB 3.23Å; G363-A367 WeakPolarHBondContact O-CB 3.2Å; G363-A367 PolarHBondContact O-N 2.94Å; R364-A367 PolarHBondContact O-N 3.5Å; A367-K371 VanDerWaalsContact O-CB 3.25Å; A367-K371 WeakPolarHBondContact O-CB 3.35Å; A367-K371 VanDerWaalsContact O-CG 3.26Å; A367-K371 WeakPolarHBondContact O-CG 3.23Å; A367-K371 PolarHBondContact O-N 3.21Å |
| 368 | C | 76.9 | Confident | 69.3 | Low | 79 Ų | 79 | 94.9 Ų | 94.9 | 53% | 0.534 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -65.5 | -39.6 | 173.6 | -70.9 | 0 | 0 | 0 | 0 | 112.6 | R364 H365 L366 R372 | R364-C368 PolarHBondContact O-N 2.98Å; R364-C368 PolarHBondContact O-SG 3.46Å; R364-C368 VanDerWaalsContact O-SG 3.32Å; H365-C368 PolarHBondContact O-N 2.87Å; L366-C368 VanDerWaalsContact C-N 3.3Å; L366-C368 PolarHBondContact O-N 3.29Å; C368-R372 WeakPolarHBondContact O-CB 3.34Å; C368-R372 PolarHBondContact O-N 3.38Å |
| 369 | I | 76.2 | Confident | 67.5 | Low | 107 Ų | 107 | 103.8 Ų | 103.8 | 55% | 0.549 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -66.3 | -46.9 | 177.3 | -66.8 | 164.3 | 0 | 0 | 0 | 110.4 | H365 L366 R372 A373 | H365-I369 VanDerWaalsContact O-CG1 3.3Å; H365-I369 WeakPolarHBondContact O-CG1 3.34Å; H365-I369 PolarHBondContact O-N 2.98Å; L366-I369 PolarHBondContact O-N 2.7Å; L366-I369 VanDerWaalsContact O-N 3.1Å; I369-R372 PolarHBondContact O-N 2.93Å; I369-A373 WeakPolarHBondContact O-CB 3.21Å; I369-A373 PolarHBondContact O-N 3.32Å; I369-A373 VanDerWaalsContact O-N 3.08Å |
| 370 | F | 73.3 | Confident | 64.9 | Low | 149 Ų | 149 | 106.8 Ų | 106.8 | 65% | 0.654 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -69 | -34.3 | 178.7 | -73.4 | -66.9 | 0 | 0 | 0 | 112.9 | L366 R372 A373 G374 | L366-F370 HydrophobicContact CB-CD2 4.29Å; L366-F370 HydrophobicContact CB-CE2 4.27Å; L366-F370 HydrophobicContact CD2-CE2 4.24Å; L366-F370 WeakPolarHBondContact O-CD2 3.45Å; L366-F370 PolarHBondContact O-N 2.91Å; F370-R372 VanDerWaalsContact C-N 3.33Å; F370-A373 PolarHBondContact O-N 2.96Å; F370-G374 PolarHBondContact O-N 3.13Å |
| 371 | K | 68.8 | Low | 62.5 | Low | 183 Ų | 183 | 108.6 Ų | 108.6 | 80% | 0.796 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -66.6 | -33.3 | 171.7 | -79.8 | -175.8 | 176.5 | -169.4 | 0 | 112.7 | A367 A373 | A367-K371 VanDerWaalsContact O-CB 3.25Å; A367-K371 WeakPolarHBondContact O-CB 3.35Å; A367-K371 VanDerWaalsContact O-CG 3.26Å; A367-K371 WeakPolarHBondContact O-CG 3.23Å; A367-K371 PolarHBondContact O-N 3.21Å; K371-A373 VanDerWaalsContact C-N 3.31Å |
| 372 | R | 56.8 | Low | 60.2 | Low | 230 Ų | 230 | 112 Ų | 112 | 87% | 0.868 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -77.4 | -17.3 | 176.2 | -162.2 | 172.6 | -168.1 | 165.9 | 4.4 | 113.3 | C368 I369 F370 | C368-R372 WeakPolarHBondContact O-CB 3.34Å; C368-R372 PolarHBondContact O-N 3.38Å; I369-R372 PolarHBondContact O-N 2.93Å; F370-R372 VanDerWaalsContact C-N 3.33Å |
| 373 | A | 54.7 | Low | 58.1 | Low | 80 Ų | 80 | 115.8 Ų | 115.8 | 66% | 0.661 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.9 | -1.5 | 178 | 0 | 0 | 0 | 0 | 0 | 114 | I369 F370 K371 | I369-A373 WeakPolarHBondContact O-CB 3.21Å; I369-A373 PolarHBondContact O-N 3.32Å; I369-A373 VanDerWaalsContact O-N 3.08Å; F370-A373 PolarHBondContact O-N 2.96Å; K371-A373 VanDerWaalsContact C-N 3.31Å |
