| 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 | 41.8 | Very low | 37.9 | Very low | 240 Ų | 240 | 132.6 Ų | 132.6 | 100% | 1.182 | 82% | 0.816 | S | S | * | * | 0 | 123.8 | 0 | -60.6 | 172.9 | -178.5 | 0 | 0 | 107.2 | |||||
| 2 | S | 35.5 | Very low | 37.7 | Very low | 96 Ų | 96 | 140.5 Ų | 140.5 | 67% | 0.671 | 82% | 0.82 | S | S | * | * | cis | 163.7 | 110.7 | -18.1 | 34.9 | 0 | 0 | 0 | 0 | 105.7 | ||||
| 3 | L | 36.6 | Very low | 37.3 | Very low | 177 Ų | 177 | 147.2 Ų | 147.2 | 93% | 0.927 | 82% | 0.823 | S | S | * | * | trans | 68.6 | 149.4 | 161.8 | -47.7 | 173.1 | 0 | 0 | 0 | 114.7 | ||||
| 4 | S | 39.1 | Very low | 36.8 | Very low | 100 Ų | 100 | 144.4 Ų | 144.4 | 70% | 0.699 | 82% | 0.818 | S | S | * | * | cis | -144.5 | 147.9 | 30 | -175.1 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 5 | V | 42.2 | Very low | 36.5 | Very low | 122 Ų | 122 | 142.1 Ų | 142.1 | 74% | 0.739 | 82% | 0.815 | S | S | * | * | trans | -111.4 | 134.4 | 162.5 | 169.7 | 0 | 0 | 0 | 0 | 107 | T7 | V5-T7 HydrophobicContact CG1-CG2 4.47Š| ||
| 6 | C | 40 | Very low | 36.4 | Very low | 123 Ų | 123 | 139.7 Ų | 139.7 | 83% | 0.831 | 81% | 0.809 | S | S | * | * | trans | -125.4 | 94.2 | 168.6 | -76.3 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 7 | T | 45.3 | Very low | 36.5 | Very low | 125 Ų | 125 | 141.1 Ų | 141.1 | 77% | 0.767 | 81% | 0.806 | S | S | * | * | trans | -119.2 | 115.4 | 162.5 | 49.7 | 0 | 0 | 0 | 0 | 109 | V5 | V5-T7 HydrophobicContact CG1-CG2 4.47Š| ||
| 8 | S | 34.6 | Very low | 36.3 | Very low | 114 Ų | 114 | 141.9 Ų | 141.9 | 80% | 0.797 | 81% | 0.808 | S | S | * | * | trans | -168 | 121.3 | 162.9 | 52 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 9 | A | 33.5 | Very low | 35.9 | Very low | 90 Ų | 90 | 138.4 Ų | 138.4 | 74% | 0.744 | 81% | 0.806 | S | S | * | * | cis | 101.2 | 121.8 | 41.4 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 10 | L | 36.6 | Very low | 35.8 | Very low | 159 Ų | 159 | 136.5 Ų | 136.5 | 83% | 0.832 | 81% | 0.807 | S | S | * | * | trans | 8.4 | 127.2 | 155.3 | -59.5 | 100.3 | 0 | 0 | 0 | 120.9 | ||||
| 11 | S | 32.3 | Very low | 35.7 | Very low | 113 Ų | 113 | 135.4 Ų | 135.4 | 79% | 0.79 | 81% | 0.814 | S | S | * | * | -167.5 | 130.9 | 113.4 | -88.5 | 0 | 0 | 0 | 0 | 110.1 | |||||
| 12 | R | 34.6 | Very low | 35.3 | Very low | 227 Ų | 227 | 128 Ų | 128 | 86% | 0.857 | 80% | 0.799 | S | S | * | * | 86.4 | 140 | 51.7 | -176.6 | -173.8 | -90.7 | -116 | 4.4 | 111.7 | |||||
| 13 | R | 33.2 | Very low | 35.5 | Very low | 227 Ų | 227 | 135 Ų | 135 | 86% | 0.857 | 81% | 0.811 | S | S | * | * | trans | 95.8 | 103.3 | 170.6 | -139.1 | 167.4 | -162.4 | -123.2 | 2.1 | 113.7 | ||||
| 14 | S | 30 | Very low | 36 | Very low | 109 Ų | 109 | 132 Ų | 132 | 76% | 0.762 | 80% | 0.801 | S | S | * | * | cis | 84 | 112.2 | 47.5 | -57 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 15 | S | 32 | Very low | 35.7 | Very low | 109 Ų | 109 | 139.5 Ų | 139.5 | 76% | 0.762 | 81% | 0.814 | S | S | * | * | -179.7 | 121 | 128.9 | 55.1 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 16 | S | 35.5 | Very low | 35.2 | Very low | 104 Ų | 104 | 136.5 Ų | 136.5 | 73% | 0.727 | 81% | 0.808 | S | S | * | * | trans | 57.2 | 149.3 | 132.7 | 68.1 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 17 | Q | 37.7 | Very low | 34.8 | Very low | 163 Ų | 163 | 135 Ų | 135 | 76% | 0.762 | 81% | 0.805 | S | S | * | * | cis | -161.8 | 143.6 | 18.1 | -145.5 | 165 | 17.1 | 0 | 0 | 113.3 | ||||
| 18 | N | 32.1 | Very low | 34.1 | Very low | 157 Ų | 157 | 134.9 Ų | 134.9 | 84% | 0.84 | 81% | 0.809 | S | S | * | * | trans | 53.9 | 143.7 | 149.9 | -67.1 | 6.7 | 0 | 0 | 0 | 124.3 | ||||
| 19 | G | 29.8 | Very low | 33.9 | Very low | 75 Ų | 75 | 133.6 Ų | 133.6 | 77% | 0.773 | 81% | 0.805 | S | S | * | * | trans | 133.5 | 53.8 | 169.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 20 | A | 33.8 | Very low | 33.8 | Very low | 99 Ų | 99 | 134.5 Ų | 134.5 | 82% | 0.818 | 81% | 0.806 | S | S | * | * | 81.7 | 126.8 | 76 | 0 | 0 | 0 | 0 | 0 | 115.3 | |||||
| 21 | A | 33.8 | Very low | 33.5 | Very low | 115 Ų | 115 | 131.8 Ų | 131.8 | 95% | 0.95 | 80% | 0.8 | S | S | * | * | trans | 73.5 | 130.4 | 168.8 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 22 | G | 32.7 | Very low | 33.6 | Very low | 84 Ų | 84 | 133.2 Ų | 133.2 | 87% | 0.866 | 80% | 0.804 | S | S | * | * | trans | 135.6 | 60.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 23 | R | 39.9 | Very low | 33.5 | Very low | 244 Ų | 244 | 127.1 Ų | 127.1 | 92% | 0.921 | 80% | 0.802 | S | S | * | * | trans | -96.5 | 161.7 | 178.4 | -105 | -170.4 | 166.7 | -103.6 | -0.3 | 112.8 | ||||
| 24 | P | 48.1 | Very low | 33.4 | Very low | 112 Ų | 112 | 120.2 Ų | 120.2 | 73% | 0.727 | 80% | 0.802 | S | S | * | * | trans | -107.9 | 171.6 | -158.2 | 41.8 | -37.8 | 0 | 0 | 0 | 115.9 | ||||
