| 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 | 51.2 | Low | 54.5 | Low | 244 Ų | 244 | 149.8 Ų | 149.8 | 100% | 1.202 | 83% | 0.825 | S | S | * | * | 0 | 135.1 | 0 | -67 | -56.8 | 175.2 | 0 | 0 | 108.2 | |||||
| 2 | A | 51.8 | Low | 54.6 | Low | 94 Ų | 94 | 143.7 Ų | 143.7 | 78% | 0.777 | 81% | 0.809 | S | S | * | * | trans | -47.4 | 143.2 | -162.5 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 3 | F | 49.8 | Very low | 54.8 | Low | 190 Ų | 190 | 141 Ų | 141 | 83% | 0.833 | 80% | 0.803 | S | S | * | * | 65.5 | 118.6 | 56.8 | -93.8 | -65.4 | 0 | 0 | 0 | 115.9 | |||||
| 4 | L | 59 | Low | 54.8 | Low | 157 Ų | 157 | 147.7 Ų | 147.7 | 82% | 0.822 | 81% | 0.809 | S | S | * | * | trans | 73.4 | 150 | 151.4 | -53.3 | 177.9 | 0 | 0 | 0 | 116.3 | ||||
| 5 | A | 59.9 | Low | 54.6 | Low | 84 Ų | 84 | 146.1 Ų | 146.1 | 69% | 0.694 | 81% | 0.813 | S | S | * | * | cis | -167.5 | 146.8 | -0.5 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 6 | R | 53.5 | Low | 54.4 | Low | 206 Ų | 206 | 146 Ų | 146 | 78% | 0.777 | 82% | 0.817 | S | S | * | * | trans | 19.9 | 126 | 130.9 | -168.3 | 178 | -175.7 | 166.4 | 1.5 | 119 | F8 | R6-F8 HydrophobicContact CG-CD2 4.33Š| ||
| 7 | C | 58.5 | Low | 54.6 | Low | 133 Ų | 133 | 143.1 Ų | 143.1 | 90% | 0.899 | 82% | 0.815 | S | S | * | * | trans | -137.3 | 119.8 | 147.7 | -78.5 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 8 | F | 48.2 | Very low | 54.8 | Low | 184 Ų | 184 | 143.6 Ų | 143.6 | 81% | 0.807 | 81% | 0.814 | S | S | * | * | trans | -90.3 | 134 | 161.8 | -91.9 | -100.9 | 0 | 0 | 0 | 107.9 | R6 | R6-F8 HydrophobicContact CG-CD2 4.33Š| ||
| 9 | G | 52.5 | Low | 54.9 | Low | 64 Ų | 64 | 144.7 Ų | 144.7 | 66% | 0.66 | 82% | 0.817 | S | S | * | * | trans | -121.9 | 123.6 | 157.2 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 10 | C | 57.1 | Low | 54.9 | Low | 115 Ų | 115 | 143.2 Ų | 143.2 | 78% | 0.777 | 82% | 0.816 | S | S | * | * | 51.1 | 128.3 | 76.1 | -76.3 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 11 | Q | 57.9 | Low | 55 | Low | 177 Ų | 177 | 139.3 Ų | 139.3 | 83% | 0.827 | 81% | 0.807 | S | S | * | * | cis | -176.8 | 138.5 | 30.2 | -116 | 173.8 | 93 | 0 | 0 | 104.5 | ||||
| 12 | A | 55.9 | Low | 55.3 | Low | 76 Ų | 76 | 139.6 Ų | 139.6 | 63% | 0.628 | 80% | 0.795 | S | S | * | * | 106.8 | 138.7 | 102.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | |||||
| 13 | C | 57.3 | Low | 55.7 | Low | 109 Ų | 109 | 145 Ų | 145 | 74% | 0.736 | 80% | 0.797 | S | S | * | * | trans | 67.8 | 105.8 | 144.7 | -61.1 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 14 | R | 54.8 | Low | 55.9 | Low | 235 Ų | 235 | 143.9 Ų | 143.9 | 89% | 0.887 | 80% | 0.799 | S | S | * | * | 64.9 | 113.7 | 89.5 | -75.1 | -173.6 | 174.3 | -135.6 | -0.9 | 112.8 | |||||
| 15 | S | 51.4 | Low | 55.9 | Low | 124 Ų | 124 | 144 Ų | 144 | 87% | 0.867 | 80% | 0.795 | S | S | * | * | trans | -171.9 | 103.3 | 140.4 | -75.6 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 16 | V | 52.5 | Low | 55.4 | Low | 144 Ų | 144 | 145.2 Ų | 145.2 | 87% | 0.873 | 80% | 0.798 | S | S | * | * | trans | -85.8 | 121.7 | 158.4 | 162.4 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 17 | A | 57.6 | Low | 55.6 | Low | 96 Ų | 96 | 144.4 Ų | 144.4 | 79% | 0.793 | 80% | 0.795 | S | S | * | * | trans | -130.2 | 110.7 | 165.6 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 18 | L | 56.8 | Low | 55.3 | Low | 153 Ų | 153 | 144.1 Ų | 144.1 | 80% | 0.801 | 79% | 0.789 | S | S | * | * | trans | -51.4 | 143.3 | 158.4 | -76.9 | 126 | 0 | 0 | 0 | 110.3 | ||||
| 19 | L | 57.5 | Low | 55.6 | Low | 164 Ų | 164 | 146.1 Ų | 146.1 | 86% | 0.859 | 79% | 0.792 | S | S | * | * | trans | 172.3 | 101.6 | 138.9 | -90.6 | 148.5 | 0 | 0 | 0 | 105.9 | ||||
| 20 | S | 55.7 | Low | 55.5 | Low | 115 Ų | 115 | 151.8 Ų | 151.8 | 80% | 0.804 | 80% | 0.803 | S | S | * | * | 57.2 | 98 | 98.1 | -174.8 | 0 | 0 | 0 | 0 | 111.7 | |||||
| 21 | G | 55.9 | Low | 55.6 | Low | 61 Ų | 61 | 149.8 Ų | 149.8 | 63% | 0.629 | 80% | 0.801 | S | S | * | * | trans | 178.4 | 42.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y23 | G21-Y23 VanDerWaalsContact C-N 3.27Å; G21-Y23 PolarHBondContact O-N 3.47Å | ||