| 374 | G | 45.3 | Very low | 56.3 | Low | 33 Ų | 33 | 123.1 Ų | 123.1 | 34% | 0.34 | 65% | 0.653 | S | S | . | * | S | Bend | trans | -70.5 | 158.7 | 166.6 | 0 | 0 | 0 | 0 | 0 | 111 | F370 V376 | F370-G374 PolarHBondContact O-N 3.13Å; G374-V376 PolarHBondContact O-N 2.96Å |
| 375 | P | 40.2 | Very low | 54.3 | Low | 112 Ų | 112 | 123.8 Ų | 123.8 | 73% | 0.727 | 66% | 0.662 | S | S | * | * | trans | -53.8 | 137.9 | 174.2 | -15.3 | 27.7 | 0 | 0 | 0 | 109.1 | E377 | P375-E377 PolarHBondContact O-N 2.93Š| ||
| 376 | V | 46.3 | Very low | 52.4 | Low | 153 Ų | 153 | 124.5 Ų | 124.5 | 93% | 0.927 | 67% | 0.674 | S | S | * | * | trans | -64.3 | 81.7 | 166.7 | 179.9 | 0 | 0 | 0 | 0 | 107.2 | G374 | G374-V376 PolarHBondContact O-N 2.96Š| ||
| 377 | E | 40.1 | Very low | 50.6 | Low | 174 Ų | 174 | 123.5 Ų | 123.5 | 81% | 0.813 | 67% | 0.674 | S | S | * | * | trans | -114.6 | 105.6 | 163.4 | -91.5 | -173.8 | 125.2 | 0 | 0 | 107.4 | P375 | P375-E377 PolarHBondContact O-N 2.93Š| ||
| 378 | G | 37.3 | Very low | 49.1 | Very low | 71 Ų | 71 | 126 Ų | 126 | 73% | 0.732 | 68% | 0.68 | S | S | * | * | trans | 68.5 | 99.4 | 162.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | Q380 | G378-Q380 PolarHBondContact O-N 3.09Š| ||
| 379 | E | 41.6 | Very low | 47.8 | Very low | 186 Ų | 186 | 128.7 Ų | 128.7 | 87% | 0.869 | 68% | 0.684 | S | S | * | * | trans | -52.4 | 104.8 | 155.3 | -80.3 | -177.3 | 92.6 | 0 | 0 | 109.9 | ||||
| 380 | Q | 33.8 | Very low | 46.8 | Very low | 191 Ų | 191 | 130 Ų | 130 | 89% | 0.893 | 69% | 0.688 | S | S | * | * | trans | -119 | 93.1 | 156.2 | -141.5 | 150 | 11.2 | 0 | 0 | 107.2 | G378 | G378-Q380 PolarHBondContact O-N 3.09Š| ||
| 381 | L | 35.3 | Very low | 45.7 | Very low | 142 Ų | 142 | 127.8 Ų | 127.8 | 74% | 0.743 | 68% | 0.683 | S | S | * | * | trans | -51.1 | 144.7 | 174.1 | -76.9 | 153.4 | 0 | 0 | 0 | 110.7 | S383 | L381-S383 PolarHBondContact O-N 3.46Š| ||
| 382 | P | 37.4 | Very low | 44.8 | Very low | 109 Ų | 109 | 125.2 Ų | 125.2 | 71% | 0.708 | 67% | 0.672 | S | S | * | * | trans | -70.8 | 95.3 | 171.5 | 28.9 | -30.1 | 0 | 0 | 0 | 109.6 | R384 | P382-R384 PolarHBondContact O-N 3.21Š| ||
| 383 | S | 41.3 | Very low | 44.6 | Very low | 102 Ų | 102 | 118.8 Ų | 118.8 | 71% | 0.713 | 65% | 0.654 | S | S | * | * | S | Bend | trans | 19.6 | 27.4 | 144 | 80.2 | 0 | 0 | 0 | 0 | 122.1 | L381 | L381-S383 PolarHBondContact O-N 3.46Š|
| 384 | R | 44.6 | Very low | 44.6 | Very low | 192 Ų | 192 | 121.1 Ų | 121.1 | 73% | 0.725 | 65% | 0.652 | S | S | * | * | S | Bend | trans | -110.4 | -35 | 178.2 | -160.1 | 173 | 179 | 175.6 | -2.2 | 112.8 | P382 I388 | P382-R384 PolarHBondContact O-N 3.21Å; R384-I388 WeakPolarHBondContact O-CG1 3.17Å |
| 385 | E | 43.3 | Very low | 44.9 | Very low | 145 Ų | 145 | 126.5 Ų | 126.5 | 68% | 0.678 | 67% | 0.666 | S | S | * | * | S | Bend | trans | -77 | -34.2 | 171.9 | -101.9 | 63.7 | -153.7 | 0 | 0 | 112.5 | S387 I388 E389 | E385-S387 VanDerWaalsContact C-N 3.3Å; E385-S387 PolarHBondContact O-N 2.91Å; E385-I388 PolarHBondContact O-N 3.06Å; E385-I388 VanDerWaalsContact O-N 3.16Å; E385-E389 PolarHBondContact O-N 2.81Å; E385-E389 VanDerWaalsContact O-N 3.11Å |
| 386 | A | 42.8 | Very low | 45.5 | Very low | 56 Ų | 56 | 125.7 Ų | 125.7 | 46% | 0.463 | 66% | 0.655 | S | S | . | * | H | α-helix | trans | -65 | -31.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | I388 E390 | A386-I388 VanDerWaalsContact C-N 3.32Å; A386-E390 VanDerWaalsContact O-CB 3.27Å; A386-E390 WeakPolarHBondContact O-CB 3.44Å; A386-E390 VanDerWaalsContact O-CG 3.29Å; A386-E390 WeakPolarHBondContact O-CG 3.49Å; A386-E390 PolarHBondContact O-N 3.18Å |