| 25 | W | 31.6 | Very low | 33.6 | Very low | 258 Ų | 258 | 118.3 Ų | 118.3 | 98% | 0.977 | 80% | 0.799 | S | S | * | * | trans | -121.9 | 145.9 | 154.2 | -124.8 | -56.2 | 0 | 0 | 0 | 106.4 | ||||
| 26 | G | 31.8 | Very low | 33.9 | Very low | 59 Ų | 59 | 124.7 Ų | 124.7 | 61% | 0.608 | 81% | 0.808 | S | S | * | * | cis | 137.7 | 79.8 | -6.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 27 | A | 31.4 | Very low | 33.7 | Very low | 93 Ų | 93 | 123.5 Ų | 123.5 | 77% | 0.769 | 81% | 0.812 | S | S | * | * | trans | 60.5 | 125.8 | 144.9 | 0 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 28 | S | 30.2 | Very low | 33.3 | Very low | 121 Ų | 121 | 119.5 Ų | 119.5 | 85% | 0.846 | 82% | 0.815 | S | S | * | * | 91.1 | 158.8 | 126.8 | -67.2 | 0 | 0 | 0 | 0 | 123.6 | |||||
| 29 | A | 31.2 | Very low | 33.4 | Very low | 87 Ų | 87 | 118.2 Ų | 118.2 | 72% | 0.719 | 82% | 0.818 | S | S | * | * | trans | 77.4 | 111.1 | 170.1 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 30 | S | 31.2 | Very low | 33.4 | Very low | 110 Ų | 110 | 119.4 Ų | 119.4 | 77% | 0.769 | 82% | 0.821 | S | S | * | * | 69.7 | 134.9 | 65.9 | 80.6 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 31 | S | 30.8 | Very low | 33.5 | Very low | 101 Ų | 101 | 121 Ų | 121 | 71% | 0.706 | 83% | 0.826 | S | S | * | * | cis | -179.9 | -176.7 | 43 | 57.1 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 32 | V | 33.4 | Very low | 33.3 | Very low | 144 Ų | 144 | 119.3 Ų | 119.3 | 87% | 0.873 | 82% | 0.82 | S | S | * | * | trans | 82.7 | 140.9 | 154.9 | 169.8 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 33 | A | 32.7 | Very low | 33.3 | Very low | 99 Ų | 99 | 126 Ų | 126 | 82% | 0.818 | 83% | 0.825 | S | S | * | * | trans | -103.8 | 174 | -170.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 34 | G | 31.4 | Very low | 32.7 | Very low | 82 Ų | 82 | 117.6 Ų | 117.6 | 85% | 0.845 | 82% | 0.815 | S | S | * | * | trans | -174.2 | 95.9 | 168.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 35 | G | 35.3 | Very low | 31.9 | Very low | 68 Ų | 68 | 119.5 Ų | 119.5 | 70% | 0.701 | 82% | 0.824 | S | S | * | * | trans | -102.6 | 154.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 36 | Y | 37.3 | Very low | 31.9 | Very low | 243 Ų | 243 | 110.5 Ų | 110.5 | 95% | 0.953 | 81% | 0.811 | S | S | * | * | trans | -146.1 | 130.7 | 154.7 | -107.7 | -82.7 | 0 | 0 | 0 | 109.1 | ||||
| 37 | G | 32.3 | Very low | 31.9 | Very low | 79 Ų | 79 | 114.1 Ų | 114.1 | 81% | 0.814 | 83% | 0.826 | S | S | * | * | trans | -89 | 167.3 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 38 | G | 29.6 | Very low | 31.7 | Very low | 80 Ų | 80 | 113.2 Ų | 113.2 | 83% | 0.825 | 83% | 0.825 | S | S | * | * | trans | -164.2 | 74.9 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 39 | S | 33.4 | Very low | 31.7 | Very low | 129 Ų | 129 | 110.7 Ų | 110.7 | 90% | 0.902 | 82% | 0.819 | S | S | * | * | trans | -76.4 | 130.5 | 174.8 | -58.6 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 40 | A | 29.3 | Very low | 31.7 | Very low | 101 Ų | 101 | 114.1 Ų | 114.1 | 84% | 0.835 | 82% | 0.824 | S | S | * | * | trans | -141.1 | 100.3 | 166.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 41 | S | 35.8 | Very low | 31.6 | Very low | 132 Ų | 132 | 118.4 Ų | 118.4 | 92% | 0.923 | 83% | 0.83 | S | S | * | * | trans | -81.9 | 136.1 | 167.5 | 41.1 | 0 | 0 | 0 | 0 | 110 | ||||
| 42 | G | 29.3 | Very low | 31.5 | Very low | 79 Ų | 79 | 118.7 Ų | 118.7 | 81% | 0.814 | 83% | 0.832 | S | S | * | * | trans | -149.4 | 97.5 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 43 | F | 33.2 | Very low | 31.3 | Very low | 225 Ų | 225 | 116.5 Ų | 116.5 | 99% | 0.987 | 83% | 0.829 | S | S | * | * | trans | -73 | 139.4 | 159.1 | -95.8 | -103 | 0 | 0 | 0 | 109 | ||||
| 44 | G | 28 | Very low | 31.1 | Very low | 68 Ų | 68 | 116.5 Ų | 116.5 | 70% | 0.701 | 83% | 0.829 | S | S | * | * | trans | 174.3 | 85.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 45 | V | 31 | Very low | 31 | Very low | 151 Ų | 151 | 117.4 Ų | 117.4 | 92% | 0.915 | 82% | 0.822 | S | S | * | * | trans | 29.7 | 129.2 | 139.1 | -170.3 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 46 | G | 31.3 | Very low | 30.9 | Very low | 69 Ų | 69 | 122.4 Ų | 122.4 | 71% | 0.711 | 83% | 0.829 | S | S | * | * | trans | -81.7 | -179.3 | -177.8 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 47 | C | 31.5 | Very low | 30.5 | Very low | 135 Ų | 135 | 120.9 Ų | 120.9 | 91% | 0.912 | 83% | 0.828 | S | S | * | * | trans | -167.1 | 156.9 | 159.3 | -108.1 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 48 | G | 28.5 | Very low | 30.2 | Very low | 74 Ų | 74 | 119.4 Ų | 119.4 | 76% | 0.763 | 81% | 0.813 | S | S | * | * | cis | 120.9 | 109.2 | 9 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 49 | G | 29.6 | Very low | 30.2 | Very low | 69 Ų | 69 | 121.1 Ų | 121.1 | 71% | 0.711 | 81% | 0.812 | S | S | * | * | trans | 104.8 | 119.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 50 | L | 30.5 | Very low | 30 | Very low | 158 Ų | 158 | 120.4 Ų | 120.4 | 83% | 0.827 | 81% | 0.807 | S | S | * | * | 80.9 | 117.9 | 61.9 | -77.9 | 164.7 | 0 | 0 | 0 | 112.9 | |||||
