| 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 | 41.2 | Very low | 48.2 | Very low | 248 Ų | 248 | 149.7 Ų | 149.7 | 100% | 1.222 | 82% | 0.815 | S | S | * | * | 0 | 121.5 | 0 | -85.6 | 167.3 | 154.4 | 0 | 0 | 107.6 | |||||
| 2 | N | 45.6 | Very low | 48.2 | Very low | 162 Ų | 162 | 146.3 Ų | 146.3 | 87% | 0.866 | 81% | 0.806 | S | S | * | * | trans | 56.3 | 99.9 | -179.1 | -81.3 | -11.3 | 0 | 0 | 0 | 120.8 | ||||
| 3 | P | 51.7 | Low | 48 | Very low | 104 Ų | 104 | 144.7 Ų | 144.7 | 68% | 0.675 | 81% | 0.812 | S | S | * | * | trans | -85.6 | -172.7 | 155.4 | 38.3 | -28.1 | 0 | 0 | 0 | 110.5 | ||||
| 4 | D | 48.2 | Very low | 48.1 | Very low | 144 Ų | 144 | 144.9 Ų | 144.9 | 77% | 0.77 | 81% | 0.809 | S | S | * | * | trans | 80 | 90.4 | 166.9 | -66.4 | -34.2 | 0 | 0 | 0 | 119.2 | ||||
| 5 | V | 52.9 | Low | 47.9 | Very low | 149 Ų | 149 | 145.7 Ų | 145.7 | 90% | 0.903 | 81% | 0.811 | S | S | * | * | -127.5 | 81.7 | 127.2 | -174.9 | 0 | 0 | 0 | 0 | 106.9 | M7 | V5-M7 PolarHBondContact O-N 3.37Š| |||
| 6 | G | 47.2 | Very low | 47.6 | Very low | 57 Ų | 57 | 146.7 Ų | 146.7 | 59% | 0.588 | 81% | 0.813 | S | S | * | * | trans | -64.2 | 121.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | M8 | G6-M8 VanDerWaalsContact C-N 3.3Å; G6-M8 PolarHBondContact O-N 3.3Å | ||
| 7 | M | 51.7 | Low | 47.3 | Very low | 154 Ų | 154 | 145.5 Ų | 145.5 | 76% | 0.759 | 81% | 0.81 | S | S | * | * | trans | -69.5 | 84.4 | 166.4 | -69.5 | -78.4 | -76.9 | 0 | 0 | 109 | V5 Y9 | V5-M7 PolarHBondContact O-N 3.37Å; M7-Y9 HydrophobicContact CE-CE2 3.89Å; M7-Y9 PolarHBondContact O-N 3.4Å | ||
| 8 | M | 51.7 | Low | 46.6 | Very low | 173 Ų | 173 | 143.8 Ų | 143.8 | 85% | 0.852 | 81% | 0.81 | S | S | * | * | trans | -89.8 | 92.3 | 171 | -73.8 | -164.1 | 163.4 | 0 | 0 | 110.2 | G6 N10 | G6-M8 VanDerWaalsContact C-N 3.3Å; G6-M8 PolarHBondContact O-N 3.3Å; M8-N10 PolarHBondContact O-N 3.33Å | ||
| 9 | Y | 47.4 | Very low | 46.7 | Very low | 196 Ų | 196 | 143.2 Ų | 143.2 | 77% | 0.769 | 81% | 0.81 | S | S | * | * | trans | -68.9 | 107.1 | 157.4 | -82.1 | -90.5 | 0 | 0 | 0 | 108.7 | M7 | M7-Y9 HydrophobicContact CE-CE2 3.89Å; M7-Y9 PolarHBondContact O-N 3.4Å | ||
| 10 | N | 46.9 | Very low | 46.4 | Very low | 153 Ų | 153 | 143.4 Ų | 143.4 | 82% | 0.818 | 81% | 0.809 | S | S | * | * | trans | -110.5 | 121.1 | 163.5 | -95.8 | 18.1 | 0 | 0 | 0 | 109.2 | M8 | M8-N10 PolarHBondContact O-N 3.33Š| ||
| 11 | S | 46 | Very low | 46.3 | Very low | 107 Ų | 107 | 141.7 Ų | 141.7 | 75% | 0.748 | 80% | 0.804 | S | S | * | * | trans | -128.8 | 165.4 | 168.9 | -53.2 | 0 | 0 | 0 | 0 | 108 | ||||
| 12 | P | 48.5 | Very low | 46.3 | Very low | 109 Ų | 109 | 141 Ų | 141 | 71% | 0.708 | 79% | 0.788 | S | S | * | * | -112.3 | 145.6 | -96.7 | 30.6 | -13.9 | 0 | 0 | 0 | 112.6 | L14 | P12-L14 PolarHBondContact O-N 2.99Š| |||
| 13 | S | 45.1 | Very low | 46 | Very low | 125 Ų | 125 | 138.7 Ų | 138.7 | 87% | 0.874 | 78% | 0.784 | S | S | * | * | trans | -89.2 | 88.9 | 170.4 | -57.5 | 0 | 0 | 0 | 0 | 110.4 | N15 | S13-N15 PolarHBondContact O-N 3.38Š| ||
| 14 | L | 49.9 | Very low | 45.5 | Very low | 148 Ų | 148 | 142.1 Ų | 142.1 | 78% | 0.775 | 79% | 0.793 | S | S | * | * | trans | -79.1 | 98.6 | 163.4 | -78.3 | 166 | 0 | 0 | 0 | 108.6 | P12 L16 | P12-L14 PolarHBondContact O-N 2.99Å; L14-L16 PolarHBondContact O-N 2.72Å; L14-L16 VanDerWaalsContact O-N 3.13Å | ||
| 15 | N | 45 | Very low | 45.3 | Very low | 156 Ų | 156 | 141.4 Ų | 141.4 | 83% | 0.834 | 79% | 0.794 | S | S | * | * | trans | -75.4 | 95.6 | 166.2 | -93.2 | -30 | 0 | 0 | 0 | 109 | S13 V17 | S13-N15 PolarHBondContact O-N 3.38Å; N15-V17 PolarHBondContact O-N 3.03Å | ||
| 16 | L | 43.2 | Very low | 44.6 | Very low | 162 Ų | 162 | 139.2 Ų | 139.2 | 85% | 0.848 | 79% | 0.785 | S | S | * | * | trans | -73.2 | 96.2 | 164.7 | -77.7 | 151.1 | 0 | 0 | 0 | 108.8 | L14 | L14-L16 PolarHBondContact O-N 2.72Å; L14-L16 VanDerWaalsContact O-N 3.13Å | ||
| 17 | V | 42.8 | Very low | 44.7 | Very low | 126 Ų | 126 | 142.3 Ų | 142.3 | 76% | 0.764 | 80% | 0.798 | S | S | * | * | trans | -96.7 | 101.3 | 160.9 | 172.8 | 0 | 0 | 0 | 0 | 107.6 | N15 | N15-V17 PolarHBondContact O-N 3.03Š| ||
| 18 | S | 34.4 | Very low | 44.4 | Very low | 116 Ų | 116 | 140.4 Ų | 140.4 | 81% | 0.811 | 80% | 0.797 | S | S | * | * | trans | -82.7 | 115.1 | 173.7 | -140.2 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 19 | T | 47.5 | Very low | 43.7 | Very low | 131 Ų | 131 | 141 Ų | 141 | 80% | 0.804 | 80% | 0.8 | S | S | * | * | trans | -147.7 | 98.6 | 158 | 41.3 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 20 | D | 41.1 | Very low | 43.8 | Very low | 148 Ų | 148 | 139.3 Ų | 139.3 | 79% | 0.791 | 80% | 0.803 | S | S | * | * | trans | -99.8 | 138.5 | 158.9 | -141.2 | -21.4 | 0 | 0 | 0 | 106 | ||||
| 21 | P | 44.3 | Very low | 43.2 | Very low | 108 Ų | 108 | 134.9 Ų | 134.9 | 70% | 0.701 | 79% | 0.794 | S | S | * | * | -149.7 | 139.2 | 107.8 | 34 | -15.5 | 0 | 0 | 0 | 115.3 | |||||
| 22 | R | 41.1 | Very low | 43.2 | Very low | 233 Ų | 233 | 138 Ų | 138 | 88% | 0.879 | 80% | 0.801 | S | S | * | * | trans | 62.6 | 101.2 | 135.8 | -67.6 | 177.3 | 149.2 | -179.1 | -6.4 | 117.9 | ||||
| 23 | S | 40.5 | Very low | 42.5 | Very low | 113 Ų | 113 | 138.8 Ų | 138.8 | 79% | 0.79 | 81% | 0.809 | S | S | * | * | trans | -147.3 | 91.2 | 132.6 | -179.4 | 0 | 0 | 0 | 0 | 109.8 | T25 | S23-T25 PolarHBondContact O-N 2.9Š| ||
| 24 | M | 39.7 | Very low | 42.3 | Very low | 176 Ų | 176 | 144.4 Ų | 144.4 | 87% | 0.867 | 81% | 0.811 | S | S | * | * | trans | -80.7 | 106.9 | 168.6 | -74.2 | -107.4 | 167.2 | 0 | 0 | 108.7 | ||||
| 25 | T | 44.4 | Very low | 41.7 | Very low | 130 Ų | 130 | 145.9 Ų | 145.9 | 80% | 0.798 | 81% | 0.814 | S | S | * | * | trans | -138.8 | 77.3 | 155.7 | 48.9 | 0 | 0 | 0 | 0 | 109.1 | S23 | S23-T25 PolarHBondContact O-N 2.9Š| ||
| 26 | S | 37.7 | Very low | 41.5 | Very low | 102 Ų | 102 | 145.4 Ų | 145.4 | 71% | 0.713 | 81% | 0.811 | S | S | * | * | trans | -75.5 | 129.3 | 157.7 | 47.2 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 27 | S | 49.3 | Very low | 41.3 | Very low | 122 Ų | 122 | 145.7 Ų | 145.7 | 85% | 0.853 | 81% | 0.814 | S | S | * | * | trans | -169.2 | 151.9 | 154.2 | -88.4 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 28 | P | 45.1 | Very low | 41.1 | Very low | 114 Ų | 114 | 146.7 Ų | 146.7 | 74% | 0.74 | 81% | 0.814 | S | S | * | * | -113.2 | 173 | -126.1 | 38.7 | -31.2 | 0 | 0 | 0 | 115.2 | I30 | P28-I30 PolarHBondContact O-N 3.02Š| |||
| 29 | M | 38.2 | Very low | 41.5 | Very low | 185 Ų | 185 | 147.4 Ų | 147.4 | 91% | 0.911 | 81% | 0.813 | S | S | * | * | trans | -38.7 | 119.6 | 167.5 | -69.9 | -173.6 | -67.3 | 0 | 0 | 114.7 | ||||
| 30 | I | 49.4 | Very low | 40.8 | Very low | 161 Ų | 161 | 149.3 Ų | 149.3 | 83% | 0.826 | 82% | 0.818 | S | S | * | * | trans | -147.7 | 107.6 | 149.5 | -57 | -176 | 0 | 0 | 0 | 103.4 | P28 | P28-I30 PolarHBondContact O-N 3.02Š| ||
| 31 | G | 34.8 | Very low | 40.9 | Very low | 61 Ų | 61 | 145.5 Ų | 145.5 | 63% | 0.629 | 81% | 0.807 | S | S | * | * | 86.2 | 89.1 | 60.3 | 0 | 0 | 0 | 0 | 0 | 108.3 | |||||
| 32 | L | 44.3 | Very low | 40.7 | Very low | 172 Ų | 172 | 148 Ų | 148 | 90% | 0.901 | 82% | 0.815 | S | S | * | * | trans | 176.8 | 92.8 | 149.9 | -93.2 | 165.5 | 0 | 0 | 0 | 109.3 | ||||
| 33 | S | 35 | Very low | 40.5 | Very low | 125 Ų | 125 | 144.4 Ų | 144.4 | 87% | 0.874 | 81% | 0.812 | S | S | * | * | trans | -68.4 | 122.4 | 160 | -64.3 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 34 | R | 40.5 | Very low | 40.5 | Very low | 244 Ų | 244 | 143.8 Ų | 143.8 | 92% | 0.921 | 81% | 0.806 | S | S | * | * | trans | -154.1 | 72.7 | 154.4 | -156.7 | 175.8 | 178.9 | 161.6 | -0.3 | 111.2 | ||||
| 35 | E | 36.4 | Very low | 40.6 | Very low | 178 Ų | 178 | 143.7 Ų | 143.7 | 83% | 0.832 | 80% | 0.803 | S | S | * | * | trans | -130.9 | 109.8 | 159.6 | -67.2 | -173 | 175.9 | 0 | 0 | 107.3 | ||||
| 36 | N | 40.8 | Very low | 40.3 | Very low | 146 Ų | 146 | 146.2 Ų | 146.2 | 78% | 0.781 | 81% | 0.806 | S | S | * | * | -179.5 | 96.9 | 126.2 | -87.5 | -27.2 | 0 | 0 | 0 | 109.5 | L38 | N36-L38 HydrophobicContact CB-CD1 4.35Å; N36-L38 PolarHBondContact O-N 3.27Å; N36-L38 VanDerWaalsContact O-N 3.14Å | |||
| 37 | N | 39.6 | Very low | 40.3 | Very low | 168 Ų | 168 | 146.2 Ų | 146.2 | 90% | 0.898 | 81% | 0.812 | S | S | * | * | trans | -54.7 | 104 | 156.8 | -75.9 | -38 | 0 | 0 | 0 | 109.2 | ||||
| 38 | L | 38.3 | Very low | 39.6 | Very low | 147 Ų | 147 | 144.9 Ų | 144.9 | 77% | 0.77 | 81% | 0.808 | S | S | * | * | trans | -141.9 | 146.9 | 152.9 | -81 | 105.8 | 0 | 0 | 0 | 108.2 | N36 | N36-L38 HydrophobicContact CB-CD1 4.35Å; N36-L38 PolarHBondContact O-N 3.27Å; N36-L38 VanDerWaalsContact O-N 3.14Å | ||
| 39 | V | 44.5 | Very low | 39.4 | Very low | 131 Ų | 131 | 145.1 Ų | 145.1 | 79% | 0.794 | 81% | 0.812 | S | S | * | * | trans | 87.7 | 73.3 | 171.3 | -155.1 | 0 | 0 | 0 | 0 | 115 | A41 | V39-A41 HydrophobicContact CG1-CB 4.25Å; V39-A41 PolarHBondContact O-N 2.74Å | ||
| 40 | N | 32.5 | Very low | 39.4 | Very low | 171 Ų | 171 | 142.8 Ų | 142.8 | 91% | 0.914 | 81% | 0.809 | S | S | * | * | trans | -78 | 102.4 | 155.7 | -166.9 | 23 | 0 | 0 | 0 | 107.9 | ||||