| 387 | S | 46.2 | Very low | 45.7 | Very low | 52 Ų | 52 | 126.1 Ų | 126.1 | 36% | 0.364 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -76 | -21.6 | 176.9 | 104.3 | 0 | 0 | 0 | 0 | 112.6 | E385 N391 | E385-S387 VanDerWaalsContact C-N 3.3Å; E385-S387 PolarHBondContact O-N 2.91Å; S387-N391 VanDerWaalsContact O-CB 3.3Å; S387-N391 WeakPolarHBondContact O-CB 3.35Å; S387-N391 PolarHBondContact O-N 2.85Å; S387-N391 PolarHBondContact O-ND2 2.73Å |
| 388 | I | 49.4 | Very low | 46 | Very low | 101 Ų | 101 | 121 Ų | 121 | 52% | 0.518 | 64% | 0.64 | S | S | . | * | H | α-helix | trans | -82.9 | -39.1 | 177.8 | -63.4 | 170.6 | 0 | 0 | 0 | 109.1 | R384 E385 A386 N391 F392 | R384-I388 WeakPolarHBondContact O-CG1 3.17Å; E385-I388 PolarHBondContact O-N 3.06Å; E385-I388 VanDerWaalsContact O-N 3.16Å; A386-I388 VanDerWaalsContact C-N 3.32Å; I388-N391 PolarHBondContact O-N 3.34Å; I388-F392 VanDerWaalsContact O-CB 3.23Å; I388-F392 WeakPolarHBondContact O-CB 3.22Å; I388-F392 PolarHBondContact O-N 2.98Å |
| 389 | E | 49.8 | Very low | 46.4 | Very low | 134 Ų | 134 | 122.7 Ų | 122.7 | 63% | 0.626 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -72.6 | -36.3 | 176 | -163.3 | 154.1 | -174.1 | 0 | 0 | 112.5 | E385 F392 L393 | E385-E389 PolarHBondContact O-N 2.81Å; E385-E389 VanDerWaalsContact O-N 3.11Å; E389-F392 PolarHBondContact O-N 2.86Å; E389-L393 HydrophobicContact CG-CD1 4.17Å; E389-L393 VanDerWaalsContact O-CB 3.28Å; E389-L393 WeakPolarHBondContact O-CB 3.23Å; E389-L393 VanDerWaalsContact O-CG 3.32Å; E389-L393 WeakPolarHBondContact O-CG 3.39Å; E389-L393 PolarHBondContact O-N 3.44Å |
| 390 | E | 53.7 | Low | 46 | Very low | 135 Ų | 135 | 116.5 Ų | 116.5 | 63% | 0.631 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -65 | -41.2 | 169.4 | -77.9 | 177.6 | 167.2 | 0 | 0 | 112 | A386 Q394 | A386-E390 VanDerWaalsContact O-CB 3.27Å; A386-E390 WeakPolarHBondContact O-CB 3.44Å; A386-E390 VanDerWaalsContact O-CG 3.29Å; A386-E390 WeakPolarHBondContact O-CG 3.49Å; A386-E390 PolarHBondContact O-N 3.18Å; E390-Q394 WeakPolarHBondContact O-CB 3.31Å; E390-Q394 PolarHBondContact O-N 3.07Å |
| 391 | N | 51.4 | Low | 45.9 | Very low | 102 Ų | 102 | 113.4 Ų | 113.4 | 55% | 0.545 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -69.2 | -33 | 174.9 | -85.7 | -64.2 | 0 | 0 | 0 | 112.6 | S387 I388 F395 | S387-N391 VanDerWaalsContact O-CB 3.3Å; S387-N391 WeakPolarHBondContact O-CB 3.35Å; S387-N391 PolarHBondContact O-N 2.85Å; S387-N391 PolarHBondContact O-ND2 2.73Å; I388-N391 PolarHBondContact O-N 3.34Å; N391-F395 WeakPolarHBondContact O-CB 3.45Å; N391-F395 PolarHBondContact O-N 3.44Å |
| 392 | F | 50.5 | Low | 45.6 | Very low | 130 Ų | 130 | 114 Ų | 114 | 57% | 0.57 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -74.2 | -39.2 | 177.6 | -162.6 | -102.6 | 0 | 0 | 0 | 111.5 | I388 E389 F395 L396 | I388-F392 VanDerWaalsContact O-CB 3.23Å; I388-F392 WeakPolarHBondContact O-CB 3.22Å; I388-F392 PolarHBondContact O-N 2.98Å; E389-F392 PolarHBondContact O-N 2.86Å; F392-F395 PolarHBondContact O-N 2.78Å; F392-L396 HydrophobicContact CD1-CD1 3.82Å; F392-L396 HydrophobicContact CD1-CG 4.48Å; F392-L396 HydrophobicContact CE1-CD1 3.82Å; F392-L396 HydrophobicContact CE1-CG 4.46Å; F392-L396 WeakPolarHBondContact O-CB 3.28Å; F392-L396 VanDerWaalsContact O-CG 3.27Å; F392-L396 WeakPolarHBondContact O-CG 3.42Å; F392-L396 PolarHBondContact O-N 3.2Å |
