| 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 | 45.4 | Very low | 49 | Very low | 240 Ų | 240 | 158.8 Ų | 158.8 | 100% | 1.182 | 91% | 0.907 | S | S | * | * | 0 | 115.7 | 0 | -62.4 | 163 | 75.9 | 0 | 0 | 108.5 | |||||
| 2 | K | 46.3 | Very low | 48.8 | Very low | 215 Ų | 215 | 165.8 Ų | 165.8 | 94% | 0.935 | 91% | 0.908 | S | S | * | * | trans | -158 | 100.7 | 174.4 | -90.7 | 148.4 | 169.3 | 179.2 | 0 | 106.6 | ||||
| 3 | S | 49.1 | Very low | 49.6 | Very low | 124 Ų | 124 | 168.4 Ų | 168.4 | 87% | 0.867 | 91% | 0.905 | S | S | * | * | trans | -89.9 | 129 | -178.1 | -49.3 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 4 | K | 49.7 | Very low | 49.6 | Very low | 217 Ų | 217 | 164.7 Ų | 164.7 | 94% | 0.943 | 89% | 0.894 | S | S | * | * | trans | -112.4 | 115.2 | 164.7 | -91 | -172.4 | 172.8 | 179 | 0 | 108.9 | ||||
| 5 | G | 54.9 | Low | 48.8 | Very low | 81 Ų | 81 | 170.9 Ų | 170.9 | 84% | 0.835 | 90% | 0.9 | S | S | * | * | P | Polyproline II helix | trans | -77 | 152.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||
| 6 | K | 49.4 | Very low | 48.9 | Very low | 213 Ų | 213 | 168.4 Ų | 168.4 | 93% | 0.926 | 89% | 0.894 | S | S | * | * | P | Polyproline II helix | trans | -82.9 | 160.1 | -175.6 | -70.1 | -161.6 | 174.2 | -177.9 | 0 | 113.5 | ||
| 7 | A | 48.1 | Very low | 48.7 | Very low | 104 Ų | 104 | 169 Ų | 169 | 86% | 0.86 | 89% | 0.89 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 152.2 | 178.3 | 0 | 0 | 0 | 0 | 0 | 115 | ||
| 8 | A | 50.6 | Low | 48.6 | Very low | 103 Ų | 103 | 166.2 Ų | 166.2 | 85% | 0.851 | 88% | 0.884 | S | S | * | * | trans | -132.6 | 133.8 | 160.7 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 9 | K | 50.7 | Low | 48.1 | Very low | 214 Ų | 214 | 165 Ų | 165 | 93% | 0.93 | 88% | 0.877 | S | S | * | * | P | Polyproline II helix | trans | -86.3 | 131.9 | -179.4 | -68.1 | 152 | 172.9 | 175.6 | 0 | 108.9 | ||
| 10 | S | 46.3 | Very low | 48.2 | Very low | 124 Ų | 124 | 162.3 Ų | 162.3 | 87% | 0.867 | 87% | 0.869 | S | S | * | * | P | Polyproline II helix | trans | -97.3 | 126 | 173.5 | 68.4 | 0 | 0 | 0 | 0 | 111.9 | ||
| 11 | S | 48.8 | Very low | 48.1 | Very low | 112 Ų | 112 | 162.4 Ų | 162.4 | 78% | 0.783 | 87% | 0.865 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 146 | -178.9 | -165.1 | 0 | 0 | 0 | 0 | 114.4 | ||
| 12 | R | 46.7 | Very low | 48.3 | Very low | 242 Ų | 242 | 156.9 Ų | 156.9 | 91% | 0.913 | 85% | 0.847 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 133.4 | 169 | -71.2 | -179.8 | 172.6 | -136.6 | -0.8 | 109.3 | ||
| 13 | K | 58.5 | Low | 48.1 | Very low | 200 Ų | 200 | 154.5 Ų | 154.5 | 87% | 0.87 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -90.1 | 134.7 | 170.3 | -68.6 | -175.6 | 176.5 | -175.2 | 0 | 110 | ||
| 14 | P | 50.6 | Low | 47.7 | Very low | 117 Ų | 117 | 155.7 Ų | 155.7 | 76% | 0.76 | 84% | 0.841 | S | S | * | * | P | Polyproline II helix | trans | -79.7 | 152.4 | 177.5 | 30.8 | -32.4 | 0 | 0 | 0 | 112.4 | ||
| 15 | W | 37 | Very low | 47.1 | Very low | 258 Ų | 258 | 150.2 Ų | 150.2 | 98% | 0.977 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 133.8 | 178.1 | -72 | 80.7 | 0 | 0 | 0 | 111.2 | ||
| 16 | T | 50.4 | Low | 46.3 | Very low | 130 Ų | 130 | 153.5 Ų | 153.5 | 80% | 0.798 | 83% | 0.829 | S | S | * | * | trans | -105 | 121.4 | 169.6 | -54.2 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 17 | E | 46 | Very low | 45.7 | Very low | 179 Ų | 179 | 148.5 Ų | 148.5 | 84% | 0.836 | 82% | 0.816 | S | S | * | * | trans | -91 | 143.3 | 170.6 | -170.5 | 172.4 | -138.9 | 0 | 0 | 109.3 | ||||
| 18 | P | 45.8 | Very low | 45.3 | Very low | 119 Ų | 119 | 148.8 Ų | 148.8 | 77% | 0.773 | 81% | 0.812 | S | S | * | * | trans | -139.8 | 132.8 | 141.9 | 33 | -16.5 | 0 | 0 | 0 | 113.9 | ||||
| 19 | D | 39.9 | Very low | 45.2 | Very low | 143 Ų | 143 | 152.7 Ų | 152.7 | 77% | 0.765 | 81% | 0.812 | S | S | * | * | trans | -83.5 | 171 | 155.1 | -162 | 30.3 | 0 | 0 | 0 | 108.8 | ||||
| 20 | P | 50.4 | Low | 45.1 | Very low | 110 Ų | 110 | 148.5 Ų | 148.5 | 71% | 0.714 | 81% | 0.807 | S | S | * | * | cis | -130.6 | 178.4 | -4.6 | 33 | -10.1 | 0 | 0 | 0 | 116.1 | ||||
| 21 | E | 45.4 | Very low | 44.4 | Very low | 166 Ų | 166 | 145.7 Ų | 145.7 | 78% | 0.776 | 80% | 0.798 | S | S | * | * | trans | -58.9 | 166.7 | 178.5 | -54.5 | -165.4 | 143.4 | 0 | 0 | 116.1 | ||||
| 22 | P | 49.3 | Very low | 44 | Very low | 123 Ų | 123 | 146.3 Ų | 146.3 | 80% | 0.799 | 80% | 0.802 | S | S | * | * | -147.5 | 142.7 | 95.9 | 35.6 | -17.4 | 0 | 0 | 0 | 117.5 | |||||
| 23 | E | 43.3 | Very low | 43.8 | Very low | 165 Ų | 165 | 140.1 Ų | 140.1 | 77% | 0.771 | 80% | 0.796 | S | S | * | * | trans | 14.7 | 125.8 | 143.8 | -63.3 | -101.9 | 140.3 | 0 | 0 | 120.6 | ||||
| 24 | T | 39.8 | Very low | 43.4 | Very low | 150 Ų | 150 | 139.8 Ų | 139.8 | 92% | 0.92 | 80% | 0.797 | S | S | * | * | trans | -147.4 | 140.1 | 132.7 | 47 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 25 | S | 37.6 | Very low | 43 | Very low | 101 Ų | 101 | 142.9 Ų | 142.9 | 71% | 0.706 | 80% | 0.802 | S | S | * | * | trans | -82.3 | 160.7 | -169.7 | 52.7 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 26 | D | 37.3 | Very low | 43.3 | Very low | 151 Ų | 151 | 138.9 Ų | 138.9 | 81% | 0.807 | 79% | 0.794 | S | S | * | * | trans | 71.7 | 133.7 | 155.5 | -116.1 | -26.1 | 0 | 0 | 0 | 114.4 | ||||
| 27 | T | 36.9 | Very low | 42.8 | Very low | 108 Ų | 108 | 136.8 Ų | 136.8 | 66% | 0.663 | 80% | 0.799 | S | S | * | * | cis | -166.9 | 152.7 | 42.1 | 70.4 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 28 | S | 40.5 | Very low | 42.8 | Very low | 109 Ų | 109 | 133.4 Ų | 133.4 | 76% | 0.762 | 80% | 0.795 | S | S | * | * | trans | 71.1 | 105.2 | 143.6 | -53.1 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 29 | E | 47.4 | Very low | 42.9 | Very low | 186 Ų | 186 | 136.8 Ų | 136.8 | 87% | 0.869 | 80% | 0.8 | S | S | * | * | trans | -49.9 | 142.8 | 143.5 | -70.2 | -107.9 | 132.3 | 0 | 0 | 110.7 | ||||
| 30 | P | 49.1 | Very low | 42.9 | Very low | 125 Ų | 125 | 134.3 Ų | 134.3 | 81% | 0.812 | 80% | 0.8 | S | S | * | * | -149.9 | 160.7 | 97.4 | 37.1 | -20 | 0 | 0 | 0 | 115.1 | |||||
| 31 | G | 32.2 | Very low | 42.4 | Very low | 66 Ų | 66 | 133.4 Ų | 133.4 | 68% | 0.68 | 80% | 0.796 | S | S | * | * | trans | 111.4 | 96 | 131.8 | 0 | 0 | 0 | 0 | 0 | 116.6 | S33 | G31-S33 PolarHBondContact O-N 3.01Š| ||
| 32 | S | 40.1 | Very low | 42.1 | Very low | 125 Ų | 125 | 131.9 Ų | 131.9 | 87% | 0.874 | 80% | 0.797 | S | S | * | * | trans | -40.7 | 128.1 | 153.8 | -165.4 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 33 | S | 41.7 | Very low | 41.7 | Very low | 112 Ų | 112 | 133.9 Ų | 133.9 | 78% | 0.783 | 80% | 0.796 | S | S | * | * | trans | -154 | 116 | 157.2 | -168.5 | 0 | 0 | 0 | 0 | 109.4 | G31 Q35 | G31-S33 PolarHBondContact O-N 3.01Å; S33-Q35 PolarHBondContact O-N 3.24Å | ||
| 34 | E | 50.7 | Low | 41.8 | Very low | 192 Ų | 192 | 133.7 Ų | 133.7 | 90% | 0.897 | 80% | 0.799 | S | S | * | * | trans | -64 | 120.5 | 173.4 | -58.9 | 174.5 | 118.8 | 0 | 0 | 108.8 | ||||
| 35 | Q | 41.7 | Very low | 42 | Very low | 182 Ų | 182 | 130.3 Ų | 130.3 | 85% | 0.85 | 79% | 0.793 | S | S | * | * | trans | -127.2 | 114.7 | 172.7 | -168.5 | 160 | 38.9 | 0 | 0 | 111 | S33 | S33-Q35 PolarHBondContact O-N 3.24Š| ||
| 36 | E | 44.8 | Very low | 41.9 | Very low | 174 Ų | 174 | 127.9 Ų | 127.9 | 81% | 0.813 | 78% | 0.784 | S | S | * | * | trans | -13.2 | 119.9 | 168.3 | -78.7 | 176.3 | 119.6 | 0 | 0 | 116.3 | S38 | E36-S38 VanDerWaalsContact C-N 3.34Å; E36-S38 PolarHBondContact O-N 3.18Å | ||
| 37 | G | 38.1 | Very low | 42.3 | Very low | 87 Ų | 87 | 126.1 Ų | 126.1 | 90% | 0.897 | 78% | 0.784 | S | S | * | * | trans | -61.1 | 91.9 | 166.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | E39 | G37-E39 PolarHBondContact O-N 3.27Š| ||
| 38 | S | 47.6 | Very low | 42.5 | Very low | 108 Ų | 108 | 133 Ų | 133 | 76% | 0.755 | 80% | 0.798 | S | S | * | * | trans | -70.6 | 119.3 | 166.6 | -68.1 | 0 | 0 | 0 | 0 | 109.8 | E36 A40 | E36-S38 VanDerWaalsContact C-N 3.34Å; E36-S38 PolarHBondContact O-N 3.18Å; S38-A40 VanDerWaalsContact C-N 3.32Å; S38-A40 PolarHBondContact O-N 3.38Å | ||
| 39 | E | 47 | Very low | 42.9 | Very low | 189 Ų | 189 | 139.2 Ų | 139.2 | 88% | 0.883 | 80% | 0.804 | S | S | * | * | trans | -59.9 | 79.5 | 174.1 | 48.2 | -173 | 123.5 | 0 | 0 | 112.7 | G37 S41 | G37-E39 PolarHBondContact O-N 3.27Å; E39-S41 PolarHBondContact O-N 3.37Å; E39-S41 VanDerWaalsContact O-N 3.09Å | ||
| 40 | A | 39.2 | Very low | 42.4 | Very low | 92 Ų | 92 | 133.5 Ų | 133.5 | 76% | 0.76 | 80% | 0.795 | S | S | * | * | trans | -77.1 | 97.3 | 171 | 0 | 0 | 0 | 0 | 0 | 110.3 | S38 V42 | S38-A40 VanDerWaalsContact C-N 3.32Å; S38-A40 PolarHBondContact O-N 3.38Å; A40-V42 PolarHBondContact O-N 2.98Å; A40-V42 VanDerWaalsContact O-N 3.09Å | ||
| 41 | S | 40.6 | Very low | 41.9 | Very low | 91 Ų | 91 | 133.7 Ų | 133.7 | 64% | 0.636 | 79% | 0.794 | S | S | * | * | trans | -50.5 | 109 | 166.9 | -73.8 | 0 | 0 | 0 | 0 | 111.6 | E39 H43 | E39-S41 PolarHBondContact O-N 3.37Å; E39-S41 VanDerWaalsContact O-N 3.09Å; S41-H43 WeakPolarHBondContact CB-CE1 3.5Å; S41-H43 PolarHBondContact O-CE1 2.96Å; S41-H43 PolarHBondContact O-N 3.01Å; S41-H43 PolarHBondContact O-ND1 3.28Å | ||
| 42 | V | 40.2 | Very low | 42.3 | Very low | 133 Ų | 133 | 139 Ų | 139 | 81% | 0.806 | 81% | 0.806 | S | S | * | * | trans | -70.1 | 98.6 | 167.1 | -96.8 | 0 | 0 | 0 | 0 | 109.5 | A40 I44 | A40-V42 PolarHBondContact O-N 2.98Å; A40-V42 VanDerWaalsContact O-N 3.09Å; V42-I44 PolarHBondContact O-N 3.21Å | ||
| 43 | H | 40.4 | Very low | 42.3 | Very low | 166 Ų | 166 | 144.9 Ų | 144.9 | 77% | 0.769 | 81% | 0.809 | S | S | * | * | trans | -74 | 89.1 | 171.9 | -57.4 | -0.2 | 0 | 0 | 0 | 108.7 | S41 G45 | S41-H43 WeakPolarHBondContact CB-CE1 3.5Å; S41-H43 PolarHBondContact O-CE1 2.96Å; S41-H43 PolarHBondContact O-N 3.01Å; S41-H43 PolarHBondContact O-ND1 3.28Å; H43-G45 PolarHBondContact O-N 2.68Å | ||
| 44 | I | 45.2 | Very low | 41.9 | Very low | 161 Ų | 161 | 143.7 Ų | 143.7 | 83% | 0.826 | 82% | 0.815 | S | S | * | * | trans | -73.1 | 99.2 | 169.4 | -61.1 | -172.4 | 0 | 0 | 0 | 107.8 | V42 G46 | V42-I44 PolarHBondContact O-N 3.21Å; I44-G46 PolarHBondContact O-N 3.44Å; I44-G46 VanDerWaalsContact O-N 3.16Å | ||
| 45 | G | 43.9 | Very low | 41.1 | Very low | 78 Ų | 78 | 138.2 Ų | 138.2 | 80% | 0.804 | 81% | 0.81 | S | S | * | * | trans | -63.7 | 107.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | H43 | H43-G45 PolarHBondContact O-N 2.68Š| ||