| 41 | A | 43.5 | Very low | 39.1 | Very low | 68 Ų | 68 | 143 Ų | 143 | 56% | 0.562 | 81% | 0.811 | S | S | * | * | trans | -126.1 | 122.1 | 171.3 | 0 | 0 | 0 | 0 | 0 | 109.1 | V39 | V39-A41 HydrophobicContact CG1-CB 4.25Å; V39-A41 PolarHBondContact O-N 2.74Å | ||
| 42 | N | 38.1 | Very low | 39.5 | Very low | 161 Ų | 161 | 146.1 Ų | 146.1 | 86% | 0.861 | 82% | 0.817 | S | S | * | * | trans | 66.9 | 104.9 | 160.3 | -65.2 | -13.5 | 0 | 0 | 0 | 119.9 | ||||
| 43 | L | 37.8 | Very low | 39.7 | Very low | 157 Ų | 157 | 143.8 Ų | 143.8 | 82% | 0.822 | 81% | 0.81 | S | S | * | * | trans | -41.5 | 177.2 | 145.1 | -102.4 | 77.2 | 0 | 0 | 0 | 114 | ||||
| 44 | P | 40.2 | Very low | 40.2 | Very low | 100 Ų | 100 | 142.1 Ų | 142.1 | 65% | 0.649 | 80% | 0.796 | S | S | * | * | cis | -136.5 | 166.3 | -26.5 | 33.4 | -15.9 | 0 | 0 | 0 | 112.6 | ||||
| 45 | Q | 41.7 | Very low | 40.3 | Very low | 175 Ų | 175 | 137.1 Ų | 137.1 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | trans | 179.5 | 123.9 | 140.3 | -103 | 161.5 | 5 | 0 | 0 | 112.5 | ||||
| 46 | Q | 37.6 | Very low | 41.1 | Very low | 183 Ų | 183 | 136.9 Ų | 136.9 | 86% | 0.855 | 79% | 0.789 | S | S | * | * | trans | 35.6 | 113.3 | 138.8 | -67.4 | 176.9 | -18 | 0 | 0 | 119.3 | ||||
| 47 | A | 39.3 | Very low | 41.9 | Very low | 101 Ų | 101 | 135.7 Ų | 135.7 | 84% | 0.835 | 79% | 0.789 | S | S | * | * | 164.9 | 129.9 | 102.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 48 | A | 33.9 | Very low | 42.5 | Very low | 95 Ų | 95 | 135.4 Ų | 135.4 | 79% | 0.785 | 79% | 0.785 | S | S | * | * | trans | -62.9 | 145.5 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 49 | S | 41.7 | Very low | 43 | Very low | 118 Ų | 118 | 132 Ų | 132 | 83% | 0.825 | 78% | 0.777 | S | S | * | * | trans | -171.6 | 131.9 | 136.8 | -78.7 | 0 | 0 | 0 | 0 | 111 | ||||
| 50 | V | 37.8 | Very low | 43.1 | Very low | 137 Ų | 137 | 132 Ų | 132 | 83% | 0.83 | 78% | 0.78 | S | S | * | * | trans | -59.4 | 130.3 | 178.3 | 175 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 51 | L | 43.6 | Very low | 44 | Very low | 166 Ų | 166 | 125.7 Ų | 125.7 | 87% | 0.869 | 76% | 0.756 | S | S | * | * | trans | -145.5 | 120.9 | 159.9 | -114.1 | 135.4 | 0 | 0 | 0 | 110.5 | V53 | L51-V53 PolarHBondContact O-N 2.88Š| ||
| 52 | V | 42.9 | Very low | 44.5 | Very low | 126 Ų | 126 | 124.9 Ų | 124.9 | 76% | 0.764 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 122.8 | -176.3 | 176.1 | 0 | 0 | 0 | 0 | 110.9 | ||
| 53 | V | 47 | Very low | 45.2 | Very low | 123 Ų | 123 | 124.4 Ų | 124.4 | 75% | 0.745 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -80.8 | 126.6 | 168.5 | 179.7 | 0 | 0 | 0 | 0 | 108 | L51 T55 | L51-V53 PolarHBondContact O-N 2.88Å; V53-T55 PolarHBondContact O-N 3.21Å |
| 54 | P | 47.3 | Very low | 46 | Very low | 89 Ų | 89 | 123.6 Ų | 123.6 | 58% | 0.578 | 73% | 0.733 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 118.6 | 173.8 | 29.2 | -29.6 | 0 | 0 | 0 | 108.9 | F56 | P54-F56 HydrophobicContact CG-CE2 4.17Å; P54-F56 PolarHBondContact O-N 3.18Å; P54-F56 VanDerWaalsContact O-N 3.11Å |
| 55 | T | 41.3 | Very low | 46.9 | Very low | 139 Ų | 139 | 122.3 Ų | 122.3 | 85% | 0.853 | 73% | 0.727 | S | S | * | * | trans | -64.4 | 105.6 | 167.7 | -51.6 | 0 | 0 | 0 | 0 | 108.4 | V53 | V53-T55 PolarHBondContact O-N 3.21Š| ||
| 56 | F | 52.8 | Low | 47.9 | Very low | 173 Ų | 173 | 117.5 Ų | 117.5 | 76% | 0.759 | 72% | 0.717 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 134.8 | 168.1 | -75.8 | -87.5 | 0 | 0 | 0 | 109.4 | P54 M58 | P54-F56 HydrophobicContact CG-CE2 4.17Å; P54-F56 PolarHBondContact O-N 3.18Å; P54-F56 VanDerWaalsContact O-N 3.11Å; F56-M58 PolarHBondContact O-N 3.22Å |
| 57 | P | 58.6 | Low | 49.4 | Very low | 121 Ų | 121 | 115.1 Ų | 115.1 | 79% | 0.786 | 71% | 0.706 | S | S | * | * | P | Polyproline II helix | trans | -64.4 | 129.5 | 173 | 26.6 | -31.2 | 0 | 0 | 0 | 109.3 | A59 | P57-A59 PolarHBondContact O-N 3.34Š|
| 58 | M | 51.6 | Low | 50.9 | Low | 163 Ų | 163 | 117.6 Ų | 117.6 | 80% | 0.803 | 70% | 0.698 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 120.5 | 176.9 | -160.9 | 161.2 | 72.8 | 0 | 0 | 109.3 | F56 | F56-M58 PolarHBondContact O-N 3.22Š|
| 59 | A | 49.6 | Very low | 52.9 | Low | 74 Ų | 74 | 118.8 Ų | 118.8 | 61% | 0.612 | 69% | 0.687 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 136.4 | -177.4 | 0 | 0 | 0 | 0 | 0 | 111 | P57 G61 | P57-A59 PolarHBondContact O-N 3.34Å; A59-G61 PolarHBondContact O-N 3.41Å; A59-G61 VanDerWaalsContact O-N 3.1Å |
| 60 | P | 46.8 | Very low | 54.7 | Low | 131 Ų | 131 | 119 Ų | 119 | 85% | 0.851 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.1 | 110.9 | 176.5 | 12.7 | -7 | 0 | 0 | 0 | 108.9 | ||
| 61 | G | 50.7 | Low | 56.9 | Low | 40 Ų | 40 | 119.2 Ų | 119.2 | 41% | 0.412 | 67% | 0.667 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 150.5 | -12.1 | -173.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | A59 E63 S65 | A59-G61 PolarHBondContact O-N 3.41Å; A59-G61 VanDerWaalsContact O-N 3.1Å; G61-E63 VanDerWaalsContact C-N 3.25Å; G61-E63 PolarHBondContact O-N 3.25Å; G61-S65 PolarHBondContact O-OG 3.15Å |
| 62 | A | 53.9 | Low | 58.8 | Low | 51 Ų | 51 | 116.4 Ų | 116.4 | 42% | 0.421 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -65.3 | -25.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | S65 | A62-S65 PolarHBondContact O-N 2.94Å |
| 63 | E | 53.1 | Low | 60.7 | Low | 150 Ų | 150 | 115.2 Ų | 115.2 | 70% | 0.701 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -79.2 | -22 | -176.3 | 45.1 | -138.1 | 113.1 | 0 | 0 | 115.3 | G61 S65 | G61-E63 VanDerWaalsContact C-N 3.25Å; G61-E63 PolarHBondContact O-N 3.25Å; E63-S65 VanDerWaalsContact C-N 3.33Å |
| 64 | H | 54.5 | Low | 62.5 | Low | 140 Ų | 140 | 115.5 Ų | 115.5 | 65% | 0.648 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -79.5 | -17.1 | 170.6 | -86.7 | -72.3 | 0 | 0 | 0 | 113.4 | K68 | H64-K68 WeakPolarHBondContact O-CB 3.48Å; H64-K68 PolarHBondContact O-N 2.85Å |
| 65 | S | 58.7 | Low | 64.4 | Low | 74 Ų | 74 | 117.5 Ų | 117.5 | 52% | 0.517 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -74.3 | -38.1 | -173.5 | -62.2 | 0 | 0 | 0 | 0 | 111.9 | G61 A62 E63 H69 | G61-S65 PolarHBondContact O-OG 3.15Å; A62-S65 PolarHBondContact O-N 2.94Å; E63-S65 VanDerWaalsContact C-N 3.33Å; S65-H69 WeakPolarHBondContact O-CB 3.11Å; S65-H69 PolarHBondContact O-N 3.14Å |
| 66 | A | 64.1 | Low | 66.6 | Low | 73 Ų | 73 | 118.7 Ų | 118.7 | 60% | 0.603 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -66.4 | -44.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | H69 Q70 | A66-H69 PolarHBondContact O-N 3.35Å; A66-Q70 PolarHBondContact O-N 3.43Å; A66-Q70 VanDerWaalsContact O-N 3.1Å |
| 67 | Q | 68 | Low | 68.1 | Low | 134 Ų | 134 | 117.1 Ų | 117.1 | 63% | 0.626 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -69.9 | -40.8 | -179.4 | -162 | 176.5 | 3.5 | 0 | 0 | 111.9 | H69 Q70 Q71 | Q67-H69 VanDerWaalsContact C-N 3.35Å; Q67-Q70 PolarHBondContact O-N 3.33Å; Q67-Q71 PolarHBondContact O-N 3.39Å |
| 68 | K | 72 | Confident | 69.4 | Low | 152 Ų | 152 | 118.2 Ų | 118.2 | 66% | 0.661 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -66 | -36.7 | 174.8 | -169.1 | 178.5 | -177.8 | -178.9 | 0 | 112 | H64 Q71 L72 | H64-K68 WeakPolarHBondContact O-CB 3.48Å; H64-K68 PolarHBondContact O-N 2.85Å; K68-Q71 PolarHBondContact O-N 3.25Å; K68-L72 WeakPolarHBondContact O-CB 3.33Å; K68-L72 PolarHBondContact O-N 3.13Å |
| 69 | H | 75.5 | Confident | 71.1 | Confident | 120 Ų | 120 | 117.4 Ų | 117.4 | 56% | 0.556 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -64.2 | -41 | 175.8 | -166.7 | 83.7 | 0 | 0 | 0 | 111.7 | S65 A66 Q67 L72 Q73 | S65-H69 WeakPolarHBondContact O-CB 3.11Å; S65-H69 PolarHBondContact O-N 3.14Å; A66-H69 PolarHBondContact O-N 3.35Å; Q67-H69 VanDerWaalsContact C-N 3.35Å; H69-L72 PolarHBondContact O-N 2.91Å; H69-Q73 PolarHBondContact O-N 3.07Å |
| 70 | Q | 78.3 | Confident | 72.9 | Confident | 123 Ų | 123 | 118.8 Ų | 118.8 | 58% | 0.575 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -66.1 | -40.2 | 176.6 | -155.9 | 177.1 | 20.4 | 0 | 0 | 112 | A66 Q67 Q73 Q74 | A66-Q70 PolarHBondContact O-N 3.43Å; A66-Q70 VanDerWaalsContact O-N 3.1Å; Q67-Q70 PolarHBondContact O-N 3.33Å; Q70-Q73 PolarHBondContact O-N 3.48Å; Q70-Q74 PolarHBondContact O-N 2.88Å; Q70-Q74 VanDerWaalsContact O-N 3.15Å |
| 71 | Q | 83.6 | Confident | 74.8 | Confident | 142 Ų | 142 | 119.9 Ų | 119.9 | 66% | 0.664 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -66.8 | -40.9 | 176.5 | -160.9 | 176.8 | 22.4 | 0 | 0 | 112.2 | Q67 K68 Q73 Q74 Q75 | Q67-Q71 PolarHBondContact O-N 3.39Å; K68-Q71 PolarHBondContact O-N 3.25Å; Q71-Q73 VanDerWaalsContact C-N 3.31Å; Q71-Q73 PolarHBondContact O-N 3.26Å; Q71-Q74 PolarHBondContact O-N 2.87Å; Q71-Q75 PolarHBondContact O-N 3.39Å |
| 72 | L | 83.9 | Confident | 76.6 | Confident | 107 Ų | 107 | 125.4 Ų | 125.4 | 56% | 0.56 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -64.3 | -36.4 | 175.4 | -162.2 | 80.7 | 0 | 0 | 0 | 111.6 | K68 H69 Q75 R76 | K68-L72 WeakPolarHBondContact O-CB 3.33Å; K68-L72 PolarHBondContact O-N 3.13Å; H69-L72 PolarHBondContact O-N 2.91Å; L72-Q75 PolarHBondContact O-N 2.9Å; L72-R76 PolarHBondContact O-N 2.91Å |