| 22 | R | 58.4 | Low | 55.5 | Low | 250 Ų | 250 | 149.7 Ų | 149.7 | 94% | 0.943 | 81% | 0.806 | S | S | * | * | trans | -84.1 | 76.1 | 167.3 | -69.9 | -171.1 | -175.1 | -153.3 | 2.7 | 108.5 | ||||
| 23 | Y | 59.2 | Low | 55.5 | Low | 207 Ų | 207 | 150.5 Ų | 150.5 | 81% | 0.812 | 81% | 0.805 | S | S | * | * | trans | -107.9 | 99.7 | 160.7 | -66.4 | -79.2 | 0 | 0 | 0 | 107.6 | G21 Q25 | G21-Y23 VanDerWaalsContact C-N 3.27Å; G21-Y23 PolarHBondContact O-N 3.47Å; Y23-Q25 PolarHBondContact O-N 2.88Å | ||
| 24 | L | 54.5 | Low | 55.6 | Low | 167 Ų | 167 | 151.5 Ų | 151.5 | 87% | 0.874 | 80% | 0.803 | S | S | * | * | trans | 24 | 81.9 | 149.2 | -69.3 | 158.4 | 0 | 0 | 0 | 115.2 | S26 | L24-S26 VanDerWaalsContact C-N 3.3Å; L24-S26 PolarHBondContact O-N 3.35Å | ||
| 25 | Q | 58.4 | Low | 55.7 | Low | 161 Ų | 161 | 145.6 Ų | 145.6 | 75% | 0.752 | 80% | 0.797 | S | S | * | * | trans | -64.1 | 99.8 | 150.3 | -109.3 | -173.7 | 3 | 0 | 0 | 106.5 | Y23 R27 | Y23-Q25 PolarHBondContact O-N 2.88Å; Q25-R27 PolarHBondContact O-N 3.17Å | ||
| 26 | S | 49.5 | Very low | 56.2 | Low | 108 Ų | 108 | 151 Ų | 151 | 76% | 0.755 | 80% | 0.799 | S | S | * | * | trans | -64.1 | 82 | 159.5 | 31.3 | 0 | 0 | 0 | 0 | 107.7 | L24 V28 | L24-S26 VanDerWaalsContact C-N 3.3Å; L24-S26 PolarHBondContact O-N 3.35Å; S26-V28 PolarHBondContact O-N 2.9Å | ||
| 27 | R | 58.4 | Low | 56.7 | Low | 189 Ų | 189 | 149.5 Ų | 149.5 | 71% | 0.713 | 79% | 0.792 | S | S | * | * | trans | -73.9 | 65 | 172.7 | -165.4 | -176.5 | -91.3 | -119.1 | 1.3 | 108.1 | Q25 W29 | Q25-R27 PolarHBondContact O-N 3.17Å; R27-W29 HydrophobicContact CG-CG 4.44Å; R27-W29 PolarHBondContact O-N 3.24Å | ||
| 28 | V | 52.8 | Low | 56.8 | Low | 128 Ų | 128 | 152.4 Ų | 152.4 | 78% | 0.776 | 79% | 0.793 | S | S | * | * | trans | -81.2 | 72.6 | 163.7 | -177.4 | 0 | 0 | 0 | 0 | 106.6 | S26 | S26-V28 PolarHBondContact O-N 2.9Š| ||
| 29 | W | 53.2 | Low | 57 | Low | 226 Ų | 226 | 153 Ų | 153 | 86% | 0.856 | 80% | 0.797 | S | S | * | * | trans | -103.2 | 70.8 | 165.2 | -80.9 | 85.5 | 0 | 0 | 0 | 106.9 | R27 | R27-W29 HydrophobicContact CG-CG 4.44Å; R27-W29 PolarHBondContact O-N 3.24Å | ||
| 30 | M | 51.5 | Low | 57.3 | Low | 183 Ų | 183 | 150.5 Ų | 150.5 | 90% | 0.901 | 79% | 0.793 | S | S | * | * | trans | -151.3 | 121.1 | 165.6 | -74.8 | -155.3 | -139.7 | 0 | 0 | 108.8 | ||||
| 31 | G | 57.7 | Low | 58 | Low | 72 Ų | 72 | 152.6 Ų | 152.6 | 74% | 0.742 | 79% | 0.794 | S | S | * | * | trans | 119.8 | 38.6 | 146.4 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 32 | L | 56.6 | Low | 58.8 | Low | 175 Ų | 175 | 158.2 Ų | 158.2 | 92% | 0.916 | 80% | 0.804 | S | S | * | * | trans | -141.1 | 94.1 | 154.6 | -100.2 | 153.8 | 0 | 0 | 0 | 109.7 | ||||
| 33 | P | 56.6 | Low | 59.9 | Low | 94 Ų | 94 | 154.3 Ų | 154.3 | 61% | 0.61 | 80% | 0.796 | S | S | * | * | trans | -75.6 | 161.6 | 162.7 | 35.4 | -30.4 | 0 | 0 | 0 | 109.2 | ||||
| 34 | D | 59.7 | Low | 60.9 | Low | 129 Ų | 129 | 149.2 Ų | 149.2 | 69% | 0.69 | 80% | 0.798 | S | S | * | * | trans | 83.2 | 65.8 | 161.3 | -45.5 | -29.3 | 0 | 0 | 0 | 116.2 | W36 | D34-W36 PolarHBondContact O-N 3.07Š| ||
| 35 | S | 56.4 | Low | 62.4 | Low | 111 Ų | 111 | 152.5 Ų | 152.5 | 78% | 0.776 | 80% | 0.798 | S | S | * | * | 8.4 | 87.6 | 123.1 | 56.9 | 0 | 0 | 0 | 0 | 115.7 | P37 | S35-P37 VanDerWaalsContact O-CD 3.26Å; S35-P37 WeakPolarHBondContact O-CD 3.5Å | |||
| 36 | W | 60.6 | Low | 63.8 | Low | 238 Ų | 238 | 148.2 Ų | 148.2 | 90% | 0.902 | 80% | 0.798 | S | S | * | * | trans | -73.2 | 115.9 | 151.3 | -71.7 | -44.3 | 0 | 0 | 0 | 107.4 | D34 L38 | D34-W36 PolarHBondContact O-N 3.07Å; W36-L38 PolarHBondContact O-N 3.45Å | ||
| 37 | P | 63.7 | Low | 65.7 | Low | 113 Ų | 113 | 154.7 Ų | 154.7 | 73% | 0.734 | 81% | 0.806 | S | S | * | * | trans | -69 | 97.1 | 160.7 | 29.8 | -26.7 | 0 | 0 | 0 | 104.8 | S35 L39 | S35-P37 VanDerWaalsContact O-CD 3.26Å; S35-P37 WeakPolarHBondContact O-CD 3.5Å; P37-L39 VanDerWaalsContact C-N 3.32Å; P37-L39 PolarHBondContact O-N 3.26Å | ||
| 38 | L | 60.5 | Low | 67.2 | Low | 156 Ų | 156 | 150.1 Ų | 150.1 | 82% | 0.817 | 81% | 0.808 | S | S | * | * | trans | -51.7 | 111.7 | 155.7 | -71.8 | 173 | 0 | 0 | 0 | 104.4 | W36 S40 | W36-L38 PolarHBondContact O-N 3.45Å; L38-S40 PolarHBondContact O-N 3.1Å | ||
