| 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 | 36.7 | Very low | 47 | Very low | 251 Ų | 251 | 159.9 Ų | 159.9 | 100% | 1.236 | 83% | 0.826 | S | S | * | * | 0 | 126.2 | 0 | -80 | 175.7 | 154.4 | 0 | 0 | 107.6 | |||||
| 2 | L | 47.5 | Very low | 47.6 | Very low | 162 Ų | 162 | 154.6 Ų | 154.6 | 85% | 0.848 | 81% | 0.809 | S | S | * | * | trans | -71.3 | 149 | 178.5 | -67.7 | 154.6 | 0 | 0 | 0 | 110.4 | ||||
| 3 | N | 37.5 | Very low | 48.2 | Very low | 151 Ų | 151 | 152.1 Ų | 152.1 | 81% | 0.807 | 81% | 0.808 | S | S | * | * | -178 | 113.8 | 127.9 | -90.8 | -2.2 | 0 | 0 | 0 | 106.8 | |||||
| 4 | S | 45.2 | Very low | 48.2 | Very low | 87 Ų | 87 | 150.2 Ų | 150.2 | 61% | 0.608 | 81% | 0.806 | S | S | * | * | 92 | 110.5 | 66.6 | -72.6 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 5 | E | 47.3 | Very low | 48.1 | Very low | 160 Ų | 160 | 151.5 Ų | 151.5 | 75% | 0.748 | 80% | 0.804 | S | S | * | * | trans | 63.9 | 107.2 | 138.3 | -58.2 | 178.5 | 109.4 | 0 | 0 | 118.9 | ||||
| 6 | Q | 51.1 | Low | 47.8 | Very low | 199 Ų | 199 | 148.8 Ų | 148.8 | 93% | 0.93 | 80% | 0.801 | S | S | * | * | -144.8 | 103.5 | 124.3 | -112.7 | 133.2 | 38 | 0 | 0 | 111.1 | E8 | Q6-E8 PolarHBondContact O-N 2.96Š| |||
| 7 | T | 52 | Low | 47.4 | Very low | 112 Ų | 112 | 150.2 Ų | 150.2 | 69% | 0.687 | 80% | 0.801 | S | S | * | * | trans | -60.9 | 111.3 | 157.5 | 38.9 | 0 | 0 | 0 | 0 | 109 | ||||
| 8 | E | 50.7 | Low | 47.3 | Very low | 200 Ų | 200 | 147.8 Ų | 147.8 | 94% | 0.935 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -91.5 | 119 | 164.7 | -147.8 | -179.8 | -174.1 | 0 | 0 | 108.7 | Q6 | Q6-E8 PolarHBondContact O-N 2.96Š|
| 9 | I | 54.5 | Low | 47.2 | Very low | 137 Ų | 137 | 150 Ų | 150 | 70% | 0.703 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -82.3 | 134.4 | -171 | -74.1 | 159.5 | 0 | 0 | 0 | 109.1 | ||
| 10 | D | 43.9 | Very low | 47.1 | Very low | 147 Ų | 147 | 147.9 Ų | 147.9 | 79% | 0.786 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 130.7 | 172.4 | -164.6 | 23.2 | 0 | 0 | 0 | 111.3 | ||
| 11 | L | 51.1 | Low | 46.9 | Very low | 153 Ų | 153 | 147 Ų | 147 | 80% | 0.801 | 80% | 0.8 | S | S | * | * | trans | -125.3 | 120.4 | 166.8 | -128.9 | 80.7 | 0 | 0 | 0 | 109.4 | ||||
| 12 | P | 54.5 | Low | 47.1 | Very low | 96 Ų | 96 | 145.3 Ų | 145.3 | 62% | 0.623 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -75.1 | 147.2 | -179 | 30.2 | -34.4 | 0 | 0 | 0 | 111.2 | T14 | P12-T14 PolarHBondContact O-N 3.03Š|
| 13 | P | 55.3 | Low | 46.9 | Very low | 122 Ų | 122 | 142.5 Ų | 142.5 | 79% | 0.792 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 126 | 168.7 | 27.5 | -31.4 | 0 | 0 | 0 | 109.4 | H15 | P13-H15 PolarHBondContact O-N 3.48Š|
| 14 | T | 48.4 | Very low | 47 | Very low | 126 Ų | 126 | 142.4 Ų | 142.4 | 77% | 0.773 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -61.6 | 129.7 | 179.4 | 47.3 | 0 | 0 | 0 | 0 | 111 | P12 S16 | P12-T14 PolarHBondContact O-N 3.03Å; T14-S16 PolarHBondContact O-N 3.36Å |
| 15 | H | 46.1 | Very low | 47 | Very low | 170 Ų | 170 | 144.1 Ų | 144.1 | 79% | 0.787 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -61 | 119.1 | 163.8 | -81.2 | -114.7 | 0 | 0 | 0 | 109 | P13 | P13-H15 PolarHBondContact O-N 3.48Š|
| 16 | S | 43.8 | Very low | 46.6 | Very low | 107 Ų | 107 | 139.2 Ų | 139.2 | 75% | 0.748 | 78% | 0.782 | S | S | * | * | trans | -119.6 | 91.8 | 155.9 | -65.3 | 0 | 0 | 0 | 0 | 106.8 | T14 S18 | T14-S16 PolarHBondContact O-N 3.36Å; S16-S18 PolarHBondContact O-N 3.13Å | ||
| 17 | E | 40.3 | Very low | 46.1 | Very low | 173 Ų | 173 | 133.9 Ų | 133.9 | 81% | 0.808 | 78% | 0.781 | S | S | * | * | trans | -63.3 | 116.8 | 169.1 | -61.8 | -174.5 | 129.7 | 0 | 0 | 108.2 | ||||
| 18 | S | 45.3 | Very low | 45.3 | Very low | 107 Ų | 107 | 132.4 Ų | 132.4 | 75% | 0.748 | 79% | 0.788 | S | S | * | * | trans | -111.7 | 97.6 | 155.5 | 42.5 | 0 | 0 | 0 | 0 | 106.4 | S16 S20 | S16-S18 PolarHBondContact O-N 3.13Å; S18-S20 PolarHBondContact O-N 3.48Å | ||
| 19 | E | 45.7 | Very low | 44.5 | Very low | 190 Ų | 190 | 126.8 Ų | 126.8 | 89% | 0.888 | 78% | 0.784 | S | S | * | * | trans | -54.1 | 119.1 | 165.5 | -62.7 | -148 | 121 | 0 | 0 | 108.8 | ||||
| 20 | S | 45.2 | Very low | 43.4 | Very low | 108 Ų | 108 | 123.7 Ų | 123.7 | 76% | 0.755 | 79% | 0.786 | S | S | * | * | trans | -137.9 | 90 | 158.7 | 52.4 | 0 | 0 | 0 | 0 | 107.9 | S18 | S18-S20 PolarHBondContact O-N 3.48Š| ||
| 21 | V | 42.9 | Very low | 43 | Very low | 130 Ų | 130 | 128.3 Ų | 128.3 | 79% | 0.788 | 79% | 0.792 | S | S | * | * | trans | 21.4 | 109.8 | 143.5 | -172.4 | 0 | 0 | 0 | 0 | 114.2 | S23 | V21-S23 VanDerWaalsContact C-N 3.29Å; V21-S23 PolarHBondContact O-N 3.23Å | ||
| 22 | F | 41.2 | Very low | 42.2 | Very low | 215 Ų | 215 | 126 Ų | 126 | 94% | 0.943 | 80% | 0.795 | S | S | * | * | trans | -48.9 | 94.2 | 160.7 | -89.9 | -99.2 | 0 | 0 | 0 | 109.7 | D24 | F22-D24 PolarHBondContact O-N 3.46Š| ||
| 23 | S | 42.4 | Very low | 41 | Very low | 102 Ų | 102 | 125.2 Ų | 125.2 | 71% | 0.713 | 81% | 0.805 | S | S | * | * | trans | -83.9 | 95.1 | 169.8 | -155.3 | 0 | 0 | 0 | 0 | 107.2 | V21 C25 | V21-S23 VanDerWaalsContact C-N 3.29Å; V21-S23 PolarHBondContact O-N 3.23Å; S23-C25 VanDerWaalsContact C-N 3.34Å; S23-C25 PolarHBondContact O-N 2.97Å; S23-C25 PolarHBondContact O-SG 3.09Å | ||
| 24 | D | 40.1 | Very low | 40 | Very low | 149 Ų | 149 | 125 Ų | 125 | 80% | 0.797 | 81% | 0.806 | S | S | * | * | trans | -55.9 | 95.2 | 165 | -178.8 | 31.3 | 0 | 0 | 0 | 108.9 | F22 G26 | F22-D24 PolarHBondContact O-N 3.46Å; D24-G26 PolarHBondContact O-N 3.46Å; D24-G26 VanDerWaalsContact O-N 3.13Å | ||
| 25 | C | 45.6 | Very low | 39.4 | Very low | 123 Ų | 123 | 126 Ų | 126 | 83% | 0.831 | 81% | 0.812 | S | S | * | * | trans | -87.9 | 74.4 | 169.1 | 24.9 | 0 | 0 | 0 | 0 | 108.3 | S23 | S23-C25 VanDerWaalsContact C-N 3.34Å; S23-C25 PolarHBondContact O-N 2.97Å; S23-C25 PolarHBondContact O-SG 3.09Å | ||
| 26 | G | 38 | Very low | 38.9 | Very low | 57 Ų | 57 | 127 Ų | 127 | 59% | 0.588 | 82% | 0.816 | S | S | * | * | trans | -51.6 | 143.6 | 162.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | D24 | D24-G26 PolarHBondContact O-N 3.46Å; D24-G26 VanDerWaalsContact O-N 3.13Å | ||
| 27 | G | 41.7 | Very low | 38.2 | Very low | 88 Ų | 88 | 130 Ų | 130 | 91% | 0.907 | 82% | 0.824 | S | S | * | * | trans | -72 | 148.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 28 | G | 34.3 | Very low | 38.3 | Very low | 80 Ų | 80 | 125.6 Ų | 125.6 | 83% | 0.825 | 82% | 0.817 | S | S | * | * | trans | 162.9 | 128 | 168.1 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 29 | G | 34.3 | Very low | 37.9 | Very low | 83 Ų | 83 | 126.7 Ų | 126.7 | 86% | 0.856 | 83% | 0.825 | S | S | * | * | cis | 108.3 | 81 | 30.3 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 30 | G | 31.3 | Very low | 37.3 | Very low | 72 Ų | 72 | 121.4 Ų | 121.4 | 74% | 0.742 | 82% | 0.822 | S | S | * | * | trans | 80.6 | 127.1 | 144.6 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 31 | R | 35.4 | Very low | 37.3 | Very low | 244 Ų | 244 | 125 Ų | 125 | 92% | 0.921 | 83% | 0.83 | S | S | * | * | trans | 80.9 | 115.4 | 134 | -66.5 | 176.6 | 80.9 | -167.1 | 5.1 | 121.3 | ||||
| 32 | A | 34 | Very low | 37 | Very low | 104 Ų | 104 | 122.3 Ų | 122.3 | 86% | 0.86 | 83% | 0.829 | S | S | * | * | 67.7 | 130 | 120.1 | 0 | 0 | 0 | 0 | 0 | 121.3 | |||||
| 33 | G | 29.3 | Very low | 37.3 | Very low | 80 Ų | 80 | 120.8 Ų | 120.8 | 83% | 0.825 | 83% | 0.83 | S | S | * | * | trans | 170.1 | 99 | 158.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 34 | S | 34.6 | Very low | 37.1 | Very low | 117 Ų | 117 | 120.7 Ų | 120.7 | 82% | 0.818 | 83% | 0.828 | S | S | * | * | trans | -66.2 | 146.9 | 169.3 | -55.4 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 35 | V | 36.8 | Very low | 37.5 | Very low | 148 Ų | 148 | 117.5 Ų | 117.5 | 90% | 0.897 | 83% | 0.83 | S | S | * | * | trans | -157.2 | 137.8 | 130.8 | -85.5 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 36 | E | 34.1 | Very low | 37.5 | Very low | 189 Ų | 189 | 119.1 Ų | 119.1 | 88% | 0.883 | 83% | 0.826 | S | S | * | * | trans | -81.4 | 147.2 | -175.2 | -53 | 173.8 | 145.1 | 0 | 0 | 109.7 | ||||