| 46 | G | 36 | Very low | 40.8 | Very low | 51 Ų | 51 | 137.3 Ų | 137.3 | 53% | 0.526 | 81% | 0.811 | S | S | . | * | trans | -120.4 | 101.8 | 169 | 0 | 0 | 0 | 0 | 0 | 110 | I44 W48 | I44-G46 PolarHBondContact O-N 3.44Å; I44-G46 VanDerWaalsContact O-N 3.16Å; G46-W48 VanDerWaalsContact O-CD1 3.28Å; G46-W48 PolarHBondContact O-N 2.89Å | ||
| 47 | S | 44.2 | Very low | 40.5 | Very low | 113 Ų | 113 | 140.6 Ų | 140.6 | 79% | 0.79 | 82% | 0.815 | S | S | * | * | trans | -67.2 | 93.9 | 174.9 | 167.4 | 0 | 0 | 0 | 0 | 111.1 | R49 | S47-R49 PolarHBondContact O-N 3.36Š| ||
| 48 | W | 41.5 | Very low | 40.4 | Very low | 252 Ų | 252 | 145.2 Ų | 145.2 | 96% | 0.955 | 81% | 0.814 | S | S | * | * | trans | -91.6 | 76 | 165.8 | -61.6 | 92.7 | 0 | 0 | 0 | 109.7 | G46 | G46-W48 VanDerWaalsContact O-CD1 3.28Å; G46-W48 PolarHBondContact O-N 2.89Å | ||
| 49 | R | 49.9 | Very low | 40.2 | Very low | 240 Ų | 240 | 148.9 Ų | 148.9 | 91% | 0.906 | 82% | 0.819 | S | S | * | * | trans | -100.5 | 112.9 | 159.9 | -90.3 | -165.3 | -169.8 | -85.9 | 1.6 | 108.6 | S47 | S47-R49 PolarHBondContact O-N 3.36Š| ||
| 50 | G | 35.6 | Very low | 39.8 | Very low | 66 Ų | 66 | 143.5 Ų | 143.5 | 68% | 0.68 | 81% | 0.814 | S | S | * | * | trans | 179.2 | 75.3 | 175 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 51 | V | 39.5 | Very low | 40.1 | Very low | 130 Ų | 130 | 151.2 Ų | 151.2 | 79% | 0.788 | 82% | 0.824 | S | S | * | * | 66 | 96.4 | 109.3 | -178.4 | 0 | 0 | 0 | 0 | 113 | |||||
| 52 | L | 40.3 | Very low | 40 | Very low | 178 Ų | 178 | 150.3 Ų | 150.3 | 93% | 0.932 | 83% | 0.829 | S | S | * | * | trans | -136.5 | 113.9 | 134.9 | -75.1 | -179.2 | 0 | 0 | 0 | 108.6 | ||||
| 53 | R | 40.5 | Very low | 40.3 | Very low | 248 Ų | 248 | 148.3 Ų | 148.3 | 94% | 0.936 | 84% | 0.835 | S | S | * | * | trans | -62.9 | 147.9 | 161.8 | -97.9 | 172.6 | 175.3 | -108.4 | 1 | 109.3 | ||||
| 54 | G | 32.2 | Very low | 40.2 | Very low | 87 Ų | 87 | 143.9 Ų | 143.9 | 90% | 0.897 | 84% | 0.835 | S | S | * | * | trans | 132.3 | 106.6 | 152.8 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 55 | G | 33.8 | Very low | 40.1 | Very low | 77 Ų | 77 | 140 Ų | 140 | 79% | 0.794 | 83% | 0.834 | S | S | * | * | trans | 162.4 | 82.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 56 | D | 36 | Very low | 40.5 | Very low | 163 Ų | 163 | 140 Ų | 140 | 87% | 0.872 | 83% | 0.826 | S | S | * | * | trans | -34.6 | 129.5 | 172.4 | -96.9 | -99.8 | 0 | 0 | 0 | 114.5 | E58 | D56-E58 PolarHBondContact O-N 3.03Š| ||
| 57 | R | 38.7 | Very low | 41.6 | Very low | 242 Ų | 242 | 143.9 Ų | 143.9 | 91% | 0.913 | 84% | 0.84 | S | S | * | * | trans | -94.5 | 80.5 | 174.6 | -166.3 | 176.4 | -176.9 | 134.4 | -1.9 | 108.2 | ||||
| 58 | E | 37.3 | Very low | 42.4 | Very low | 184 Ų | 184 | 146.5 Ų | 146.5 | 86% | 0.86 | 84% | 0.84 | S | S | * | * | trans | -80.1 | 126.3 | 170.3 | -158.2 | 176.6 | 148.8 | 0 | 0 | 110.1 | D56 G60 | D56-E58 PolarHBondContact O-N 3.03Å; E58-G60 PolarHBondContact O-N 2.73Å; E58-G60 VanDerWaalsContact O-N 3.13Å | ||
| 59 | Q | 43.3 | Very low | 43.3 | Very low | 185 Ų | 185 | 139.3 Ų | 139.3 | 86% | 0.864 | 82% | 0.82 | S | S | * | * | trans | -75.2 | 93.7 | -179.6 | -80.5 | 161.5 | 43.4 | 0 | 0 | 110.4 | R61 | Q59-R61 PolarHBondContact O-N 3.37Š| ||
| 60 | G | 37.4 | Very low | 43.8 | Very low | 76 Ų | 76 | 132.2 Ų | 132.2 | 78% | 0.784 | 81% | 0.805 | S | S | * | * | trans | -85.3 | 96.6 | 162.8 | 0 | 0 | 0 | 0 | 0 | 111 | E58 G62 | E58-G60 PolarHBondContact O-N 2.73Å; E58-G60 VanDerWaalsContact O-N 3.13Å; G60-G62 PolarHBondContact O-N 3Å | ||
| 61 | R | 46.6 | Very low | 45 | Very low | 254 Ų | 254 | 134.9 Ų | 134.9 | 96% | 0.958 | 80% | 0.799 | S | S | * | * | trans | -67.5 | 111.7 | 158 | -78.3 | -177 | 171.2 | -136.8 | 0.4 | 107.8 | Q59 | Q59-R61 PolarHBondContact O-N 3.37Š| ||
| 62 | G | 38 | Very low | 46 | Very low | 73 Ų | 73 | 139 Ų | 139 | 75% | 0.753 | 80% | 0.801 | S | S | * | * | trans | -156.9 | 102.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 110.2 | G60 | G60-G62 PolarHBondContact O-N 3Š| ||
| 63 | G | 47.2 | Very low | 46.9 | Very low | 91 Ų | 91 | 140.6 Ų | 140.6 | 94% | 0.938 | 79% | 0.794 | S | S | * | * | trans | -66.9 | 144.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 64 | G | 38.3 | Very low | 47.8 | Very low | 73 Ų | 73 | 134.5 Ų | 134.5 | 75% | 0.753 | 78% | 0.776 | S | S | * | * | trans | -180 | 105.6 | 171.6 | 0 | 0 | 0 | 0 | 0 | 109.1 | A66 | G64-A66 PolarHBondContact O-N 2.94Š| ||
| 65 | G | 42.3 | Very low | 49.2 | Very low | 78 Ų | 78 | 140.4 Ų | 140.4 | 80% | 0.804 | 77% | 0.771 | S | S | * | * | trans | -53.2 | 122.7 | -175 | 0 | 0 | 0 | 0 | 0 | 112.5 | T67 | G65-T67 VanDerWaalsContact C-N 3.34Å; G65-T67 PolarHBondContact O-N 3.24Å | ||
| 66 | A | 52.3 | Low | 50.7 | Low | 79 Ų | 79 | 140 Ų | 140 | 65% | 0.653 | 76% | 0.756 | S | S | * | * | trans | -70 | 92.1 | 169.4 | 0 | 0 | 0 | 0 | 0 | 108.9 | G64 H68 | G64-A66 PolarHBondContact O-N 2.94Å; A66-H68 PolarHBondContact O-N 3.39Å; A66-H68 PolarHBondContact O-ND1 2.88Å | ||
| 67 | T | 59.8 | Low | 52.1 | Low | 132 Ų | 132 | 137.1 Ų | 137.1 | 81% | 0.81 | 74% | 0.737 | S | S | * | * | trans | -58.1 | 106.6 | 158 | 49.9 | 0 | 0 | 0 | 0 | 106.7 | G65 N69 | G65-T67 VanDerWaalsContact C-N 3.34Å; G65-T67 PolarHBondContact O-N 3.24Å; T67-N69 VanDerWaalsContact C-N 3.28Å; T67-N69 PolarHBondContact O-N 2.81Å | ||
| 68 | H | 58.9 | Low | 53.8 | Low | 169 Ų | 169 | 130.3 Ų | 130.3 | 78% | 0.782 | 72% | 0.719 | S | S | * | * | trans | -68.3 | 89.8 | 179 | -79.8 | 53.2 | 0 | 0 | 0 | 108 | A66 P70 | A66-H68 PolarHBondContact O-N 3.39Å; A66-H68 PolarHBondContact O-ND1 2.88Å; H68-P70 WeakPolarHBondContact O-CD 3.36Å | ||
| 69 | N | 61.2 | Low | 56 | Low | 101 Ų | 101 | 124.2 Ų | 124.2 | 54% | 0.54 | 70% | 0.697 | S | S | . | * | trans | -84.1 | 103.6 | 172.9 | -166.3 | 7.4 | 0 | 0 | 0 | 108.9 | T67 H71 R72 | T67-N69 VanDerWaalsContact C-N 3.28Å; T67-N69 PolarHBondContact O-N 2.81Å; N69-H71 PolarHBondContact O-N 3.25Å; N69-H71 VanDerWaalsContact O-N 3.12Å; N69-H71 PolarHBondContact OD1-CD2 3.02Å; N69-R72 PolarHBondContact O-N 2.95Å | ||
| 70 | P | 61.5 | Low | 58 | Low | 90 Ų | 90 | 118.8 Ų | 118.8 | 58% | 0.584 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -62.4 | -22.3 | -174.8 | 26.1 | -34.9 | 0 | 0 | 0 | 112.9 | H68 R72 R73 Q74 | H68-P70 WeakPolarHBondContact O-CD 3.36Å; P70-R72 VanDerWaalsContact C-N 3.3Å; P70-R72 PolarHBondContact O-N 3.37Å; P70-R73 PolarHBondContact O-N 3.16Å; P70-Q74 PolarHBondContact O-N 3.41Å |
| 71 | H | 60.5 | Low | 60.5 | Low | 123 Ų | 123 | 121.4 Ų | 121.4 | 57% | 0.569 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -63.7 | -28.2 | -179.3 | -70.5 | -61.7 | 0 | 0 | 0 | 114.5 | N69 R75 | N69-H71 PolarHBondContact O-N 3.25Å; N69-H71 VanDerWaalsContact O-N 3.12Å; N69-H71 PolarHBondContact OD1-CD2 3.02Å; H71-R75 PolarHBondContact O-N 2.85Å |
| 72 | R | 60.1 | Low | 62.6 | Low | 216 Ų | 216 | 114.1 Ų | 114.1 | 82% | 0.815 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -74.3 | -30.1 | -179.2 | -157.3 | 175.7 | -174.2 | -124.9 | 2.2 | 112.5 | N69 P70 | N69-R72 PolarHBondContact O-N 2.95Å; P70-R72 VanDerWaalsContact C-N 3.3Å; P70-R72 PolarHBondContact O-N 3.37Å |
| 73 | R | 59 | Low | 65.3 | Low | 211 Ų | 211 | 118.3 Ų | 118.3 | 80% | 0.796 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -74.3 | -37.6 | 175.2 | -76.4 | -177.2 | 153.8 | -169.4 | -5.8 | 112 | P70 S76 H77 | P70-R73 PolarHBondContact O-N 3.16Å; R73-S76 PolarHBondContact O-N 3.06Å; R73-H77 PolarHBondContact O-N 2.67Å; R73-H77 VanDerWaalsContact O-N 3.12Å |
| 74 | Q | 59.7 | Low | 67.5 | Low | 120 Ų | 120 | 117 Ų | 117 | 56% | 0.561 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -66.9 | -40.3 | 179.7 | -155.5 | 176.6 | -0.1 | 0 | 0 | 112.3 | P70 S76 H77 N78 | P70-Q74 PolarHBondContact O-N 3.41Å; Q74-S76 PolarHBondContact O-N 3.03Å; Q74-H77 PolarHBondContact O-N 3.48Å; Q74-N78 PolarHBondContact O-N 2.96Å; Q74-N78 VanDerWaalsContact O-N 3.1Å; Q74-N78 PolarHBondContact O-OD1 3.4Å |
| 75 | R | 61.1 | Low | 70.2 | Confident | 211 Ų | 211 | 117 Ų | 117 | 80% | 0.796 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -61.2 | -40.1 | 173 | -104.5 | -179.2 | 161.4 | -163.8 | -4.8 | 113.4 | H71 N78 S79 | H71-R75 PolarHBondContact O-N 2.85Å; R75-N78 PolarHBondContact O-N 3.34Å; R75-S79 PolarHBondContact O-N 3.46Å |
| 76 | S | 65.6 | Low | 72.8 | Confident | 68 Ų | 68 | 120.4 Ų | 120.4 | 48% | 0.476 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -66.2 | -40.3 | 177.4 | -178.2 | 0 | 0 | 0 | 0 | 112.1 | R73 Q74 S79 N80 | R73-S76 PolarHBondContact O-N 3.06Å; Q74-S76 PolarHBondContact O-N 3.03Å; S76-S79 PolarHBondContact O-N 3.16Å; S76-N80 VanDerWaalsContact O-CG 3.31Å; S76-N80 PolarHBondContact O-N 3.34Å |
| 77 | H | 66.1 | Low | 74.9 | Confident | 103 Ų | 103 | 124.1 Ų | 124.1 | 48% | 0.477 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -66 | -38.2 | 176.3 | -171.9 | -98.6 | 0 | 0 | 0 | 112.6 | R73 Q74 N80 K81 | R73-H77 PolarHBondContact O-N 2.67Å; R73-H77 VanDerWaalsContact O-N 3.12Å; Q74-H77 PolarHBondContact O-N 3.48Å; H77-N80 PolarHBondContact O-N 2.79Å; H77-K81 PolarHBondContact O-N 3.35Å |
| 78 | N | 74.7 | Confident | 76.7 | Confident | 99 Ų | 99 | 122.5 Ų | 122.5 | 53% | 0.529 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -65.6 | -40.5 | 173.7 | -75.5 | 19.5 | 0 | 0 | 0 | 112.1 | Q74 R75 N80 K81 E82 | Q74-N78 PolarHBondContact O-N 2.96Å; Q74-N78 VanDerWaalsContact O-N 3.1Å; Q74-N78 PolarHBondContact O-OD1 3.4Å; R75-N78 PolarHBondContact O-N 3.34Å; N78-N80 VanDerWaalsContact C-N 3.31Å; N78-N80 PolarHBondContact O-N 3.44Å; N78-K81 PolarHBondContact O-N 2.98Å; N78-E82 PolarHBondContact O-N 3.33Å |
| 79 | S | 81.6 | Confident | 78.6 | Confident | 57 Ų | 57 | 119.5 Ų | 119.5 | 40% | 0.399 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -63.3 | -35.8 | 173.7 | -179.6 | 0 | 0 | 0 | 0 | 112.7 | R75 S76 E82 R83 | R75-S79 PolarHBondContact O-N 3.46Å; S76-S79 PolarHBondContact O-N 3.16Å; S79-E82 PolarHBondContact O-N 3.15Å; S79-R83 WeakPolarHBondContact O-CB 3.28Å; S79-R83 WeakPolarHBondContact O-CG 3.21Å; S79-R83 PolarHBondContact O-N 3.35Å |