| 393 | L | 52.3 | Low | 45.2 | Very low | 94 Ų | 94 | 117.2 Ų | 117.2 | 49% | 0.492 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -69.7 | -34.5 | 171.9 | -74.8 | 167.1 | 0 | 0 | 0 | 112.1 | E389 L396 Q397 | E389-L393 HydrophobicContact CG-CD1 4.17Å; E389-L393 VanDerWaalsContact O-CB 3.28Å; E389-L393 WeakPolarHBondContact O-CB 3.23Å; E389-L393 VanDerWaalsContact O-CG 3.32Å; E389-L393 WeakPolarHBondContact O-CG 3.39Å; E389-L393 PolarHBondContact O-N 3.44Å; L393-L396 HydrophobicContact CD2-CD1 4.5Å; L393-L396 CarbonylContact O-C 3.47Å; L393-L396 PolarHBondContact O-N 3.29Å; L393-Q397 WeakPolarHBondContact O-CB 3.49Å; L393-Q397 PolarHBondContact O-N 3.2Å |
| 394 | Q | 55.1 | Low | 44.8 | Very low | 130 Ų | 130 | 120.5 Ų | 120.5 | 61% | 0.607 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -73.8 | -27.3 | 174.2 | -163.5 | 162.5 | 22.5 | 0 | 0 | 112.2 | E390 G398 | E390-Q394 WeakPolarHBondContact O-CB 3.31Å; E390-Q394 PolarHBondContact O-N 3.07Å; Q394-G398 PolarHBondContact O-N 3.36Å |
| 395 | F | 51.1 | Low | 44 | Very low | 145 Ų | 145 | 117.4 Ų | 117.4 | 64% | 0.636 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -72.1 | -39.8 | 168.4 | -175.9 | -99.1 | 0 | 0 | 0 | 111.9 | N391 F392 G398 T399 | N391-F395 WeakPolarHBondContact O-CB 3.45Å; N391-F395 PolarHBondContact O-N 3.44Å; F392-F395 PolarHBondContact O-N 2.78Å; F395-G398 PolarHBondContact O-N 2.76Å; F395-T399 PolarHBondContact O-N 3.31Å; F395-T399 PolarHBondContact O-OG1 3.12Å |
| 396 | L | 51.5 | Low | 43.2 | Very low | 96 Ų | 96 | 116.8 Ų | 116.8 | 50% | 0.503 | 65% | 0.654 | S | S | . | * | H | α-helix | trans | -69.3 | -33.8 | 172.4 | -71.6 | 168.7 | 0 | 0 | 0 | 112.5 | F392 L393 | F392-L396 HydrophobicContact CD1-CD1 3.82Å; F392-L396 HydrophobicContact CD1-CG 4.48Å; F392-L396 HydrophobicContact CE1-CD1 3.82Å; F392-L396 HydrophobicContact CE1-CG 4.46Å; F392-L396 WeakPolarHBondContact O-CB 3.28Å; F392-L396 VanDerWaalsContact O-CG 3.27Å; F392-L396 WeakPolarHBondContact O-CG 3.42Å; F392-L396 PolarHBondContact O-N 3.2Å; L393-L396 HydrophobicContact CD2-CD1 4.5Å; L393-L396 CarbonylContact O-C 3.47Å; L393-L396 PolarHBondContact O-N 3.29Å |
| 397 | Q | 50.9 | Low | 42.4 | Very low | 161 Ų | 161 | 121.5 Ų | 121.5 | 75% | 0.752 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -76.6 | -24.6 | 171 | -89.3 | 178.5 | -42.3 | 0 | 0 | 112.8 | L393 T399 | L393-Q397 WeakPolarHBondContact O-CB 3.49Å; L393-Q397 PolarHBondContact O-N 3.2Å; Q397-T399 VanDerWaalsContact C-N 3.25Å; Q397-T399 PolarHBondContact O-N 2.79Å |
| 398 | G | 47.7 | Very low | 41.5 | Very low | 66 Ų | 66 | 123.4 Ų | 123.4 | 68% | 0.68 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.5 | -7.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | Q394 F395 | Q394-G398 PolarHBondContact O-N 3.36Å; F395-G398 PolarHBondContact O-N 2.76Å |
| 399 | T | 45.7 | Very low | 40.5 | Very low | 108 Ų | 108 | 126.7 Ų | 126.7 | 66% | 0.663 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.3 | 6.2 | 175.9 | 26.1 | 0 | 0 | 0 | 0 | 114.3 | F395 Q397 C401 | F395-T399 PolarHBondContact O-N 3.31Å; F395-T399 PolarHBondContact O-OG1 3.12Å; Q397-T399 VanDerWaalsContact C-N 3.25Å; Q397-T399 PolarHBondContact O-N 2.79Å; T399-C401 PolarHBondContact O-N 3.41Å |
