| 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 | 36.1 | Very low | 36 | Very low | 234 Ų | 234 | 151.7 Ų | 151.7 | 100% | 1.153 | 85% | 0.846 | S | S | * | * | 0 | 128.2 | 0 | -37.5 | -177.8 | -158.8 | 0 | 0 | 105.7 | |||||
| 2 | M | 36.2 | Very low | 35.8 | Very low | 157 Ų | 157 | 152.2 Ų | 152.2 | 77% | 0.773 | 85% | 0.846 | S | S | * | * | cis | -130.6 | 157.2 | 0.4 | -58.7 | 179.2 | 164.8 | 0 | 0 | 108.2 | ||||
| 3 | Q | 37.5 | Very low | 35.4 | Very low | 168 Ų | 168 | 145.8 Ų | 145.8 | 79% | 0.785 | 84% | 0.835 | S | S | * | * | 43.3 | 133.3 | 99.1 | -49 | 174.5 | 1.6 | 0 | 0 | 114.4 | |||||
| 4 | D | 33.4 | Very low | 36.3 | Very low | 146 Ų | 146 | 144.6 Ų | 144.6 | 78% | 0.781 | 84% | 0.835 | S | S | * | * | cis | -167.7 | -171 | -10.2 | -132.5 | -74.9 | 0 | 0 | 0 | 110.7 | ||||
| 5 | S | 38.6 | Very low | 36 | Very low | 113 Ų | 113 | 141.5 Ų | 141.5 | 79% | 0.79 | 83% | 0.834 | S | S | * | * | trans | 97.5 | 138.9 | 160.7 | -44.5 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 6 | T | 37.6 | Very low | 35.9 | Very low | 131 Ų | 131 | 142.3 Ų | 142.3 | 80% | 0.804 | 83% | 0.833 | S | S | * | * | trans | -96.1 | 143.1 | -178.4 | 49.8 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 7 | T | 37.8 | Very low | 36.1 | Very low | 139 Ų | 139 | 144.8 Ų | 144.8 | 85% | 0.853 | 84% | 0.835 | S | S | * | * | trans | -147.8 | 121.6 | 150.6 | -18.2 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 8 | E | 35.6 | Very low | 36 | Very low | 193 Ų | 193 | 146.3 Ų | 146.3 | 90% | 0.902 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -89.7 | 141 | -178.8 | -58.5 | -167.6 | 127 | 0 | 0 | 111.4 | ||
| 9 | T | 37.1 | Very low | 35.8 | Very low | 139 Ų | 139 | 142.5 Ų | 142.5 | 85% | 0.853 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -95.1 | 125.6 | -167.9 | 38.4 | 0 | 0 | 0 | 0 | 113.9 | ||
| 10 | V | 36 | Very low | 35.6 | Very low | 137 Ų | 137 | 139.3 Ų | 139.3 | 83% | 0.83 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 141.8 | 161.3 | 151.8 | 0 | 0 | 0 | 0 | 110.5 | ||
| 11 | S | 30.3 | Very low | 35.4 | Very low | 112 Ų | 112 | 137.7 Ų | 137.7 | 78% | 0.783 | 84% | 0.836 | S | S | * | * | trans | -147.3 | 153.2 | 158.9 | -162.2 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 12 | N | 33.6 | Very low | 35.1 | Very low | 157 Ų | 157 | 134.3 Ų | 134.3 | 84% | 0.84 | 82% | 0.822 | S | S | * | * | trans | -81.7 | 165.3 | -173.8 | -53.8 | -85.1 | 0 | 0 | 0 | 110.9 | ||||
| 13 | G | 30.1 | Very low | 35.3 | Very low | 69 Ų | 69 | 135 Ų | 135 | 71% | 0.711 | 83% | 0.826 | S | S | * | * | cis | 167 | -154.6 | 7.8 | 0 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 14 | P | 48.8 | Very low | 34.9 | Very low | 129 Ų | 129 | 134.1 Ų | 134.1 | 84% | 0.838 | 83% | 0.826 | S | S | * | * | cis | -134 | 176.5 | -15.7 | 42.4 | -26.3 | 0 | 0 | 0 | 114.6 | ||||
| 15 | A | 32 | Very low | 34.7 | Very low | 98 Ų | 98 | 131.8 Ų | 131.8 | 81% | 0.81 | 82% | 0.822 | S | S | * | * | trans | 13.5 | 130 | 155.3 | 0 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 16 | N | 34.3 | Very low | 34.6 | Very low | 154 Ų | 154 | 133.1 Ų | 133.1 | 82% | 0.824 | 83% | 0.825 | S | S | * | * | trans | -137.6 | 168.3 | 132.8 | -158.7 | -0.5 | 0 | 0 | 0 | 109.9 | ||||
| 17 | Q | 39.4 | Very low | 34.3 | Very low | 185 Ų | 185 | 135.1 Ų | 135.1 | 86% | 0.864 | 83% | 0.83 | S | S | * | * | trans | -98.9 | 162.3 | -152.2 | -65.6 | 166 | 100 | 0 | 0 | 114.9 | ||||
| 18 | N | 33.5 | Very low | 34.2 | Very low | 173 Ų | 173 | 138 Ų | 138 | 93% | 0.925 | 83% | 0.825 | S | S | * | * | trans | -112.7 | 158.4 | -175.6 | -173.7 | 17 | 0 | 0 | 0 | 110.9 | ||||
| 19 | G | 31.9 | Very low | 34.1 | Very low | 73 Ų | 73 | 136.5 Ų | 136.5 | 75% | 0.753 | 82% | 0.818 | S | S | * | * | trans | 140.9 | 118.1 | 169.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 20 | G | 33.3 | Very low | 33.7 | Very low | 78 Ų | 78 | 133.3 Ų | 133.3 | 80% | 0.804 | 81% | 0.813 | S | S | * | * | trans | -144.8 | 153.4 | 169.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 21 | A | 31.4 | Very low | 33.7 | Very low | 106 Ų | 106 | 133.2 Ų | 133.2 | 88% | 0.876 | 81% | 0.813 | S | S | * | * | trans | -164.4 | 127.8 | 169.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 22 | N | 28 | Very low | 34.4 | Very low | 163 Ų | 163 | 133.3 Ų | 133.3 | 87% | 0.872 | 81% | 0.811 | S | S | * | * | -168.5 | 149.5 | 119.3 | -153.1 | -13.9 | 0 | 0 | 0 | 109.5 | |||||
| 23 | M | 41 | Very low | 34.7 | Very low | 172 Ų | 172 | 135.2 Ų | 135.2 | 85% | 0.847 | 81% | 0.812 | S | S | * | * | trans | -153.4 | 120.3 | 179 | 62.3 | -168 | -177.8 | 0 | 0 | 109.5 | ||||
| 24 | D | 30.2 | Very low | 35.2 | Very low | 149 Ų | 149 | 137.9 Ų | 137.9 | 80% | 0.797 | 82% | 0.819 | S | S | * | * | trans | -165 | 165.7 | 162.3 | -145.1 | -78.6 | 0 | 0 | 0 | 113 | ||||
| 25 | S | 29.2 | Very low | 34.6 | Very low | 98 Ų | 98 | 136.4 Ų | 136.4 | 69% | 0.685 | 82% | 0.818 | S | S | * | * | trans | 63.5 | 77.1 | 154.2 | -72.7 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 26 | V | 34.9 | Very low | 34.9 | Very low | 141 Ų | 141 | 137.9 Ų | 137.9 | 86% | 0.855 | 82% | 0.817 | S | S | * | * | 7.4 | 126.4 | 124.3 | 179.8 | 0 | 0 | 0 | 0 | 117.1 | |||||
| 27 | L | 32 | Very low | 35 | Very low | 172 Ų | 172 | 136 Ų | 136 | 90% | 0.901 | 81% | 0.813 | S | S | * | * | trans | -134.2 | 155.2 | 149.1 | -169.1 | 58.5 | 0 | 0 | 0 | 110.7 | ||||
| 28 | R | 35.1 | Very low | 35.1 | Very low | 201 Ų | 201 | 134 Ų | 134 | 76% | 0.758 | 81% | 0.808 | S | S | * | * | trans | -82.1 | 136.7 | -166.1 | -93.7 | -172.4 | -175.5 | -109.3 | 9.5 | 115 | ||||
| 29 | E | 33.3 | Very low | 35.7 | Very low | 160 Ų | 160 | 131.1 Ų | 131.1 | 75% | 0.748 | 80% | 0.796 | S | S | * | * | 47.4 | 104.1 | 116.3 | -156.7 | -179.1 | 169.7 | 0 | 0 | 117.8 | |||||
| 30 | G | 28.6 | Very low | 36.3 | Very low | 73 Ų | 73 | 134.1 Ų | 134.1 | 75% | 0.753 | 80% | 0.795 | S | S | * | * | trans | -170.7 | 112.7 | 171 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 31 | T | 37.6 | Very low | 37.1 | Very low | 135 Ų | 135 | 134.6 Ų | 134.6 | 83% | 0.828 | 78% | 0.782 | S | S | * | * | trans | -151.2 | 121 | 165.7 | -70.3 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 32 | P | 45.4 | Very low | 38.5 | Very low | 113 Ų | 113 | 132.9 Ų | 132.9 | 73% | 0.734 | 76% | 0.761 | S | S | * | * | -142 | 123.8 | 124.7 | 33.3 | -18 | 0 | 0 | 0 | 114.4 | |||||
| 33 | K | 38.7 | Very low | 39.6 | Very low | 198 Ų | 198 | 129.2 Ų | 129.2 | 86% | 0.861 | 75% | 0.753 | S | S | * | * | trans | 56.1 | 135.8 | 134.6 | -61.3 | 178.1 | 177.2 | 177.4 | 0 | 121.1 | ||||
| 34 | S | 40.4 | Very low | 40.1 | Very low | 124 Ų | 124 | 124.2 Ų | 124.2 | 87% | 0.867 | 74% | 0.739 | S | S | * | * | trans | 84.7 | 79.4 | 146.9 | -164.2 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 35 | A | 35.8 | Very low | 40.8 | Very low | 99 Ų | 99 | 121.2 Ų | 121.2 | 82% | 0.818 | 72% | 0.723 | S | S | * | * | trans | -131.7 | 148.7 | 140.6 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 36 | T | 38.2 | Very low | 41.9 | Very low | 128 Ų | 128 | 121.8 Ų | 121.8 | 79% | 0.785 | 72% | 0.718 | S | S | * | * | trans | -61.8 | 142.9 | -176.7 | -25.1 | 0 | 0 | 0 | 0 | 111.6 | L38 | T36-L38 PolarHBondContact O-N 3.13Š| ||
| 37 | P | 36.5 | Very low | 42.7 | Very low | 115 Ų | 115 | 119.6 Ų | 119.6 | 75% | 0.747 | 70% | 0.701 | S | S | * | * | trans | -69.8 | 87.7 | 161.8 | 30.3 | -33.4 | 0 | 0 | 0 | 108.8 | V39 | P37-V39 PolarHBondContact O-N 3.3Š| ||
| 38 | L | 42.8 | Very low | 43.7 | Very low | 144 Ų | 144 | 117.2 Ų | 117.2 | 75% | 0.754 | 69% | 0.685 | S | S | * | * | trans | -65.1 | 103.2 | 161 | -179.8 | 66.3 | 0 | 0 | 0 | 106.5 | T36 D40 | T36-L38 PolarHBondContact O-N 3.13Å; L38-D40 PolarHBondContact O-N 3.27Å; L38-D40 VanDerWaalsContact O-N 3.13Å | ||
| 39 | V | 46.3 | Very low | 44.6 | Very low | 111 Ų | 111 | 112.7 Ų | 112.7 | 67% | 0.673 | 68% | 0.675 | S | S | * | * | trans | -70.9 | 106.8 | 170.7 | -179.7 | 0 | 0 | 0 | 0 | 106.4 | P37 V41 | P37-V39 PolarHBondContact O-N 3.3Å; V39-V41 HydrophobicContact CG1-CG2 4.13Å; V39-V41 PolarHBondContact O-N 3.45Å | ||
| 40 | D | 43.8 | Very low | 45.8 | Very low | 137 Ų | 137 | 111.2 Ų | 111.2 | 73% | 0.733 | 67% | 0.668 | S | S | * | * | trans | -64.9 | 85.2 | 166.5 | -87 | -46.1 | 0 | 0 | 0 | 108.6 | L38 T42 | L38-D40 PolarHBondContact O-N 3.27Å; L38-D40 VanDerWaalsContact O-N 3.13Å; D40-T42 PolarHBondContact O-N 3.41Å | ||
| 41 | V | 50.9 | Low | 47 | Very low | 87 Ų | 87 | 113.4 Ų | 113.4 | 53% | 0.527 | 66% | 0.659 | S | S | . | * | trans | -63.5 | 102.8 | 171.3 | 178 | 0 | 0 | 0 | 0 | 106.7 | V39 D45 L46 | V39-V41 HydrophobicContact CG1-CG2 4.13Å; V39-V41 PolarHBondContact O-N 3.45Å; V41-D45 HydrophobicContact CG1-CB 3.91Å; V41-L46 HydrophobicContact CG1-CB 4.33Å | ||
| 42 | T | 59 | Low | 48.4 | Very low | 70 Ų | 70 | 112 Ų | 112 | 43% | 0.429 | 64% | 0.643 | S | S | . | * | trans | -63.5 | 155.3 | -174.5 | 74.5 | 0 | 0 | 0 | 0 | 110.2 | D40 A44 D45 L46 | D40-T42 PolarHBondContact O-N 3.41Å; T42-A44 PolarHBondContact O-N 3.34Å; T42-A44 PolarHBondContact OG1-N 3.47Å; T42-D45 WeakPolarHBondContact CB-OD2 3.3Å; T42-D45 PolarHBondContact N-OD2 2.98Å; T42-D45 PolarHBondContact O-N 3.34Å; T42-D45 PolarHBondContact OG1-N 2.97Å; T42-D45 PolarHBondContact OG1-OD2 3.26Å; T42-L46 PolarHBondContact O-N 3.19Å | ||
| 43 | A | 51.4 | Low | 48.8 | Very low | 87 Ų | 87 | 112.9 Ų | 112.9 | 72% | 0.719 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -57.9 | -24.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | L47 | A43-L47 VanDerWaalsContact O-CB 3.26Å; A43-L47 WeakPolarHBondContact O-CB 3.4Å; A43-L47 PolarHBondContact O-N 3.13Å; A43-L47 VanDerWaalsContact O-N 3.1Å |
| 44 | A | 51 | Low | 49.5 | Very low | 67 Ų | 67 | 106.3 Ų | 106.3 | 55% | 0.554 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -70.6 | -44.6 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | T42 L47 H48 | T42-A44 PolarHBondContact O-N 3.34Å; T42-A44 PolarHBondContact OG1-N 3.47Å; A44-L47 PolarHBondContact O-N 2.78Å; A44-H48 VanDerWaalsContact O-CB 3.26Å; A44-H48 WeakPolarHBondContact O-CB 3.26Å; A44-H48 PolarHBondContact O-N 2.88Å |
| 45 | D | 46.6 | Very low | 50.2 | Low | 86 Ų | 86 | 107.6 Ų | 107.6 | 46% | 0.46 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -64 | -41.5 | 176.3 | -65.8 | -63.5 | 0 | 0 | 0 | 112 | V41 T42 H48 L49 | V41-D45 HydrophobicContact CG1-CB 3.91Å; T42-D45 WeakPolarHBondContact CB-OD2 3.3Å; T42-D45 PolarHBondContact N-OD2 2.98Å; T42-D45 PolarHBondContact O-N 3.34Å; T42-D45 PolarHBondContact OG1-N 2.97Å; T42-D45 PolarHBondContact OG1-OD2 3.26Å; D45-H48 PolarHBondContact O-N 2.91Å; D45-L49 VanDerWaalsContact O-CB 3.28Å; D45-L49 WeakPolarHBondContact O-CB 3.32Å; D45-L49 PolarHBondContact O-N 3.03Å |
| 46 | L | 52.4 | Low | 51.4 | Low | 109 Ų | 109 | 107.6 Ų | 107.6 | 57% | 0.571 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -66.3 | -39.6 | 177.1 | -171.7 | 61.5 | 0 | 0 | 0 | 111.8 | V41 T42 Q50 | V41-L46 HydrophobicContact CG1-CB 4.33Å; T42-L46 PolarHBondContact O-N 3.19Å; L46-Q50 WeakPolarHBondContact O-CB 3.49Å; L46-Q50 PolarHBondContact O-N 3.41Å |
| 47 | L | 51.4 | Low | 52.6 | Low | 96 Ų | 96 | 105.4 Ų | 105.4 | 50% | 0.503 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -65.8 | -39.9 | 173.5 | -175 | 70.3 | 0 | 0 | 0 | 111.8 | A43 A44 Q50 Q51 | A43-L47 VanDerWaalsContact O-CB 3.26Å; A43-L47 WeakPolarHBondContact O-CB 3.4Å; A43-L47 PolarHBondContact O-N 3.13Å; A43-L47 VanDerWaalsContact O-N 3.1Å; A44-L47 PolarHBondContact O-N 2.78Å; L47-Q50 PolarHBondContact O-N 2.97Å; L47-Q51 VanDerWaalsContact O-CB 3.32Å; L47-Q51 WeakPolarHBondContact O-CB 3.36Å; L47-Q51 PolarHBondContact O-N 3.28Å |
| 48 | H | 52.4 | Low | 53.4 | Low | 122 Ų | 122 | 102.7 Ų | 102.7 | 57% | 0.565 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -70 | -38.1 | 179.1 | -162 | -164.3 | 0 | 0 | 0 | 111.3 | A44 D45 Q51 H52 | A44-H48 VanDerWaalsContact O-CB 3.26Å; A44-H48 WeakPolarHBondContact O-CB 3.26Å; A44-H48 PolarHBondContact O-N 2.88Å; D45-H48 PolarHBondContact O-N 2.91Å; H48-Q51 PolarHBondContact O-N 3.01Å; H48-H52 VanDerWaalsContact O-CB 3.22Å; H48-H52 WeakPolarHBondContact O-CB 3.48Å; H48-H52 PolarHBondContact O-N 3.15Å |
| 49 | L | 54.8 | Low | 54.3 | Low | 106 Ų | 106 | 102.6 Ų | 102.6 | 56% | 0.555 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -64.2 | -43.4 | 171.1 | -179.1 | 60.9 | 0 | 0 | 0 | 111.8 | D45 H52 Q53 | D45-L49 VanDerWaalsContact O-CB 3.28Å; D45-L49 WeakPolarHBondContact O-CB 3.32Å; D45-L49 PolarHBondContact O-N 3.03Å; L49-H52 PolarHBondContact O-N 3.05Å; L49-Q53 WeakPolarHBondContact O-CB 3.45Å; L49-Q53 PolarHBondContact O-N 3.33Å |
| 50 | Q | 57.5 | Low | 54.7 | Low | 128 Ų | 128 | 103.5 Ų | 103.5 | 60% | 0.598 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -65.5 | -41.9 | 176.2 | -170.5 | 176.5 | 38.2 | 0 | 0 | 111.8 | L46 L47 Q53 A54 | L46-Q50 WeakPolarHBondContact O-CB 3.49Å; L46-Q50 PolarHBondContact O-N 3.41Å; L47-Q50 PolarHBondContact O-N 2.97Å; Q50-Q53 PolarHBondContact O-N 2.98Å; Q50-A54 WeakPolarHBondContact O-CB 3.25Å; Q50-A54 PolarHBondContact O-N 3.18Å |
| 51 | Q | 54 | Low | 55.5 | Low | 119 Ų | 119 | 101.9 Ų | 101.9 | 56% | 0.556 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -60.7 | -46.7 | 173.1 | -172.4 | -166.4 | 108.8 | 0 | 0 | 110.9 | L47 H48 Q53 A54 F55 | L47-Q51 VanDerWaalsContact O-CB 3.32Å; L47-Q51 WeakPolarHBondContact O-CB 3.36Å; L47-Q51 PolarHBondContact O-N 3.28Å; H48-Q51 PolarHBondContact O-N 3.01Å; Q51-Q53 PolarHBondContact O-N 3.45Å; Q51-A54 PolarHBondContact O-N 3.35Å; Q51-F55 WeakPolarHBondContact O-CB 3.33Å; Q51-F55 PolarHBondContact O-N 3.39Å |
| 52 | H | 67.8 | Low | 55.9 | Low | 105 Ų | 105 | 102.9 Ų | 102.9 | 49% | 0.486 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -61.9 | -43.8 | 178.3 | -175.6 | 94.2 | 0 | 0 | 0 | 111.8 | H48 L49 F55 Q56 | H48-H52 VanDerWaalsContact O-CB 3.22Å; H48-H52 WeakPolarHBondContact O-CB 3.48Å; H48-H52 PolarHBondContact O-N 3.15Å; L49-H52 PolarHBondContact O-N 3.05Å; H52-F55 PolarHBondContact O-N 2.9Å; H52-Q56 PolarHBondContact NE2-NE2 3Å; H52-Q56 WeakPolarHBondContact O-CG 3.45Å; H52-Q56 PolarHBondContact O-N 3.11Å |
| 53 | Q | 53.9 | Low | 56 | Low | 132 Ų | 132 | 103.5 Ų | 103.5 | 62% | 0.617 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -63.7 | -43.2 | 176.7 | -167.8 | 175.2 | 50.3 | 0 | 0 | 111.5 | L49 Q50 Q51 F55 Q56 V57 | L49-Q53 WeakPolarHBondContact O-CB 3.45Å; L49-Q53 PolarHBondContact O-N 3.33Å; Q50-Q53 PolarHBondContact O-N 2.98Å; Q51-Q53 PolarHBondContact O-N 3.45Å; Q53-F55 VanDerWaalsContact C-N 3.34Å; Q53-F55 PolarHBondContact O-N 2.73Å; Q53-Q56 PolarHBondContact O-N 2.69Å; Q53-V57 WeakPolarHBondContact O-CG2 3.36Å; Q53-V57 PolarHBondContact O-N 3.32Å |
| 54 | A | 52.6 | Low | 56.4 | Low | 61 Ų | 61 | 105.8 Ų | 105.8 | 50% | 0.504 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -61.8 | -40 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q50 Q51 V57 A58 | Q50-A54 WeakPolarHBondContact O-CB 3.25Å; Q50-A54 PolarHBondContact O-N 3.18Å; Q51-A54 PolarHBondContact O-N 3.35Å; A54-V57 PolarHBondContact O-N 2.97Å; A54-A58 WeakPolarHBondContact O-CB 3.33Å; A54-A58 PolarHBondContact O-N 2.97Å |
| 55 | F | 54.3 | Low | 56.6 | Low | 150 Ų | 150 | 107.3 Ų | 107.3 | 66% | 0.658 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -68.5 | -36.3 | 177.6 | -146.4 | -85.7 | 0 | 0 | 0 | 112.3 | Q51 H52 Q53 R59 | Q51-F55 WeakPolarHBondContact O-CB 3.33Å; Q51-F55 PolarHBondContact O-N 3.39Å; H52-F55 PolarHBondContact O-N 2.9Å; Q53-F55 VanDerWaalsContact C-N 3.34Å; Q53-F55 PolarHBondContact O-N 2.73Å; F55-R59 WeakPolarHBondContact O-CB 3.5Å; F55-R59 PolarHBondContact O-N 2.76Å |
| 56 | Q | 61.3 | Low | 56.9 | Low | 99 Ų | 99 | 109 Ų | 109 | 46% | 0.463 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -65.4 | -44.2 | 172 | -70.5 | -143.1 | 56.8 | 0 | 0 | 112 | H52 Q53 R59 Q60 | H52-Q56 PolarHBondContact NE2-NE2 3Å; H52-Q56 WeakPolarHBondContact O-CG 3.45Å; H52-Q56 PolarHBondContact O-N 3.11Å; Q53-Q56 PolarHBondContact O-N 2.69Å; Q56-R59 PolarHBondContact O-N 3.03Å; Q56-Q60 WeakPolarHBondContact O-CB 3.4Å; Q56-Q60 PolarHBondContact O-N 2.73Å |
| 57 | V | 64.1 | Low | 56.9 | Low | 82 Ų | 82 | 110.7 Ų | 110.7 | 50% | 0.497 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -62.1 | -44.1 | 175.1 | 171.8 | 0 | 0 | 0 | 0 | 111.3 | Q53 A54 R59 Q60 I61 | Q53-V57 WeakPolarHBondContact O-CG2 3.36Å; Q53-V57 PolarHBondContact O-N 3.32Å; A54-V57 PolarHBondContact O-N 2.97Å; V57-R59 VanDerWaalsContact C-N 3.35Å; V57-R59 PolarHBondContact O-N 3.35Å; V57-Q60 WeakPolarHBondContact O-CB 3.3Å; V57-Q60 PolarHBondContact O-N 3.24Å; V57-I61 HydrophobicContact CG1-CD1 3.82Å; V57-I61 HydrophobicContact CG1-CG1 4.49Å; V57-I61 WeakPolarHBondContact O-CG1 3.45Å; V57-I61 PolarHBondContact O-N 3.31Å |
| 58 | A | 52.7 | Low | 57 | Low | 58 Ų | 58 | 109.3 Ų | 109.3 | 48% | 0.479 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -59.7 | -43.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | A54 Q60 I61 L62 | A54-A58 WeakPolarHBondContact O-CB 3.33Å; A54-A58 PolarHBondContact O-N 2.97Å; A58-Q60 VanDerWaalsContact C-N 3.35Å; A58-Q60 PolarHBondContact O-N 3.42Å; A58-I61 PolarHBondContact O-N 3.49Å; A58-L62 WeakPolarHBondContact O-CB 3.27Å; A58-L62 PolarHBondContact O-N 2.97Å |
| 59 | R | 62 | Low | 57 | Low | 143 Ų | 143 | 109.6 Ų | 109.6 | 54% | 0.54 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -65 | -37.6 | 175.9 | -155.6 | 179.7 | 95.5 | -118.5 | 3.3 | 112.1 | F55 Q56 V57 L62 L63 | F55-R59 WeakPolarHBondContact O-CB 3.5Å; F55-R59 PolarHBondContact O-N 2.76Å; Q56-R59 PolarHBondContact O-N 3.03Å; V57-R59 VanDerWaalsContact C-N 3.35Å; V57-R59 PolarHBondContact O-N 3.35Å; R59-L62 PolarHBondContact O-N 3.33Å; R59-L63 WeakPolarHBondContact O-CB 3.37Å; R59-L63 WeakPolarHBondContact O-CG 3.33Å; R59-L63 PolarHBondContact O-N 3.2Å |
| 60 | Q | 54 | Low | 56.9 | Low | 130 Ų | 130 | 108.3 Ų | 108.3 | 61% | 0.607 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -65.1 | -43.3 | 177.1 | -168.8 | 67 | 83.7 | 0 | 0 | 111.9 | Q56 V57 A58 Q64 | Q56-Q60 WeakPolarHBondContact O-CB 3.4Å; Q56-Q60 PolarHBondContact O-N 2.73Å; V57-Q60 WeakPolarHBondContact O-CB 3.3Å; V57-Q60 PolarHBondContact O-N 3.24Å; A58-Q60 VanDerWaalsContact C-N 3.35Å; A58-Q60 PolarHBondContact O-N 3.42Å; Q60-Q64 PolarHBondContact O-N 3.36Å; Q60-Q64 VanDerWaalsContact O-N 3.09Å |
| 61 | I | 62.3 | Low | 56.6 | Low | 102 Ų | 102 | 109.2 Ų | 109.2 | 52% | 0.523 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -65.7 | -43.2 | 176.2 | -67.4 | 166.6 | 0 | 0 | 0 | 110.9 | V57 A58 L63 Q64 Q65 | V57-I61 HydrophobicContact CG1-CD1 3.82Å; V57-I61 HydrophobicContact CG1-CG1 4.49Å; V57-I61 WeakPolarHBondContact O-CG1 3.45Å; V57-I61 PolarHBondContact O-N 3.31Å; A58-I61 PolarHBondContact O-N 3.49Å; I61-L63 PolarHBondContact O-N 2.91Å; I61-Q64 PolarHBondContact O-N 2.99Å; I61-Q65 PolarHBondContact O-N 2.9Å |
| 62 | L | 58.1 | Low | 56.5 | Low | 109 Ų | 109 | 109 Ų | 109 | 57% | 0.571 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -64 | -40.5 | 178.8 | -170.8 | 66.8 | 0 | 0 | 0 | 112.2 | A58 R59 Q65 Q66 | A58-L62 WeakPolarHBondContact O-CB 3.27Å; A58-L62 PolarHBondContact O-N 2.97Å; R59-L62 PolarHBondContact O-N 3.33Å; L62-Q65 PolarHBondContact O-N 3.43Å; L62-Q66 PolarHBondContact O-N 3.44Å |
| 63 | L | 62.5 | Low | 55.5 | Low | 82 Ų | 82 | 110 Ų | 110 | 43% | 0.429 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -63.8 | -39.5 | 173.9 | -75.7 | 167.3 | 0 | 0 | 0 | 112.1 | R59 I61 Q66 Q67 | R59-L63 WeakPolarHBondContact O-CB 3.37Å; R59-L63 WeakPolarHBondContact O-CG 3.33Å; R59-L63 PolarHBondContact O-N 3.2Å; I61-L63 PolarHBondContact O-N 2.91Å; L63-Q66 PolarHBondContact O-N 2.91Å; L63-Q67 WeakPolarHBondContact O-CB 3.47Å; L63-Q67 PolarHBondContact O-N 2.93Å |