| 39 | L | 60.5 | Low | 69.1 | Low | 167 Ų | 167 | 154.9 Ų | 154.9 | 87% | 0.874 | 81% | 0.812 | S | S | * | * | trans | -53.9 | 88 | 174.2 | -76.1 | 159.8 | 0 | 0 | 0 | 106.8 | P37 L41 | P37-L39 VanDerWaalsContact C-N 3.32Å; P37-L39 PolarHBondContact O-N 3.26Å; L39-L41 PolarHBondContact O-N 2.88Å | ||
| 40 | S | 64.6 | Low | 71 | Confident | 110 Ų | 110 | 147.2 Ų | 147.2 | 77% | 0.769 | 80% | 0.803 | S | S | * | * | trans | -69 | 92.2 | 166.5 | 44.4 | 0 | 0 | 0 | 0 | 103.8 | L38 Q42 | L38-S40 PolarHBondContact O-N 3.1Å; S40-Q42 PolarHBondContact O-N 2.8Å | ||
| 41 | L | 68.5 | Low | 73.1 | Confident | 160 Ų | 160 | 143.9 Ų | 143.9 | 84% | 0.838 | 79% | 0.789 | S | S | * | * | trans | -62.1 | 83.2 | 168.7 | -129.3 | 155.8 | 0 | 0 | 0 | 105.3 | L39 Q43 | L39-L41 PolarHBondContact O-N 2.88Å; L41-Q43 PolarHBondContact O-N 3.21Å | ||
| 42 | Q | 74.1 | Confident | 74.9 | Confident | 178 Ų | 178 | 146.6 Ų | 146.6 | 83% | 0.832 | 78% | 0.783 | S | S | * | * | trans | -61.5 | 112.3 | -178.7 | -176.4 | 171 | 3.3 | 0 | 0 | 106.2 | S40 A44 | S40-Q42 PolarHBondContact O-N 2.8Å; Q42-A44 PolarHBondContact O-N 2.73Å | ||
| 43 | Q | 81.2 | Confident | 76.8 | Confident | 168 Ų | 168 | 146.5 Ų | 146.5 | 79% | 0.785 | 77% | 0.771 | S | S | * | * | trans | -55.9 | 112.1 | 177.3 | -70.6 | 176.2 | -38.6 | 0 | 0 | 108.4 | L41 R45 | L41-Q43 PolarHBondContact O-N 3.21Å; Q43-R45 PolarHBondContact O-N 2.7Å | ||
| 44 | A | 80.4 | Confident | 78.7 | Confident | 101 Ų | 101 | 148.1 Ų | 148.1 | 84% | 0.835 | 77% | 0.77 | S | S | * | * | trans | -66 | 104 | 172.5 | 0 | 0 | 0 | 0 | 0 | 108.1 | Q42 | Q42-A44 PolarHBondContact O-N 2.73Š| ||
| 45 | R | 86 | Confident | 80.5 | Confident | 235 Ų | 235 | 146.5 Ų | 146.5 | 89% | 0.887 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -71 | 130.7 | 172.4 | -67.4 | -178 | 178.3 | 168.3 | -0.4 | 108.9 | Q43 | Q43-R45 PolarHBondContact O-N 2.7Š|
| 46 | G | 87.1 | Confident | 82.5 | Confident | 72 Ų | 72 | 143.3 Ų | 143.3 | 74% | 0.742 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -63 | 161 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||
| 47 | R | 89 | Confident | 84.3 | Confident | 244 Ų | 244 | 137.3 Ų | 137.3 | 92% | 0.921 | 73% | 0.73 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 146.3 | 171.4 | -63 | -66 | -173.3 | 178.1 | 0.2 | 110.1 | ||
| 48 | A | 90.3 | Very high | 86 | Confident | 93 Ų | 93 | 137.9 Ų | 137.9 | 77% | 0.769 | 73% | 0.726 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 136.2 | 172.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||
| 49 | R | 92.9 | Very high | 87.8 | Confident | 228 Ų | 228 | 137 Ų | 137 | 86% | 0.86 | 72% | 0.715 | S | S | * | * | P | Polyproline II helix | trans | -84.8 | 171.6 | 166.6 | -67.8 | -173.1 | -178.4 | 170.1 | 0.8 | 109.8 | E52 | R49-E52 WeakPolarHBondContact CB-OE1 3.4Š|
| 50 | G | 93.8 | Very high | 89.6 | Confident | 65 Ų | 65 | 132.7 Ų | 132.7 | 67% | 0.67 | 69% | 0.688 | S | S | * | * | trans | 118.1 | -4.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | E52 | G50-E52 WeakPolarHBondContact CA-OE2 3.44Å; G50-E52 PolarHBondContact N-OE1 3.4Å; G50-E52 PolarHBondContact N-OE2 2.85Å; G50-E52 VanDerWaalsContact N-OE2 3.12Å | ||
| 51 | N | 94.1 | Very high | 91.2 | Very high | 112 Ų | 112 | 132 Ų | 132 | 60% | 0.599 | 67% | 0.671 | S | S | * | * | trans | -101.8 | 20.6 | 175.6 | 72.1 | -15.6 | 0 | 0 | 0 | 112.7 | Y53 Q54 | N51-Y53 VanDerWaalsContact C-N 3.28Å; N51-Y53 PolarHBondContact O-N 2.72Å; N51-Q54 WeakPolarHBondContact O-CG 3.44Å; N51-Q54 PolarHBondContact O-NE2 2.99Å | ||
| 52 | E | 96.8 | Very high | 92.6 | Very high | 130 Ų | 130 | 130.8 Ų | 130.8 | 61% | 0.607 | 66% | 0.66 | S | S | * | * | trans | -63.1 | -37.3 | -177 | -62.7 | 73.7 | -159 | 0 | 0 | 111.7 | R49 G50 Q54 | R49-E52 WeakPolarHBondContact CB-OE1 3.4Å; G50-E52 WeakPolarHBondContact CA-OE2 3.44Å; G50-E52 PolarHBondContact N-OE1 3.4Å; G50-E52 PolarHBondContact N-OE2 2.85Å; G50-E52 VanDerWaalsContact N-OE2 3.12Å; E52-Q54 PolarHBondContact O-N 3.2Å | ||
| 53 | Y | 96.5 | Very high | 93.7 | Very high | 172 Ų | 172 | 128.7 Ų | 128.7 | 68% | 0.675 | 65% | 0.649 | S | S | * | * | trans | -85.6 | 100.4 | 174.7 | -176.3 | -113.2 | 0 | 0 | 0 | 110.6 | N51 P55 | N51-Y53 VanDerWaalsContact C-N 3.28Å; N51-Y53 PolarHBondContact O-N 2.72Å; Y53-P55 HydrophobicContact CE1-CB 3.86Å; Y53-P55 HydrophobicContact CE1-CG 4.44Å | ||