| 80 | N | 87.1 | Confident | 80.3 | Confident | 71 Ų | 71 | 117.5 Ų | 117.5 | 38% | 0.38 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -68.5 | -40.9 | 175.9 | -71.8 | -12 | 0 | 0 | 0 | 112.3 | S76 H77 N78 R83 N84 | S76-N80 VanDerWaalsContact O-CG 3.31Å; S76-N80 PolarHBondContact O-N 3.34Å; H77-N80 PolarHBondContact O-N 2.79Å; N78-N80 VanDerWaalsContact C-N 3.31Å; N78-N80 PolarHBondContact O-N 3.44Å; N80-R83 PolarHBondContact O-N 2.8Å; N80-R83 PolarHBondContact OD1-NH2 3.46Å; N80-N84 WeakPolarHBondContact O-CB 3.39Å; N80-N84 PolarHBondContact O-N 2.92Å |
| 81 | K | 89.5 | Confident | 82.1 | Confident | 131 Ų | 131 | 117.3 Ų | 117.3 | 57% | 0.57 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -61.2 | -46.7 | 172.9 | -87.3 | 176.9 | 170.6 | -179 | 0 | 111.2 | H77 N78 R83 N84 V85 | H77-K81 PolarHBondContact O-N 3.35Å; N78-K81 PolarHBondContact O-N 2.98Å; K81-R83 PolarHBondContact O-N 3.34Å; K81-N84 WeakPolarHBondContact O-CB 3.47Å; K81-N84 PolarHBondContact O-N 3.47Å; K81-N84 VanDerWaalsContact O-N 3.11Å; K81-V85 WeakPolarHBondContact O-CG2 3.45Å; K81-V85 PolarHBondContact O-N 2.9Å |
| 82 | E | 91.1 | Very high | 83.9 | Confident | 101 Ų | 101 | 115.8 Ų | 115.8 | 47% | 0.472 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -62.7 | -42.4 | 178.2 | -166.9 | -176.5 | 169.5 | 0 | 0 | 112.2 | N78 S79 N84 V85 R86 | N78-E82 PolarHBondContact O-N 3.33Å; S79-E82 PolarHBondContact O-N 3.15Å; E82-N84 VanDerWaalsContact C-N 3.3Å; E82-N84 PolarHBondContact O-N 3.32Å; E82-V85 PolarHBondContact O-N 2.82Å; E82-R86 WeakPolarHBondContact O-CG 3.36Å; E82-R86 PolarHBondContact O-N 3.2Å; E82-R86 IonicContact OE1-CZ 3.5Å; E82-R86 IonicContact OE1-NE 3.58Å; E82-R86 IonicContact OE1-NH2 2.7Å; E82-R86 PolarHBondContact OE1-NH2 3.06Å |
| 83 | R | 93 | Very high | 85.7 | Confident | 160 Ų | 160 | 112.8 Ų | 112.8 | 60% | 0.604 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -60.4 | -39.5 | 172 | -80.7 | -166.1 | -64.5 | 175 | -1 | 112.4 | S79 N80 K81 R87 | S79-R83 WeakPolarHBondContact O-CB 3.28Å; S79-R83 WeakPolarHBondContact O-CG 3.21Å; S79-R83 PolarHBondContact O-N 3.35Å; N80-R83 PolarHBondContact O-N 2.8Å; N80-R83 PolarHBondContact OD1-NH2 3.46Å; K81-R83 PolarHBondContact O-N 3.34Å; R83-R87 WeakPolarHBondContact O-CB 3.48Å; R83-R87 PolarHBondContact O-N 3.47Å |
| 84 | N | 94.4 | Very high | 87.6 | Confident | 64 Ų | 64 | 106.8 Ų | 106.8 | 34% | 0.342 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -66.1 | -42.5 | 177.8 | -166.5 | 44.8 | 0 | 0 | 0 | 111.4 | N80 K81 E82 R87 L88 | N80-N84 WeakPolarHBondContact O-CB 3.39Å; N80-N84 PolarHBondContact O-N 2.92Å; K81-N84 WeakPolarHBondContact O-CB 3.47Å; K81-N84 PolarHBondContact O-N 3.47Å; K81-N84 VanDerWaalsContact O-N 3.11Å; E82-N84 VanDerWaalsContact C-N 3.3Å; E82-N84 PolarHBondContact O-N 3.32Å; N84-R87 WeakPolarHBondContact O-CB 3.48Å; N84-R87 PolarHBondContact O-N 2.94Å; N84-R87 PolarHBondContact OD1-NH2 3.41Å; N84-L88 WeakPolarHBondContact O-CG 3.49Å; N84-L88 PolarHBondContact O-N 3.41Å |
| 85 | V | 95.2 | Very high | 89.4 | Confident | 72 Ų | 72 | 108.7 Ų | 108.7 | 44% | 0.436 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -59.1 | -50.6 | 175.1 | 172.6 | 0 | 0 | 0 | 0 | 110.7 | K81 E82 R87 L88 E89 | K81-V85 WeakPolarHBondContact O-CG2 3.45Å; K81-V85 PolarHBondContact O-N 2.9Å; E82-V85 PolarHBondContact O-N 2.82Å; V85-R87 PolarHBondContact O-N 3.36Å; V85-L88 WeakPolarHBondContact O-CB 3.22Å; V85-L88 PolarHBondContact O-N 3.36Å; V85-E89 HydrophobicContact CG1-CG 4.35Å; V85-E89 WeakPolarHBondContact CG1-OE1 3.11Å; V85-E89 WeakPolarHBondContact O-CG 3.46Å; V85-E89 PolarHBondContact O-N 3.23Å |
| 86 | R | 96.1 | Very high | 91.2 | Very high | 151 Ų | 151 | 103.2 Ų | 103.2 | 57% | 0.57 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -57.8 | -37.6 | 177 | -68.4 | 178 | -172.1 | -163.3 | 2.7 | 112.8 | E82 S90 | E82-R86 WeakPolarHBondContact O-CG 3.36Å; E82-R86 PolarHBondContact O-N 3.2Å; E82-R86 IonicContact OE1-CZ 3.5Å; E82-R86 IonicContact OE1-NE 3.58Å; E82-R86 IonicContact OE1-NH2 2.7Å; E82-R86 PolarHBondContact OE1-NH2 3.06Å; R86-S90 WeakPolarHBondContact O-CB 3.25Å; R86-S90 PolarHBondContact O-N 2.9Å |
| 87 | R | 97.3 | Very high | 92.8 | Very high | 156 Ų | 156 | 106.7 Ų | 106.7 | 59% | 0.589 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -67.2 | -43.1 | 175.7 | -175.3 | 174.9 | 62.5 | 178.2 | 1.1 | 111.6 | R83 N84 V85 S90 N91 | R83-R87 WeakPolarHBondContact O-CB 3.48Å; R83-R87 PolarHBondContact O-N 3.47Å; N84-R87 WeakPolarHBondContact O-CB 3.48Å; N84-R87 PolarHBondContact O-N 2.94Å; N84-R87 PolarHBondContact OD1-NH2 3.41Å; V85-R87 PolarHBondContact O-N 3.36Å; R87-S90 PolarHBondContact O-N 2.91Å; R87-N91 WeakPolarHBondContact O-CB 3.39Å; R87-N91 PolarHBondContact O-N 3.08Å; R87-N91 PolarHBondContact O-OD1 3.2Å |
| 88 | L | 97.6 | Very high | 94.3 | Very high | 98 Ų | 98 | 104.8 Ų | 104.8 | 51% | 0.513 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63.2 | -45.5 | 176.3 | -70 | 172.4 | 0 | 0 | 0 | 111.5 | N84 V85 S90 N91 E92 | N84-L88 WeakPolarHBondContact O-CG 3.49Å; N84-L88 PolarHBondContact O-N 3.41Å; V85-L88 WeakPolarHBondContact O-CB 3.22Å; V85-L88 PolarHBondContact O-N 3.36Å; L88-S90 VanDerWaalsContact C-N 3.32Å; L88-S90 PolarHBondContact O-N 3.28Å; L88-N91 PolarHBondContact O-N 2.93Å; L88-E92 WeakPolarHBondContact O-CB 3.26Å; L88-E92 PolarHBondContact O-N 2.93Å |
| 89 | E | 97.8 | Very high | 95.5 | Very high | 106 Ų | 106 | 105.4 Ų | 105.4 | 50% | 0.495 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -59.5 | -42.6 | 174.7 | -71.1 | 172.1 | 177.7 | 0 | 0 | 112 | V85 E92 R93 | V85-E89 HydrophobicContact CG1-CG 4.35Å; V85-E89 WeakPolarHBondContact CG1-OE1 3.11Å; V85-E89 WeakPolarHBondContact O-CG 3.46Å; V85-E89 PolarHBondContact O-N 3.23Å; E89-E92 PolarHBondContact O-N 3Å; E89-R93 WeakPolarHBondContact O-CB 3.38Å; E89-R93 PolarHBondContact O-N 3.01Å |
| 90 | S | 97.7 | Very high | 96.3 | Very high | 60 Ų | 60 | 110.2 Ų | 110.2 | 42% | 0.42 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.8 | -41.9 | 176 | -168.5 | 0 | 0 | 0 | 0 | 112 | R86 R87 L88 R93 E94 | R86-S90 WeakPolarHBondContact O-CB 3.25Å; R86-S90 PolarHBondContact O-N 2.9Å; R87-S90 PolarHBondContact O-N 2.91Å; L88-S90 VanDerWaalsContact C-N 3.32Å; L88-S90 PolarHBondContact O-N 3.28Å; S90-R93 PolarHBondContact O-N 3.46Å; S90-E94 PolarHBondContact O-N 3.02Å; S90-E94 VanDerWaalsContact O-N 3.07Å |
| 91 | N | 98.4 | Very high | 96.8 | Very high | 86 Ų | 86 | 110.2 Ų | 110.2 | 46% | 0.46 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.9 | -42.3 | 177.5 | -73.3 | -10 | 0 | 0 | 0 | 111.4 | R87 L88 R93 E94 R95 | R87-N91 WeakPolarHBondContact O-CB 3.39Å; R87-N91 PolarHBondContact O-N 3.08Å; R87-N91 PolarHBondContact O-OD1 3.2Å; L88-N91 PolarHBondContact O-N 2.93Å; N91-R93 VanDerWaalsContact C-N 3.35Å; N91-E94 PolarHBondContact O-N 3.4Å; N91-R95 WeakPolarHBondContact O-CG 3.27Å; N91-R95 PolarHBondContact O-N 2.89Å |
| 92 | E | 98.4 | Very high | 97.2 | Very high | 91 Ų | 91 | 107.3 Ų | 107.3 | 43% | 0.425 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63.4 | -42.5 | 177.3 | 179.8 | 50.9 | -146.9 | 0 | 0 | 111.3 | L88 E89 E94 R95 Q96 | L88-E92 WeakPolarHBondContact O-CB 3.26Å; L88-E92 PolarHBondContact O-N 2.93Å; E89-E92 PolarHBondContact O-N 3Å; E92-E94 VanDerWaalsContact C-N 3.31Å; E92-E94 PolarHBondContact O-N 3.01Å; E92-R95 WeakPolarHBondContact O-CB 3.27Å; E92-R95 PolarHBondContact O-N 2.84Å; E92-Q96 WeakPolarHBondContact O-CG 3.49Å; E92-Q96 PolarHBondContact O-N 2.89Å; E92-Q96 WeakPolarHBondContact OE1-CG 3.4Å; E92-Q96 PolarHBondContact OE1-NE2 2.92Å |
| 93 | R | 98.5 | Very high | 97.5 | Very high | 152 Ų | 152 | 107.9 Ų | 107.9 | 57% | 0.574 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -59 | -42.1 | 174.2 | -165.9 | -175.3 | -57.8 | 111.4 | 3.7 | 112.3 | E89 S90 N91 Q96 R97 | E89-R93 WeakPolarHBondContact O-CB 3.38Å; E89-R93 PolarHBondContact O-N 3.01Å; S90-R93 PolarHBondContact O-N 3.46Å; N91-R93 VanDerWaalsContact C-N 3.35Å; R93-Q96 PolarHBondContact O-N 3.3Å; R93-R97 WeakPolarHBondContact O-CB 3.19Å; R93-R97 PolarHBondContact O-N 3.21Å |
| 94 | E | 98.4 | Very high | 97.7 | Very high | 86 Ų | 86 | 103.3 Ų | 103.3 | 40% | 0.402 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -68.3 | -36.7 | 177.7 | -170.2 | 57.2 | -149.8 | 0 | 0 | 111.8 | S90 N91 E92 R97 M98 | S90-E94 PolarHBondContact O-N 3.02Å; S90-E94 VanDerWaalsContact O-N 3.07Å; N91-E94 PolarHBondContact O-N 3.4Å; E92-E94 VanDerWaalsContact C-N 3.31Å; E92-E94 PolarHBondContact O-N 3.01Å; E94-R97 WeakPolarHBondContact O-CB 3.15Å; E94-R97 PolarHBondContact O-N 3.31Å; E94-R97 IonicContact OE1-CZ 3.98Å; E94-R97 IonicContact OE1-NH1 2.84Å; E94-R97 PolarHBondContact OE1-NH1 3.33Å; E94-R97 IonicContact OE2-NH1 3.93Å; E94-M98 WeakPolarHBondContact O-CG 2.92Å; E94-M98 PolarHBondContact O-N 3.49Å |
| 95 | R | 98.6 | Very high | 97.8 | Very high | 160 Ų | 160 | 101.5 Ų | 101.5 | 60% | 0.604 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -58.9 | -49.1 | 171.4 | -73.1 | -179.7 | -178.6 | -82.3 | 0.2 | 110.9 | N91 E92 R97 M98 H99 | N91-R95 WeakPolarHBondContact O-CG 3.27Å; N91-R95 PolarHBondContact O-N 2.89Å; E92-R95 WeakPolarHBondContact O-CB 3.27Å; E92-R95 PolarHBondContact O-N 2.84Å; R95-R97 VanDerWaalsContact C-N 3.31Å; R95-R97 PolarHBondContact O-N 2.95Å; R95-M98 CarbonylContact O-C 3.59Å; R95-M98 PolarHBondContact O-N 2.89Å; R95-M98 VanDerWaalsContact O-N 3.14Å; R95-H99 PolarHBondContact O-CD2 2.56Å; R95-H99 PolarHBondContact O-N 3.13Å |
| 96 | Q | 98.6 | Very high | 97.8 | Very high | 96 Ų | 96 | 101.7 Ų | 101.7 | 45% | 0.449 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -60.6 | -40.8 | 177.6 | -68.9 | 174.3 | 9.3 | 0 | 0 | 112.2 | E92 R93 M98 H99 K100 | E92-Q96 WeakPolarHBondContact O-CG 3.49Å; E92-Q96 PolarHBondContact O-N 2.89Å; E92-Q96 WeakPolarHBondContact OE1-CG 3.4Å; E92-Q96 PolarHBondContact OE1-NE2 2.92Å; R93-Q96 PolarHBondContact O-N 3.3Å; Q96-M98 PolarHBondContact O-N 3.19Å; Q96-H99 PolarHBondContact O-N 3.31Å; Q96-K100 WeakPolarHBondContact O-CG 3.3Å; Q96-K100 PolarHBondContact O-N 3.39Å |
| 97 | R | 98.6 | Very high | 97.7 | Very high | 141 Ų | 141 | 97.1 Ų | 97.1 | 53% | 0.532 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -59.4 | -45.6 | 173.5 | -178.1 | -179.8 | 172.1 | -94.1 | -6.2 | 111.5 | R93 E94 R95 K100 L101 | R93-R97 WeakPolarHBondContact O-CB 3.19Å; R93-R97 PolarHBondContact O-N 3.21Å; E94-R97 WeakPolarHBondContact O-CB 3.15Å; E94-R97 PolarHBondContact O-N 3.31Å; E94-R97 IonicContact OE1-CZ 3.98Å; E94-R97 IonicContact OE1-NH1 2.84Å; E94-R97 PolarHBondContact OE1-NH1 3.33Å; E94-R97 IonicContact OE2-NH1 3.93Å; R95-R97 VanDerWaalsContact C-N 3.31Å; R95-R97 PolarHBondContact O-N 2.95Å; R97-K100 PolarHBondContact O-N 3.24Å; R97-L101 PolarHBondContact O-N 2.94Å |