| 64 | Q | 59.2 | Low | 55.1 | Low | 136 Ų | 136 | 107.6 Ų | 107.6 | 64% | 0.636 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -68.6 | -35.8 | 176.5 | -171.1 | 155.8 | 82.2 | 0 | 0 | 112.3 | Q60 I61 Q67 S68 | Q60-Q64 PolarHBondContact O-N 3.36Å; Q60-Q64 VanDerWaalsContact O-N 3.09Å; I61-Q64 PolarHBondContact O-N 2.99Å; Q64-Q67 PolarHBondContact O-N 3.48Å; Q64-S68 PolarHBondContact O-N 2.87Å; Q64-S68 VanDerWaalsContact O-N 3.1Å |
| 65 | Q | 55 | Low | 54.7 | Low | 98 Ų | 98 | 114 Ų | 114 | 46% | 0.458 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -64 | -44.3 | 171.3 | -170.3 | -176.8 | 106.9 | 0 | 0 | 111.8 | I61 L62 S68 Q69 | I61-Q65 PolarHBondContact O-N 2.9Å; L62-Q65 PolarHBondContact O-N 3.43Å; Q65-S68 PolarHBondContact O-N 3.39Å; Q65-Q69 PolarHBondContact O-N 3.44Å |
| 66 | Q | 52.2 | Low | 54.2 | Low | 122 Ų | 122 | 113.1 Ų | 113.1 | 57% | 0.57 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -62.2 | -43.6 | 176.5 | -175.6 | 176.1 | 81.8 | 0 | 0 | 111.8 | L62 L63 S68 Q69 V70 | L62-Q66 PolarHBondContact O-N 3.44Å; L63-Q66 PolarHBondContact O-N 2.91Å; Q66-S68 VanDerWaalsContact C-N 3.33Å; Q66-S68 PolarHBondContact O-N 2.98Å; Q66-Q69 PolarHBondContact O-N 3.3Å; Q66-V70 WeakPolarHBondContact O-CG2 3.48Å; Q66-V70 PolarHBondContact O-N 3.48Å |
| 67 | Q | 52.9 | Low | 53.2 | Low | 145 Ų | 145 | 115 Ų | 115 | 68% | 0.678 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -63.7 | -37.4 | 178.4 | -167.7 | 170 | 65.9 | 0 | 0 | 112.4 | L63 Q64 V70 Q71 | L63-Q67 WeakPolarHBondContact O-CB 3.47Å; L63-Q67 PolarHBondContact O-N 2.93Å; Q64-Q67 PolarHBondContact O-N 3.48Å; Q67-V70 PolarHBondContact O-N 2.96Å; Q67-Q71 PolarHBondContact O-N 3.44Å |
| 68 | S | 52.9 | Low | 52.1 | Low | 66 Ų | 66 | 116.3 Ų | 116.3 | 46% | 0.462 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -63.8 | -42.6 | 172 | -177.3 | 0 | 0 | 0 | 0 | 112.5 | Q64 Q65 Q66 Q71 L72 | Q64-S68 PolarHBondContact O-N 2.87Å; Q64-S68 VanDerWaalsContact O-N 3.1Å; Q65-S68 PolarHBondContact O-N 3.39Å; Q66-S68 VanDerWaalsContact C-N 3.33Å; Q66-S68 PolarHBondContact O-N 2.98Å; S68-Q71 PolarHBondContact O-N 3.36Å; S68-L72 PolarHBondContact O-N 3.03Å; S68-L72 VanDerWaalsContact O-N 3.07Å |
| 69 | Q | 53.6 | Low | 51.4 | Low | 129 Ų | 129 | 116.5 Ų | 116.5 | 60% | 0.603 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -64.2 | -42.2 | 176.5 | -170 | -179 | 98.5 | 0 | 0 | 112.3 | Q65 Q66 Q71 L72 Q73 | Q65-Q69 PolarHBondContact O-N 3.44Å; Q66-Q69 PolarHBondContact O-N 3.3Å; Q69-Q71 PolarHBondContact O-N 3.46Å; Q69-L72 WeakPolarHBondContact O-CB 3.39Å; Q69-L72 PolarHBondContact O-N 2.9Å; Q69-Q73 PolarHBondContact O-N 3.5Å; Q69-Q73 VanDerWaalsContact O-N 3.13Å |
| 70 | V | 52.2 | Low | 50 | Low | 79 Ų | 79 | 115 Ų | 115 | 48% | 0.479 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -61.1 | -44.4 | 174.6 | 171.9 | 0 | 0 | 0 | 0 | 110.8 | Q66 Q67 L72 Q73 T74 | Q66-V70 WeakPolarHBondContact O-CG2 3.48Å; Q66-V70 PolarHBondContact O-N 3.48Å; Q67-V70 PolarHBondContact O-N 2.96Å; V70-L72 VanDerWaalsContact C-N 3.33Å; V70-L72 PolarHBondContact O-N 2.91Å; V70-Q73 PolarHBondContact O-N 3.31Å; V70-T74 PolarHBondContact O-N 2.82Å; V70-T74 PolarHBondContact O-OG1 3.47Å; V70-T74 VanDerWaalsContact O-OG1 3.04Å |
| 71 | Q | 50.4 | Low | 49 | Very low | 147 Ų | 147 | 118.8 Ų | 118.8 | 69% | 0.687 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -64.1 | -35.9 | 179.9 | -166.9 | 172.7 | 62.1 | 0 | 0 | 112.8 | Q67 S68 Q69 Q73 R75 | Q67-Q71 PolarHBondContact O-N 3.44Å; S68-Q71 PolarHBondContact O-N 3.36Å; Q69-Q71 PolarHBondContact O-N 3.46Å; Q71-Q73 VanDerWaalsContact C-N 3.33Å; Q71-R75 PolarHBondContact O-N 3.4Å |
| 72 | L | 52.2 | Low | 47.5 | Very low | 114 Ų | 114 | 119.1 Ų | 119.1 | 60% | 0.597 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -61.6 | -39.7 | 170 | -83.5 | 160.8 | 0 | 0 | 0 | 112.3 | S68 Q69 V70 | S68-L72 PolarHBondContact O-N 3.03Å; S68-L72 VanDerWaalsContact O-N 3.07Å; Q69-L72 WeakPolarHBondContact O-CB 3.39Å; Q69-L72 PolarHBondContact O-N 2.9Å; V70-L72 VanDerWaalsContact C-N 3.33Å; V70-L72 PolarHBondContact O-N 2.91Å |
| 73 | Q | 46.4 | Very low | 46.2 | Very low | 125 Ų | 125 | 119.9 Ų | 119.9 | 58% | 0.584 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -76.2 | -38.7 | -178.8 | -157.7 | 164.9 | 40.5 | 0 | 0 | 112.6 | Q69 V70 Q71 R75 L76 N77 | Q69-Q73 PolarHBondContact O-N 3.5Å; Q69-Q73 VanDerWaalsContact O-N 3.13Å; V70-Q73 PolarHBondContact O-N 3.31Å; Q71-Q73 VanDerWaalsContact C-N 3.33Å; Q73-R75 PolarHBondContact O-N 3.22Å; Q73-L76 PolarHBondContact O-N 2.94Å; Q73-L76 VanDerWaalsContact O-N 3.17Å; Q73-N77 PolarHBondContact O-N 2.99Å |
| 74 | T | 45.6 | Very low | 44.7 | Very low | 82 Ų | 82 | 125.8 Ų | 125.8 | 50% | 0.503 | 66% | 0.661 | S | S | . | * | H | α-helix | trans | -58.2 | -38.5 | 171.7 | -49.3 | 0 | 0 | 0 | 0 | 111.4 | V70 L76 N77 T78 | V70-T74 PolarHBondContact O-N 2.82Å; V70-T74 PolarHBondContact O-OG1 3.47Å; V70-T74 VanDerWaalsContact O-OG1 3.04Å; T74-L76 PolarHBondContact O-N 3.09Å; T74-N77 PolarHBondContact O-N 3.08Å; T74-T78 PolarHBondContact O-N 3.47Å; T74-T78 PolarHBondContact O-OG1 2.85Å |
| 75 | R | 45 | Very low | 43.2 | Very low | 196 Ų | 196 | 127.6 Ų | 127.6 | 74% | 0.74 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -75.2 | -7.6 | -178.8 | -154.5 | -105 | -78.6 | -115.9 | -0 | 114.4 | Q71 Q73 | Q71-R75 PolarHBondContact O-N 3.4Å; Q73-R75 PolarHBondContact O-N 3.22Å |
| 76 | L | 42.8 | Very low | 41.8 | Very low | 131 Ų | 131 | 128 Ų | 128 | 69% | 0.686 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -86.4 | -43 | 166.3 | -76.1 | 166.2 | 0 | 0 | 0 | 111.6 | Q73 T74 T78 G79 | Q73-L76 PolarHBondContact O-N 2.94Å; Q73-L76 VanDerWaalsContact O-N 3.17Å; T74-L76 PolarHBondContact O-N 3.09Å; L76-T78 VanDerWaalsContact C-N 3.28Å; L76-T78 PolarHBondContact O-N 3.27Å; L76-G79 PolarHBondContact O-N 3.44Å |
| 77 | N | 40.5 | Very low | 40.8 | Very low | 140 Ų | 140 | 129.6 Ų | 129.6 | 75% | 0.749 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -71.8 | -16.5 | -174.7 | -76.9 | 18.6 | 0 | 0 | 0 | 114.6 | Q73 T74 | Q73-N77 PolarHBondContact O-N 2.99Å; T74-N77 PolarHBondContact O-N 3.08Å |
| 78 | T | 41.1 | Very low | 39.7 | Very low | 109 Ų | 109 | 132.2 Ų | 132.2 | 67% | 0.669 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.5 | -3.9 | 178.9 | 50.8 | 0 | 0 | 0 | 0 | 114.8 | T74 L76 | T74-T78 PolarHBondContact O-N 3.47Å; T74-T78 PolarHBondContact O-OG1 2.85Å; L76-T78 VanDerWaalsContact C-N 3.28Å; L76-T78 PolarHBondContact O-N 3.27Å |
| 79 | G | 38.9 | Very low | 38.5 | Very low | 62 Ų | 62 | 137.4 Ų | 137.4 | 64% | 0.639 | 73% | 0.726 | S | S | * | * | S | Bend | trans | -89.4 | -14.4 | -169.5 | 0 | 0 | 0 | 0 | 0 | 117.4 | L76 | L76-G79 PolarHBondContact O-N 3.44Š|
| 80 | C | 32.6 | Very low | 37.6 | Very low | 112 Ų | 112 | 140.2 Ų | 140.2 | 76% | 0.757 | 74% | 0.739 | S | S | * | * | trans | -108.8 | 93.9 | -164.7 | -66.9 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 81 | K | 33.3 | Very low | 36.4 | Very low | 209 Ų | 209 | 143 Ų | 143 | 91% | 0.909 | 75% | 0.751 | S | S | * | * | trans | -123.6 | 80.1 | 162.9 | -69.6 | -169.8 | -179.3 | -176.6 | 0 | 110.5 | ||||
| 82 | S | 29.8 | Very low | 35.7 | Very low | 109 Ų | 109 | 143.7 Ų | 143.7 | 76% | 0.762 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -78.8 | 135 | -178.8 | -53.3 | 0 | 0 | 0 | 0 | 112.5 | ||
| 83 | P | 30.2 | Very low | 34.6 | Very low | 125 Ų | 125 | 146.3 Ų | 146.3 | 81% | 0.812 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 155.1 | 164.4 | -16 | 30.9 | 0 | 0 | 0 | 111.8 | ||
| 84 | K | 31.8 | Very low | 33.7 | Very low | 206 Ų | 206 | 148.7 Ų | 148.7 | 90% | 0.896 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 140.3 | 172.1 | -73.1 | -177.9 | 173.9 | -178.3 | 0 | 111.6 | ||
| 85 | L | 27.1 | Very low | 32.8 | Very low | 173 Ų | 173 | 150.1 Ų | 150.1 | 91% | 0.906 | 79% | 0.788 | S | S | * | * | trans | -152.7 | 165.4 | 143.2 | -111.2 | 170.1 | 0 | 0 | 0 | 109.8 | ||||
| 86 | S | 26 | Very low | 32.3 | Very low | 108 Ų | 108 | 146 Ų | 146 | 76% | 0.755 | 79% | 0.787 | S | S | * | * | trans | -99.4 | 136.1 | -153.2 | -53.4 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 87 | D | 31.7 | Very low | 31.9 | Very low | 155 Ų | 155 | 145.2 Ų | 145.2 | 83% | 0.829 | 79% | 0.787 | S | S | * | * | trans | 55.8 | 150.6 | 138.1 | -126.9 | -66.8 | 0 | 0 | 0 | 123.4 | ||||
| 88 | K | 29.8 | Very low | 31.6 | Very low | 199 Ų | 199 | 143.7 Ų | 143.7 | 87% | 0.865 | 79% | 0.787 | S | S | * | * | trans | 79.5 | 141.3 | 162.3 | -133 | 165.6 | -179.3 | 173.6 | 0 | 119.6 | ||||
| 89 | Q | 26.8 | Very low | 31.5 | Very low | 176 Ų | 176 | 143.6 Ų | 143.6 | 82% | 0.822 | 79% | 0.786 | S | S | * | * | trans | 80.3 | 74.1 | 168.8 | -159.8 | 155.5 | 68 | 0 | 0 | 119.3 | ||||
| 90 | Q | 36 | Very low | 31.5 | Very low | 187 Ų | 187 | 144.1 Ų | 144.1 | 87% | 0.874 | 78% | 0.784 | S | S | * | * | 35.4 | 105.7 | 118.6 | -175.7 | -179.1 | -6.4 | 0 | 0 | 118.2 | |||||
| 91 | N | 25.8 | Very low | 31.5 | Very low | 137 Ų | 137 | 147 Ų | 147 | 73% | 0.733 | 79% | 0.789 | S | S | * | * | trans | -148.1 | 167.6 | 153.2 | -150 | -21 | 0 | 0 | 0 | 111.5 | ||||
| 92 | Q | 35.3 | Very low | 31.7 | Very low | 163 Ų | 163 | 144 Ų | 144 | 76% | 0.762 | 78% | 0.78 | S | S | * | * | trans | -71.4 | 136.9 | -168.6 | -60.2 | 160.2 | 91.9 | 0 | 0 | 113.2 | ||||
| 93 | L | 29.8 | Very low | 31.8 | Very low | 168 Ų | 168 | 144 Ų | 144 | 88% | 0.88 | 78% | 0.775 | S | S | * | * | trans | -95.3 | 82.4 | 156.1 | -93.5 | 71.7 | 0 | 0 | 0 | 109.5 | V95 | L93-V95 PolarHBondContact O-N 2.95Š| ||
| 94 | Q | 26.9 | Very low | 32.1 | Very low | 175 Ų | 175 | 144 Ų | 144 | 82% | 0.818 | 78% | 0.775 | S | S | * | * | trans | -70.6 | 113.2 | 161.3 | -175.6 | 177.4 | 43.5 | 0 | 0 | 107.7 | P96 | Q94-P96 VanDerWaalsContact O-CD 3.27Å; Q94-P96 WeakPolarHBondContact O-CD 3.43Å | ||
| 95 | V | 27.7 | Very low | 32.1 | Very low | 113 Ų | 113 | 142 Ų | 142 | 69% | 0.685 | 77% | 0.769 | S | S | * | * | trans | -70 | 118.6 | -177.7 | -179.8 | 0 | 0 | 0 | 0 | 109.8 | L93 V97 | L93-V95 PolarHBondContact O-N 2.95Å; V95-V97 VanDerWaalsContact C-N 3.33Å; V95-V97 HydrophobicContact CG1-CG2 4.05Å; V95-V97 PolarHBondContact O-N 3.31Å | ||
| 96 | P | 35 | Very low | 32.8 | Very low | 110 Ų | 110 | 139.6 Ų | 139.6 | 71% | 0.714 | 76% | 0.761 | S | S | * | * | trans | -77.6 | 85.7 | 174.9 | 32.1 | -33 | 0 | 0 | 0 | 109.5 | Q94 S98 | Q94-P96 VanDerWaalsContact O-CD 3.27Å; Q94-P96 WeakPolarHBondContact O-CD 3.43Å; P96-S98 VanDerWaalsContact C-N 3.3Å; P96-S98 PolarHBondContact O-N 2.99Å | ||
| 97 | V | 34 | Very low | 33.8 | Very low | 113 Ų | 113 | 139.8 Ų | 139.8 | 69% | 0.685 | 75% | 0.753 | S | S | * | * | trans | -70.6 | 90.2 | 169.4 | -174.9 | 0 | 0 | 0 | 0 | 108.1 | V95 V99 | V95-V97 VanDerWaalsContact C-N 3.33Å; V95-V97 HydrophobicContact CG1-CG2 4.05Å; V95-V97 PolarHBondContact O-N 3.31Å; V97-V99 HydrophobicContact CG1-CG2 3.85Å; V97-V99 PolarHBondContact O-N 3.34Å | ||
| 98 | S | 34.7 | Very low | 34.7 | Very low | 108 Ų | 108 | 135.8 Ų | 135.8 | 76% | 0.755 | 73% | 0.734 | S | S | * | * | trans | -71.7 | 73.4 | -179.1 | -66.4 | 0 | 0 | 0 | 0 | 112.2 | P96 A100 | P96-S98 VanDerWaalsContact C-N 3.3Å; P96-S98 PolarHBondContact O-N 2.99Å; S98-A100 VanDerWaalsContact C-N 3.33Å; S98-A100 PolarHBondContact O-N 3.49Å | ||
| 99 | V | 37.9 | Very low | 35.6 | Very low | 108 Ų | 108 | 131.4 Ų | 131.4 | 66% | 0.655 | 73% | 0.726 | S | S | * | * | trans | -71 | 88.6 | 170 | -168.8 | 0 | 0 | 0 | 0 | 108.9 | V97 M101 | V97-V99 HydrophobicContact CG1-CG2 3.85Å; V97-V99 PolarHBondContact O-N 3.34Å; V99-M101 HydrophobicContact CG1-CG 4.14Å; V99-M101 PolarHBondContact O-N 3.42Å | ||
| 100 | A | 38.4 | Very low | 36.6 | Very low | 72 Ų | 72 | 130.1 Ų | 130.1 | 60% | 0.595 | 72% | 0.72 | S | S | * | * | trans | -80.5 | 57.4 | -174.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | S98 M102 | S98-A100 VanDerWaalsContact C-N 3.33Å; S98-A100 PolarHBondContact O-N 3.49Å; A100-M102 HydrophobicContact CB-CE 4.05Å; A100-M102 HydrophobicContact CB-CG 4.26Å; A100-M102 PolarHBondContact O-N 2.91Å | ||
| 101 | M | 34 | Very low | 37.3 | Very low | 173 Ų | 173 | 126.1 Ų | 126.1 | 85% | 0.852 | 70% | 0.701 | S | S | * | * | trans | -73.7 | 69.6 | 167.8 | -75.3 | -67.3 | -155.3 | 0 | 0 | 110.3 | V99 | V99-M101 HydrophobicContact CG1-CG 4.14Å; V99-M101 PolarHBondContact O-N 3.42Å | ||
| 102 | M | 36.2 | Very low | 38.5 | Very low | 147 Ų | 147 | 124.9 Ų | 124.9 | 72% | 0.724 | 69% | 0.692 | S | S | * | * | trans | -97 | 110.8 | -178.6 | -44.4 | -48 | -168.1 | 0 | 0 | 110 | A100 | A100-M102 HydrophobicContact CB-CE 4.05Å; A100-M102 HydrophobicContact CB-CG 4.26Å; A100-M102 PolarHBondContact O-N 2.91Å | ||
| 103 | T | 33.3 | Very low | 39.4 | Very low | 109 Ų | 109 | 123.8 Ų | 123.8 | 67% | 0.669 | 69% | 0.687 | S | S | * | * | trans | -54.5 | 152.4 | 151.6 | 33 | 0 | 0 | 0 | 0 | 109.3 | Q105 | T103-Q105 VanDerWaalsContact C-N 3.3Å; T103-Q105 PolarHBondContact O-N 3.44Å | ||
| 104 | P | 36.6 | Very low | 40.3 | Very low | 125 Ų | 125 | 122 Ų | 122 | 81% | 0.812 | 67% | 0.674 | S | S | * | * | trans | -65.3 | 92.5 | 175.4 | 27.3 | -34 | 0 | 0 | 0 | 109.6 | V106 | P104-V106 PolarHBondContact O-N 3.48Š| ||
| 105 | Q | 30.4 | Very low | 41.6 | Very low | 164 Ų | 164 | 117.2 Ų | 117.2 | 77% | 0.766 | 65% | 0.653 | S | S | * | * | trans | -61.1 | 103.8 | 174.1 | -79.4 | -80 | 41.1 | 0 | 0 | 108.5 | T103 I107 | T103-Q105 VanDerWaalsContact C-N 3.3Å; T103-Q105 PolarHBondContact O-N 3.44Å; Q105-I107 PolarHBondContact O-N 2.95Å; Q105-I107 VanDerWaalsContact O-N 3.15Å | ||
| 106 | V | 42 | Very low | 42.6 | Very low | 122 Ų | 122 | 116.3 Ų | 116.3 | 74% | 0.739 | 64% | 0.644 | S | S | * | * | trans | -60.7 | 115.4 | 169 | -78.5 | 0 | 0 | 0 | 0 | 108.2 | P104 T108 | P104-V106 PolarHBondContact O-N 3.48Å; V106-T108 PolarHBondContact O-N 3.36Å | ||
| 107 | I | 47.9 | Very low | 43.2 | Very low | 111 Ų | 111 | 118.9 Ų | 118.9 | 57% | 0.569 | 65% | 0.647 | S | S | * | * | trans | -57.9 | 113.4 | 173.4 | -67.8 | 170.5 | 0 | 0 | 0 | 106.9 | Q105 Q111 | Q105-I107 PolarHBondContact O-N 2.95Å; Q105-I107 VanDerWaalsContact O-N 3.15Å; I107-Q111 HydrophobicContact CG2-CB 4.33Å | ||
| 108 | T | 49.6 | Very low | 43.7 | Very low | 72 Ų | 72 | 121.6 Ų | 121.6 | 44% | 0.442 | 65% | 0.652 | S | S | . | * | trans | -65.1 | 142.7 | -178.6 | 49.5 | 0 | 0 | 0 | 0 | 109.5 | V106 Q110 Q111 M112 | V106-T108 PolarHBondContact O-N 3.36Å; T108-Q110 PolarHBondContact O-N 3.23Å; T108-Q111 PolarHBondContact O-N 3.04Å; T108-M112 PolarHBondContact O-N 3.05Å | ||
| 109 | P | 48.2 | Very low | 44.3 | Very low | 106 Ų | 106 | 119.8 Ų | 119.8 | 69% | 0.688 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -60.4 | -23.1 | -176.7 | 22.7 | -33.3 | 0 | 0 | 0 | 112.7 | Q113 | P109-Q113 WeakPolarHBondContact O-CB 3.25Å; P109-Q113 PolarHBondContact O-N 3.4Å |
| 110 | Q | 49.2 | Very low | 44.6 | Very low | 149 Ų | 149 | 121.1 Ų | 121.1 | 70% | 0.696 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -65.3 | -42.1 | 171.9 | -69.7 | 165.6 | -30.5 | 0 | 0 | 112.6 | T108 Q113 Q114 | T108-Q110 PolarHBondContact O-N 3.23Å; Q110-Q113 PolarHBondContact O-N 3.47Å; Q110-Q114 PolarHBondContact O-N 3.28Å |
| 111 | Q | 49.7 | Very low | 45.2 | Very low | 103 Ų | 103 | 119.7 Ų | 119.7 | 48% | 0.481 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -67.1 | -40.5 | 176.1 | -167.1 | -176.7 | 37.1 | 0 | 0 | 111.1 | I107 T108 Q113 Q114 I115 | I107-Q111 HydrophobicContact CG2-CB 4.33Å; T108-Q111 PolarHBondContact O-N 3.04Å; Q111-Q113 VanDerWaalsContact C-N 3.35Å; Q111-Q113 PolarHBondContact O-N 3.48Å; Q111-Q114 PolarHBondContact O-N 3.41Å; Q111-I115 HydrophobicContact CG-CD1 4.18Å; Q111-I115 WeakPolarHBondContact O-CG1 3.49Å; Q111-I115 PolarHBondContact O-N 2.93Å |
| 112 | M | 50.9 | Low | 46.7 | Very low | 111 Ų | 111 | 113.2 Ų | 113.2 | 55% | 0.547 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -59.1 | -44.8 | 173.4 | -177.7 | -177.9 | 177.7 | 0 | 0 | 111.7 | T108 I115 L116 | T108-M112 PolarHBondContact O-N 3.05Å; M112-I115 PolarHBondContact O-N 3.33Å; M112-L116 PolarHBondContact O-N 3.09Å |
| 113 | Q | 54.8 | Low | 47.7 | Very low | 140 Ų | 140 | 110.9 Ų | 110.9 | 65% | 0.654 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -65.9 | -38 | 178.5 | -171.1 | 174.7 | 96.4 | 0 | 0 | 112.5 | P109 Q110 Q111 L116 Q117 | P109-Q113 WeakPolarHBondContact O-CB 3.25Å; P109-Q113 PolarHBondContact O-N 3.4Å; Q110-Q113 PolarHBondContact O-N 3.47Å; Q111-Q113 VanDerWaalsContact C-N 3.35Å; Q111-Q113 PolarHBondContact O-N 3.48Å; Q113-L116 PolarHBondContact O-N 3.37Å; Q113-Q117 PolarHBondContact O-N 2.97Å |
| 114 | Q | 49.9 | Very low | 48.8 | Very low | 130 Ų | 130 | 111.5 Ų | 111.5 | 61% | 0.607 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -72.8 | -31.1 | 177.8 | -165.7 | 169.3 | 10 | 0 | 0 | 112.9 | Q110 Q111 Q117 | Q110-Q114 PolarHBondContact O-N 3.28Å; Q111-Q114 PolarHBondContact O-N 3.41Å; Q114-Q117 PolarHBondContact O-N 3.43Å |
| 115 | I | 53 | Low | 49.8 | Very low | 75 Ų | 75 | 110.5 Ų | 110.5 | 39% | 0.385 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -64.8 | -47.6 | 169.9 | -71.2 | 166.2 | 0 | 0 | 0 | 110.1 | Q111 M112 Q117 Q118 Q119 | Q111-I115 HydrophobicContact CG-CD1 4.18Å; Q111-I115 WeakPolarHBondContact O-CG1 3.49Å; Q111-I115 PolarHBondContact O-N 2.93Å; M112-I115 PolarHBondContact O-N 3.33Å; I115-Q117 PolarHBondContact O-N 3.05Å; I115-Q117 VanDerWaalsContact O-N 3.13Å; I115-Q118 PolarHBondContact O-N 3.39Å; I115-Q119 HydrophobicContact CG2-CB 4.29Å; I115-Q119 VanDerWaalsContact O-CB 3.26Å; I115-Q119 WeakPolarHBondContact O-CB 3.34Å; I115-Q119 PolarHBondContact O-N 3.1Å |
| 116 | L | 49.6 | Very low | 51.5 | Low | 94 Ų | 94 | 106.5 Ų | 106.5 | 49% | 0.492 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -56.4 | -29 | 177.1 | -109.7 | 72.6 | 0 | 0 | 0 | 113.8 | M112 Q113 | M112-L116 PolarHBondContact O-N 3.09Å; Q113-L116 PolarHBondContact O-N 3.37Å |
| 117 | Q | 46 | Very low | 52.8 | Low | 165 Ų | 165 | 107.5 Ų | 107.5 | 77% | 0.771 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -83.9 | -26.7 | -175.4 | -153.5 | -175.4 | 114.9 | 0 | 0 | 114.1 | Q113 Q114 I115 | Q113-Q117 PolarHBondContact O-N 2.97Å; Q114-Q117 PolarHBondContact O-N 3.43Å; I115-Q117 PolarHBondContact O-N 3.05Å; I115-Q117 VanDerWaalsContact O-N 3.13Å |
| 118 | Q | 45.7 | Very low | 53.8 | Low | 169 Ų | 169 | 106.9 Ų | 106.9 | 79% | 0.79 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -105 | -18.9 | 176.2 | -78.7 | -175.7 | 94.2 | 0 | 0 | 113.7 | I115 | I115-Q118 PolarHBondContact O-N 3.39Å |
| 119 | Q | 46.3 | Very low | 54.8 | Low | 70 Ų | 70 | 106.8 Ų | 106.8 | 33% | 0.327 | 55% | 0.547 | S | S | . | . | trans | -115.3 | 92.9 | -177.6 | -165.3 | 176.2 | 97 | 0 | 0 | 109.2 | I115 L121 | I115-Q119 HydrophobicContact CG2-CB 4.29Å; I115-Q119 VanDerWaalsContact O-CB 3.26Å; I115-Q119 WeakPolarHBondContact O-CB 3.34Å; I115-Q119 PolarHBondContact O-N 3.1Å; Q119-L121 HydrophobicContact CG-CG 4.25Å; Q119-L121 PolarHBondContact O-N 2.96Å | ||
| 120 | V | 44.8 | Very low | 56 | Low | 137 Ų | 137 | 107 Ų | 107 | 83% | 0.83 | 54% | 0.542 | S | S | * | . | trans | -73.6 | 68.7 | 171.1 | -169.6 | 0 | 0 | 0 | 0 | 109.4 | S122 | V120-S122 PolarHBondContact O-N 2.92Š| ||