| 54 | Q | 97 | Very high | 94.5 | Very high | 128 Ų | 128 | 124.3 Ų | 124.3 | 60% | 0.598 | 63% | 0.628 | S | S | * | * | trans | -104.9 | 106.4 | 167.5 | -63.3 | -54.7 | -50.4 | 0 | 0 | 109.5 | N51 E52 S56 | N51-Q54 WeakPolarHBondContact O-CG 3.44Å; N51-Q54 PolarHBondContact O-NE2 2.99Å; E52-Q54 PolarHBondContact O-N 3.2Å; Q54-S56 PolarHBondContact O-N 2.99Å | ||
| 55 | P | 97.3 | Very high | 95.4 | Very high | 95 Ų | 95 | 119.7 Ų | 119.7 | 62% | 0.617 | 59% | 0.59 | S | S | * | * | trans | -66.8 | 127.9 | -168.1 | 25.5 | -33.3 | 0 | 0 | 0 | 111.3 | Y53 | Y53-P55 HydrophobicContact CE1-CB 3.86Å; Y53-P55 HydrophobicContact CE1-CG 4.44Å | ||
| 56 | S | 98.4 | Very high | 96 | Very high | 44 Ų | 44 | 114.3 Ų | 114.3 | 31% | 0.308 | 57% | 0.57 | S | S | . | * | trans | -148.1 | 117.5 | 171.4 | 45 | 0 | 0 | 0 | 0 | 109.5 | Q54 I58 K59 R60 | Q54-S56 PolarHBondContact O-N 2.99Å; S56-I58 VanDerWaalsContact C-N 3.32Å; S56-I58 PolarHBondContact O-N 3.36Å; S56-K59 PolarHBondContact O-N 2.97Å; S56-K59 WeakPolarHBondContact OG-CB 3.47Å; S56-K59 VanDerWaalsContact OG-CD 3.25Å; S56-K59 WeakPolarHBondContact OG-CD 3.37Å; S56-K59 VanDerWaalsContact OG-CG 3.25Å; S56-K59 WeakPolarHBondContact OG-CG 3.48Å; S56-R60 PolarHBondContact O-N 3.19Å | ||
| 57 | N | 98.2 | Very high | 96.5 | Very high | 113 Ų | 113 | 116.5 Ų | 116.5 | 60% | 0.604 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -63 | -39.4 | -175.2 | -78.8 | -46.4 | 0 | 0 | 0 | 112.4 | R60 K61 | N57-R60 PolarHBondContact O-N 3.14Å; N57-R60 PolarHBondContact OD1-NE 3.34Å; N57-R60 PolarHBondContact OD1-NH2 2.71Å; N57-K61 WeakPolarHBondContact O-CG 3.47Å; N57-K61 PolarHBondContact O-N 2.93Å |
| 58 | I | 98.3 | Very high | 97 | Very high | 124 Ų | 124 | 110.9 Ų | 110.9 | 64% | 0.636 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -57.7 | -52.4 | 176.4 | -60.2 | 168.4 | 0 | 0 | 0 | 110.2 | S56 R60 K61 H62 | S56-I58 VanDerWaalsContact C-N 3.32Å; S56-I58 PolarHBondContact O-N 3.36Å; I58-R60 VanDerWaalsContact C-N 3.32Å; I58-R60 PolarHBondContact O-N 3.05Å; I58-K61 PolarHBondContact O-N 3.45Å; I58-H62 WeakPolarHBondContact O-CB 3.36Å; I58-H62 PolarHBondContact O-N 3.4Å |
| 59 | K | 98.2 | Very high | 97.4 | Very high | 137 Ų | 137 | 109.3 Ų | 109.3 | 60% | 0.596 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -61.4 | -41.4 | 178.6 | -60.6 | -170.4 | -174 | 168.8 | 0 | 111.3 | S56 K63 | S56-K59 PolarHBondContact O-N 2.97Å; S56-K59 WeakPolarHBondContact OG-CB 3.47Å; S56-K59 VanDerWaalsContact OG-CD 3.25Å; S56-K59 WeakPolarHBondContact OG-CD 3.37Å; S56-K59 VanDerWaalsContact OG-CG 3.25Å; S56-K59 WeakPolarHBondContact OG-CG 3.48Å; K59-K63 VanDerWaalsContact O-CB 3.27Å; K59-K63 WeakPolarHBondContact O-CB 3.35Å; K59-K63 VanDerWaalsContact O-CG 3.29Å; K59-K63 WeakPolarHBondContact O-CG 3.46Å; K59-K63 PolarHBondContact O-N 2.94Å |
| 60 | R | 98.5 | Very high | 97.6 | Very high | 78 Ų | 78 | 102.4 Ų | 102.4 | 29% | 0.294 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.1 | -48.9 | 179 | -177.8 | 174 | 61.3 | 83.3 | -4.2 | 112.1 | S56 N57 I58 H64 H92 | S56-R60 PolarHBondContact O-N 3.19Å; N57-R60 PolarHBondContact O-N 3.14Å; N57-R60 PolarHBondContact OD1-NE 3.34Å; N57-R60 PolarHBondContact OD1-NH2 2.71Å; I58-R60 VanDerWaalsContact C-N 3.32Å; I58-R60 PolarHBondContact O-N 3.05Å; R60-H64 PolarHBondContact O-N 3.37Å; R60-H92 HydrophobicContact CG-CB 4.22Å; R60-H92 PolarHBondContact NH1-OXT 3.24Å |
| 61 | K | 98.4 | Very high | 97.8 | Very high | 95 Ų | 95 | 102.9 Ų | 102.9 | 41% | 0.413 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -71.9 | -36.4 | -178.8 | -62.1 | -61.1 | -71.3 | -177.5 | 0 | 112.2 | N57 I58 G65 H92 | N57-K61 WeakPolarHBondContact O-CG 3.47Å; N57-K61 PolarHBondContact O-N 2.93Å; I58-K61 PolarHBondContact O-N 3.45Å; K61-G65 WeakPolarHBondContact O-CA 3.25Å; K61-G65 PolarHBondContact O-N 2.97Å; K61-H92 PolarHBondContact NZ-O 3.26Å; K61-H92 PolarHBondContact NZ-OXT 2.89Å |
| 62 | H | 98 | Very high | 98 | Very high | 134 Ų | 134 | 100 Ų | 100 | 62% | 0.62 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -67.7 | -40.9 | 174.2 | -69.5 | 178.8 | 0 | 0 | 0 | 113 | I58 R68 | I58-H62 WeakPolarHBondContact O-CB 3.36Å; I58-H62 PolarHBondContact O-N 3.4Å; H62-R68 WeakPolarHBondContact O-CB 3.39Å; H62-R68 WeakPolarHBondContact O-CD 3.43Å; H62-R68 VanDerWaalsContact O-CG 3.26Å; H62-R68 WeakPolarHBondContact O-CG 3.48Å |