| 73 | Q | 83.2 | Confident | 78.3 | Confident | 101 Ų | 101 | 128.3 Ų | 128.3 | 47% | 0.472 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -64.1 | -42.5 | 176 | -122.4 | -179.4 | 16.5 | 0 | 0 | 112.1 | H69 Q70 Q71 R76 Q77 | H69-Q73 PolarHBondContact O-N 3.07Å; Q70-Q73 PolarHBondContact O-N 3.48Å; Q71-Q73 VanDerWaalsContact C-N 3.31Å; Q71-Q73 PolarHBondContact O-N 3.26Å; Q73-R76 PolarHBondContact O-N 2.93Å; Q73-Q77 PolarHBondContact O-N 3.18Å |
| 74 | Q | 85.3 | Confident | 80 | Confident | 129 Ų | 129 | 128.1 Ų | 128.1 | 60% | 0.603 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -64.5 | -41.9 | 175.2 | -74.1 | -175 | 3.9 | 0 | 0 | 111.8 | Q70 Q71 R76 Q77 Q78 | Q70-Q74 PolarHBondContact O-N 2.88Å; Q70-Q74 VanDerWaalsContact O-N 3.15Å; Q71-Q74 PolarHBondContact O-N 2.87Å; Q74-R76 VanDerWaalsContact C-N 3.32Å; Q74-R76 PolarHBondContact O-N 3.16Å; Q74-Q77 PolarHBondContact O-N 2.76Å; Q74-Q78 PolarHBondContact O-N 2.88Å |
| 75 | Q | 87.5 | Confident | 81.6 | Confident | 131 Ų | 131 | 127.3 Ų | 127.3 | 61% | 0.612 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -63.8 | -38.7 | 178.3 | -161 | 177.8 | 41.9 | 0 | 0 | 111.9 | Q71 L72 Q77 Q78 Q79 | Q71-Q75 PolarHBondContact O-N 3.39Å; L72-Q75 PolarHBondContact O-N 2.9Å; Q75-Q77 VanDerWaalsContact C-N 3.34Å; Q75-Q77 PolarHBondContact O-N 3.24Å; Q75-Q78 PolarHBondContact O-N 3.45Å; Q75-Q79 PolarHBondContact O-N 3.23Å; Q75-Q79 VanDerWaalsContact O-N 3.16Å |
| 76 | R | 86.5 | Confident | 83.1 | Confident | 163 Ų | 163 | 129 Ų | 129 | 62% | 0.615 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -66.5 | -34.2 | 177.8 | -146.3 | -134.4 | -63.4 | -173.6 | 0.8 | 112.6 | L72 Q73 Q74 L80 | L72-R76 PolarHBondContact O-N 2.91Å; Q73-R76 PolarHBondContact O-N 2.93Å; Q74-R76 VanDerWaalsContact C-N 3.32Å; Q74-R76 PolarHBondContact O-N 3.16Å; R76-L80 WeakPolarHBondContact O-CG 3.27Å; R76-L80 PolarHBondContact O-N 3.13Å; R76-L80 VanDerWaalsContact O-N 3.15Å |
| 77 | Q | 84.9 | Confident | 84.2 | Confident | 141 Ų | 141 | 129.2 Ų | 129.2 | 66% | 0.659 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -66.3 | -42.6 | 175.5 | -75 | -171.4 | 29 | 0 | 0 | 112.1 | Q73 Q74 Q75 Q79 L80 Q81 | Q73-Q77 PolarHBondContact O-N 3.18Å; Q74-Q77 PolarHBondContact O-N 2.76Å; Q75-Q77 VanDerWaalsContact C-N 3.34Å; Q75-Q77 PolarHBondContact O-N 3.24Å; Q77-Q79 VanDerWaalsContact C-N 3.33Å; Q77-Q79 PolarHBondContact O-N 2.71Å; Q77-L80 PolarHBondContact O-N 2.82Å; Q77-Q81 PolarHBondContact O-N 2.74Å; Q77-Q81 VanDerWaalsContact O-N 3.13Å |
| 78 | Q | 85.7 | Confident | 85.1 | Confident | 144 Ų | 144 | 128.9 Ų | 128.9 | 67% | 0.673 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -63.4 | -39.5 | 176.9 | -72.7 | -173.2 | -3.8 | 0 | 0 | 112.2 | Q74 Q75 Q81 Q82 | Q74-Q78 PolarHBondContact O-N 2.88Å; Q75-Q78 PolarHBondContact O-N 3.45Å; Q78-Q81 PolarHBondContact O-N 3.49Å; Q78-Q82 PolarHBondContact O-N 3.45Å; Q78-Q82 VanDerWaalsContact O-N 3.11Å |
| 79 | Q | 86.5 | Confident | 85.7 | Confident | 145 Ų | 145 | 127 Ų | 127 | 68% | 0.678 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -67.8 | -38.5 | -179.7 | -146.7 | 177.9 | 26.6 | 0 | 0 | 112.2 | Q75 Q77 Q82 H83 | Q75-Q79 PolarHBondContact O-N 3.23Å; Q75-Q79 VanDerWaalsContact O-N 3.16Å; Q77-Q79 VanDerWaalsContact C-N 3.33Å; Q77-Q79 PolarHBondContact O-N 2.71Å; Q79-Q82 PolarHBondContact O-N 3.15Å; Q79-H83 WeakPolarHBondContact O-CB 3.47Å; Q79-H83 PolarHBondContact O-N 2.99Å |
| 80 | L | 87.6 | Confident | 85.9 | Confident | 104 Ų | 104 | 127.1 Ų | 127.1 | 55% | 0.545 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -64.6 | -39.5 | 174.5 | -76.9 | 166.5 | 0 | 0 | 0 | 112.2 | R76 Q77 H83 Q84 | R76-L80 WeakPolarHBondContact O-CG 3.27Å; R76-L80 PolarHBondContact O-N 3.13Å; R76-L80 VanDerWaalsContact O-N 3.15Å; Q77-L80 PolarHBondContact O-N 2.82Å; L80-H83 PolarHBondContact O-N 3.36Å; L80-Q84 PolarHBondContact O-N 3.48Å |
| 81 | Q | 88.1 | Confident | 85.9 | Confident | 154 Ų | 154 | 127.4 Ų | 127.4 | 72% | 0.72 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -66.7 | -41.2 | 178.9 | -163.9 | 172.5 | 61 | 0 | 0 | 111.7 | Q77 Q78 Q84 L85 | Q77-Q81 PolarHBondContact O-N 2.74Å; Q77-Q81 VanDerWaalsContact O-N 3.13Å; Q78-Q81 PolarHBondContact O-N 3.49Å; Q81-Q84 PolarHBondContact O-N 3.36Å; Q81-L85 PolarHBondContact O-N 3.49Å |
| 82 | Q | 87.6 | Confident | 85.6 | Confident | 155 Ų | 155 | 126.4 Ų | 126.4 | 72% | 0.724 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -64.7 | -41.7 | 174.7 | -112.7 | -162.4 | 79.5 | 0 | 0 | 112.6 | Q78 Q79 Q84 L85 L86 | Q78-Q82 PolarHBondContact O-N 3.45Å; Q78-Q82 VanDerWaalsContact O-N 3.11Å; Q79-Q82 PolarHBondContact O-N 3.15Å; Q82-Q84 VanDerWaalsContact C-N 3.33Å; Q82-Q84 PolarHBondContact O-N 3.07Å; Q82-L85 PolarHBondContact O-N 3.25Å; Q82-L86 PolarHBondContact O-N 3.01Å |
| 83 | H | 89.7 | Confident | 84.9 | Confident | 112 Ų | 112 | 127.9 Ų | 127.9 | 52% | 0.519 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -63.7 | -39.2 | 178.7 | -173.4 | 71.6 | 0 | 0 | 0 | 112.1 | Q79 L80 L86 L87 | Q79-H83 WeakPolarHBondContact O-CB 3.47Å; Q79-H83 PolarHBondContact O-N 2.99Å; L80-H83 PolarHBondContact O-N 3.36Å; H83-L86 PolarHBondContact O-N 3.08Å; H83-L87 VanDerWaalsContact NE2-CD1 3.34Å; H83-L87 WeakPolarHBondContact NE2-CD1 3.38Å; H83-L87 PolarHBondContact O-N 3.47Å |
| 84 | Q | 88.3 | Confident | 84 | Confident | 147 Ų | 147 | 128.5 Ų | 128.5 | 69% | 0.687 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -65.6 | -38.7 | 177.1 | -161.9 | 177.7 | 98.2 | 0 | 0 | 112 | L80 Q81 Q82 Q88 | L80-Q84 PolarHBondContact O-N 3.48Å; Q81-Q84 PolarHBondContact O-N 3.36Å; Q82-Q84 VanDerWaalsContact C-N 3.33Å; Q82-Q84 PolarHBondContact O-N 3.07Å; Q84-Q88 PolarHBondContact O-N 3.23Å; Q84-Q88 VanDerWaalsContact O-N 3.16Å |
| 85 | L | 89.2 | Confident | 82.9 | Confident | 122 Ų | 122 | 128.7 Ų | 128.7 | 64% | 0.639 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -64.8 | -41.7 | 174.7 | -161.9 | 91.1 | 0 | 0 | 0 | 111.8 | Q81 Q82 Q88 Q89 | Q81-L85 PolarHBondContact O-N 3.49Å; Q82-L85 PolarHBondContact O-N 3.25Å; L85-Q88 PolarHBondContact O-N 3.37Å; L85-Q89 PolarHBondContact O-N 3.41Å |
| 86 | L | 89.8 | Confident | 81.6 | Confident | 109 Ų | 109 | 129 Ų | 129 | 57% | 0.571 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -63.2 | -43.9 | 178.3 | -169 | 86.6 | 0 | 0 | 0 | 111.8 | Q82 H83 Q88 Q89 Q90 | Q82-L86 PolarHBondContact O-N 3.01Å; H83-L86 PolarHBondContact O-N 3.08Å; L86-Q88 VanDerWaalsContact C-N 3.32Å; L86-Q88 PolarHBondContact O-N 2.91Å; L86-Q89 PolarHBondContact O-N 3.44Å; L86-Q90 PolarHBondContact O-N 3.5Å |
| 87 | L | 87.7 | Confident | 80.2 | Confident | 78 Ų | 78 | 128 Ų | 128 | 41% | 0.408 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -59.6 | -42 | 176 | -95.1 | 153.9 | 0 | 0 | 0 | 111.9 | H83 Q90 Q91 | H83-L87 VanDerWaalsContact NE2-CD1 3.34Å; H83-L87 WeakPolarHBondContact NE2-CD1 3.38Å; H83-L87 PolarHBondContact O-N 3.47Å; L87-Q90 PolarHBondContact O-N 2.82Å; L87-Q91 PolarHBondContact O-N 2.89Å; L87-Q91 VanDerWaalsContact O-N 3.12Å |
| 88 | Q | 85.9 | Confident | 78.7 | Confident | 127 Ų | 127 | 127.4 Ų | 127.4 | 59% | 0.593 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -65.6 | -40.1 | 177.4 | -167.6 | 179.1 | 93.7 | 0 | 0 | 111.9 | Q84 L85 L86 Q90 Q91 Q92 | Q84-Q88 PolarHBondContact O-N 3.23Å; Q84-Q88 VanDerWaalsContact O-N 3.16Å; L85-Q88 PolarHBondContact O-N 3.37Å; L86-Q88 VanDerWaalsContact C-N 3.32Å; L86-Q88 PolarHBondContact O-N 2.91Å; Q88-Q90 VanDerWaalsContact C-N 3.34Å; Q88-Q90 PolarHBondContact O-N 3.46Å; Q88-Q91 PolarHBondContact O-N 3.35Å; Q88-Q92 PolarHBondContact O-N 3.05Å; Q88-Q92 VanDerWaalsContact O-N 3.16Å |
| 89 | Q | 84 | Confident | 77.1 | Confident | 114 Ų | 114 | 127.4 Ų | 127.4 | 53% | 0.533 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -64.6 | -39.1 | 175.6 | -162.2 | -159.1 | 105.9 | 0 | 0 | 111.7 | L85 L86 Q92 K93 | L85-Q89 PolarHBondContact O-N 3.41Å; L86-Q89 PolarHBondContact O-N 3.44Å; Q89-Q92 PolarHBondContact O-N 2.81Å; Q89-K93 PolarHBondContact O-N 2.87Å; Q89-K93 VanDerWaalsContact O-N 3.07Å |
| 90 | Q | 80.7 | Confident | 75.2 | Confident | 121 Ų | 121 | 124 Ų | 124 | 57% | 0.565 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -65.7 | -38.7 | 178.9 | -163.6 | -173.5 | 72.2 | 0 | 0 | 111.9 | L86 L87 Q88 K93 Q94 | L86-Q90 PolarHBondContact O-N 3.5Å; L87-Q90 PolarHBondContact O-N 2.82Å; Q88-Q90 VanDerWaalsContact C-N 3.34Å; Q88-Q90 PolarHBondContact O-N 3.46Å; Q90-K93 PolarHBondContact O-N 3.38Å; Q90-Q94 PolarHBondContact O-N 2.89Å; Q90-Q94 VanDerWaalsContact O-N 3.15Å |
| 91 | Q | 77.8 | Confident | 73.2 | Confident | 129 Ų | 129 | 125.2 Ų | 125.2 | 60% | 0.603 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -64.5 | -41.7 | 173.8 | -81.4 | -169 | 19.1 | 0 | 0 | 112.6 | L87 Q88 K93 Q94 Q95 | L87-Q91 PolarHBondContact O-N 2.89Å; L87-Q91 VanDerWaalsContact O-N 3.12Å; Q88-Q91 PolarHBondContact O-N 3.35Å; Q91-K93 VanDerWaalsContact C-N 3.31Å; Q91-K93 PolarHBondContact O-N 3.39Å; Q91-Q94 PolarHBondContact O-N 3.49Å; Q91-Q95 PolarHBondContact O-N 2.87Å; Q91-Q95 VanDerWaalsContact O-N 3.09Å |
| 92 | Q | 76.7 | Confident | 71.3 | Confident | 122 Ų | 122 | 124.9 Ų | 124.9 | 57% | 0.57 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -61.8 | -39.5 | 176 | -80 | -174.4 | -5.7 | 0 | 0 | 112 | Q88 Q89 Q94 Q95 Q96 | Q88-Q92 PolarHBondContact O-N 3.05Å; Q88-Q92 VanDerWaalsContact O-N 3.16Å; Q89-Q92 PolarHBondContact O-N 2.81Å; Q92-Q94 PolarHBondContact O-N 3.46Å; Q92-Q95 PolarHBondContact O-N 3.46Å; Q92-Q96 PolarHBondContact O-N 3.25Å |