| 51 | F | 28.9 | Very low | 30.1 | Very low | 201 Ų | 201 | 121 Ų | 121 | 88% | 0.882 | 80% | 0.804 | S | S | * | * | trans | -170 | 113.3 | 134.2 | -72.3 | -52.4 | 0 | 0 | 0 | 107.2 | ||||
| 52 | S | 29.8 | Very low | 29.6 | Very low | 107 Ų | 107 | 118.2 Ų | 118.2 | 75% | 0.748 | 80% | 0.797 | S | S | * | * | 61.9 | 112.7 | 101.6 | -53.3 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 53 | A | 28.7 | Very low | 29.6 | Very low | 98 Ų | 98 | 124.5 Ų | 124.5 | 81% | 0.81 | 80% | 0.802 | S | S | * | * | cis | 68.5 | 136.1 | 32.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 54 | A | 29.1 | Very low | 29.3 | Very low | 99 Ų | 99 | 118.5 Ų | 118.5 | 82% | 0.818 | 79% | 0.788 | S | S | * | * | trans | 74.5 | 144.9 | -174.2 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 55 | S | 28.3 | Very low | 29.4 | Very low | 101 Ų | 101 | 119.4 Ų | 119.4 | 71% | 0.706 | 80% | 0.797 | S | S | * | * | cis | -172.4 | 151.5 | -14 | 46.7 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 56 | M | 33.1 | Very low | 29.2 | Very low | 173 Ų | 173 | 116 Ų | 116 | 85% | 0.852 | 79% | 0.793 | S | S | * | * | trans | 26.6 | 122.5 | 141.1 | -57 | 175.8 | 70.2 | 0 | 0 | 121.4 | ||||
| 57 | F | 29 | Very low | 29.1 | Very low | 211 Ų | 211 | 118.8 Ų | 118.8 | 93% | 0.925 | 80% | 0.802 | S | S | * | * | -164.7 | 142.6 | 119.7 | -128.5 | -115.1 | 0 | 0 | 0 | 107 | |||||
| 58 | G | 26 | Very low | 29 | Very low | 48 Ų | 48 | 117.6 Ų | 117.6 | 50% | 0.495 | 80% | 0.801 | S | S | . | * | cis | 96.4 | 78.4 | 47.4 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 59 | S | 30 | Very low | 28.9 | Very low | 115 Ų | 115 | 118 Ų | 118 | 80% | 0.804 | 81% | 0.805 | S | S | * | * | 100.4 | 134.2 | 92.1 | -75 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 60 | S | 29.2 | Very low | 28.7 | Very low | 114 Ų | 114 | 120.4 Ų | 120.4 | 80% | 0.797 | 81% | 0.81 | S | S | * | * | trans | 88.5 | 147.8 | 147 | 76.4 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 61 | S | 30.5 | Very low | 28.6 | Very low | 113 Ų | 113 | 120.1 Ų | 120.1 | 79% | 0.79 | 81% | 0.809 | S | S | * | * | trans | 62.7 | 90.9 | 160.6 | 56.8 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 62 | G | 27.3 | Very low | 29.3 | Very low | 74 Ų | 74 | 115.9 Ų | 115.9 | 76% | 0.763 | 80% | 0.801 | S | S | * | * | 77.3 | 123.5 | 93.5 | 0 | 0 | 0 | 0 | 0 | 120 | |||||
| 63 | F | 28.5 | Very low | 29.1 | Very low | 212 Ų | 212 | 114.1 Ų | 114.1 | 93% | 0.93 | 80% | 0.8 | S | S | * | * | trans | -149.8 | 152.6 | 140 | -134.9 | -90.9 | 0 | 0 | 0 | 111.3 | ||||
| 64 | S | 27.4 | Very low | 29.2 | Very low | 99 Ų | 99 | 118.2 Ų | 118.2 | 69% | 0.692 | 81% | 0.807 | S | S | * | * | trans | -113.1 | 141.7 | -169.9 | 55.5 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 65 | G | 28.9 | Very low | 29.1 | Very low | 86 Ų | 86 | 116.7 Ų | 116.7 | 89% | 0.887 | 80% | 0.801 | S | S | * | * | trans | 73.2 | 133.9 | 141.6 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 66 | G | 26.8 | Very low | 29.3 | Very low | 81 Ų | 81 | 118 Ų | 118 | 84% | 0.835 | 81% | 0.81 | S | S | * | * | trans | 172.5 | 105.3 | 168.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 67 | S | 30.6 | Very low | 29.1 | Very low | 127 Ų | 127 | 114.1 Ų | 114.1 | 89% | 0.888 | 81% | 0.806 | S | S | * | * | trans | -94 | 149.2 | -179 | -48.5 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 68 | A | 27.9 | Very low | 29.2 | Very low | 109 Ų | 109 | 115.6 Ų | 115.6 | 90% | 0.901 | 81% | 0.807 | S | S | * | * | trans | 152.8 | 135.9 | 138.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 69 | G | 26.9 | Very low | 29.4 | Very low | 82 Ų | 82 | 117.1 Ų | 117.1 | 85% | 0.845 | 82% | 0.823 | S | S | * | * | trans | 177.7 | 58.5 | -179 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 70 | C | 25.5 | Very low | 29.4 | Very low | 120 Ų | 120 | 115.1 Ų | 115.1 | 81% | 0.811 | 82% | 0.82 | S | S | * | * | trans | -84.9 | 155.1 | 163.3 | -75.1 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 71 | L | 28.1 | Very low | 29.9 | Very low | 153 Ų | 153 | 115.7 Ų | 115.7 | 80% | 0.801 | 82% | 0.821 | S | S | * | * | cis | -168.7 | -171.9 | 2.2 | -106 | 164.5 | 0 | 0 | 0 | 104.9 | ||||
| 72 | P | 43.2 | Very low | 29.9 | Very low | 112 Ų | 112 | 118.5 Ų | 118.5 | 73% | 0.727 | 83% | 0.826 | S | S | * | * | cis | -133.8 | 172 | -29 | 36.8 | -20 | 0 | 0 | 0 | 114.7 | ||||
| 73 | G | 26 | Very low | 30 | Very low | 69 Ų | 69 | 126.5 Ų | 126.5 | 71% | 0.711 | 83% | 0.833 | S | S | * | * | 83.8 | 103.8 | 127.2 | 0 | 0 | 0 | 0 | 0 | 122.2 | |||||