| 98 | M | 98.6 | Very high | 97.6 | Very high | 63 Ų | 63 | 92.4 Ų | 92.4 | 31% | 0.31 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -65.7 | -38.3 | 175.9 | -74.6 | -60.8 | 102.1 | 0 | 0 | 112.8 | E94 R95 Q96 L101 N102 | E94-M98 WeakPolarHBondContact O-CG 2.92Å; E94-M98 PolarHBondContact O-N 3.49Å; R95-M98 CarbonylContact O-C 3.59Å; R95-M98 PolarHBondContact O-N 2.89Å; R95-M98 VanDerWaalsContact O-N 3.14Å; Q96-M98 PolarHBondContact O-N 3.19Å; M98-L101 HydrophobicContact CE-CD1 4.06Å; M98-L101 PolarHBondContact O-N 2.96Å; M98-N102 WeakPolarHBondContact O-CB 3.1Å; M98-N102 PolarHBondContact O-N 3.47Å; M98-N102 PolarHBondContact O-ND2 3.3Å |
| 99 | H | 98.4 | Very high | 97.4 | Very high | 111 Ų | 111 | 90.3 Ų | 90.3 | 51% | 0.514 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -61 | -46.8 | 174.1 | -74.7 | -60.2 | 0 | 0 | 0 | 111.6 | R95 Q96 L101 N102 N103 | R95-H99 PolarHBondContact O-CD2 2.56Å; R95-H99 PolarHBondContact O-N 3.13Å; Q96-H99 PolarHBondContact O-N 3.31Å; H99-L101 VanDerWaalsContact C-N 3.34Å; H99-L101 PolarHBondContact O-N 2.98Å; H99-N102 PolarHBondContact O-N 3.4Å; H99-N103 WeakPolarHBondContact O-CB 3.42Å; H99-N103 PolarHBondContact O-N 3.41Å; H99-N103 PolarHBondContact O-OD1 2.99Å |
| 100 | K | 98.4 | Very high | 97.2 | Very high | 158 Ų | 158 | 91.9 Ų | 91.9 | 69% | 0.687 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -57.7 | -46.1 | 175.1 | -70.7 | 179.7 | -177.7 | -175.2 | 0 | 111.9 | Q96 R97 N103 A104 | Q96-K100 WeakPolarHBondContact O-CG 3.3Å; Q96-K100 PolarHBondContact O-N 3.39Å; R97-K100 PolarHBondContact O-N 3.24Å; K100-N103 PolarHBondContact O-N 3.13Å; K100-A104 PolarHBondContact O-N 3.44Å |
| 101 | L | 98.2 | Very high | 97 | Very high | 72 Ų | 72 | 92 Ų | 92 | 38% | 0.377 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -60.8 | -47.4 | 177.3 | -177.1 | 155.4 | 0 | 0 | 0 | 111.4 | R97 M98 H99 N103 A104 F105 | R97-L101 PolarHBondContact O-N 2.94Å; M98-L101 HydrophobicContact CE-CD1 4.06Å; M98-L101 PolarHBondContact O-N 2.96Å; H99-L101 VanDerWaalsContact C-N 3.34Å; H99-L101 PolarHBondContact O-N 2.98Å; L101-N103 VanDerWaalsContact C-N 3.31Å; L101-N103 PolarHBondContact O-N 3.27Å; L101-A104 PolarHBondContact O-N 3.2Å; L101-F105 WeakPolarHBondContact O-CB 3.25Å; L101-F105 PolarHBondContact O-N 3.31Å |
| 102 | N | 97.4 | Very high | 96.7 | Very high | 69 Ų | 69 | 88.5 Ų | 88.5 | 37% | 0.369 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -65.9 | -35.6 | -178.6 | -71 | -27.1 | 0 | 0 | 0 | 112 | M98 H99 F105 Q106 | M98-N102 WeakPolarHBondContact O-CB 3.1Å; M98-N102 PolarHBondContact O-N 3.47Å; M98-N102 PolarHBondContact O-ND2 3.3Å; H99-N102 PolarHBondContact O-N 3.4Å; N102-F105 PolarHBondContact O-N 2.91Å; N102-Q106 WeakPolarHBondContact O-CB 3.44Å; N102-Q106 PolarHBondContact O-N 3.04Å |
| 103 | N | 97.4 | Very high | 96.2 | Very high | 113 Ų | 113 | 86.7 Ų | 86.7 | 60% | 0.604 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -65.4 | -46.5 | 174.5 | -69.1 | -0.5 | 0 | 0 | 0 | 111.1 | H99 K100 L101 F105 Q106 A107 | H99-N103 WeakPolarHBondContact O-CB 3.42Å; H99-N103 PolarHBondContact O-N 3.41Å; H99-N103 PolarHBondContact O-OD1 2.99Å; K100-N103 PolarHBondContact O-N 3.13Å; L101-N103 VanDerWaalsContact C-N 3.31Å; L101-N103 PolarHBondContact O-N 3.27Å; N103-F105 VanDerWaalsContact C-N 3.26Å; N103-F105 PolarHBondContact O-N 2.78Å; N103-Q106 WeakPolarHBondContact O-CB 3.44Å; N103-Q106 PolarHBondContact O-N 3.45Å; N103-Q106 VanDerWaalsContact O-N 3.14Å; N103-A107 PolarHBondContact O-N 3.12Å |
| 104 | A | 97.6 | Very high | 95.1 | Very high | 64 Ų | 64 | 88.4 Ų | 88.4 | 53% | 0.529 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -60.4 | -39 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | K100 L101 Q106 A107 L108 | K100-A104 PolarHBondContact O-N 3.44Å; L101-A104 PolarHBondContact O-N 3.2Å; A104-Q106 VanDerWaalsContact C-N 3.32Å; A104-Q106 PolarHBondContact O-N 3.44Å; A104-A107 PolarHBondContact O-N 3Å; A104-L108 PolarHBondContact O-N 3.21Å |
| 105 | F | 96.6 | Very high | 93.9 | Very high | 26 Ų | 26 | 86.1 Ų | 86.1 | 11% | 0.114 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -66.5 | -34.8 | 176.5 | -156.7 | -85.3 | 0 | 0 | 0 | 112.5 | L101 N102 N103 L108 R109 K123 T126 L127 | L101-F105 WeakPolarHBondContact O-CB 3.25Å; L101-F105 PolarHBondContact O-N 3.31Å; N102-F105 PolarHBondContact O-N 2.91Å; N103-F105 VanDerWaalsContact C-N 3.26Å; N103-F105 PolarHBondContact O-N 2.78Å; F105-L108 WeakPolarHBondContact O-CB 3.44Å; F105-L108 PolarHBondContact O-N 3.2Å; F105-R109 VanDerWaalsContact CD1-CZ 3.46Å; F105-R109 PolarHBondContact O-N 3.35Å; F105-K123 HydrophobicContact CE1-CB 4.34Å; F105-K123 HydrophobicContact CE1-CG 4.01Å; F105-K123 HydrophobicContact CE2-CB 4.4Å; F105-K123 HydrophobicContact CE2-CG 4.32Å; F105-K123 VanDerWaalsContact CZ-CA 3.43Å; F105-K123 HydrophobicContact CZ-CB 3.84Å; F105-K123 HydrophobicContact CZ-CG 3.87Å; F105-K123 WeakPolarHBondContact CZ-O 3.3Å; F105-T126 HydrophobicContact CD1-CG2 4.49Å; F105-T126 HydrophobicContact CE1-CG2 3.73Å; F105-T126 HydrophobicContact CZ-CG2 3.81Å; F105-L127 HydrophobicContact CE2-CD2 4.11Å; F105-L127 HydrophobicContact CE2-CG 4.19Å; F105-L127 HydrophobicContact CZ-CG 4.39Å |
| 106 | Q | 94.4 | Very high | 92.4 | Very high | 77 Ų | 77 | 86.2 Ų | 86.2 | 36% | 0.36 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -69.5 | -44.2 | 175.3 | -178.4 | 56.6 | 28.9 | 0 | 0 | 111.4 | N102 N103 A104 L108 R109 E110 | N102-Q106 WeakPolarHBondContact O-CB 3.44Å; N102-Q106 PolarHBondContact O-N 3.04Å; N103-Q106 WeakPolarHBondContact O-CB 3.44Å; N103-Q106 PolarHBondContact O-N 3.45Å; N103-Q106 VanDerWaalsContact O-N 3.14Å; A104-Q106 VanDerWaalsContact C-N 3.32Å; A104-Q106 PolarHBondContact O-N 3.44Å; Q106-L108 PolarHBondContact O-N 3.5Å; Q106-R109 WeakPolarHBondContact O-CB 3.38Å; Q106-R109 PolarHBondContact O-N 3.44Å; Q106-E110 PolarHBondContact NE2-OE1 3.44Å; Q106-E110 VanDerWaalsContact NE2-OE1 3.07Å; Q106-E110 PolarHBondContact O-N 3.07Å; Q106-E110 VanDerWaalsContact O-N 3.12Å |
| 107 | A | 94.4 | Very high | 90.6 | Very high | 54 Ų | 54 | 90.4 Ų | 90.4 | 45% | 0.446 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -57.8 | -38.4 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | N103 A104 R109 E110 A111 | N103-A107 PolarHBondContact O-N 3.12Å; A104-A107 PolarHBondContact O-N 3Å; A107-R109 VanDerWaalsContact C-N 3.34Å; A107-R109 PolarHBondContact O-N 3.45Å; A107-E110 PolarHBondContact O-N 3.33Å; A107-A111 PolarHBondContact O-N 3.47Å; A107-A111 VanDerWaalsContact O-N 3.13Å |
| 108 | L | 95.6 | Very high | 89.1 | Confident | 58 Ų | 58 | 91 Ų | 91 | 30% | 0.304 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -61.4 | -40.2 | 173.5 | -178.3 | 62.4 | 0 | 0 | 0 | 112.3 | A104 F105 Q106 E110 A111 I112 T126 L127 A130 | A104-L108 PolarHBondContact O-N 3.21Å; F105-L108 WeakPolarHBondContact O-CB 3.44Å; F105-L108 PolarHBondContact O-N 3.2Å; Q106-L108 PolarHBondContact O-N 3.5Å; L108-E110 VanDerWaalsContact C-N 3.31Å; L108-E110 PolarHBondContact O-N 2.9Å; L108-A111 PolarHBondContact O-N 3.39Å; L108-I112 WeakPolarHBondContact O-CG1 3.3Å; L108-I112 PolarHBondContact O-N 2.84Å; L108-T126 HydrophobicContact CB-CG2 4.48Å; L108-T126 HydrophobicContact CD2-CG2 3.91Å; L108-T126 HydrophobicContact CG-CG2 3.93Å; L108-L127 HydrophobicContact CD2-CD2 4.19Å; L108-A130 HydrophobicContact CD1-CB 3.88Å; L108-A130 HydrophobicContact CD2-CB 4.35Å; L108-A130 HydrophobicContact CG-CB 4.33Å |
| 109 | R | 94.1 | Very high | 88.2 | Confident | 54 Ų | 54 | 95.9 Ų | 95.9 | 20% | 0.204 | 49% | 0.492 | C | S | . | . | H | α-helix | trans | -62.9 | -40 | 176.4 | -68.7 | -174.8 | -173.5 | 102.2 | 2.6 | 112.1 | F105 Q106 A107 A111 I112 L121 T126 | F105-R109 VanDerWaalsContact CD1-CZ 3.46Å; F105-R109 PolarHBondContact O-N 3.35Å; Q106-R109 WeakPolarHBondContact O-CB 3.38Å; Q106-R109 PolarHBondContact O-N 3.44Å; A107-R109 VanDerWaalsContact C-N 3.34Å; A107-R109 PolarHBondContact O-N 3.45Å; R109-A111 VanDerWaalsContact C-N 3.26Å; R109-A111 PolarHBondContact O-N 3.37Å; R109-I112 PolarHBondContact O-N 2.76Å; R109-L121 PolarHBondContact NE-O 3.46Å; R109-L121 PolarHBondContact NH2-O 3.25Å; R109-T126 HydrophobicContact CG-CG2 3.66Å |
| 110 | E | 92.3 | Very high | 87.5 | Confident | 139 Ų | 139 | 99.9 Ų | 99.9 | 65% | 0.65 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -67.5 | -29 | -179.7 | -70.9 | 164.6 | -162.5 | 0 | 0 | 112.2 | Q106 A107 L108 I112 | Q106-E110 PolarHBondContact NE2-OE1 3.44Å; Q106-E110 VanDerWaalsContact NE2-OE1 3.07Å; Q106-E110 PolarHBondContact O-N 3.07Å; Q106-E110 VanDerWaalsContact O-N 3.12Å; A107-E110 PolarHBondContact O-N 3.33Å; L108-E110 VanDerWaalsContact C-N 3.31Å; L108-E110 PolarHBondContact O-N 2.9Å; E110-I112 VanDerWaalsContact C-N 3.31Å |
| 111 | A | 93.3 | Very high | 87.1 | Confident | 61 Ų | 61 | 93.6 Ų | 93.6 | 50% | 0.504 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -75 | -16.2 | 175 | 0 | 0 | 0 | 0 | 0 | 113.9 | A107 L108 R109 Y133 | A107-A111 PolarHBondContact O-N 3.47Å; A107-A111 VanDerWaalsContact O-N 3.13Å; L108-A111 PolarHBondContact O-N 3.39Å; R109-A111 VanDerWaalsContact C-N 3.26Å; R109-A111 PolarHBondContact O-N 3.37Å; A111-Y133 WeakPolarHBondContact O-CE1 3.34Å |
| 112 | I | 92.6 | Very high | 86.9 | Confident | 13 Ų | 13 | 92.5 Ų | 92.5 | 7% | 0.067 | 48% | 0.48 | C | S | . | . | S | Bend | trans | -83.6 | 122.6 | -178.8 | -61.6 | 166.5 | 0 | 0 | 0 | 109.3 | L108 R109 E110 V115 L121 T126 L129 A130 | L108-I112 WeakPolarHBondContact O-CG1 3.3Å; L108-I112 PolarHBondContact O-N 2.84Å; R109-I112 PolarHBondContact O-N 2.76Å; E110-I112 VanDerWaalsContact C-N 3.31Å; I112-V115 HydrophobicContact CB-CG2 3.83Å; I112-V115 HydrophobicContact CG2-CG2 3.53Å; I112-L121 HydrophobicContact CD1-CD1 4.29Å; I112-T126 HydrophobicContact CD1-CG2 3.7Å; I112-T126 WeakPolarHBondContact CD1-O 3.5Å; I112-L129 HydrophobicContact CD1-CB 4.06Å; I112-L129 HydrophobicContact CG2-CB 3.94Å; I112-L129 HydrophobicContact CG2-CD1 4.44Å; I112-A130 HydrophobicContact CD1-CB 4.2Å; I112-A130 HydrophobicContact CG1-CB 4.4Å |
| 113 | P | 88.9 | Confident | 86.8 | Confident | 53 Ų | 53 | 94.9 Ų | 94.9 | 34% | 0.344 | 49% | 0.487 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.6 | 151.5 | -177.5 | 27.5 | -35.3 | 0 | 0 | 0 | 112.5 | V115 Y133 | P113-V115 PolarHBondContact O-N 2.88Å; P113-Y133 HydrophobicContact CG-CD1 4.49Å; P113-Y133 HydrophobicContact CG-CD2 3.72Å; P113-Y133 HydrophobicContact CG-CE1 4.34Å; P113-Y133 HydrophobicContact CG-CE2 3.57Å; P113-Y133 HydrophobicContact CG-CG 4.2Å |