| 121 | L | 51.5 | Low | 57.4 | Low | 41 Ų | 41 | 104.8 Ų | 104.8 | 22% | 0.215 | 53% | 0.532 | C | S | . | . | trans | -48.9 | 128.3 | 155.3 | -82.7 | 159.9 | 0 | 0 | 0 | 107.7 | Q119 Q125 I208 | Q119-L121 HydrophobicContact CG-CG 4.25Å; Q119-L121 PolarHBondContact O-N 2.96Å; L121-Q125 HydrophobicContact CD2-CB 3.89Å; L121-I208 HydrophobicContact CD2-CD1 3.83Å | ||
| 122 | S | 65.3 | Low | 58.2 | Low | 37 Ų | 37 | 103.8 Ų | 103.8 | 26% | 0.259 | 53% | 0.527 | S | S | . | . | trans | -63 | 150.9 | 177.5 | 95.9 | 0 | 0 | 0 | 0 | 109.7 | V120 Q124 Q125 L126 | V120-S122 PolarHBondContact O-N 2.92Å; S122-Q124 VanDerWaalsContact CB-OE1 3.3Å; S122-Q124 PolarHBondContact O-N 2.83Å; S122-Q124 VanDerWaalsContact O-N 3.11Å; S122-Q124 PolarHBondContact OG-N 2.82Å; S122-Q124 PolarHBondContact OG-OE1 3Å; S122-Q125 WeakPolarHBondContact O-CA 3.43Å; S122-Q125 WeakPolarHBondContact O-CB 3.46Å; S122-Q125 PolarHBondContact O-N 3.31Å; S122-Q125 PolarHBondContact OG-N 3.35Å; S122-L126 PolarHBondContact O-N 2.95Å | ||
| 123 | P | 57.2 | Low | 58.9 | Low | 99 Ų | 99 | 104.5 Ų | 104.5 | 64% | 0.643 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -57.5 | -28.8 | 177.4 | 20.9 | -31.5 | 0 | 0 | 0 | 112.2 | Q127 | P123-Q127 WeakPolarHBondContact O-CB 3.33Å; P123-Q127 PolarHBondContact O-N 3.33Å |
| 124 | Q | 56.6 | Low | 59.7 | Low | 121 Ų | 121 | 103.4 Ų | 103.4 | 57% | 0.565 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -68 | -42 | 171.2 | -54.1 | 84.7 | -0.9 | 0 | 0 | 112.5 | S122 Q127 V128 | S122-Q124 VanDerWaalsContact CB-OE1 3.3Å; S122-Q124 PolarHBondContact O-N 2.83Å; S122-Q124 VanDerWaalsContact O-N 3.11Å; S122-Q124 PolarHBondContact OG-N 2.82Å; S122-Q124 PolarHBondContact OG-OE1 3Å; Q124-Q127 PolarHBondContact O-N 2.88Å; Q124-V128 WeakPolarHBondContact O-CB 3.22Å; Q124-V128 WeakPolarHBondContact O-CG2 3.49Å; Q124-V128 PolarHBondContact O-N 3.19Å |
| 125 | Q | 57.7 | Low | 60.6 | Low | 105 Ų | 105 | 99.9 Ų | 99.9 | 49% | 0.491 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63.2 | -41.2 | 176 | -69.2 | 175.7 | -46.3 | 0 | 0 | 111.7 | L121 S122 V128 L129 | L121-Q125 HydrophobicContact CD2-CB 3.89Å; S122-Q125 WeakPolarHBondContact O-CA 3.43Å; S122-Q125 WeakPolarHBondContact O-CB 3.46Å; S122-Q125 PolarHBondContact O-N 3.31Å; S122-Q125 PolarHBondContact OG-N 3.35Å; Q125-V128 PolarHBondContact O-N 3.08Å; Q125-L129 WeakPolarHBondContact O-CB 3.05Å; Q125-L129 PolarHBondContact O-N 2.88Å |
| 126 | L | 65 | Low | 61.4 | Low | 80 Ų | 80 | 98 Ų | 98 | 42% | 0.419 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.3 | -41.5 | 175.6 | -170.6 | 69 | 0 | 0 | 0 | 111.8 | S122 L129 L130 | S122-L126 PolarHBondContact O-N 2.95Å; L126-L129 PolarHBondContact O-N 2.89Å; L126-L130 PolarHBondContact O-N 3.36Å |
| 127 | Q | 69.6 | Low | 62.3 | Low | 143 Ų | 143 | 98.7 Ų | 98.7 | 67% | 0.668 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -66.3 | -40.3 | 177.2 | -168.2 | 168.9 | 31.7 | 0 | 0 | 112.1 | P123 Q124 L130 Q131 | P123-Q127 WeakPolarHBondContact O-CB 3.33Å; P123-Q127 PolarHBondContact O-N 3.33Å; Q124-Q127 PolarHBondContact O-N 2.88Å; Q127-L130 PolarHBondContact O-N 3.44Å; Q127-Q131 WeakPolarHBondContact O-CB 3.34Å; Q127-Q131 PolarHBondContact O-N 3Å |
| 128 | V | 69.6 | Low | 63.7 | Low | 98 Ų | 98 | 95.1 Ų | 95.1 | 59% | 0.594 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -64.1 | -41.5 | 173.2 | 169.1 | 0 | 0 | 0 | 0 | 111.4 | Q124 Q125 Q131 Q132 | Q124-V128 WeakPolarHBondContact O-CB 3.22Å; Q124-V128 WeakPolarHBondContact O-CG2 3.49Å; Q124-V128 PolarHBondContact O-N 3.19Å; Q125-V128 PolarHBondContact O-N 3.08Å; V128-Q131 PolarHBondContact O-N 3.3Å; V128-Q132 VanDerWaalsContact O-CB 3.3Å; V128-Q132 WeakPolarHBondContact O-CB 3.47Å; V128-Q132 PolarHBondContact O-N 3.46Å |
| 129 | L | 69.8 | Low | 64.7 | Low | 69 Ų | 69 | 91 Ų | 91 | 36% | 0.361 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -64.1 | -41.6 | 177.1 | -177.6 | 64.1 | 0 | 0 | 0 | 111.9 | Q125 L126 Q132 Q133 | Q125-L129 WeakPolarHBondContact O-CB 3.05Å; Q125-L129 PolarHBondContact O-N 2.88Å; L126-L129 PolarHBondContact O-N 2.89Å; L129-Q132 PolarHBondContact O-N 2.95Å; L129-Q133 PolarHBondContact O-N 3.35Å |
| 130 | L | 74.8 | Confident | 65.6 | Low | 111 Ų | 111 | 91.5 Ų | 91.5 | 58% | 0.581 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -67.7 | -41.3 | 176 | -170.6 | 66.6 | 0 | 0 | 0 | 111.8 | L126 Q127 Q132 Q133 Q134 | L126-L130 PolarHBondContact O-N 3.36Å; Q127-L130 PolarHBondContact O-N 3.44Å; L130-Q132 VanDerWaalsContact C-N 3.33Å; L130-Q132 PolarHBondContact O-N 2.98Å; L130-Q133 PolarHBondContact O-N 3.42Å; L130-Q134 PolarHBondContact O-N 3.31Å |
| 131 | Q | 77.6 | Confident | 67.1 | Low | 103 Ų | 103 | 90.6 Ų | 90.6 | 48% | 0.481 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -61.8 | -41.7 | 174.8 | -170.8 | 77.3 | 96.4 | 0 | 0 | 111.4 | Q127 V128 Q134 A135 | Q127-Q131 WeakPolarHBondContact O-CB 3.34Å; Q127-Q131 PolarHBondContact O-N 3Å; V128-Q131 PolarHBondContact O-N 3.3Å; Q131-Q134 PolarHBondContact O-N 3.2Å; Q131-A135 WeakPolarHBondContact O-CB 3.23Å; Q131-A135 PolarHBondContact O-N 2.9Å |
| 132 | Q | 67.2 | Low | 67.7 | Low | 82 Ų | 82 | 95 Ų | 95 | 38% | 0.383 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.2 | -44.1 | 175.3 | -172.6 | -161.1 | 96.5 | 0 | 0 | 111.4 | V128 L129 L130 Q134 A135 L136 | V128-Q132 VanDerWaalsContact O-CB 3.3Å; V128-Q132 WeakPolarHBondContact O-CB 3.47Å; V128-Q132 PolarHBondContact O-N 3.46Å; L129-Q132 PolarHBondContact O-N 2.95Å; L130-Q132 VanDerWaalsContact C-N 3.33Å; L130-Q132 PolarHBondContact O-N 2.98Å; Q132-Q134 VanDerWaalsContact C-N 3.33Å; Q132-Q134 PolarHBondContact O-N 3.32Å; Q132-A135 PolarHBondContact O-N 3.27Å; Q132-L136 WeakPolarHBondContact O-CB 3.31Å; Q132-L136 PolarHBondContact O-N 3.11Å |
| 133 | Q | 65.6 | Low | 67.7 | Low | 125 Ų | 125 | 95.9 Ų | 95.9 | 58% | 0.584 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -60.2 | -42 | 175.7 | -173.4 | -173 | 101.9 | 0 | 0 | 111.7 | L129 L130 L136 M137 | L129-Q133 PolarHBondContact O-N 3.35Å; L130-Q133 PolarHBondContact O-N 3.42Å; Q133-L136 PolarHBondContact O-N 3.13Å; Q133-M137 PolarHBondContact O-N 2.75Å |
| 134 | Q | 70.7 | Confident | 67.9 | Low | 117 Ų | 117 | 96.3 Ų | 96.3 | 55% | 0.547 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -67.2 | -41.2 | 177.2 | -171.2 | 174.3 | 57.7 | 0 | 0 | 112.2 | L130 Q131 Q132 L136 M137 L138 | L130-Q134 PolarHBondContact O-N 3.31Å; Q131-Q134 PolarHBondContact O-N 3.2Å; Q132-Q134 VanDerWaalsContact C-N 3.33Å; Q132-Q134 PolarHBondContact O-N 3.32Å; Q134-L136 VanDerWaalsContact C-N 3.34Å; Q134-L136 PolarHBondContact O-N 3.22Å; Q134-M137 PolarHBondContact O-N 3.11Å; Q134-L138 PolarHBondContact O-N 3.16Å |
| 135 | A | 70.3 | Confident | 68.4 | Low | 57 Ų | 57 | 96.8 Ų | 96.8 | 47% | 0.471 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -64.4 | -37.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q131 Q132 L138 Q139 | Q131-A135 WeakPolarHBondContact O-CB 3.23Å; Q131-A135 PolarHBondContact O-N 2.9Å; Q132-A135 PolarHBondContact O-N 3.27Å; A135-L138 PolarHBondContact O-N 3.47Å; A135-Q139 WeakPolarHBondContact O-CB 3.25Å; A135-Q139 PolarHBondContact O-N 3.36Å |
| 136 | L | 68.2 | Low | 68.9 | Low | 36 Ų | 36 | 98 Ų | 98 | 19% | 0.188 | 49% | 0.486 | C | S | . | . | H | α-helix | trans | -63.3 | -44.1 | 174.6 | -173 | 160.3 | 0 | 0 | 0 | 111.4 | Q132 Q133 Q134 Q139 Q140 L197 L200 | Q132-L136 WeakPolarHBondContact O-CB 3.31Å; Q132-L136 PolarHBondContact O-N 3.11Å; Q133-L136 PolarHBondContact O-N 3.13Å; Q134-L136 VanDerWaalsContact C-N 3.34Å; Q134-L136 PolarHBondContact O-N 3.22Å; L136-Q139 PolarHBondContact O-N 3.37Å; L136-Q140 PolarHBondContact O-N 2.99Å; L136-L197 HydrophobicContact CD2-CD1 4.08Å; L136-L200 HydrophobicContact CD1-CB 4.27Å; L136-L200 HydrophobicContact CD1-CD2 4.26Å; L136-L200 HydrophobicContact CD1-CG 3.82Å; L136-L200 HydrophobicContact CG-CD2 3.79Å; L136-L200 HydrophobicContact CG-CG 3.93Å |
| 137 | M | 69.4 | Low | 68.6 | Low | 108 Ų | 108 | 96.6 Ų | 96.6 | 53% | 0.532 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -60.5 | -46.5 | 173.2 | -173.6 | -145.8 | -60.9 | 0 | 0 | 111.7 | Q133 Q134 Q139 Q140 Q141 | Q133-M137 PolarHBondContact O-N 2.75Å; Q134-M137 PolarHBondContact O-N 3.11Å; M137-Q139 VanDerWaalsContact C-N 3.34Å; M137-Q139 PolarHBondContact O-N 3.49Å; M137-Q140 WeakPolarHBondContact O-CB 3.3Å; M137-Q140 PolarHBondContact O-N 2.86Å; M137-Q141 PolarHBondContact O-N 3.04Å |
| 138 | L | 75.4 | Confident | 68.4 | Low | 89 Ų | 89 | 95.5 Ų | 95.5 | 47% | 0.466 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -63.4 | -40.5 | -179.1 | -150.6 | 80.4 | 0 | 0 | 0 | 112 | Q134 A135 Q141 Q142 | Q134-L138 PolarHBondContact O-N 3.16Å; A135-L138 PolarHBondContact O-N 3.47Å; L138-Q141 PolarHBondContact O-N 3.18Å; L138-Q142 PolarHBondContact O-N 3.45Å |
| 139 | Q | 66.4 | Low | 68.3 | Low | 83 Ų | 83 | 98.3 Ų | 98.3 | 39% | 0.388 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -62.6 | -44.5 | 174.3 | -170.7 | -169.2 | 114.1 | 0 | 0 | 111.6 | A135 L136 M137 Q141 Q142 L143 H196 L200 | A135-Q139 WeakPolarHBondContact O-CB 3.25Å; A135-Q139 PolarHBondContact O-N 3.36Å; L136-Q139 PolarHBondContact O-N 3.37Å; M137-Q139 VanDerWaalsContact C-N 3.34Å; M137-Q139 PolarHBondContact O-N 3.49Å; Q139-Q141 VanDerWaalsContact C-N 3.29Å; Q139-Q141 PolarHBondContact O-N 2.96Å; Q139-Q142 PolarHBondContact O-N 2.96Å; Q139-L143 WeakPolarHBondContact O-CB 3.47Å; Q139-L143 PolarHBondContact O-N 3.41Å; Q139-H196 PolarHBondContact OE1-NE2 3.07Å; Q139-L200 VanDerWaalsContact OE1-CD2 3.31Å |
| 140 | Q | 66.1 | Low | 68 | Low | 80 Ų | 80 | 98 Ų | 98 | 37% | 0.374 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -57.1 | -44.7 | 176 | -173.9 | -163 | 104.5 | 0 | 0 | 111 | L136 M137 L143 Q144 L197 | L136-Q140 PolarHBondContact O-N 2.99Å; M137-Q140 WeakPolarHBondContact O-CB 3.3Å; M137-Q140 PolarHBondContact O-N 2.86Å; Q140-L143 PolarHBondContact O-N 3.48Å; Q140-Q144 WeakPolarHBondContact O-CB 3.42Å; Q140-Q144 PolarHBondContact O-N 2.99Å; Q140-L197 VanDerWaalsContact NE2-CD1 3.33Å |
| 141 | Q | 74.8 | Confident | 67.3 | Low | 119 Ų | 119 | 97.6 Ų | 97.6 | 56% | 0.556 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -65.4 | -48.1 | -178.5 | -173.1 | 139.9 | 84.1 | 0 | 0 | 112.4 | M137 L138 Q139 L143 Q144 E145 | M137-Q141 PolarHBondContact O-N 3.04Å; L138-Q141 PolarHBondContact O-N 3.18Å; Q139-Q141 VanDerWaalsContact C-N 3.29Å; Q139-Q141 PolarHBondContact O-N 2.96Å; Q141-L143 VanDerWaalsContact C-N 3.29Å; Q141-L143 PolarHBondContact O-N 3Å; Q141-Q144 PolarHBondContact O-N 2.82Å; Q141-E145 PolarHBondContact O-N 2.85Å |
| 142 | Q | 65.3 | Low | 66.9 | Low | 133 Ų | 133 | 97.7 Ų | 97.7 | 62% | 0.621 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -58.7 | -40.7 | 174.7 | -78.4 | -167.1 | -31.8 | 0 | 0 | 112.5 | L138 Q139 Q144 E145 F146 | L138-Q142 PolarHBondContact O-N 3.45Å; Q139-Q142 PolarHBondContact O-N 2.96Å; Q142-Q144 VanDerWaalsContact C-N 3.33Å; Q142-Q144 PolarHBondContact O-N 3.22Å; Q142-E145 PolarHBondContact O-N 2.96Å; Q142-F146 WeakPolarHBondContact O-CB 3.47Å; Q142-F146 PolarHBondContact O-N 3.14Å |
| 143 | L | 65.4 | Low | 66.9 | Low | 56 Ų | 56 | 100.4 Ų | 100.4 | 29% | 0.293 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -66.3 | -37.3 | 178.8 | -150.3 | 76.1 | 0 | 0 | 0 | 111.5 | Q139 Q140 Q141 F146 Y147 | Q139-L143 WeakPolarHBondContact O-CB 3.47Å; Q139-L143 PolarHBondContact O-N 3.41Å; Q140-L143 PolarHBondContact O-N 3.48Å; Q141-L143 VanDerWaalsContact C-N 3.29Å; Q141-L143 PolarHBondContact O-N 3Å; L143-F146 PolarHBondContact O-N 2.87Å; L143-Y147 HydrophobicContact CD2-CE2 4.01Å; L143-Y147 HydrophobicContact CG-CD2 4.36Å; L143-Y147 HydrophobicContact CG-CE2 3.77Å; L143-Y147 WeakPolarHBondContact O-CD2 3.38Å; L143-Y147 PolarHBondContact O-N 3.46Å; L143-Y147 VanDerWaalsContact O-N 3.14Å |
| 144 | Q | 60.8 | Low | 66.8 | Low | 108 Ų | 108 | 97.3 Ų | 97.3 | 51% | 0.505 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -70.4 | -37.7 | 176.7 | -169.6 | 164.4 | 10.6 | 0 | 0 | 112.6 | Q140 Q141 Q142 K148 | Q140-Q144 WeakPolarHBondContact O-CB 3.42Å; Q140-Q144 PolarHBondContact O-N 2.99Å; Q141-Q144 PolarHBondContact O-N 2.82Å; Q142-Q144 VanDerWaalsContact C-N 3.33Å; Q142-Q144 PolarHBondContact O-N 3.22Å; Q144-K148 WeakPolarHBondContact O-CB 3.47Å; Q144-K148 PolarHBondContact O-N 2.82Å |
| 145 | E | 67.3 | Low | 66.6 | Low | 131 Ų | 131 | 97.6 Ų | 97.6 | 61% | 0.612 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -66.5 | -38.9 | 172.2 | -69.5 | -152.9 | 120.6 | 0 | 0 | 112.7 | Q141 Q142 K148 K149 | Q141-E145 PolarHBondContact O-N 2.85Å; Q142-E145 PolarHBondContact O-N 2.96Å; E145-K148 PolarHBondContact O-N 3.46Å; E145-K149 PolarHBondContact O-N 3.39Å |
| 146 | F | 67.1 | Low | 66.8 | Low | 131 Ų | 131 | 100.6 Ų | 100.6 | 58% | 0.575 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -58.3 | -48.5 | 174.7 | 176.9 | -95 | 0 | 0 | 0 | 111.6 | Q142 L143 K149 Q150 | Q142-F146 WeakPolarHBondContact O-CB 3.47Å; Q142-F146 PolarHBondContact O-N 3.14Å; L143-F146 PolarHBondContact O-N 2.87Å; F146-K149 PolarHBondContact O-N 3.45Å; F146-Q150 PolarHBondContact O-N 3.37Å |
| 147 | Y | 59.6 | Low | 66.8 | Low | 49 Ų | 49 | 103.9 Ų | 103.9 | 19% | 0.192 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -67.8 | -35.5 | 177.4 | -68.3 | -51.7 | 0 | 0 | 0 | 113.2 | L143 Q150 Q151 V189 | L143-Y147 HydrophobicContact CD2-CE2 4.01Å; L143-Y147 HydrophobicContact CG-CD2 4.36Å; L143-Y147 HydrophobicContact CG-CE2 3.77Å; L143-Y147 WeakPolarHBondContact O-CD2 3.38Å; L143-Y147 PolarHBondContact O-N 3.46Å; L143-Y147 VanDerWaalsContact O-N 3.14Å; Y147-Q150 PolarHBondContact O-N 2.87Å; Y147-Q151 PolarHBondContact O-N 3.16Å; Y147-V189 HydrophobicContact CD1-CG1 3.5Å; Y147-V189 HydrophobicContact CD2-CG1 4.04Å; Y147-V189 HydrophobicContact CE1-CB 4.42Å; Y147-V189 HydrophobicContact CE1-CG1 3.34Å; Y147-V189 HydrophobicContact CE1-CG2 4.18Å; Y147-V189 HydrophobicContact CE2-CG1 3.88Å; Y147-V189 HydrophobicContact CG-CG1 3.87Å |
| 148 | K | 65.6 | Low | 66.6 | Low | 120 Ų | 120 | 101.5 Ų | 101.5 | 52% | 0.522 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -58.9 | -48.5 | 171.8 | -175.9 | -169.8 | 166 | -166.1 | 0 | 111 | Q144 E145 Q150 Q151 E152 | Q144-K148 WeakPolarHBondContact O-CB 3.47Å; Q144-K148 PolarHBondContact O-N 2.82Å; E145-K148 PolarHBondContact O-N 3.46Å; K148-Q150 VanDerWaalsContact C-N 3.33Å; K148-Q150 PolarHBondContact O-N 2.94Å; K148-Q151 WeakPolarHBondContact O-CB 3.43Å; K148-Q151 PolarHBondContact O-N 2.84Å; K148-Q151 VanDerWaalsContact O-N 3.15Å; K148-E152 VanDerWaalsContact CE-OE1 3.23Å; K148-E152 WeakPolarHBondContact CE-OE1 3.4Å; K148-E152 IonicContact NZ-OE1 3.92Å; K148-E152 PolarHBondContact O-N 3.08Å |
| 149 | K | 67.1 | Low | 66.2 | Low | 158 Ų | 158 | 101.1 Ų | 101.1 | 69% | 0.687 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -59 | -41.5 | 175.9 | -95.7 | -175.4 | 172.4 | 177.7 | 0 | 112.6 | E145 F146 Q151 E152 Q153 | E145-K149 PolarHBondContact O-N 3.39Å; F146-K149 PolarHBondContact O-N 3.45Å; K149-Q151 VanDerWaalsContact C-N 3.32Å; K149-Q151 PolarHBondContact O-N 3.29Å; K149-E152 PolarHBondContact O-N 2.97Å; K149-Q153 WeakPolarHBondContact O-CB 3.45Å; K149-Q153 PolarHBondContact O-N 3.34Å |
| 150 | Q | 63.5 | Low | 66.3 | Low | 61 Ų | 61 | 102.7 Ų | 102.7 | 29% | 0.285 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -62.7 | -39.9 | 176.7 | -163.9 | -166.7 | 3.7 | 0 | 0 | 111.7 | F146 Y147 K148 L154 | F146-Q150 PolarHBondContact O-N 3.37Å; Y147-Q150 PolarHBondContact O-N 2.87Å; K148-Q150 VanDerWaalsContact C-N 3.33Å; K148-Q150 PolarHBondContact O-N 2.94Å; Q150-L154 PolarHBondContact O-N 3.46Å |
| 151 | Q | 59.2 | Low | 66 | Low | 103 Ų | 103 | 103.9 Ų | 103.9 | 48% | 0.481 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -67.4 | -42.1 | 176.8 | -172 | 178.1 | -4.8 | 0 | 0 | 112.1 | Y147 K148 K149 H155 L186 | Y147-Q151 PolarHBondContact O-N 3.16Å; K148-Q151 WeakPolarHBondContact O-CB 3.43Å; K148-Q151 PolarHBondContact O-N 2.84Å; K148-Q151 VanDerWaalsContact O-N 3.15Å; K149-Q151 VanDerWaalsContact C-N 3.32Å; K149-Q151 PolarHBondContact O-N 3.29Å; Q151-H155 WeakPolarHBondContact O-CB 3.49Å; Q151-H155 PolarHBondContact O-N 3.36Å; Q151-L186 HydrophobicContact CG-CD2 4.46Å |
| 152 | E | 69.2 | Low | 65.2 | Low | 106 Ų | 106 | 105.1 Ų | 105.1 | 50% | 0.495 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.6 | -43.8 | 175 | -74.4 | 173.1 | 141.5 | 0 | 0 | 111.7 | K148 K149 L154 H155 L156 | K148-E152 VanDerWaalsContact CE-OE1 3.23Å; K148-E152 WeakPolarHBondContact CE-OE1 3.4Å; K148-E152 IonicContact NZ-OE1 3.92Å; K148-E152 PolarHBondContact O-N 3.08Å; K149-E152 PolarHBondContact O-N 2.97Å; E152-L154 PolarHBondContact O-N 2.9Å; E152-H155 PolarHBondContact O-N 3.37Å; E152-L156 PolarHBondContact O-N 3.2Å |
| 153 | Q | 68.6 | Low | 64.7 | Low | 139 Ų | 139 | 106.4 Ų | 106.4 | 65% | 0.65 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -58.5 | -45.1 | 177.8 | -177.1 | -179.8 | -12.6 | 0 | 0 | 112.1 | K149 L156 Q157 | K149-Q153 WeakPolarHBondContact O-CB 3.45Å; K149-Q153 PolarHBondContact O-N 3.34Å; Q153-L156 PolarHBondContact O-N 3.12Å; Q153-Q157 PolarHBondContact O-N 3.47Å |
| 154 | L | 63.5 | Low | 63.9 | Low | 60 Ų | 60 | 111.6 Ų | 111.6 | 31% | 0.314 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -74.6 | -33 | 179 | -171.6 | 140.5 | 0 | 0 | 0 | 112.9 | Q150 E152 L156 Q157 L158 F182 | Q150-L154 PolarHBondContact O-N 3.46Å; E152-L154 PolarHBondContact O-N 2.9Å; L154-L156 PolarHBondContact O-N 2.82Å; L154-Q157 WeakPolarHBondContact O-CB 3.38Å; L154-Q157 PolarHBondContact O-N 3.23Å; L154-L158 WeakPolarHBondContact O-CB 3.29Å; L154-L158 PolarHBondContact O-N 3.46Å; L154-F182 HydrophobicContact CB-CE1 4.18Å; L154-F182 HydrophobicContact CB-CZ 4.14Å; L154-F182 HydrophobicContact CD1-CB 4.14Å; L154-F182 HydrophobicContact CD1-CD1 3.85Å; L154-F182 HydrophobicContact CD1-CD2 3.53Å; L154-F182 HydrophobicContact CD1-CE1 4.11Å; L154-F182 HydrophobicContact CD1-CE2 3.81Å; L154-F182 HydrophobicContact CD1-CG 3.53Å; L154-F182 HydrophobicContact CD1-CZ 4.08Å; L154-F182 HydrophobicContact CD2-CD1 3.5Å; L154-F182 HydrophobicContact CD2-CE1 3.78Å; L154-F182 HydrophobicContact CD2-CG 4Å; L154-F182 HydrophobicContact CD2-CZ 4.48Å; L154-F182 HydrophobicContact CG-CD1 4.18Å; L154-F182 HydrophobicContact CG-CE1 4.23Å; L154-F182 HydrophobicContact CG-CG 4.34Å; L154-F182 HydrophobicContact CG-CZ 4.46Å |
| 155 | H | 65.7 | Low | 63.2 | Low | 123 Ų | 123 | 109.9 Ų | 109.9 | 57% | 0.569 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -58.2 | -41.5 | 171.2 | -176.4 | 75.2 | 0 | 0 | 0 | 111.1 | Q151 E152 L158 L159 | Q151-H155 WeakPolarHBondContact O-CB 3.49Å; Q151-H155 PolarHBondContact O-N 3.36Å; E152-H155 PolarHBondContact O-N 3.37Å; H155-L158 PolarHBondContact O-N 2.77Å; H155-L159 WeakPolarHBondContact O-CB 3.46Å; H155-L159 PolarHBondContact O-N 2.91Å |
| 156 | L | 73.8 | Confident | 62.1 | Low | 119 Ų | 119 | 107.1 Ų | 107.1 | 62% | 0.623 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -66.2 | -40.4 | 175.1 | -148.5 | 73.8 | 0 | 0 | 0 | 112.3 | E152 Q153 L154 L158 L159 Q160 | E152-L156 PolarHBondContact O-N 3.2Å; Q153-L156 PolarHBondContact O-N 3.12Å; L154-L156 PolarHBondContact O-N 2.82Å; L156-L158 VanDerWaalsContact C-N 3.35Å; L156-L158 PolarHBondContact O-N 3Å; L156-L159 PolarHBondContact O-N 2.99Å; L156-Q160 WeakPolarHBondContact O-CB 3.08Å; L156-Q160 PolarHBondContact O-N 3.21Å |
| 157 | Q | 69.4 | Low | 61 | Low | 106 Ų | 106 | 105.7 Ų | 105.7 | 50% | 0.495 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -60.5 | -42.1 | 175.3 | -166.3 | 73.7 | 80.6 | 0 | 0 | 112.2 | Q153 L154 Q161 | Q153-Q157 PolarHBondContact O-N 3.47Å; L154-Q157 WeakPolarHBondContact O-CB 3.38Å; L154-Q157 PolarHBondContact O-N 3.23Å; Q157-Q161 WeakPolarHBondContact O-CB 3.49Å; Q157-Q161 PolarHBondContact O-N 3.32Å |