| 93 | K | 70.4 | Confident | 69.1 | Low | 138 Ų | 138 | 122.3 Ų | 122.3 | 60% | 0.6 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -63.8 | -37.7 | 176.2 | -109.1 | -172.7 | 174.6 | -177.8 | 0 | 112.9 | Q89 Q90 Q91 Q97 | Q89-K93 PolarHBondContact O-N 2.87Å; Q89-K93 VanDerWaalsContact O-N 3.07Å; Q90-K93 PolarHBondContact O-N 3.38Å; Q91-K93 VanDerWaalsContact C-N 3.31Å; Q91-K93 PolarHBondContact O-N 3.39Å; K93-Q97 PolarHBondContact O-N 2.89Å; K93-Q97 VanDerWaalsContact O-N 3.13Å |
| 94 | Q | 64.1 | Low | 67 | Low | 113 Ų | 113 | 125.9 Ų | 125.9 | 53% | 0.528 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -68.9 | -38.4 | 175.9 | -75.9 | -172.3 | 5.3 | 0 | 0 | 112.6 | Q90 Q91 Q92 Q97 Q98 | Q90-Q94 PolarHBondContact O-N 2.89Å; Q90-Q94 VanDerWaalsContact O-N 3.15Å; Q91-Q94 PolarHBondContact O-N 3.49Å; Q92-Q94 PolarHBondContact O-N 3.46Å; Q94-Q97 PolarHBondContact O-N 2.85Å; Q94-Q98 PolarHBondContact O-N 3.36Å; Q94-Q98 VanDerWaalsContact O-N 3.16Å |
| 95 | Q | 63 | Low | 65 | Low | 133 Ų | 133 | 122.5 Ų | 122.5 | 62% | 0.621 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -67.8 | -38.9 | 176.1 | -74.5 | -172.8 | 12 | 0 | 0 | 112.4 | Q91 Q92 Q98 Q99 | Q91-Q95 PolarHBondContact O-N 2.87Å; Q91-Q95 VanDerWaalsContact O-N 3.09Å; Q92-Q95 PolarHBondContact O-N 3.46Å; Q95-Q98 PolarHBondContact O-N 3.39Å; Q95-Q99 PolarHBondContact O-N 2.84Å |
| 96 | Q | 59.2 | Low | 62.8 | Low | 139 Ų | 139 | 123.9 Ų | 123.9 | 65% | 0.65 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -67 | -34.2 | 174.9 | -87.3 | -176.8 | 9 | 0 | 0 | 113.2 | Q92 Q99 A100 | Q92-Q96 PolarHBondContact O-N 3.25Å; Q96-Q99 PolarHBondContact O-N 3.43Å; Q96-A100 WeakPolarHBondContact O-CB 3.45Å; Q96-A100 PolarHBondContact O-N 3.16Å |
| 97 | Q | 57.3 | Low | 60.6 | Low | 142 Ų | 142 | 126.7 Ų | 126.7 | 66% | 0.664 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -69.6 | -30.9 | 174.1 | -82.7 | -176.2 | -4.4 | 0 | 0 | 113 | K93 Q94 N101 | K93-Q97 PolarHBondContact O-N 2.89Å; K93-Q97 VanDerWaalsContact O-N 3.13Å; Q94-Q97 PolarHBondContact O-N 2.85Å; Q97-N101 PolarHBondContact O-N 3.41Å |
| 98 | Q | 54.2 | Low | 58.4 | Low | 128 Ų | 128 | 130.8 Ų | 130.8 | 60% | 0.598 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -71.5 | -41.2 | 172 | -71.3 | 178.5 | 19.8 | 0 | 0 | 111.2 | Q94 Q95 N101 F102 | Q94-Q98 PolarHBondContact O-N 3.36Å; Q94-Q98 VanDerWaalsContact O-N 3.16Å; Q95-Q98 PolarHBondContact O-N 3.39Å; Q98-N101 PolarHBondContact O-N 3.01Å; Q98-F102 VanDerWaalsContact O-CD2 3.31Å; Q98-F102 WeakPolarHBondContact O-CD2 3.44Å; Q98-F102 PolarHBondContact O-N 2.64Å |
| 99 | Q | 50.4 | Low | 56.6 | Low | 144 Ų | 144 | 135.6 Ų | 135.6 | 67% | 0.673 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -70 | -34.7 | 178.8 | -121.1 | 167.5 | 8 | 0 | 0 | 113.5 | Q95 Q96 N101 F102 | Q95-Q99 PolarHBondContact O-N 2.84Å; Q96-Q99 PolarHBondContact O-N 3.43Å; Q99-N101 VanDerWaalsContact C-N 3.31Å; Q99-N101 PolarHBondContact O-N 3.32Å; Q99-F102 PolarHBondContact O-N 3.3Å |
| 100 | A | 47.2 | Very low | 54.9 | Low | 72 Ų | 72 | 139.1 Ų | 139.1 | 60% | 0.595 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -68.8 | -27 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | Q96 | Q96-A100 WeakPolarHBondContact O-CB 3.45Å; Q96-A100 PolarHBondContact O-N 3.16Å |
| 101 | N | 44.9 | Very low | 53.8 | Low | 131 Ų | 131 | 140.9 Ų | 140.9 | 70% | 0.701 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -83.5 | -17.8 | 176 | -105 | -8 | 0 | 0 | 0 | 113.9 | Q97 Q98 Q99 | Q97-N101 PolarHBondContact O-N 3.41Å; Q98-N101 PolarHBondContact O-N 3.01Å; Q99-N101 VanDerWaalsContact C-N 3.31Å; Q99-N101 PolarHBondContact O-N 3.32Å |
| 102 | F | 48.2 | Very low | 52.7 | Low | 147 Ų | 147 | 138.3 Ų | 138.3 | 65% | 0.645 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -85.5 | -21.9 | 178.7 | -95.2 | -96 | 0 | 0 | 0 | 113.4 | Q98 Q99 Q104 S105 | Q98-F102 VanDerWaalsContact O-CD2 3.31Å; Q98-F102 WeakPolarHBondContact O-CD2 3.44Å; Q98-F102 PolarHBondContact O-N 2.64Å; Q99-F102 PolarHBondContact O-N 3.3Å; F102-Q104 VanDerWaalsContact C-N 3.3Å; F102-Q104 PolarHBondContact O-N 3.36Å; F102-S105 PolarHBondContact O-OG 3.07Å |
| 103 | S | 42.1 | Very low | 51.9 | Low | 100 Ų | 100 | 137.6 Ų | 137.6 | 70% | 0.699 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.7 | 5.3 | -179.3 | -58.2 | 0 | 0 | 0 | 0 | 115.3 | ||
| 104 | Q | 46.9 | Very low | 51.6 | Low | 187 Ų | 187 | 135.4 Ų | 135.4 | 87% | 0.874 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.1 | -1 | 171.2 | -79.6 | -163.2 | -21.8 | 0 | 0 | 114.6 | F102 | F102-Q104 VanDerWaalsContact C-N 3.3Å; F102-Q104 PolarHBondContact O-N 3.36Å |
| 105 | S | 44.9 | Very low | 51.5 | Low | 76 Ų | 76 | 137.5 Ų | 137.5 | 53% | 0.531 | 68% | 0.676 | S | S | . | * | trans | -110.1 | 12.4 | -176.5 | 50.4 | 0 | 0 | 0 | 0 | 115.2 | F102 Q107 | F102-S105 PolarHBondContact O-OG 3.07Å; S105-Q107 PolarHBondContact O-N 3.37Å | ||
| 106 | D | 42.6 | Very low | 51.5 | Low | 152 Ų | 152 | 139.8 Ų | 139.8 | 81% | 0.813 | 69% | 0.686 | S | S | * | * | trans | -82.4 | 21.2 | 178.3 | -92.2 | -36.5 | 0 | 0 | 0 | 114.8 | ||||
| 107 | Q | 44.7 | Very low | 51.6 | Low | 168 Ų | 168 | 141 Ų | 141 | 79% | 0.785 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -119.7 | 98.1 | 161.3 | -75.1 | -171.2 | 20.9 | 0 | 0 | 111.2 | S105 | S105-Q107 PolarHBondContact O-N 3.37Š|
| 108 | Q | 40.4 | Very low | 51.9 | Low | 164 Ų | 164 | 139.3 Ų | 139.3 | 77% | 0.766 | 69% | 0.688 | S | S | * | * | S | Bend | 65.9 | 76.9 | 127.2 | -65.1 | 175.5 | -23.8 | 0 | 0 | 117 | |||
| 109 | R | 49.1 | Very low | 52.5 | Low | 228 Ų | 228 | 140.5 Ų | 140.5 | 86% | 0.86 | 69% | 0.691 | S | S | * | * | 178 | 116.9 | 105.7 | -96.2 | -176.9 | -94.7 | -162.9 | -2.4 | 108.1 | I111 | R109-I111 PolarHBondContact O-N 3.42Š| |||
| 110 | K | 48.1 | Very low | 53.5 | Low | 188 Ų | 188 | 138.8 Ų | 138.8 | 82% | 0.817 | 69% | 0.692 | S | S | * | * | trans | -48.3 | 105.2 | 155.7 | -175.3 | -167.4 | 179.3 | -163.8 | 0 | 106.2 | V112 | K110-V112 HydrophobicContact CD-CG2 3.5Å; K110-V112 VanDerWaalsContact CD-CG2 3.5Å; K110-V112 HydrophobicContact CG-CG2 3.66Å; K110-V112 PolarHBondContact O-N 3.13Å | ||
| 111 | I | 57.7 | Low | 54.2 | Low | 157 Ų | 157 | 141.3 Ų | 141.3 | 81% | 0.805 | 71% | 0.705 | S | S | * | * | trans | -72.1 | 81.1 | 173.2 | -54.9 | 175.5 | 0 | 0 | 0 | 105.5 | R109 M113 | R109-I111 PolarHBondContact O-N 3.42Å; I111-M113 PolarHBondContact O-N 3.03Å | ||
| 112 | V | 55.6 | Low | 55.2 | Low | 76 Ų | 76 | 142.6 Ų | 142.6 | 46% | 0.461 | 71% | 0.711 | S | S | . | * | trans | -79.2 | 108.8 | 158.9 | -177.7 | 0 | 0 | 0 | 0 | 104.4 | K110 D114 | K110-V112 HydrophobicContact CD-CG2 3.5Å; K110-V112 VanDerWaalsContact CD-CG2 3.5Å; K110-V112 HydrophobicContact CG-CG2 3.66Å; K110-V112 PolarHBondContact O-N 3.13Å; V112-D114 VanDerWaalsContact C-N 3.34Å; V112-D114 PolarHBondContact O-N 3.48Å; V112-D114 VanDerWaalsContact O-N 3.08Å | ||
| 113 | M | 59.8 | Low | 55.9 | Low | 106 Ų | 106 | 144 Ų | 144 | 52% | 0.522 | 72% | 0.719 | S | S | . | * | trans | -76.1 | 91.1 | 174.3 | -167.5 | 151.2 | 48 | 0 | 0 | 107.2 | I111 Y115 | I111-M113 PolarHBondContact O-N 3.03Å; M113-Y115 HydrophobicContact CE-CE1 4.49Å; M113-Y115 WeakPolarHBondContact CE-OH 3.29Å; M113-Y115 HydrophobicContact CG-CE1 4.2Å; M113-Y115 HydrophobicContact CG-CE2 4.3Å; M113-Y115 WeakPolarHBondContact O-CD2 3.41Å; M113-Y115 PolarHBondContact O-N 3.15Å; M113-Y115 HydrophobicContact SD-CE1 4.45Å | ||
| 114 | D | 63.7 | Low | 56.5 | Low | 93 Ų | 93 | 144.8 Ų | 144.8 | 50% | 0.497 | 72% | 0.722 | S | S | . | * | trans | -81.3 | 90.5 | 173.1 | -88.8 | -28.1 | 0 | 0 | 0 | 108.7 | V112 E116 Q117 | V112-D114 VanDerWaalsContact C-N 3.34Å; V112-D114 PolarHBondContact O-N 3.48Å; V112-D114 VanDerWaalsContact O-N 3.08Å; D114-E116 PolarHBondContact O-N 3.25Å; D114-Q117 PolarHBondContact O-N 2.93Å | ||
| 115 | Y | 61.4 | Low | 56.5 | Low | 156 Ų | 156 | 141.7 Ų | 141.7 | 61% | 0.612 | 72% | 0.721 | S | S | * | * | H | α-helix | trans | -54.6 | -23.1 | -178 | -68.3 | -84.4 | 0 | 0 | 0 | 114.4 | M113 | M113-Y115 HydrophobicContact CE-CE1 4.49Å; M113-Y115 WeakPolarHBondContact CE-OH 3.29Å; M113-Y115 HydrophobicContact CG-CE1 4.2Å; M113-Y115 HydrophobicContact CG-CE2 4.3Å; M113-Y115 WeakPolarHBondContact O-CD2 3.41Å; M113-Y115 PolarHBondContact O-N 3.15Å; M113-Y115 HydrophobicContact SD-CE1 4.45Å |
| 116 | E | 64 | Low | 56.7 | Low | 181 Ų | 181 | 142.7 Ų | 142.7 | 85% | 0.846 | 73% | 0.734 | S | S | * | * | H | α-helix | trans | -72.3 | -25.6 | 177.5 | -69.7 | -80.3 | 128.5 | 0 | 0 | 113.2 | D114 | D114-E116 PolarHBondContact O-N 3.25Å |
| 117 | Q | 61.2 | Low | 56.9 | Low | 164 Ų | 164 | 139.2 Ų | 139.2 | 77% | 0.766 | 73% | 0.726 | S | S | * | * | H | α-helix | trans | -91.2 | -30.6 | 178.3 | -77.6 | -170 | -14.8 | 0 | 0 | 113.1 | D114 | D114-Q117 PolarHBondContact O-N 2.93Å |
| 118 | D | 63.9 | Low | 56.7 | Low | 107 Ų | 107 | 137.4 Ų | 137.4 | 57% | 0.572 | 73% | 0.729 | S | S | * | * | H | α-helix | trans | -82 | -15 | -176.9 | -75.8 | -27.6 | 0 | 0 | 0 | 113.5 | ||
| 119 | F | 65.9 | Low | 57.2 | Low | 153 Ų | 153 | 136.4 Ų | 136.4 | 67% | 0.671 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -139 | 85.4 | 179.3 | -64.2 | -86.1 | 0 | 0 | 0 | 111.1 | C121 | F119-C121 PolarHBondContact O-N 3.08Å; F119-C121 VanDerWaalsContact O-N 3.15Å |