| 37 | D | 30.9 | Very low | 37.8 | Very low | 171 Ų | 171 | 122 Ų | 122 | 91% | 0.914 | 84% | 0.836 | S | S | * | * | trans | -156.8 | 149.1 | 130.4 | -133.2 | -32 | 0 | 0 | 0 | 112.1 | ||||
| 38 | A | 42.4 | Very low | 37.7 | Very low | 80 Ų | 80 | 129.1 Ų | 129.1 | 66% | 0.661 | 84% | 0.836 | S | S | * | * | trans | -97.5 | 168.2 | -159.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 39 | S | 35.5 | Very low | 38.4 | Very low | 131 Ų | 131 | 132.2 Ų | 132.2 | 92% | 0.916 | 83% | 0.832 | S | S | * | * | trans | 103.6 | 112.9 | 156.5 | -51.7 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 40 | G | 34.3 | Very low | 39.1 | Very low | 79 Ų | 79 | 132.5 Ų | 132.5 | 81% | 0.814 | 83% | 0.827 | S | S | * | * | trans | 179.3 | 91.1 | 171.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 41 | I | 44.4 | Very low | 40 | Very low | 183 Ų | 183 | 136.6 Ų | 136.6 | 94% | 0.938 | 83% | 0.826 | S | S | * | * | trans | -66 | 128.2 | 177.6 | -28.3 | 172.9 | 0 | 0 | 0 | 108.8 | ||||
| 42 | G | 36.7 | Very low | 40.7 | Very low | 73 Ų | 73 | 130.3 Ų | 130.3 | 75% | 0.753 | 82% | 0.817 | S | S | * | * | trans | -170.4 | 89.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113 | C44 | G42-C44 PolarHBondContact O-N 3.22Š| ||
| 43 | L | 46.9 | Very low | 41.6 | Very low | 184 Ų | 184 | 127.3 Ų | 127.3 | 96% | 0.963 | 80% | 0.796 | S | S | * | * | trans | -73.6 | 114.8 | 166.5 | -78.5 | 156.6 | 0 | 0 | 0 | 109.4 | ||||
| 44 | C | 37.7 | Very low | 42.5 | Very low | 100 Ų | 100 | 129.1 Ų | 129.1 | 68% | 0.676 | 78% | 0.783 | S | S | * | * | trans | -160.8 | 116.8 | 151.8 | -169.6 | 0 | 0 | 0 | 0 | 108.7 | G42 Q46 | G42-C44 PolarHBondContact O-N 3.22Å; C44-Q46 PolarHBondContact O-N 3Å | ||
| 45 | G | 49.7 | Very low | 43.1 | Very low | 82 Ų | 82 | 126.9 Ų | 126.9 | 85% | 0.845 | 77% | 0.772 | S | S | * | * | trans | -63.4 | 106.6 | -178.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 46 | Q | 44.4 | Very low | 43.9 | Very low | 157 Ų | 157 | 126.9 Ų | 126.9 | 73% | 0.734 | 76% | 0.764 | S | S | * | * | trans | -103.1 | 114.2 | 166.8 | -85.4 | 149 | 58.4 | 0 | 0 | 108.7 | C44 R48 | C44-Q46 PolarHBondContact O-N 3Å; Q46-R48 PolarHBondContact O-N 3.19Å | ||
| 47 | S | 44.3 | Very low | 44.7 | Very low | 116 Ų | 116 | 123.6 Ų | 123.6 | 81% | 0.811 | 75% | 0.747 | S | S | * | * | trans | -52.7 | 99.4 | 166.2 | -50.2 | 0 | 0 | 0 | 0 | 108.8 | I49 | S47-I49 PolarHBondContact O-N 3.12Š| ||
| 48 | R | 41.3 | Very low | 45.7 | Very low | 238 Ų | 238 | 122.7 Ų | 122.7 | 90% | 0.898 | 73% | 0.734 | S | S | * | * | trans | -68.9 | 96.6 | 175.5 | -71.3 | -168.2 | -92.2 | -151.1 | -3.9 | 108.5 | Q46 A50 | Q46-R48 PolarHBondContact O-N 3.19Å; R48-A50 PolarHBondContact O-N 3.46Å; R48-A50 VanDerWaalsContact O-N 3.15Å | ||
| 49 | I | 49 | Very low | 46.5 | Very low | 145 Ų | 145 | 124.1 Ų | 124.1 | 74% | 0.744 | 73% | 0.731 | S | S | * | * | trans | -63.3 | 111.8 | 157.8 | -59.6 | 179.3 | 0 | 0 | 0 | 105.2 | S47 E51 | S47-I49 PolarHBondContact O-N 3.12Å; I49-E51 PolarHBondContact O-N 3.48Å | ||
| 50 | A | 48 | Very low | 47.7 | Very low | 90 Ų | 90 | 121.5 Ų | 121.5 | 74% | 0.744 | 71% | 0.706 | S | S | * | * | trans | -67.8 | 104.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 108.5 | R48 P52 | R48-A50 PolarHBondContact O-N 3.46Å; R48-A50 VanDerWaalsContact O-N 3.15Å; A50-P52 WeakPolarHBondContact O-CD 3.27Å | ||
| 51 | E | 50.9 | Low | 49.1 | Very low | 157 Ų | 157 | 125.1 Ų | 125.1 | 73% | 0.734 | 70% | 0.702 | S | S | * | * | trans | -58.9 | 118.3 | 172.9 | -74 | -67.9 | 118.9 | 0 | 0 | 109.9 | I49 G53 | I49-E51 PolarHBondContact O-N 3.48Å; E51-G53 PolarHBondContact O-N 3.28Å | ||
| 52 | P | 50.6 | Low | 50.6 | Low | 112 Ų | 112 | 125.2 Ų | 125.2 | 73% | 0.727 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.1 | 14.7 | -176.9 | 31 | -33 | 0 | 0 | 0 | 113.4 | A50 E54 | A50-P52 WeakPolarHBondContact O-CD 3.27Å; P52-E54 PolarHBondContact O-N 2.93Å |
| 53 | G | 52.8 | Low | 52.7 | Low | 41 Ų | 41 | 123.4 Ų | 123.4 | 42% | 0.423 | 67% | 0.671 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -78.2 | -16.6 | -170.7 | 0 | 0 | 0 | 0 | 0 | 116 | E51 | E51-G53 PolarHBondContact O-N 3.28Š|
| 54 | E | 47.7 | Very low | 54.7 | Low | 119 Ų | 119 | 118.6 Ų | 118.6 | 56% | 0.556 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.7 | -23.8 | -173 | -77.8 | -63.9 | 122.9 | 0 | 0 | 114.1 | P52 K57 | P52-E54 PolarHBondContact O-N 2.93Å; E54-K57 IonicContact OE1-NZ 2.66Å; E54-K57 PolarHBondContact OE1-NZ 3.27Å |
| 55 | A | 47.2 | Very low | 57.1 | Low | 69 Ų | 69 | 122.5 Ų | 122.5 | 57% | 0.57 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -71.5 | -39.2 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | K57 K58 | A55-K57 VanDerWaalsContact C-N 3.27Å; A55-K57 PolarHBondContact O-N 3.39Å; A55-K58 PolarHBondContact O-N 2.92Å |
| 56 | M | 53.6 | Low | 59 | Low | 149 Ų | 149 | 123.4 Ų | 123.4 | 73% | 0.734 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -71 | -20.5 | -173.5 | -159 | 175.9 | 167.3 | 0 | 0 | 113.6 | ||
| 57 | K | 50.3 | Low | 61.2 | Low | 120 Ų | 120 | 119 Ų | 119 | 52% | 0.522 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -75.7 | -29.8 | 176.8 | -67.1 | 178 | -171.8 | 164.7 | 0 | 112.6 | E54 A55 | E54-K57 IonicContact OE1-NZ 2.66Å; E54-K57 PolarHBondContact OE1-NZ 3.27Å; A55-K57 VanDerWaalsContact C-N 3.27Å; A55-K57 PolarHBondContact O-N 3.39Å |
| 58 | K | 52.4 | Low | 63.4 | Low | 152 Ų | 152 | 119.3 Ų | 119.3 | 66% | 0.661 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -71.5 | -36.2 | -177.8 | -68.3 | -178.9 | 178.9 | 177 | 0 | 111.7 | A55 L60 Q61 | A55-K58 PolarHBondContact O-N 2.92Å; K58-L60 PolarHBondContact O-N 2.96Å; K58-Q61 PolarHBondContact O-N 3.35Å |
| 59 | D | 59.5 | Low | 65.8 | Low | 109 Ų | 109 | 113 Ų | 113 | 58% | 0.583 | 58% | 0.575 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.7 | -19.2 | 179.3 | -65.6 | -21.8 | 0 | 0 | 0 | 114.1 | L63 | D59-L63 VanDerWaalsContact O-CG 3.25Å; D59-L63 WeakPolarHBondContact O-CG 3.3Å |
| 60 | L | 59 | Low | 67.9 | Low | 77 Ų | 77 | 114.4 Ų | 114.4 | 40% | 0.403 | 57% | 0.57 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -81.4 | -18.9 | 178 | -71.9 | 163 | 0 | 0 | 0 | 113.2 | K58 L63 R68 | K58-L60 PolarHBondContact O-N 2.96Å; L60-L63 HydrophobicContact CD2-CD1 3.86Å; L60-R68 PolarHBondContact O-NH2 2.94Å |
| 61 | Q | 65 | Low | 70 | Confident | 155 Ų | 155 | 115.2 Ų | 115.2 | 72% | 0.724 | 55% | 0.554 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.9 | -27.2 | -175.1 | -63.5 | -169 | 3.2 | 0 | 0 | 112.6 | K58 | K58-Q61 PolarHBondContact O-N 3.35Š|
| 62 | H | 76.2 | Confident | 71.9 | Confident | 184 Ų | 184 | 116.3 Ų | 116.3 | 85% | 0.852 | 55% | 0.551 | S | S | * | * | S | Bend | trans | -93.5 | 5.2 | -179.8 | -148.4 | -82.3 | 0 | 0 | 0 | 114.2 | ||
| 63 | L | 79.7 | Confident | 74 | Confident | 35 Ų | 35 | 117 Ų | 117 | 18% | 0.183 | 54% | 0.54 | C | S | . | . | S | Bend | trans | -79.9 | 137.4 | 179.9 | -57.3 | 172.8 | 0 | 0 | 0 | 110.7 | D59 L60 E67 | D59-L63 VanDerWaalsContact O-CG 3.25Å; D59-L63 WeakPolarHBondContact O-CG 3.3Å; L60-L63 HydrophobicContact CD2-CD1 3.86Å; L63-E67 HydrophobicContact CB-CB 4.09Å; L63-E67 HydrophobicContact CB-CG 4.08Å; L63-E67 HydrophobicContact CD1-CG 4.2Å; L63-E67 HydrophobicContact CD2-CG 3.77Å; L63-E67 HydrophobicContact CG-CG 4.21Å |