| 74 | L | 30.9 | Very low | 30.1 | Very low | 185 Ų | 185 | 119.8 Ų | 119.8 | 97% | 0.969 | 82% | 0.824 | S | S | * | * | trans | 179.9 | 138 | 131.5 | -118.2 | 80.7 | 0 | 0 | 0 | 105.4 | ||||
| 75 | G | 26.8 | Very low | 30.1 | Very low | 67 Ų | 67 | 119 Ų | 119 | 69% | 0.691 | 83% | 0.831 | S | S | * | * | cis | 135.5 | 80.5 | 7.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 76 | S | 32.2 | Very low | 30.4 | Very low | 127 Ų | 127 | 120.4 Ų | 120.4 | 89% | 0.888 | 84% | 0.835 | S | S | * | * | trans | -163.5 | 107.3 | 162 | -85.8 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 77 | A | 29.3 | Very low | 30.5 | Very low | 93 Ų | 93 | 120.6 Ų | 120.6 | 77% | 0.769 | 84% | 0.836 | S | S | * | * | trans | -104.6 | 136.9 | 166 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 78 | Y | 31.9 | Very low | 30.5 | Very low | 242 Ų | 242 | 118.2 Ų | 118.2 | 95% | 0.949 | 83% | 0.832 | S | S | * | * | trans | -130.2 | 86.3 | 159.9 | -105.6 | -85.4 | 0 | 0 | 0 | 108.6 | ||||
| 79 | G | 28.9 | Very low | 30.7 | Very low | 80 Ų | 80 | 121.6 Ų | 121.6 | 83% | 0.825 | 83% | 0.832 | S | S | * | * | trans | -105.7 | 126.5 | 161.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 80 | G | 30.8 | Very low | 30.8 | Very low | 72 Ų | 72 | 121.3 Ų | 121.3 | 74% | 0.742 | 83% | 0.829 | S | S | * | * | trans | -135.4 | 149.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 81 | P | 39.7 | Very low | 31.1 | Very low | 127 Ų | 127 | 123.2 Ų | 123.2 | 83% | 0.825 | 83% | 0.829 | S | S | * | * | trans | -114.9 | 178.6 | -130.9 | 39.4 | -32.3 | 0 | 0 | 0 | 115.7 | ||||
| 82 | L | 30.7 | Very low | 31.3 | Very low | 172 Ų | 172 | 119.4 Ų | 119.4 | 90% | 0.901 | 83% | 0.827 | S | S | * | * | trans | -41.7 | 139.2 | 173.9 | -71.2 | 78 | 0 | 0 | 0 | 113.6 | ||||
| 83 | R | 30 | Very low | 30.8 | Very low | 241 Ų | 241 | 122.6 Ų | 122.6 | 91% | 0.909 | 84% | 0.835 | S | S | * | * | trans | -124.6 | 114.4 | 151.6 | -166.3 | 172.1 | -167.3 | -97.2 | 1.7 | 109.1 | ||||
| 84 | G | 29.5 | Very low | 31 | Very low | 72 Ų | 72 | 122.4 Ų | 122.4 | 74% | 0.742 | 83% | 0.833 | S | S | * | * | trans | -73.7 | 149.2 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 85 | G | 28.3 | Very low | 31 | Very low | 82 Ų | 82 | 122 Ų | 122 | 85% | 0.845 | 83% | 0.829 | S | S | * | * | trans | -133 | 93.9 | 163.6 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 86 | A | 33.6 | Very low | 31.3 | Very low | 116 Ų | 116 | 123.8 Ų | 123.8 | 96% | 0.959 | 84% | 0.838 | S | S | * | * | trans | -85 | 125.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 87 | G | 30.6 | Very low | 31.2 | Very low | 84 Ų | 84 | 121.2 Ų | 121.2 | 87% | 0.866 | 83% | 0.831 | S | S | * | * | trans | 169.7 | 89.3 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 88 | G | 29.9 | Very low | 31.2 | Very low | 78 Ų | 78 | 122.1 Ų | 122.1 | 80% | 0.804 | 83% | 0.832 | S | S | * | * | trans | -176.6 | 89.7 | -178 | 0 | 0 | 0 | 0 | 0 | 111.4 | G90 | G88-G90 PolarHBondContact O-N 2.91Å; G88-G90 VanDerWaalsContact O-N 3.13Å | ||
| 89 | M | 32.6 | Very low | 31.2 | Very low | 180 Ų | 180 | 116 Ų | 116 | 89% | 0.887 | 82% | 0.824 | S | S | * | * | trans | -71.2 | 100.3 | -179.1 | -169 | 88.1 | 141.7 | 0 | 0 | 110.3 | I91 | M89-I91 HydrophobicContact CG-CG1 4.48Å; M89-I91 PolarHBondContact O-N 2.92Å | ||
| 90 | G | 28.7 | Very low | 31.3 | Very low | 76 Ų | 76 | 115.9 Ų | 115.9 | 78% | 0.784 | 82% | 0.823 | S | S | * | * | trans | -78 | 106 | 176 | 0 | 0 | 0 | 0 | 0 | 112.1 | G88 G92 | G88-G90 PolarHBondContact O-N 2.91Å; G88-G90 VanDerWaalsContact O-N 3.13Å; G90-G92 PolarHBondContact O-N 3.47Å | ||
| 91 | I | 32.3 | Very low | 31.5 | Very low | 159 Ų | 159 | 116.4 Ų | 116.4 | 82% | 0.815 | 83% | 0.829 | S | S | * | * | trans | -94.1 | 88.2 | 169.6 | -53.4 | 178.4 | 0 | 0 | 0 | 108.2 | M89 | M89-I91 HydrophobicContact CG-CG1 4.48Å; M89-I91 PolarHBondContact O-N 2.92Å | ||
| 92 | G | 31.2 | Very low | 31 | Very low | 74 Ų | 74 | 114.4 Ų | 114.4 | 76% | 0.763 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -79.6 | 122.7 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | G90 | G90-G92 PolarHBondContact O-N 3.47Š|
| 93 | M | 32.6 | Very low | 31.4 | Very low | 179 Ų | 179 | 111.4 Ų | 111.4 | 88% | 0.882 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -80.4 | 120.3 | 177.9 | -177.2 | 56.9 | 84.6 | 0 | 0 | 110.9 | ||
| 94 | G | 29.8 | Very low | 31.7 | Very low | 65 Ų | 65 | 107.3 Ų | 107.3 | 67% | 0.67 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -102.2 | 127.6 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||
| 95 | I | 32.4 | Very low | 32 | Very low | 176 Ų | 176 | 109.2 Ų | 109.2 | 90% | 0.903 | 82% | 0.821 | S | S | * | * | trans | -85.7 | 109.6 | -178.3 | 39 | 167.6 | 0 | 0 | 0 | 113.2 | ||||