| 63 | K | 97.8 | Very high | 98.1 | Very high | 135 Ų | 135 | 98.7 Ų | 98.7 | 59% | 0.587 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -80.8 | -36 | -177.3 | -69 | -172.9 | 177.2 | -160.6 | 0 | 113.6 | K59 | K59-K63 VanDerWaalsContact O-CB 3.27Å; K59-K63 WeakPolarHBondContact O-CB 3.35Å; K59-K63 VanDerWaalsContact O-CG 3.29Å; K59-K63 WeakPolarHBondContact O-CG 3.46Å; K59-K63 PolarHBondContact O-N 2.94Å |
| 64 | H | 98.3 | Very high | 98.2 | Very high | 76 Ų | 76 | 93.3 Ų | 93.3 | 35% | 0.352 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -133.3 | 7.6 | -168.8 | -44.9 | -53.6 | 0 | 0 | 0 | 114.6 | R60 S91 H92 | R60-H64 PolarHBondContact O-N 3.37Å; H64-S91 PolarHBondContact O-OG 3.11Å; H64-H92 HydrophobicContact CB-CB 4.27Å; H64-H92 WeakPolarHBondContact CB-CD2 3.26Å; H64-H92 PolarHBondContact O-N 3.03Å |
| 65 | G | 98.4 | Very high | 98.3 | Very high | 3 Ų | 3 | 87.4 Ų | 87.4 | 3% | 0.031 | 45% | 0.448 | C | S | . | . | S | Bend | trans | -70.9 | 168.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | K61 R68 R69 S91 | K61-G65 WeakPolarHBondContact O-CA 3.25Å; K61-G65 PolarHBondContact O-N 2.97Å; G65-R68 PolarHBondContact O-N 3.05Å; G65-R69 WeakPolarHBondContact O-CG 3.48Å; G65-R69 PolarHBondContact O-N 3.12Å; G65-S91 PolarHBondContact O-OG 2.89Å |
| 66 | W | 98.4 | Very high | 98.3 | Very high | 123 Ų | 123 | 85.5 Ų | 85.5 | 47% | 0.466 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -56.1 | -52 | -178.5 | 179.4 | -104.3 | 0 | 0 | 0 | 113.1 | R68 R69 L70 I79 L90 | W66-R68 VanDerWaalsContact C-N 3.28Å; W66-R68 PolarHBondContact O-N 3.25Å; W66-R69 WeakPolarHBondContact O-CB 3.12Å; W66-R69 PolarHBondContact O-N 3.38Å; W66-L70 HydrophobicContact CD2-CD1 4.44Å; W66-L70 HydrophobicContact CZ2-CD1 3.91Å; W66-L70 HydrophobicContact CZ2-CD2 4.23Å; W66-L70 HydrophobicContact CZ2-CG 4.37Å; W66-L70 PolarHBondContact O-N 3.1Å; W66-L70 VanDerWaalsContact O-N 3.11Å; W66-I79 HydrophobicContact CE3-CD1 4.25Å; W66-I79 HydrophobicContact CH2-CG2 4.16Å; W66-I79 HydrophobicContact CZ3-CD1 4.01Å; W66-I79 HydrophobicContact CZ3-CG1 4.39Å; W66-I79 HydrophobicContact CZ3-CG2 4Å; W66-L90 HydrophobicContact CZ3-CB 4.33Å; W66-L90 HydrophobicContact CZ3-CD1 4.27Å |
| 67 | V | 98.3 | Very high | 98.3 | Very high | 118 Ų | 118 | 89 Ų | 89 | 72% | 0.715 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -56 | -43.2 | -179.7 | 179.8 | 0 | 0 | 0 | 0 | 111.3 | R69 L70 S71 | V67-R69 VanDerWaalsContact C-N 3.28Å; V67-R69 PolarHBondContact O-N 3.41Å; V67-L70 PolarHBondContact O-N 3.02Å; V67-S71 PolarHBondContact O-N 3.24Å |
| 68 | R | 98.5 | Very high | 98.4 | Very high | 125 Ų | 125 | 85 Ų | 85 | 47% | 0.472 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -62.6 | -33.7 | 177.9 | -176.7 | 70 | -175.5 | 108.2 | -4.8 | 112.7 | H62 G65 W66 S71 | H62-R68 WeakPolarHBondContact O-CB 3.39Å; H62-R68 WeakPolarHBondContact O-CD 3.43Å; H62-R68 VanDerWaalsContact O-CG 3.26Å; H62-R68 WeakPolarHBondContact O-CG 3.48Å; G65-R68 PolarHBondContact O-N 3.05Å; W66-R68 VanDerWaalsContact C-N 3.28Å; W66-R68 PolarHBondContact O-N 3.25Å; R68-S71 PolarHBondContact NH1-OG 3.31Å; R68-S71 VanDerWaalsContact NH1-OG 3.16Å; R68-S71 PolarHBondContact O-OG 3.16Å; R68-S71 VanDerWaalsContact O-OG 3.13Å |
| 69 | R | 98.4 | Very high | 98.4 | Very high | 61 Ų | 61 | 79.5 Ų | 79.5 | 23% | 0.23 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -72.8 | -37.8 | 177.3 | -63.9 | -65.3 | -178.7 | 179.2 | -0.2 | 111.5 | G65 W66 V67 S71 G75 V76 I79 S91 | G65-R69 WeakPolarHBondContact O-CG 3.48Å; G65-R69 PolarHBondContact O-N 3.12Å; W66-R69 WeakPolarHBondContact O-CB 3.12Å; W66-R69 PolarHBondContact O-N 3.38Å; V67-R69 VanDerWaalsContact C-N 3.28Å; V67-R69 PolarHBondContact O-N 3.41Å; R69-S71 VanDerWaalsContact C-N 3.31Å; R69-G75 CarbonylContact O-C 3.01Å; R69-G75 WeakPolarHBondContact O-CA 3.37Å; R69-V76 PolarHBondContact O-N 3Å; R69-V76 VanDerWaalsContact O-N 3.1Å; R69-I79 HydrophobicContact CB-CD1 3.69Å; R69-I79 HydrophobicContact CB-CG1 3.96Å; R69-I79 HydrophobicContact CG-CD1 3.86Å; R69-S91 WeakPolarHBondContact CG-OG 3.45Å |