| 64 | S | 88.8 | Confident | 76 | Confident | 83 Ų | 83 | 118 Ų | 118 | 58% | 0.58 | 54% | 0.544 | S | S | * | . | trans | -50.4 | 148.9 | 165.4 | 174.5 | 0 | 0 | 0 | 0 | 110.6 | E66 E67 R68 | S64-E66 PolarHBondContact O-N 3.36Å; S64-E66 PolarHBondContact OG-N 3.47Å; S64-E67 PolarHBondContact O-N 3.15Å; S64-R68 PolarHBondContact O-N 3.05Å | ||
| 65 | R | 88.8 | Confident | 78.3 | Confident | 183 Ų | 183 | 115.5 Ų | 115.5 | 69% | 0.691 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -49.5 | -36.2 | 175.8 | -175.3 | -179.7 | -177.9 | -167.3 | 2.4 | 111.9 | R69 | R65-R69 WeakPolarHBondContact O-CG 3.39Å; R65-R69 PolarHBondContact O-N 3.36Å |
| 66 | E | 90.3 | Very high | 80.6 | Confident | 100 Ų | 100 | 115 Ų | 115 | 47% | 0.467 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -71.6 | -41.4 | 179.8 | -169.3 | 53.6 | -149.4 | 0 | 0 | 112.5 | S64 R68 R69 R70 | S64-E66 PolarHBondContact O-N 3.36Å; S64-E66 PolarHBondContact OG-N 3.47Å; E66-R68 VanDerWaalsContact C-N 3.32Å; E66-R68 PolarHBondContact O-N 3.28Å; E66-R69 WeakPolarHBondContact O-CB 3.35Å; E66-R69 PolarHBondContact O-N 2.83Å; E66-R69 VanDerWaalsContact O-N 3.11Å; E66-R69 IonicContact OE2-NH1 3.74Å; E66-R70 PolarHBondContact O-N 3.11Å |
| 67 | E | 90.8 | Very high | 82.7 | Confident | 66 Ų | 66 | 116.4 Ų | 116.4 | 31% | 0.308 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -66 | -36.6 | 178 | -176.1 | 54.6 | -145.5 | 0 | 0 | 111.2 | L63 S64 R69 R70 R71 | L63-E67 HydrophobicContact CB-CB 4.09Å; L63-E67 HydrophobicContact CB-CG 4.08Å; L63-E67 HydrophobicContact CD1-CG 4.2Å; L63-E67 HydrophobicContact CD2-CG 3.77Å; L63-E67 HydrophobicContact CG-CG 4.21Å; S64-E67 PolarHBondContact O-N 3.15Å; E67-R69 PolarHBondContact O-N 3.33Å; E67-R70 PolarHBondContact O-N 2.98Å; E67-R71 WeakPolarHBondContact O-CG 3.34Å; E67-R71 PolarHBondContact O-N 3.37Å; E67-R71 IonicContact OE1-NE 3.74Å; E67-R71 PolarHBondContact OE1-NE 3.01Å |
| 68 | R | 89.6 | Confident | 84.9 | Confident | 122 Ų | 122 | 115.4 Ų | 115.4 | 46% | 0.46 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -62.7 | -39.6 | 171.6 | -170.7 | 179.8 | -66.7 | 170 | 2.6 | 112.4 | L60 S64 E66 R72 | L60-R68 PolarHBondContact O-NH2 2.94Å; S64-R68 PolarHBondContact O-N 3.05Å; E66-R68 VanDerWaalsContact C-N 3.32Å; E66-R68 PolarHBondContact O-N 3.28Å; R68-R72 PolarHBondContact O-N 3.46Å; R68-R72 VanDerWaalsContact O-N 3.1Å |
| 69 | R | 90.9 | Very high | 87 | Confident | 106 Ų | 106 | 115 Ų | 115 | 40% | 0.4 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -66.3 | -44.8 | 175.6 | -74.4 | 170.7 | 170 | -177.7 | -4.7 | 111.1 | R65 E66 E67 R72 R73 | R65-R69 WeakPolarHBondContact O-CG 3.39Å; R65-R69 PolarHBondContact O-N 3.36Å; E66-R69 WeakPolarHBondContact O-CB 3.35Å; E66-R69 PolarHBondContact O-N 2.83Å; E66-R69 VanDerWaalsContact O-N 3.11Å; E66-R69 IonicContact OE2-NH1 3.74Å; E67-R69 PolarHBondContact O-N 3.33Å; R69-R72 PolarHBondContact O-N 2.67Å; R69-R73 WeakPolarHBondContact O-CG 3.34Å; R69-R73 PolarHBondContact O-N 3.13Å |
| 70 | R | 93.5 | Very high | 88.9 | Confident | 174 Ų | 174 | 113.9 Ų | 113.9 | 66% | 0.657 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -58.5 | -49.4 | 177.5 | -169.5 | 178.7 | -175.6 | 168.3 | 2 | 111.3 | E66 E67 R72 R73 A74 | E66-R70 PolarHBondContact O-N 3.11Å; E67-R70 PolarHBondContact O-N 2.98Å; R70-R72 PolarHBondContact O-N 3.17Å; R70-R73 PolarHBondContact O-N 2.95Å; R70-A74 WeakPolarHBondContact O-CB 3.28Å; R70-A74 PolarHBondContact O-N 3.41Å |
| 71 | R | 91.8 | Very high | 90.7 | Very high | 106 Ų | 106 | 112.3 Ų | 112.3 | 40% | 0.4 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -59.5 | -44.2 | 176.5 | -71.7 | -172.4 | -172.7 | -167.7 | 3.3 | 112.5 | E67 R73 A74 T75 | E67-R71 WeakPolarHBondContact O-CG 3.34Å; E67-R71 PolarHBondContact O-N 3.37Å; E67-R71 IonicContact OE1-NE 3.74Å; E67-R71 PolarHBondContact OE1-NE 3.01Å; R71-R73 PolarHBondContact O-N 3.33Å; R71-A74 PolarHBondContact O-N 3.4Å; R71-T75 PolarHBondContact O-N 3.16Å |
| 72 | R | 91.9 | Very high | 92.3 | Very high | 180 Ų | 180 | 109.9 Ų | 109.9 | 68% | 0.679 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -59 | -46.9 | 175.1 | -82 | -170.7 | 176 | -137.7 | 0.9 | 112 | R68 R69 R70 A74 T75 Y78 | R68-R72 PolarHBondContact O-N 3.46Å; R68-R72 VanDerWaalsContact O-N 3.1Å; R69-R72 PolarHBondContact O-N 2.67Å; R70-R72 PolarHBondContact O-N 3.17Å; R72-A74 VanDerWaalsContact C-N 3.25Å; R72-A74 PolarHBondContact O-N 3.26Å; R72-T75 WeakPolarHBondContact O-CB 3.38Å; R72-T75 PolarHBondContact O-N 3.29Å; R72-T75 VanDerWaalsContact O-N 3.09Å; R72-T75 PolarHBondContact O-OG1 3.32Å; R72-Y78 WeakPolarHBondContact O-CB 3.42Å |
| 73 | R | 94.7 | Very high | 93.3 | Very high | 128 Ų | 128 | 103.4 Ų | 103.4 | 48% | 0.483 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -64 | -30.4 | 178.3 | -68.9 | 177.4 | 180 | 160.9 | -0.6 | 113 | R69 R70 R71 T75 Y78 | R69-R73 WeakPolarHBondContact O-CG 3.34Å; R69-R73 PolarHBondContact O-N 3.13Å; R70-R73 PolarHBondContact O-N 2.95Å; R71-R73 PolarHBondContact O-N 3.33Å; R73-T75 VanDerWaalsContact C-N 3.27Å; R73-T75 PolarHBondContact O-N 3Å; R73-Y78 HydrophobicContact CB-CD1 4.11Å; R73-Y78 HydrophobicContact CB-CE1 4.08Å; R73-Y78 HydrophobicContact CG-CD1 4.16Å; R73-Y78 HydrophobicContact CG-CE1 3.72Å; R73-Y78 HydrophobicContact CG-CE2 4.2Å |
| 74 | A | 93.9 | Very high | 94.2 | Very high | 62 Ų | 62 | 104.8 Ų | 104.8 | 51% | 0.512 | 50% | 0.495 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.6 | -7.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | R70 R71 R72 R79 | R70-A74 WeakPolarHBondContact O-CB 3.28Å; R70-A74 PolarHBondContact O-N 3.41Å; R71-A74 PolarHBondContact O-N 3.4Å; R72-A74 VanDerWaalsContact C-N 3.25Å; R72-A74 PolarHBondContact O-N 3.26Å; A74-R79 VanDerWaalsContact C-NH1 3.34Å; A74-R79 PolarHBondContact O-NH1 3.19Å |
| 75 | T | 96.1 | Very high | 94.7 | Very high | 65 Ų | 65 | 109.7 Ų | 109.7 | 40% | 0.399 | 50% | 0.501 | S | S | . | . | S | Bend | trans | -71.2 | 142.4 | 173.5 | 64.3 | 0 | 0 | 0 | 0 | 110.9 | R71 R72 R73 K77 Y78 R79 | R71-T75 PolarHBondContact O-N 3.16Å; R72-T75 WeakPolarHBondContact O-CB 3.38Å; R72-T75 PolarHBondContact O-N 3.29Å; R72-T75 VanDerWaalsContact O-N 3.09Å; R72-T75 PolarHBondContact O-OG1 3.32Å; R73-T75 VanDerWaalsContact C-N 3.27Å; R73-T75 PolarHBondContact O-N 3Å; T75-K77 VanDerWaalsContact C-N 3.25Å; T75-K77 PolarHBondContact O-N 2.98Å; T75-Y78 PolarHBondContact O-N 3.48Å; T75-Y78 VanDerWaalsContact OG1-CB 3.32Å; T75-Y78 WeakPolarHBondContact OG1-CB 3.25Å; T75-Y78 PolarHBondContact OG1-N 2.76Å; T75-R79 PolarHBondContact O-N 2.85Å |
| 76 | A | 96.5 | Very high | 95.2 | Very high | 59 Ų | 59 | 104.4 Ų | 104.4 | 49% | 0.488 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -57 | -41.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | Y78 R79 T80 | A76-Y78 VanDerWaalsContact C-N 3.34Å; A76-Y78 PolarHBondContact O-N 3.3Å; A76-R79 PolarHBondContact O-N 3.09Å; A76-R79 VanDerWaalsContact O-N 3.16Å; A76-T80 WeakPolarHBondContact O-CG2 3.47Å; A76-T80 PolarHBondContact O-N 3.1Å; A76-T80 PolarHBondContact O-OG1 2.94Å; A76-T80 VanDerWaalsContact O-OG1 3.12Å |
| 77 | K | 96.3 | Very high | 95.6 | Very high | 179 Ų | 179 | 107.1 Ų | 107.1 | 78% | 0.778 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -55.7 | -43.7 | 177 | -65.1 | -172.4 | 179.3 | -173.9 | 0 | 112.8 | T75 T80 A81 | T75-K77 VanDerWaalsContact C-N 3.25Å; T75-K77 PolarHBondContact O-N 2.98Å; K77-T80 PolarHBondContact O-OG1 3.18Å; K77-T80 VanDerWaalsContact O-OG1 3.1Å; K77-A81 VanDerWaalsContact O-CB 3.26Å; K77-A81 WeakPolarHBondContact O-CB 3.48Å; K77-A81 PolarHBondContact O-N 3.06Å |