| 158 | L | 65.1 | Low | 60 | Low | 57 Ų | 57 | 112.9 Ų | 112.9 | 30% | 0.298 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -66.4 | -44 | 177.3 | -170.1 | 70.1 | 0 | 0 | 0 | 111.5 | L154 H155 L156 Q161 Q162 | L154-L158 WeakPolarHBondContact O-CB 3.29Å; L154-L158 PolarHBondContact O-N 3.46Å; H155-L158 PolarHBondContact O-N 2.77Å; L156-L158 VanDerWaalsContact C-N 3.35Å; L156-L158 PolarHBondContact O-N 3Å; L158-Q161 PolarHBondContact O-N 3.38Å; L158-Q162 PolarHBondContact O-N 2.93Å |
| 159 | L | 66.1 | Low | 58.7 | Low | 81 Ų | 81 | 116.2 Ų | 116.2 | 42% | 0.424 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -65.1 | -39.3 | 178.1 | -174.1 | 64 | 0 | 0 | 0 | 111.9 | H155 L156 Q162 Q163 | H155-L159 WeakPolarHBondContact O-CB 3.46Å; H155-L159 PolarHBondContact O-N 2.91Å; L156-L159 PolarHBondContact O-N 2.99Å; L159-Q162 PolarHBondContact O-N 3.01Å; L159-Q163 PolarHBondContact O-N 3.32Å |
| 160 | Q | 67.9 | Low | 57.4 | Low | 117 Ų | 117 | 114.6 Ų | 114.6 | 55% | 0.547 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -64.1 | -46.3 | 173.8 | -176.3 | 174.8 | 78.2 | 0 | 0 | 111.5 | L156 Q162 Q163 H164 | L156-Q160 WeakPolarHBondContact O-CB 3.08Å; L156-Q160 PolarHBondContact O-N 3.21Å; Q160-Q162 PolarHBondContact O-N 2.94Å; Q160-Q163 PolarHBondContact O-N 3.41Å; Q160-Q163 VanDerWaalsContact O-N 3.17Å; Q160-H164 PolarHBondContact O-CD2 2.92Å; Q160-H164 PolarHBondContact O-N 3.29Å |
| 161 | Q | 60.3 | Low | 55.9 | Low | 104 Ų | 104 | 121 Ų | 121 | 49% | 0.486 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -57.9 | -37.3 | 176.2 | -172.7 | 177.3 | 96.3 | 0 | 0 | 111.8 | Q157 L158 H164 | Q157-Q161 WeakPolarHBondContact O-CB 3.49Å; Q157-Q161 PolarHBondContact O-N 3.32Å; L158-Q161 PolarHBondContact O-N 3.38Å; Q161-H164 PolarHBondContact O-N 3.46Å |
| 162 | Q | 57.7 | Low | 54.7 | Low | 146 Ų | 146 | 124.5 Ų | 124.5 | 68% | 0.682 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -68.2 | -31.8 | 178.6 | -171.9 | 161.9 | 87.1 | 0 | 0 | 113.7 | L158 L159 Q160 A165 | L158-Q162 PolarHBondContact O-N 2.93Å; L159-Q162 PolarHBondContact O-N 3.01Å; Q160-Q162 PolarHBondContact O-N 2.94Å; Q162-A165 PolarHBondContact O-N 3.15Å |
| 163 | Q | 55.3 | Low | 53.3 | Low | 160 Ų | 160 | 128.5 Ų | 128.5 | 75% | 0.748 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -71.1 | -31.8 | 175.7 | -69.5 | -157.1 | 16.7 | 0 | 0 | 113.3 | L159 Q160 A165 G166 | L159-Q163 PolarHBondContact O-N 3.32Å; Q160-Q163 PolarHBondContact O-N 3.41Å; Q160-Q163 VanDerWaalsContact O-N 3.17Å; Q163-A165 PolarHBondContact O-N 3.42Å; Q163-G166 PolarHBondContact O-N 3.28Å |
| 164 | H | 49.6 | Very low | 52 | Low | 164 Ų | 164 | 129.6 Ų | 129.6 | 76% | 0.759 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.8 | -10 | 176.8 | -74.3 | -77.3 | 0 | 0 | 0 | 114 | Q160 Q161 G166 | Q160-H164 PolarHBondContact O-CD2 2.92Å; Q160-H164 PolarHBondContact O-N 3.29Å; Q161-H164 PolarHBondContact O-N 3.46Å; H164-G166 PolarHBondContact O-N 3.42Å |
| 165 | A | 46.4 | Very low | 51.3 | Low | 73 Ų | 73 | 130.5 Ų | 130.5 | 60% | 0.603 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.4 | 9.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | Q162 Q163 S167 | Q162-A165 PolarHBondContact O-N 3.15Å; Q163-A165 PolarHBondContact O-N 3.42Å; A165-S167 PolarHBondContact O-N 3.27Å |
| 166 | G | 44.1 | Very low | 50.7 | Low | 73 Ų | 73 | 126.2 Ų | 126.2 | 75% | 0.753 | 66% | 0.656 | S | S | * | * | trans | -62.7 | 5.4 | -168.7 | 0 | 0 | 0 | 0 | 0 | 118.6 | Q163 H164 | Q163-G166 PolarHBondContact O-N 3.28Å; H164-G166 PolarHBondContact O-N 3.42Å | ||
| 167 | S | 43.5 | Very low | 49.6 | Very low | 100 Ų | 100 | 124.9 Ų | 124.9 | 70% | 0.699 | 65% | 0.654 | S | S | * | * | S | Bend | trans | -155.5 | 78.7 | 175.8 | 64.1 | 0 | 0 | 0 | 0 | 115.6 | A165 | A165-S167 PolarHBondContact O-N 3.27Š|
| 168 | K | 37.9 | Very low | 48.9 | Very low | 201 Ų | 201 | 125.7 Ų | 125.7 | 87% | 0.874 | 66% | 0.658 | S | S | * | * | S | Bend | 178.5 | 158.1 | 126 | -93.8 | 153.7 | -171.1 | 177.3 | 0 | 113.1 | |||
| 169 | Q | 38.6 | Very low | 48.5 | Very low | 190 Ų | 190 | 126.8 Ų | 126.8 | 89% | 0.888 | 66% | 0.662 | S | S | * | * | trans | -46.2 | 149.5 | -165.3 | -69.3 | 160.5 | -97.2 | 0 | 0 | 118.4 | ||||
| 170 | S | 39.5 | Very low | 48.2 | Very low | 123 Ų | 123 | 127.9 Ų | 127.9 | 86% | 0.86 | 67% | 0.667 | S | S | * | * | trans | -64.9 | 134.8 | 173.9 | -38.1 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 171 | K | 32.7 | Very low | 47.9 | Very low | 195 Ų | 195 | 125 Ų | 125 | 85% | 0.848 | 66% | 0.663 | S | S | * | * | -154.8 | 159.6 | 116.9 | -141.3 | 169.9 | -178.9 | 179.4 | 0 | 111.1 | |||||
| 172 | E | 33.7 | Very low | 48.1 | Very low | 178 Ų | 178 | 121.3 Ų | 121.3 | 83% | 0.832 | 65% | 0.646 | S | S | * | * | trans | 66.6 | 119.1 | 178.6 | -63.6 | -173.7 | 64.6 | 0 | 0 | 116.8 | Q174 | E172-Q174 PolarHBondContact O-N 3.38Š| ||
| 173 | Q | 40.5 | Very low | 48.4 | Very low | 189 Ų | 189 | 121.2 Ų | 121.2 | 88% | 0.883 | 65% | 0.645 | S | S | * | * | trans | -80.9 | 59.7 | -179.2 | -166.4 | 78.3 | 16.1 | 0 | 0 | 110.3 | V175 | Q173-V175 PolarHBondContact O-N 3.31Š| ||
| 174 | Q | 41.2 | Very low | 49.1 | Very low | 163 Ų | 163 | 119.8 Ų | 119.8 | 76% | 0.762 | 64% | 0.639 | S | S | * | * | trans | -69.7 | 94.5 | 178 | -166.7 | 178.1 | 33.6 | 0 | 0 | 109.7 | E172 S176 | E172-Q174 PolarHBondContact O-N 3.38Å; Q174-S176 PolarHBondContact O-N 3.17Å | ||
| 175 | V | 48.1 | Very low | 49.9 | Very low | 79 Ų | 79 | 116.9 Ų | 116.9 | 48% | 0.479 | 63% | 0.625 | S | S | . | * | trans | -52.6 | 111.6 | 158.9 | 172.5 | 0 | 0 | 0 | 0 | 106.1 | Q173 Q179 | Q173-V175 PolarHBondContact O-N 3.31Å; V175-Q179 HydrophobicContact CG1-CB 4.3Å; V175-Q179 HydrophobicContact CG1-CG 4.43Å | ||
| 176 | S | 53.2 | Low | 51 | Low | 33 Ų | 33 | 115.6 Ų | 115.6 | 23% | 0.231 | 61% | 0.608 | C | S | . | * | trans | -54.9 | 137.5 | -171.5 | 171.2 | 0 | 0 | 0 | 0 | 109.8 | Q174 Q178 Q179 L180 | Q174-S176 PolarHBondContact O-N 3.17Å; S176-Q178 PolarHBondContact O-N 3.33Å; S176-Q178 WeakPolarHBondContact OG-CB 3.23Å; S176-Q178 PolarHBondContact OG-N 3.04Å; S176-Q179 WeakPolarHBondContact O-CA 3.29Å; S176-Q179 WeakPolarHBondContact O-CB 3.36Å; S176-Q179 PolarHBondContact O-N 3.13Å; S176-L180 PolarHBondContact O-N 3.07Å; S176-L180 VanDerWaalsContact O-N 3.12Å | ||
| 177 | P | 50.8 | Low | 52.3 | Low | 91 Ų | 91 | 117.5 Ų | 117.5 | 59% | 0.591 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -56 | -25.7 | 174.7 | 22.8 | -33 | 0 | 0 | 0 | 111.6 | A181 | P177-A181 WeakPolarHBondContact O-CB 3.5Å; P177-A181 PolarHBondContact O-N 3.39Å |
| 178 | Q | 54.8 | Low | 53.5 | Low | 122 Ų | 122 | 117.9 Ų | 117.9 | 57% | 0.57 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -67.7 | -37 | 172.9 | -159.9 | 171.6 | 31.3 | 0 | 0 | 112.9 | S176 F182 | S176-Q178 PolarHBondContact O-N 3.33Å; S176-Q178 WeakPolarHBondContact OG-CB 3.23Å; S176-Q178 PolarHBondContact OG-N 3.04Å; Q178-F182 WeakPolarHBondContact O-CB 3.49Å; Q178-F182 PolarHBondContact O-N 3.36Å |
| 179 | Q | 56.8 | Low | 54.9 | Low | 81 Ų | 81 | 109.8 Ų | 109.8 | 38% | 0.379 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -70.9 | -38.8 | 176.2 | -170.1 | -179.9 | 10.7 | 0 | 0 | 111.4 | V175 S176 Q183 | V175-Q179 HydrophobicContact CG1-CB 4.3Å; V175-Q179 HydrophobicContact CG1-CG 4.43Å; S176-Q179 WeakPolarHBondContact O-CA 3.29Å; S176-Q179 WeakPolarHBondContact O-CB 3.36Å; S176-Q179 PolarHBondContact O-N 3.13Å; Q179-Q183 PolarHBondContact O-N 3.45Å; Q179-Q183 VanDerWaalsContact O-N 3.08Å |
| 180 | L | 59.8 | Low | 56.3 | Low | 104 Ų | 104 | 106.5 Ų | 106.5 | 55% | 0.545 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -74 | -41.5 | 178.8 | -151.3 | 158.8 | 0 | 0 | 0 | 111.3 | S176 F182 Q183 Q184 | S176-L180 PolarHBondContact O-N 3.07Å; S176-L180 VanDerWaalsContact O-N 3.12Å; L180-F182 VanDerWaalsContact C-N 3.34Å; L180-F182 PolarHBondContact O-N 3.32Å; L180-Q183 PolarHBondContact O-N 2.99Å; L180-Q184 PolarHBondContact O-N 3.03Å |
| 181 | A | 60.6 | Low | 57.4 | Low | 56 Ų | 56 | 107 Ų | 107 | 46% | 0.463 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -59.7 | -40.9 | 171.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | P177 Q184 Q185 | P177-A181 WeakPolarHBondContact O-CB 3.5Å; P177-A181 PolarHBondContact O-N 3.39Å; A181-Q184 WeakPolarHBondContact O-CB 3.48Å; A181-Q184 PolarHBondContact O-N 2.98Å; A181-Q185 PolarHBondContact O-N 3.25Å |
| 182 | F | 66.1 | Low | 59 | Low | 26 Ų | 26 | 101.4 Ų | 101.4 | 11% | 0.114 | 51% | 0.514 | C | S | . | . | H | α-helix | trans | -68.5 | -37.1 | 175.6 | -176 | -104.2 | 0 | 0 | 0 | 113.1 | L154 Q178 L180 Q184 Q185 L186 | L154-F182 HydrophobicContact CB-CE1 4.18Å; L154-F182 HydrophobicContact CB-CZ 4.14Å; L154-F182 HydrophobicContact CD1-CB 4.14Å; L154-F182 HydrophobicContact CD1-CD1 3.85Å; L154-F182 HydrophobicContact CD1-CD2 3.53Å; L154-F182 HydrophobicContact CD1-CE1 4.11Å; L154-F182 HydrophobicContact CD1-CE2 3.81Å; L154-F182 HydrophobicContact CD1-CG 3.53Å; L154-F182 HydrophobicContact CD1-CZ 4.08Å; L154-F182 HydrophobicContact CD2-CD1 3.5Å; L154-F182 HydrophobicContact CD2-CE1 3.78Å; L154-F182 HydrophobicContact CD2-CG 4Å; L154-F182 HydrophobicContact CD2-CZ 4.48Å; L154-F182 HydrophobicContact CG-CD1 4.18Å; L154-F182 HydrophobicContact CG-CE1 4.23Å; L154-F182 HydrophobicContact CG-CG 4.34Å; L154-F182 HydrophobicContact CG-CZ 4.46Å; Q178-F182 WeakPolarHBondContact O-CB 3.49Å; Q178-F182 PolarHBondContact O-N 3.36Å; L180-F182 VanDerWaalsContact C-N 3.34Å; L180-F182 PolarHBondContact O-N 3.32Å; F182-Q184 VanDerWaalsContact C-N 3.28Å; F182-Q184 PolarHBondContact O-N 3.27Å; F182-Q185 HydrophobicContact CD2-CB 4.42Å; F182-Q185 WeakPolarHBondContact O-CB 3.3Å; F182-Q185 PolarHBondContact O-N 3.25Å; F182-Q185 VanDerWaalsContact O-N 3.14Å; F182-L186 HydrophobicContact CE1-CD1 4.44Å; F182-L186 HydrophobicContact CZ-CD1 4.2Å; F182-L186 PolarHBondContact O-N 2.99Å |
| 183 | Q | 63.9 | Low | 60.5 | Low | 144 Ų | 144 | 95.8 Ų | 95.8 | 67% | 0.673 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -60.2 | -41.2 | 173.7 | -165.6 | -168.6 | 111.4 | 0 | 0 | 111.2 | Q179 L180 L186 L187 | Q179-Q183 PolarHBondContact O-N 3.45Å; Q179-Q183 VanDerWaalsContact O-N 3.08Å; L180-Q183 PolarHBondContact O-N 2.99Å; Q183-L186 PolarHBondContact O-N 3.48Å; Q183-L187 PolarHBondContact O-N 3.38Å; Q183-L187 VanDerWaalsContact O-N 3.16Å |
| 184 | Q | 68.8 | Low | 61.6 | Low | 130 Ų | 130 | 93 Ų | 93 | 61% | 0.607 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -62.4 | -43.8 | 172.6 | -169.2 | -161.1 | 98.8 | 0 | 0 | 111.6 | L180 A181 F182 L186 L187 Q188 | L180-Q184 PolarHBondContact O-N 3.03Å; A181-Q184 WeakPolarHBondContact O-CB 3.48Å; A181-Q184 PolarHBondContact O-N 2.98Å; F182-Q184 VanDerWaalsContact C-N 3.28Å; F182-Q184 PolarHBondContact O-N 3.27Å; Q184-L186 PolarHBondContact O-N 2.92Å; Q184-L187 PolarHBondContact O-N 2.87Å; Q184-Q188 WeakPolarHBondContact O-CB 3.42Å; Q184-Q188 PolarHBondContact O-N 3.22Å |
| 185 | Q | 67.2 | Low | 62.5 | Low | 103 Ų | 103 | 90 Ų | 90 | 48% | 0.481 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -60.6 | -42.2 | 177.9 | -170.4 | 177.9 | 23.1 | 0 | 0 | 112.1 | A181 F182 L187 Q188 V189 | A181-Q185 PolarHBondContact O-N 3.25Å; F182-Q185 HydrophobicContact CD2-CB 4.42Å; F182-Q185 WeakPolarHBondContact O-CB 3.3Å; F182-Q185 PolarHBondContact O-N 3.25Å; F182-Q185 VanDerWaalsContact O-N 3.14Å; Q185-L187 VanDerWaalsContact C-N 3.32Å; Q185-L187 PolarHBondContact O-N 3.47Å; Q185-Q188 PolarHBondContact O-N 3.16Å; Q185-V189 WeakPolarHBondContact O-CB 3.41Å; Q185-V189 WeakPolarHBondContact O-CG2 3.22Å; Q185-V189 PolarHBondContact O-N 3.05Å |
| 186 | L | 69.7 | Low | 63.2 | Low | 46 Ų | 46 | 89.6 Ų | 89.6 | 24% | 0.241 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -64 | -37.9 | 177.2 | -161.5 | 74.6 | 0 | 0 | 0 | 111.7 | Q151 F182 Q183 Q184 Q190 | Q151-L186 HydrophobicContact CG-CD2 4.46Å; F182-L186 HydrophobicContact CE1-CD1 4.44Å; F182-L186 HydrophobicContact CZ-CD1 4.2Å; F182-L186 PolarHBondContact O-N 2.99Å; Q183-L186 PolarHBondContact O-N 3.48Å; Q184-L186 PolarHBondContact O-N 2.92Å; L186-Q190 WeakPolarHBondContact O-CB 3.37Å; L186-Q190 PolarHBondContact O-N 3.02Å |
| 187 | L | 70.1 | Confident | 63.7 | Low | 114 Ų | 114 | 91.3 Ų | 91.3 | 60% | 0.597 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -70.7 | -41.5 | 176.1 | -170.4 | 67.3 | 0 | 0 | 0 | 112.3 | Q183 Q184 Q185 V189 Q190 Q191 | Q183-L187 PolarHBondContact O-N 3.38Å; Q183-L187 VanDerWaalsContact O-N 3.16Å; Q184-L187 PolarHBondContact O-N 2.87Å; Q185-L187 VanDerWaalsContact C-N 3.32Å; Q185-L187 PolarHBondContact O-N 3.47Å; L187-V189 VanDerWaalsContact C-N 3.33Å; L187-V189 PolarHBondContact O-N 2.99Å; L187-Q190 PolarHBondContact O-N 3.45Å; L187-Q191 PolarHBondContact O-N 3.36Å |
| 188 | Q | 69.6 | Low | 64 | Low | 108 Ų | 108 | 91.2 Ų | 91.2 | 51% | 0.505 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -58.4 | -46 | 172.7 | -174.7 | 95.3 | 99.3 | 0 | 0 | 110.7 | Q184 Q185 Q191 V192 | Q184-Q188 WeakPolarHBondContact O-CB 3.42Å; Q184-Q188 PolarHBondContact O-N 3.22Å; Q185-Q188 PolarHBondContact O-N 3.16Å; Q188-Q191 PolarHBondContact O-N 2.97Å; Q188-V192 WeakPolarHBondContact O-CG2 3.42Å; Q188-V192 PolarHBondContact O-N 3.06Å |
| 189 | V | 67.1 | Low | 64.1 | Low | 31 Ų | 31 | 88.8 Ų | 88.8 | 19% | 0.188 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -59 | -45.2 | 174.7 | 157.6 | 0 | 0 | 0 | 0 | 111.7 | Y147 Q185 L187 Q191 V192 Q193 | Y147-V189 HydrophobicContact CD1-CG1 3.5Å; Y147-V189 HydrophobicContact CD2-CG1 4.04Å; Y147-V189 HydrophobicContact CE1-CB 4.42Å; Y147-V189 HydrophobicContact CE1-CG1 3.34Å; Y147-V189 HydrophobicContact CE1-CG2 4.18Å; Y147-V189 HydrophobicContact CE2-CG1 3.88Å; Y147-V189 HydrophobicContact CG-CG1 3.87Å; Q185-V189 WeakPolarHBondContact O-CB 3.41Å; Q185-V189 WeakPolarHBondContact O-CG2 3.22Å; Q185-V189 PolarHBondContact O-N 3.05Å; L187-V189 VanDerWaalsContact C-N 3.33Å; L187-V189 PolarHBondContact O-N 2.99Å; V189-Q191 VanDerWaalsContact C-N 3.33Å; V189-Q191 PolarHBondContact O-N 3.29Å; V189-V192 PolarHBondContact O-N 2.86Å; V189-Q193 WeakPolarHBondContact O-CB 3.48Å; V189-Q193 PolarHBondContact O-N 3.1Å |
| 190 | Q | 67.6 | Low | 64 | Low | 121 Ų | 121 | 86.5 Ų | 86.5 | 57% | 0.565 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -64.8 | -36.1 | 178.2 | -171.4 | 175.9 | 95.8 | 0 | 0 | 112.4 | L186 L187 Q193 Q194 | L186-Q190 WeakPolarHBondContact O-CB 3.37Å; L186-Q190 PolarHBondContact O-N 3.02Å; L187-Q190 PolarHBondContact O-N 3.45Å; Q190-Q193 WeakPolarHBondContact O-CB 3.49Å; Q190-Q193 PolarHBondContact O-N 3.42Å; Q190-Q194 PolarHBondContact O-N 3.36Å; Q190-Q194 VanDerWaalsContact O-N 3.16Å |
| 191 | Q | 64.1 | Low | 63.7 | Low | 133 Ų | 133 | 87.1 Ų | 87.1 | 62% | 0.621 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -66.9 | -41.9 | 173.6 | -169.9 | -177.3 | 61.3 | 0 | 0 | 111.8 | L187 Q188 V189 Q194 Q195 | L187-Q191 PolarHBondContact O-N 3.36Å; Q188-Q191 PolarHBondContact O-N 2.97Å; V189-Q191 VanDerWaalsContact C-N 3.33Å; V189-Q191 PolarHBondContact O-N 3.29Å; Q191-Q194 PolarHBondContact O-N 3.5Å; Q191-Q195 PolarHBondContact O-N 2.85Å; Q191-Q195 VanDerWaalsContact O-N 3.08Å |
| 192 | V | 65.9 | Low | 63.4 | Low | 77 Ų | 77 | 91.4 Ų | 91.4 | 47% | 0.467 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -65.4 | -39 | 174.9 | 171.8 | 0 | 0 | 0 | 0 | 111.5 | Q188 V189 Q194 Q195 H196 | Q188-V192 WeakPolarHBondContact O-CG2 3.42Å; Q188-V192 PolarHBondContact O-N 3.06Å; V189-V192 PolarHBondContact O-N 2.86Å; V192-Q194 PolarHBondContact O-N 3.04Å; V192-Q195 PolarHBondContact O-N 3.5Å; V192-H196 WeakPolarHBondContact O-CB 3.38Å; V192-H196 PolarHBondContact O-N 3.5Å |
| 193 | Q | 65.4 | Low | 62.6 | Low | 61 Ų | 61 | 96.2 Ų | 96.2 | 29% | 0.285 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -56.5 | -48 | 173.6 | 180 | -162.1 | 77 | 0 | 0 | 111.3 | V189 Q190 H196 L197 | V189-Q193 WeakPolarHBondContact O-CB 3.48Å; V189-Q193 PolarHBondContact O-N 3.1Å; Q190-Q193 WeakPolarHBondContact O-CB 3.49Å; Q190-Q193 PolarHBondContact O-N 3.42Å; Q193-H196 PolarHBondContact O-N 2.94Å; Q193-L197 WeakPolarHBondContact O-CB 3.49Å; Q193-L197 PolarHBondContact O-N 2.95Å |
| 194 | Q | 64 | Low | 62 | Low | 131 Ų | 131 | 90.3 Ų | 90.3 | 61% | 0.612 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -63.9 | -42.3 | 178.8 | -162.6 | -169.3 | 113.9 | 0 | 0 | 111.5 | Q190 Q191 V192 L197 L198 | Q190-Q194 PolarHBondContact O-N 3.36Å; Q190-Q194 VanDerWaalsContact O-N 3.16Å; Q191-Q194 PolarHBondContact O-N 3.5Å; V192-Q194 PolarHBondContact O-N 3.04Å; Q194-L197 PolarHBondContact O-N 3.36Å; Q194-L198 HydrophobicContact CG-CD1 4.44Å; Q194-L198 WeakPolarHBondContact O-CG 3.4Å; Q194-L198 PolarHBondContact O-N 2.94Å; Q194-L198 VanDerWaalsContact O-N 3.1Å |
| 195 | Q | 58.9 | Low | 60.9 | Low | 98 Ų | 98 | 89.6 Ų | 89.6 | 46% | 0.458 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -65 | -42 | 177.2 | -160.5 | -142.4 | 108 | 0 | 0 | 112.1 | Q191 V192 L198 N199 | Q191-Q195 PolarHBondContact O-N 2.85Å; Q191-Q195 VanDerWaalsContact O-N 3.08Å; V192-Q195 PolarHBondContact O-N 3.5Å; Q195-L198 PolarHBondContact O-N 2.89Å; Q195-N199 VanDerWaalsContact O-CB 3.29Å; Q195-N199 WeakPolarHBondContact O-CB 3.4Å; Q195-N199 PolarHBondContact O-N 3.35Å |
| 196 | H | 63.6 | Low | 59.7 | Low | 71 Ų | 71 | 90.1 Ų | 90.1 | 33% | 0.329 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -62.3 | -44.8 | 177.2 | -177.8 | 64.7 | 0 | 0 | 0 | 111.4 | Q139 V192 Q193 L198 N199 L200 | Q139-H196 PolarHBondContact OE1-NE2 3.07Å; V192-H196 WeakPolarHBondContact O-CB 3.38Å; V192-H196 PolarHBondContact O-N 3.5Å; Q193-H196 PolarHBondContact O-N 2.94Å; H196-L198 PolarHBondContact O-N 3.19Å; H196-N199 PolarHBondContact O-N 3.04Å; H196-L200 VanDerWaalsContact O-CB 3.29Å; H196-L200 WeakPolarHBondContact O-CB 3.48Å; H196-L200 PolarHBondContact O-N 3.48Å |
| 197 | L | 62.1 | Low | 58.3 | Low | 69 Ų | 69 | 93.6 Ų | 93.6 | 36% | 0.361 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -60 | -45.1 | 176.9 | -177.8 | 59.5 | 0 | 0 | 0 | 112.1 | L136 Q140 Q193 Q194 Q201 | L136-L197 HydrophobicContact CD2-CD1 4.08Å; Q140-L197 VanDerWaalsContact NE2-CD1 3.33Å; Q193-L197 WeakPolarHBondContact O-CB 3.49Å; Q193-L197 PolarHBondContact O-N 2.95Å; Q194-L197 PolarHBondContact O-N 3.36Å; L197-Q201 PolarHBondContact O-N 3.22Å |
| 198 | L | 58.7 | Low | 56.8 | Low | 90 Ų | 90 | 92.5 Ų | 92.5 | 47% | 0.471 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -62.5 | -44.6 | 174.8 | -71.9 | 167 | 0 | 0 | 0 | 111.6 | Q194 Q195 H196 Q201 R202 | Q194-L198 HydrophobicContact CG-CD1 4.44Å; Q194-L198 WeakPolarHBondContact O-CG 3.4Å; Q194-L198 PolarHBondContact O-N 2.94Å; Q194-L198 VanDerWaalsContact O-N 3.1Å; Q195-L198 PolarHBondContact O-N 2.89Å; H196-L198 PolarHBondContact O-N 3.19Å; L198-Q201 PolarHBondContact O-N 3.42Å; L198-R202 WeakPolarHBondContact O-CG 3.43Å; L198-R202 PolarHBondContact O-N 3.19Å |
| 199 | N | 57.2 | Low | 54.9 | Low | 71 Ų | 71 | 94.7 Ų | 94.7 | 38% | 0.38 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -62.9 | -43.9 | 179.3 | -168.1 | -58.1 | 0 | 0 | 0 | 111.7 | Q195 H196 R202 Q203 | Q195-N199 VanDerWaalsContact O-CB 3.29Å; Q195-N199 WeakPolarHBondContact O-CB 3.4Å; Q195-N199 PolarHBondContact O-N 3.35Å; H196-N199 PolarHBondContact O-N 3.04Å; N199-R202 WeakPolarHBondContact O-CA 3.49Å; N199-R202 WeakPolarHBondContact O-CB 3.31Å; N199-R202 PolarHBondContact O-N 3Å; N199-R202 VanDerWaalsContact O-N 3.09Å; N199-Q203 WeakPolarHBondContact O-CG 3.39Å; N199-Q203 PolarHBondContact O-N 3.39Å; N199-Q203 PolarHBondContact OD1-NE2 3.03Å |