| 114 | H | 73.9 | Confident | 86.8 | Confident | 189 Ų | 189 | 95.1 Ų | 95.1 | 88% | 0.875 | 49% | 0.487 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 60.1 | 9.6 | 173.9 | -49 | -62.3 | 0 | 0 | 0 | 116.6 | K116 | H114-K116 PolarHBondContact O-N 3.35Š|
| 115 | V | 74.7 | Confident | 86.7 | Confident | 37 Ų | 37 | 96.8 Ų | 96.8 | 22% | 0.224 | 48% | 0.484 | C | S | . | . | trans | -69.6 | 101.4 | 164.5 | -175 | 0 | 0 | 0 | 0 | 106.4 | I112 P113 M117 L121 | I112-V115 HydrophobicContact CB-CG2 3.83Å; I112-V115 HydrophobicContact CG2-CG2 3.53Å; P113-V115 PolarHBondContact O-N 2.88Å; V115-M117 PolarHBondContact O-N 3.02Å; V115-M117 VanDerWaalsContact O-N 3.08Å; V115-L121 HydrophobicContact CB-CD1 4.3Å; V115-L121 HydrophobicContact CG1-CD1 3.75Å; V115-L121 HydrophobicContact CG1-CD2 4.33Å; V115-L121 HydrophobicContact CG1-CG 3.7Å; V115-L121 HydrophobicContact CG2-CD1 3.51Å; V115-L121 HydrophobicContact CG2-CG 4.32Å | ||
| 116 | K | 65.6 | Low | 86.6 | Confident | 162 Ų | 162 | 95.5 Ų | 95.5 | 70% | 0.704 | 48% | 0.478 | S | S | * | . | trans | -51.9 | 123.3 | 173.8 | -62.7 | -173 | -179.7 | -171.8 | 0 | 107.1 | H114 D118 K119 | H114-K116 PolarHBondContact O-N 3.35Å; K116-D118 PolarHBondContact O-N 3.14Å; K116-K119 PolarHBondContact O-N 3.32Å | ||
| 117 | M | 62.6 | Low | 86.8 | Confident | 185 Ų | 185 | 96.3 Ų | 96.3 | 91% | 0.911 | 48% | 0.484 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.5 | -22.1 | -173.9 | -59.4 | 169.2 | 52.7 | 0 | 0 | 112.8 | V115 | V115-M117 PolarHBondContact O-N 3.02Å; V115-M117 VanDerWaalsContact O-N 3.08Å |
| 118 | D | 65.6 | Low | 86.8 | Confident | 152 Ų | 152 | 96.8 Ų | 96.8 | 81% | 0.813 | 48% | 0.482 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.3 | -19.4 | -178.2 | -47.8 | -41.3 | 0 | 0 | 0 | 114.3 | K116 | K116-D118 PolarHBondContact O-N 3.14Š|
| 119 | K | 79.3 | Confident | 86.8 | Confident | 166 Ų | 166 | 97.4 Ų | 97.4 | 72% | 0.722 | 49% | 0.485 | S | S | * | . | S | Bend | trans | -103 | 105.1 | 177.2 | -80.4 | -168.1 | 174.4 | -173.6 | 0 | 110.9 | K116 L121 | K116-K119 PolarHBondContact O-N 3.32Å; K119-L121 PolarHBondContact O-N 2.99Å |
| 120 | K | 83.7 | Confident | 86.9 | Confident | 196 Ų | 196 | 95.4 Ų | 95.4 | 85% | 0.852 | 48% | 0.48 | S | S | * | . | trans | -67.8 | 112.6 | 173.2 | -67.8 | -177.4 | 178.2 | 176 | 0 | 110.5 | ||||
| 121 | L | 90.2 | Very high | 87.1 | Confident | 26 Ų | 26 | 93.5 Ų | 93.5 | 14% | 0.136 | 47% | 0.471 | C | S | . | . | trans | -66.5 | 139.2 | 171.9 | -65.5 | 176.6 | 0 | 0 | 0 | 111.6 | R109 I112 V115 K119 E125 T126 L129 | R109-L121 PolarHBondContact NE-O 3.46Å; R109-L121 PolarHBondContact NH2-O 3.25Å; I112-L121 HydrophobicContact CD1-CD1 4.29Å; V115-L121 HydrophobicContact CB-CD1 4.3Å; V115-L121 HydrophobicContact CG1-CD1 3.75Å; V115-L121 HydrophobicContact CG1-CD2 4.33Å; V115-L121 HydrophobicContact CG1-CG 3.7Å; V115-L121 HydrophobicContact CG2-CD1 3.51Å; V115-L121 HydrophobicContact CG2-CG 4.32Å; K119-L121 PolarHBondContact O-N 2.99Å; L121-E125 HydrophobicContact CB-CB 4.43Å; L121-E125 HydrophobicContact CD2-CB 4.28Å; L121-T126 VanDerWaalsContact CB-OG1 3.29Å; L121-T126 WeakPolarHBondContact CB-OG1 3.45Å; L121-L129 HydrophobicContact CD1-CD1 3.74Å; L121-L129 HydrophobicContact CD2-CD1 4.05Å | ||
| 122 | S | 94.8 | Very high | 87.3 | Confident | 49 Ų | 49 | 94.1 Ų | 94.1 | 34% | 0.343 | 47% | 0.466 | S | S | . | . | trans | -65.5 | 166.8 | 169.3 | 72.3 | 0 | 0 | 0 | 0 | 111.3 | I124 E125 T126 | S122-I124 VanDerWaalsContact C-N 3.31Å; S122-I124 PolarHBondContact O-N 3.48Å; S122-I124 WeakPolarHBondContact OG-CG2 3.38Å; S122-E125 WeakPolarHBondContact CB-OE2 3.35Å; S122-E125 PolarHBondContact N-OE2 3.32Å; S122-E125 PolarHBondContact O-N 3.47Å; S122-E125 WeakPolarHBondContact OG-CB 3.47Å; S122-E125 VanDerWaalsContact OG-CG 3.22Å; S122-E125 WeakPolarHBondContact OG-CG 3.49Å; S122-E125 PolarHBondContact OG-N 3.44Å; S122-E125 PolarHBondContact OG-OE2 2.87Å; S122-T126 WeakPolarHBondContact O-CB 3.46Å; S122-T126 PolarHBondContact O-N 2.93Å; S122-T126 PolarHBondContact O-OG1 3.24Å | ||
| 123 | K | 95.8 | Very high | 87.4 | Confident | 118 Ų | 118 | 97.6 Ų | 97.6 | 51% | 0.513 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -60.9 | -42.2 | -179.8 | -72.3 | -174.7 | 177.7 | -178 | 0 | 112.1 | F105 L127 | F105-K123 HydrophobicContact CE1-CB 4.34Å; F105-K123 HydrophobicContact CE1-CG 4.01Å; F105-K123 HydrophobicContact CE2-CB 4.4Å; F105-K123 HydrophobicContact CE2-CG 4.32Å; F105-K123 VanDerWaalsContact CZ-CA 3.43Å; F105-K123 HydrophobicContact CZ-CB 3.84Å; F105-K123 HydrophobicContact CZ-CG 3.87Å; F105-K123 WeakPolarHBondContact CZ-O 3.3Å; K123-L127 VanDerWaalsContact O-CG 3.31Å; K123-L127 WeakPolarHBondContact O-CG 3.34Å; K123-L127 PolarHBondContact O-N 3.19Å |
| 124 | I | 97.1 | Very high | 87.7 | Confident | 119 Ų | 119 | 100.2 Ų | 100.2 | 61% | 0.61 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -68.7 | -46.6 | -179.1 | -173.4 | 61.5 | 0 | 0 | 0 | 111.2 | S122 T126 L127 T128 | S122-I124 VanDerWaalsContact C-N 3.31Å; S122-I124 PolarHBondContact O-N 3.48Å; S122-I124 WeakPolarHBondContact OG-CG2 3.38Å; I124-T126 VanDerWaalsContact C-N 3.32Å; I124-T126 PolarHBondContact O-N 3.44Å; I124-L127 PolarHBondContact O-N 3.47Å; I124-T128 PolarHBondContact O-N 3.48Å; I124-T128 PolarHBondContact O-OG1 3.24Å; I124-T128 VanDerWaalsContact O-OG1 3.06Å |
| 125 | E | 94.4 | Very high | 88.5 | Confident | 98 Ų | 98 | 96.5 Ų | 96.5 | 46% | 0.458 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -60.4 | -42.3 | 179.7 | -69.4 | 164.5 | 138.2 | 0 | 0 | 111.8 | L121 S122 L127 T128 L129 | L121-E125 HydrophobicContact CB-CB 4.43Å; L121-E125 HydrophobicContact CD2-CB 4.28Å; S122-E125 WeakPolarHBondContact CB-OE2 3.35Å; S122-E125 PolarHBondContact N-OE2 3.32Å; S122-E125 PolarHBondContact O-N 3.47Å; S122-E125 WeakPolarHBondContact OG-CB 3.47Å; S122-E125 VanDerWaalsContact OG-CG 3.22Å; S122-E125 WeakPolarHBondContact OG-CG 3.49Å; S122-E125 PolarHBondContact OG-N 3.44Å; S122-E125 PolarHBondContact OG-OE2 2.87Å; E125-L127 PolarHBondContact O-N 3.11Å; E125-T128 PolarHBondContact O-N 3.03Å; E125-L129 WeakPolarHBondContact O-CB 3.47Å; E125-L129 VanDerWaalsContact O-CG 3.3Å; E125-L129 WeakPolarHBondContact O-CG 3.38Å; E125-L129 PolarHBondContact O-N 3.27Å |
| 126 | T | 95.6 | Very high | 89.4 | Confident | 0 Ų | 0 | 97.7 Ų | 97.7 | 0% | 0 | 48% | 0.48 | C | S | . | . | H | α-helix | trans | -60 | -46.4 | 177.7 | -53.1 | 0 | 0 | 0 | 0 | 110.9 | F105 L108 R109 I112 L121 S122 I124 A130 | F105-T126 HydrophobicContact CD1-CG2 4.49Å; F105-T126 HydrophobicContact CE1-CG2 3.73Å; F105-T126 HydrophobicContact CZ-CG2 3.81Å; L108-T126 HydrophobicContact CB-CG2 4.48Å; L108-T126 HydrophobicContact CD2-CG2 3.91Å; L108-T126 HydrophobicContact CG-CG2 3.93Å; R109-T126 HydrophobicContact CG-CG2 3.66Å; I112-T126 HydrophobicContact CD1-CG2 3.7Å; I112-T126 WeakPolarHBondContact CD1-O 3.5Å; L121-T126 VanDerWaalsContact CB-OG1 3.29Å; L121-T126 WeakPolarHBondContact CB-OG1 3.45Å; S122-T126 WeakPolarHBondContact O-CB 3.46Å; S122-T126 PolarHBondContact O-N 2.93Å; S122-T126 PolarHBondContact O-OG1 3.24Å; I124-T126 VanDerWaalsContact C-N 3.32Å; I124-T126 PolarHBondContact O-N 3.44Å; T126-A130 VanDerWaalsContact O-CB 3.25Å; T126-A130 WeakPolarHBondContact O-CB 3.38Å; T126-A130 PolarHBondContact O-N 3.3Å |
| 127 | L | 97.4 | Very high | 90.7 | Very high | 94 Ų | 94 | 93.1 Ų | 93.1 | 49% | 0.492 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -65.4 | -43.9 | 179.7 | -67.4 | 174.6 | 0 | 0 | 0 | 111.6 | F105 L108 K123 I124 E125 A130 E131 | F105-L127 HydrophobicContact CE2-CD2 4.11Å; F105-L127 HydrophobicContact CE2-CG 4.19Å; F105-L127 HydrophobicContact CZ-CG 4.39Å; L108-L127 HydrophobicContact CD2-CD2 4.19Å; K123-L127 VanDerWaalsContact O-CG 3.31Å; K123-L127 WeakPolarHBondContact O-CG 3.34Å; K123-L127 PolarHBondContact O-N 3.19Å; I124-L127 PolarHBondContact O-N 3.47Å; E125-L127 PolarHBondContact O-N 3.11Å; L127-A130 PolarHBondContact O-N 2.76Å; L127-E131 PolarHBondContact O-N 3.21Å |
| 128 | T | 96.3 | Very high | 92 | Very high | 63 Ų | 63 | 87.2 Ų | 87.2 | 39% | 0.387 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -63.2 | -45 | 178 | -57.9 | 0 | 0 | 0 | 0 | 112 | I124 E125 E131 N132 | I124-T128 PolarHBondContact O-N 3.48Å; I124-T128 PolarHBondContact O-OG1 3.24Å; I124-T128 VanDerWaalsContact O-OG1 3.06Å; E125-T128 PolarHBondContact O-N 3.03Å; T128-E131 PolarHBondContact O-N 3.35Å; T128-N132 PolarHBondContact O-N 2.64Å; T128-N132 VanDerWaalsContact O-N 3.11Å; T128-N132 PolarHBondContact O-ND2 2.87Å |
| 129 | L | 95 | Very high | 93 | Very high | 71 Ų | 71 | 84.6 Ų | 84.6 | 37% | 0.372 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -68.1 | -39.4 | 178.8 | -72.4 | 173.9 | 0 | 0 | 0 | 111.9 | I112 L121 E125 N132 Y133 | I112-L129 HydrophobicContact CD1-CB 4.06Å; I112-L129 HydrophobicContact CG2-CB 3.94Å; I112-L129 HydrophobicContact CG2-CD1 4.44Å; L121-L129 HydrophobicContact CD1-CD1 3.74Å; L121-L129 HydrophobicContact CD2-CD1 4.05Å; E125-L129 WeakPolarHBondContact O-CB 3.47Å; E125-L129 VanDerWaalsContact O-CG 3.3Å; E125-L129 WeakPolarHBondContact O-CG 3.38Å; E125-L129 PolarHBondContact O-N 3.27Å; L129-N132 PolarHBondContact O-N 2.61Å; L129-Y133 VanDerWaalsContact O-CB 3.32Å; L129-Y133 WeakPolarHBondContact O-CB 3.42Å; L129-Y133 PolarHBondContact O-N 3.49Å |
| 130 | A | 96.6 | Very high | 93.6 | Very high | 12 Ų | 12 | 81.3 Ų | 81.3 | 10% | 0.099 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -60.8 | -45.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | L108 I112 T126 L127 N132 Y133 I134 | L108-A130 HydrophobicContact CD1-CB 3.88Å; L108-A130 HydrophobicContact CD2-CB 4.35Å; L108-A130 HydrophobicContact CG-CB 4.33Å; I112-A130 HydrophobicContact CD1-CB 4.2Å; I112-A130 HydrophobicContact CG1-CB 4.4Å; T126-A130 VanDerWaalsContact O-CB 3.25Å; T126-A130 WeakPolarHBondContact O-CB 3.38Å; T126-A130 PolarHBondContact O-N 3.3Å; L127-A130 PolarHBondContact O-N 2.76Å; A130-N132 PolarHBondContact O-N 2.85Å; A130-Y133 PolarHBondContact O-N 3.06Å; A130-I134 WeakPolarHBondContact O-CG1 3.32Å; A130-I134 PolarHBondContact O-N 3.05Å |