| 78 | Y | 97 | Very high | 95.9 | Very high | 99 Ų | 99 | 108.8 Ų | 108.8 | 39% | 0.388 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -66.4 | -45.8 | 177.3 | -177 | -83.1 | 0 | 0 | 0 | 111.4 | R72 R73 T75 A76 A81 H82 | R72-Y78 WeakPolarHBondContact O-CB 3.42Å; R73-Y78 HydrophobicContact CB-CD1 4.11Å; R73-Y78 HydrophobicContact CB-CE1 4.08Å; R73-Y78 HydrophobicContact CG-CD1 4.16Å; R73-Y78 HydrophobicContact CG-CE1 3.72Å; R73-Y78 HydrophobicContact CG-CE2 4.2Å; T75-Y78 PolarHBondContact O-N 3.48Å; T75-Y78 VanDerWaalsContact OG1-CB 3.32Å; T75-Y78 WeakPolarHBondContact OG1-CB 3.25Å; T75-Y78 PolarHBondContact OG1-N 2.76Å; A76-Y78 VanDerWaalsContact C-N 3.34Å; A76-Y78 PolarHBondContact O-N 3.3Å; Y78-A81 PolarHBondContact O-N 3.38Å; Y78-H82 HydrophobicContact CE1-CB 4.43Å; Y78-H82 WeakPolarHBondContact O-CB 3.35Å; Y78-H82 PolarHBondContact O-N 3.33Å |
| 79 | R | 97.3 | Very high | 96.4 | Very high | 142 Ų | 142 | 110 Ų | 110 | 54% | 0.536 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62 | -45.7 | -179.9 | -67.9 | -162.8 | -59.3 | -83.4 | 1.8 | 112.1 | A74 T75 A76 H82 A83 | A74-R79 VanDerWaalsContact C-NH1 3.34Å; A74-R79 PolarHBondContact O-NH1 3.19Å; T75-R79 PolarHBondContact O-N 2.85Å; A76-R79 PolarHBondContact O-N 3.09Å; A76-R79 VanDerWaalsContact O-N 3.16Å; R79-H82 PolarHBondContact O-N 3.45Å; R79-A83 WeakPolarHBondContact O-CB 3.46Å; R79-A83 PolarHBondContact O-N 3.36Å |
| 80 | T | 98.1 | Very high | 96.7 | Very high | 87 Ų | 87 | 107.6 Ų | 107.6 | 53% | 0.534 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65 | -45.7 | 179.1 | 55.2 | 0 | 0 | 0 | 0 | 111.2 | A76 K77 H82 A83 T84 | A76-T80 WeakPolarHBondContact O-CG2 3.47Å; A76-T80 PolarHBondContact O-N 3.1Å; A76-T80 PolarHBondContact O-OG1 2.94Å; A76-T80 VanDerWaalsContact O-OG1 3.12Å; K77-T80 PolarHBondContact O-OG1 3.18Å; K77-T80 VanDerWaalsContact O-OG1 3.1Å; T80-H82 VanDerWaalsContact C-N 3.33Å; T80-H82 PolarHBondContact O-N 3.37Å; T80-A83 PolarHBondContact O-N 3.3Å; T80-T84 PolarHBondContact O-N 3.42Å; T80-T84 PolarHBondContact O-OG1 2.92Å |
| 81 | A | 97.7 | Very high | 97 | Very high | 44 Ų | 44 | 104.5 Ų | 104.5 | 36% | 0.364 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -59.2 | -42.9 | 176 | 0 | 0 | 0 | 0 | 0 | 112.2 | K77 Y78 T84 R85 | K77-A81 VanDerWaalsContact O-CB 3.26Å; K77-A81 WeakPolarHBondContact O-CB 3.48Å; K77-A81 PolarHBondContact O-N 3.06Å; Y78-A81 PolarHBondContact O-N 3.38Å; A81-T84 PolarHBondContact O-N 3.26Å; A81-R85 WeakPolarHBondContact O-CG 3.46Å; A81-R85 PolarHBondContact O-N 3.13Å |
| 82 | H | 97.7 | Very high | 97.3 | Very high | 104 Ų | 104 | 102.1 Ų | 102.1 | 48% | 0.481 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.8 | -44.2 | 176.9 | -170.7 | -73.2 | 0 | 0 | 0 | 112.1 | Y78 R79 T80 T84 R85 E86 | Y78-H82 HydrophobicContact CE1-CB 4.43Å; Y78-H82 WeakPolarHBondContact O-CB 3.35Å; Y78-H82 PolarHBondContact O-N 3.33Å; R79-H82 PolarHBondContact O-N 3.45Å; T80-H82 VanDerWaalsContact C-N 3.33Å; T80-H82 PolarHBondContact O-N 3.37Å; H82-T84 VanDerWaalsContact C-N 3.33Å; H82-T84 PolarHBondContact O-N 2.84Å; H82-R85 PolarHBondContact O-N 3.05Å; H82-E86 PolarHBondContact O-N 3.07Å |
| 83 | A | 98.4 | Very high | 97.6 | Very high | 47 Ų | 47 | 98 Ų | 98 | 39% | 0.388 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61.8 | -41 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | R79 T80 E86 R87 | R79-A83 WeakPolarHBondContact O-CB 3.46Å; R79-A83 PolarHBondContact O-N 3.36Å; T80-A83 PolarHBondContact O-N 3.3Å; A83-E86 PolarHBondContact O-N 3.28Å; A83-R87 WeakPolarHBondContact O-CB 3.47Å; A83-R87 PolarHBondContact O-N 2.93Å |
| 84 | T | 98.6 | Very high | 97.8 | Very high | 65 Ų | 65 | 95.2 Ų | 95.2 | 40% | 0.399 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -63.4 | -45.1 | 175.7 | -64.2 | 0 | 0 | 0 | 0 | 111.8 | T80 A81 H82 E86 R87 I88 | T80-T84 PolarHBondContact O-N 3.42Å; T80-T84 PolarHBondContact O-OG1 2.92Å; A81-T84 PolarHBondContact O-N 3.26Å; H82-T84 VanDerWaalsContact C-N 3.33Å; H82-T84 PolarHBondContact O-N 2.84Å; T84-E86 VanDerWaalsContact C-N 3.32Å; T84-E86 PolarHBondContact O-N 3.29Å; T84-R87 WeakPolarHBondContact O-CB 3.21Å; T84-R87 PolarHBondContact O-N 3.07Å; T84-I88 HydrophobicContact CG2-CD1 4.02Å; T84-I88 WeakPolarHBondContact O-CG1 3.39Å; T84-I88 PolarHBondContact O-N 2.83Å |
| 85 | R | 98.6 | Very high | 98 | Very high | 185 Ų | 185 | 97.8 Ų | 97.8 | 70% | 0.698 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -59.3 | -44.2 | 176.2 | -72.7 | 174.2 | -172.9 | -177.5 | 0.5 | 112.1 | A81 H82 I88 R89 | A81-R85 WeakPolarHBondContact O-CG 3.46Å; A81-R85 PolarHBondContact O-N 3.13Å; H82-R85 PolarHBondContact O-N 3.05Å; R85-I88 PolarHBondContact O-N 3.19Å; R85-R89 PolarHBondContact O-N 3.15Å |
| 86 | E | 98.6 | Very high | 98.1 | Very high | 73 Ų | 73 | 97.6 Ų | 97.6 | 34% | 0.341 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -66.9 | -38.1 | 178.9 | -176.5 | 55.4 | -159.6 | 0 | 0 | 111.9 | H82 A83 T84 I88 R89 V90 | H82-E86 PolarHBondContact O-N 3.07Å; A83-E86 PolarHBondContact O-N 3.28Å; T84-E86 VanDerWaalsContact C-N 3.32Å; T84-E86 PolarHBondContact O-N 3.29Å; E86-I88 PolarHBondContact O-N 3.17Å; E86-R89 WeakPolarHBondContact O-CB 3.44Å; E86-R89 PolarHBondContact O-N 3.38Å; E86-R89 IonicContact OE1-CZ 2.67Å; E86-R89 VanDerWaalsContact OE1-CZ 3.31Å; E86-R89 IonicContact OE1-NE 3.31Å; E86-R89 PolarHBondContact OE1-NE 3.27Å; E86-R89 VanDerWaalsContact OE1-NE 3.17Å; E86-R89 IonicContact OE1-NH2 3.17Å; E86-R89 PolarHBondContact OE1-NH2 3.36Å; E86-R89 IonicContact OE2-CZ 3.01Å; E86-R89 IonicContact OE2-NE 3.71Å; E86-R89 PolarHBondContact OE2-NE 2.97Å; E86-R89 IonicContact OE2-NH2 2.83Å; E86-V90 WeakPolarHBondContact O-CG2 3.33Å; E86-V90 PolarHBondContact O-N 3.42Å; E86-V90 WeakPolarHBondContact OE1-CG2 3.47Å |
| 87 | R | 98.7 | Very high | 98.2 | Very high | 156 Ų | 156 | 96.1 Ų | 96.1 | 59% | 0.589 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -58.3 | -49 | 173.2 | -172.5 | -174.5 | -64.1 | 108.3 | -1.5 | 111.3 | A83 T84 R89 V90 E91 | A83-R87 WeakPolarHBondContact O-CB 3.47Å; A83-R87 PolarHBondContact O-N 2.93Å; T84-R87 WeakPolarHBondContact O-CB 3.21Å; T84-R87 PolarHBondContact O-N 3.07Å; R87-R89 VanDerWaalsContact C-N 3.32Å; R87-R89 PolarHBondContact O-N 3.15Å; R87-V90 PolarHBondContact O-N 3.22Å; R87-E91 WeakPolarHBondContact O-CB 3.29Å; R87-E91 PolarHBondContact O-N 3.48Å |
| 88 | I | 98.7 | Very high | 98.2 | Very high | 101 Ų | 101 | 89.8 Ų | 89.8 | 52% | 0.518 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -59.7 | -44 | 177.8 | -67.1 | 164.8 | 0 | 0 | 0 | 110.6 | T84 R85 E86 V90 E91 A92 | T84-I88 HydrophobicContact CG2-CD1 4.02Å; T84-I88 WeakPolarHBondContact O-CG1 3.39Å; T84-I88 PolarHBondContact O-N 2.83Å; R85-I88 PolarHBondContact O-N 3.19Å; E86-I88 PolarHBondContact O-N 3.17Å; I88-V90 VanDerWaalsContact C-N 3.33Å; I88-V90 PolarHBondContact O-N 2.94Å; I88-E91 PolarHBondContact O-N 2.66Å; I88-A92 WeakPolarHBondContact O-CB 3.33Å; I88-A92 PolarHBondContact O-N 3.43Å |
| 89 | R | 98.7 | Very high | 98.3 | Very high | 148 Ų | 148 | 89.9 Ų | 89.9 | 56% | 0.558 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -59.3 | -44.6 | 177.5 | -167.7 | -170.8 | 74.2 | 81.9 | 1 | 111.8 | R85 E86 R87 F93 | R85-R89 PolarHBondContact O-N 3.15Å; E86-R89 WeakPolarHBondContact O-CB 3.44Å; E86-R89 PolarHBondContact O-N 3.38Å; E86-R89 IonicContact OE1-CZ 2.67Å; E86-R89 VanDerWaalsContact OE1-CZ 3.31Å; E86-R89 IonicContact OE1-NE 3.31Å; E86-R89 PolarHBondContact OE1-NE 3.27Å; E86-R89 VanDerWaalsContact OE1-NE 3.17Å; E86-R89 IonicContact OE1-NH2 3.17Å; E86-R89 PolarHBondContact OE1-NH2 3.36Å; E86-R89 IonicContact OE2-CZ 3.01Å; E86-R89 IonicContact OE2-NE 3.71Å; E86-R89 PolarHBondContact OE2-NE 2.97Å; E86-R89 IonicContact OE2-NH2 2.83Å; R87-R89 VanDerWaalsContact C-N 3.32Å; R87-R89 PolarHBondContact O-N 3.15Å; R89-F93 WeakPolarHBondContact O-CB 3.49Å; R89-F93 PolarHBondContact O-N 3.49Å; R89-F93 VanDerWaalsContact O-N 3.09Å |