| 70 | L | 98.3 | Very high | 98.4 | Very high | 82 Ų | 82 | 77.7 Ų | 77.7 | 43% | 0.429 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -75.7 | -21.1 | 179.2 | -62 | -171.7 | 0 | 0 | 0 | 113.2 | W66 V67 T72 V76 | W66-L70 HydrophobicContact CD2-CD1 4.44Å; W66-L70 HydrophobicContact CZ2-CD1 3.91Å; W66-L70 HydrophobicContact CZ2-CD2 4.23Å; W66-L70 HydrophobicContact CZ2-CG 4.37Å; W66-L70 PolarHBondContact O-N 3.1Å; W66-L70 VanDerWaalsContact O-N 3.11Å; V67-L70 PolarHBondContact O-N 3.02Å; L70-T72 PolarHBondContact O-N 3.4Å; L70-V76 HydrophobicContact CD2-CG2 4.21Å |
| 71 | S | 98.3 | Very high | 98.4 | Very high | 76 Ų | 76 | 81.6 Ų | 81.6 | 53% | 0.531 | 41% | 0.409 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.6 | -12 | -178.1 | 86 | 0 | 0 | 0 | 0 | 114.5 | V67 R68 R69 | V67-S71 PolarHBondContact O-N 3.24Å; R68-S71 PolarHBondContact NH1-OG 3.31Å; R68-S71 VanDerWaalsContact NH1-OG 3.16Å; R68-S71 PolarHBondContact O-OG 3.16Å; R68-S71 VanDerWaalsContact O-OG 3.13Å; R69-S71 VanDerWaalsContact C-N 3.31Å |
| 72 | T | 98.5 | Very high | 98.4 | Very high | 50 Ų | 50 | 79.4 Ų | 79.4 | 31% | 0.307 | 40% | 0.398 | S | S | . | . | S | Bend | trans | -135.2 | 145.8 | 179.6 | 69.3 | 0 | 0 | 0 | 0 | 111.2 | L70 A74 G75 V76 | L70-T72 PolarHBondContact O-N 3.4Å; T72-A74 VanDerWaalsContact C-N 3.29Å; T72-A74 PolarHBondContact O-N 3.34Å; T72-G75 WeakPolarHBondContact O-CA 3.32Å; T72-G75 PolarHBondContact O-N 2.97Å; T72-G75 PolarHBondContact OG1-N 2.93Å; T72-G75 VanDerWaalsContact OG1-N 3.09Å; T72-V76 PolarHBondContact O-N 3.06Å |
| 73 | P | 98.5 | Very high | 98.4 | Very high | 104 Ų | 104 | 78.3 Ų | 78.3 | 68% | 0.675 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -60.9 | -38.6 | 178.9 | 22.9 | -33 | 0 | 0 | 0 | 112.1 | G75 V76 Q77 | P73-G75 VanDerWaalsContact C-N 3.3Å; P73-G75 PolarHBondContact O-N 3.27Å; P73-V76 PolarHBondContact O-N 3.23Å; P73-Q77 WeakPolarHBondContact O-CG 3.43Å; P73-Q77 PolarHBondContact O-N 3.32Å |
| 74 | A | 98.5 | Very high | 98.5 | Very high | 58 Ų | 58 | 79.4 Ų | 79.4 | 48% | 0.479 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -62.9 | -36.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | T72 Q77 V78 | T72-A74 VanDerWaalsContact C-N 3.29Å; T72-A74 PolarHBondContact O-N 3.34Å; A74-Q77 PolarHBondContact O-N 2.91Å; A74-V78 WeakPolarHBondContact O-CG2 3.25Å; A74-V78 PolarHBondContact O-N 3.37Å; A74-V78 VanDerWaalsContact O-N 3.12Å |
| 75 | G | 98.5 | Very high | 98.5 | Very high | 5 Ų | 5 | 82.4 Ų | 82.4 | 5% | 0.052 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -66.5 | -40.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | R69 T72 P73 V78 I79 | R69-G75 CarbonylContact O-C 3.01Å; R69-G75 WeakPolarHBondContact O-CA 3.37Å; T72-G75 WeakPolarHBondContact O-CA 3.32Å; T72-G75 PolarHBondContact O-N 2.97Å; T72-G75 PolarHBondContact OG1-N 2.93Å; T72-G75 VanDerWaalsContact OG1-N 3.09Å; P73-G75 VanDerWaalsContact C-N 3.3Å; P73-G75 PolarHBondContact O-N 3.27Å; G75-V78 WeakPolarHBondContact O-CB 3.25Å; G75-V78 PolarHBondContact O-N 3.34Å; G75-V78 VanDerWaalsContact O-N 3.16Å; G75-I79 PolarHBondContact O-N 3.2Å |
| 76 | V | 98.5 | Very high | 98.5 | Very high | 54 Ų | 54 | 85.3 Ų | 85.3 | 33% | 0.327 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -60.8 | -45.4 | 172.9 | 176.9 | 0 | 0 | 0 | 0 | 110.7 | R69 L70 T72 P73 V78 I79 L80 | R69-V76 PolarHBondContact O-N 3Å; R69-V76 VanDerWaalsContact O-N 3.1Å; L70-V76 HydrophobicContact CD2-CG2 4.21Å; T72-V76 PolarHBondContact O-N 3.06Å; P73-V76 PolarHBondContact O-N 3.23Å; V76-V78 PolarHBondContact O-N 3.33Å; V76-I79 WeakPolarHBondContact O-CA 3.17Å; V76-I79 WeakPolarHBondContact O-CB 3.49Å; V76-I79 PolarHBondContact O-N 3.16Å; V76-L80 HydrophobicContact CG1-CD1 4.33Å; V76-L80 HydrophobicContact CG1-CG 4.48Å; V76-L80 PolarHBondContact O-N 3.09Å |
| 77 | Q | 98.6 | Very high | 98.5 | Very high | 117 Ų | 117 | 86 Ų | 86 | 55% | 0.547 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -59.7 | -32.3 | 175.1 | -68.3 | 173.7 | 7.8 | 0 | 0 | 113 | P73 A74 R81 | P73-Q77 WeakPolarHBondContact O-CG 3.43Å; P73-Q77 PolarHBondContact O-N 3.32Å; A74-Q77 PolarHBondContact O-N 2.91Å; Q77-R81 WeakPolarHBondContact O-CG 3.27Å; Q77-R81 PolarHBondContact O-N 3.01Å; Q77-R81 PolarHBondContact O-NE 3.4Å |