| 200 | L | 54.2 | Low | 53.3 | Low | 33 Ų | 33 | 98.8 Ų | 98.8 | 17% | 0.173 | 50% | 0.504 | C | S | . | . | H | α-helix | trans | -67.9 | -37.3 | -179.6 | -160.1 | 59.3 | 0 | 0 | 0 | 111.7 | L136 Q139 H196 Q203 G204 | L136-L200 HydrophobicContact CD1-CB 4.27Å; L136-L200 HydrophobicContact CD1-CD2 4.26Å; L136-L200 HydrophobicContact CD1-CG 3.82Å; L136-L200 HydrophobicContact CG-CD2 3.79Å; L136-L200 HydrophobicContact CG-CG 3.93Å; Q139-L200 VanDerWaalsContact OE1-CD2 3.31Å; H196-L200 VanDerWaalsContact O-CB 3.29Å; H196-L200 WeakPolarHBondContact O-CB 3.48Å; H196-L200 PolarHBondContact O-N 3.48Å; L200-Q203 PolarHBondContact O-N 3.02Å; L200-G204 PolarHBondContact O-N 3.3Å |
| 201 | Q | 53.5 | Low | 51.6 | Low | 116 Ų | 116 | 96.2 Ų | 96.2 | 54% | 0.542 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.2 | -40.7 | 168.3 | -171.8 | -166.9 | 60.9 | 0 | 0 | 112 | L197 L198 G204 L205 | L197-Q201 PolarHBondContact O-N 3.22Å; L198-Q201 PolarHBondContact O-N 3.42Å; Q201-G204 PolarHBondContact O-N 2.91Å; Q201-L205 HydrophobicContact CG-CD1 4.5Å |
| 202 | R | 52.9 | Low | 50 | Low | 147 Ų | 147 | 97.5 Ų | 97.5 | 56% | 0.555 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -64.2 | -39.5 | 177.4 | -62.5 | -118.7 | 63.8 | -135.1 | -0.5 | 111.9 | L198 N199 G204 L205 L206 | L198-R202 WeakPolarHBondContact O-CG 3.43Å; L198-R202 PolarHBondContact O-N 3.19Å; N199-R202 WeakPolarHBondContact O-CA 3.49Å; N199-R202 WeakPolarHBondContact O-CB 3.31Å; N199-R202 PolarHBondContact O-N 3Å; N199-R202 VanDerWaalsContact O-N 3.09Å; R202-G204 VanDerWaalsContact C-N 3.34Å; R202-G204 PolarHBondContact O-N 3.38Å; R202-L205 PolarHBondContact O-N 2.94Å; R202-L206 WeakPolarHBondContact O-CD1 3.43Å; R202-L206 WeakPolarHBondContact O-CG 3.36Å |
| 203 | Q | 50.5 | Low | 48.7 | Very low | 127 Ų | 127 | 99.9 Ų | 99.9 | 59% | 0.593 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -64.4 | -36.2 | 177.6 | -72.6 | -177.5 | 67.3 | 0 | 0 | 112.6 | N199 L200 L205 | N199-Q203 WeakPolarHBondContact O-CG 3.39Å; N199-Q203 PolarHBondContact O-N 3.39Å; N199-Q203 PolarHBondContact OD1-NE2 3.03Å; L200-Q203 PolarHBondContact O-N 3.02Å; Q203-L205 VanDerWaalsContact C-N 3.35Å; Q203-L205 PolarHBondContact O-N 3.42Å |
| 204 | G | 51.7 | Low | 47.1 | Very low | 19 Ų | 19 | 102.1 Ų | 102.1 | 20% | 0.196 | 55% | 0.553 | C | S | . | * | H | α-helix | trans | -68.9 | -25.2 | 179.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | L200 Q201 R202 | L200-G204 PolarHBondContact O-N 3.3Å; Q201-G204 PolarHBondContact O-N 2.91Å; R202-G204 VanDerWaalsContact C-N 3.34Å; R202-G204 PolarHBondContact O-N 3.38Å |
| 205 | L | 44.3 | Very low | 45.5 | Very low | 116 Ų | 116 | 103.6 Ų | 103.6 | 61% | 0.607 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -102.1 | -3.3 | -173.4 | -83 | 161.5 | 0 | 0 | 0 | 115 | Q201 R202 Q203 | Q201-L205 HydrophobicContact CG-CD1 4.5Å; R202-L205 PolarHBondContact O-N 2.94Å; Q203-L205 VanDerWaalsContact C-N 3.35Å; Q203-L205 PolarHBondContact O-N 3.42Å |
| 206 | L | 41.8 | Very low | 44.6 | Very low | 113 Ų | 113 | 104.1 Ų | 104.1 | 59% | 0.592 | 58% | 0.577 | S | S | * | * | trans | -103 | 31.4 | -167 | -77.6 | 176.8 | 0 | 0 | 0 | 115.9 | R202 | R202-L206 WeakPolarHBondContact O-CD1 3.43Å; R202-L206 WeakPolarHBondContact O-CG 3.36Å | ||
| 207 | S | 40.5 | Very low | 42.9 | Very low | 119 Ų | 119 | 109.3 Ų | 109.3 | 83% | 0.832 | 61% | 0.606 | S | S | * | * | trans | -135.7 | 40.1 | 173.7 | -150.7 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 208 | I | 38.8 | Very low | 41.9 | Very low | 92 Ų | 92 | 113.7 Ų | 113.7 | 47% | 0.472 | 62% | 0.624 | S | S | . | * | trans | -128.7 | 84.3 | 162.8 | -49.1 | 177.8 | 0 | 0 | 0 | 108.3 | L121 P210 | L121-I208 HydrophobicContact CD2-CD1 3.83Å; I208-P210 WeakPolarHBondContact O-CD 3.35Å | ||
| 209 | Q | 29.7 | Very low | 40.5 | Very low | 154 Ų | 154 | 115.3 Ų | 115.3 | 72% | 0.72 | 64% | 0.643 | S | S | * | * | trans | -82.5 | 117.1 | 167.5 | -171.2 | -177.1 | 113.2 | 0 | 0 | 108 | G211 | Q209-G211 PolarHBondContact O-N 3.36Š| ||
| 210 | P | 33.6 | Very low | 39.4 | Very low | 116 Ų | 116 | 120 Ų | 120 | 75% | 0.753 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.9 | 127.5 | -179.1 | 29.1 | -33.2 | 0 | 0 | 0 | 110.8 | I208 | I208-P210 WeakPolarHBondContact O-CD 3.35Š|
| 211 | G | 32.1 | Very low | 38.6 | Very low | 67 Ų | 67 | 124.1 Ų | 124.1 | 69% | 0.691 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 100.2 | 33.6 | 161.4 | 0 | 0 | 0 | 0 | 0 | 118 | Q209 | Q209-G211 PolarHBondContact O-N 3.36Š|
| 212 | Q | 30.7 | Very low | 37.5 | Very low | 160 Ų | 160 | 128.1 Ų | 128.1 | 75% | 0.748 | 71% | 0.713 | S | S | * | * | trans | -122 | 114.2 | 164.5 | -69.3 | -60.6 | -23 | 0 | 0 | 112 | ||||
| 213 | T | 38.1 | Very low | 36.6 | Very low | 128 Ų | 128 | 124.8 Ų | 124.8 | 79% | 0.785 | 72% | 0.724 | S | S | * | * | trans | -89.3 | 145.5 | 171.4 | 41.9 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 214 | S | 31.5 | Very low | 36 | Very low | 107 Ų | 107 | 125.7 Ų | 125.7 | 75% | 0.748 | 73% | 0.73 | S | S | * | * | trans | 87.9 | 115.5 | 168.7 | 80.3 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 215 | L | 30.4 | Very low | 35.8 | Very low | 163 Ų | 163 | 129.7 Ų | 129.7 | 85% | 0.853 | 75% | 0.746 | S | S | * | * | trans | 66.9 | 160.4 | 153.8 | -50.7 | 176.6 | 0 | 0 | 0 | 118.3 | ||||
| 216 | P | 39.8 | Very low | 36.3 | Very low | 109 Ų | 109 | 129 Ų | 129 | 71% | 0.708 | 75% | 0.748 | S | S | * | * | -120.7 | 139.5 | -63.9 | 34.7 | -23 | 0 | 0 | 0 | 112.1 | H218 | P216-H218 PolarHBondContact O-N 3.47Š| |||
| 217 | L | 28.6 | Very low | 37.1 | Very low | 179 Ų | 179 | 126.7 Ų | 126.7 | 94% | 0.937 | 75% | 0.745 | S | S | * | * | trans | -80.4 | 80.8 | -175.3 | -169.7 | 96.8 | 0 | 0 | 0 | 112.8 | ||||
| 218 | H | 40.5 | Very low | 37.6 | Very low | 161 Ų | 161 | 125.2 Ų | 125.2 | 75% | 0.745 | 73% | 0.725 | S | S | * | * | trans | -126.6 | 98 | 170.9 | -94.1 | -102.8 | 0 | 0 | 0 | 111.3 | P216 | P216-H218 PolarHBondContact O-N 3.47Š| ||
| 219 | S | 29.8 | Very low | 38.5 | Very low | 125 Ų | 125 | 125.7 Ų | 125.7 | 87% | 0.874 | 73% | 0.728 | S | S | * | * | S | Bend | trans | -169.7 | 22.6 | 161.1 | -114.7 | 0 | 0 | 0 | 0 | 116.1 | ||
| 220 | L | 34.1 | Very low | 39.7 | Very low | 168 Ų | 168 | 124.9 Ų | 124.9 | 88% | 0.88 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -149.8 | 36.1 | 173.2 | -130.1 | 174.1 | 0 | 0 | 0 | 114.8 | ||
| 221 | T | 36.7 | Very low | 40.5 | Very low | 121 Ų | 121 | 125.1 Ų | 125.1 | 74% | 0.742 | 72% | 0.715 | S | S | * | * | trans | -142.9 | 86 | 176.4 | 49.8 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 222 | Q | 31.7 | Very low | 41.5 | Very low | 200 Ų | 200 | 126.7 Ų | 126.7 | 94% | 0.935 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -140.8 | 92.1 | 163.9 | -170.7 | 114.1 | 34 | 0 | 0 | 110 | ||
| 223 | G | 34.8 | Very low | 42.6 | Very low | 76 Ų | 76 | 127.1 Ų | 127.1 | 78% | 0.784 | 70% | 0.702 | S | S | * | * | S | Bend | trans | 85.2 | 54.8 | 155.3 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||
| 224 | M | 36.7 | Very low | 43.2 | Very low | 147 Ų | 147 | 128.1 Ų | 128.1 | 72% | 0.724 | 70% | 0.695 | S | S | * | * | trans | -150.1 | 147.2 | 136.3 | -76.6 | -137.9 | 86.3 | 0 | 0 | 109.2 | ||||
| 225 | I | 48.2 | Very low | 43.9 | Very low | 103 Ų | 103 | 129.3 Ų | 129.3 | 53% | 0.528 | 69% | 0.689 | S | S | . | * | trans | -87.6 | 131 | -175.6 | -57.3 | 171.5 | 0 | 0 | 0 | 109.4 | A227 E228 L229 | I225-A227 HydrophobicContact CG2-CB 4.23Å; I225-A227 PolarHBondContact O-N 2.9Å; I225-A227 VanDerWaalsContact O-N 3.08Å; I225-E228 HydrophobicContact CB-CG 4.2Å; I225-E228 PolarHBondContact O-N 3.44Å; I225-L229 PolarHBondContact O-N 3.44Å | ||
| 226 | P | 54.5 | Low | 44.9 | Very low | 102 Ų | 102 | 127.2 Ų | 127.2 | 66% | 0.662 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -57.1 | -28.6 | -177 | -28.5 | 35.8 | 0 | 0 | 0 | 115.2 | Q230 | P226-Q230 PolarHBondContact O-N 2.92Å |
| 227 | A | 57.4 | Low | 45.4 | Very low | 63 Ų | 63 | 127 Ų | 127 | 52% | 0.521 | 68% | 0.68 | S | S | . | * | H | α-helix | trans | -66.7 | -40.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | I225 L229 Q230 Q231 | I225-A227 HydrophobicContact CG2-CB 4.23Å; I225-A227 PolarHBondContact O-N 2.9Å; I225-A227 VanDerWaalsContact O-N 3.08Å; A227-L229 VanDerWaalsContact C-N 3.33Å; A227-L229 PolarHBondContact O-N 3.14Å; A227-Q230 PolarHBondContact O-N 3.41Å; A227-Q231 WeakPolarHBondContact O-CB 3.47Å; A227-Q231 PolarHBondContact O-N 3.36Å |
| 228 | E | 51.7 | Low | 46.2 | Very low | 89 Ų | 89 | 124.2 Ų | 124.2 | 42% | 0.416 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -65.7 | -37.9 | 178.9 | -66.2 | -178.7 | 133.5 | 0 | 0 | 111.3 | I225 Q231 L232 | I225-E228 HydrophobicContact CB-CG 4.2Å; I225-E228 PolarHBondContact O-N 3.44Å; E228-Q231 PolarHBondContact O-N 3.06Å; E228-Q231 VanDerWaalsContact O-N 3.13Å; E228-L232 VanDerWaalsContact O-CD1 3.22Å; E228-L232 WeakPolarHBondContact O-CD1 3.45Å; E228-L232 PolarHBondContact O-N 3.3Å |
| 229 | L | 58.8 | Low | 46.1 | Very low | 102 Ų | 102 | 120.8 Ų | 120.8 | 53% | 0.534 | 67% | 0.665 | S | S | . | * | H | α-helix | trans | -64.5 | -42 | 176 | -172.4 | 63.5 | 0 | 0 | 0 | 111.7 | I225 A227 Q231 W233 | I225-L229 PolarHBondContact O-N 3.44Å; A227-L229 VanDerWaalsContact C-N 3.33Å; A227-L229 PolarHBondContact O-N 3.14Å; L229-Q231 VanDerWaalsContact C-N 3.26Å; L229-Q231 PolarHBondContact O-N 3.26Å; L229-W233 PolarHBondContact O-N 3.12Å |
| 230 | Q | 54.3 | Low | 46.5 | Very low | 136 Ų | 136 | 123 Ų | 123 | 64% | 0.636 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -63.6 | -33.1 | 172.6 | -70.4 | -171.8 | -0.6 | 0 | 0 | 112.3 | P226 A227 K234 | P226-Q230 PolarHBondContact O-N 2.92Å; A227-Q230 PolarHBondContact O-N 3.41Å; Q230-K234 WeakPolarHBondContact O-CB 3.45Å; Q230-K234 PolarHBondContact O-N 3.34Å |
| 231 | Q | 50.2 | Low | 46.5 | Very low | 122 Ų | 122 | 121.4 Ų | 121.4 | 57% | 0.57 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -73.7 | -44.5 | 178.4 | -164.6 | 166.6 | -42.4 | 0 | 0 | 112.2 | A227 E228 L229 W233 K234 E235 | A227-Q231 WeakPolarHBondContact O-CB 3.47Å; A227-Q231 PolarHBondContact O-N 3.36Å; E228-Q231 PolarHBondContact O-N 3.06Å; E228-Q231 VanDerWaalsContact O-N 3.13Å; L229-Q231 VanDerWaalsContact C-N 3.26Å; L229-Q231 PolarHBondContact O-N 3.26Å; Q231-W233 VanDerWaalsContact C-N 3.32Å; Q231-W233 PolarHBondContact O-N 3.08Å; Q231-K234 CarbonylContact O-C 3.5Å; Q231-K234 WeakPolarHBondContact O-CA 3.42Å; Q231-K234 WeakPolarHBondContact O-CB 3.47Å; Q231-K234 PolarHBondContact O-N 3.45Å; Q231-E235 PolarHBondContact O-N 3.04Å |
| 232 | L | 54 | Low | 46.4 | Very low | 100 Ų | 100 | 123.4 Ų | 123.4 | 52% | 0.524 | 66% | 0.657 | S | S | . | * | H | α-helix | trans | -55.3 | -45.5 | 173.5 | -97.6 | 81.3 | 0 | 0 | 0 | 111.9 | E228 K234 E235 V236 | E228-L232 VanDerWaalsContact O-CD1 3.22Å; E228-L232 WeakPolarHBondContact O-CD1 3.45Å; E228-L232 PolarHBondContact O-N 3.3Å; L232-K234 PolarHBondContact O-N 3.07Å; L232-E235 PolarHBondContact O-N 3.3Å; L232-E235 VanDerWaalsContact O-N 3.16Å; L232-V236 WeakPolarHBondContact O-CG2 3.46Å; L232-V236 PolarHBondContact O-N 2.88Å |
| 233 | W | 52.9 | Low | 46.3 | Very low | 169 Ų | 169 | 120.4 Ų | 120.4 | 64% | 0.64 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -64.1 | -26 | 178.1 | -78.1 | 53.1 | 0 | 0 | 0 | 112.6 | L229 Q231 T237 | L229-W233 PolarHBondContact O-N 3.12Å; Q231-W233 VanDerWaalsContact C-N 3.32Å; Q231-W233 PolarHBondContact O-N 3.08Å; W233-T237 WeakPolarHBondContact O-CG2 3.48Å; W233-T237 PolarHBondContact O-OG1 3.38Å; W233-T237 VanDerWaalsContact O-OG1 3.11Å |
| 234 | K | 50.9 | Low | 46.1 | Very low | 148 Ų | 148 | 124.3 Ų | 124.3 | 64% | 0.643 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -86.9 | -21 | 176.8 | -155.7 | 177.1 | -172.6 | -178.7 | 0 | 113 | Q230 Q231 L232 T237 N238 | Q230-K234 WeakPolarHBondContact O-CB 3.45Å; Q230-K234 PolarHBondContact O-N 3.34Å; Q231-K234 CarbonylContact O-C 3.5Å; Q231-K234 WeakPolarHBondContact O-CA 3.42Å; Q231-K234 WeakPolarHBondContact O-CB 3.47Å; Q231-K234 PolarHBondContact O-N 3.45Å; L232-K234 PolarHBondContact O-N 3.07Å; K234-T237 PolarHBondContact O-OG1 2.91Å; K234-N238 PolarHBondContact O-ND2 3.42Å |
| 235 | E | 46 | Very low | 45.9 | Very low | 132 Ų | 132 | 124.4 Ų | 124.4 | 62% | 0.617 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -86.5 | -44.5 | 178.9 | -151.7 | 161.8 | 121 | 0 | 0 | 110.9 | Q231 L232 T237 N238 | Q231-E235 PolarHBondContact O-N 3.04Å; L232-E235 PolarHBondContact O-N 3.3Å; L232-E235 VanDerWaalsContact O-N 3.16Å; E235-T237 PolarHBondContact O-N 2.92Å; E235-N238 PolarHBondContact O-N 3.35Å; E235-N238 VanDerWaalsContact O-N 3.11Å |
| 236 | V | 50.8 | Low | 45 | Very low | 120 Ų | 120 | 126.1 Ų | 126.1 | 73% | 0.727 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -58.3 | -30.9 | 174.8 | 170.2 | 0 | 0 | 0 | 0 | 112.7 | L232 | L232-V236 WeakPolarHBondContact O-CG2 3.46Å; L232-V236 PolarHBondContact O-N 2.88Å |
| 237 | T | 50.8 | Low | 43.8 | Very low | 105 Ų | 105 | 128.7 Ų | 128.7 | 64% | 0.644 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.8 | -14.7 | 178.7 | 47.3 | 0 | 0 | 0 | 0 | 115.2 | W233 K234 E235 | W233-T237 WeakPolarHBondContact O-CG2 3.48Å; W233-T237 PolarHBondContact O-OG1 3.38Å; W233-T237 VanDerWaalsContact O-OG1 3.11Å; K234-T237 PolarHBondContact O-OG1 2.91Å; E235-T237 PolarHBondContact O-N 2.92Å |
| 238 | N | 44.6 | Very low | 42.4 | Very low | 120 Ų | 120 | 128.7 Ų | 128.7 | 64% | 0.642 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -102.9 | 1.5 | -172.3 | -79.3 | -39.4 | 0 | 0 | 0 | 114.2 | K234 E235 H240 | K234-N238 PolarHBondContact O-ND2 3.42Å; E235-N238 PolarHBondContact O-N 3.35Å; E235-N238 VanDerWaalsContact O-N 3.11Å; N238-H240 VanDerWaalsContact C-N 3.32Å; N238-H240 PolarHBondContact O-N 2.97Å |
| 239 | A | 38.3 | Very low | 41.4 | Very low | 88 Ų | 88 | 130 Ų | 130 | 73% | 0.727 | 68% | 0.682 | S | S | * | * | trans | -82.9 | 43.6 | -167.3 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 240 | H | 38.6 | Very low | 40.1 | Very low | 172 Ų | 172 | 130 Ų | 130 | 80% | 0.796 | 69% | 0.691 | S | S | * | * | trans | -168 | 83.9 | 157.4 | -172.5 | -80.8 | 0 | 0 | 0 | 114.3 | N238 | N238-H240 VanDerWaalsContact C-N 3.32Å; N238-H240 PolarHBondContact O-N 2.97Å | ||
| 241 | V | 34 | Very low | 39.1 | Very low | 135 Ų | 135 | 131 Ų | 131 | 82% | 0.818 | 70% | 0.701 | S | S | * | * | trans | -150.4 | 118.7 | 141.7 | -174.1 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 242 | K | 35.2 | Very low | 38.2 | Very low | 162 Ų | 162 | 133.1 Ų | 133.1 | 70% | 0.704 | 72% | 0.716 | S | S | * | * | trans | -107 | 152 | 144.1 | -93 | -179.4 | 139.1 | -125.7 | 0 | 105.8 | ||||
| 243 | E | 30.5 | Very low | 37.1 | Very low | 138 Ų | 138 | 131.1 Ų | 131.1 | 65% | 0.645 | 72% | 0.719 | S | S | * | * | cis | -156.6 | 167.1 | 6.9 | -133.2 | 153 | 161 | 0 | 0 | 107.8 | ||||
| 244 | E | 29.8 | Very low | 36.2 | Very low | 158 Ų | 158 | 132.4 Ų | 132.4 | 74% | 0.738 | 73% | 0.732 | S | S | * | * | trans | 179.8 | 120 | 144.9 | -100.4 | -58 | 99.5 | 0 | 0 | 112.7 | ||||
| 245 | H | 32.5 | Very low | 35.8 | Very low | 148 Ų | 148 | 136.9 Ų | 136.9 | 69% | 0.685 | 75% | 0.745 | S | S | * | * | trans | 29 | 112.8 | 152.5 | -69 | 104.6 | 0 | 0 | 0 | 126.1 | ||||
| 246 | N | 28.5 | Very low | 35.1 | Very low | 139 Ų | 139 | 133.8 Ų | 133.8 | 74% | 0.743 | 75% | 0.748 | S | S | * | * | 100.6 | 133.8 | 111 | -155.3 | -6.2 | 0 | 0 | 0 | 121.6 | |||||
| 247 | N | 29.4 | Very low | 34.8 | Very low | 157 Ų | 157 | 136.7 Ų | 136.7 | 84% | 0.84 | 76% | 0.759 | S | S | * | * | trans | 62.6 | 130.8 | 167.8 | -100.7 | -19.3 | 0 | 0 | 0 | 120 | ||||
| 248 | G | 28.8 | Very low | 33.8 | Very low | 62 Ų | 62 | 138.5 Ų | 138.5 | 64% | 0.639 | 76% | 0.764 | S | S | * | * | cis | 176 | 178.4 | -4.5 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 249 | S | 31.2 | Very low | 33.5 | Very low | 117 Ų | 117 | 141.2 Ų | 141.2 | 82% | 0.818 | 78% | 0.778 | S | S | * | * | trans | 76.9 | 106.5 | 169.7 | -70.5 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 250 | S | 31 | Very low | 33.1 | Very low | 103 Ų | 103 | 142.7 Ų | 142.7 | 72% | 0.72 | 78% | 0.783 | S | S | * | * | 102.3 | 103.4 | 128.7 | -59.9 | 0 | 0 | 0 | 0 | 121 | |||||
| 251 | N | 33.3 | Very low | 32.7 | Very low | 157 Ų | 157 | 140 Ų | 140 | 84% | 0.84 | 78% | 0.783 | S | S | * | * | trans | 31.8 | 135.3 | 130.9 | -50 | -21.6 | 0 | 0 | 0 | 119.2 | ||||
| 252 | N | 30.4 | Very low | 32.3 | Very low | 166 Ų | 166 | 139.4 Ų | 139.4 | 89% | 0.888 | 79% | 0.786 | S | S | * | * | cis | -150.3 | 152.1 | 35 | -165.6 | 23.7 | 0 | 0 | 0 | 110.8 | ||||
| 253 | G | 31.4 | Very low | 32.2 | Very low | 57 Ų | 57 | 136 Ų | 136 | 59% | 0.588 | 79% | 0.787 | S | S | * | * | trans | -103.7 | 175.5 | -169.5 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 254 | H | 34.8 | Very low | 32.4 | Very low | 196 Ų | 196 | 134.9 Ų | 134.9 | 91% | 0.907 | 79% | 0.792 | S | S | * | * | trans | -161.1 | 170.8 | 138 | -122.5 | -116 | 0 | 0 | 0 | 112.5 | ||||
| 255 | R | 42.7 | Very low | 32.6 | Very low | 243 Ų | 243 | 133.6 Ų | 133.6 | 92% | 0.917 | 80% | 0.797 | S | S | * | * | trans | -75.2 | 152.3 | -170.3 | -63.1 | 165.1 | 164.1 | -123.8 | 0.4 | 114 | ||||
| 256 | G | 30.3 | Very low | 32.5 | Very low | 67 Ų | 67 | 136 Ų | 136 | 69% | 0.691 | 81% | 0.806 | S | S | * | * | trans | -172.2 | 104.7 | 162 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 257 | L | 44 | Very low | 32.5 | Very low | 181 Ų | 181 | 137 Ų | 137 | 95% | 0.948 | 81% | 0.811 | S | S | * | * | trans | -127.1 | 108.2 | 161.4 | -80.3 | 175.4 | 0 | 0 | 0 | 106.5 | ||||
| 258 | D | 30.8 | Very low | 32.7 | Very low | 142 Ų | 142 | 135.4 Ų | 135.4 | 76% | 0.759 | 81% | 0.809 | S | S | * | * | trans | -138 | 127 | 170.5 | 59.5 | -69.8 | 0 | 0 | 0 | 111.5 | ||||
| 259 | L | 39.1 | Very low | 32.9 | Very low | 178 Ų | 178 | 139 Ų | 139 | 93% | 0.932 | 82% | 0.818 | S | S | * | * | trans | -103.2 | 117.2 | 167 | -68.5 | 166.1 | 0 | 0 | 0 | 105.9 | ||||
| 260 | S | 28.3 | Very low | 32.8 | Very low | 118 Ų | 118 | 141.2 Ų | 141.2 | 83% | 0.825 | 82% | 0.82 | S | S | * | * | trans | -154.3 | 144.8 | 169.8 | -86.4 | 0 | 0 | 0 | 0 | 113 | ||||
| 261 | S | 29.9 | Very low | 32.6 | Very low | 115 Ų | 115 | 141.6 Ų | 141.6 | 80% | 0.804 | 82% | 0.815 | S | S | * | * | trans | -94.6 | 154 | -177.3 | 178.4 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 262 | S | 25.6 | Very low | 32.4 | Very low | 124 Ų | 124 | 142.5 Ų | 142.5 | 87% | 0.867 | 81% | 0.814 | S | S | * | * | trans | -153.2 | 154.3 | 159.6 | -90.3 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 263 | A | 33.3 | Very low | 32.3 | Very low | 89 Ų | 89 | 143 Ų | 143 | 74% | 0.736 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -85.5 | 161.7 | -166 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||
| 264 | P | 35.3 | Very low | 32.1 | Very low | 116 Ų | 116 | 145.1 Ų | 145.1 | 75% | 0.753 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 148.3 | 178.6 | 27.2 | -36 | 0 | 0 | 0 | 113.5 | ||
| 265 | P | 33.6 | Very low | 32 | Very low | 130 Ų | 130 | 140.4 Ų | 140.4 | 84% | 0.844 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -76.7 | 166.3 | 179.9 | 32.3 | -35.9 | 0 | 0 | 0 | 113.5 | ||
| 266 | K | 30.9 | Very low | 31.3 | Very low | 199 Ų | 199 | 135.1 Ų | 135.1 | 87% | 0.865 | 81% | 0.812 | S | S | * | * | trans | -105.5 | 139.9 | -172.6 | -59.6 | 165.7 | -175.9 | 172.1 | 0 | 111.3 | ||||
| 267 | N | 27.6 | Very low | 31.1 | Very low | 159 Ų | 159 | 138.9 Ų | 138.9 | 85% | 0.85 | 82% | 0.816 | S | S | * | * | trans | -77.8 | 140.7 | 168.8 | -80.3 | -36.6 | 0 | 0 | 0 | 111.5 | ||||