| 90 | V | 98.8 | Very high | 98.3 | Very high | 55 Ų | 55 | 85.9 Ų | 85.9 | 33% | 0.333 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -70.5 | -36.7 | 179.1 | 172.1 | 0 | 0 | 0 | 0 | 111.6 | E86 R87 I88 F93 N94 | E86-V90 WeakPolarHBondContact O-CG2 3.33Å; E86-V90 PolarHBondContact O-N 3.42Å; E86-V90 WeakPolarHBondContact OE1-CG2 3.47Å; R87-V90 PolarHBondContact O-N 3.22Å; I88-V90 VanDerWaalsContact C-N 3.33Å; I88-V90 PolarHBondContact O-N 2.94Å; V90-F93 WeakPolarHBondContact O-CB 3.47Å; V90-F93 PolarHBondContact O-N 3.01Å; V90-N94 WeakPolarHBondContact O-CB 3.49Å; V90-N94 PolarHBondContact O-N 3.25Å; V90-N94 PolarHBondContact O-ND2 2.88Å |
| 91 | E | 98.7 | Very high | 98.3 | Very high | 110 Ų | 110 | 84.6 Ų | 84.6 | 51% | 0.514 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -62.2 | -50.6 | 174.5 | -177.1 | 175.3 | -174 | 0 | 0 | 111.2 | R87 I88 F93 N94 M95 | R87-E91 WeakPolarHBondContact O-CB 3.29Å; R87-E91 PolarHBondContact O-N 3.48Å; I88-E91 PolarHBondContact O-N 2.66Å; E91-F93 VanDerWaalsContact C-N 3.27Å; E91-F93 PolarHBondContact O-N 2.84Å; E91-N94 CarbonylContact O-C 3.46Å; E91-N94 PolarHBondContact O-N 3.02Å; E91-M95 WeakPolarHBondContact O-CG 3.36Å; E91-M95 PolarHBondContact O-N 2.88Å |
| 92 | A | 98.6 | Very high | 98.2 | Very high | 56 Ų | 56 | 89.5 Ų | 89.5 | 46% | 0.463 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -56.8 | -41.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112 | I88 M95 A96 | I88-A92 WeakPolarHBondContact O-CB 3.33Å; I88-A92 PolarHBondContact O-N 3.43Å; A92-M95 PolarHBondContact O-N 3.27Å; A92-A96 PolarHBondContact O-N 3.3Å; A92-A96 VanDerWaalsContact O-N 3.1Å |
| 93 | F | 98.4 | Very high | 98.1 | Very high | 94 Ų | 94 | 90.5 Ų | 90.5 | 41% | 0.412 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -62.1 | -43.3 | 173.7 | 174.5 | -88.9 | 0 | 0 | 0 | 112.5 | R89 V90 E91 A96 F97 K115 | R89-F93 WeakPolarHBondContact O-CB 3.49Å; R89-F93 PolarHBondContact O-N 3.49Å; R89-F93 VanDerWaalsContact O-N 3.09Å; V90-F93 WeakPolarHBondContact O-CB 3.47Å; V90-F93 PolarHBondContact O-N 3.01Å; E91-F93 VanDerWaalsContact C-N 3.27Å; E91-F93 PolarHBondContact O-N 2.84Å; F93-A96 PolarHBondContact O-N 2.76Å; F93-F97 HydrophobicContact CD1-CD2 4.08Å; F93-F97 HydrophobicContact CD1-CE2 4.42Å; F93-F97 HydrophobicContact CD2-CE2 4.46Å; F93-F97 AromaticContact CE1-CD2 3.52Å; F93-F97 HydrophobicContact CE1-CD2 3.52Å; F93-F97 AromaticContact CE1-CE2 3.51Å; F93-F97 HydrophobicContact CE1-CE2 3.51Å; F93-F97 HydrophobicContact CE1-CG 4.46Å; F93-F97 HydrophobicContact CE1-CZ 4.41Å; F93-F97 HydrophobicContact CE2-CD2 4.07Å; F93-F97 AromaticContact CE2-CE2 3.6Å; F93-F97 HydrophobicContact CE2-CE2 3.6Å; F93-F97 AromaticContact CZ-CD2 3.56Å; F93-F97 HydrophobicContact CZ-CD2 3.56Å; F93-F97 AromaticContact CZ-CE2 3.06Å; F93-F97 HydrophobicContact CZ-CE2 3.06Å; F93-F97 AromaticContact CZ-CZ 3.94Å; F93-F97 HydrophobicContact CZ-CZ 3.94Å; F93-F97 PolarHBondContact O-N 3.02Å; F93-F97 VanDerWaalsContact O-N 3.13Å; F93-K115 HydrophobicContact CE1-CD 4.15Å |
| 94 | N | 98.3 | Very high | 98.1 | Very high | 69 Ų | 69 | 88.9 Ų | 88.9 | 37% | 0.369 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -69.2 | -34.7 | 179.3 | -69.8 | -27.6 | 0 | 0 | 0 | 111.8 | V90 E91 F97 A98 K115 | V90-N94 WeakPolarHBondContact O-CB 3.49Å; V90-N94 PolarHBondContact O-N 3.25Å; V90-N94 PolarHBondContact O-ND2 2.88Å; E91-N94 CarbonylContact O-C 3.46Å; E91-N94 PolarHBondContact O-N 3.02Å; N94-F97 WeakPolarHBondContact O-CB 3.47Å; N94-F97 PolarHBondContact O-N 2.64Å; N94-A98 PolarHBondContact O-N 3.23Å; N94-K115 WeakPolarHBondContact OD1-CE 3.35Å; N94-K115 PolarHBondContact OD1-NZ 3.05Å |
| 95 | M | 98.4 | Very high | 97.9 | Very high | 116 Ų | 116 | 89 Ų | 89 | 57% | 0.571 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -60.6 | -46.3 | 172.1 | -71.3 | -179.4 | 69.1 | 0 | 0 | 111.1 | E91 A92 F97 A98 E99 | E91-M95 WeakPolarHBondContact O-CG 3.36Å; E91-M95 PolarHBondContact O-N 2.88Å; A92-M95 PolarHBondContact O-N 3.27Å; M95-F97 VanDerWaalsContact C-N 3.28Å; M95-F97 PolarHBondContact O-N 2.75Å; M95-A98 WeakPolarHBondContact O-CB 3.37Å; M95-A98 PolarHBondContact O-N 3.29Å; M95-E99 PolarHBondContact O-N 3.4Å |
| 96 | A | 98.4 | Very high | 97.8 | Very high | 60 Ų | 60 | 81.8 Ų | 81.8 | 50% | 0.496 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -59.4 | -38.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | A92 F93 E99 L100 | A92-A96 PolarHBondContact O-N 3.3Å; A92-A96 VanDerWaalsContact O-N 3.1Å; F93-A96 PolarHBondContact O-N 2.76Å; A96-E99 PolarHBondContact O-N 3.25Å; A96-L100 WeakPolarHBondContact O-CB 3.37Å; A96-L100 PolarHBondContact O-N 3Å |
| 97 | F | 98.2 | Very high | 97.4 | Very high | 28 Ų | 28 | 86 Ų | 86 | 12% | 0.123 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -65.3 | -36.7 | 173.6 | -100 | -95 | 0 | 0 | 0 | 113.1 | F93 N94 M95 R101 K115 I118 L119 | F93-F97 HydrophobicContact CD1-CD2 4.08Å; F93-F97 HydrophobicContact CD1-CE2 4.42Å; F93-F97 HydrophobicContact CD2-CE2 4.46Å; F93-F97 AromaticContact CE1-CD2 3.52Å; F93-F97 HydrophobicContact CE1-CD2 3.52Å; F93-F97 AromaticContact CE1-CE2 3.51Å; F93-F97 HydrophobicContact CE1-CE2 3.51Å; F93-F97 HydrophobicContact CE1-CG 4.46Å; F93-F97 HydrophobicContact CE1-CZ 4.41Å; F93-F97 HydrophobicContact CE2-CD2 4.07Å; F93-F97 AromaticContact CE2-CE2 3.6Å; F93-F97 HydrophobicContact CE2-CE2 3.6Å; F93-F97 AromaticContact CZ-CD2 3.56Å; F93-F97 HydrophobicContact CZ-CD2 3.56Å; F93-F97 AromaticContact CZ-CE2 3.06Å; F93-F97 HydrophobicContact CZ-CE2 3.06Å; F93-F97 AromaticContact CZ-CZ 3.94Å; F93-F97 HydrophobicContact CZ-CZ 3.94Å; F93-F97 PolarHBondContact O-N 3.02Å; F93-F97 VanDerWaalsContact O-N 3.13Å; N94-F97 WeakPolarHBondContact O-CB 3.47Å; N94-F97 PolarHBondContact O-N 2.64Å; M95-F97 VanDerWaalsContact C-N 3.28Å; M95-F97 PolarHBondContact O-N 2.75Å; F97-R101 VanDerWaalsContact O-CB 3.29Å; F97-R101 WeakPolarHBondContact O-CB 3.27Å; F97-R101 PolarHBondContact O-N 2.9Å; F97-K115 HydrophobicContact CD1-CB 4.26Å; F97-K115 HydrophobicContact CD1-CG 3.96Å; F97-K115 HydrophobicContact CE1-CB 3.72Å; F97-K115 HydrophobicContact CE1-CG 3.88Å; F97-K115 HydrophobicContact CZ-CB 4.27Å; F97-K115 HydrophobicContact CZ-CG 4.45Å; F97-I118 HydrophobicContact CD1-CB 4.25Å; F97-I118 HydrophobicContact CD1-CD1 3.88Å; F97-I118 HydrophobicContact CD1-CG2 3.94Å; F97-I118 HydrophobicContact CE1-CB 4.24Å; F97-I118 HydrophobicContact CE1-CG2 4.08Å; F97-L119 HydrophobicContact CE1-CD2 4.26Å; F97-L119 HydrophobicContact CE1-CG 4.15Å; F97-L119 HydrophobicContact CZ-CD1 4.26Å; F97-L119 HydrophobicContact CZ-CD2 3.91Å; F97-L119 HydrophobicContact CZ-CG 4.04Å |
| 98 | A | 97.2 | Very high | 97 | Very high | 47 Ų | 47 | 82 Ų | 82 | 39% | 0.388 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -67.9 | -41.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | N94 M95 R101 K102 | N94-A98 PolarHBondContact O-N 3.23Å; M95-A98 WeakPolarHBondContact O-CB 3.37Å; M95-A98 PolarHBondContact O-N 3.29Å; A98-R101 WeakPolarHBondContact O-CB 3.46Å; A98-R101 PolarHBondContact O-N 3.27Å; A98-K102 WeakPolarHBondContact O-CG 3.46Å; A98-K102 PolarHBondContact O-N 2.66Å |
| 99 | E | 97.8 | Very high | 96.4 | Very high | 101 Ų | 101 | 82.7 Ų | 82.7 | 47% | 0.472 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -64.2 | -46.5 | 175.1 | -66.5 | -48.5 | 132 | 0 | 0 | 111.8 | M95 A96 R101 K102 | M95-E99 PolarHBondContact O-N 3.4Å; A96-E99 PolarHBondContact O-N 3.25Å; E99-R101 VanDerWaalsContact C-N 3.26Å; E99-R101 PolarHBondContact O-N 3.33Å; E99-K102 PolarHBondContact O-N 3.06Å; E99-K102 VanDerWaalsContact O-N 3.17Å; E99-K102 IonicContact OE1-NZ 3.33Å; E99-K102 PolarHBondContact OE1-NZ 2.93Å; E99-K102 IonicContact OE2-NZ 2.8Å; E99-K102 PolarHBondContact OE2-NZ 3.39Å |