| 78 | V | 98.4 | Very high | 98.5 | Very high | 31 Ų | 31 | 91 Ų | 91 | 19% | 0.188 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -65.5 | -41.2 | 172.4 | 172.3 | 0 | 0 | 0 | 0 | 111.1 | A74 G75 V76 R82 | A74-V78 WeakPolarHBondContact O-CG2 3.25Å; A74-V78 PolarHBondContact O-N 3.37Å; A74-V78 VanDerWaalsContact O-N 3.12Å; G75-V78 WeakPolarHBondContact O-CB 3.25Å; G75-V78 PolarHBondContact O-N 3.34Å; G75-V78 VanDerWaalsContact O-N 3.16Å; V76-V78 PolarHBondContact O-N 3.33Å; V78-R82 WeakPolarHBondContact O-CG 3.44Å; V78-R82 PolarHBondContact O-N 3.13Å; V78-R82 VanDerWaalsContact O-N 3.14Å |
| 79 | I | 98.5 | Very high | 98.4 | Very high | 7 Ų | 7 | 89.1 Ų | 89.1 | 4% | 0.036 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -61.4 | -50.7 | 175.6 | -56.4 | -57.8 | 0 | 0 | 0 | 110.1 | W66 R69 G75 V76 R81 R82 M83 L90 | W66-I79 HydrophobicContact CE3-CD1 4.25Å; W66-I79 HydrophobicContact CH2-CG2 4.16Å; W66-I79 HydrophobicContact CZ3-CD1 4.01Å; W66-I79 HydrophobicContact CZ3-CG1 4.39Å; W66-I79 HydrophobicContact CZ3-CG2 4Å; R69-I79 HydrophobicContact CB-CD1 3.69Å; R69-I79 HydrophobicContact CB-CG1 3.96Å; R69-I79 HydrophobicContact CG-CD1 3.86Å; G75-I79 PolarHBondContact O-N 3.2Å; V76-I79 WeakPolarHBondContact O-CA 3.17Å; V76-I79 WeakPolarHBondContact O-CB 3.49Å; V76-I79 PolarHBondContact O-N 3.16Å; I79-R81 VanDerWaalsContact C-N 3.34Å; I79-R81 PolarHBondContact O-N 2.81Å; I79-R82 WeakPolarHBondContact O-CA 3.29Å; I79-R82 WeakPolarHBondContact O-CB 3.36Å; I79-R82 PolarHBondContact O-N 3.36Å; I79-M83 HydrophobicContact CG2-CG 4.27Å; I79-M83 HydrophobicContact CG2-SD 3.84Å; I79-M83 WeakPolarHBondContact O-CG 3.26Å; I79-M83 PolarHBondContact O-N 2.94Å; I79-L90 HydrophobicContact CG2-CD1 4.18Å |
| 80 | L | 98.5 | Very high | 98.4 | Very high | 99 Ų | 99 | 88.5 Ų | 88.5 | 52% | 0.518 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -57.4 | -45.2 | -179.1 | -66.9 | 176 | 0 | 0 | 0 | 112 | V76 R82 M83 L84 | V76-L80 HydrophobicContact CG1-CD1 4.33Å; V76-L80 HydrophobicContact CG1-CG 4.48Å; V76-L80 PolarHBondContact O-N 3.09Å; L80-R82 VanDerWaalsContact C-N 3.29Å; L80-R82 PolarHBondContact O-N 3.33Å; L80-M83 HydrophobicContact CD2-SD 4.39Å; L80-M83 PolarHBondContact O-N 3.2Å; L80-L84 WeakPolarHBondContact O-CB 3.45Å; L80-L84 PolarHBondContact O-N 3.17Å |
| 81 | R | 98.7 | Very high | 98.4 | Very high | 160 Ų | 160 | 85.8 Ų | 85.8 | 60% | 0.604 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -61.8 | -35 | 175.2 | -73.8 | -176.4 | -68.1 | 167.9 | -6.3 | 113.1 | Q77 I79 K85 | Q77-R81 WeakPolarHBondContact O-CG 3.27Å; Q77-R81 PolarHBondContact O-N 3.01Å; Q77-R81 PolarHBondContact O-NE 3.4Å; I79-R81 VanDerWaalsContact C-N 3.34Å; I79-R81 PolarHBondContact O-N 2.81Å; R81-K85 WeakPolarHBondContact O-CB 3.42Å; R81-K85 PolarHBondContact O-N 2.99Å; R81-K85 VanDerWaalsContact O-N 3.1Å |
| 82 | R | 98.8 | Very high | 98.3 | Very high | 50 Ų | 50 | 87.5 Ų | 87.5 | 19% | 0.189 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -73.5 | -35.8 | 176.8 | -72.6 | -170.4 | -62 | -163.5 | 10.2 | 112.6 | V78 I79 L80 K85 G86 R87 L90 | V78-R82 WeakPolarHBondContact O-CG 3.44Å; V78-R82 PolarHBondContact O-N 3.13Å; V78-R82 VanDerWaalsContact O-N 3.14Å; I79-R82 WeakPolarHBondContact O-CA 3.29Å; I79-R82 WeakPolarHBondContact O-CB 3.36Å; I79-R82 PolarHBondContact O-N 3.36Å; L80-R82 VanDerWaalsContact C-N 3.29Å; L80-R82 PolarHBondContact O-N 3.33Å; R82-K85 PolarHBondContact O-N 3.12Å; R82-G86 PolarHBondContact O-N 3.01Å; R82-R87 HydrophobicContact CB-CB 4.42Å; R82-R87 HydrophobicContact CB-CG 4.32Å; R82-R87 HydrophobicContact CG-CG 4.45Å; R82-R87 PolarHBondContact O-N 2.7Å; R82-R87 VanDerWaalsContact O-N 3.07Å; R82-L90 HydrophobicContact CB-CD2 3.83Å; R82-L90 PolarHBondContact NE-O 2.64Å; R82-L90 PolarHBondContact NH1-O 2.84Å; R82-L90 PolarHBondContact NH2-O 3.05Å |
| 83 | M | 98.5 | Very high | 98.3 | Very high | 110 Ų | 110 | 89.4 Ų | 89.4 | 54% | 0.542 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -64.3 | -48.7 | 172.5 | -68.6 | 170.4 | 66.9 | 0 | 0 | 110.7 | I79 L80 K85 G86 L90 | I79-M83 HydrophobicContact CG2-CG 4.27Å; I79-M83 HydrophobicContact CG2-SD 3.84Å; I79-M83 WeakPolarHBondContact O-CG 3.26Å; I79-M83 PolarHBondContact O-N 2.94Å; L80-M83 HydrophobicContact CD2-SD 4.39Å; L80-M83 PolarHBondContact O-N 3.2Å; M83-K85 PolarHBondContact O-N 2.99Å; M83-G86 WeakPolarHBondContact O-CA 3.02Å; M83-G86 PolarHBondContact O-N 2.8Å; M83-L90 HydrophobicContact CG-CD1 3.77Å; M83-L90 HydrophobicContact CG-CD2 3.79Å; M83-L90 HydrophobicContact CG-CG 4.46Å; M83-L90 HydrophobicContact SD-CD1 4.38Å |