| 268 | P | 35.6 | Very low | 30.5 | Very low | 124 Ų | 124 | 133.4 Ų | 133.4 | 81% | 0.805 | 80% | 0.804 | S | S | * | * | trans | -83.5 | 159.3 | 172.5 | 34.5 | -34.6 | 0 | 0 | 0 | 112.5 | ||||
| 269 | V | 31.8 | Very low | 30.5 | Very low | 137 Ų | 137 | 134.1 Ų | 134.1 | 83% | 0.83 | 80% | 0.802 | S | S | * | * | trans | -127.9 | 119.7 | 179.2 | 173.7 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 270 | L | 30.2 | Very low | 30 | Very low | 164 Ų | 164 | 134.8 Ų | 134.8 | 86% | 0.859 | 79% | 0.794 | S | S | * | * | trans | -168.5 | 153.4 | 156.3 | -128.8 | 60.4 | 0 | 0 | 0 | 106.5 | ||||
| 271 | N | 25.3 | Very low | 30.4 | Very low | 112 Ų | 112 | 134.8 Ų | 134.8 | 60% | 0.599 | 78% | 0.783 | S | S | * | * | cis | -141.9 | 163.6 | 15.7 | -171.1 | 38.5 | 0 | 0 | 0 | 112.5 | H273 | N271-H273 PolarHBondContact ND2-CE1 3.09Å; N271-H273 VanDerWaalsContact ND2-CE1 3.26Å; N271-H273 PolarHBondContact ND2-NE2 3.23Å; N271-H273 VanDerWaalsContact ND2-NE2 3.11Å | ||
| 272 | Q | 29.2 | Very low | 30.5 | Very low | 176 Ų | 176 | 134.2 Ų | 134.2 | 82% | 0.822 | 78% | 0.779 | S | S | * | * | trans | -103 | 139.4 | 179.9 | -67 | 175.4 | 6.5 | 0 | 0 | 112.8 | ||||
| 273 | H | 28.6 | Very low | 31.1 | Very low | 175 Ų | 175 | 137.5 Ų | 137.5 | 81% | 0.81 | 78% | 0.78 | S | S | * | * | trans | -141 | 140.2 | 160.2 | -56.4 | -70.8 | 0 | 0 | 0 | 110.1 | N271 | N271-H273 PolarHBondContact ND2-CE1 3.09Å; N271-H273 VanDerWaalsContact ND2-CE1 3.26Å; N271-H273 PolarHBondContact ND2-NE2 3.23Å; N271-H273 VanDerWaalsContact ND2-NE2 3.11Å | ||
| 274 | A | 27 | Very low | 31.5 | Very low | 102 Ų | 102 | 142.7 Ų | 142.7 | 84% | 0.843 | 79% | 0.786 | S | S | * | * | trans | -128.8 | 173.1 | -175.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 275 | A | 33.7 | Very low | 31.8 | Very low | 97 Ų | 97 | 148.5 Ų | 148.5 | 80% | 0.802 | 79% | 0.793 | S | S | * | * | cis | -173.5 | 164.8 | -28.4 | 0 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 276 | T | 27.8 | Very low | 31.9 | Very low | 132 Ų | 132 | 150.1 Ų | 150.1 | 81% | 0.81 | 79% | 0.794 | S | S | * | * | trans | -155.9 | 122.1 | 156.7 | -165 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 277 | N | 26.1 | Very low | 31.8 | Very low | 146 Ų | 146 | 143.5 Ų | 143.5 | 78% | 0.781 | 78% | 0.783 | S | S | * | * | trans | 38.3 | 129.3 | 135.5 | -155.3 | 26.3 | 0 | 0 | 0 | 119.8 | ||||
| 278 | G | 30.5 | Very low | 32.6 | Very low | 66 Ų | 66 | 142 Ų | 142 | 68% | 0.68 | 79% | 0.785 | S | S | * | * | cis | 144.6 | 155.4 | 5.1 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 279 | Q | 32.3 | Very low | 32.6 | Very low | 157 Ų | 157 | 141.1 Ų | 141.1 | 73% | 0.734 | 78% | 0.777 | S | S | * | * | cis | -122.9 | -124.5 | 2.1 | -53.5 | -178.4 | 8.5 | 0 | 0 | 110.3 | ||||
| 280 | Y | 27.5 | Very low | 33.3 | Very low | 192 Ų | 192 | 142.3 Ų | 142.3 | 75% | 0.753 | 78% | 0.778 | S | S | * | * | cis | -150.4 | 145.2 | 1.1 | -176.9 | -101.1 | 0 | 0 | 0 | 111.2 | ||||
| 281 | M | 36.1 | Very low | 33.7 | Very low | 119 Ų | 119 | 142.3 Ų | 142.3 | 59% | 0.586 | 77% | 0.773 | S | S | * | * | trans | 15.2 | 131.6 | 174.5 | -55.1 | -50.3 | 122.1 | 0 | 0 | 123.8 | ||||
| 282 | S | 32.8 | Very low | 34.4 | Very low | 103 Ų | 103 | 143.9 Ų | 143.9 | 72% | 0.72 | 78% | 0.777 | S | S | * | * | trans | -98 | 144 | 161.2 | 85.6 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 283 | H | 38.2 | Very low | 35 | Very low | 192 Ų | 192 | 140.3 Ų | 140.3 | 89% | 0.889 | 77% | 0.769 | S | S | * | * | trans | -107.3 | 112.8 | 157.4 | -82.2 | -73.9 | 0 | 0 | 0 | 110.5 | ||||
| 284 | K | 40.8 | Very low | 36.1 | Very low | 199 Ų | 199 | 135 Ų | 135 | 87% | 0.865 | 75% | 0.751 | S | S | * | * | trans | -81.4 | 135.6 | 156.8 | -71.8 | -171.1 | 174.3 | -171.4 | 0 | 108.8 | ||||
| 285 | R | 41.6 | Very low | 37.5 | Very low | 238 Ų | 238 | 134.6 Ų | 134.6 | 90% | 0.898 | 74% | 0.74 | S | S | * | * | trans | -140.8 | 129.4 | 155.6 | -178 | 167.7 | -68.4 | -165.2 | 1.2 | 108.6 | ||||
| 286 | D | 35.7 | Very low | 38.6 | Very low | 163 Ų | 163 | 135.3 Ų | 135.3 | 87% | 0.872 | 73% | 0.727 | S | S | * | * | trans | -74.7 | 141.6 | 170.4 | -161.4 | -77 | 0 | 0 | 0 | 109.2 | ||||
| 287 | G | 30.6 | Very low | 40.2 | Very low | 61 Ų | 61 | 133 Ų | 133 | 63% | 0.629 | 72% | 0.716 | S | S | * | * | trans | 172.3 | 88.5 | -172.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | V289 | G287-V289 PolarHBondContact O-N 2.97Š| ||
| 288 | S | 44.6 | Very low | 42.4 | Very low | 127 Ų | 127 | 128.8 Ų | 128.8 | 89% | 0.888 | 69% | 0.691 | S | S | * | * | trans | -72.6 | 90 | 165.7 | 172.4 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 289 | V | 35.3 | Very low | 44.7 | Very low | 106 Ų | 106 | 131.2 Ų | 131.2 | 64% | 0.642 | 70% | 0.695 | S | S | * | * | trans | -112.1 | 129 | 167.4 | 175.5 | 0 | 0 | 0 | 0 | 109.4 | G287 E291 | G287-V289 PolarHBondContact O-N 2.97Å; V289-E291 PolarHBondContact O-N 3.41Å; V289-E291 VanDerWaalsContact O-N 3.14Å | ||
| 290 | L | 46 | Very low | 46.8 | Very low | 162 Ų | 162 | 126 Ų | 126 | 85% | 0.848 | 67% | 0.672 | S | S | * | * | trans | -72.9 | 94.4 | 167 | 177 | 69.5 | 0 | 0 | 0 | 107.7 | E292 | L290-E292 PolarHBondContact O-N 3.2Š| ||
| 291 | E | 37.7 | Very low | 49.4 | Very low | 163 Ų | 163 | 119 Ų | 119 | 76% | 0.762 | 65% | 0.645 | S | S | * | * | trans | -64 | 104.6 | 170.4 | -74.8 | -71.6 | 92.4 | 0 | 0 | 108.7 | V289 | V289-E291 PolarHBondContact O-N 3.41Å; V289-E291 VanDerWaalsContact O-N 3.14Å | ||
| 292 | E | 41.3 | Very low | 51.5 | Low | 145 Ų | 145 | 114 Ų | 114 | 68% | 0.678 | 62% | 0.624 | S | S | * | * | trans | -65.5 | 128.1 | 176.8 | -160 | -88 | 116 | 0 | 0 | 108.6 | L290 S294 | L290-E292 PolarHBondContact O-N 3.2Å; E292-S294 VanDerWaalsContact C-N 3.28Å; E292-S294 PolarHBondContact O-N 2.91Å | ||
| 293 | P | 41.9 | Very low | 53.7 | Low | 102 Ų | 102 | 118.1 Ų | 118.1 | 66% | 0.662 | 63% | 0.631 | S | S | * | * | trans | -74.5 | 80.5 | -169.6 | 30.9 | -36.4 | 0 | 0 | 0 | 111.4 | ||||
| 294 | S | 51.3 | Low | 55.7 | Low | 62 Ų | 62 | 109.7 Ų | 109.7 | 43% | 0.434 | 60% | 0.596 | S | S | . | * | trans | -43.2 | 130.6 | 180 | -173 | 0 | 0 | 0 | 0 | 111.4 | E292 H296 S297 | E292-S294 VanDerWaalsContact C-N 3.28Å; E292-S294 PolarHBondContact O-N 2.91Å; S294-H296 PolarHBondContact O-N 3.49Å; S294-S297 PolarHBondContact O-N 3.43Å; S294-S297 PolarHBondContact O-OG 3.04Å | ||
| 295 | P | 55.8 | Low | 57.8 | Low | 94 Ų | 94 | 102.4 Ų | 102.4 | 61% | 0.61 | 57% | 0.569 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.4 | 10.3 | -166.7 | 25.6 | -35.7 | 0 | 0 | 0 | 115.8 | F318 | P295-F318 WeakPolarHBondContact O-CE1 3.41Š|
| 296 | H | 56.9 | Low | 60 | Low | 112 Ų | 112 | 91.2 Ų | 91.2 | 52% | 0.519 | 53% | 0.527 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -117.4 | -0.9 | 177.1 | -52.3 | 103.5 | 0 | 0 | 0 | 113.2 | S294 H298 F318 | S294-H296 PolarHBondContact O-N 3.49Å; H296-H298 PolarHBondContact O-N 3.48Å; H296-F318 HydrophobicContact CB-CD1 4.45Å; H296-F318 HydrophobicContact CB-CG 4.27Å; H296-F318 AromaticContact CD2-CD1 3.74Å; H296-F318 AromaticContact CD2-CG 3.92Å; H296-F318 WeakPolarHBondContact O-CE2 3.49Å |
| 297 | S | 60.5 | Low | 62.2 | Low | 84 Ų | 84 | 88.4 Ų | 88.4 | 59% | 0.587 | 51% | 0.507 | S | S | * | . | trans | -89.9 | 73.5 | -176.7 | 67.2 | 0 | 0 | 0 | 0 | 113 | S294 | S294-S297 PolarHBondContact O-N 3.43Å; S294-S297 PolarHBondContact O-OG 3.04Å | ||
| 298 | H | 72.3 | Confident | 64.6 | Low | 57 Ų | 57 | 90 Ų | 90 | 26% | 0.264 | 49% | 0.494 | S | S | . | . | trans | -89.7 | 133.8 | 169.7 | -171 | -104.4 | 0 | 0 | 0 | 111 | H296 L300 Y301 F318 F321 L325 | H296-H298 PolarHBondContact O-N 3.48Å; H298-L300 PolarHBondContact ND1-N 2.97Å; H298-L300 PolarHBondContact O-N 2.98Å; H298-Y301 PolarHBondContact O-N 2.89Å; H298-F318 HydrophobicContact CB-CE2 3.6Å; H298-F318 HydrophobicContact CB-CZ 3.9Å; H298-F321 HydrophobicContact CB-CE1 4.07Å; H298-F321 AromaticContact CG-CE1 3.91Å; H298-F321 AromaticContact ND1-CE1 3.46Å; H298-F321 WeakPolarHBondContact ND1-CE1 3.35Å; H298-F321 AromaticContact ND1-CZ 3.42Å; H298-F321 WeakPolarHBondContact ND1-CZ 3.39Å; H298-L325 WeakPolarHBondContact CE1-CD2 3.35Å | ||
| 299 | P | 79.6 | Confident | 66.2 | Low | 117 Ų | 117 | 89.3 Ų | 89.3 | 76% | 0.76 | 49% | 0.487 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.5 | -26.6 | -175.1 | -27.7 | 35.6 | 0 | 0 | 0 | 115.4 | ||
| 300 | L | 77.3 | Confident | 67.8 | Low | 48 Ų | 48 | 88.7 Ų | 88.7 | 25% | 0.251 | 50% | 0.501 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.2 | 10 | 178.3 | -63.4 | 163 | 0 | 0 | 0 | 113.4 | H298 K307 W308 F321 L325 | H298-L300 PolarHBondContact ND1-N 2.97Å; H298-L300 PolarHBondContact O-N 2.98Å; L300-K307 PolarHBondContact O-N 3.41Å; L300-W308 HydrophobicContact CD1-CE3 3.74Å; L300-W308 HydrophobicContact CD1-CZ3 3.95Å; L300-W308 HydrophobicContact CD2-CE3 4.3Å; L300-F321 HydrophobicContact CB-CZ 4.24Å; L300-F321 WeakPolarHBondContact O-CE2 3.47Å; L300-L325 HydrophobicContact CD1-CD1 4.22Å |
| 301 | Y | 81.1 | Confident | 69.4 | Low | 44 Ų | 44 | 82 Ų | 82 | 17% | 0.173 | 47% | 0.468 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.1 | 144.8 | 175 | -176.5 | -115.5 | 0 | 0 | 0 | 110.5 | H298 F318 F321 | H298-Y301 PolarHBondContact O-N 2.89Å; Y301-F318 AromaticContact CD1-CD2 3.54Å; Y301-F318 HydrophobicContact CD1-CD2 3.54Å; Y301-F318 HydrophobicContact CD1-CE2 4.06Å; Y301-F318 HydrophobicContact CE1-CB 4.23Å; Y301-F318 AromaticContact CE1-CD2 3.75Å; Y301-F318 HydrophobicContact CE1-CD2 3.75Å; Y301-F318 HydrophobicContact CE1-CG 4.47Å; Y301-F318 HydrophobicContact CG-CD2 4.02Å; Y301-F318 HydrophobicContact CG-CE2 4.35Å; Y301-F321 HydrophobicContact CD2-CB 3.68Å; Y301-F321 AromaticContact CD2-CD1 3.89Å; Y301-F321 HydrophobicContact CD2-CD1 3.89Å; Y301-F321 AromaticContact CD2-CD2 3.65Å; Y301-F321 HydrophobicContact CD2-CD2 3.65Å; Y301-F321 HydrophobicContact CD2-CE2 4.33Å; Y301-F321 AromaticContact CD2-CG 3.4Å; Y301-F321 HydrophobicContact CD2-CG 3.4Å; Y301-F321 VanDerWaalsContact CD2-CG 3.4Å; Y301-F321 HydrophobicContact CE2-CB 3.72Å; Y301-F321 HydrophobicContact CE2-CD2 4.45Å; Y301-F321 HydrophobicContact CE2-CG 4.01Å; Y301-F321 HydrophobicContact CG-CD1 4.02Å; Y301-F321 HydrophobicContact CG-CD2 4.38Å; Y301-F321 HydrophobicContact CG-CE1 4.42Å; Y301-F321 HydrophobicContact CG-CG 4.02Å |
| 302 | G | 80 | Confident | 71.4 | Confident | 15 Ų | 15 | 82.9 Ų | 82.9 | 16% | 0.155 | 47% | 0.472 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 167.6 | 146 | 164.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | G304 V305 K307 | G302-G304 PolarHBondContact O-N 3.35Å; G302-V305 PolarHBondContact N-O 3.28Å; G302-V305 WeakPolarHBondContact O-CG2 3.18Å; G302-V305 PolarHBondContact O-N 3.47Å; G302-K307 WeakPolarHBondContact O-CE 3.34Å |
| 303 | H | 78.3 | Confident | 73.3 | Confident | 189 Ų | 189 | 77.4 Ų | 77.4 | 88% | 0.875 | 45% | 0.452 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.4 | 33.5 | -165.7 | -52.5 | -68.9 | 0 | 0 | 0 | 113.3 | V305 | H303-V305 VanDerWaalsContact C-N 3.25Å; H303-V305 PolarHBondContact O-N 3.03Å |
| 304 | G | 81.3 | Confident | 75.4 | Confident | 15 Ų | 15 | 77.4 Ų | 77.4 | 16% | 0.155 | 45% | 0.45 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 72.1 | 8.9 | -179.6 | 0 | 0 | 0 | 0 | 0 | 115 | G302 V314 F315 | G302-G304 PolarHBondContact O-N 3.35Å; G304-V314 CarbonylContact O-C 3.2Å; G304-V314 WeakPolarHBondContact O-CA 3.38Å; G304-F315 WeakPolarHBondContact CA-O 3.45Å; G304-F315 PolarHBondContact O-N 3.17Å; G304-F315 VanDerWaalsContact O-O 3.12Å |
| 305 | V | 84 | Confident | 76.9 | Confident | 47 Ų | 47 | 76.1 Ų | 76.1 | 29% | 0.285 | 44% | 0.436 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116 | 147.7 | -179.9 | -54.9 | 0 | 0 | 0 | 0 | 113 | G302 H303 K307 A313 V314 | G302-V305 PolarHBondContact N-O 3.28Å; G302-V305 WeakPolarHBondContact O-CG2 3.18Å; G302-V305 PolarHBondContact O-N 3.47Å; H303-V305 VanDerWaalsContact C-N 3.25Å; H303-V305 PolarHBondContact O-N 3.03Å; V305-K307 HydrophobicContact CG2-CG 4.29Å; V305-A313 WeakPolarHBondContact CA-O 3.45Å; V305-V314 HydrophobicContact CG1-CB 4.44Å; V305-V314 HydrophobicContact CG1-CG1 4.24Å; V305-V314 HydrophobicContact CG1-CG2 4.06Å |
| 306 | C | 87.7 | Confident | 78.1 | Confident | 3 Ų | 3 | 79.3 Ų | 79.3 | 2% | 0.02 | 45% | 0.448 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.3 | 134.7 | 161.7 | -174.2 | 0 | 0 | 0 | 0 | 109.4 | A313 F315 F321 H324 H329 | C306-A313 PolarHBondContact N-O 3.41Å; C306-F315 HydrophobicContact CB-CE2 4.22Å; C306-F321 HydrophobicContact CB-CD2 4.16Å; C306-F321 HydrophobicContact CB-CE2 4.03Å; C306-H324 WeakPolarHBondContact CB-NE2 3.38Å; C306-H324 PolarHBondContact SG-NE2 3.03Å; C306-H324 VanDerWaalsContact SG-NE2 3.44Å; C306-H329 VanDerWaalsContact SG-CD2 3.54Å |
| 307 | K | 83.6 | Confident | 79.4 | Confident | 104 Ų | 104 | 78.8 Ų | 78.8 | 45% | 0.452 | 45% | 0.449 | S | S | . | . | trans | -110.4 | 23.1 | -179.1 | -61.4 | -177.9 | 176.7 | 176.3 | 0 | 112.6 | L300 G302 V305 | L300-K307 PolarHBondContact O-N 3.41Å; G302-K307 WeakPolarHBondContact O-CE 3.34Å; V305-K307 HydrophobicContact CG2-CG 4.29Å | ||
| 308 | W | 80.7 | Confident | 80.5 | Confident | 94 Ų | 94 | 76.6 Ų | 76.6 | 36% | 0.356 | 43% | 0.429 | S | S | . | . | S | Bend | trans | -69.1 | 139.4 | 173.4 | -170.2 | -92 | 0 | 0 | 0 | 110.3 | L300 G310 C311 H329 | L300-W308 HydrophobicContact CD1-CE3 3.74Å; L300-W308 HydrophobicContact CD1-CZ3 3.95Å; L300-W308 HydrophobicContact CD2-CE3 4.3Å; W308-G310 PolarHBondContact O-N 3.26Å; W308-C311 HydrophobicContact CB-CB 4Å; W308-C311 PolarHBondContact O-N 3.35Å; W308-H329 VanDerWaalsContact CB-CD2 3.5Å; W308-H329 WeakPolarHBondContact CB-CD2 3.43Å; W308-H329 WeakPolarHBondContact CB-NE2 3.43Å; W308-H329 AromaticContact CD1-CE1 3.93Å; W308-H329 HydrophobicContact CD2-CB 4.3Å; W308-H329 HydrophobicContact CE3-CB 4.44Å; W308-H329 AromaticContact CG-CD2 3.66Å; W308-H329 AromaticContact CG-CG 3.94Å; W308-H329 AromaticContact CG-NE2 3.8Å |
| 309 | P | 77 | Confident | 81.1 | Confident | 113 Ų | 113 | 80.6 Ų | 80.6 | 73% | 0.734 | 45% | 0.448 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57 | 115.1 | -180 | -26.2 | 35.5 | 0 | 0 | 0 | 112.4 | ||
| 310 | G | 68.6 | Low | 81.4 | Confident | 92 Ų | 92 | 77.4 Ų | 77.4 | 95% | 0.948 | 43% | 0.428 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 86.2 | 8.1 | -177.7 | 0 | 0 | 0 | 0 | 0 | 115.5 | W308 | W308-G310 PolarHBondContact O-N 3.26Š|
| 311 | C | 80.3 | Confident | 81.8 | Confident | 23 Ų | 23 | 75.1 Ų | 75.1 | 16% | 0.155 | 42% | 0.416 | C | S | . | . | trans | -110.5 | 136.3 | 168.2 | -169.5 | 0 | 0 | 0 | 0 | 110.6 | W308 H324 H329 | W308-C311 HydrophobicContact CB-CB 4Å; W308-C311 PolarHBondContact O-N 3.35Å; C311-H324 VanDerWaalsContact SG-CE1 3.57Å; C311-H329 WeakPolarHBondContact CB-NE2 3.47Å; C311-H329 PolarHBondContact SG-NE2 3.46Å | ||
| 312 | E | 79.3 | Confident | 82 | Confident | 180 Ų | 180 | 76.8 Ų | 76.8 | 84% | 0.841 | 43% | 0.428 | S | S | * | . | trans | -125.2 | 21.7 | 177.6 | -59.9 | -173.7 | 122.5 | 0 | 0 | 111.4 | ||||
| 313 | A | 81.4 | Confident | 82.2 | Confident | 30 Ų | 30 | 82.2 Ų | 82.2 | 25% | 0.248 | 45% | 0.447 | C | S | . | . | trans | -68.7 | 133.1 | -175 | 0 | 0 | 0 | 0 | 0 | 112.2 | V305 C306 F315 | V305-A313 WeakPolarHBondContact CA-O 3.45Å; C306-A313 PolarHBondContact N-O 3.41Å; A313-F315 HydrophobicContact CB-CE2 3.58Å; A313-F315 HydrophobicContact CB-CZ 3.54Å; A313-F315 WeakPolarHBondContact O-CE2 3.46Å | ||
| 314 | V | 85.7 | Confident | 82.6 | Confident | 102 Ų | 102 | 74.3 Ų | 74.3 | 62% | 0.618 | 41% | 0.411 | S | S | * | . | B | Isolated β-bridge | trans | -105.3 | 140.1 | -175.3 | -165.6 | 0 | 0 | 0 | 0 | 110.3 | G304 V305 | G304-V314 CarbonylContact O-C 3.2Å; G304-V314 WeakPolarHBondContact O-CA 3.38Å; V305-V314 HydrophobicContact CG1-CB 4.44Å; V305-V314 HydrophobicContact CG1-CG1 4.24Å; V305-V314 HydrophobicContact CG1-CG2 4.06Å |
| 315 | F | 83.6 | Confident | 82.7 | Confident | 35 Ų | 35 | 75 Ų | 75 | 15% | 0.154 | 41% | 0.411 | C | S | . | . | trans | -143.4 | 127.2 | -178.1 | -53.6 | -77.5 | 0 | 0 | 0 | 110.4 | G304 C306 A313 D317 F321 H324 | G304-F315 WeakPolarHBondContact CA-O 3.45Å; G304-F315 PolarHBondContact O-N 3.17Å; G304-F315 VanDerWaalsContact O-O 3.12Å; C306-F315 HydrophobicContact CB-CE2 4.22Å; A313-F315 HydrophobicContact CB-CE2 3.58Å; A313-F315 HydrophobicContact CB-CZ 3.54Å; A313-F315 WeakPolarHBondContact O-CE2 3.46Å; F315-D317 VanDerWaalsContact C-N 3.33Å; F315-F321 HydrophobicContact CB-CB 4.12Å; F315-F321 HydrophobicContact CD2-CB 3.84Å; F315-F321 HydrophobicContact CD2-CD2 4.21Å; F315-F321 HydrophobicContact CE2-CD2 4.44Å; F315-F321 HydrophobicContact CG-CB 3.99Å; F315-H324 HydrophobicContact CE1-CB 3.61Å; F315-H324 AromaticContact CE1-CG 3.99Å; F315-H324 HydrophobicContact CE2-CB 3.99Å; F315-H324 AromaticContact CE2-CD2 3.34Å; F315-H324 WeakPolarHBondContact CE2-CD2 3.43Å; F315-H324 AromaticContact CE2-CG 3.66Å; F315-H324 AromaticContact CE2-NE2 3.92Å; F315-H324 HydrophobicContact CZ-CB 3.29Å; F315-H324 AromaticContact CZ-CD2 3.38Å; F315-H324 WeakPolarHBondContact CZ-CD2 3.42Å; F315-H324 AromaticContact CZ-CG 3.15Å; F315-H324 AromaticContact CZ-ND1 3.67Å; F315-H324 AromaticContact CZ-NE2 4Å | ||
| 316 | D | 81.8 | Confident | 82.6 | Confident | 161 Ų | 161 | 78.4 Ų | 78.4 | 86% | 0.861 | 43% | 0.427 | S | S | * | . | S | Bend | trans | -71.4 | -31.6 | 173.5 | -49.6 | -84.7 | 0 | 0 | 0 | 111.6 | ||
| 317 | D | 84.2 | Confident | 82.2 | Confident | 102 Ų | 102 | 83.9 Ų | 83.9 | 55% | 0.545 | 46% | 0.456 | S | S | . | . | S | Bend | trans | -111.4 | 134.9 | -179.3 | -69.5 | -64.4 | 0 | 0 | 0 | 113.2 | F315 Q319 S320 F321 | F315-D317 VanDerWaalsContact C-N 3.33Å; D317-Q319 PolarHBondContact O-N 2.88Å; D317-S320 WeakPolarHBondContact O-CB 3.44Å; D317-S320 PolarHBondContact O-N 2.84Å; D317-F321 PolarHBondContact O-N 2.89Å |
| 318 | F | 82.4 | Confident | 81.8 | Confident | 37 Ų | 37 | 85.6 Ų | 85.6 | 16% | 0.162 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -56.6 | -35.7 | 171.6 | -179 | -114.7 | 0 | 0 | 0 | 113.1 | P295 H296 H298 Y301 S320 F321 L322 | P295-F318 WeakPolarHBondContact O-CE1 3.41Å; H296-F318 HydrophobicContact CB-CD1 4.45Å; H296-F318 HydrophobicContact CB-CG 4.27Å; H296-F318 AromaticContact CD2-CD1 3.74Å; H296-F318 AromaticContact CD2-CG 3.92Å; H296-F318 WeakPolarHBondContact O-CE2 3.49Å; H298-F318 HydrophobicContact CB-CE2 3.6Å; H298-F318 HydrophobicContact CB-CZ 3.9Å; Y301-F318 AromaticContact CD1-CD2 3.54Å; Y301-F318 HydrophobicContact CD1-CD2 3.54Å; Y301-F318 HydrophobicContact CD1-CE2 4.06Å; Y301-F318 HydrophobicContact CE1-CB 4.23Å; Y301-F318 AromaticContact CE1-CD2 3.75Å; Y301-F318 HydrophobicContact CE1-CD2 3.75Å; Y301-F318 HydrophobicContact CE1-CG 4.47Å; Y301-F318 HydrophobicContact CG-CD2 4.02Å; Y301-F318 HydrophobicContact CG-CE2 4.35Å; F318-S320 VanDerWaalsContact C-N 3.29Å; F318-S320 PolarHBondContact O-N 3.03Å; F318-F321 HydrophobicContact CD2-CD1 4.04Å; F318-F321 AromaticContact CE2-CD1 3.98Å; F318-F321 HydrophobicContact CE2-CD1 3.98Å; F318-F321 HydrophobicContact CE2-CE1 4.27Å; F318-F321 WeakPolarHBondContact O-CB 3.45Å; F318-F321 PolarHBondContact O-N 2.86Å; F318-L322 WeakPolarHBondContact O-CB 3.49Å; F318-L322 PolarHBondContact O-N 3.43Å |
| 319 | Q | 85.3 | Confident | 81.6 | Confident | 141 Ų | 141 | 82.7 Ų | 82.7 | 66% | 0.659 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -74.3 | -20.9 | 179.2 | -160.7 | 171.5 | 62.6 | 0 | 0 | 112.7 | D317 K323 | D317-Q319 PolarHBondContact O-N 2.88Å; Q319-K323 WeakPolarHBondContact O-CG 3.17Å; Q319-K323 PolarHBondContact O-N 3.16Å |