| 131 | E | 96.6 | Very high | 93.8 | Very high | 99 Ų | 99 | 75.9 Ų | 75.9 | 46% | 0.463 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -58.7 | -47.6 | 175.7 | -174.6 | -168.8 | 152.9 | 0 | 0 | 111.6 | L127 T128 Y133 I134 K135 | L127-E131 PolarHBondContact O-N 3.21Å; T128-E131 PolarHBondContact O-N 3.35Å; E131-Y133 VanDerWaalsContact C-N 3.3Å; E131-Y133 PolarHBondContact O-N 3.03Å; E131-I134 PolarHBondContact O-N 3.42Å; E131-K135 HydrophobicContact CG-CD 4.37Å; E131-K135 WeakPolarHBondContact O-CG 3.45Å; E131-K135 PolarHBondContact O-N 3.25Å; E131-K135 WeakPolarHBondContact OE1-CE 3.49Å; E131-K135 IonicContact OE1-NZ 2.61Å; E131-K135 PolarHBondContact OE1-NZ 3.2Å |
| 132 | N | 95.6 | Very high | 93.4 | Very high | 74 Ų | 74 | 75.8 Ų | 75.8 | 40% | 0.396 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -65.2 | -35.3 | 178.2 | -71.2 | -26.2 | 0 | 0 | 0 | 112.3 | T128 L129 A130 K135 S136 | T128-N132 PolarHBondContact O-N 2.64Å; T128-N132 VanDerWaalsContact O-N 3.11Å; T128-N132 PolarHBondContact O-ND2 2.87Å; L129-N132 PolarHBondContact O-N 2.61Å; A130-N132 PolarHBondContact O-N 2.85Å; N132-K135 PolarHBondContact O-N 3.41Å; N132-S136 WeakPolarHBondContact O-CB 3.5Å; N132-S136 PolarHBondContact O-N 2.86Å; N132-S136 PolarHBondContact O-OG 3.39Å |
| 133 | Y | 95.8 | Very high | 92.8 | Very high | 86 Ų | 86 | 75.3 Ų | 75.3 | 34% | 0.337 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -66.6 | -46.7 | 178.2 | -177.3 | -137 | 0 | 0 | 0 | 111.3 | A111 P113 L129 A130 E131 K135 S136 L137 | A111-Y133 WeakPolarHBondContact O-CE1 3.34Å; P113-Y133 HydrophobicContact CG-CD1 4.49Å; P113-Y133 HydrophobicContact CG-CD2 3.72Å; P113-Y133 HydrophobicContact CG-CE1 4.34Å; P113-Y133 HydrophobicContact CG-CE2 3.57Å; P113-Y133 HydrophobicContact CG-CG 4.2Å; L129-Y133 VanDerWaalsContact O-CB 3.32Å; L129-Y133 WeakPolarHBondContact O-CB 3.42Å; L129-Y133 PolarHBondContact O-N 3.49Å; A130-Y133 PolarHBondContact O-N 3.06Å; E131-Y133 VanDerWaalsContact C-N 3.3Å; E131-Y133 PolarHBondContact O-N 3.03Å; Y133-K135 PolarHBondContact O-N 2.98Å; Y133-S136 PolarHBondContact O-N 3.3Å; Y133-L137 HydrophobicContact CD1-CD1 4.3Å; Y133-L137 HydrophobicContact CD2-CD1 4.25Å; Y133-L137 HydrophobicContact CD2-CG 4.01Å; Y133-L137 HydrophobicContact CE1-CD1 3.84Å; Y133-L137 HydrophobicContact CE2-CD1 3.75Å; Y133-L137 HydrophobicContact CE2-CD2 3.75Å; Y133-L137 HydrophobicContact CE2-CG 3.62Å; Y133-L137 HydrophobicContact CG-CD1 4.5Å; Y133-L137 WeakPolarHBondContact O-CG 3.37Å; Y133-L137 PolarHBondContact O-N 3.46Å |
| 134 | I | 94.9 | Very high | 92.1 | Very high | 109 Ų | 109 | 76.3 Ų | 76.3 | 56% | 0.559 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -56.1 | -50.3 | 173.1 | -66.3 | 167 | 0 | 0 | 0 | 110.1 | A130 E131 S136 L137 T138 | A130-I134 WeakPolarHBondContact O-CG1 3.32Å; A130-I134 PolarHBondContact O-N 3.05Å; E131-I134 PolarHBondContact O-N 3.42Å; I134-S136 VanDerWaalsContact C-N 3.3Å; I134-S136 PolarHBondContact O-N 3.35Å; I134-L137 PolarHBondContact O-N 3.41Å; I134-T138 WeakPolarHBondContact O-CB 3.38Å; I134-T138 PolarHBondContact O-N 3.42Å; I134-T138 PolarHBondContact O-OG1 3.48Å |
| 135 | K | 91.6 | Very high | 91 | Very high | 110 Ų | 110 | 73.3 Ų | 73.3 | 48% | 0.478 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -56.3 | -42.5 | 178 | -74.9 | 171.4 | 170.9 | 173.4 | 0 | 112.9 | E131 N132 Y133 T139 | E131-K135 HydrophobicContact CG-CD 4.37Å; E131-K135 WeakPolarHBondContact O-CG 3.45Å; E131-K135 PolarHBondContact O-N 3.25Å; E131-K135 WeakPolarHBondContact OE1-CE 3.49Å; E131-K135 IonicContact OE1-NZ 2.61Å; E131-K135 PolarHBondContact OE1-NZ 3.2Å; N132-K135 PolarHBondContact O-N 3.41Å; Y133-K135 PolarHBondContact O-N 2.98Å; K135-T139 WeakPolarHBondContact O-CB 3.4Å; K135-T139 PolarHBondContact O-N 2.94Å; K135-T139 PolarHBondContact O-OG1 2.82Å |
| 136 | S | 93.3 | Very high | 89.4 | Confident | 62 Ų | 62 | 71 Ų | 71 | 43% | 0.434 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -66.9 | -47.3 | -180 | -57.8 | 0 | 0 | 0 | 0 | 111.2 | N132 Y133 I134 T139 I140 | N132-S136 WeakPolarHBondContact O-CB 3.5Å; N132-S136 PolarHBondContact O-N 2.86Å; N132-S136 PolarHBondContact O-OG 3.39Å; Y133-S136 PolarHBondContact O-N 3.3Å; I134-S136 VanDerWaalsContact C-N 3.3Å; I134-S136 PolarHBondContact O-N 3.35Å; S136-T139 PolarHBondContact O-N 3.06Å; S136-I140 VanDerWaalsContact O-CG1 3.3Å; S136-I140 WeakPolarHBondContact O-CG1 3.46Å; S136-I140 PolarHBondContact O-N 2.94Å |
| 137 | L | 92.4 | Very high | 87.5 | Confident | 66 Ų | 66 | 75.1 Ų | 75.1 | 35% | 0.346 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -60.7 | -46.4 | 176.7 | -70.6 | 179.8 | 0 | 0 | 0 | 111.6 | Y133 I134 T139 I140 I141 | Y133-L137 HydrophobicContact CD1-CD1 4.3Å; Y133-L137 HydrophobicContact CD2-CD1 4.25Å; Y133-L137 HydrophobicContact CD2-CG 4.01Å; Y133-L137 HydrophobicContact CE1-CD1 3.84Å; Y133-L137 HydrophobicContact CE2-CD1 3.75Å; Y133-L137 HydrophobicContact CE2-CD2 3.75Å; Y133-L137 HydrophobicContact CE2-CG 3.62Å; Y133-L137 HydrophobicContact CG-CD1 4.5Å; Y133-L137 WeakPolarHBondContact O-CG 3.37Å; Y133-L137 PolarHBondContact O-N 3.46Å; I134-L137 PolarHBondContact O-N 3.41Å; L137-T139 VanDerWaalsContact C-N 3.28Å; L137-T139 PolarHBondContact O-N 3.33Å; L137-I140 PolarHBondContact O-N 3.06Å; L137-I141 WeakPolarHBondContact O-CB 3.25Å; L137-I141 VanDerWaalsContact O-CG1 3.27Å; L137-I141 WeakPolarHBondContact O-CG1 3.29Å; L137-I141 PolarHBondContact O-N 3.35Å |
| 138 | T | 89.3 | Confident | 85.3 | Confident | 62 Ų | 62 | 81.8 Ų | 81.8 | 38% | 0.38 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -57.1 | -43.6 | 175.9 | -59 | 0 | 0 | 0 | 0 | 111.4 | I134 L142 L163 | I134-T138 WeakPolarHBondContact O-CB 3.38Å; I134-T138 PolarHBondContact O-N 3.42Å; I134-T138 PolarHBondContact O-OG1 3.48Å; T138-L142 WeakPolarHBondContact O-CB 3.3Å; T138-L142 PolarHBondContact O-N 2.92Å; T138-L163 HydrophobicContact CG2-CD1 4.42Å |
| 139 | T | 87.5 | Confident | 83 | Confident | 96 Ų | 96 | 83.8 Ų | 83.8 | 59% | 0.589 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -65.5 | -41.2 | 178.3 | -56.5 | 0 | 0 | 0 | 0 | 112.1 | K135 S136 L137 L142 G143 | K135-T139 WeakPolarHBondContact O-CB 3.4Å; K135-T139 PolarHBondContact O-N 2.94Å; K135-T139 PolarHBondContact O-OG1 2.82Å; S136-T139 PolarHBondContact O-N 3.06Å; L137-T139 VanDerWaalsContact C-N 3.28Å; L137-T139 PolarHBondContact O-N 3.33Å; T139-L142 PolarHBondContact O-N 3.36Å; T139-G143 PolarHBondContact O-N 3.31Å |
| 140 | I | 90.8 | Very high | 80.8 | Confident | 97 Ų | 97 | 85.5 Ų | 85.5 | 50% | 0.497 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -64.1 | -51 | 177.6 | -69.5 | 163.4 | 0 | 0 | 0 | 110.2 | S136 L137 L142 G143 M144 | S136-I140 VanDerWaalsContact O-CG1 3.3Å; S136-I140 WeakPolarHBondContact O-CG1 3.46Å; S136-I140 PolarHBondContact O-N 2.94Å; L137-I140 PolarHBondContact O-N 3.06Å; I140-L142 VanDerWaalsContact C-N 3.27Å; I140-L142 PolarHBondContact O-N 2.92Å; I140-G143 PolarHBondContact O-N 3.4Å; I140-M144 HydrophobicContact CG2-CG 4.39Å; I140-M144 HydrophobicContact CG2-SD 3.72Å; I140-M144 WeakPolarHBondContact O-CB 3.22Å; I140-M144 VanDerWaalsContact O-CG 3.22Å; I140-M144 WeakPolarHBondContact O-CG 3.43Å; I140-M144 PolarHBondContact O-N 3.14Å |
| 141 | I | 88.1 | Confident | 78.4 | Confident | 82 Ų | 82 | 91.4 Ų | 91.4 | 42% | 0.421 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -58.9 | -43.5 | 178.9 | -66.7 | 165.9 | 0 | 0 | 0 | 110.2 | L137 M144 S145 L163 | L137-I141 WeakPolarHBondContact O-CB 3.25Å; L137-I141 VanDerWaalsContact O-CG1 3.27Å; L137-I141 WeakPolarHBondContact O-CG1 3.29Å; L137-I141 PolarHBondContact O-N 3.35Å; I141-M144 PolarHBondContact O-N 2.96Å; I141-S145 WeakPolarHBondContact O-CB 3.36Å; I141-S145 PolarHBondContact O-N 3.43Å; I141-S145 PolarHBondContact O-OG 3.19Å; I141-L163 HydrophobicContact CG2-CD1 4.12Å; I141-L163 HydrophobicContact CG2-CD2 3.68Å; I141-L163 HydrophobicContact CG2-CG 4.46Å |
| 142 | L | 83.3 | Confident | 76.4 | Confident | 24 Ų | 24 | 90.5 Ų | 90.5 | 13% | 0.126 | 52% | 0.521 | C | S | . | . | H | α-helix | trans | -59.9 | -54.1 | 174.6 | 173.2 | 47 | 0 | 0 | 0 | 111.5 | T138 T139 I140 M144 S145 S146 S159 | T138-L142 WeakPolarHBondContact O-CB 3.3Å; T138-L142 PolarHBondContact O-N 2.92Å; T139-L142 PolarHBondContact O-N 3.36Å; I140-L142 VanDerWaalsContact C-N 3.27Å; I140-L142 PolarHBondContact O-N 2.92Å; L142-M144 PolarHBondContact O-N 2.9Å; L142-S145 WeakPolarHBondContact CA-OG 3.37Å; L142-S145 CarbonylContact O-C 3.57Å; L142-S145 PolarHBondContact O-N 2.88Å; L142-S145 PolarHBondContact O-OG 3.07Å; L142-S146 WeakPolarHBondContact O-CB 3.32Å; L142-S146 PolarHBondContact O-N 3.17Å; L142-S159 WeakPolarHBondContact CD1-OG 3.48Å; L142-S159 WeakPolarHBondContact CD2-OG 3.17Å |
| 143 | G | 81.5 | Confident | 74.3 | Confident | 40 Ų | 40 | 94.2 Ų | 94.2 | 41% | 0.412 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -56.2 | -39.3 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | T139 I140 S146 A147 | T139-G143 PolarHBondContact O-N 3.31Å; I140-G143 PolarHBondContact O-N 3.4Å; G143-S146 PolarHBondContact O-N 3.26Å; G143-A147 PolarHBondContact O-N 3.43Å; G143-A147 VanDerWaalsContact O-N 3.16Å |
| 144 | M | 80.8 | Confident | 72.2 | Confident | 139 Ų | 139 | 96.3 Ų | 96.3 | 69% | 0.685 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -65 | -40.1 | 174.8 | -68.2 | 171.4 | 71.5 | 0 | 0 | 112.2 | I140 I141 L142 | I140-M144 HydrophobicContact CG2-CG 4.39Å; I140-M144 HydrophobicContact CG2-SD 3.72Å; I140-M144 WeakPolarHBondContact O-CB 3.22Å; I140-M144 VanDerWaalsContact O-CG 3.22Å; I140-M144 WeakPolarHBondContact O-CG 3.43Å; I140-M144 PolarHBondContact O-N 3.14Å; I141-M144 PolarHBondContact O-N 2.96Å; L142-M144 PolarHBondContact O-N 2.9Å |
| 145 | S | 73.8 | Confident | 70.2 | Confident | 56 Ų | 56 | 94.3 Ų | 94.3 | 39% | 0.392 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -73.4 | -30.3 | 177 | 72 | 0 | 0 | 0 | 0 | 113.4 | I141 L142 A147 | I141-S145 WeakPolarHBondContact O-CB 3.36Å; I141-S145 PolarHBondContact O-N 3.43Å; I141-S145 PolarHBondContact O-OG 3.19Å; L142-S145 WeakPolarHBondContact CA-OG 3.37Å; L142-S145 CarbonylContact O-C 3.57Å; L142-S145 PolarHBondContact O-N 2.88Å; L142-S145 PolarHBondContact O-OG 3.07Å; S145-A147 VanDerWaalsContact C-N 3.35Å |
| 146 | S | 61 | Low | 68.7 | Low | 48 Ų | 48 | 94 Ų | 94 | 34% | 0.336 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -78 | -18.4 | 178 | 127.3 | 0 | 0 | 0 | 0 | 112.8 | L142 G143 R148 L149 | L142-S146 WeakPolarHBondContact O-CB 3.32Å; L142-S146 PolarHBondContact O-N 3.17Å; G143-S146 PolarHBondContact O-N 3.26Å; S146-R148 PolarHBondContact O-N 2.96Å; S146-L149 PolarHBondContact O-N 2.93Å |