| 120 | P | 71.3 | Confident | 57 | Low | 108 Ų | 108 | 134.8 Ų | 134.8 | 70% | 0.701 | 74% | 0.736 | S | S | * | * | trans | -57.8 | 123.1 | 176.3 | 22.6 | -32.5 | 0 | 0 | 0 | 110.3 | L122 | P120-L122 PolarHBondContact O-N 3.4Å; P120-L122 VanDerWaalsContact O-N 3.16Å | ||
| 121 | C | 62.1 | Low | 57 | Low | 126 Ų | 126 | 130.2 Ų | 130.2 | 85% | 0.851 | 73% | 0.733 | S | S | * | * | trans | -62.5 | 116.3 | 178.8 | -161.4 | 0 | 0 | 0 | 0 | 109.2 | F119 E123 | F119-C121 PolarHBondContact O-N 3.08Å; F119-C121 VanDerWaalsContact O-N 3.15Å; C121-E123 PolarHBondContact O-N 3.01Å | ||
| 122 | L | 66 | Low | 56.4 | Low | 158 Ų | 158 | 128.6 Ų | 128.6 | 83% | 0.827 | 73% | 0.733 | S | S | * | * | trans | -69.4 | 112.6 | 175.4 | -64.5 | 173.8 | 0 | 0 | 0 | 108.1 | P120 | P120-L122 PolarHBondContact O-N 3.4Å; P120-L122 VanDerWaalsContact O-N 3.16Å | ||
| 123 | E | 61.8 | Low | 55.7 | Low | 175 Ų | 175 | 136.8 Ų | 136.8 | 82% | 0.818 | 76% | 0.755 | S | S | * | * | trans | -46.6 | 127.2 | 173.4 | -75.6 | -89.7 | 136.6 | 0 | 0 | 110 | C121 S125 | C121-E123 PolarHBondContact O-N 3.01Å; E123-S125 PolarHBondContact O-N 3.47Å | ||
| 124 | P | 54.5 | Low | 55 | Low | 118 Ų | 118 | 137.7 Ų | 137.7 | 77% | 0.766 | 77% | 0.767 | S | S | * | * | trans | -62.3 | 108.6 | 178 | 22.7 | -29.5 | 0 | 0 | 0 | 109.2 | A126 | P124-A126 PolarHBondContact O-N 3.17Š| ||
| 125 | S | 48.3 | Very low | 53.9 | Low | 121 Ų | 121 | 138.2 Ų | 138.2 | 85% | 0.846 | 78% | 0.784 | S | S | * | * | trans | -55.9 | 104.6 | 176.8 | -174.3 | 0 | 0 | 0 | 0 | 109.8 | E123 A127 | E123-S125 PolarHBondContact O-N 3.47Å; S125-A127 PolarHBondContact O-N 3.49Å; S125-A127 VanDerWaalsContact O-N 3.07Å | ||
| 126 | A | 48.3 | Very low | 53.3 | Low | 98 Ų | 98 | 134.2 Ų | 134.2 | 81% | 0.81 | 78% | 0.783 | S | S | * | * | trans | -69 | 100.6 | 174.2 | 0 | 0 | 0 | 0 | 0 | 109.4 | P124 | P124-A126 PolarHBondContact O-N 3.17Š| ||
| 127 | A | 46.4 | Very low | 52.7 | Low | 79 Ų | 79 | 131.7 Ų | 131.7 | 65% | 0.653 | 78% | 0.78 | S | S | * | * | 156 | 133.4 | 128.7 | 0 | 0 | 0 | 0 | 0 | 111 | S125 | S125-A127 PolarHBondContact O-N 3.49Å; S125-A127 VanDerWaalsContact O-N 3.07Å | |||
| 128 | P | 42.3 | Very low | 52 | Low | 129 Ų | 129 | 129.1 Ų | 129.1 | 84% | 0.838 | 78% | 0.778 | S | S | * | * | trans | -84.3 | 122.6 | -178.8 | 33.3 | -29.7 | 0 | 0 | 0 | 110.3 | ||||
| 129 | V | 50.6 | Low | 51.2 | Low | 144 Ų | 144 | 129.2 Ų | 129.2 | 87% | 0.873 | 78% | 0.782 | S | S | * | * | trans | -109.8 | 120.7 | 163.1 | -177.4 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 130 | Q | 43.9 | Very low | 50.4 | Low | 194 Ų | 194 | 129.4 Ų | 129.4 | 91% | 0.907 | 79% | 0.788 | S | S | * | * | trans | -57.8 | 129.6 | -169.7 | -64.3 | 166.6 | -0 | 0 | 0 | 112.7 | ||||
| 131 | A | 47.8 | Very low | 49.3 | Very low | 91 Ų | 91 | 133.8 Ų | 133.8 | 75% | 0.752 | 79% | 0.791 | S | S | * | * | trans | -123.9 | 140 | 157.2 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 132 | P | 45.6 | Very low | 48.4 | Very low | 123 Ų | 123 | 139.7 Ų | 139.7 | 80% | 0.799 | 80% | 0.795 | S | S | * | * | trans | -71.8 | 135.5 | -154.8 | 29.3 | -36.5 | 0 | 0 | 0 | 113.1 | V134 | P132-V134 PolarHBondContact O-N 3.22Š| ||
| 133 | R | 42 | Very low | 47.6 | Very low | 248 Ų | 248 | 137 Ų | 137 | 94% | 0.936 | 79% | 0.786 | S | S | * | * | trans | -64.1 | 96.9 | 171.1 | -81.4 | -178.9 | 169 | 179.6 | -2.7 | 110.4 | A135 | R133-A135 PolarHBondContact O-N 3Š| ||
| 134 | V | 44 | Very low | 46.8 | Very low | 126 Ų | 126 | 135.7 Ų | 135.7 | 76% | 0.764 | 78% | 0.784 | S | S | * | * | trans | -85.3 | 95.2 | 154.2 | -178.6 | 0 | 0 | 0 | 0 | 106.8 | P132 A136 | P132-V134 PolarHBondContact O-N 3.22Å; V134-A136 HydrophobicContact CG1-CB 4.11Å; V134-A136 PolarHBondContact O-N 2.94Å | ||
| 135 | A | 41.4 | Very low | 46.3 | Very low | 103 Ų | 103 | 136.5 Ų | 136.5 | 85% | 0.851 | 79% | 0.787 | S | S | * | * | trans | -71.8 | 71.9 | 168.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | R133 | R133-A135 PolarHBondContact O-N 3Š| ||
| 136 | A | 48.1 | Very low | 46.4 | Very low | 72 Ų | 72 | 135.6 Ų | 135.6 | 60% | 0.595 | 78% | 0.776 | S | S | * | * | trans | -97 | 102.4 | 163.4 | 0 | 0 | 0 | 0 | 0 | 106.4 | V134 P138 | V134-A136 HydrophobicContact CG1-CB 4.11Å; V134-A136 PolarHBondContact O-N 2.94Å; A136-P138 WeakPolarHBondContact O-CD 3.33Å | ||
| 137 | T | 51.2 | Low | 46.6 | Very low | 129 Ų | 129 | 139.1 Ų | 139.1 | 79% | 0.791 | 78% | 0.776 | S | S | * | * | trans | -63.8 | 109.7 | 163 | 32.6 | 0 | 0 | 0 | 0 | 107.5 | V139 | T137-V139 PolarHBondContact O-N 2.76Š| ||
| 138 | P | 47.7 | Very low | 47.2 | Very low | 109 Ų | 109 | 142.3 Ų | 142.3 | 71% | 0.708 | 78% | 0.78 | S | S | * | * | trans | -73 | 108.1 | 167.8 | 30.9 | -27.3 | 0 | 0 | 0 | 105.9 | A136 I140 | A136-P138 WeakPolarHBondContact O-CD 3.33Å; P138-I140 VanDerWaalsContact C-N 3.33Å; P138-I140 PolarHBondContact O-N 3.35Å | ||
| 139 | V | 46.5 | Very low | 47.8 | Very low | 110 Ų | 110 | 145.4 Ų | 145.4 | 67% | 0.667 | 78% | 0.781 | S | S | * | * | trans | -52.9 | 105 | 158 | 175 | 0 | 0 | 0 | 0 | 105.6 | T137 R141 | T137-V139 PolarHBondContact O-N 2.76Å; V139-R141 HydrophobicContact CG1-CG 3.83Å; V139-R141 PolarHBondContact O-N 2.86Å | ||
| 140 | I | 49.1 | Very low | 48 | Very low | 156 Ų | 156 | 144.3 Ų | 144.3 | 80% | 0.8 | 77% | 0.766 | S | S | * | * | trans | -68.3 | 78.2 | 173.8 | -58.3 | 174.4 | 0 | 0 | 0 | 106.6 | P138 | P138-I140 VanDerWaalsContact C-N 3.33Å; P138-I140 PolarHBondContact O-N 3.35Å | ||
| 141 | R | 48.2 | Very low | 49 | Very low | 201 Ų | 201 | 138.4 Ų | 138.4 | 76% | 0.758 | 74% | 0.741 | S | S | * | * | trans | -66.5 | 129.3 | 159.7 | -66.2 | -169.6 | 177.8 | 178.8 | -0.3 | 105.3 | V139 T143 | V139-R141 HydrophobicContact CG1-CG 3.83Å; V139-R141 PolarHBondContact O-N 2.86Å; R141-T143 VanDerWaalsContact C-N 3.32Å; R141-T143 PolarHBondContact O-N 3.09Å; R141-T143 PolarHBondContact O-OG1 3.26Å | ||
| 142 | R | 43.5 | Very low | 49.9 | Very low | 249 Ų | 249 | 137.5 Ų | 137.5 | 94% | 0.94 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -50.2 | 85.4 | -177.4 | -67 | 175.1 | 172.6 | 161.6 | -3.3 | 112 | ||
| 143 | T | 48.8 | Very low | 50.4 | Low | 102 Ų | 102 | 139.7 Ų | 139.7 | 63% | 0.626 | 72% | 0.721 | S | S | * | * | trans | -155.2 | 114.6 | 173.8 | 53.6 | 0 | 0 | 0 | 0 | 110.2 | R141 | R141-T143 VanDerWaalsContact C-N 3.32Å; R141-T143 PolarHBondContact O-N 3.09Å; R141-T143 PolarHBondContact O-OG1 3.26Å | ||
| 144 | N | 43.9 | Very low | 51.3 | Low | 147 Ų | 147 | 134.2 Ų | 134.2 | 79% | 0.786 | 71% | 0.706 | S | S | * | * | S | Bend | trans | 69.9 | 40.6 | 150.6 | -49.2 | -22.1 | 0 | 0 | 0 | 120.6 | ||
| 145 | V | 44.5 | Very low | 52 | Low | 136 Ų | 136 | 133 Ų | 133 | 82% | 0.824 | 69% | 0.692 | S | S | * | * | trans | -129.6 | 67.3 | 168.8 | -170.8 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 146 | T | 50.4 | Low | 52.7 | Low | 101 Ų | 101 | 133.3 Ų | 133.3 | 62% | 0.62 | 67% | 0.671 | S | S | * | * | trans | -136.4 | 53.1 | 157.2 | 38 | 0 | 0 | 0 | 0 | 108.6 | I148 Q150 | T146-I148 VanDerWaalsContact C-N 3.32Å; T146-I148 PolarHBondContact O-N 3.06Å; T146-Q150 PolarHBondContact O-NE2 3.33Å; T146-Q150 PolarHBondContact OG1-NE2 3.12Å | ||
| 147 | Q | 52.1 | Low | 53 | Low | 173 Ų | 173 | 137.6 Ų | 137.6 | 81% | 0.808 | 67% | 0.672 | S | S | * | * | trans | -93.8 | 60.2 | 171.5 | -72 | -173.8 | -21.1 | 0 | 0 | 110.2 | ||||
| 148 | I | 59.4 | Low | 53 | Low | 146 Ų | 146 | 140.1 Ų | 140.1 | 75% | 0.749 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -140.1 | 101.4 | 170.3 | -56.8 | 179 | 0 | 0 | 0 | 105.8 | T146 | T146-I148 VanDerWaalsContact C-N 3.32Å; T146-I148 PolarHBondContact O-N 3.06Å |
| 149 | F | 55.8 | Low | 53.3 | Low | 194 Ų | 194 | 144.9 Ų | 144.9 | 85% | 0.851 | 67% | 0.672 | S | S | * | * | trans | 58.1 | 55.3 | -178.6 | -56.5 | -76.6 | 0 | 0 | 0 | 117.3 | L151 | F149-L151 PolarHBondContact O-N 3.03Š| ||
| 150 | Q | 55.1 | Low | 53.6 | Low | 121 Ų | 121 | 147.5 Ų | 147.5 | 57% | 0.565 | 68% | 0.677 | S | S | * | * | trans | -84.3 | 93.9 | 166.8 | -130.7 | 150.4 | 51.4 | 0 | 0 | 109 | T146 | T146-Q150 PolarHBondContact O-NE2 3.33Å; T146-Q150 PolarHBondContact OG1-NE2 3.12Å | ||
| 151 | L | 63.1 | Low | 53.7 | Low | 70 Ų | 70 | 144.6 Ų | 144.6 | 37% | 0.366 | 67% | 0.667 | S | S | . | * | trans | -46.8 | 134.7 | 171.2 | -101.7 | 75.9 | 0 | 0 | 0 | 109.8 | F149 E155 R156 | F149-L151 PolarHBondContact O-N 3.03Å; L151-E155 HydrophobicContact CD2-CB 4.15Å; L151-E155 WeakPolarHBondContact CD2-OE2 3.41Å; L151-E155 VanDerWaalsContact CG-OE2 3.27Å; L151-E155 WeakPolarHBondContact CG-OE2 3.32Å; L151-R156 PolarHBondContact O-NE 3.45Å; L151-R156 PolarHBondContact O-NH2 2.9Å | ||
| 152 | P | 66.7 | Low | 53.6 | Low | 72 Ų | 72 | 139 Ų | 139 | 47% | 0.468 | 66% | 0.658 | S | S | . | * | trans | -47.6 | 141.6 | 176.1 | -25.1 | 31.6 | 0 | 0 | 0 | 111.1 | E154 E155 R156 | P152-E154 HydrophobicContact CB-CB 4.43Å; P152-E154 PolarHBondContact O-N 3.33Å; P152-E154 VanDerWaalsContact O-N 3.15Å; P152-E155 HydrophobicContact CB-CG 4.32Å; P152-E155 HydrophobicContact CG-CG 4.24Å; P152-E155 PolarHBondContact O-N 3.41Å; P152-R156 PolarHBondContact O-N 3.3Å | ||
| 153 | Y | 57.5 | Low | 53.9 | Low | 168 Ų | 168 | 132.4 Ų | 132.4 | 66% | 0.659 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -56.5 | -31.8 | 178.6 | -134.1 | -85.7 | 0 | 0 | 0 | 111.4 | R156 R157 | Y153-R156 PolarHBondContact O-N 2.99Å; Y153-R157 PolarHBondContact O-N 3.28Å |