| 96 | A | 31.3 | Very low | 32.4 | Very low | 105 Ų | 105 | 111.2 Ų | 111.2 | 87% | 0.868 | 81% | 0.81 | S | S | * | * | trans | -164.9 | 146.3 | 156.9 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 97 | G | 30.3 | Very low | 32.5 | Very low | 72 Ų | 72 | 115.7 Ų | 115.7 | 74% | 0.742 | 81% | 0.809 | S | S | * | * | cis | 150.7 | 126.9 | 6.3 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 98 | S | 29.8 | Very low | 33 | Very low | 113 Ų | 113 | 116.8 Ų | 116.8 | 79% | 0.79 | 80% | 0.803 | S | S | * | * | trans | 81.8 | 123.5 | 167.2 | -153.6 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 99 | S | 32.4 | Very low | 33.4 | Very low | 113 Ų | 113 | 116.7 Ų | 116.7 | 79% | 0.79 | 80% | 0.802 | S | S | * | * | trans | 59.4 | 126.8 | 135.9 | 65.3 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 100 | G | 31.1 | Very low | 33.8 | Very low | 78 Ų | 78 | 115.1 Ų | 115.1 | 80% | 0.804 | 80% | 0.797 | S | S | * | * | 131.1 | 113.5 | 121.3 | 0 | 0 | 0 | 0 | 0 | 118.1 | |||||
| 101 | G | 34 | Very low | 34.4 | Very low | 83 Ų | 83 | 118.5 Ų | 118.5 | 86% | 0.856 | 80% | 0.797 | S | S | * | * | trans | 78.5 | 131.4 | 164.8 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 102 | G | 30.8 | Very low | 35 | Very low | 84 Ų | 84 | 114.8 Ų | 114.8 | 87% | 0.866 | 80% | 0.799 | S | S | * | * | cis | 98.9 | 88.7 | 9.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 103 | S | 37.8 | Very low | 35.4 | Very low | 110 Ų | 110 | 114.8 Ų | 114.8 | 77% | 0.769 | 80% | 0.798 | S | S | * | * | trans | -147.4 | 107.4 | 159.6 | -162 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 104 | L | 35.6 | Very low | 36.1 | Very low | 155 Ų | 155 | 113.9 Ų | 113.9 | 81% | 0.812 | 80% | 0.796 | S | S | * | * | trans | -103.7 | 110.6 | 172.9 | -144 | 132.2 | 0 | 0 | 0 | 105.5 | I106 | L104-I106 HydrophobicContact CD2-CD1 3.95Å; L104-I106 HydrophobicContact CD2-CG1 4.06Å | ||
| 105 | C | 36.2 | Very low | 37.1 | Very low | 112 Ų | 112 | 119.4 Ų | 119.4 | 76% | 0.757 | 81% | 0.809 | S | S | * | * | trans | -109.5 | 84.5 | 179.7 | -71 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 106 | I | 37.7 | Very low | 37.8 | Very low | 123 Ų | 123 | 116 Ų | 116 | 63% | 0.631 | 80% | 0.801 | S | S | * | * | trans | -75.9 | 127.9 | 159.1 | -68.5 | 167 | 0 | 0 | 0 | 107.3 | L104 | L104-I106 HydrophobicContact CD2-CD1 3.95Å; L104-I106 HydrophobicContact CD2-CG1 4.06Å | ||
| 107 | F | 35.7 | Very low | 38.7 | Very low | 211 Ų | 211 | 113.3 Ų | 113.3 | 93% | 0.925 | 78% | 0.784 | S | S | * | * | trans | -121.8 | 104.5 | 153.1 | -109.4 | -84.1 | 0 | 0 | 0 | 108.5 | ||||
| 108 | S | 41.3 | Very low | 40 | Very low | 106 Ų | 106 | 113.7 Ų | 113.7 | 74% | 0.741 | 78% | 0.775 | S | S | * | * | trans | -79 | 141.7 | 168.2 | -60.4 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 109 | G | 37.6 | Very low | 41.3 | Very low | 76 Ų | 76 | 115.6 Ų | 115.6 | 78% | 0.784 | 77% | 0.771 | S | S | * | * | trans | -152 | 107.1 | 172.3 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 110 | N | 40.4 | Very low | 43.1 | Very low | 147 Ų | 147 | 117.8 Ų | 117.8 | 79% | 0.786 | 77% | 0.767 | S | S | * | * | trans | -49.2 | 160.2 | 163.1 | -96.3 | 46 | 0 | 0 | 0 | 111.5 | ||||
| 111 | D | 42.5 | Very low | 44.9 | Very low | 147 Ų | 147 | 121 Ų | 121 | 79% | 0.786 | 76% | 0.76 | S | S | * | * | cis | -144 | 163.6 | 28.5 | -97.7 | -52.6 | 0 | 0 | 0 | 112.9 | ||||
| 112 | G | 43.9 | Very low | 46.4 | Very low | 82 Ų | 82 | 120.7 Ų | 120.7 | 85% | 0.845 | 74% | 0.742 | S | S | * | * | trans | -78.6 | 140.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 113 | G | 40.3 | Very low | 48.5 | Very low | 73 Ų | 73 | 122.1 Ų | 122.1 | 75% | 0.753 | 73% | 0.728 | S | S | * | * | trans | -165.4 | 104.7 | 178 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 114 | L | 46.4 | Very low | 50.5 | Low | 161 Ų | 161 | 122.2 Ų | 122.2 | 84% | 0.843 | 72% | 0.716 | S | S | * | * | trans | 65.7 | 103.4 | 151.6 | -140.6 | 77.9 | 0 | 0 | 0 | 119.5 | S116 | L114-S116 VanDerWaalsContact C-N 3.26Å; L114-S116 PolarHBondContact O-N 3.07Å | ||
| 115 | L | 50.6 | Low | 52.6 | Low | 181 Ų | 181 | 119.9 Ų | 119.9 | 95% | 0.948 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -67 | 68.5 | 167 | -73.5 | 159.1 | 0 | 0 | 0 | 112.7 | ||
| 116 | S | 48.8 | Very low | 54.8 | Low | 104 Ų | 104 | 119 Ų | 119 | 73% | 0.727 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -155.2 | 28.8 | 176.2 | -166.5 | 0 | 0 | 0 | 0 | 115.1 | L114 | L114-S116 VanDerWaalsContact C-N 3.26Å; L114-S116 PolarHBondContact O-N 3.07Å |
| 117 | G | 49.2 | Very low | 57.1 | Low | 49 Ų | 49 | 118.1 Ų | 118.1 | 51% | 0.505 | 69% | 0.688 | S | S | . | * | S | Bend | trans | -139.5 | -11.2 | 178.7 | 0 | 0 | 0 | 0 | 0 | 116.4 | E119 | G117-E119 PolarHBondContact O-N 2.72Š|