| 400 | G | 33 | Very low | 39.4 | Very low | 56 Ų | 56 | 125.2 Ų | 125.2 | 58% | 0.577 | 70% | 0.702 | S | S | * | * | trans | -89.2 | 98.2 | 169.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | N402 | G400-N402 PolarHBondContact O-N 3.05Š| ||
| 401 | C | 31.1 | Very low | 38.1 | Very low | 125 Ų | 125 | 130.2 Ų | 130.2 | 85% | 0.845 | 72% | 0.715 | S | S | * | * | trans | -52.3 | 134.6 | 169.4 | -82.9 | 0 | 0 | 0 | 0 | 111.7 | T399 L403 | T399-C401 PolarHBondContact O-N 3.41Å; C401-L403 PolarHBondContact O-N 3.17Å | ||
| 402 | N | 29.2 | Very low | 36.9 | Very low | 155 Ų | 155 | 130.1 Ų | 130.1 | 83% | 0.829 | 73% | 0.728 | S | S | * | * | trans | -44.2 | 124 | 159 | -83.6 | -74.7 | 0 | 0 | 0 | 110.6 | G400 | G400-N402 PolarHBondContact O-N 3.05Š| ||
| 403 | L | 29.2 | Very low | 35.7 | Very low | 176 Ų | 176 | 129.4 Ų | 129.4 | 92% | 0.921 | 74% | 0.74 | S | S | * | * | trans | -105 | 92.6 | 160.9 | -144.9 | 85.8 | 0 | 0 | 0 | 107.6 | C401 | C401-L403 PolarHBondContact O-N 3.17Š| ||
| 404 | E | 32.7 | Very low | 35.3 | Very low | 172 Ų | 172 | 130.1 Ų | 130.1 | 80% | 0.804 | 75% | 0.75 | S | S | * | * | trans | -81.4 | 137.9 | 161.9 | -137.3 | 164.1 | 154.3 | 0 | 0 | 107.7 | C406 | E404-C406 PolarHBondContact O-N 2.94Š| ||
| 405 | P | 27.9 | Very low | 34 | Very low | 127 Ų | 127 | 132.5 Ų | 132.5 | 83% | 0.825 | 76% | 0.761 | S | S | * | * | trans | -82.8 | 121.1 | -175.6 | 30.5 | -29.4 | 0 | 0 | 0 | 110.4 | ||||
| 406 | C | 26.1 | Very low | 32.8 | Very low | 132 Ų | 132 | 132.9 Ų | 132.9 | 89% | 0.892 | 77% | 0.765 | S | S | * | * | trans | -136.7 | 134.5 | 163.7 | -149.2 | 0 | 0 | 0 | 0 | 111.9 | E404 | E404-C406 PolarHBondContact O-N 2.94Š| ||
| 407 | N | 25.9 | Very low | 31.7 | Very low | 154 Ų | 154 | 134.6 Ų | 134.6 | 82% | 0.824 | 78% | 0.775 | S | S | * | * | trans | -63.4 | 145.4 | -171.7 | -82.1 | -31.7 | 0 | 0 | 0 | 114.5 | ||||
| 408 | S | 27.1 | Very low | 30.5 | Very low | 92 Ų | 92 | 133.1 Ų | 133.1 | 64% | 0.643 | 78% | 0.777 | S | S | * | * | trans | 43 | 111.4 | 142 | 66.6 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 409 | H | 28.5 | Very low | 30.1 | Very low | 171 Ų | 171 | 135.8 Ų | 135.8 | 79% | 0.792 | 78% | 0.782 | S | S | * | * | 159.8 | 131.5 | 103.5 | -94.4 | -66.9 | 0 | 0 | 0 | 113 | |||||
| 410 | S | 26.1 | Very low | 29.4 | Very low | 102 Ų | 102 | 135 Ų | 135 | 71% | 0.713 | 79% | 0.786 | S | S | * | * | trans | 68.1 | 118.2 | 139.4 | -68.9 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 411 | R | 26.8 | Very low | 29.2 | Very low | 241 Ų | 241 | 140.2 Ų | 140.2 | 91% | 0.909 | 80% | 0.801 | S | S | * | * | 90.7 | 120.1 | 126.5 | -96.4 | -179.6 | 170.6 | 158 | -2.5 | 121.3 | |||||
| 412 | A | 26.3 | Very low | 29.1 | Very low | 99 Ų | 99 | 143.5 Ų | 143.5 | 82% | 0.818 | 80% | 0.801 | S | S | * | * | trans | 102.1 | 111.2 | 130.4 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 413 | S | 24.6 | Very low | 29.5 | Very low | 116 Ų | 116 | 142 Ų | 142 | 81% | 0.811 | 80% | 0.8 | S | S | * | * | trans | -45.2 | -178 | 152.9 | -83.2 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 414 | P | 44.4 | Very low | 29.6 | Very low | 108 Ų | 108 | 141.5 Ų | 141.5 | 70% | 0.701 | 80% | 0.797 | S | S | * | * | cis | -136.9 | -159.2 | -32 | 34 | -12.2 | 0 | 0 | 0 | 112.2 | ||||