| 100 | L | 97.9 | Very high | 95.8 | Very high | 58 Ų | 58 | 81.3 Ų | 81.3 | 30% | 0.304 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -56 | -44.3 | 175.4 | 176.4 | 57.9 | 0 | 0 | 0 | 111.3 | A96 K102 L103 I118 A122 | A96-L100 WeakPolarHBondContact O-CB 3.37Å; A96-L100 PolarHBondContact O-N 3Å; L100-K102 VanDerWaalsContact C-N 3.3Å; L100-K102 PolarHBondContact O-N 3.42Å; L100-L103 WeakPolarHBondContact O-CB 3.42Å; L100-L103 PolarHBondContact O-N 3.4Å; L100-L103 VanDerWaalsContact O-N 3.11Å; L100-I118 HydrophobicContact CB-CG2 4.46Å; L100-I118 HydrophobicContact CD2-CG2 3.59Å; L100-I118 HydrophobicContact CG-CG2 3.85Å; L100-A122 HydrophobicContact CD1-CB 4.17Å; L100-A122 HydrophobicContact CD2-CB 4.35Å |
| 101 | R | 97.3 | Very high | 95.6 | Very high | 59 Ų | 59 | 83.2 Ų | 83.2 | 22% | 0.223 | 45% | 0.45 | C | S | . | . | H | α-helix | trans | -60.2 | -35.4 | -179.6 | 173.4 | -176.8 | 162.8 | 73.5 | 6.3 | 113.3 | F97 A98 E99 L103 L104 D110 K111 I118 | F97-R101 VanDerWaalsContact O-CB 3.29Å; F97-R101 WeakPolarHBondContact O-CB 3.27Å; F97-R101 PolarHBondContact O-N 2.9Å; A98-R101 WeakPolarHBondContact O-CB 3.46Å; A98-R101 PolarHBondContact O-N 3.27Å; E99-R101 VanDerWaalsContact C-N 3.26Å; E99-R101 PolarHBondContact O-N 3.33Å; R101-L103 PolarHBondContact O-N 3.49Å; R101-L104 PolarHBondContact O-N 3.07Å; R101-L104 VanDerWaalsContact O-N 3.16Å; R101-D110 PolarHBondContact NH2-O 3.47Å; R101-K111 PolarHBondContact NH1-O 3.47Å; R101-K111 PolarHBondContact NH2-O 2.99Å; R101-I118 HydrophobicContact CB-CD1 4.1Å; R101-I118 HydrophobicContact CB-CG1 4.42Å; R101-I118 HydrophobicContact CG-CD1 4.45Å |
| 102 | K | 95.8 | Very high | 95.4 | Very high | 147 Ų | 147 | 87.2 Ų | 87.2 | 64% | 0.639 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -63.4 | -25.9 | 177.9 | -67.9 | 171.4 | -172.5 | 169.8 | 0 | 112.7 | A98 E99 L100 | A98-K102 WeakPolarHBondContact O-CG 3.46Å; A98-K102 PolarHBondContact O-N 2.66Å; E99-K102 PolarHBondContact O-N 3.06Å; E99-K102 VanDerWaalsContact O-N 3.17Å; E99-K102 IonicContact OE1-NZ 3.33Å; E99-K102 PolarHBondContact OE1-NZ 2.93Å; E99-K102 IonicContact OE2-NZ 2.8Å; E99-K102 PolarHBondContact OE2-NZ 3.39Å; L100-K102 VanDerWaalsContact C-N 3.3Å; L100-K102 PolarHBondContact O-N 3.42Å |
| 103 | L | 96.4 | Very high | 95.2 | Very high | 125 Ų | 125 | 85.8 Ų | 85.8 | 65% | 0.654 | 45% | 0.45 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.1 | -10.9 | 179.5 | -56 | 175.5 | 0 | 0 | 0 | 112.7 | L100 R101 Y125 | L100-L103 WeakPolarHBondContact O-CB 3.42Å; L100-L103 PolarHBondContact O-N 3.4Å; L100-L103 VanDerWaalsContact O-N 3.11Å; R101-L103 PolarHBondContact O-N 3.49Å; L103-Y125 WeakPolarHBondContact O-CE1 3.32Å |
| 104 | L | 97.1 | Very high | 95.2 | Very high | 14 Ų | 14 | 83.8 Ų | 83.8 | 7% | 0.073 | 45% | 0.448 | C | S | . | . | S | Bend | trans | -87.5 | 135.6 | -175 | -61.6 | -178.9 | 0 | 0 | 0 | 111.6 | R101 T106 L113 I118 L121 A122 Y125 | R101-L104 PolarHBondContact O-N 3.07Å; R101-L104 VanDerWaalsContact O-N 3.16Å; L104-T106 PolarHBondContact O-N 3.16Å; L104-L113 HydrophobicContact CD1-CD1 4.33Å; L104-I118 HydrophobicContact CD1-CB 4.23Å; L104-I118 HydrophobicContact CD1-CG1 4.42Å; L104-I118 HydrophobicContact CD1-CG2 3.87Å; L104-I118 WeakPolarHBondContact CD1-O 3.49Å; L104-L121 HydrophobicContact CB-CD2 3.82Å; L104-L121 HydrophobicContact CB-CG 4.29Å; L104-L121 HydrophobicContact CD1-CB 4.15Å; L104-L121 HydrophobicContact CD1-CD2 4.07Å; L104-L121 HydrophobicContact CD1-CG 4.23Å; L104-L121 HydrophobicContact CD2-CG 4.39Å; L104-L121 HydrophobicContact CG-CD2 4.43Å; L104-A122 HydrophobicContact CD2-CB 3.87Å; L104-Y125 HydrophobicContact CD2-CD1 4.49Å |
| 105 | P | 96.1 | Very high | 95.2 | Very high | 68 Ų | 68 | 85.1 Ų | 85.1 | 44% | 0.442 | 45% | 0.451 | S | S | . | . | trans | -72.8 | 118.6 | 176.7 | 28.9 | -33.7 | 0 | 0 | 0 | 110.8 | Y125 | P105-Y125 HydrophobicContact CG-CD1 4.47Å; P105-Y125 HydrophobicContact CG-CD2 3.78Å; P105-Y125 HydrophobicContact CG-CE2 3.93Å; P105-Y125 HydrophobicContact CG-CG 4.08Å | ||
| 106 | T | 95.2 | Very high | 95.2 | Very high | 33 Ų | 33 | 84 Ų | 84 | 20% | 0.202 | 45% | 0.446 | C | S | . | . | trans | -136.4 | 148.3 | 174.9 | 64.3 | 0 | 0 | 0 | 0 | 113.1 | L104 P108 L113 L121 | L104-T106 PolarHBondContact O-N 3.16Å; T106-P108 CarbonylContact C-O 3.48Å; T106-P108 CarbonylContact O-C 3.6Å; T106-P108 PolarHBondContact OG1-O 2.91Å; T106-P108 VanDerWaalsContact OG1-O 3.07Å; T106-L113 HydrophobicContact CG2-CD1 3.78Å; T106-L113 HydrophobicContact CG2-CD2 4.48Å; T106-L113 HydrophobicContact CG2-CG 4.34Å; T106-L121 HydrophobicContact CG2-CD2 4.04Å | ||
| 107 | L | 89.9 | Confident | 95.1 | Very high | 162 Ų | 162 | 85 Ų | 85 | 85% | 0.848 | 44% | 0.44 | S | S | * | . | S | Bend | trans | -122.4 | 121.2 | 169.8 | -144.1 | 79.8 | 0 | 0 | 0 | 109 | ||
| 108 | P | 90.4 | Very high | 95.1 | Very high | 71 Ų | 71 | 84 Ų | 84 | 46% | 0.461 | 44% | 0.436 | S | S | . | . | S | Bend | cis | -66.1 | 164.3 | -11.3 | 32.5 | -38.2 | 0 | 0 | 0 | 112.6 | T106 D110 K111 | T106-P108 CarbonylContact C-O 3.48Å; T106-P108 CarbonylContact O-C 3.6Å; T106-P108 PolarHBondContact OG1-O 2.91Å; T106-P108 VanDerWaalsContact OG1-O 3.07Å; P108-D110 WeakPolarHBondContact CB-OD1 3.28Å; P108-D110 WeakPolarHBondContact CG-OD1 3.25Å; P108-D110 PolarHBondContact O-N 2.93Å; P108-D110 VanDerWaalsContact O-N 3.15Å; P108-K111 HydrophobicContact CG-CB 4.33Å; P108-K111 VanDerWaalsContact O-CB 3.25Å; P108-K111 WeakPolarHBondContact O-CB 3.4Å; P108-K111 PolarHBondContact O-N 3.25Å; P108-K111 VanDerWaalsContact O-N 3.07Å |
| 109 | P | 86.3 | Confident | 95.2 | Very high | 115 Ų | 115 | 85.6 Ų | 85.6 | 75% | 0.747 | 44% | 0.437 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.5 | -20.5 | -176.4 | 23.9 | -34.5 | 0 | 0 | 0 | 114.1 | ||
| 110 | D | 86.9 | Confident | 95.2 | Very high | 119 Ų | 119 | 88.9 Ų | 88.9 | 64% | 0.636 | 45% | 0.446 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.4 | 5 | 178.6 | 66.6 | -34.3 | 0 | 0 | 0 | 113.4 | R101 P108 K112 | R101-D110 PolarHBondContact NH2-O 3.47Å; P108-D110 WeakPolarHBondContact CB-OD1 3.28Å; P108-D110 WeakPolarHBondContact CG-OD1 3.25Å; P108-D110 PolarHBondContact O-N 2.93Å; P108-D110 VanDerWaalsContact O-N 3.15Å; D110-K112 PolarHBondContact O-N 3.5Å |
| 111 | K | 94.4 | Very high | 95.2 | Very high | 95 Ų | 95 | 88.5 Ų | 88.5 | 41% | 0.413 | 44% | 0.444 | S | S | . | . | trans | -52.4 | 111.4 | -178.3 | 174.7 | -179.8 | 174.1 | 169.4 | 0 | 111.9 | R101 P108 L113 | R101-K111 PolarHBondContact NH1-O 3.47Å; R101-K111 PolarHBondContact NH2-O 2.99Å; P108-K111 HydrophobicContact CG-CB 4.33Å; P108-K111 VanDerWaalsContact O-CB 3.25Å; P108-K111 WeakPolarHBondContact O-CB 3.4Å; P108-K111 PolarHBondContact O-N 3.25Å; P108-K111 VanDerWaalsContact O-N 3.07Å; K111-L113 HydrophobicContact CD-CD2 4.23Å; K111-L113 HydrophobicContact CG-CD2 4.4Å; K111-L113 PolarHBondContact O-N 3.06Å | ||
| 112 | K | 93.8 | Very high | 95.3 | Very high | 194 Ų | 194 | 86.3 Ų | 86.3 | 84% | 0.843 | 44% | 0.438 | S | S | * | . | trans | -60.9 | 121.3 | 177.6 | -63 | -176.6 | -179.2 | 176.9 | 0 | 110.9 | D110 | D110-K112 PolarHBondContact O-N 3.5Š| ||
| 113 | L | 95.3 | Very high | 95.4 | Very high | 27 Ų | 27 | 84.7 Ų | 84.7 | 14% | 0.141 | 44% | 0.435 | C | S | . | . | trans | -111.5 | 137.7 | 178 | -62.9 | 173.8 | 0 | 0 | 0 | 108.5 | L104 T106 K111 E117 I118 L121 | L104-L113 HydrophobicContact CD1-CD1 4.33Å; T106-L113 HydrophobicContact CG2-CD1 3.78Å; T106-L113 HydrophobicContact CG2-CD2 4.48Å; T106-L113 HydrophobicContact CG2-CG 4.34Å; K111-L113 HydrophobicContact CD-CD2 4.23Å; K111-L113 HydrophobicContact CG-CD2 4.4Å; K111-L113 PolarHBondContact O-N 3.06Å; L113-E117 HydrophobicContact CB-CB 4.21Å; L113-E117 HydrophobicContact CD2-CB 4.18Å; L113-I118 HydrophobicContact CB-CD1 4.32Å; L113-I118 HydrophobicContact CB-CG1 3.71Å; L113-I118 HydrophobicContact CD1-CG1 4.08Å; L113-L121 HydrophobicContact CD1-CD2 3.94Å | ||