| 320 | S | 86.4 | Confident | 81.3 | Confident | 50 Ų | 50 | 79 Ų | 79 | 35% | 0.35 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -78.6 | -42.2 | 169.9 | -64.2 | 0 | 0 | 0 | 0 | 111 | D317 F318 L322 K323 H324 | D317-S320 WeakPolarHBondContact O-CB 3.44Å; D317-S320 PolarHBondContact O-N 2.84Å; F318-S320 VanDerWaalsContact C-N 3.29Å; F318-S320 PolarHBondContact O-N 3.03Å; S320-L322 VanDerWaalsContact C-N 3.31Å; S320-L322 PolarHBondContact O-N 3.25Å; S320-K323 PolarHBondContact O-N 2.99Å; S320-H324 PolarHBondContact O-N 3.21Å |
| 321 | F | 86 | Confident | 80.9 | Confident | 0 Ų | 0 | 81.6 Ų | 81.6 | 0% | 0 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -54.7 | -45.8 | 167.8 | 160.7 | -94.9 | 0 | 0 | 0 | 111.9 | H298 L300 Y301 C306 F315 D317 F318 K323 H324 L325 | H298-F321 HydrophobicContact CB-CE1 4.07Å; H298-F321 AromaticContact CG-CE1 3.91Å; H298-F321 AromaticContact ND1-CE1 3.46Å; H298-F321 WeakPolarHBondContact ND1-CE1 3.35Å; H298-F321 AromaticContact ND1-CZ 3.42Å; H298-F321 WeakPolarHBondContact ND1-CZ 3.39Å; L300-F321 HydrophobicContact CB-CZ 4.24Å; L300-F321 WeakPolarHBondContact O-CE2 3.47Å; Y301-F321 HydrophobicContact CD2-CB 3.68Å; Y301-F321 AromaticContact CD2-CD1 3.89Å; Y301-F321 HydrophobicContact CD2-CD1 3.89Å; Y301-F321 AromaticContact CD2-CD2 3.65Å; Y301-F321 HydrophobicContact CD2-CD2 3.65Å; Y301-F321 HydrophobicContact CD2-CE2 4.33Å; Y301-F321 AromaticContact CD2-CG 3.4Å; Y301-F321 HydrophobicContact CD2-CG 3.4Å; Y301-F321 VanDerWaalsContact CD2-CG 3.4Å; Y301-F321 HydrophobicContact CE2-CB 3.72Å; Y301-F321 HydrophobicContact CE2-CD2 4.45Å; Y301-F321 HydrophobicContact CE2-CG 4.01Å; Y301-F321 HydrophobicContact CG-CD1 4.02Å; Y301-F321 HydrophobicContact CG-CD2 4.38Å; Y301-F321 HydrophobicContact CG-CE1 4.42Å; Y301-F321 HydrophobicContact CG-CG 4.02Å; C306-F321 HydrophobicContact CB-CD2 4.16Å; C306-F321 HydrophobicContact CB-CE2 4.03Å; F315-F321 HydrophobicContact CB-CB 4.12Å; F315-F321 HydrophobicContact CD2-CB 3.84Å; F315-F321 HydrophobicContact CD2-CD2 4.21Å; F315-F321 HydrophobicContact CE2-CD2 4.44Å; F315-F321 HydrophobicContact CG-CB 3.99Å; D317-F321 PolarHBondContact O-N 2.89Å; F318-F321 HydrophobicContact CD2-CD1 4.04Å; F318-F321 AromaticContact CE2-CD1 3.98Å; F318-F321 HydrophobicContact CE2-CD1 3.98Å; F318-F321 HydrophobicContact CE2-CE1 4.27Å; F318-F321 WeakPolarHBondContact O-CB 3.45Å; F318-F321 PolarHBondContact O-N 2.86Å; F321-K323 VanDerWaalsContact C-N 3.33Å; F321-K323 PolarHBondContact O-N 3.45Å; F321-H324 WeakPolarHBondContact O-CB 3.38Å; F321-H324 PolarHBondContact O-N 2.96Å; F321-H324 VanDerWaalsContact O-N 3.16Å; F321-L325 HydrophobicContact CE1-CB 4.46Å; F321-L325 HydrophobicContact CE1-CD2 4.16Å; F321-L325 HydrophobicContact CE2-CB 4.41Å; F321-L325 HydrophobicContact CE2-CD1 4.4Å; F321-L325 HydrophobicContact CZ-CB 4.13Å; F321-L325 HydrophobicContact CZ-CD1 4.05Å; F321-L325 HydrophobicContact CZ-CD2 3.96Å; F321-L325 HydrophobicContact CZ-CG 4.28Å; F321-L325 WeakPolarHBondContact O-CB 3.39Å; F321-L325 PolarHBondContact O-N 2.78Å |
| 322 | L | 85.1 | Confident | 80.2 | Confident | 80 Ų | 80 | 85 Ų | 85 | 42% | 0.419 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -65.4 | -35.9 | -176.6 | -159.4 | 73.4 | 0 | 0 | 0 | 112.3 | F318 S320 N326 | F318-L322 WeakPolarHBondContact O-CB 3.49Å; F318-L322 PolarHBondContact O-N 3.43Å; S320-L322 VanDerWaalsContact C-N 3.31Å; S320-L322 PolarHBondContact O-N 3.25Å; L322-N326 WeakPolarHBondContact O-CB 3.37Å; L322-N326 PolarHBondContact O-N 3.34Å; L322-N326 VanDerWaalsContact O-N 3.13Å |
| 323 | K | 83.3 | Confident | 79.6 | Confident | 128 Ų | 128 | 82.8 Ų | 82.8 | 56% | 0.557 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -66.7 | -43.1 | 171.5 | -72.6 | 169.7 | -175.7 | 171.1 | 0 | 111.9 | Q319 S320 F321 N326 N327 | Q319-K323 WeakPolarHBondContact O-CG 3.17Å; Q319-K323 PolarHBondContact O-N 3.16Å; S320-K323 PolarHBondContact O-N 2.99Å; F321-K323 VanDerWaalsContact C-N 3.33Å; F321-K323 PolarHBondContact O-N 3.45Å; K323-N326 PolarHBondContact O-N 2.88Å; K323-N327 WeakPolarHBondContact O-CB 3.42Å; K323-N327 PolarHBondContact O-N 2.88Å; K323-N327 VanDerWaalsContact O-N 3.15Å; K323-N327 PolarHBondContact O-ND2 3.45Å |
| 324 | H | 86.6 | Confident | 79 | Confident | 23 Ų | 23 | 90.4 Ų | 90.4 | 11% | 0.106 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -60 | -49.6 | 174.7 | 156.1 | 74.9 | 0 | 0 | 0 | 111.6 | C306 C311 F315 S320 F321 N326 N327 E328 H329 | C306-H324 WeakPolarHBondContact CB-NE2 3.38Å; C306-H324 PolarHBondContact SG-NE2 3.03Å; C306-H324 VanDerWaalsContact SG-NE2 3.44Å; C311-H324 VanDerWaalsContact SG-CE1 3.57Å; F315-H324 HydrophobicContact CE1-CB 3.61Å; F315-H324 AromaticContact CE1-CG 3.99Å; F315-H324 HydrophobicContact CE2-CB 3.99Å; F315-H324 AromaticContact CE2-CD2 3.34Å; F315-H324 WeakPolarHBondContact CE2-CD2 3.43Å; F315-H324 AromaticContact CE2-CG 3.66Å; F315-H324 AromaticContact CE2-NE2 3.92Å; F315-H324 HydrophobicContact CZ-CB 3.29Å; F315-H324 AromaticContact CZ-CD2 3.38Å; F315-H324 WeakPolarHBondContact CZ-CD2 3.42Å; F315-H324 AromaticContact CZ-CG 3.15Å; F315-H324 AromaticContact CZ-ND1 3.67Å; F315-H324 AromaticContact CZ-NE2 4Å; S320-H324 PolarHBondContact O-N 3.21Å; F321-H324 WeakPolarHBondContact O-CB 3.38Å; F321-H324 PolarHBondContact O-N 2.96Å; F321-H324 VanDerWaalsContact O-N 3.16Å; H324-N326 VanDerWaalsContact C-N 3.26Å; H324-N326 PolarHBondContact O-N 3.42Å; H324-N327 PolarHBondContact O-N 2.94Å; H324-E328 WeakPolarHBondContact ND1-CG 3.33Å; H324-E328 WeakPolarHBondContact O-CB 3.48Å; H324-E328 PolarHBondContact O-N 3.14Å; H324-H329 AromaticContact CE1-NE2 3.66Å; H324-H329 AromaticContact NE2-CD2 3.71Å; H324-H329 AromaticContact NE2-NE2 3.38Å; H324-H329 PolarHBondContact NE2-NE2 3.26Å |
| 325 | L | 83.3 | Confident | 78.6 | Confident | 29 Ų | 29 | 88.2 Ų | 88.2 | 15% | 0.152 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -55.8 | -42.2 | 177.9 | -173.7 | 77.5 | 0 | 0 | 0 | 111.4 | H298 L300 F321 N327 H329 A330 | H298-L325 WeakPolarHBondContact CE1-CD2 3.35Å; L300-L325 HydrophobicContact CD1-CD1 4.22Å; F321-L325 HydrophobicContact CE1-CB 4.46Å; F321-L325 HydrophobicContact CE1-CD2 4.16Å; F321-L325 HydrophobicContact CE2-CB 4.41Å; F321-L325 HydrophobicContact CE2-CD1 4.4Å; F321-L325 HydrophobicContact CZ-CB 4.13Å; F321-L325 HydrophobicContact CZ-CD1 4.05Å; F321-L325 HydrophobicContact CZ-CD2 3.96Å; F321-L325 HydrophobicContact CZ-CG 4.28Å; F321-L325 WeakPolarHBondContact O-CB 3.39Å; F321-L325 PolarHBondContact O-N 2.78Å; L325-N327 VanDerWaalsContact C-N 3.3Å; L325-N327 PolarHBondContact O-N 3.46Å; L325-H329 HydrophobicContact CD1-CB 4.07Å; L325-H329 CarbonylContact O-C 3.52Å; L325-H329 WeakPolarHBondContact O-CA 3.38Å; L325-H329 WeakPolarHBondContact O-CB 3.36Å; L325-H329 PolarHBondContact O-N 3.09Å; L325-A330 PolarHBondContact O-N 3.28Å |
| 326 | N | 82.7 | Confident | 78.6 | Confident | 119 Ų | 119 | 89.4 Ų | 89.4 | 64% | 0.636 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -77.4 | -8.9 | -179.8 | -163.5 | 85.1 | 0 | 0 | 0 | 114.5 | L322 K323 H324 A330 | L322-N326 WeakPolarHBondContact O-CB 3.37Å; L322-N326 PolarHBondContact O-N 3.34Å; L322-N326 VanDerWaalsContact O-N 3.13Å; K323-N326 PolarHBondContact O-N 2.88Å; H324-N326 VanDerWaalsContact C-N 3.26Å; H324-N326 PolarHBondContact O-N 3.42Å; N326-A330 WeakPolarHBondContact O-CB 3.32Å |
| 327 | N | 80 | Confident | 78.6 | Confident | 118 Ų | 118 | 84 Ų | 84 | 63% | 0.631 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -111.6 | -45.6 | -179.4 | -69.8 | -15 | 0 | 0 | 0 | 112.4 | K323 H324 L325 | K323-N327 WeakPolarHBondContact O-CB 3.42Å; K323-N327 PolarHBondContact O-N 2.88Å; K323-N327 VanDerWaalsContact O-N 3.15Å; K323-N327 PolarHBondContact O-ND2 3.45Å; H324-N327 PolarHBondContact O-N 2.94Å; L325-N327 VanDerWaalsContact C-N 3.3Å; L325-N327 PolarHBondContact O-N 3.46Å |
| 328 | E | 75.1 | Confident | 78.5 | Confident | 141 Ų | 141 | 85.2 Ų | 85.2 | 66% | 0.659 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -96.3 | -20.1 | -174.2 | -58.4 | -70.7 | 113.7 | 0 | 0 | 112.6 | H324 | H324-E328 WeakPolarHBondContact ND1-CG 3.33Å; H324-E328 WeakPolarHBondContact O-CB 3.48Å; H324-E328 PolarHBondContact O-N 3.14Å |
| 329 | H | 74.8 | Confident | 78.8 | Confident | 32 Ų | 32 | 87.5 Ų | 87.5 | 15% | 0.148 | 46% | 0.459 | C | S | . | . | S | Bend | trans | -129.4 | 9.1 | -175.9 | -58.8 | -21.4 | 0 | 0 | 0 | 113.6 | C306 W308 C311 H324 L325 L331 | C306-H329 VanDerWaalsContact SG-CD2 3.54Å; W308-H329 VanDerWaalsContact CB-CD2 3.5Å; W308-H329 WeakPolarHBondContact CB-CD2 3.43Å; W308-H329 WeakPolarHBondContact CB-NE2 3.43Å; W308-H329 AromaticContact CD1-CE1 3.93Å; W308-H329 HydrophobicContact CD2-CB 4.3Å; W308-H329 HydrophobicContact CE3-CB 4.44Å; W308-H329 AromaticContact CG-CD2 3.66Å; W308-H329 AromaticContact CG-CG 3.94Å; W308-H329 AromaticContact CG-NE2 3.8Å; C311-H329 WeakPolarHBondContact CB-NE2 3.47Å; C311-H329 PolarHBondContact SG-NE2 3.46Å; H324-H329 AromaticContact CE1-NE2 3.66Å; H324-H329 AromaticContact NE2-CD2 3.71Å; H324-H329 AromaticContact NE2-NE2 3.38Å; H324-H329 PolarHBondContact NE2-NE2 3.26Å; L325-H329 HydrophobicContact CD1-CB 4.07Å; L325-H329 CarbonylContact O-C 3.52Å; L325-H329 WeakPolarHBondContact O-CA 3.38Å; L325-H329 WeakPolarHBondContact O-CB 3.36Å; L325-H329 PolarHBondContact O-N 3.09Å; H329-L331 PolarHBondContact O-N 3.11Å |
| 330 | A | 70.9 | Confident | 79.1 | Confident | 35 Ų | 35 | 88.8 Ų | 88.8 | 29% | 0.289 | 46% | 0.458 | S | S | . | . | S | Bend | trans | -64.7 | 123.9 | 160.3 | 0 | 0 | 0 | 0 | 0 | 108.1 | L325 N326 D332 | L325-A330 PolarHBondContact O-N 3.28Å; N326-A330 WeakPolarHBondContact O-CB 3.32Å; A330-D332 WeakPolarHBondContact O-CA 3.46Å; A330-D332 PolarHBondContact O-N 2.99Å |
| 331 | L | 60.7 | Low | 79.6 | Confident | 148 Ų | 148 | 90.5 Ų | 90.5 | 78% | 0.775 | 47% | 0.466 | S | S | * | . | trans | -58.8 | 104.5 | 174.9 | -71.9 | 166.6 | 0 | 0 | 0 | 108.5 | H329 D333 | H329-L331 PolarHBondContact O-N 3.11Å; L331-D333 PolarHBondContact O-N 3.47Å | ||
| 332 | D | 66.3 | Low | 79.8 | Confident | 95 Ų | 95 | 96.9 Ų | 96.9 | 51% | 0.508 | 50% | 0.496 | S | S | . | . | trans | -50.3 | 125.6 | -142.4 | -58.8 | -121.3 | 0 | 0 | 0 | 113.9 | A330 R334 S335 T336 | A330-D332 WeakPolarHBondContact O-CA 3.46Å; A330-D332 PolarHBondContact O-N 2.99Å; D332-R334 HydrophobicContact CB-CB 3.93Å; D332-R334 PolarHBondContact O-N 3.38Å; D332-R334 VanDerWaalsContact O-N 3.11Å; D332-S335 WeakPolarHBondContact O-CA 3.34Å; D332-S335 PolarHBondContact O-N 2.93Å; D332-S335 PolarHBondContact O-OG 3.43Å; D332-T336 PolarHBondContact O-N 3.33Å | ||
| 333 | D | 67.1 | Low | 80.1 | Confident | 132 Ų | 132 | 99.3 Ų | 99.3 | 71% | 0.706 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -54.5 | -28.6 | 162.1 | -85 | -50.8 | 0 | 0 | 0 | 110.9 | L331 T336 A337 | L331-D333 PolarHBondContact O-N 3.47Å; D333-T336 PolarHBondContact O-N 2.85Å; D333-A337 WeakPolarHBondContact O-CB 3.12Å; D333-A337 PolarHBondContact O-N 3.5Å |
| 334 | R | 68.7 | Low | 80.7 | Confident | 190 Ų | 190 | 100.1 Ų | 100.1 | 72% | 0.717 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.3 | -40.8 | 170.7 | -166.2 | -179.4 | -170.4 | 155.4 | 3.6 | 113.1 | D332 Q338 | D332-R334 HydrophobicContact CB-CB 3.93Å; D332-R334 PolarHBondContact O-N 3.38Å; D332-R334 VanDerWaalsContact O-N 3.11Å; R334-Q338 WeakPolarHBondContact O-CB 3.28Å; R334-Q338 WeakPolarHBondContact O-CG 3.22Å; R334-Q338 PolarHBondContact O-N 3.25Å |
| 335 | S | 77.3 | Confident | 81.2 | Confident | 57 Ų | 57 | 102.6 Ų | 102.6 | 40% | 0.399 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -72.9 | -40.1 | 176.8 | 76.2 | 0 | 0 | 0 | 0 | 111.2 | D332 Q338 C339 | D332-S335 WeakPolarHBondContact O-CA 3.34Å; D332-S335 PolarHBondContact O-N 2.93Å; D332-S335 PolarHBondContact O-OG 3.43Å; S335-Q338 PolarHBondContact O-N 3.33Å; S335-C339 WeakPolarHBondContact O-CB 3.26Å; S335-C339 PolarHBondContact O-N 3.47Å |
| 336 | T | 82.3 | Confident | 81.8 | Confident | 60 Ų | 60 | 104.7 Ų | 104.7 | 37% | 0.368 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -64.4 | -40.7 | 174.7 | -64.2 | 0 | 0 | 0 | 0 | 111.5 | D332 D333 R340 | D332-T336 PolarHBondContact O-N 3.33Å; D333-T336 PolarHBondContact O-N 2.85Å; T336-R340 WeakPolarHBondContact O-CG 3.36Å; T336-R340 PolarHBondContact O-N 2.79Å; T336-R340 VanDerWaalsContact O-N 3.16Å |
| 337 | A | 82.5 | Confident | 82.5 | Confident | 48 Ų | 48 | 105.1 Ų | 105.1 | 40% | 0.397 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -67.9 | -43.2 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | D333 C339 R340 V341 | D333-A337 WeakPolarHBondContact O-CB 3.12Å; D333-A337 PolarHBondContact O-N 3.5Å; A337-C339 VanDerWaalsContact C-N 3.33Å; A337-C339 PolarHBondContact O-N 2.85Å; A337-R340 PolarHBondContact O-N 2.86Å; A337-V341 WeakPolarHBondContact O-CG2 3.41Å; A337-V341 PolarHBondContact O-N 2.89Å |
| 338 | Q | 81.5 | Confident | 83.2 | Confident | 126 Ų | 126 | 104.8 Ų | 104.8 | 59% | 0.589 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -59.5 | -42 | 173.8 | -85.7 | -171.7 | -27.2 | 0 | 0 | 112 | R334 S335 R340 V341 Q342 | R334-Q338 WeakPolarHBondContact O-CB 3.28Å; R334-Q338 WeakPolarHBondContact O-CG 3.22Å; R334-Q338 PolarHBondContact O-N 3.25Å; S335-Q338 PolarHBondContact O-N 3.33Å; Q338-R340 PolarHBondContact O-N 3.11Å; Q338-V341 PolarHBondContact O-N 2.87Å; Q338-Q342 WeakPolarHBondContact O-CB 3.5Å; Q338-Q342 PolarHBondContact O-N 2.85Å |
| 339 | C | 88.4 | Confident | 84.3 | Confident | 85 Ų | 85 | 103.4 Ų | 103.4 | 57% | 0.574 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -58 | -46.4 | 174.6 | -177 | 0 | 0 | 0 | 0 | 111.7 | S335 A337 Q342 M343 | S335-C339 WeakPolarHBondContact O-CB 3.26Å; S335-C339 PolarHBondContact O-N 3.47Å; A337-C339 VanDerWaalsContact C-N 3.33Å; A337-C339 PolarHBondContact O-N 2.85Å; C339-Q342 PolarHBondContact O-N 3.33Å; C339-M343 WeakPolarHBondContact O-CB 3.26Å; C339-M343 PolarHBondContact O-N 2.86Å |
| 340 | R | 92.6 | Very high | 85.3 | Confident | 169 Ų | 169 | 107 Ų | 107 | 64% | 0.638 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -63.3 | -45.2 | 176.6 | -68.1 | 170.3 | -172.6 | -84.9 | 2.3 | 112.6 | T336 A337 Q338 M343 Q344 | T336-R340 WeakPolarHBondContact O-CG 3.36Å; T336-R340 PolarHBondContact O-N 2.79Å; T336-R340 VanDerWaalsContact O-N 3.16Å; A337-R340 PolarHBondContact O-N 2.86Å; Q338-R340 PolarHBondContact O-N 3.11Å; R340-M343 PolarHBondContact O-N 3.31Å; R340-Q344 PolarHBondContact O-N 2.98Å; R340-Q344 VanDerWaalsContact O-N 3.09Å |
| 341 | V | 96.1 | Very high | 86.6 | Confident | 85 Ų | 85 | 109.2 Ų | 109.2 | 52% | 0.515 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -64.6 | -42.7 | 177.1 | 170.3 | 0 | 0 | 0 | 0 | 111 | A337 Q338 M343 Q344 V345 | A337-V341 WeakPolarHBondContact O-CG2 3.41Å; A337-V341 PolarHBondContact O-N 2.89Å; Q338-V341 PolarHBondContact O-N 2.87Å; V341-M343 VanDerWaalsContact C-N 3.33Å; V341-M343 PolarHBondContact O-N 2.77Å; V341-Q344 WeakPolarHBondContact O-CB 3.24Å; V341-Q344 PolarHBondContact O-N 2.94Å; V341-Q344 VanDerWaalsContact O-N 3.14Å; V341-V345 WeakPolarHBondContact O-CG2 3.48Å; V341-V345 PolarHBondContact O-N 2.93Å |
| 342 | Q | 89.9 | Confident | 88.3 | Confident | 134 Ų | 134 | 106 Ų | 106 | 63% | 0.626 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -67.9 | -34.9 | -179.7 | -168.2 | 150.1 | 18.7 | 0 | 0 | 111.7 | Q338 C339 V345 V346 | Q338-Q342 WeakPolarHBondContact O-CB 3.5Å; Q338-Q342 PolarHBondContact O-N 2.85Å; C339-Q342 PolarHBondContact O-N 3.33Å; Q342-V345 PolarHBondContact O-N 3.35Å; Q342-V346 WeakPolarHBondContact O-CG2 3.38Å; Q342-V346 PolarHBondContact O-N 3.47Å |
| 343 | M | 92.2 | Very high | 89.7 | Confident | 132 Ų | 132 | 106.1 Ų | 106.1 | 65% | 0.65 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -64.6 | -38.5 | 170.2 | -169.6 | 165.5 | 64.1 | 0 | 0 | 112.2 | C339 R340 V341 V346 Q347 | C339-M343 WeakPolarHBondContact O-CB 3.26Å; C339-M343 PolarHBondContact O-N 2.86Å; R340-M343 PolarHBondContact O-N 3.31Å; V341-M343 VanDerWaalsContact C-N 3.33Å; V341-M343 PolarHBondContact O-N 2.77Å; M343-V346 PolarHBondContact O-N 2.92Å; M343-Q347 PolarHBondContact O-N 3.31Å |
| 344 | Q | 95.5 | Very high | 91.1 | Very high | 144 Ų | 144 | 102.1 Ų | 102.1 | 67% | 0.673 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -66 | -38.4 | 171.4 | -74.4 | -169.1 | -28.5 | 0 | 0 | 112.9 | R340 V341 Q347 Q348 | R340-Q344 PolarHBondContact O-N 2.98Å; R340-Q344 VanDerWaalsContact O-N 3.09Å; V341-Q344 WeakPolarHBondContact O-CB 3.24Å; V341-Q344 PolarHBondContact O-N 2.94Å; V341-Q344 VanDerWaalsContact O-N 3.14Å; Q344-Q347 PolarHBondContact O-N 3.02Å; Q344-Q348 WeakPolarHBondContact O-CB 3.47Å; Q344-Q348 PolarHBondContact O-N 2.84Å |
| 345 | V | 97.4 | Very high | 92.5 | Very high | 76 Ų | 76 | 97.8 Ų | 97.8 | 46% | 0.461 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.6 | -41.7 | 174.5 | 171.2 | 0 | 0 | 0 | 0 | 111.1 | V341 Q342 Q348 L349 | V341-V345 WeakPolarHBondContact O-CG2 3.48Å; V341-V345 PolarHBondContact O-N 2.93Å; Q342-V345 PolarHBondContact O-N 3.35Å; V345-Q348 PolarHBondContact O-N 3.36Å; V345-L349 HydrophobicContact CG1-CD1 4.09Å; V345-L349 VanDerWaalsContact O-CG 3.31Å; V345-L349 WeakPolarHBondContact O-CG 3.39Å; V345-L349 PolarHBondContact O-N 3.1Å |
| 346 | V | 95.9 | Very high | 93.4 | Very high | 72 Ų | 72 | 98.2 Ų | 98.2 | 44% | 0.436 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.3 | -50 | 173.1 | 170 | 0 | 0 | 0 | 0 | 110.6 | Q342 M343 Q348 L349 E350 | Q342-V346 WeakPolarHBondContact O-CG2 3.38Å; Q342-V346 PolarHBondContact O-N 3.47Å; M343-V346 PolarHBondContact O-N 2.92Å; V346-Q348 VanDerWaalsContact C-N 3.28Å; V346-Q348 PolarHBondContact O-N 3.4Å; V346-L349 WeakPolarHBondContact O-CB 3.42Å; V346-L349 PolarHBondContact O-N 3.45Å; V346-E350 HydrophobicContact CG1-CG 4.35Å; V346-E350 WeakPolarHBondContact O-CG 3.35Å; V346-E350 PolarHBondContact O-N 2.82Å |
| 347 | Q | 96.4 | Very high | 94 | Very high | 129 Ų | 129 | 101.7 Ų | 101.7 | 60% | 0.603 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -59.1 | -38.1 | 178.8 | -162.6 | 106.7 | 100.9 | 0 | 0 | 112.8 | M343 Q344 E350 L351 | M343-Q347 PolarHBondContact O-N 3.31Å; Q344-Q347 PolarHBondContact O-N 3.02Å; Q347-E350 PolarHBondContact NE2-OE2 3.25Å; Q347-E350 VanDerWaalsContact NE2-OE2 3.07Å; Q347-E350 PolarHBondContact O-N 2.94Å; Q347-L351 WeakPolarHBondContact O-CB 3.49Å; Q347-L351 PolarHBondContact O-N 3.38Å |
| 348 | Q | 95.6 | Very high | 94.7 | Very high | 110 Ų | 110 | 106.2 Ų | 106.2 | 51% | 0.514 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -67.7 | -37 | 175.6 | -178.4 | 60.6 | 29.4 | 0 | 0 | 112.2 | Q344 V345 V346 Q352 | Q344-Q348 WeakPolarHBondContact O-CB 3.47Å; Q344-Q348 PolarHBondContact O-N 2.84Å; V345-Q348 PolarHBondContact O-N 3.36Å; V346-Q348 VanDerWaalsContact C-N 3.28Å; V346-Q348 PolarHBondContact O-N 3.4Å; Q348-Q352 WeakPolarHBondContact O-CB 3.35Å; Q348-Q352 PolarHBondContact O-N 3.35Å |
| 349 | L | 97.4 | Very high | 95.3 | Very high | 112 Ų | 112 | 108.1 Ų | 108.1 | 59% | 0.586 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -70.5 | -37.5 | 174.4 | -71.1 | 168.7 | 0 | 0 | 0 | 112.1 | V345 V346 Q352 L353 | V345-L349 HydrophobicContact CG1-CD1 4.09Å; V345-L349 VanDerWaalsContact O-CG 3.31Å; V345-L349 WeakPolarHBondContact O-CG 3.39Å; V345-L349 PolarHBondContact O-N 3.1Å; V346-L349 WeakPolarHBondContact O-CB 3.42Å; V346-L349 PolarHBondContact O-N 3.45Å; L349-Q352 PolarHBondContact O-N 3.06Å; L349-L353 VanDerWaalsContact O-CB 3.3Å; L349-L353 WeakPolarHBondContact O-CB 3.48Å; L349-L353 PolarHBondContact O-N 3.05Å |