| 415 | E | 27.2 | Very low | 29.5 | Very low | 180 Ų | 180 | 139.2 Ų | 139.2 | 84% | 0.841 | 80% | 0.797 | S | S | * | * | trans | 91.6 | 146.9 | 166.1 | -63.1 | -178.1 | 157.6 | 0 | 0 | 117 | ||||
| 416 | E | 27.5 | Very low | 29.7 | Very low | 153 Ų | 153 | 136.9 Ų | 136.9 | 72% | 0.715 | 80% | 0.795 | S | S | * | * | cis | -177.3 | 158.9 | -25 | -157.7 | -173.7 | -154.6 | 0 | 0 | 104.2 | ||||
| 417 | N | 26.8 | Very low | 29.9 | Very low | 133 Ų | 133 | 140 Ų | 140 | 71% | 0.711 | 80% | 0.797 | S | S | * | * | trans | 95.3 | 138.7 | 156.1 | -57.6 | -42.6 | 0 | 0 | 0 | 122.1 | ||||
| 418 | T | 27.5 | Very low | 30.3 | Very low | 130 Ų | 130 | 141 Ų | 141 | 80% | 0.798 | 80% | 0.801 | S | S | * | * | trans | -97.5 | -169.6 | -159.1 | -23.2 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 419 | P | 39.4 | Very low | 30.4 | Very low | 122 Ų | 122 | 143.9 Ų | 143.9 | 79% | 0.792 | 81% | 0.808 | S | S | * | * | -101.4 | 166.4 | -113.5 | 39.8 | -23.1 | 0 | 0 | 0 | 115.3 | |||||
| 420 | A | 29.6 | Very low | 30.8 | Very low | 91 Ų | 91 | 144.5 Ų | 144.5 | 75% | 0.752 | 81% | 0.811 | S | S | * | * | trans | -146.4 | 126.5 | 163.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 421 | D | 29 | Very low | 31.3 | Very low | 165 Ų | 165 | 147.8 Ų | 147.8 | 88% | 0.882 | 82% | 0.815 | S | S | * | * | trans | -65.8 | 142.9 | 171.7 | -75.7 | -52.5 | 0 | 0 | 0 | 112.7 | ||||
| 422 | F | 29.4 | Very low | 31.9 | Very low | 194 Ų | 194 | 140.9 Ų | 140.9 | 85% | 0.851 | 80% | 0.8 | S | S | * | * | trans | -139.5 | 136.1 | 162.4 | -90.6 | -84.4 | 0 | 0 | 0 | 111 | ||||
| 423 | P | 36.5 | Very low | 32.6 | Very low | 123 Ų | 123 | 140.2 Ų | 140.2 | 80% | 0.799 | 80% | 0.795 | S | S | * | * | trans | -89.8 | 155.1 | -177.9 | 35 | -32.7 | 0 | 0 | 0 | 113.3 | ||||
| 424 | I | 32.2 | Very low | 33.3 | Very low | 167 Ų | 167 | 143.2 Ų | 143.2 | 86% | 0.856 | 80% | 0.795 | S | S | * | * | trans | -112 | 143.8 | 176.1 | -62.5 | 177.1 | 0 | 0 | 0 | 110.5 | ||||
| 425 | P | 31.2 | Very low | 32.9 | Very low | 124 Ų | 124 | 145.3 Ų | 145.3 | 81% | 0.805 | 79% | 0.794 | S | S | * | * | trans | -94.3 | 156.1 | -163 | -0.3 | 22.2 | 0 | 0 | 0 | 115.2 | ||||
| 426 | G | 32.3 | Very low | 33.6 | Very low | 77 Ų | 77 | 141.5 Ų | 141.5 | 79% | 0.794 | 78% | 0.778 | S | S | * | * | trans | 120.2 | 37.7 | 139.4 | 0 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 427 | Q | 29.5 | Very low | 34.3 | Very low | 199 Ų | 199 | 141.7 Ų | 141.7 | 93% | 0.93 | 78% | 0.779 | S | S | * | * | trans | -117.3 | 119.6 | 161.6 | -90.4 | -176.2 | -26.1 | 0 | 0 | 112.4 | ||||
| 428 | I | 33.4 | Very low | 35 | Very low | 175 Ų | 175 | 142.2 Ų | 142.2 | 90% | 0.897 | 78% | 0.777 | S | S | * | * | trans | -78.5 | 113.5 | 172.4 | -62.9 | 166.6 | 0 | 0 | 0 | 107.2 | ||||
| 429 | L | 30.2 | Very low | 35.6 | Very low | 152 Ų | 152 | 141.6 Ų | 141.6 | 80% | 0.796 | 77% | 0.766 | S | S | * | * | trans | -108.8 | 123.2 | 162.4 | -179 | 65.8 | 0 | 0 | 0 | 107.5 | E431 | L429-E431 PolarHBondContact O-N 3.38Š| ||
| 430 | E | 36.9 | Very low | 35.6 | Very low | 184 Ų | 184 | 142.3 Ų | 142.3 | 86% | 0.86 | 76% | 0.758 | S | S | * | * | trans | -82.6 | 95.1 | -178.2 | -174.3 | 171.9 | 175 | 0 | 0 | 109.3 | ||||
| 431 | E | 36.3 | Very low | 36.2 | Very low | 171 Ų | 171 | 144 Ų | 144 | 80% | 0.799 | 75% | 0.754 | S | S | * | * | trans | -163 | 72.1 | 168.8 | -116 | 177.7 | -161.4 | 0 | 0 | 111.1 | L429 | L429-E431 PolarHBondContact O-N 3.38Š| ||