| 154 | E | 59.2 | Low | 53.9 | Low | 134 Ų | 134 | 136.2 Ų | 136.2 | 63% | 0.626 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -54.2 | -49.3 | 169.6 | -121.1 | 69.3 | -155.3 | 0 | 0 | 112.8 | P152 R156 R157 Y158 | P152-E154 HydrophobicContact CB-CB 4.43Å; P152-E154 PolarHBondContact O-N 3.33Å; P152-E154 VanDerWaalsContact O-N 3.15Å; E154-R156 VanDerWaalsContact C-N 3.31Å; E154-R156 PolarHBondContact O-N 3.03Å; E154-R157 PolarHBondContact O-N 3.5Å; E154-Y158 WeakPolarHBondContact O-CD2 3.26Å; E154-Y158 PolarHBondContact O-N 3.16Å; E154-Y158 VanDerWaalsContact O-N 3.14Å |
| 155 | E | 59.2 | Low | 54.2 | Low | 100 Ų | 100 | 131.4 Ų | 131.4 | 47% | 0.467 | 64% | 0.64 | S | S | . | * | H | α-helix | trans | -70 | -28.5 | -179 | -69.5 | -170.6 | 174.4 | 0 | 0 | 112.6 | L151 P152 R159 | L151-E155 HydrophobicContact CD2-CB 4.15Å; L151-E155 WeakPolarHBondContact CD2-OE2 3.41Å; L151-E155 VanDerWaalsContact CG-OE2 3.27Å; L151-E155 WeakPolarHBondContact CG-OE2 3.32Å; P152-E155 HydrophobicContact CB-CG 4.32Å; P152-E155 HydrophobicContact CG-CG 4.24Å; P152-E155 PolarHBondContact O-N 3.41Å; E155-R159 PolarHBondContact O-N 3.49Å |
| 156 | R | 55.7 | Low | 54.2 | Low | 110 Ų | 110 | 133.8 Ų | 133.8 | 42% | 0.415 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -69 | -34.5 | 173.5 | -79.5 | -175.8 | -104.6 | -167.1 | -2.9 | 112.4 | L151 P152 Y153 E154 Q160 | L151-R156 PolarHBondContact O-NE 3.45Å; L151-R156 PolarHBondContact O-NH2 2.9Å; P152-R156 PolarHBondContact O-N 3.3Å; Y153-R156 PolarHBondContact O-N 2.99Å; E154-R156 VanDerWaalsContact C-N 3.31Å; E154-R156 PolarHBondContact O-N 3.03Å; R156-Q160 PolarHBondContact O-N 2.88Å |
| 157 | R | 56 | Low | 54.4 | Low | 161 Ų | 161 | 136.9 Ų | 136.9 | 61% | 0.608 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -69.8 | -43.7 | 173.7 | -71 | -166.9 | -177.3 | 175.2 | 3.7 | 111.3 | Y153 E154 R159 Q160 T161 | Y153-R157 PolarHBondContact O-N 3.28Å; E154-R157 PolarHBondContact O-N 3.5Å; R157-R159 VanDerWaalsContact C-N 3.28Å; R157-R159 PolarHBondContact O-N 3.28Å; R157-Q160 CarbonylContact O-C 3.56Å; R157-Q160 WeakPolarHBondContact O-CA 3.4Å; R157-Q160 PolarHBondContact O-N 2.75Å; R157-T161 PolarHBondContact O-N 2.89Å; R157-T161 PolarHBondContact O-OG1 2.84Å |
| 158 | Y | 50.7 | Low | 54.6 | Low | 182 Ų | 182 | 132.5 Ų | 132.5 | 71% | 0.714 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -60.6 | -32.1 | 179 | -94.4 | -86.3 | 0 | 0 | 0 | 114.2 | E154 Q160 S162 | E154-Y158 WeakPolarHBondContact O-CD2 3.26Å; E154-Y158 PolarHBondContact O-N 3.16Å; E154-Y158 VanDerWaalsContact O-N 3.14Å; Y158-Q160 VanDerWaalsContact C-N 3.34Å; Y158-S162 PolarHBondContact O-N 3.45Å |
| 159 | R | 53.8 | Low | 54.7 | Low | 210 Ų | 210 | 128.3 Ų | 128.3 | 79% | 0.792 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -74.4 | -21.8 | 172.3 | -71.5 | -169.5 | 177.6 | -137.8 | 1 | 114.1 | E155 R157 | E155-R159 PolarHBondContact O-N 3.49Å; R157-R159 VanDerWaalsContact C-N 3.28Å; R157-R159 PolarHBondContact O-N 3.28Å |
| 160 | Q | 53.3 | Low | 55.1 | Low | 164 Ų | 164 | 126.4 Ų | 126.4 | 77% | 0.766 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -96.8 | -20.1 | 178.7 | -94.7 | 179.2 | -6.9 | 0 | 0 | 113.9 | R156 R157 Y158 | R156-Q160 PolarHBondContact O-N 2.88Å; R157-Q160 CarbonylContact O-C 3.56Å; R157-Q160 WeakPolarHBondContact O-CA 3.4Å; R157-Q160 PolarHBondContact O-N 2.75Å; Y158-Q160 VanDerWaalsContact C-N 3.34Å |
| 161 | T | 50.7 | Low | 55.4 | Low | 96 Ų | 96 | 126.1 Ų | 126.1 | 59% | 0.589 | 61% | 0.613 | S | S | * | * | S | Bend | trans | -113.9 | 12.9 | -178.2 | 53.1 | 0 | 0 | 0 | 0 | 114.4 | R157 D163 | R157-T161 PolarHBondContact O-N 2.89Å; R157-T161 PolarHBondContact O-OG1 2.84Å; T161-D163 PolarHBondContact O-N 3.44Å |
| 162 | S | 45.7 | Very low | 55.5 | Low | 82 Ų | 82 | 126.2 Ų | 126.2 | 57% | 0.573 | 62% | 0.616 | S | S | * | * | trans | -76 | 61.8 | 169 | -177.1 | 0 | 0 | 0 | 0 | 111.1 | Y158 M164 | Y158-S162 PolarHBondContact O-N 3.45Å; S162-M164 PolarHBondContact O-N 3.39Å | ||
| 163 | D | 51.1 | Low | 55.5 | Low | 111 Ų | 111 | 124.8 Ų | 124.8 | 59% | 0.594 | 61% | 0.61 | S | S | * | * | trans | -83.4 | 16.9 | 164 | -75.4 | -42.3 | 0 | 0 | 0 | 111.6 | T161 R167 | T161-D163 PolarHBondContact O-N 3.44Å; D163-R167 IonicContact OD1-CZ 3.72Å; D163-R167 IonicContact OD1-NH1 2.64Å; D163-R167 IonicContact OD1-NH2 2.76Å; D163-R167 PolarHBondContact OD1-NH2 3.41Å | ||
| 164 | M | 48.7 | Very low | 56.1 | Low | 183 Ų | 183 | 120 Ų | 120 | 90% | 0.901 | 60% | 0.601 | S | S | * | * | S | Bend | trans | -117.6 | 26.1 | -175.1 | -67.9 | -70.4 | -89.1 | 0 | 0 | 113.9 | S162 | S162-M164 PolarHBondContact O-N 3.39Š|
| 165 | G | 49.6 | Very low | 56.8 | Low | 46 Ų | 46 | 117.4 Ų | 117.4 | 47% | 0.474 | 59% | 0.591 | S | S | . | * | S | Bend | trans | -138.4 | 117.6 | 169.9 | 0 | 0 | 0 | 0 | 0 | 107.4 | R167 | G165-R167 PolarHBondContact O-N 2.98Š|
| 166 | E | 45.3 | Very low | 57.6 | Low | 186 Ų | 186 | 117.3 Ų | 117.3 | 87% | 0.869 | 59% | 0.59 | S | S | * | * | trans | -27 | 101.9 | 178.8 | -66.7 | 175.2 | 146.3 | 0 | 0 | 111.1 | T168 | E166-T168 PolarHBondContact O-N 2.83Å; E166-T168 PolarHBondContact O-OG1 3.46Å | ||
| 167 | R | 53.3 | Low | 58.5 | Low | 165 Ų | 165 | 117.1 Ų | 117.1 | 62% | 0.623 | 60% | 0.596 | S | S | * | * | trans | -61.6 | 92.1 | 161.8 | -79.4 | -171.6 | -179.6 | 134.3 | 13.5 | 104.5 | D163 G165 G169 V172 | D163-R167 IonicContact OD1-CZ 3.72Å; D163-R167 IonicContact OD1-NH1 2.64Å; D163-R167 IonicContact OD1-NH2 2.76Å; D163-R167 PolarHBondContact OD1-NH2 3.41Å; G165-R167 PolarHBondContact O-N 2.98Å; R167-G169 PolarHBondContact O-N 3.06Å; R167-G169 VanDerWaalsContact O-N 3.13Å; R167-V172 HydrophobicContact CB-CG2 3.9Å | ||
| 168 | T | 56.9 | Low | 59.2 | Low | 82 Ų | 82 | 115.1 Ų | 115.1 | 50% | 0.503 | 60% | 0.595 | S | S | . | * | trans | -47.2 | 124.9 | 176.8 | -28.4 | 0 | 0 | 0 | 0 | 104.8 | E166 E170 Q171 | E166-T168 PolarHBondContact O-N 2.83Å; E166-T168 PolarHBondContact O-OG1 3.46Å; T168-E170 CarbonylContact O-C 3.53Å; T168-E170 PolarHBondContact O-N 3.15Å; T168-Q171 PolarHBondContact O-N 3.48Å | ||
| 169 | G | 62 | Low | 60.2 | Low | 58 Ų | 58 | 112.1 Ų | 112.1 | 60% | 0.598 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -50.3 | -24.7 | -173.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | R167 V172 A173 | R167-G169 PolarHBondContact O-N 3.06Å; R167-G169 VanDerWaalsContact O-N 3.13Å; G169-V172 PolarHBondContact O-N 3.06Å; G169-A173 VanDerWaalsContact O-CB 3.29Å; G169-A173 WeakPolarHBondContact O-CB 3.33Å; G169-A173 PolarHBondContact O-N 3.45Å |
| 170 | E | 62.9 | Low | 61 | Low | 154 Ų | 154 | 108.5 Ų | 108.5 | 72% | 0.72 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -60.3 | -40.3 | 171.1 | -58.8 | -177.4 | 169.3 | 0 | 0 | 114.7 | T168 A173 C174 | T168-E170 CarbonylContact O-C 3.53Å; T168-E170 PolarHBondContact O-N 3.15Å; E170-A173 PolarHBondContact O-N 3.33Å; E170-C174 VanDerWaalsContact O-CB 3.27Å; E170-C174 WeakPolarHBondContact O-CB 3.36Å; E170-C174 PolarHBondContact O-N 3.41Å |
| 171 | Q | 61.4 | Low | 61.5 | Low | 115 Ų | 115 | 104.6 Ų | 104.6 | 54% | 0.537 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -73.5 | -35.4 | 178.3 | -163.5 | 179.9 | 23 | 0 | 0 | 111.7 | T168 N175 | T168-Q171 PolarHBondContact O-N 3.48Å; Q171-N175 WeakPolarHBondContact O-CB 3.22Å; Q171-N175 PolarHBondContact O-N 3.16Å; Q171-N175 VanDerWaalsContact O-N 3.07Å; Q171-N175 PolarHBondContact O-ND2 3.43Å |
| 172 | V | 64.8 | Low | 61.9 | Low | 72 Ų | 72 | 102.1 Ų | 102.1 | 44% | 0.436 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -66.7 | -45.6 | 172.5 | -179 | 0 | 0 | 0 | 0 | 109.9 | R167 G169 C174 N175 E176 | R167-V172 HydrophobicContact CB-CG2 3.9Å; G169-V172 PolarHBondContact O-N 3.06Å; V172-C174 PolarHBondContact O-N 3.46Å; V172-N175 PolarHBondContact O-N 3.33Å; V172-E176 WeakPolarHBondContact O-CB 3.38Å; V172-E176 PolarHBondContact O-N 3.42Å |
| 173 | A | 67 | Low | 62.6 | Low | 42 Ų | 42 | 104.9 Ų | 104.9 | 35% | 0.347 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -62.2 | -42.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | G169 E170 E176 I177 | G169-A173 VanDerWaalsContact O-CB 3.29Å; G169-A173 WeakPolarHBondContact O-CB 3.33Å; G169-A173 PolarHBondContact O-N 3.45Å; E170-A173 PolarHBondContact O-N 3.33Å; A173-E176 PolarHBondContact O-N 3Å; A173-I177 WeakPolarHBondContact O-CB 3.31Å; A173-I177 VanDerWaalsContact O-CG1 3.22Å; A173-I177 WeakPolarHBondContact O-CG1 3.35Å; A173-I177 PolarHBondContact O-N 3.45Å |
| 174 | C | 71.3 | Confident | 63.1 | Low | 68 Ų | 68 | 102.4 Ų | 102.4 | 46% | 0.459 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -61.9 | -45.5 | 177.1 | -173.4 | 0 | 0 | 0 | 0 | 111.5 | E170 V172 E176 I177 M178 | E170-C174 VanDerWaalsContact O-CB 3.27Å; E170-C174 WeakPolarHBondContact O-CB 3.36Å; E170-C174 PolarHBondContact O-N 3.41Å; V172-C174 PolarHBondContact O-N 3.46Å; C174-E176 VanDerWaalsContact C-N 3.34Å; C174-E176 PolarHBondContact O-N 3.37Å; C174-I177 PolarHBondContact O-N 3.16Å; C174-M178 WeakPolarHBondContact O-CB 3.39Å; C174-M178 WeakPolarHBondContact O-CG 3.38Å; C174-M178 PolarHBondContact O-N 3.34Å |