| 350 | E | 96.6 | Very high | 95.6 | Very high | 107 Ų | 107 | 108.3 Ų | 108.3 | 50% | 0.5 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -60.7 | -46.3 | 172.2 | -70.1 | 175 | 148.1 | 0 | 0 | 111.3 | V346 Q347 L353 A354 | V346-E350 HydrophobicContact CG1-CG 4.35Å; V346-E350 WeakPolarHBondContact O-CG 3.35Å; V346-E350 PolarHBondContact O-N 2.82Å; Q347-E350 PolarHBondContact NE2-OE2 3.25Å; Q347-E350 VanDerWaalsContact NE2-OE2 3.07Å; Q347-E350 PolarHBondContact O-N 2.94Å; E350-L353 PolarHBondContact O-N 3.3Å; E350-A354 WeakPolarHBondContact O-CB 3.49Å; E350-A354 PolarHBondContact O-N 2.96Å |
| 351 | L | 97.5 | Very high | 95.7 | Very high | 82 Ų | 82 | 105.9 Ų | 105.9 | 43% | 0.429 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.1 | -38.9 | 176.1 | 179.6 | 60.9 | 0 | 0 | 0 | 112.3 | Q347 A354 K355 | Q347-L351 WeakPolarHBondContact O-CB 3.49Å; Q347-L351 PolarHBondContact O-N 3.38Å; L351-A354 PolarHBondContact O-N 3.06Å; L351-K355 WeakPolarHBondContact O-CG 3.42Å; L351-K355 PolarHBondContact O-N 2.63Å; L351-K355 VanDerWaalsContact O-N 3.12Å |
| 352 | Q | 96.1 | Very high | 95.6 | Very high | 81 Ų | 81 | 103.8 Ų | 103.8 | 38% | 0.379 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.6 | -45.4 | 174.9 | -175.6 | 57.3 | 41.5 | 0 | 0 | 111.1 | Q348 L349 A354 K355 D356 | Q348-Q352 WeakPolarHBondContact O-CB 3.35Å; Q348-Q352 PolarHBondContact O-N 3.35Å; L349-Q352 PolarHBondContact O-N 3.06Å; Q352-A354 VanDerWaalsContact C-N 3.29Å; Q352-A354 PolarHBondContact O-N 2.97Å; Q352-K355 PolarHBondContact O-N 3.2Å; Q352-D356 PolarHBondContact NE2-OD2 3.22Å; Q352-D356 PolarHBondContact O-N 2.81Å |
| 353 | L | 97.4 | Very high | 95.8 | Very high | 98 Ų | 98 | 101.9 Ų | 101.9 | 51% | 0.513 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.4 | -34.7 | 176.6 | -177 | 65.2 | 0 | 0 | 0 | 112.3 | L349 E350 K357 | L349-L353 VanDerWaalsContact O-CB 3.3Å; L349-L353 WeakPolarHBondContact O-CB 3.48Å; L349-L353 PolarHBondContact O-N 3.05Å; E350-L353 PolarHBondContact O-N 3.3Å; L353-K357 HydrophobicContact CG-CD 4.49Å; L353-K357 WeakPolarHBondContact O-CB 3.38Å; L353-K357 VanDerWaalsContact O-CG 3.25Å; L353-K357 WeakPolarHBondContact O-CG 3.44Å; L353-K357 PolarHBondContact O-N 2.83Å |
| 354 | A | 96.6 | Very high | 95.7 | Very high | 47 Ų | 47 | 99.5 Ų | 99.5 | 39% | 0.388 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.1 | -48.3 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | E350 L351 Q352 D356 K357 E358 | E350-A354 WeakPolarHBondContact O-CB 3.49Å; E350-A354 PolarHBondContact O-N 2.96Å; L351-A354 PolarHBondContact O-N 3.06Å; Q352-A354 VanDerWaalsContact C-N 3.29Å; Q352-A354 PolarHBondContact O-N 2.97Å; A354-D356 PolarHBondContact O-N 3.43Å; A354-K357 WeakPolarHBondContact O-CB 3.34Å; A354-K357 PolarHBondContact O-N 2.9Å; A354-E358 PolarHBondContact O-N 3.04Å |
| 355 | K | 97.1 | Very high | 95.1 | Very high | 100 Ų | 100 | 95.8 Ų | 95.8 | 44% | 0.435 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -62 | -41.5 | 177.1 | -70.6 | 169.5 | -179.2 | 175.4 | 0 | 112.7 | L351 Q352 K357 E358 R359 | L351-K355 WeakPolarHBondContact O-CG 3.42Å; L351-K355 PolarHBondContact O-N 2.63Å; L351-K355 VanDerWaalsContact O-N 3.12Å; Q352-K355 PolarHBondContact O-N 3.2Å; K355-K357 VanDerWaalsContact C-N 3.33Å; K355-E358 PolarHBondContact O-N 3.28Å; K355-R359 VanDerWaalsContact O-CB 3.3Å; K355-R359 WeakPolarHBondContact O-CB 3.38Å; K355-R359 PolarHBondContact O-N 3.16Å |
| 356 | D | 96.2 | Very high | 94.4 | Very high | 65 Ų | 65 | 98.4 Ų | 98.4 | 35% | 0.348 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -70.7 | -29 | 177 | -76.2 | -44.6 | 0 | 0 | 0 | 112.4 | Q352 A354 R359 L360 | Q352-D356 PolarHBondContact NE2-OD2 3.22Å; Q352-D356 PolarHBondContact O-N 2.81Å; A354-D356 PolarHBondContact O-N 3.43Å; D356-R359 IonicContact OD1-NH1 3.73Å; D356-L360 VanDerWaalsContact O-CB 3.23Å; D356-L360 WeakPolarHBondContact O-CB 3.4Å; D356-L360 PolarHBondContact O-N 3Å |
| 357 | K | 95.6 | Very high | 93.7 | Very high | 134 Ų | 134 | 100.7 Ų | 100.7 | 58% | 0.583 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -66.6 | -46 | 168 | -78.3 | 170.5 | 179.3 | 176.7 | 0 | 112.3 | L353 A354 K355 R359 L360 Q361 | L353-K357 HydrophobicContact CG-CD 4.49Å; L353-K357 WeakPolarHBondContact O-CB 3.38Å; L353-K357 VanDerWaalsContact O-CG 3.25Å; L353-K357 WeakPolarHBondContact O-CG 3.44Å; L353-K357 PolarHBondContact O-N 2.83Å; A354-K357 WeakPolarHBondContact O-CB 3.34Å; A354-K357 PolarHBondContact O-N 2.9Å; K355-K357 VanDerWaalsContact C-N 3.33Å; K357-R359 VanDerWaalsContact C-N 3.35Å; K357-L360 PolarHBondContact O-N 3.44Å; K357-Q361 VanDerWaalsContact O-CB 3.31Å; K357-Q361 WeakPolarHBondContact O-CB 3.47Å; K357-Q361 PolarHBondContact O-N 2.84Å |
| 358 | E | 95.8 | Very high | 92.3 | Very high | 143 Ų | 143 | 100.4 Ų | 100.4 | 67% | 0.668 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -61.5 | -44 | 175.7 | -71.6 | -176.2 | 148.6 | 0 | 0 | 111.5 | A354 K355 Q361 A362 | A354-E358 PolarHBondContact O-N 3.04Å; K355-E358 PolarHBondContact O-N 3.28Å; E358-Q361 PolarHBondContact O-N 3.15Å; E358-A362 WeakPolarHBondContact O-CB 3.38Å; E358-A362 PolarHBondContact O-N 3.29Å |
| 359 | R | 95.5 | Very high | 90.5 | Very high | 165 Ų | 165 | 100 Ų | 100 | 62% | 0.623 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -61.1 | -44.9 | 174.8 | -177.4 | -178.4 | 174 | -150.5 | -1 | 111.9 | K355 D356 K357 A362 M363 | K355-R359 VanDerWaalsContact O-CB 3.3Å; K355-R359 WeakPolarHBondContact O-CB 3.38Å; K355-R359 PolarHBondContact O-N 3.16Å; D356-R359 IonicContact OD1-NH1 3.73Å; K357-R359 VanDerWaalsContact C-N 3.35Å; R359-A362 PolarHBondContact O-N 2.81Å; R359-M363 WeakPolarHBondContact O-CG 3.4Å; R359-M363 PolarHBondContact O-N 2.91Å |
| 360 | L | 95.1 | Very high | 88.4 | Confident | 90 Ų | 90 | 103.5 Ų | 103.5 | 47% | 0.471 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.5 | -42.3 | 176.1 | 179.8 | 59.5 | 0 | 0 | 0 | 111.4 | D356 K357 A362 M363 M364 | D356-L360 VanDerWaalsContact O-CB 3.23Å; D356-L360 WeakPolarHBondContact O-CB 3.4Å; D356-L360 PolarHBondContact O-N 3Å; K357-L360 PolarHBondContact O-N 3.44Å; L360-A362 VanDerWaalsContact C-N 3.33Å; L360-A362 PolarHBondContact O-N 3.43Å; L360-M363 HydrophobicContact CD1-CE 3.83Å; L360-M363 PolarHBondContact O-N 3.06Å; L360-M364 HydrophobicContact CD1-CG 4.33Å; L360-M364 HydrophobicContact CG-SD 4.31Å; L360-M364 WeakPolarHBondContact O-CB 3.36Å; L360-M364 WeakPolarHBondContact O-CG 3.42Å; L360-M364 PolarHBondContact O-N 3.31Å |
| 361 | Q | 94.3 | Very high | 86.2 | Confident | 117 Ų | 117 | 103.2 Ų | 103.2 | 55% | 0.547 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -59.9 | -42.6 | 175.3 | -176.2 | 64.5 | 14.8 | 0 | 0 | 111.2 | K357 E358 M364 T365 | K357-Q361 VanDerWaalsContact O-CB 3.31Å; K357-Q361 WeakPolarHBondContact O-CB 3.47Å; K357-Q361 PolarHBondContact O-N 2.84Å; E358-Q361 PolarHBondContact O-N 3.15Å; Q361-M364 PolarHBondContact O-N 2.74Å; Q361-T365 WeakPolarHBondContact O-CG2 3.38Å; Q361-T365 PolarHBondContact O-N 3.13Å; Q361-T365 PolarHBondContact O-OG1 3.38Å |
| 362 | A | 93.9 | Very high | 83.7 | Confident | 42 Ų | 42 | 104 Ų | 104 | 35% | 0.347 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65.3 | -41 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | E358 R359 L360 M364 T365 H366 | E358-A362 WeakPolarHBondContact O-CB 3.38Å; E358-A362 PolarHBondContact O-N 3.29Å; R359-A362 PolarHBondContact O-N 2.81Å; L360-A362 VanDerWaalsContact C-N 3.33Å; L360-A362 PolarHBondContact O-N 3.43Å; A362-M364 VanDerWaalsContact C-N 3.33Å; A362-M364 PolarHBondContact O-N 3.04Å; A362-T365 PolarHBondContact O-N 3.13Å; A362-T365 PolarHBondContact O-OG1 3.3Å; A362-T365 VanDerWaalsContact O-OG1 3.08Å; A362-H366 WeakPolarHBondContact O-CB 3.4Å; A362-H366 PolarHBondContact O-CD2 3.23Å; A362-H366 PolarHBondContact O-N 3.39Å |
| 363 | M | 93.7 | Very high | 80.9 | Confident | 94 Ų | 94 | 108.2 Ų | 108.2 | 46% | 0.463 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -62.6 | -41.4 | 172.4 | -69 | -166.5 | -52.5 | 0 | 0 | 111.5 | R359 L360 H366 L367 | R359-M363 WeakPolarHBondContact O-CG 3.4Å; R359-M363 PolarHBondContact O-N 2.91Å; L360-M363 HydrophobicContact CD1-CE 3.83Å; L360-M363 PolarHBondContact O-N 3.06Å; M363-H366 PolarHBondContact O-N 3.42Å; M363-L367 WeakPolarHBondContact O-CG 3.47Å; M363-L367 PolarHBondContact O-N 3.33Å |
| 364 | M | 89.8 | Confident | 78.1 | Confident | 81 Ų | 81 | 108.9 Ų | 108.9 | 40% | 0.399 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -65.2 | -45.2 | 176.8 | -73.9 | -176.4 | 70 | 0 | 0 | 111.7 | L360 Q361 A362 H366 L367 H368 | L360-M364 HydrophobicContact CD1-CG 4.33Å; L360-M364 HydrophobicContact CG-SD 4.31Å; L360-M364 WeakPolarHBondContact O-CB 3.36Å; L360-M364 WeakPolarHBondContact O-CG 3.42Å; L360-M364 PolarHBondContact O-N 3.31Å; Q361-M364 PolarHBondContact O-N 2.74Å; A362-M364 VanDerWaalsContact C-N 3.33Å; A362-M364 PolarHBondContact O-N 3.04Å; M364-H366 PolarHBondContact O-N 3.36Å; M364-L367 PolarHBondContact O-N 3.41Å; M364-H368 PolarHBondContact O-N 3.35Å; M364-H368 PolarHBondContact O-ND1 3.05Å |
| 365 | T | 83.9 | Confident | 75.5 | Confident | 66 Ų | 66 | 115.9 Ų | 115.9 | 41% | 0.405 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -64.2 | -40.6 | 176.8 | 54.3 | 0 | 0 | 0 | 0 | 111.6 | Q361 A362 L367 H368 V369 | Q361-T365 WeakPolarHBondContact O-CG2 3.38Å; Q361-T365 PolarHBondContact O-N 3.13Å; Q361-T365 PolarHBondContact O-OG1 3.38Å; A362-T365 PolarHBondContact O-N 3.13Å; A362-T365 PolarHBondContact O-OG1 3.3Å; A362-T365 VanDerWaalsContact O-OG1 3.08Å; T365-L367 VanDerWaalsContact C-N 3.3Å; T365-L367 PolarHBondContact O-N 3.39Å; T365-H368 PolarHBondContact O-N 2.89Å; T365-V369 WeakPolarHBondContact O-CB 3.37Å; T365-V369 VanDerWaalsContact O-CG2 3.25Å; T365-V369 WeakPolarHBondContact O-CG2 3.46Å; T365-V369 PolarHBondContact O-N 2.87Å |
| 366 | H | 81.3 | Confident | 72.7 | Confident | 131 Ų | 131 | 115.1 Ų | 115.1 | 61% | 0.606 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -62 | -32.6 | 173.4 | -78.2 | -55.1 | 0 | 0 | 0 | 113.9 | A362 M363 M364 K370 | A362-H366 WeakPolarHBondContact O-CB 3.4Å; A362-H366 PolarHBondContact O-CD2 3.23Å; A362-H366 PolarHBondContact O-N 3.39Å; M363-H366 PolarHBondContact O-N 3.42Å; M364-H366 PolarHBondContact O-N 3.36Å; H366-K370 WeakPolarHBondContact O-CG 3.46Å; H366-K370 PolarHBondContact O-N 2.97Å |
| 367 | L | 81.6 | Confident | 70.1 | Confident | 121 Ų | 121 | 117.2 Ų | 117.2 | 63% | 0.634 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -70.9 | -48.3 | 173.5 | -76.1 | 164.6 | 0 | 0 | 0 | 111.8 | M363 M364 T365 V369 K370 S371 | M363-L367 WeakPolarHBondContact O-CG 3.47Å; M363-L367 PolarHBondContact O-N 3.33Å; M364-L367 PolarHBondContact O-N 3.41Å; T365-L367 VanDerWaalsContact C-N 3.3Å; T365-L367 PolarHBondContact O-N 3.39Å; L367-V369 PolarHBondContact O-N 3.22Å; L367-K370 PolarHBondContact O-N 3Å; L367-S371 PolarHBondContact O-N 3.45Å |
| 368 | H | 68.4 | Low | 67.3 | Low | 123 Ų | 123 | 119.1 Ų | 119.1 | 57% | 0.569 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -65.1 | -40.7 | -179.7 | -67.6 | 95.8 | 0 | 0 | 0 | 112.1 | M364 T365 K370 S371 T372 | M364-H368 PolarHBondContact O-N 3.35Å; M364-H368 PolarHBondContact O-ND1 3.05Å; T365-H368 PolarHBondContact O-N 2.89Å; H368-K370 VanDerWaalsContact C-N 3.25Å; H368-K370 PolarHBondContact O-N 3.23Å; H368-S371 WeakPolarHBondContact O-CB 3.39Å; H368-S371 PolarHBondContact O-N 3.02Å; H368-T372 PolarHBondContact O-N 2.72Å |
| 369 | V | 57.6 | Low | 64.3 | Low | 102 Ų | 102 | 120 Ų | 120 | 62% | 0.618 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -61.3 | -32.8 | 176.2 | 168.2 | 0 | 0 | 0 | 0 | 112 | T365 L367 S371 | T365-V369 WeakPolarHBondContact O-CB 3.37Å; T365-V369 VanDerWaalsContact O-CG2 3.25Å; T365-V369 WeakPolarHBondContact O-CG2 3.46Å; T365-V369 PolarHBondContact O-N 2.87Å; L367-V369 PolarHBondContact O-N 3.22Å; V369-S371 VanDerWaalsContact C-N 3.32Å |
| 370 | K | 52.6 | Low | 61.7 | Low | 184 Ų | 184 | 118.1 Ų | 118.1 | 80% | 0.8 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -75.9 | -14.5 | 174 | -77.6 | -177.6 | 174.1 | -176.4 | 0 | 114.4 | H366 L367 H368 | H366-K370 WeakPolarHBondContact O-CG 3.46Å; H366-K370 PolarHBondContact O-N 2.97Å; L367-K370 PolarHBondContact O-N 3Å; H368-K370 VanDerWaalsContact C-N 3.25Å; H368-K370 PolarHBondContact O-N 3.23Å |
| 371 | S | 49.6 | Very low | 58.7 | Low | 102 Ų | 102 | 119.7 Ų | 119.7 | 71% | 0.713 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -90.9 | -9.2 | 176.7 | -167.1 | 0 | 0 | 0 | 0 | 113.5 | L367 H368 V369 | L367-S371 PolarHBondContact O-N 3.45Å; H368-S371 WeakPolarHBondContact O-CB 3.39Å; H368-S371 PolarHBondContact O-N 3.02Å; V369-S371 VanDerWaalsContact C-N 3.32Å |
| 372 | T | 46.3 | Very low | 55.9 | Low | 99 Ų | 99 | 119.7 Ų | 119.7 | 61% | 0.607 | 66% | 0.664 | S | S | * | * | trans | -121 | 69.1 | 176.1 | 59.2 | 0 | 0 | 0 | 0 | 110.7 | H368 P374 | H368-T372 PolarHBondContact O-N 2.72Å; T372-P374 VanDerWaalsContact O-CD 3.25Å; T372-P374 WeakPolarHBondContact O-CD 3.08Å | ||
| 373 | E | 35.9 | Very low | 53 | Low | 168 Ų | 168 | 122.3 Ų | 122.3 | 79% | 0.785 | 68% | 0.679 | S | S | * | * | trans | -65.2 | 117.9 | 158.9 | -177.9 | -175.8 | 101.8 | 0 | 0 | 108.4 | K375 | E373-K375 PolarHBondContact O-N 3.14Š| ||
| 374 | P | 40.2 | Very low | 50.3 | Low | 113 Ų | 113 | 124.3 Ų | 124.3 | 73% | 0.734 | 69% | 0.692 | S | S | * | * | trans | -72.5 | 115.5 | 168.4 | -8.5 | 26.8 | 0 | 0 | 0 | 107.2 | T372 A376 | T372-P374 VanDerWaalsContact O-CD 3.25Å; T372-P374 WeakPolarHBondContact O-CD 3.08Å; P374-A376 PolarHBondContact O-N 3.07Å | ||
| 375 | K | 41.6 | Very low | 48 | Very low | 193 Ų | 193 | 125.7 Ų | 125.7 | 84% | 0.839 | 71% | 0.707 | S | S | * | * | trans | -68.4 | 73.4 | 174.8 | -173.7 | 175.2 | 175.9 | 172.9 | 0 | 110.8 | E373 | E373-K375 PolarHBondContact O-N 3.14Š| ||
| 376 | A | 38.3 | Very low | 46.2 | Very low | 84 Ų | 84 | 127.6 Ų | 127.6 | 69% | 0.694 | 72% | 0.718 | S | S | * | * | trans | -93.4 | 110.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | P374 L378 | P374-A376 PolarHBondContact O-N 3.07Å; A376-L378 PolarHBondContact O-N 2.77Å | ||
| 377 | T | 41.6 | Very low | 44.3 | Very low | 110 Ų | 110 | 129.1 Ų | 129.1 | 68% | 0.675 | 73% | 0.729 | S | S | * | * | trans | -57.9 | 114.6 | -174 | -54.5 | 0 | 0 | 0 | 0 | 113.2 | Q379 | T377-Q379 HydrophobicContact CG2-CG 3.51Š| ||
| 378 | L | 36.5 | Very low | 42.4 | Very low | 173 Ų | 173 | 132.9 Ų | 132.9 | 91% | 0.906 | 74% | 0.736 | S | S | * | * | trans | -106.9 | 110.3 | 153.3 | -67.2 | -179.3 | 0 | 0 | 0 | 108.2 | A376 | A376-L378 PolarHBondContact O-N 2.77Š| ||
| 379 | Q | 33.2 | Very low | 41.5 | Very low | 161 Ų | 161 | 132.5 Ų | 132.5 | 75% | 0.752 | 74% | 0.744 | S | S | * | * | trans | -80.7 | 150.4 | -178.3 | -75 | -135.9 | 65.2 | 0 | 0 | 112.3 | T377 V381 | T377-Q379 HydrophobicContact CG2-CG 3.51Å; Q379-V381 PolarHBondContact O-N 3.01Å; Q379-V381 VanDerWaalsContact O-N 3.13Å | ||
| 380 | P | 40.3 | Very low | 40.8 | Very low | 126 Ų | 126 | 133.7 Ų | 133.7 | 82% | 0.818 | 75% | 0.754 | S | S | * | * | trans | -76.9 | 96.5 | 173.5 | 32 | -33.5 | 0 | 0 | 0 | 110.8 | ||||
| 381 | V | 33.1 | Very low | 40.3 | Very low | 123 Ų | 123 | 129.5 Ų | 129.5 | 75% | 0.745 | 75% | 0.754 | S | S | * | * | trans | -91.8 | 106.9 | 164.7 | 52.8 | 0 | 0 | 0 | 0 | 109.8 | Q379 | Q379-V381 PolarHBondContact O-N 3.01Å; Q379-V381 VanDerWaalsContact O-N 3.13Å | ||
| 382 | S | 34.5 | Very low | 40.6 | Very low | 118 Ų | 118 | 130.6 Ų | 130.6 | 83% | 0.825 | 76% | 0.757 | S | S | * | * | trans | -79.7 | 116.8 | 168 | -178.9 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 383 | S | 32.9 | Very low | 41 | Very low | 96 Ų | 96 | 132 Ų | 132 | 67% | 0.671 | 77% | 0.768 | S | S | * | * | trans | -148.2 | 80.2 | 170.3 | 61.1 | 0 | 0 | 0 | 0 | 110.1 | P385 | S383-P385 VanDerWaalsContact O-CD 3.3Å; S383-P385 WeakPolarHBondContact O-CD 3.4Å | ||
| 384 | N | 36.7 | Very low | 41.2 | Very low | 137 Ų | 137 | 132.3 Ų | 132.3 | 73% | 0.733 | 77% | 0.769 | S | S | * | * | trans | -104.9 | 105.3 | 178.2 | -173.5 | 35.2 | 0 | 0 | 0 | 110.9 | ||||
| 385 | P | 42.7 | Very low | 41.3 | Very low | 110 Ų | 110 | 131.3 Ų | 131.3 | 71% | 0.714 | 76% | 0.764 | S | S | * | * | trans | -99.4 | 122.9 | 161.3 | 32.9 | -25.6 | 0 | 0 | 0 | 110.5 | S383 | S383-P385 VanDerWaalsContact O-CD 3.3Å; S383-P385 WeakPolarHBondContact O-CD 3.4Å | ||
| 386 | V | 45 | Very low | 41.2 | Very low | 106 Ų | 106 | 131 Ų | 131 | 64% | 0.642 | 76% | 0.763 | S | S | * | * | trans | -74.2 | 124.3 | -178.9 | 175.5 | 0 | 0 | 0 | 0 | 111.3 | Y388 | V386-Y388 HydrophobicContact CG1-CD2 4.24Å; V386-Y388 HydrophobicContact CG1-CE2 4.04Å | ||
| 387 | I | 41.4 | Very low | 41.4 | Very low | 163 Ų | 163 | 132.7 Ų | 132.7 | 84% | 0.836 | 77% | 0.769 | S | S | * | * | trans | -134.5 | 139 | 157.7 | -61.2 | -175.3 | 0 | 0 | 0 | 108.5 | ||||
| 388 | Y | 42.6 | Very low | 41.8 | Very low | 200 Ų | 200 | 134.6 Ų | 134.6 | 78% | 0.784 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -81 | 158.2 | -174.3 | -82.2 | -99.7 | 0 | 0 | 0 | 113.5 | V386 | V386-Y388 HydrophobicContact CG1-CD2 4.24Å; V386-Y388 HydrophobicContact CG1-CE2 4.04Å |
| 389 | P | 49.1 | Very low | 42.5 | Very low | 114 Ų | 114 | 135.7 Ų | 135.7 | 74% | 0.74 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -87.5 | 150 | -175.4 | 34.9 | -35.8 | 0 | 0 | 0 | 113.9 | ||
| 390 | P | 43.7 | Very low | 43 | Very low | 127 Ų | 127 | 134.4 Ų | 134.4 | 83% | 0.825 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -97.2 | 146.9 | 163.2 | 34.9 | -29.3 | 0 | 0 | 0 | 113.1 | ||
| 391 | A | 41.8 | Very low | 43.2 | Very low | 96 Ų | 96 | 134.8 Ų | 134.8 | 79% | 0.793 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -47.1 | 154.6 | -173.4 | 0 | 0 | 0 | 0 | 0 | 119 | ||
| 392 | T | 54.8 | Low | 43.7 | Very low | 125 Ų | 125 | 135.5 Ų | 135.5 | 77% | 0.767 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 132.8 | 160.2 | 48.1 | 0 | 0 | 0 | 0 | 112 | ||
| 393 | P | 54.9 | Low | 44.3 | Very low | 130 Ų | 130 | 136.5 Ų | 136.5 | 84% | 0.844 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -70.9 | 142.7 | 159.5 | 31.1 | -32.4 | 0 | 0 | 0 | 110 | ||
| 394 | H | 41.4 | Very low | 45 | Very low | 174 Ų | 174 | 139.1 Ų | 139.1 | 81% | 0.806 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -102.2 | 161.7 | -176.3 | -158 | -88.5 | 0 | 0 | 0 | 111 | ||
| 395 | S | 40.7 | Very low | 45.5 | Very low | 91 Ų | 91 | 139.2 Ų | 139.2 | 64% | 0.636 | 81% | 0.811 | S | S | * | * | trans | 73.3 | 150.1 | 177.8 | -50.8 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 396 | F | 41.1 | Very low | 45.7 | Very low | 186 Ų | 186 | 141.3 Ų | 141.3 | 82% | 0.816 | 82% | 0.818 | S | S | * | * | cis | -118 | 142 | 18.7 | -83.5 | -103.4 | 0 | 0 | 0 | 115.1 | L398 | F396-L398 HydrophobicContact CD1-CD1 4.3Å; F396-L398 HydrophobicContact CD1-CG 4.37Å | ||
| 397 | C | 41.8 | Very low | 45.8 | Very low | 121 Ų | 121 | 144 Ų | 144 | 82% | 0.818 | 83% | 0.832 | S | S | * | * | trans | -102.9 | 146.4 | 142.4 | -167.4 | 0 | 0 | 0 | 0 | 107 | ||||
| 398 | L | 50 | Low | 46.1 | Very low | 149 Ų | 149 | 142.4 Ų | 142.4 | 78% | 0.78 | 83% | 0.832 | S | S | * | * | trans | -130.9 | 147.2 | 170.5 | -96.6 | 155.9 | 0 | 0 | 0 | 108.1 | F396 | F396-L398 HydrophobicContact CD1-CD1 4.3Å; F396-L398 HydrophobicContact CD1-CG 4.37Å | ||
| 399 | S | 51.8 | Low | 46.5 | Very low | 196 Ų | 196 | 137.2 Ų | 137.2 | 100% | 1.371 | 84% | 0.836 | S | S | * | * | trans | -74.3 | 0 | -171.6 | -51 | 0 | 0 | 0 | 0 | 114.3 |
Retrieved 399 of 399 residues in 149.5 ms
(Link to these results)