| 118 | S | 57.2 | Low | 59.3 | Low | 79 Ų | 79 | 113.4 Ų | 113.4 | 55% | 0.552 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -65.6 | -34.4 | -166.8 | 49.8 | 0 | 0 | 0 | 0 | 114.9 | K120 E121 T122 | S118-K120 PolarHBondContact O-N 2.99Å; S118-E121 PolarHBondContact O-N 3.4Å; S118-T122 WeakPolarHBondContact O-CB 3.1Å; S118-T122 WeakPolarHBondContact O-CG2 3.41Å; S118-T122 PolarHBondContact O-N 3.1Å; S118-T122 PolarHBondContact O-OG1 3.43Å |
| 119 | E | 58.4 | Low | 61.4 | Low | 154 Ų | 154 | 115 Ų | 115 | 72% | 0.72 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -64.2 | -43.9 | -173.6 | -170 | 176 | 175.3 | 0 | 0 | 112.3 | G117 T122 M123 | G117-E119 PolarHBondContact O-N 2.72Å; E119-T122 WeakPolarHBondContact CA-OG1 3.32Å; E119-T122 PolarHBondContact O-N 3.02Å; E119-T122 PolarHBondContact O-OG1 3.21Å; E119-M123 WeakPolarHBondContact O-CB 3.39Å; E119-M123 WeakPolarHBondContact O-CG 3.31Å; E119-M123 PolarHBondContact O-N 3.38Å |
| 120 | K | 69.3 | Low | 63.8 | Low | 159 Ų | 159 | 116.2 Ų | 116.2 | 69% | 0.691 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -70.8 | -37.1 | -177.9 | -167.2 | 175.5 | -179.4 | -178 | 0 | 112.6 | S118 M123 Q124 | S118-K120 PolarHBondContact O-N 2.99Å; K120-M123 PolarHBondContact O-N 3.48Å; K120-Q124 WeakPolarHBondContact O-CG 3.41Å; K120-Q124 PolarHBondContact O-N 3.43Å |
| 121 | E | 68.4 | Low | 66 | Low | 144 Ų | 144 | 111.8 Ų | 111.8 | 67% | 0.673 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -71.6 | -39.1 | 176.4 | -169.5 | 172.4 | -171.2 | 0 | 0 | 111.5 | S118 M123 Q124 N125 | S118-E121 PolarHBondContact O-N 3.4Å; E121-M123 VanDerWaalsContact C-N 3.35Å; E121-M123 PolarHBondContact O-N 2.79Å; E121-Q124 PolarHBondContact O-N 2.92Å; E121-N125 WeakPolarHBondContact O-CB 3.24Å; E121-N125 PolarHBondContact O-N 2.84Å |
| 122 | T | 66.4 | Low | 68.1 | Low | 78 Ų | 78 | 108.2 Ų | 108.2 | 48% | 0.479 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -63.9 | -39 | 170.6 | 55.1 | 0 | 0 | 0 | 0 | 112.3 | S118 E119 N125 L126 | S118-T122 WeakPolarHBondContact O-CB 3.1Å; S118-T122 WeakPolarHBondContact O-CG2 3.41Å; S118-T122 PolarHBondContact O-N 3.1Å; S118-T122 PolarHBondContact O-OG1 3.43Å; E119-T122 WeakPolarHBondContact CA-OG1 3.32Å; E119-T122 PolarHBondContact O-N 3.02Å; E119-T122 PolarHBondContact O-OG1 3.21Å; T122-N125 PolarHBondContact O-N 2.79Å; T122-L126 WeakPolarHBondContact O-CB 3.4Å; T122-L126 WeakPolarHBondContact O-CD1 3.4Å; T122-L126 WeakPolarHBondContact O-CG 3.28Å; T122-L126 PolarHBondContact O-N 2.83Å |
| 123 | M | 74.4 | Confident | 70.3 | Confident | 113 Ų | 113 | 110.2 Ų | 110.2 | 56% | 0.557 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -66.5 | -36.1 | 174.3 | -80 | -63.8 | -67.4 | 0 | 0 | 112.6 | E119 K120 E121 L126 N127 | E119-M123 WeakPolarHBondContact O-CB 3.39Å; E119-M123 WeakPolarHBondContact O-CG 3.31Å; E119-M123 PolarHBondContact O-N 3.38Å; K120-M123 PolarHBondContact O-N 3.48Å; E121-M123 VanDerWaalsContact C-N 3.35Å; E121-M123 PolarHBondContact O-N 2.79Å; M123-L126 HydrophobicContact SD-CD1 4.35Å; M123-N127 VanDerWaalsContact O-CB 3.28Å; M123-N127 WeakPolarHBondContact O-CB 3.28Å; M123-N127 PolarHBondContact O-N 3.4Å |
| 124 | Q | 80.2 | Confident | 72.7 | Confident | 113 Ų | 113 | 111.5 Ų | 111.5 | 53% | 0.528 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -66.6 | -45.6 | 171.4 | -76.9 | -177 | -80.2 | 0 | 0 | 111.4 | K120 E121 L126 N127 D128 | K120-Q124 WeakPolarHBondContact O-CG 3.41Å; K120-Q124 PolarHBondContact O-N 3.43Å; E121-Q124 PolarHBondContact O-N 2.92Å; Q124-L126 VanDerWaalsContact C-N 3.32Å; Q124-L126 PolarHBondContact O-N 2.77Å; Q124-N127 CarbonylContact O-C 3.58Å; Q124-N127 PolarHBondContact O-N 2.85Å; Q124-D128 WeakPolarHBondContact O-CB 3.43Å; Q124-D128 VanDerWaalsContact O-CG 3.32Å; Q124-D128 PolarHBondContact O-N 3.21Å |
| 125 | N | 80.7 | Confident | 74.9 | Confident | 106 Ų | 106 | 105.5 Ų | 105.5 | 57% | 0.567 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -59.3 | -41.5 | 176.4 | -168.4 | -86.9 | 0 | 0 | 0 | 112.4 | E121 T122 R129 | E121-N125 WeakPolarHBondContact O-CB 3.24Å; E121-N125 PolarHBondContact O-N 2.84Å; T122-N125 PolarHBondContact O-N 2.79Å; N125-R129 WeakPolarHBondContact O-CB 3.46Å; N125-R129 PolarHBondContact O-N 3.07Å |
| 126 | L | 82.5 | Confident | 76.9 | Confident | 93 Ų | 93 | 102.4 Ų | 102.4 | 49% | 0.487 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -61.7 | -42 | 172.1 | -84.1 | 156.9 | 0 | 0 | 0 | 112.1 | T122 M123 Q124 R129 L130 | T122-L126 WeakPolarHBondContact O-CB 3.4Å; T122-L126 WeakPolarHBondContact O-CD1 3.4Å; T122-L126 WeakPolarHBondContact O-CG 3.28Å; T122-L126 PolarHBondContact O-N 2.83Å; M123-L126 HydrophobicContact SD-CD1 4.35Å; Q124-L126 VanDerWaalsContact C-N 3.32Å; Q124-L126 PolarHBondContact O-N 2.77Å; L126-R129 PolarHBondContact O-N 3.37Å; L126-L130 WeakPolarHBondContact O-CB 3.31Å; L126-L130 VanDerWaalsContact O-CG 3.31Å; L126-L130 WeakPolarHBondContact O-CG 3.31Å; L126-L130 PolarHBondContact O-N 3.12Å |