| 114 | S | 97.8 | Very high | 95.5 | Very high | 51 Ų | 51 | 82.7 Ų | 82.7 | 36% | 0.357 | 43% | 0.431 | S | S | . | . | trans | -70.2 | 163.1 | 168.3 | 66.5 | 0 | 0 | 0 | 0 | 111.5 | I116 E117 I118 | S114-I116 VanDerWaalsContact C-N 3.25Å; S114-I116 PolarHBondContact O-N 3.36Å; S114-I116 WeakPolarHBondContact OG-CG2 3.49Å; S114-E117 VanDerWaalsContact CB-OE2 3.28Å; S114-E117 WeakPolarHBondContact CB-OE2 3.26Å; S114-E117 PolarHBondContact N-OE2 3.41Å; S114-E117 PolarHBondContact O-N 3.46Å; S114-E117 VanDerWaalsContact O-N 3.15Å; S114-E117 VanDerWaalsContact OG-CD 3.32Å; S114-E117 VanDerWaalsContact OG-CG 3.27Å; S114-E117 WeakPolarHBondContact OG-CG 3.35Å; S114-E117 PolarHBondContact OG-N 3.11Å; S114-E117 PolarHBondContact OG-OE2 3.21Å; S114-I118 WeakPolarHBondContact O-CG1 3.47Å; S114-I118 PolarHBondContact O-N 2.88Å | ||
| 115 | K | 97.9 | Very high | 95.5 | Very high | 98 Ų | 98 | 85.6 Ų | 85.6 | 43% | 0.426 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -56.4 | -39.7 | 178.3 | -69.7 | -176.9 | 173.8 | 178.1 | 0 | 112.2 | F93 N94 F97 L119 | F93-K115 HydrophobicContact CE1-CD 4.15Å; N94-K115 WeakPolarHBondContact OD1-CE 3.35Å; N94-K115 PolarHBondContact OD1-NZ 3.05Å; F97-K115 HydrophobicContact CD1-CB 4.26Å; F97-K115 HydrophobicContact CD1-CG 3.96Å; F97-K115 HydrophobicContact CE1-CB 3.72Å; F97-K115 HydrophobicContact CE1-CG 3.88Å; F97-K115 HydrophobicContact CZ-CB 4.27Å; F97-K115 HydrophobicContact CZ-CG 4.45Å; K115-L119 WeakPolarHBondContact O-CG 3.4Å; K115-L119 PolarHBondContact O-N 3.34Å |
| 116 | I | 98.3 | Very high | 95.6 | Very high | 92 Ų | 92 | 87.2 Ų | 87.2 | 47% | 0.472 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -69.8 | -38.2 | 179.2 | -174.3 | 59.6 | 0 | 0 | 0 | 112.2 | S114 L119 R120 | S114-I116 VanDerWaalsContact C-N 3.25Å; S114-I116 PolarHBondContact O-N 3.36Å; S114-I116 WeakPolarHBondContact OG-CG2 3.49Å; I116-L119 PolarHBondContact O-N 3.44Å; I116-R120 HydrophobicContact CD1-CG 4.39Å; I116-R120 WeakPolarHBondContact O-CG 3.41Å; I116-R120 PolarHBondContact O-N 2.95Å |
| 117 | E | 97.7 | Very high | 95.8 | Very high | 81 Ų | 81 | 89.1 Ų | 89.1 | 38% | 0.379 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -65.7 | -42.2 | 176.1 | -72 | 167.3 | 122.5 | 0 | 0 | 111.4 | L113 S114 L119 R120 L121 | L113-E117 HydrophobicContact CB-CB 4.21Å; L113-E117 HydrophobicContact CD2-CB 4.18Å; S114-E117 VanDerWaalsContact CB-OE2 3.28Å; S114-E117 WeakPolarHBondContact CB-OE2 3.26Å; S114-E117 PolarHBondContact N-OE2 3.41Å; S114-E117 PolarHBondContact O-N 3.46Å; S114-E117 VanDerWaalsContact O-N 3.15Å; S114-E117 VanDerWaalsContact OG-CD 3.32Å; S114-E117 VanDerWaalsContact OG-CG 3.27Å; S114-E117 WeakPolarHBondContact OG-CG 3.35Å; S114-E117 PolarHBondContact OG-N 3.11Å; S114-E117 PolarHBondContact OG-OE2 3.21Å; E117-L119 VanDerWaalsContact C-N 3.32Å; E117-L119 PolarHBondContact O-N 3.29Å; E117-R120 PolarHBondContact O-N 3.47Å; E117-L121 WeakPolarHBondContact O-CB 3.34Å; E117-L121 PolarHBondContact O-N 3.1Å |
| 118 | I | 98.2 | Very high | 96.1 | Very high | 8 Ų | 8 | 88.1 Ų | 88.1 | 4% | 0.041 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -55.7 | -48.5 | 175.2 | -69.8 | 167.9 | 0 | 0 | 0 | 110.2 | F97 L100 R101 L104 L113 S114 A122 | F97-I118 HydrophobicContact CD1-CB 4.25Å; F97-I118 HydrophobicContact CD1-CD1 3.88Å; F97-I118 HydrophobicContact CD1-CG2 3.94Å; F97-I118 HydrophobicContact CE1-CB 4.24Å; F97-I118 HydrophobicContact CE1-CG2 4.08Å; L100-I118 HydrophobicContact CB-CG2 4.46Å; L100-I118 HydrophobicContact CD2-CG2 3.59Å; L100-I118 HydrophobicContact CG-CG2 3.85Å; R101-I118 HydrophobicContact CB-CD1 4.1Å; R101-I118 HydrophobicContact CB-CG1 4.42Å; R101-I118 HydrophobicContact CG-CD1 4.45Å; L104-I118 HydrophobicContact CD1-CB 4.23Å; L104-I118 HydrophobicContact CD1-CG1 4.42Å; L104-I118 HydrophobicContact CD1-CG2 3.87Å; L104-I118 WeakPolarHBondContact CD1-O 3.49Å; L113-I118 HydrophobicContact CB-CD1 4.32Å; L113-I118 HydrophobicContact CB-CG1 3.71Å; L113-I118 HydrophobicContact CD1-CG1 4.08Å; S114-I118 WeakPolarHBondContact O-CG1 3.47Å; S114-I118 PolarHBondContact O-N 2.88Å; I118-A122 VanDerWaalsContact O-CB 3.28Å; I118-A122 WeakPolarHBondContact O-CB 3.36Å; I118-A122 PolarHBondContact O-N 3.22Å |
| 119 | L | 98.7 | Very high | 96.5 | Very high | 79 Ų | 79 | 87.9 Ų | 87.9 | 41% | 0.414 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -64.2 | -45.9 | -179.9 | -67.3 | 176.3 | 0 | 0 | 0 | 112.4 | F97 K115 I116 E117 A122 I123 | F97-L119 HydrophobicContact CE1-CD2 4.26Å; F97-L119 HydrophobicContact CE1-CG 4.15Å; F97-L119 HydrophobicContact CZ-CD1 4.26Å; F97-L119 HydrophobicContact CZ-CD2 3.91Å; F97-L119 HydrophobicContact CZ-CG 4.04Å; K115-L119 WeakPolarHBondContact O-CG 3.4Å; K115-L119 PolarHBondContact O-N 3.34Å; I116-L119 PolarHBondContact O-N 3.44Å; E117-L119 VanDerWaalsContact C-N 3.32Å; E117-L119 PolarHBondContact O-N 3.29Å; L119-A122 PolarHBondContact O-N 3.35Å; L119-I123 WeakPolarHBondContact O-CG1 3.21Å; L119-I123 PolarHBondContact O-N 2.67Å; L119-I123 VanDerWaalsContact O-N 3.15Å |
| 120 | R | 98.4 | Very high | 97 | Very high | 170 Ų | 170 | 86.4 Ų | 86.4 | 64% | 0.642 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -62.7 | -45.7 | 178.8 | -73.6 | 176.9 | 174.3 | -176.2 | -1.9 | 111.6 | I116 E117 I123 C124 | I116-R120 HydrophobicContact CD1-CG 4.39Å; I116-R120 WeakPolarHBondContact O-CG 3.41Å; I116-R120 PolarHBondContact O-N 2.95Å; E117-R120 PolarHBondContact O-N 3.47Å; R120-I123 PolarHBondContact O-N 3.44Å; R120-C124 PolarHBondContact O-N 3.22Å; R120-C124 PolarHBondContact O-SG 3.35Å; R120-C124 VanDerWaalsContact O-SG 3.35Å |
| 121 | L | 97.9 | Very high | 97.5 | Very high | 50 Ų | 50 | 86.7 Ų | 86.7 | 26% | 0.262 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -66.9 | -38.6 | -179.2 | -175.7 | 60.9 | 0 | 0 | 0 | 111.5 | L104 T106 L113 E117 C124 Y125 | L104-L121 HydrophobicContact CB-CD2 3.82Å; L104-L121 HydrophobicContact CB-CG 4.29Å; L104-L121 HydrophobicContact CD1-CB 4.15Å; L104-L121 HydrophobicContact CD1-CD2 4.07Å; L104-L121 HydrophobicContact CD1-CG 4.23Å; L104-L121 HydrophobicContact CD2-CG 4.39Å; L104-L121 HydrophobicContact CG-CD2 4.43Å; T106-L121 HydrophobicContact CG2-CD2 4.04Å; L113-L121 HydrophobicContact CD1-CD2 3.94Å; E117-L121 WeakPolarHBondContact O-CB 3.34Å; E117-L121 PolarHBondContact O-N 3.1Å; L121-C124 PolarHBondContact O-N 3.36Å; L121-Y125 VanDerWaalsContact O-CB 3.25Å; L121-Y125 WeakPolarHBondContact O-CB 3.42Å; L121-Y125 PolarHBondContact O-N 3.18Å |
| 122 | A | 98.5 | Very high | 97.6 | Very high | 13 Ų | 13 | 85.5 Ų | 85.5 | 11% | 0.107 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -59.5 | -46.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | L100 L104 I118 L119 Y125 I126 | L100-A122 HydrophobicContact CD1-CB 4.17Å; L100-A122 HydrophobicContact CD2-CB 4.35Å; L104-A122 HydrophobicContact CD2-CB 3.87Å; I118-A122 VanDerWaalsContact O-CB 3.28Å; I118-A122 WeakPolarHBondContact O-CB 3.36Å; I118-A122 PolarHBondContact O-N 3.22Å; L119-A122 PolarHBondContact O-N 3.35Å; A122-Y125 PolarHBondContact O-N 3.09Å; A122-I126 WeakPolarHBondContact O-CG1 3.35Å; A122-I126 PolarHBondContact O-N 3.16Å |
| 123 | I | 98.4 | Very high | 97.7 | Very high | 113 Ų | 113 | 82.7 Ų | 82.7 | 58% | 0.579 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -60.3 | -49.7 | 177 | -66.9 | 164.4 | 0 | 0 | 0 | 110.2 | L119 R120 Y125 I126 S127 | L119-I123 WeakPolarHBondContact O-CG1 3.21Å; L119-I123 PolarHBondContact O-N 2.67Å; L119-I123 VanDerWaalsContact O-N 3.15Å; R120-I123 PolarHBondContact O-N 3.44Å; I123-Y125 VanDerWaalsContact C-N 3.28Å; I123-Y125 PolarHBondContact O-N 2.8Å; I123-I126 PolarHBondContact O-N 3.25Å; I123-S127 PolarHBondContact O-N 3.46Å; I123-S127 VanDerWaalsContact O-N 3.12Å; I123-S127 PolarHBondContact O-OG 2.88Å |