| 147 | A | 55.3 | Low | 67.3 | Low | 88 Ų | 88 | 99.2 Ų | 99.2 | 73% | 0.727 | 58% | 0.577 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62 | -7.3 | 172.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | G143 S145 | G143-A147 PolarHBondContact O-N 3.43Å; G143-A147 VanDerWaalsContact O-N 3.16Å; S145-A147 VanDerWaalsContact C-N 3.35Å |
| 148 | R | 51.3 | Low | 65.9 | Low | 234 Ų | 234 | 98.4 Ų | 98.4 | 88% | 0.883 | 58% | 0.58 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.4 | -1.1 | 172.4 | -94.1 | -167.6 | 174.2 | -173.2 | 0.2 | 115.4 | S146 | S146-R148 PolarHBondContact O-N 2.96Š|
| 149 | L | 48.5 | Very low | 64.9 | Low | 104 Ų | 104 | 95.6 Ų | 95.6 | 55% | 0.545 | 56% | 0.562 | S | S | . | * | S | Bend | trans | -128.6 | 147.1 | -175 | -71.2 | 174.9 | 0 | 0 | 0 | 113.7 | S146 | S146-L149 PolarHBondContact O-N 2.93Š|
| 150 | P | 49.2 | Very low | 64.1 | Low | 107 Ų | 107 | 92.9 Ų | 92.9 | 70% | 0.695 | 55% | 0.55 | S | S | * | * | trans | -67.6 | 157.5 | -174.2 | 28.4 | -34.4 | 0 | 0 | 0 | 112.6 | G152 | P150-G152 PolarHBondContact O-N 3.42Š| ||
| 151 | P | 46.5 | Very low | 63.3 | Low | 137 Ų | 137 | 90.8 Ų | 90.8 | 89% | 0.89 | 55% | 0.547 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.9 | 111.8 | -173.9 | 22.1 | -15.3 | 0 | 0 | 0 | 110.2 | ||
| 152 | G | 54.6 | Low | 62.8 | Low | 79 Ų | 79 | 91.7 Ų | 91.7 | 81% | 0.814 | 55% | 0.545 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 176.8 | -17.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 118 | P150 | P150-G152 PolarHBondContact O-N 3.42Š|
| 153 | E | 50.2 | Low | 62.4 | Low | 153 Ų | 153 | 93.5 Ų | 93.5 | 72% | 0.715 | 56% | 0.555 | S | S | * | * | S | Bend | trans | -108.2 | 132.6 | -176.9 | -66.8 | -177.9 | 170.6 | 0 | 0 | 111.3 | P155 | E153-P155 VanDerWaalsContact O-CD 3.25Å; E153-P155 WeakPolarHBondContact O-CD 3.4Å; E153-P155 VanDerWaalsContact O-CG 3.3Å; E153-P155 WeakPolarHBondContact O-CG 3.31Å; E153-P155 VanDerWaalsContact O-N 3.09Å |
| 154 | T | 53.2 | Low | 62.2 | Low | 130 Ų | 130 | 97 Ų | 97 | 80% | 0.798 | 56% | 0.564 | S | S | * | * | trans | -60 | 111.1 | 175.5 | 44.7 | 0 | 0 | 0 | 0 | 109.3 | T156 | T154-T156 PolarHBondContact O-N 2.84Š| ||
| 155 | P | 52.5 | Low | 62.2 | Low | 67 Ų | 67 | 96.2 Ų | 96.2 | 44% | 0.435 | 56% | 0.558 | S | S | . | * | trans | -85.4 | -1.4 | -151.3 | -11.1 | 26.9 | 0 | 0 | 0 | 115.6 | E153 S159 | E153-P155 VanDerWaalsContact O-CD 3.25Å; E153-P155 WeakPolarHBondContact O-CD 3.4Å; E153-P155 VanDerWaalsContact O-CG 3.3Å; E153-P155 WeakPolarHBondContact O-CG 3.31Å; E153-P155 VanDerWaalsContact O-N 3.09Å; P155-S159 WeakPolarHBondContact O-CB 3.43Å; P155-S159 PolarHBondContact O-OG 3.42Å | ||
| 156 | T | 60.7 | Low | 62.2 | Low | 102 Ų | 102 | 96.4 Ų | 96.4 | 63% | 0.626 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -85.8 | -40 | -158.6 | -21.2 | 0 | 0 | 0 | 0 | 113.9 | T154 S159 A160 | T154-T156 PolarHBondContact O-N 2.84Å; T156-S159 PolarHBondContact O-OG 2.86Å; T156-A160 WeakPolarHBondContact O-CB 3.48Å; T156-A160 PolarHBondContact O-N 3.29Å |
| 157 | E | 62.1 | Low | 62.9 | Low | 173 Ų | 173 | 101.1 Ų | 101.1 | 81% | 0.808 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -85.7 | -47.5 | -177.4 | -79 | -177.2 | 157.3 | 0 | 0 | 112.9 | S159 A160 A161 | E157-S159 PolarHBondContact O-N 2.86Å; E157-S159 VanDerWaalsContact O-N 3.13Å; E157-A160 PolarHBondContact O-N 2.91Å; E157-A161 WeakPolarHBondContact O-CB 3.47Å; E157-A161 PolarHBondContact O-N 2.91Å |
| 158 | A | 64.9 | Low | 64 | Low | 49 Ų | 49 | 102.7 Ų | 102.7 | 41% | 0.405 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -61.4 | -27.3 | -177.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | R162 | A158-R162 WeakPolarHBondContact O-CG 3.42Å; A158-R162 PolarHBondContact O-N 3.04Å; A158-R162 PolarHBondContact O-NH1 3.23Å |
| 159 | S | 68.1 | Low | 65.2 | Low | 2 Ų | 2 | 96.6 Ų | 96.6 | 1% | 0.014 | 54% | 0.544 | C | S | . | . | H | α-helix | trans | -91.4 | -32.9 | -178.8 | 71 | 0 | 0 | 0 | 0 | 114.3 | L142 P155 T156 E157 A161 R162 L163 | L142-S159 WeakPolarHBondContact CD1-OG 3.48Å; L142-S159 WeakPolarHBondContact CD2-OG 3.17Å; P155-S159 WeakPolarHBondContact O-CB 3.43Å; P155-S159 PolarHBondContact O-OG 3.42Å; T156-S159 PolarHBondContact O-OG 2.86Å; E157-S159 PolarHBondContact O-N 2.86Å; E157-S159 VanDerWaalsContact O-N 3.13Å; S159-A161 PolarHBondContact O-N 3.24Å; S159-R162 PolarHBondContact O-N 3.46Å; S159-L163 PolarHBondContact O-N 3.03Å |
| 160 | A | 71 | Confident | 66 | Low | 40 Ų | 40 | 96.9 Ų | 96.9 | 33% | 0.331 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -60.7 | -39.6 | 166.8 | 0 | 0 | 0 | 0 | 0 | 110 | T156 E157 L163 L164 | T156-A160 WeakPolarHBondContact O-CB 3.48Å; T156-A160 PolarHBondContact O-N 3.29Å; E157-A160 PolarHBondContact O-N 2.91Å; A160-L163 PolarHBondContact O-N 2.97Å; A160-L164 WeakPolarHBondContact O-CB 3.48Å; A160-L164 WeakPolarHBondContact O-CG 3.39Å; A160-L164 PolarHBondContact O-N 2.97Å |
| 161 | A | 73.2 | Confident | 66.7 | Low | 53 Ų | 53 | 96.9 Ų | 96.9 | 44% | 0.438 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -60.6 | -42.8 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | E157 S159 L164 Q165 | E157-A161 WeakPolarHBondContact O-CB 3.47Å; E157-A161 PolarHBondContact O-N 2.91Å; S159-A161 PolarHBondContact O-N 3.24Å; A161-L164 PolarHBondContact O-N 2.87Å; A161-Q165 WeakPolarHBondContact O-CB 3.44Å; A161-Q165 PolarHBondContact O-N 3.09Å |
| 162 | R | 77.3 | Confident | 67.5 | Low | 101 Ų | 101 | 95 Ų | 95 | 38% | 0.381 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.6 | -41.3 | 175.1 | -73.2 | -176.3 | -63.7 | -101.9 | 9.7 | 112.6 | A158 S159 Q165 C166 | A158-R162 WeakPolarHBondContact O-CG 3.42Å; A158-R162 PolarHBondContact O-N 3.04Å; A158-R162 PolarHBondContact O-NH1 3.23Å; S159-R162 PolarHBondContact O-N 3.46Å; R162-Q165 PolarHBondContact O-N 3.37Å; R162-C166 WeakPolarHBondContact O-CB 3.48Å; R162-C166 PolarHBondContact O-N 2.7Å |
| 163 | L | 74.8 | Confident | 67.7 | Low | 61 Ų | 61 | 96.8 Ų | 96.8 | 32% | 0.319 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.5 | -43.2 | 175.7 | -84.1 | 168.6 | 0 | 0 | 0 | 112.2 | T138 I141 S159 A160 C166 Y167 | T138-L163 HydrophobicContact CG2-CD1 4.42Å; I141-L163 HydrophobicContact CG2-CD1 4.12Å; I141-L163 HydrophobicContact CG2-CD2 3.68Å; I141-L163 HydrophobicContact CG2-CG 4.46Å; S159-L163 PolarHBondContact O-N 3.03Å; A160-L163 PolarHBondContact O-N 2.97Å; L163-C166 PolarHBondContact O-N 3.41Å; L163-Y167 WeakPolarHBondContact O-CB 3.48Å; L163-Y167 PolarHBondContact O-N 2.95Å |
| 164 | L | 77.4 | Confident | 67.9 | Low | 115 Ų | 115 | 96.5 Ų | 96.5 | 60% | 0.602 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.5 | -43.8 | 174.7 | -78.9 | 166.9 | 0 | 0 | 0 | 111.7 | A160 A161 C166 Y167 Q168 | A160-L164 WeakPolarHBondContact O-CB 3.48Å; A160-L164 WeakPolarHBondContact O-CG 3.39Å; A160-L164 PolarHBondContact O-N 2.97Å; A161-L164 PolarHBondContact O-N 2.87Å; L164-C166 VanDerWaalsContact C-N 3.34Å; L164-C166 PolarHBondContact O-N 3.11Å; L164-Y167 PolarHBondContact O-N 3.47Å; L164-Q168 WeakPolarHBondContact O-CB 3.41Å; L164-Q168 PolarHBondContact O-N 3.46Å |
| 165 | Q | 81.3 | Confident | 68.1 | Low | 122 Ų | 122 | 92 Ų | 92 | 57% | 0.57 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -61.7 | -42.3 | 176.3 | -175.9 | 173.8 | 12 | 0 | 0 | 111.9 | A161 R162 Q168 Q169 | A161-Q165 WeakPolarHBondContact O-CB 3.44Å; A161-Q165 PolarHBondContact O-N 3.09Å; R162-Q165 PolarHBondContact O-N 3.37Å; Q165-Q168 PolarHBondContact O-N 3.09Å; Q165-Q169 PolarHBondContact O-N 2.92Å |
| 166 | C | 73.9 | Confident | 68.4 | Low | 59 Ų | 59 | 94.3 Ų | 94.3 | 40% | 0.399 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -66.5 | -40.9 | 177.9 | -140.1 | 0 | 0 | 0 | 0 | 111.7 | R162 L163 L164 Q168 Q169 H170 | R162-C166 WeakPolarHBondContact O-CB 3.48Å; R162-C166 PolarHBondContact O-N 2.7Å; L163-C166 PolarHBondContact O-N 3.41Å; L164-C166 VanDerWaalsContact C-N 3.34Å; L164-C166 PolarHBondContact O-N 3.11Å; C166-Q168 VanDerWaalsContact C-N 3.35Å; C166-Q169 PolarHBondContact O-N 3.49Å; C166-H170 PolarHBondContact O-N 3.42Å; C166-H170 VanDerWaalsContact O-N 3.15Å; C166-H170 PolarHBondContact O-ND1 3.02Å |
| 167 | Y | 74.9 | Confident | 68.5 | Low | 148 Ų | 148 | 95.5 Ų | 95.5 | 58% | 0.58 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -62.9 | -40.8 | 173.6 | 177.5 | -102.5 | 0 | 0 | 0 | 112.1 | L163 L164 H170 L171 | L163-Y167 WeakPolarHBondContact O-CB 3.48Å; L163-Y167 PolarHBondContact O-N 2.95Å; L164-Y167 PolarHBondContact O-N 3.47Å; Y167-H170 PolarHBondContact O-N 3.01Å; Y167-L171 HydrophobicContact CD1-CD1 4.03Å; Y167-L171 HydrophobicContact CE1-CD1 3.45Å; Y167-L171 VanDerWaalsContact CE1-CD1 3.45Å; Y167-L171 HydrophobicContact CE1-CG 4.21Å; Y167-L171 PolarHBondContact O-N 3.16Å |
| 168 | Q | 79.1 | Confident | 68.7 | Low | 121 Ų | 121 | 91.2 Ų | 91.2 | 57% | 0.565 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -63 | -41.8 | 177.1 | -166.3 | 116.8 | 10.2 | 0 | 0 | 111.8 | L164 Q165 C166 L171 E172 | L164-Q168 WeakPolarHBondContact O-CB 3.41Å; L164-Q168 PolarHBondContact O-N 3.46Å; Q165-Q168 PolarHBondContact O-N 3.09Å; C166-Q168 VanDerWaalsContact C-N 3.35Å; Q168-L171 PolarHBondContact O-N 3.05Å; Q168-E172 PolarHBondContact O-N 3.43Å |
| 169 | Q | 75.6 | Confident | 69 | Low | 106 Ų | 106 | 93.8 Ų | 93.8 | 50% | 0.495 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62 | -42.1 | 174.6 | -84.7 | 179 | -37.4 | 0 | 0 | 113 | Q165 C166 L171 E172 E173 | Q165-Q169 PolarHBondContact O-N 2.92Å; C166-Q169 PolarHBondContact O-N 3.49Å; Q169-L171 VanDerWaalsContact C-N 3.26Å; Q169-L171 PolarHBondContact O-N 3.03Å; Q169-E172 WeakPolarHBondContact O-CB 3.44Å; Q169-E172 PolarHBondContact O-N 2.79Å; Q169-E173 PolarHBondContact O-N 3.35Å; Q169-E173 VanDerWaalsContact O-N 3.16Å |
| 170 | H | 64.8 | Low | 69.3 | Low | 110 Ų | 110 | 96.8 Ų | 96.8 | 51% | 0.509 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65.9 | -29 | 178.4 | -76.7 | 81.2 | 0 | 0 | 0 | 112.8 | C166 Y167 E172 | C166-H170 PolarHBondContact O-N 3.42Å; C166-H170 VanDerWaalsContact O-N 3.15Å; C166-H170 PolarHBondContact O-ND1 3.02Å; Y167-H170 PolarHBondContact O-N 3.01Å; H170-E172 VanDerWaalsContact C-N 3.26Å; H170-E172 PolarHBondContact O-N 3.02Å |