| 175 | N | 74.4 | Confident | 63.7 | Low | 79 Ų | 79 | 100.7 Ų | 100.7 | 42% | 0.422 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63.8 | -38.4 | 175.3 | -82.2 | -32.7 | 0 | 0 | 0 | 112.3 | Q171 V172 M178 Q179 | Q171-N175 WeakPolarHBondContact O-CB 3.22Å; Q171-N175 PolarHBondContact O-N 3.16Å; Q171-N175 VanDerWaalsContact O-N 3.07Å; Q171-N175 PolarHBondContact O-ND2 3.43Å; V172-N175 PolarHBondContact O-N 3.33Å; N175-M178 PolarHBondContact O-N 3.13Å; N175-Q179 WeakPolarHBondContact O-CB 3.38Å; N175-Q179 WeakPolarHBondContact O-CG 3.45Å; N175-Q179 PolarHBondContact O-N 3.11Å |
| 176 | E | 75.8 | Confident | 64.4 | Low | 97 Ų | 97 | 102.2 Ų | 102.2 | 45% | 0.453 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -66.2 | -42.6 | 176.8 | -163.5 | -173.4 | 158.4 | 0 | 0 | 111.7 | V172 A173 C174 Q179 K180 | V172-E176 WeakPolarHBondContact O-CB 3.38Å; V172-E176 PolarHBondContact O-N 3.42Å; A173-E176 PolarHBondContact O-N 3Å; C174-E176 VanDerWaalsContact C-N 3.34Å; C174-E176 PolarHBondContact O-N 3.37Å; E176-Q179 PolarHBondContact O-N 3.2Å; E176-K180 HydrophobicContact CG-CD 4.29Å; E176-K180 WeakPolarHBondContact O-CB 3.47Å; E176-K180 WeakPolarHBondContact O-CG 3.27Å; E176-K180 PolarHBondContact O-N 2.83Å; E176-K180 WeakPolarHBondContact OE1-CE 3.26Å; E176-K180 IonicContact OE1-NZ 3.44Å; E176-K180 PolarHBondContact OE1-NZ 3.44Å |
| 177 | I | 74 | Confident | 65.4 | Low | 106 Ų | 106 | 97.8 Ų | 97.8 | 54% | 0.544 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.7 | -44 | 175.1 | -67.2 | 165.4 | 0 | 0 | 0 | 110.6 | A173 C174 Q179 K180 T181 | A173-I177 WeakPolarHBondContact O-CB 3.31Å; A173-I177 VanDerWaalsContact O-CG1 3.22Å; A173-I177 WeakPolarHBondContact O-CG1 3.35Å; A173-I177 PolarHBondContact O-N 3.45Å; C174-I177 PolarHBondContact O-N 3.16Å; I177-Q179 VanDerWaalsContact C-N 3.35Å; I177-Q179 PolarHBondContact O-N 2.96Å; I177-K180 PolarHBondContact O-N 3.17Å; I177-T181 VanDerWaalsContact O-CB 3.26Å; I177-T181 WeakPolarHBondContact O-CB 3.29Å; I177-T181 PolarHBondContact O-N 3.41Å; I177-T181 PolarHBondContact O-OG1 2.91Å |
| 178 | M | 70.4 | Confident | 66.2 | Low | 119 Ų | 119 | 94.4 Ų | 94.4 | 59% | 0.586 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -62.7 | -40.8 | 176.3 | -80.4 | 178.4 | 23.6 | 0 | 0 | 111.7 | C174 N175 G182 | C174-M178 WeakPolarHBondContact O-CB 3.39Å; C174-M178 WeakPolarHBondContact O-CG 3.38Å; C174-M178 PolarHBondContact O-N 3.34Å; N175-M178 PolarHBondContact O-N 3.13Å; M178-G182 PolarHBondContact O-N 3.45Å |
| 179 | Q | 71.8 | Confident | 66.8 | Low | 120 Ų | 120 | 92.5 Ų | 92.5 | 56% | 0.561 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -69.8 | -40.1 | 176.6 | -75.6 | -172.5 | 21.2 | 0 | 0 | 112.6 | N175 E176 I177 K183 | N175-Q179 WeakPolarHBondContact O-CB 3.38Å; N175-Q179 WeakPolarHBondContact O-CG 3.45Å; N175-Q179 PolarHBondContact O-N 3.11Å; E176-Q179 PolarHBondContact O-N 3.2Å; I177-Q179 VanDerWaalsContact C-N 3.35Å; I177-Q179 PolarHBondContact O-N 2.96Å; Q179-K183 WeakPolarHBondContact O-CB 3.44Å; Q179-K183 VanDerWaalsContact O-CG 3.26Å; Q179-K183 WeakPolarHBondContact O-CG 3.28Å; Q179-K183 PolarHBondContact O-N 3.37Å |
| 180 | K | 71 | Confident | 67.2 | Low | 134 Ų | 134 | 92.4 Ų | 92.4 | 58% | 0.583 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -64.9 | -43.2 | 176.1 | -79.1 | 173.6 | 170.7 | 169.2 | 0 | 111.3 | E176 I177 S184 | E176-K180 HydrophobicContact CG-CD 4.29Å; E176-K180 WeakPolarHBondContact O-CB 3.47Å; E176-K180 WeakPolarHBondContact O-CG 3.27Å; E176-K180 PolarHBondContact O-N 2.83Å; E176-K180 WeakPolarHBondContact OE1-CE 3.26Å; E176-K180 IonicContact OE1-NZ 3.44Å; E176-K180 PolarHBondContact OE1-NZ 3.44Å; I177-K180 PolarHBondContact O-N 3.17Å; K180-S184 PolarHBondContact O-N 3.34Å; K180-S184 PolarHBondContact O-OG 2.81Å |
| 181 | T | 62.5 | Low | 67.6 | Low | 82 Ų | 82 | 89.2 Ų | 89.2 | 50% | 0.503 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -71.3 | -37.7 | 177.9 | -51.1 | 0 | 0 | 0 | 0 | 112.3 | I177 S184 F185 | I177-T181 VanDerWaalsContact O-CB 3.26Å; I177-T181 WeakPolarHBondContact O-CB 3.29Å; I177-T181 PolarHBondContact O-N 3.41Å; I177-T181 PolarHBondContact O-OG1 2.91Å; T181-S184 WeakPolarHBondContact CA-OG 3.25Å; T181-S184 PolarHBondContact O-N 3.07Å; T181-S184 PolarHBondContact O-OG 2.99Å; T181-F185 WeakPolarHBondContact O-CB 3.28Å; T181-F185 PolarHBondContact O-N 3.34Å |
| 182 | G | 61 | Low | 68.1 | Low | 43 Ų | 43 | 88 Ų | 88 | 44% | 0.443 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -66.9 | -40.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | M178 C186 | M178-G182 PolarHBondContact O-N 3.45Å; G182-C186 WeakPolarHBondContact O-CB 3.46Å; G182-C186 PolarHBondContact O-N 2.95Å |
| 183 | K | 60.2 | Low | 68.4 | Low | 140 Ų | 140 | 89.6 Ų | 89.6 | 61% | 0.609 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -66.7 | -41.9 | 176 | -73 | 172.7 | -176.6 | 174.3 | 0 | 111.7 | Q179 C186 V187 | Q179-K183 WeakPolarHBondContact O-CB 3.44Å; Q179-K183 VanDerWaalsContact O-CG 3.26Å; Q179-K183 WeakPolarHBondContact O-CG 3.28Å; Q179-K183 PolarHBondContact O-N 3.37Å; K183-C186 PolarHBondContact O-N 2.87Å; K183-V187 WeakPolarHBondContact O-CG2 3.48Å; K183-V187 PolarHBondContact O-N 3.49Å; K183-V187 VanDerWaalsContact O-N 3.08Å |
| 184 | S | 60.2 | Low | 68.3 | Low | 59 Ų | 59 | 92.6 Ų | 92.6 | 41% | 0.413 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.8 | -40.6 | 177.4 | 58.8 | 0 | 0 | 0 | 0 | 112.1 | K180 T181 C186 V187 I188 | K180-S184 PolarHBondContact O-N 3.34Å; K180-S184 PolarHBondContact O-OG 2.81Å; T181-S184 WeakPolarHBondContact CA-OG 3.25Å; T181-S184 PolarHBondContact O-N 3.07Å; T181-S184 PolarHBondContact O-OG 2.99Å; S184-C186 PolarHBondContact O-N 3.39Å; S184-V187 PolarHBondContact O-N 3.39Å; S184-I188 WeakPolarHBondContact O-CD1 3.25Å; S184-I188 VanDerWaalsContact O-CG1 3.25Å; S184-I188 WeakPolarHBondContact O-CG1 3.19Å; S184-I188 PolarHBondContact O-N 3.44Å |
| 185 | F | 62.5 | Low | 68.2 | Low | 148 Ų | 148 | 97.8 Ų | 97.8 | 65% | 0.649 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -64.9 | -38.3 | 175.8 | -167.4 | -95 | 0 | 0 | 0 | 112.4 | T181 I188 S189 | T181-F185 WeakPolarHBondContact O-CB 3.28Å; T181-F185 PolarHBondContact O-N 3.34Å; F185-I188 PolarHBondContact O-N 3.39Å; F185-S189 WeakPolarHBondContact O-CB 3.47Å; F185-S189 PolarHBondContact O-N 2.93Å |
| 186 | C | 64 | Low | 67.8 | Low | 77 Ų | 77 | 102.2 Ų | 102.2 | 52% | 0.52 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -66.9 | -39.7 | 177.6 | -166.3 | 0 | 0 | 0 | 0 | 112.3 | G182 K183 S184 S190 | G182-C186 WeakPolarHBondContact O-CB 3.46Å; G182-C186 PolarHBondContact O-N 2.95Å; K183-C186 PolarHBondContact O-N 2.87Å; S184-C186 PolarHBondContact O-N 3.39Å; C186-S190 VanDerWaalsContact O-CB 3.28Å; C186-S190 WeakPolarHBondContact O-CB 3.33Å; C186-S190 PolarHBondContact O-N 3.33Å; C186-S190 PolarHBondContact O-OG 3.45Å |
| 187 | V | 65.9 | Low | 67.4 | Low | 93 Ų | 93 | 104.1 Ų | 104.1 | 56% | 0.564 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -66.4 | -45.8 | 175.2 | 175.4 | 0 | 0 | 0 | 0 | 110.7 | K183 S184 S189 S190 V191 | K183-V187 WeakPolarHBondContact O-CG2 3.48Å; K183-V187 PolarHBondContact O-N 3.49Å; K183-V187 VanDerWaalsContact O-N 3.08Å; S184-V187 PolarHBondContact O-N 3.39Å; V187-S189 PolarHBondContact O-N 3.05Å; V187-S190 PolarHBondContact O-N 3.01Å; V187-V191 HydrophobicContact CG1-CG2 4.41Å; V187-V191 VanDerWaalsContact O-CG2 3.28Å; V187-V191 WeakPolarHBondContact O-CG2 3.34Å; V187-V191 PolarHBondContact O-N 3.35Å |
| 188 | I | 69.5 | Low | 66.6 | Low | 94 Ų | 94 | 105.9 Ų | 105.9 | 48% | 0.482 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -62.8 | -45.4 | 177.9 | -66.4 | 164.3 | 0 | 0 | 0 | 110.6 | S184 F185 S190 V191 L192 | S184-I188 WeakPolarHBondContact O-CD1 3.25Å; S184-I188 VanDerWaalsContact O-CG1 3.25Å; S184-I188 WeakPolarHBondContact O-CG1 3.19Å; S184-I188 PolarHBondContact O-N 3.44Å; F185-I188 PolarHBondContact O-N 3.39Å; I188-S190 VanDerWaalsContact C-N 3.33Å; I188-S190 PolarHBondContact O-N 3.15Å; I188-V191 PolarHBondContact O-N 3.26Å; I188-L192 HydrophobicContact CG2-CD1 3.77Å; I188-L192 HydrophobicContact CG2-CG 4.27Å; I188-L192 WeakPolarHBondContact O-CB 3.04Å; I188-L192 VanDerWaalsContact O-CG 3.29Å; I188-L192 WeakPolarHBondContact O-CG 3.42Å; I188-L192 PolarHBondContact O-N 3.27Å |
| 189 | S | 69.3 | Low | 66.2 | Low | 43 Ų | 43 | 103.4 Ų | 103.4 | 30% | 0.301 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -61.3 | -41.4 | 176.6 | -178.3 | 0 | 0 | 0 | 0 | 111.7 | F185 V187 L192 L193 | F185-S189 WeakPolarHBondContact O-CB 3.47Å; F185-S189 PolarHBondContact O-N 2.93Å; V187-S189 PolarHBondContact O-N 3.05Å; S189-L192 PolarHBondContact O-N 3.39Å; S189-L193 VanDerWaalsContact O-CB 3.25Å; S189-L193 WeakPolarHBondContact O-CB 3.4Å; S189-L193 VanDerWaalsContact O-CG 3.29Å; S189-L193 WeakPolarHBondContact O-CG 3.24Å; S189-L193 PolarHBondContact O-N 3.05Å |
| 190 | S | 70.7 | Confident | 65.6 | Low | 56 Ų | 56 | 104.4 Ų | 104.4 | 39% | 0.392 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -66.6 | -38.3 | 177.1 | -60.4 | 0 | 0 | 0 | 0 | 112.6 | C186 V187 I188 N194 | C186-S190 VanDerWaalsContact O-CB 3.28Å; C186-S190 WeakPolarHBondContact O-CB 3.33Å; C186-S190 PolarHBondContact O-N 3.33Å; C186-S190 PolarHBondContact O-OG 3.45Å; V187-S190 PolarHBondContact O-N 3.01Å; I188-S190 VanDerWaalsContact C-N 3.33Å; I188-S190 PolarHBondContact O-N 3.15Å; S190-N194 WeakPolarHBondContact O-CB 3.29Å; S190-N194 PolarHBondContact O-N 3.49Å; S190-N194 PolarHBondContact O-ND2 3.32Å |