| 124 | C | 98.1 | Very high | 97.4 | Very high | 83 Ų | 83 | 88.2 Ų | 88.2 | 56% | 0.561 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -60.3 | -39.7 | 178.2 | -67.8 | 0 | 0 | 0 | 0 | 112.1 | R120 L121 S127 Y128 | R120-C124 PolarHBondContact O-N 3.22Å; R120-C124 PolarHBondContact O-SG 3.35Å; R120-C124 VanDerWaalsContact O-SG 3.35Å; L121-C124 PolarHBondContact O-N 3.36Å; C124-S127 PolarHBondContact O-N 3.1Å; C124-Y128 WeakPolarHBondContact O-CB 3.41Å; C124-Y128 PolarHBondContact O-N 3.19Å |
| 125 | Y | 98 | Very high | 95.4 | Very high | 75 Ų | 75 | 93.3 Ų | 93.3 | 29% | 0.294 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -70.7 | -41.9 | -177 | -172.7 | -135.8 | 0 | 0 | 0 | 112.2 | L103 L104 P105 L121 A122 I123 S127 Y128 L129 | L103-Y125 WeakPolarHBondContact O-CE1 3.32Å; L104-Y125 HydrophobicContact CD2-CD1 4.49Å; P105-Y125 HydrophobicContact CG-CD1 4.47Å; P105-Y125 HydrophobicContact CG-CD2 3.78Å; P105-Y125 HydrophobicContact CG-CE2 3.93Å; P105-Y125 HydrophobicContact CG-CG 4.08Å; L121-Y125 VanDerWaalsContact O-CB 3.25Å; L121-Y125 WeakPolarHBondContact O-CB 3.42Å; L121-Y125 PolarHBondContact O-N 3.18Å; A122-Y125 PolarHBondContact O-N 3.09Å; I123-Y125 VanDerWaalsContact C-N 3.28Å; I123-Y125 PolarHBondContact O-N 2.8Å; Y125-S127 PolarHBondContact O-N 3.12Å; Y125-Y128 HydrophobicContact CD2-CD1 4.19Å; Y125-Y128 HydrophobicContact CE2-CD1 4.23Å; Y125-Y128 PolarHBondContact O-N 3.22Å; Y125-L129 HydrophobicContact CD1-CD1 4.23Å; Y125-L129 HydrophobicContact CD2-CD1 4.42Å; Y125-L129 HydrophobicContact CD2-CG 4.15Å; Y125-L129 HydrophobicContact CE1-CD1 3.85Å; Y125-L129 HydrophobicContact CE2-CD1 4.05Å; Y125-L129 HydrophobicContact CE2-CD2 3.82Å; Y125-L129 HydrophobicContact CE2-CG 3.84Å; Y125-L129 HydrophobicContact CG-CD1 4.5Å; Y125-L129 WeakPolarHBondContact O-CG 3.25Å; Y125-L129 PolarHBondContact O-N 2.94Å |
| 126 | I | 98.1 | Very high | 95.3 | Very high | 102 Ų | 102 | 93.1 Ų | 93.1 | 52% | 0.523 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -58.9 | -48.1 | 172.8 | -67.4 | 166.1 | 0 | 0 | 0 | 110.3 | A122 I123 Y128 L129 N130 | A122-I126 WeakPolarHBondContact O-CG1 3.35Å; A122-I126 PolarHBondContact O-N 3.16Å; I123-I126 PolarHBondContact O-N 3.25Å; I126-Y128 VanDerWaalsContact C-N 3.31Å; I126-Y128 PolarHBondContact O-N 3.33Å; I126-L129 PolarHBondContact O-N 3.26Å; I126-N130 PolarHBondContact O-N 3.22Å; I126-N130 PolarHBondContact O-ND2 3.49Å |
| 127 | S | 97.9 | Very high | 95.1 | Very high | 73 Ų | 73 | 93.1 Ų | 93.1 | 51% | 0.51 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -60.8 | -39.9 | 178 | -62.3 | 0 | 0 | 0 | 0 | 112.7 | I123 C124 Y125 H131 | I123-S127 PolarHBondContact O-N 3.46Å; I123-S127 VanDerWaalsContact O-N 3.12Å; I123-S127 PolarHBondContact O-OG 2.88Å; C124-S127 PolarHBondContact O-N 3.1Å; Y125-S127 PolarHBondContact O-N 3.12Å; S127-H131 PolarHBondContact O-N 3.02Å; S127-H131 VanDerWaalsContact O-N 3.09Å |
| 128 | Y | 97.6 | Very high | 95 | Very high | 141 Ų | 141 | 93.8 Ų | 93.8 | 55% | 0.553 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -62.8 | -48.4 | 175.8 | 170.9 | -101.4 | 0 | 0 | 0 | 111.7 | C124 Y125 I126 N130 H131 V132 | C124-Y128 WeakPolarHBondContact O-CB 3.41Å; C124-Y128 PolarHBondContact O-N 3.19Å; Y125-Y128 HydrophobicContact CD2-CD1 4.19Å; Y125-Y128 HydrophobicContact CE2-CD1 4.23Å; Y125-Y128 PolarHBondContact O-N 3.22Å; I126-Y128 VanDerWaalsContact C-N 3.31Å; I126-Y128 PolarHBondContact O-N 3.33Å; Y128-N130 VanDerWaalsContact C-N 3.35Å; Y128-N130 PolarHBondContact O-N 2.94Å; Y128-H131 PolarHBondContact O-N 3.06Å; Y128-V132 HydrophobicContact CD1-CG2 4.41Å; Y128-V132 HydrophobicContact CD2-CG2 4.36Å; Y128-V132 HydrophobicContact CE1-CG2 3.94Å; Y128-V132 HydrophobicContact CE2-CG2 3.87Å; Y128-V132 WeakPolarHBondContact O-CG2 3.44Å; Y128-V132 PolarHBondContact O-N 2.9Å |
| 129 | L | 97.3 | Very high | 94.8 | Very high | 67 Ų | 67 | 98.8 Ų | 98.8 | 35% | 0.351 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.4 | -41.4 | 179.1 | -68.2 | 177.7 | 0 | 0 | 0 | 111.9 | Y125 I126 H131 V132 L133 | Y125-L129 HydrophobicContact CD1-CD1 4.23Å; Y125-L129 HydrophobicContact CD2-CD1 4.42Å; Y125-L129 HydrophobicContact CD2-CG 4.15Å; Y125-L129 HydrophobicContact CE1-CD1 3.85Å; Y125-L129 HydrophobicContact CE2-CD1 4.05Å; Y125-L129 HydrophobicContact CE2-CD2 3.82Å; Y125-L129 HydrophobicContact CE2-CG 3.84Å; Y125-L129 HydrophobicContact CG-CD1 4.5Å; Y125-L129 WeakPolarHBondContact O-CG 3.25Å; Y125-L129 PolarHBondContact O-N 2.94Å; I126-L129 PolarHBondContact O-N 3.26Å; L129-H131 VanDerWaalsContact C-N 3.34Å; L129-H131 PolarHBondContact O-N 3.47Å; L129-V132 PolarHBondContact O-N 3.26Å; L129-L133 VanDerWaalsContact O-CG 3.3Å; L129-L133 WeakPolarHBondContact O-CG 3.44Å; L129-L133 PolarHBondContact O-N 2.98Å |
| 130 | N | 97.8 | Very high | 94.6 | Very high | 83 Ų | 83 | 100.1 Ų | 100.1 | 44% | 0.444 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -59 | -46.1 | 174.7 | -72 | -21.3 | 0 | 0 | 0 | 111.3 | I126 Y128 V132 L133 D134 | I126-N130 PolarHBondContact O-N 3.22Å; I126-N130 PolarHBondContact O-ND2 3.49Å; Y128-N130 VanDerWaalsContact C-N 3.35Å; Y128-N130 PolarHBondContact O-N 2.94Å; N130-V132 VanDerWaalsContact C-N 3.31Å; N130-V132 PolarHBondContact O-N 3.3Å; N130-L133 PolarHBondContact O-N 2.66Å; N130-L133 VanDerWaalsContact O-N 3.13Å; N130-D134 VanDerWaalsContact O-CG 3.29Å; N130-D134 PolarHBondContact O-N 3.07Å |
| 131 | H | 96.8 | Very high | 94.3 | Very high | 125 Ų | 125 | 95.4 Ų | 95.4 | 58% | 0.579 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -61.2 | -38.6 | 176.9 | -178.6 | 53.6 | 0 | 0 | 0 | 112.8 | S127 Y128 L129 L133 V135 | S127-H131 PolarHBondContact O-N 3.02Å; S127-H131 VanDerWaalsContact O-N 3.09Å; Y128-H131 PolarHBondContact O-N 3.06Å; L129-H131 VanDerWaalsContact C-N 3.34Å; L129-H131 PolarHBondContact O-N 3.47Å; H131-L133 VanDerWaalsContact C-N 3.3Å; H131-L133 PolarHBondContact O-N 3.15Å; H131-V135 VanDerWaalsContact O-CG2 3.27Å; H131-V135 WeakPolarHBondContact O-CG2 3.37Å |
| 132 | V | 96.8 | Very high | 94 | Very high | 70 Ų | 70 | 98.6 Ų | 98.6 | 42% | 0.424 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -66.9 | -31.2 | 176.8 | 170.6 | 0 | 0 | 0 | 0 | 112.2 | Y128 L129 N130 | Y128-V132 HydrophobicContact CD1-CG2 4.41Å; Y128-V132 HydrophobicContact CD2-CG2 4.36Å; Y128-V132 HydrophobicContact CE1-CG2 3.94Å; Y128-V132 HydrophobicContact CE2-CG2 3.87Å; Y128-V132 WeakPolarHBondContact O-CG2 3.44Å; Y128-V132 PolarHBondContact O-N 2.9Å; L129-V132 PolarHBondContact O-N 3.26Å; N130-V132 VanDerWaalsContact C-N 3.31Å; N130-V132 PolarHBondContact O-N 3.3Å |
| 133 | L | 95.4 | Very high | 93.7 | Very high | 135 Ų | 135 | 105.2 Ų | 105.2 | 71% | 0.707 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -84.5 | -26.2 | -179.9 | -68.2 | 173.2 | 0 | 0 | 0 | 113.7 | L129 N130 H131 V135 | L129-L133 VanDerWaalsContact O-CG 3.3Å; L129-L133 WeakPolarHBondContact O-CG 3.44Å; L129-L133 PolarHBondContact O-N 2.98Å; N130-L133 PolarHBondContact O-N 2.66Å; N130-L133 VanDerWaalsContact O-N 3.13Å; H131-L133 VanDerWaalsContact C-N 3.3Å; H131-L133 PolarHBondContact O-N 3.15Å; L133-V135 VanDerWaalsContact C-N 3.28Å |
| 134 | D | 89.7 | Confident | 93.3 | Very high | 143 Ų | 143 | 104.6 Ų | 104.6 | 77% | 0.765 | 56% | 0.556 | S | S | * | * | trans | -80.3 | -8.9 | 178.1 | -70.3 | -28.6 | 0 | 0 | 0 | 113.2 | N130 | N130-D134 VanDerWaalsContact O-CG 3.29Å; N130-D134 PolarHBondContact O-N 3.07Å | ||
| 135 | V | 56.3 | Low | 92.9 | Very high | 158 Ų | 158 | 106.5 Ų | 106.5 | 96% | 0.958 | 56% | 0.555 | S | S | * | * | trans | -94.9 | 0 | 175.6 | 174.8 | 0 | 0 | 0 | 0 | 110 | H131 L133 | H131-V135 VanDerWaalsContact O-CG2 3.27Å; H131-V135 WeakPolarHBondContact O-CG2 3.37Å; L133-V135 VanDerWaalsContact C-N 3.28Å |
Retrieved 135 of 135 residues in 20 ms
(Link to these results)