| 127 | N | 84.2 | Confident | 79 | Confident | 105 Ų | 105 | 100.8 Ų | 100.8 | 56% | 0.561 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -72.5 | -40.3 | -179.5 | -154.9 | -10.6 | 0 | 0 | 0 | 112.2 | M123 Q124 R129 L130 A131 | M123-N127 VanDerWaalsContact O-CB 3.28Å; M123-N127 WeakPolarHBondContact O-CB 3.28Å; M123-N127 PolarHBondContact O-N 3.4Å; Q124-N127 CarbonylContact O-C 3.58Å; Q124-N127 PolarHBondContact O-N 2.85Å; N127-R129 VanDerWaalsContact C-N 3.3Å; N127-R129 PolarHBondContact O-N 2.72Å; N127-L130 CarbonylContact O-C 3.57Å; N127-L130 PolarHBondContact O-N 2.7Å; N127-A131 WeakPolarHBondContact O-CB 3.35Å; N127-A131 PolarHBondContact O-N 3.5Å |
| 128 | D | 83.6 | Confident | 81 | Confident | 112 Ų | 112 | 106 Ų | 106 | 60% | 0.599 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -64.2 | -36.9 | 172.5 | -67.6 | -29.7 | 0 | 0 | 0 | 111.2 | Q124 A131 S132 | Q124-D128 WeakPolarHBondContact O-CB 3.43Å; Q124-D128 VanDerWaalsContact O-CG 3.32Å; Q124-D128 PolarHBondContact O-N 3.21Å; D128-A131 PolarHBondContact O-N 3.17Å; D128-S132 PolarHBondContact O-N 2.87Å |
| 129 | R | 84.1 | Confident | 82.7 | Confident | 140 Ų | 140 | 104.4 Ų | 104.4 | 53% | 0.528 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -70.7 | -37.7 | 173.7 | -170 | 173.7 | 173.5 | -174.9 | -5.7 | 112 | N125 L126 N127 S132 Y133 | N125-R129 WeakPolarHBondContact O-CB 3.46Å; N125-R129 PolarHBondContact O-N 3.07Å; L126-R129 PolarHBondContact O-N 3.37Å; N127-R129 VanDerWaalsContact C-N 3.3Å; N127-R129 PolarHBondContact O-N 2.72Å; R129-S132 PolarHBondContact O-N 3.33Å; R129-S132 PolarHBondContact O-OG 3.07Å; R129-Y133 HydrophobicContact CG-CD2 4Å; R129-Y133 HydrophobicContact CG-CE2 3.65Å; R129-Y133 PolarHBondContact NH2-OH 2.84Å; R129-Y133 WeakPolarHBondContact O-CD2 3.44Å; R129-Y133 PolarHBondContact O-N 3.4Å |
| 130 | L | 88 | Confident | 84.3 | Confident | 100 Ų | 100 | 101.1 Ų | 101.1 | 52% | 0.524 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.4 | -39.1 | 170 | -77.2 | 170 | 0 | 0 | 0 | 111.7 | L126 N127 S132 Y133 L134 | L126-L130 WeakPolarHBondContact O-CB 3.31Å; L126-L130 VanDerWaalsContact O-CG 3.31Å; L126-L130 WeakPolarHBondContact O-CG 3.31Å; L126-L130 PolarHBondContact O-N 3.12Å; N127-L130 CarbonylContact O-C 3.57Å; N127-L130 PolarHBondContact O-N 2.7Å; L130-S132 VanDerWaalsContact C-N 3.34Å; L130-S132 PolarHBondContact O-N 3.06Å; L130-Y133 PolarHBondContact O-N 3.21Å; L130-L134 WeakPolarHBondContact O-CB 3.49Å; L130-L134 VanDerWaalsContact O-CG 3.28Å; L130-L134 WeakPolarHBondContact O-CG 3.47Å; L130-L134 PolarHBondContact O-N 2.96Å |
| 131 | A | 86.4 | Confident | 85.5 | Confident | 54 Ų | 54 | 99 Ų | 99 | 45% | 0.446 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.9 | -39.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | N127 D128 L134 G135 | N127-A131 WeakPolarHBondContact O-CB 3.35Å; N127-A131 PolarHBondContact O-N 3.5Å; D128-A131 PolarHBondContact O-N 3.17Å; A131-L134 PolarHBondContact O-N 3.42Å; A131-G135 PolarHBondContact O-N 3.43Å |
| 132 | S | 87.4 | Confident | 86.7 | Confident | 73 Ų | 73 | 99.2 Ų | 99.2 | 51% | 0.51 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -69.9 | -36.8 | 174 | 77.7 | 0 | 0 | 0 | 0 | 112.6 | D128 R129 L130 G135 K136 | D128-S132 PolarHBondContact O-N 2.87Å; R129-S132 PolarHBondContact O-N 3.33Å; R129-S132 PolarHBondContact O-OG 3.07Å; L130-S132 VanDerWaalsContact C-N 3.34Å; L130-S132 PolarHBondContact O-N 3.06Å; S132-G135 PolarHBondContact O-N 2.79Å; S132-K136 WeakPolarHBondContact O-CB 3.5Å; S132-K136 PolarHBondContact O-N 3.43Å |
| 133 | Y | 90.7 | Very high | 88 | Confident | 123 Ų | 123 | 97.4 Ų | 97.4 | 48% | 0.482 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64 | -44.9 | 170 | -78.3 | -59.6 | 0 | 0 | 0 | 112 | R129 L130 G135 K136 V137 | R129-Y133 HydrophobicContact CG-CD2 4Å; R129-Y133 HydrophobicContact CG-CE2 3.65Å; R129-Y133 PolarHBondContact NH2-OH 2.84Å; R129-Y133 WeakPolarHBondContact O-CD2 3.44Å; R129-Y133 PolarHBondContact O-N 3.4Å; L130-Y133 PolarHBondContact O-N 3.21Å; Y133-G135 VanDerWaalsContact C-N 3.31Å; Y133-G135 PolarHBondContact O-N 2.92Å; Y133-K136 CarbonylContact O-C 3.58Å; Y133-K136 PolarHBondContact O-N 3.48Å; Y133-K136 VanDerWaalsContact O-N 3.11Å; Y133-V137 WeakPolarHBondContact O-CG2 3.14Å; Y133-V137 PolarHBondContact O-N 2.91Å |
| 134 | L | 90.8 | Very high | 88.8 | Confident | 100 Ų | 100 | 96.5 Ų | 96.5 | 52% | 0.524 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -67 | -29.7 | 176.4 | -72.8 | 169.7 | 0 | 0 | 0 | 112.9 | L130 A131 R138 | L130-L134 WeakPolarHBondContact O-CB 3.49Å; L130-L134 VanDerWaalsContact O-CG 3.28Å; L130-L134 WeakPolarHBondContact O-CG 3.47Å; L130-L134 PolarHBondContact O-N 2.96Å; A131-L134 PolarHBondContact O-N 3.42Å; L134-R138 PolarHBondContact O-N 3.41Å; L134-R138 PolarHBondContact O-NE 2.83Å; L134-R138 VanDerWaalsContact O-NE 3.12Å |