| 191 | V | 71.9 | Confident | 65.1 | Low | 87 Ų | 87 | 104.8 Ų | 104.8 | 53% | 0.527 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -69.1 | -45 | 176.1 | 172.1 | 0 | 0 | 0 | 0 | 110.6 | V187 I188 N194 Y195 | V187-V191 HydrophobicContact CG1-CG2 4.41Å; V187-V191 VanDerWaalsContact O-CG2 3.28Å; V187-V191 WeakPolarHBondContact O-CG2 3.34Å; V187-V191 PolarHBondContact O-N 3.35Å; I188-V191 PolarHBondContact O-N 3.26Å; V191-N194 PolarHBondContact O-N 3.29Å; V191-Y195 VanDerWaalsContact O-CB 3.29Å; V191-Y195 WeakPolarHBondContact O-CB 3.44Å; V191-Y195 PolarHBondContact O-N 3.03Å |
| 192 | L | 72 | Confident | 65 | Low | 88 Ų | 88 | 105.8 Ų | 105.8 | 46% | 0.461 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -64.4 | -46.3 | 177.3 | -69.9 | 171.6 | 0 | 0 | 0 | 111.4 | I188 S189 N194 Y195 Y196 | I188-L192 HydrophobicContact CG2-CD1 3.77Å; I188-L192 HydrophobicContact CG2-CG 4.27Å; I188-L192 WeakPolarHBondContact O-CB 3.04Å; I188-L192 VanDerWaalsContact O-CG 3.29Å; I188-L192 WeakPolarHBondContact O-CG 3.42Å; I188-L192 PolarHBondContact O-N 3.27Å; S189-L192 PolarHBondContact O-N 3.39Å; L192-N194 VanDerWaalsContact C-N 3.32Å; L192-N194 PolarHBondContact O-N 3.43Å; L192-Y195 PolarHBondContact O-N 3.02Å; L192-Y196 HydrophobicContact CD2-CE2 4.1Å; L192-Y196 VanDerWaalsContact O-CD2 3.24Å; L192-Y196 WeakPolarHBondContact O-CD2 2.89Å; L192-Y196 PolarHBondContact O-N 3.23Å |
| 193 | L | 70.2 | Confident | 65.1 | Low | 106 Ų | 106 | 106.7 Ų | 106.7 | 56% | 0.555 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -59.5 | -43.3 | 175.7 | -77 | 165.5 | 0 | 0 | 0 | 110.7 | S189 Y197 | S189-L193 VanDerWaalsContact O-CB 3.25Å; S189-L193 WeakPolarHBondContact O-CB 3.4Å; S189-L193 VanDerWaalsContact O-CG 3.29Å; S189-L193 WeakPolarHBondContact O-CG 3.24Å; S189-L193 PolarHBondContact O-N 3.05Å; L193-Y197 WeakPolarHBondContact O-CA 3.2Å; L193-Y197 WeakPolarHBondContact O-CB 3.2Å; L193-Y197 PolarHBondContact O-N 2.76Å |
| 194 | N | 66 | Low | 65.2 | Low | 105 Ų | 105 | 103 Ų | 103 | 56% | 0.561 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -66.3 | -40.4 | 174.5 | -84.8 | -77 | 0 | 0 | 0 | 112.7 | S190 V191 L192 Y196 F198 | S190-N194 WeakPolarHBondContact O-CB 3.29Å; S190-N194 PolarHBondContact O-N 3.49Å; S190-N194 PolarHBondContact O-ND2 3.32Å; V191-N194 PolarHBondContact O-N 3.29Å; L192-N194 VanDerWaalsContact C-N 3.32Å; L192-N194 PolarHBondContact O-N 3.43Å; N194-Y196 PolarHBondContact O-N 2.99Å; N194-F198 WeakPolarHBondContact O-CB 3.39Å; N194-F198 PolarHBondContact O-N 2.82Å |
| 195 | Y | 69.2 | Low | 65.3 | Low | 178 Ų | 178 | 107.3 Ų | 107.3 | 70% | 0.698 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -69 | -32.2 | -177.4 | -153.8 | -93 | 0 | 0 | 0 | 113.1 | V191 L192 P199 | V191-Y195 VanDerWaalsContact O-CB 3.29Å; V191-Y195 WeakPolarHBondContact O-CB 3.44Å; V191-Y195 PolarHBondContact O-N 3.03Å; L192-Y195 PolarHBondContact O-N 3.02Å; Y195-P199 WeakPolarHBondContact O-CD 3.41Å; Y195-P199 WeakPolarHBondContact O-CG 3.46Å |
| 196 | Y | 66.7 | Low | 65.2 | Low | 171 Ų | 171 | 106.9 Ų | 106.9 | 67% | 0.671 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -90.1 | -34.7 | 175.8 | -74.7 | -75.6 | 0 | 0 | 0 | 113 | L192 N194 F200 | L192-Y196 HydrophobicContact CD2-CE2 4.1Å; L192-Y196 VanDerWaalsContact O-CD2 3.24Å; L192-Y196 WeakPolarHBondContact O-CD2 2.89Å; L192-Y196 PolarHBondContact O-N 3.23Å; N194-Y196 PolarHBondContact O-N 2.99Å; Y196-F200 WeakPolarHBondContact O-CB 3.4Å |
| 197 | Y | 65.4 | Low | 65.3 | Low | 138 Ų | 138 | 110.6 Ų | 110.6 | 54% | 0.541 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -82.7 | -30 | -175.7 | -152.7 | -95.7 | 0 | 0 | 0 | 112.8 | L193 F200 R201 | L193-Y197 WeakPolarHBondContact O-CA 3.2Å; L193-Y197 WeakPolarHBondContact O-CB 3.2Å; L193-Y197 PolarHBondContact O-N 2.76Å; Y197-F200 PolarHBondContact O-N 3.03Å; Y197-R201 HydrophobicContact CD1-CG 3.95Å; Y197-R201 HydrophobicContact CE1-CG 3.86Å; Y197-R201 WeakPolarHBondContact O-CB 3.1Å; Y197-R201 PolarHBondContact O-N 2.96Å |
| 198 | F | 58.4 | Low | 65.2 | Low | 142 Ų | 142 | 113.8 Ų | 113.8 | 62% | 0.623 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -66.1 | -48 | 177.2 | -160.4 | -92.9 | 0 | 0 | 0 | 113.5 | N194 F200 R201 L202 | N194-F198 WeakPolarHBondContact O-CB 3.39Å; N194-F198 PolarHBondContact O-N 2.82Å; F198-F200 VanDerWaalsContact C-N 3.27Å; F198-F200 PolarHBondContact O-N 3.44Å; F198-R201 PolarHBondContact O-N 3.41Å; F198-L202 WeakPolarHBondContact O-CB 3.45Å; F198-L202 PolarHBondContact O-N 2.91Å |
| 199 | P | 60.9 | Low | 64.4 | Low | 68 Ų | 68 | 122.4 Ų | 122.4 | 44% | 0.442 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -67.8 | -27.9 | 173.4 | 27.1 | -33.8 | 0 | 0 | 0 | 112 | Y195 L202 A203 | Y195-P199 WeakPolarHBondContact O-CD 3.41Å; Y195-P199 WeakPolarHBondContact O-CG 3.46Å; P199-L202 PolarHBondContact O-N 3.4Å; P199-A203 WeakPolarHBondContact O-CB 3.29Å; P199-A203 PolarHBondContact O-N 3.14Å |
| 200 | F | 59.3 | Low | 64.2 | Low | 140 Ų | 140 | 126.4 Ų | 126.4 | 61% | 0.614 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -69.9 | -40.5 | 176.1 | -156.9 | -93.7 | 0 | 0 | 0 | 112.3 | Y196 Y197 F198 T204 | Y196-F200 WeakPolarHBondContact O-CB 3.4Å; Y197-F200 PolarHBondContact O-N 3.03Å; F198-F200 VanDerWaalsContact C-N 3.27Å; F198-F200 PolarHBondContact O-N 3.44Å; F200-T204 HydrophobicContact CD1-CG2 4.41Å; F200-T204 HydrophobicContact CE1-CG2 4.3Å; F200-T204 WeakPolarHBondContact O-CB 3.33Å; F200-T204 WeakPolarHBondContact O-CG2 3.45Å; F200-T204 PolarHBondContact O-N 3.24Å; F200-T204 PolarHBondContact O-OG1 3.1Å |
| 201 | R | 61.4 | Low | 63.9 | Low | 143 Ų | 143 | 130.1 Ų | 130.1 | 54% | 0.54 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -66.9 | -37.7 | 171.4 | -85.6 | -86.2 | -174.6 | 170.7 | 0.8 | 112.3 | Y197 F198 T204 F205 | Y197-R201 HydrophobicContact CD1-CG 3.95Å; Y197-R201 HydrophobicContact CE1-CG 3.86Å; Y197-R201 WeakPolarHBondContact O-CB 3.1Å; Y197-R201 PolarHBondContact O-N 2.96Å; F198-R201 PolarHBondContact O-N 3.41Å; R201-T204 WeakPolarHBondContact CA-OG1 2.96Å; R201-T204 PolarHBondContact O-OG1 3.1Å; R201-F205 WeakPolarHBondContact O-CB 3.48Å; R201-F205 PolarHBondContact O-N 3.35Å |
| 202 | L | 59.9 | Low | 63.4 | Low | 103 Ų | 103 | 132.5 Ų | 132.5 | 54% | 0.539 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -72.2 | -40.4 | 178.3 | -162.1 | 72.2 | 0 | 0 | 0 | 112 | F198 P199 F205 Q206 | F198-L202 WeakPolarHBondContact O-CB 3.45Å; F198-L202 PolarHBondContact O-N 2.91Å; P199-L202 PolarHBondContact O-N 3.4Å; L202-F205 PolarHBondContact O-N 3.06Å; L202-Q206 WeakPolarHBondContact O-CG 3.16Å; L202-Q206 PolarHBondContact O-N 3.11Å |
| 203 | A | 62.7 | Low | 62.9 | Low | 61 Ų | 61 | 135.1 Ų | 135.1 | 50% | 0.504 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -64.9 | -40.7 | 175 | 0 | 0 | 0 | 0 | 0 | 111.7 | P199 Q206 L207 | P199-A203 WeakPolarHBondContact O-CB 3.29Å; P199-A203 PolarHBondContact O-N 3.14Å; A203-Q206 PolarHBondContact O-N 3.35Å; A203-L207 WeakPolarHBondContact O-CB 3.41Å; A203-L207 PolarHBondContact O-N 3.4Å |
| 204 | T | 63.4 | Low | 62.5 | Low | 64 Ų | 64 | 136.9 Ų | 136.9 | 39% | 0.393 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -68.6 | -33.1 | 175 | 47.1 | 0 | 0 | 0 | 0 | 112.7 | F200 R201 L208 | F200-T204 HydrophobicContact CD1-CG2 4.41Å; F200-T204 HydrophobicContact CE1-CG2 4.3Å; F200-T204 WeakPolarHBondContact O-CB 3.33Å; F200-T204 WeakPolarHBondContact O-CG2 3.45Å; F200-T204 PolarHBondContact O-N 3.24Å; F200-T204 PolarHBondContact O-OG1 3.1Å; R201-T204 WeakPolarHBondContact CA-OG1 2.96Å; R201-T204 PolarHBondContact O-OG1 3.1Å; T204-L208 PolarHBondContact O-N 3.49Å |
| 205 | F | 61.5 | Low | 62.2 | Low | 148 Ų | 148 | 139.1 Ų | 139.1 | 65% | 0.649 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -70.7 | -35.5 | 173.8 | -111.7 | -87.6 | 0 | 0 | 0 | 113.5 | R201 L202 L207 L208 | R201-F205 WeakPolarHBondContact O-CB 3.48Å; R201-F205 PolarHBondContact O-N 3.35Å; L202-F205 PolarHBondContact O-N 3.06Å; F205-L207 VanDerWaalsContact C-N 3.34Å; F205-L208 PolarHBondContact O-N 3.27Å |
| 206 | Q | 61.3 | Low | 61.7 | Low | 139 Ų | 139 | 136.3 Ų | 136.3 | 65% | 0.65 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -75.3 | -23.3 | 175.9 | -69.8 | -75.7 | 50.7 | 0 | 0 | 112.9 | L202 A203 | L202-Q206 WeakPolarHBondContact O-CG 3.16Å; L202-Q206 PolarHBondContact O-N 3.11Å; A203-Q206 PolarHBondContact O-N 3.35Å |
| 207 | L | 64.9 | Low | 61.3 | Low | 156 Ų | 156 | 133.6 Ų | 133.6 | 82% | 0.817 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -82.2 | -17.6 | 174.6 | -147.3 | 92.7 | 0 | 0 | 0 | 113 | A203 F205 | A203-L207 WeakPolarHBondContact O-CB 3.41Å; A203-L207 PolarHBondContact O-N 3.4Å; F205-L207 VanDerWaalsContact C-N 3.34Å |
| 208 | L | 65.5 | Low | 61 | Low | 160 Ų | 160 | 133.3 Ų | 133.3 | 84% | 0.838 | 64% | 0.637 | S | S | * | * | trans | -96.1 | 0.9 | -179.2 | -123 | 88.1 | 0 | 0 | 0 | 113.9 | T204 F205 | T204-L208 PolarHBondContact O-N 3.49Å; F205-L208 PolarHBondContact O-N 3.27Å | ||
| 209 | R | 52.7 | Low | 61.2 | Low | 275 Ų | 275 | 132.5 Ų | 132.5 | 100% | 1.038 | 64% | 0.638 | S | S | * | * | trans | -111.1 | 0 | 178 | -163.6 | -177.4 | -172.7 | 148.6 | 4 | 110.2 |
Retrieved 209 of 209 residues in 62 ms
(Link to these results)