| 432 | T | 40.6 | Very low | 36.8 | Very low | 95 Ų | 95 | 141.4 Ų | 141.4 | 58% | 0.583 | 74% | 0.74 | S | S | * | * | trans | -155.3 | 44.7 | 167.7 | -27 | 0 | 0 | 0 | 0 | 114.8 | F435 I436 | T432-F435 HydrophobicContact CG2-CB 4.15Å; T432-I436 HydrophobicContact CG2-CG1 4.42Å | ||
| 433 | A | 39.4 | Very low | 37.5 | Very low | 86 Ų | 86 | 137.4 Ų | 137.4 | 71% | 0.711 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -93.5 | -23.1 | 170.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 434 | E | 39.2 | Very low | 37.8 | Very low | 178 Ų | 178 | 139.3 Ų | 139.3 | 83% | 0.832 | 73% | 0.726 | S | S | * | * | H | α-helix | trans | -92.9 | -19.5 | -176.8 | -67.1 | -165.8 | 156.4 | 0 | 0 | 114.2 | ||
| 435 | F | 36.2 | Very low | 38.3 | Very low | 153 Ų | 153 | 138.1 Ų | 138.1 | 67% | 0.671 | 72% | 0.72 | S | S | * | * | H | α-helix | trans | -84.1 | -25.5 | -177.7 | -139.6 | -95.3 | 0 | 0 | 0 | 113.8 | T432 | T432-F435 HydrophobicContact CG2-CB 4.15Å |
| 436 | I | 43.2 | Very low | 38.6 | Very low | 99 Ų | 99 | 137 Ų | 137 | 51% | 0.508 | 71% | 0.714 | S | S | . | * | H | α-helix | trans | -77.3 | -34.8 | -177.8 | -64 | 178 | 0 | 0 | 0 | 111.4 | T432 Q439 Q440 | T432-I436 HydrophobicContact CG2-CG1 4.42Å; I436-Q439 PolarHBondContact O-N 2.82Å; I436-Q440 PolarHBondContact O-N 2.82Å |
| 437 | Q | 41.3 | Very low | 39 | Very low | 157 Ų | 157 | 139.3 Ų | 139.3 | 73% | 0.734 | 71% | 0.713 | S | S | * | * | H | α-helix | trans | -75.7 | -28.4 | -177 | -163.1 | 143.6 | -9.5 | 0 | 0 | 113 | L441 | Q437-L441 PolarHBondContact O-N 3.04Å |
| 438 | Q | 40.7 | Very low | 39.4 | Very low | 145 Ų | 145 | 135 Ų | 135 | 68% | 0.678 | 71% | 0.705 | S | S | * | * | H | α-helix | trans | -80.7 | -25.2 | 177.7 | -157.1 | 154 | -0.3 | 0 | 0 | 112.7 | ||
| 439 | Q | 40 | Very low | 39.7 | Very low | 117 Ų | 117 | 135.1 Ų | 135.1 | 55% | 0.547 | 70% | 0.701 | S | S | . | * | H | α-helix | trans | -84.1 | -27.5 | 177.4 | -158.8 | 160.8 | -6 | 0 | 0 | 113 | I436 N443 | I436-Q439 PolarHBondContact O-N 2.82Å; Q439-N443 PolarHBondContact O-N 3.44Å |
| 440 | Q | 41.1 | Very low | 40.1 | Very low | 136 Ų | 136 | 135.5 Ų | 135.5 | 64% | 0.636 | 70% | 0.704 | S | S | * | * | H | α-helix | trans | -72.4 | -37 | 171 | -87.4 | 179.6 | -68.6 | 0 | 0 | 113.1 | I436 N442 N443 E444 | I436-Q440 PolarHBondContact O-N 2.82Å; Q440-N442 VanDerWaalsContact C-N 3.35Å; Q440-N442 PolarHBondContact O-N 3.49Å; Q440-N443 PolarHBondContact O-N 3.41Å; Q440-E444 PolarHBondContact O-N 3.21Å |
| 441 | L | 42.5 | Very low | 40 | Very low | 127 Ų | 127 | 132.4 Ų | 132.4 | 67% | 0.665 | 70% | 0.701 | S | S | * | * | H | α-helix | trans | -68.2 | -33.5 | 179.1 | -155.7 | 82.2 | 0 | 0 | 0 | 112.6 | Q437 | Q437-L441 PolarHBondContact O-N 3.04Å |
| 442 | N | 40.8 | Very low | 39.9 | Very low | 111 Ų | 111 | 130.1 Ų | 130.1 | 59% | 0.594 | 70% | 0.703 | S | S | * | * | H | α-helix | trans | -77.2 | -23 | 177.8 | -78.6 | -8.5 | 0 | 0 | 0 | 113.5 | Q440 | Q440-N442 VanDerWaalsContact C-N 3.35Å; Q440-N442 PolarHBondContact O-N 3.49Å |
| 443 | N | 43.2 | Very low | 39.5 | Very low | 109 Ų | 109 | 135.3 Ų | 135.3 | 58% | 0.583 | 72% | 0.717 | S | S | * | * | H | α-helix | trans | -83.9 | -26.5 | 177.7 | -87.1 | -5 | 0 | 0 | 0 | 113.4 | Q439 Q440 V447 | Q439-N443 PolarHBondContact O-N 3.44Å; Q440-N443 PolarHBondContact O-N 3.41Å; N443-V447 WeakPolarHBondContact O-CG2 3.29Å |