| 84 | L | 98.5 | Very high | 98.3 | Very high | 158 Ų | 158 | 88.6 Ų | 88.6 | 83% | 0.827 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -57.7 | -37 | 176.4 | -177.6 | 63.7 | 0 | 0 | 0 | 112.1 | L80 G86 | L80-L84 WeakPolarHBondContact O-CB 3.45Å; L80-L84 PolarHBondContact O-N 3.17Å; L84-G86 VanDerWaalsContact C-N 3.29Å; L84-G86 PolarHBondContact O-N 2.88Å |
| 85 | K | 98.4 | Very high | 98.3 | Very high | 140 Ų | 140 | 90.3 Ų | 90.3 | 61% | 0.609 | 45% | 0.451 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.6 | -12.4 | 175.2 | -171.6 | 161 | -172.7 | 167.5 | 0 | 113.9 | R81 R82 M83 R87 | R81-K85 WeakPolarHBondContact O-CB 3.42Å; R81-K85 PolarHBondContact O-N 2.99Å; R81-K85 VanDerWaalsContact O-N 3.1Å; R82-K85 PolarHBondContact O-N 3.12Å; M83-K85 PolarHBondContact O-N 2.99Å; K85-R87 HydrophobicContact CB-CG 4.39Å; K85-R87 VanDerWaalsContact CE-CZ 3.48Å; K85-R87 HydrophobicContact CG-CG 4.37Å |
| 86 | G | 98.3 | Very high | 98.3 | Very high | 64 Ų | 64 | 95.3 Ų | 95.3 | 66% | 0.66 | 48% | 0.475 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 70.4 | 36.2 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | R82 M83 L84 | R82-G86 PolarHBondContact O-N 3.01Å; M83-G86 WeakPolarHBondContact O-CA 3.02Å; M83-G86 PolarHBondContact O-N 2.8Å; L84-G86 VanDerWaalsContact C-N 3.29Å; L84-G86 PolarHBondContact O-N 2.88Å |
| 87 | R | 98.4 | Very high | 98.3 | Very high | 136 Ų | 136 | 97.9 Ų | 97.9 | 51% | 0.513 | 48% | 0.484 | S | S | . | . | trans | -71.5 | 130.9 | 177.6 | -63.7 | -60.5 | -161 | -177.7 | 7.1 | 111.2 | R82 K85 S89 | R82-R87 HydrophobicContact CB-CB 4.42Å; R82-R87 HydrophobicContact CB-CG 4.32Å; R82-R87 HydrophobicContact CG-CG 4.45Å; R82-R87 PolarHBondContact O-N 2.7Å; R82-R87 VanDerWaalsContact O-N 3.07Å; K85-R87 HydrophobicContact CB-CG 4.39Å; K85-R87 VanDerWaalsContact CE-CZ 3.48Å; K85-R87 HydrophobicContact CG-CG 4.37Å; R87-S89 VanDerWaalsContact C-N 3.34Å; R87-S89 PolarHBondContact O-N 2.95Å | ||
| 88 | K | 98.2 | Very high | 98.2 | Very high | 224 Ų | 224 | 96.6 Ų | 96.6 | 97% | 0.974 | 48% | 0.48 | S | S | * | . | S | Bend | trans | -55.2 | -44.6 | 176.6 | -176.1 | 175.9 | -178.4 | 176.3 | 0 | 113 | ||
| 89 | S | 97.8 | Very high | 98.2 | Very high | 85 Ų | 85 | 101.3 Ų | 101.3 | 59% | 0.594 | 50% | 0.501 | S | S | * | . | trans | -105.3 | 120.1 | 173.8 | 60.9 | 0 | 0 | 0 | 0 | 109.7 | R87 | R87-S89 VanDerWaalsContact C-N 3.34Å; R87-S89 PolarHBondContact O-N 2.95Å | ||
| 90 | L | 98.1 | Very high | 98.2 | Very high | 49 Ų | 49 | 108.5 Ų | 108.5 | 26% | 0.257 | 54% | 0.536 | S | S | . | . | S | Bend | trans | -73.5 | -85.2 | 168.2 | -57.2 | -180 | 0 | 0 | 0 | 107.3 | W66 I79 R82 M83 | W66-L90 HydrophobicContact CZ3-CB 4.33Å; W66-L90 HydrophobicContact CZ3-CD1 4.27Å; I79-L90 HydrophobicContact CG2-CD1 4.18Å; R82-L90 HydrophobicContact CB-CD2 3.83Å; R82-L90 PolarHBondContact NE-O 2.64Å; R82-L90 PolarHBondContact NH1-O 2.84Å; R82-L90 PolarHBondContact NH2-O 3.05Å; M83-L90 HydrophobicContact CG-CD1 3.77Å; M83-L90 HydrophobicContact CG-CD2 3.79Å; M83-L90 HydrophobicContact CG-CG 4.46Å; M83-L90 HydrophobicContact SD-CD1 4.38Å |
| 91 | S | 97.5 | Very high | 98.2 | Very high | 24 Ų | 24 | 109.3 Ų | 109.3 | 17% | 0.168 | 54% | 0.538 | C | S | . | . | trans | -93.8 | 173 | 179.5 | -130.6 | 0 | 0 | 0 | 0 | 114.1 | H64 G65 R69 | H64-S91 PolarHBondContact O-OG 3.11Å; G65-S91 PolarHBondContact O-OG 2.89Å; R69-S91 WeakPolarHBondContact CG-OG 3.45Å | ||
| 92 | H | 97.1 | Very high | 98.1 | Very high | 112 Ų | 112 | 104.7 Ų | 104.7 | 52% | 0.519 | 53% | 0.532 | S | S | . | . | trans | -70.9 | 0 | 164.1 | -70.9 | -88.8 | 0 | 0 | 0 | 112.1 | R60 K61 H64 | R60-H92 HydrophobicContact CG-CB 4.22Å; R60-H92 PolarHBondContact NH1-OXT 3.24Å; K61-H92 PolarHBondContact NZ-O 3.26Å; K61-H92 PolarHBondContact NZ-OXT 2.89Å; H64-H92 HydrophobicContact CB-CB 4.27Å; H64-H92 WeakPolarHBondContact CB-CD2 3.26Å; H64-H92 PolarHBondContact O-N 3.03Å |
Retrieved 92 of 92 residues in 154.7 ms
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