| 171 | L | 65.1 | Low | 69.7 | Low | 106 Ų | 106 | 101 Ų | 101 | 56% | 0.555 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -69.4 | -23.5 | 173.5 | -74.3 | 172.8 | 0 | 0 | 0 | 113 | Y167 Q168 Q169 | Y167-L171 HydrophobicContact CD1-CD1 4.03Å; Y167-L171 HydrophobicContact CE1-CD1 3.45Å; Y167-L171 VanDerWaalsContact CE1-CD1 3.45Å; Y167-L171 HydrophobicContact CE1-CG 4.21Å; Y167-L171 PolarHBondContact O-N 3.16Å; Q168-L171 PolarHBondContact O-N 3.05Å; Q169-L171 VanDerWaalsContact C-N 3.26Å; Q169-L171 PolarHBondContact O-N 3.03Å |
| 172 | E | 62.5 | Low | 70 | Confident | 99 Ų | 99 | 104.1 Ų | 104.1 | 46% | 0.463 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -82.8 | -42.8 | 177.1 | -66.7 | 173.8 | -179.6 | 0 | 0 | 110.9 | Q168 Q169 H170 D174 G175 E176 | Q168-E172 PolarHBondContact O-N 3.43Å; Q169-E172 WeakPolarHBondContact O-CB 3.44Å; Q169-E172 PolarHBondContact O-N 2.79Å; H170-E172 VanDerWaalsContact C-N 3.26Å; H170-E172 PolarHBondContact O-N 3.02Å; E172-D174 PolarHBondContact O-N 3.47Å; E172-G175 PolarHBondContact O-N 3.1Å; E172-E176 VanDerWaalsContact O-CB 3.26Å; E172-E176 WeakPolarHBondContact O-CB 3.38Å; E172-E176 VanDerWaalsContact O-CG 3.27Å; E172-E176 WeakPolarHBondContact O-CG 3.44Å; E172-E176 PolarHBondContact O-N 3.32Å |
| 173 | E | 58.7 | Low | 70.1 | Confident | 116 Ų | 116 | 104.2 Ų | 104.2 | 54% | 0.542 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65.2 | -39.3 | -176.9 | -78.1 | 179.7 | 162.5 | 0 | 0 | 114.2 | Q169 G175 E177 | Q169-E173 PolarHBondContact O-N 3.35Å; Q169-E173 VanDerWaalsContact O-N 3.16Å; E173-G175 VanDerWaalsContact C-N 3.29Å; E173-G175 PolarHBondContact O-N 3.06Å; E173-E177 PolarHBondContact O-N 3.43Å |
| 174 | D | 55.6 | Low | 70.5 | Confident | 147 Ų | 147 | 106 Ų | 106 | 79% | 0.786 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -71.1 | -21.5 | -178 | -82.1 | -24.6 | 0 | 0 | 0 | 113.7 | E172 | E172-D174 PolarHBondContact O-N 3.47Å |
| 175 | G | 55.9 | Low | 70.7 | Confident | 35 Ų | 35 | 106.4 Ų | 106.4 | 36% | 0.361 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -98.8 | -38.9 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | E172 E173 L179 | E172-G175 PolarHBondContact O-N 3.1Å; E173-G175 VanDerWaalsContact C-N 3.29Å; E173-G175 PolarHBondContact O-N 3.06Å; G175-L179 WeakPolarHBondContact O-CB 3.33Å; G175-L179 WeakPolarHBondContact O-CD1 3.47Å; G175-L179 VanDerWaalsContact O-CG 3.3Å; G175-L179 WeakPolarHBondContact O-CG 3.49Å; G175-L179 PolarHBondContact O-N 3.31Å |
| 176 | E | 58.8 | Low | 70.9 | Confident | 116 Ų | 116 | 104.1 Ų | 104.1 | 54% | 0.542 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -82.4 | -33.9 | -169.5 | -67.7 | -167.3 | 173.2 | 0 | 0 | 113.5 | E172 S180 | E172-E176 VanDerWaalsContact O-CB 3.26Å; E172-E176 WeakPolarHBondContact O-CB 3.38Å; E172-E176 VanDerWaalsContact O-CG 3.27Å; E172-E176 WeakPolarHBondContact O-CG 3.44Å; E172-E176 PolarHBondContact O-N 3.32Å; E176-S180 WeakPolarHBondContact O-CB 3.36Å; E176-S180 PolarHBondContact O-N 3.31Å; E176-S180 PolarHBondContact O-OG 2.98Å |
| 177 | E | 63.3 | Low | 71 | Confident | 126 Ų | 126 | 107.5 Ų | 107.5 | 59% | 0.589 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -66.1 | -42.6 | 178 | -75.4 | -163.6 | 155.1 | 0 | 0 | 111.7 | E173 S180 Q181 | E173-E177 PolarHBondContact O-N 3.43Å; E177-S180 PolarHBondContact O-N 2.97Å; E177-Q181 WeakPolarHBondContact O-CB 3.48Å; E177-Q181 WeakPolarHBondContact O-CG 3.37Å; E177-Q181 PolarHBondContact O-N 2.7Å |
| 178 | S | 67.8 | Low | 71.2 | Confident | 83 Ų | 83 | 103.4 Ų | 103.4 | 58% | 0.58 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -67.1 | -41.4 | 179.2 | -169.1 | 0 | 0 | 0 | 0 | 111.8 | F182 | S178-F182 WeakPolarHBondContact O-CB 3.45Å; S178-F182 PolarHBondContact O-N 3.29Å |
| 179 | L | 69.4 | Low | 70.7 | Confident | 104 Ų | 104 | 105.6 Ų | 105.6 | 55% | 0.545 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -67.5 | -39.9 | 173.9 | -74.7 | 172.2 | 0 | 0 | 0 | 112.1 | G175 F182 L183 | G175-L179 WeakPolarHBondContact O-CB 3.33Å; G175-L179 WeakPolarHBondContact O-CD1 3.47Å; G175-L179 VanDerWaalsContact O-CG 3.3Å; G175-L179 WeakPolarHBondContact O-CG 3.49Å; G175-L179 PolarHBondContact O-N 3.31Å; L179-F182 PolarHBondContact O-N 3.34Å; L179-L183 WeakPolarHBondContact O-CB 3.47Å; L179-L183 VanDerWaalsContact O-CG 3.25Å; L179-L183 WeakPolarHBondContact O-CG 3.43Å; L179-L183 PolarHBondContact O-N 3.12Å |
| 180 | S | 75.4 | Confident | 70.3 | Confident | 64 Ų | 64 | 104.6 Ų | 104.6 | 45% | 0.448 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -65.8 | -41.7 | 178.3 | -63.6 | 0 | 0 | 0 | 0 | 111.6 | E176 E177 T184 | E176-S180 WeakPolarHBondContact O-CB 3.36Å; E176-S180 PolarHBondContact O-N 3.31Å; E176-S180 PolarHBondContact O-OG 2.98Å; E177-S180 PolarHBondContact O-N 2.97Å; S180-T184 VanDerWaalsContact O-CB 3.28Å; S180-T184 WeakPolarHBondContact O-CB 3.36Å; S180-T184 PolarHBondContact O-N 3.36Å; S180-T184 PolarHBondContact O-OG1 3.29Å |
| 181 | Q | 78.9 | Confident | 70.1 | Confident | 128 Ų | 128 | 107.1 Ų | 107.1 | 60% | 0.598 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -62.7 | -44 | 173.9 | -72.8 | 173.6 | 33.5 | 0 | 0 | 111.5 | E177 T184 Q185 | E177-Q181 WeakPolarHBondContact O-CB 3.48Å; E177-Q181 WeakPolarHBondContact O-CG 3.37Å; E177-Q181 PolarHBondContact O-N 2.7Å; Q181-T184 PolarHBondContact O-N 3.06Å; Q181-Q185 WeakPolarHBondContact O-CB 3.48Å; Q181-Q185 PolarHBondContact O-N 3.33Å |
| 182 | F | 78.8 | Confident | 69.8 | Low | 120 Ų | 120 | 110.4 Ų | 110.4 | 53% | 0.526 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -66.1 | -44.4 | 177.9 | -178.6 | -108.6 | 0 | 0 | 0 | 113.1 | S178 L179 T184 Q185 I186 | S178-F182 WeakPolarHBondContact O-CB 3.45Å; S178-F182 PolarHBondContact O-N 3.29Å; L179-F182 PolarHBondContact O-N 3.34Å; F182-T184 VanDerWaalsContact C-N 3.33Å; F182-T184 PolarHBondContact O-N 3.44Å; F182-Q185 WeakPolarHBondContact O-CB 3.48Å; F182-Q185 PolarHBondContact O-N 3.12Å; F182-I186 HydrophobicContact CD1-CD1 3.77Å; F182-I186 HydrophobicContact CE1-CD1 3.29Å; F182-I186 HydrophobicContact CE1-CG1 4.35Å; F182-I186 HydrophobicContact CE2-CD1 4.26Å; F182-I186 HydrophobicContact CG-CD1 4.45Å; F182-I186 HydrophobicContact CZ-CD1 3.58Å; F182-I186 HydrophobicContact CZ-CG1 4.31Å; F182-I186 WeakPolarHBondContact O-CG1 3.14Å; F182-I186 PolarHBondContact O-N 3.32Å |
| 183 | L | 81.3 | Confident | 69.2 | Low | 103 Ų | 103 | 114.1 Ų | 114.1 | 54% | 0.539 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -64.3 | -39.1 | 176.6 | -72.4 | 174.2 | 0 | 0 | 0 | 111.7 | L179 Q185 I186 H187 | L179-L183 WeakPolarHBondContact O-CB 3.47Å; L179-L183 VanDerWaalsContact O-CG 3.25Å; L179-L183 WeakPolarHBondContact O-CG 3.43Å; L179-L183 PolarHBondContact O-N 3.12Å; L183-Q185 VanDerWaalsContact C-N 3.32Å; L183-I186 PolarHBondContact O-N 3.41Å; L183-H187 PolarHBondContact O-N 2.83Å |
| 184 | T | 82.1 | Confident | 69.7 | Low | 97 Ų | 97 | 114 Ų | 114 | 60% | 0.595 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -62.7 | -41.2 | 173.8 | -57.7 | 0 | 0 | 0 | 0 | 111.1 | S180 Q181 F182 H187 S188 | S180-T184 VanDerWaalsContact O-CB 3.28Å; S180-T184 WeakPolarHBondContact O-CB 3.36Å; S180-T184 PolarHBondContact O-N 3.36Å; S180-T184 PolarHBondContact O-OG1 3.29Å; Q181-T184 PolarHBondContact O-N 3.06Å; F182-T184 VanDerWaalsContact C-N 3.33Å; F182-T184 PolarHBondContact O-N 3.44Å; T184-H187 PolarHBondContact O-N 3.46Å; T184-S188 PolarHBondContact O-N 2.95Å |
| 185 | Q | 82.3 | Confident | 70.4 | Confident | 124 Ų | 124 | 112.3 Ų | 112.3 | 58% | 0.579 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -68 | -33.9 | 177.9 | -172.1 | 168.1 | 10.7 | 0 | 0 | 113.3 | Q181 F182 L183 S188 F189 | Q181-Q185 WeakPolarHBondContact O-CB 3.48Å; Q181-Q185 PolarHBondContact O-N 3.33Å; F182-Q185 WeakPolarHBondContact O-CB 3.48Å; F182-Q185 PolarHBondContact O-N 3.12Å; L183-Q185 VanDerWaalsContact C-N 3.32Å; Q185-S188 PolarHBondContact O-OG 2.98Å; Q185-F189 PolarHBondContact O-N 2.95Å |
| 186 | I | 84 | Confident | 71.2 | Confident | 75 Ų | 75 | 116.6 Ų | 116.6 | 39% | 0.385 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -68.1 | -40.8 | 171.9 | -69.7 | 169.8 | 0 | 0 | 0 | 110.8 | F182 L183 F189 S190 | F182-I186 HydrophobicContact CD1-CD1 3.77Å; F182-I186 HydrophobicContact CE1-CD1 3.29Å; F182-I186 HydrophobicContact CE1-CG1 4.35Å; F182-I186 HydrophobicContact CE2-CD1 4.26Å; F182-I186 HydrophobicContact CG-CD1 4.45Å; F182-I186 HydrophobicContact CZ-CD1 3.58Å; F182-I186 HydrophobicContact CZ-CG1 4.31Å; F182-I186 WeakPolarHBondContact O-CG1 3.14Å; F182-I186 PolarHBondContact O-N 3.32Å; L183-I186 PolarHBondContact O-N 3.41Å; I186-F189 PolarHBondContact O-N 3.26Å; I186-S190 PolarHBondContact O-N 3.37Å; I186-S190 PolarHBondContact O-OG 3.44Å |
| 187 | H | 76.9 | Confident | 72 | Confident | 130 Ų | 130 | 116.6 Ų | 116.6 | 60% | 0.602 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -68.8 | -32 | -179.3 | -106.6 | -86.9 | 0 | 0 | 0 | 113.4 | L183 T184 | L183-H187 PolarHBondContact O-N 2.83Å; T184-H187 PolarHBondContact O-N 3.46Å |
| 188 | S | 80 | Confident | 72.5 | Confident | 62 Ų | 62 | 116 Ų | 116 | 43% | 0.434 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -69 | -41.6 | 173.1 | 64.8 | 0 | 0 | 0 | 0 | 111.6 | T184 Q185 S190 Q191 | T184-S188 PolarHBondContact O-N 2.95Å; Q185-S188 PolarHBondContact O-OG 2.98Å; S188-S190 PolarHBondContact O-N 3.32Å; S188-Q191 PolarHBondContact O-N 3.13Å |
| 189 | F | 68.8 | Low | 72.8 | Confident | 167 Ų | 167 | 118.2 Ų | 118.2 | 73% | 0.732 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -62.6 | -29.8 | 177.1 | -119.9 | -85.7 | 0 | 0 | 0 | 113.3 | Q185 I186 | Q185-F189 PolarHBondContact O-N 2.95Å; I186-F189 PolarHBondContact O-N 3.26Å |
| 190 | S | 66.2 | Low | 73.1 | Confident | 85 Ų | 85 | 119.2 Ų | 119.2 | 59% | 0.594 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.4 | -12.3 | -178.5 | -56.9 | 0 | 0 | 0 | 0 | 113.9 | I186 S188 | I186-S190 PolarHBondContact O-N 3.37Å; I186-S190 PolarHBondContact O-OG 3.44Å; S188-S190 PolarHBondContact O-N 3.32Å |
| 191 | Q | 61.3 | Low | 72.9 | Confident | 162 Ų | 162 | 123.5 Ų | 123.5 | 76% | 0.757 | 65% | 0.646 | S | S | * | * | S | Bend | trans | -96 | -4.1 | 178.9 | -83.7 | -174.9 | 89.7 | 0 | 0 | 113.8 | S188 | S188-Q191 PolarHBondContact O-N 3.13Š|
| 192 | E | 57.8 | Low | 72.4 | Confident | 176 Ų | 176 | 123.1 Ų | 123.1 | 82% | 0.822 | 65% | 0.65 | S | S | * | * | trans | -109.9 | 20.5 | -175.2 | -143.1 | 167.8 | 156.1 | 0 | 0 | 113.6 | ||||
| 193 | S | 49.4 | Very low | 71.8 | Confident | 176 Ų | 176 | 123.4 Ų | 123.4 | 100% | 1.231 | 66% | 0.661 | S | S | * | * | trans | -126.5 | 0 | 169.4 | -72.7 | 0 | 0 | 0 | 0 | 111.1 |
Retrieved 193 of 193 residues in 231.7 ms
(Link to these results)