| 444 | E | 43.4 | Very low | 39.2 | Very low | 164 Ų | 164 | 138 Ų | 138 | 77% | 0.766 | 73% | 0.725 | S | S | * | * | H | α-helix | trans | -78.4 | -26.7 | 174.4 | -72.9 | -160.6 | 144.9 | 0 | 0 | 113.3 | Q440 C446 | Q440-E444 PolarHBondContact O-N 3.21Å; E444-C446 VanDerWaalsContact C-N 3.33Å |
| 445 | L | 41.9 | Very low | 39.2 | Very low | 142 Ų | 142 | 135.4 Ų | 135.4 | 74% | 0.743 | 72% | 0.721 | S | S | * | * | H | α-helix | trans | -74.7 | -22.6 | 175.7 | -132 | 84.9 | 0 | 0 | 0 | 113.1 | ||
| 446 | C | 38.3 | Very low | 39.5 | Very low | 100 Ų | 100 | 133.7 Ų | 133.7 | 68% | 0.676 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.4 | -7.4 | -175.3 | -131.6 | 0 | 0 | 0 | 0 | 114.4 | E444 | E444-C446 VanDerWaalsContact C-N 3.33Š|
| 447 | V | 39.8 | Very low | 39 | Very low | 126 Ų | 126 | 137.3 Ų | 137.3 | 76% | 0.764 | 74% | 0.74 | S | S | * | * | S | Bend | trans | -95.4 | -12.8 | -178.8 | 175.2 | 0 | 0 | 0 | 0 | 112.7 | N443 | N443-V447 WeakPolarHBondContact O-CG2 3.29Š|
| 448 | S | 39.2 | Very low | 38.7 | Very low | 109 Ų | 109 | 141.5 Ų | 141.5 | 76% | 0.762 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -88.6 | -7.4 | -176.7 | -166.3 | 0 | 0 | 0 | 0 | 115.7 | ||
| 449 | E | 39.7 | Very low | 38.6 | Very low | 176 Ų | 176 | 141.3 Ų | 141.3 | 82% | 0.822 | 77% | 0.77 | S | S | * | * | S | Bend | trans | -103.5 | 0.3 | -172.3 | -91.6 | -173.5 | 144.3 | 0 | 0 | 116.3 | ||
| 450 | N | 39 | Very low | 38.5 | Very low | 161 Ų | 161 | 142.6 Ų | 142.6 | 86% | 0.861 | 78% | 0.781 | S | S | * | * | S | Bend | trans | -118.5 | 26.6 | -170.1 | -107.2 | -2.2 | 0 | 0 | 0 | 117.1 | ||
| 451 | C | 34.8 | Very low | 38.4 | Very low | 118 Ų | 118 | 142.9 Ų | 142.9 | 80% | 0.797 | 79% | 0.789 | S | S | * | * | trans | -140.8 | 80.9 | 173.1 | -156 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 452 | C | 33.4 | Very low | 38.1 | Very low | 123 Ų | 123 | 143.9 Ų | 143.9 | 83% | 0.831 | 80% | 0.797 | S | S | * | * | trans | 177.5 | 107 | 148.8 | -97.9 | 0 | 0 | 0 | 0 | 111 | ||||
| 453 | K | 31.9 | Very low | 38 | Very low | 204 Ų | 204 | 145.9 Ų | 145.9 | 89% | 0.887 | 81% | 0.809 | S | S | * | * | trans | 168.7 | 106.8 | 140.2 | -94.4 | 164.4 | -173.7 | 179.4 | 0 | 111.2 | ||||
| 454 | T | 32.8 | Very low | 37.6 | Very low | 143 Ų | 143 | 148.4 Ų | 148.4 | 88% | 0.877 | 83% | 0.825 | S | S | * | * | trans | -141.8 | 115.8 | 148.1 | 41.7 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 455 | V | 39.6 | Very low | 37.2 | Very low | 123 Ų | 123 | 147.3 Ų | 147.3 | 75% | 0.745 | 83% | 0.829 | S | S | * | * | trans | -90.2 | 150.9 | 166.4 | 176.3 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 456 | P | 42.4 | Very low | 36.9 | Very low | 118 Ų | 118 | 147.7 Ų | 147.7 | 77% | 0.766 | 84% | 0.835 | S | S | * | * | -144.3 | 133.1 | 97.2 | 28.9 | -7.5 | 0 | 0 | 0 | 113.4 | |||||
| 457 | E | 33.4 | Very low | 36.7 | Very low | 174 Ų | 174 | 151.7 Ų | 151.7 | 81% | 0.813 | 85% | 0.849 | S | S | * | * | 23.6 | 102.9 | 98.4 | -74.7 | -162.2 | 158.5 | 0 | 0 | 116.4 | |||||
| 458 | I | 34.7 | Very low | 36.4 | Very low | 245 Ų | 245 | 154 Ų | 154 | 100% | 1.256 | 86% | 0.856 | S | S | * | * | -171.4 | 0 | 101 | -83.8 | 161.7 | 0 | 0 | 0 | 108.3 |
Retrieved 458 of 458 residues in 802.7 ms
(Link to these results)