| 135 | G | 91.9 | Very high | 89.5 | Confident | 35 Ų | 35 | 93.3 Ų | 93.3 | 36% | 0.361 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -69.6 | -41.8 | 168.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | A131 S132 Y133 R138 S139 | A131-G135 PolarHBondContact O-N 3.43Å; S132-G135 PolarHBondContact O-N 2.79Å; Y133-G135 VanDerWaalsContact C-N 3.31Å; Y133-G135 PolarHBondContact O-N 2.92Å; G135-R138 PolarHBondContact O-N 3.33Å; G135-S139 PolarHBondContact O-N 3.48Å |
| 136 | K | 91.5 | Very high | 90.2 | Very high | 116 Ų | 116 | 93.4 Ų | 93.4 | 50% | 0.504 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -68 | -41.8 | 178.3 | -172.3 | 65.4 | -162.1 | 151.8 | 0 | 112.2 | S132 Y133 S139 L140 | S132-K136 WeakPolarHBondContact O-CB 3.5Å; S132-K136 PolarHBondContact O-N 3.43Å; Y133-K136 CarbonylContact O-C 3.58Å; Y133-K136 PolarHBondContact O-N 3.48Å; Y133-K136 VanDerWaalsContact O-N 3.11Å; K136-S139 PolarHBondContact NZ-OG 3.34Å; K136-S139 PolarHBondContact O-N 2.85Å; K136-S139 PolarHBondContact O-OG 3.36Å; K136-L140 HydrophobicContact CG-CD1 4.19Å; K136-L140 WeakPolarHBondContact O-CG 3.32Å; K136-L140 PolarHBondContact O-N 2.88Å |
| 137 | V | 93.3 | Very high | 90.7 | Very high | 70 Ų | 70 | 93.4 Ų | 93.4 | 42% | 0.424 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -57.3 | -52.1 | 173.2 | 168.9 | 0 | 0 | 0 | 0 | 110 | Y133 S139 L140 E141 | Y133-V137 WeakPolarHBondContact O-CG2 3.14Å; Y133-V137 PolarHBondContact O-N 2.91Å; V137-S139 VanDerWaalsContact C-N 3.32Å; V137-S139 PolarHBondContact O-N 3.23Å; V137-L140 CarbonylContact O-C 3.56Å; V137-L140 WeakPolarHBondContact O-CA 3.29Å; V137-L140 WeakPolarHBondContact O-CB 3.42Å; V137-L140 PolarHBondContact O-N 2.93Å; V137-E141 HydrophobicContact CG1-CG 4.25Å; V137-E141 WeakPolarHBondContact CG1-OE1 2.76Å; V137-E141 WeakPolarHBondContact O-CG 3.28Å; V137-E141 PolarHBondContact O-N 2.95Å |
| 138 | R | 92 | Very high | 91.1 | Very high | 160 Ų | 160 | 94.1 Ų | 94.1 | 60% | 0.604 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -57.5 | -40.4 | 175.8 | -79.8 | -179.3 | -82.9 | -176.4 | -8.4 | 113.5 | L134 G135 L140 E141 E142 | L134-R138 PolarHBondContact O-N 3.41Å; L134-R138 PolarHBondContact O-NE 2.83Å; L134-R138 VanDerWaalsContact O-NE 3.12Å; G135-R138 PolarHBondContact O-N 3.33Å; R138-L140 VanDerWaalsContact C-N 3.27Å; R138-L140 PolarHBondContact O-N 2.9Å; R138-E141 WeakPolarHBondContact CA-OE2 3.28Å; R138-E141 PolarHBondContact O-N 2.93Å; R138-E142 WeakPolarHBondContact O-CB 3.21Å; R138-E142 PolarHBondContact O-N 2.95Å |
| 139 | S | 93.5 | Very high | 91.6 | Very high | 44 Ų | 44 | 92.8 Ų | 92.8 | 31% | 0.308 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -65.8 | -27.6 | 174.8 | 77.8 | 0 | 0 | 0 | 0 | 113.8 | G135 K136 V137 A143 | G135-S139 PolarHBondContact O-N 3.48Å; K136-S139 PolarHBondContact NZ-OG 3.34Å; K136-S139 PolarHBondContact O-N 2.85Å; K136-S139 PolarHBondContact O-OG 3.36Å; V137-S139 VanDerWaalsContact C-N 3.32Å; V137-S139 PolarHBondContact O-N 3.23Å; S139-A143 VanDerWaalsContact O-CB 3.32Å; S139-A143 WeakPolarHBondContact O-CB 3.26Å; S139-A143 PolarHBondContact O-N 2.94Å |
| 140 | L | 91.9 | Very high | 92.1 | Very high | 86 Ų | 86 | 90.9 Ų | 90.9 | 45% | 0.45 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -84 | -34.3 | 177 | -70.8 | 169.9 | 0 | 0 | 0 | 111.5 | K136 V137 R138 A143 N144 | K136-L140 HydrophobicContact CG-CD1 4.19Å; K136-L140 WeakPolarHBondContact O-CG 3.32Å; K136-L140 PolarHBondContact O-N 2.88Å; V137-L140 CarbonylContact O-C 3.56Å; V137-L140 WeakPolarHBondContact O-CA 3.29Å; V137-L140 WeakPolarHBondContact O-CB 3.42Å; V137-L140 PolarHBondContact O-N 2.93Å; R138-L140 VanDerWaalsContact C-N 3.27Å; R138-L140 PolarHBondContact O-N 2.9Å; L140-A143 PolarHBondContact O-N 3.3Å; L140-N144 VanDerWaalsContact O-CB 3.28Å; L140-N144 WeakPolarHBondContact O-CB 3.38Å; L140-N144 VanDerWaalsContact O-CG 3.3Å; L140-N144 PolarHBondContact O-N 2.79Å |
| 141 | E | 93.4 | Very high | 92.3 | Very high | 114 Ų | 114 | 90.7 Ų | 90.7 | 53% | 0.533 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -62.5 | -45.5 | 170.9 | -70.4 | 168.4 | 161.4 | 0 | 0 | 110.9 | V137 R138 N144 A145 | V137-E141 HydrophobicContact CG1-CG 4.25Å; V137-E141 WeakPolarHBondContact CG1-OE1 2.76Å; V137-E141 WeakPolarHBondContact O-CG 3.28Å; V137-E141 PolarHBondContact O-N 2.95Å; R138-E141 WeakPolarHBondContact CA-OE2 3.28Å; R138-E141 PolarHBondContact O-N 2.93Å; E141-N144 PolarHBondContact O-N 2.77Å; E141-A145 WeakPolarHBondContact O-CB 3.21Å; E141-A145 PolarHBondContact O-N 3.39Å |
| 142 | E | 94.2 | Very high | 92.5 | Very high | 149 Ų | 149 | 94 Ų | 94 | 70% | 0.696 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -63.5 | -45.2 | 175.5 | -173.1 | 171.9 | -159.6 | 0 | 0 | 111.9 | R138 N144 A145 E146 | R138-E142 WeakPolarHBondContact O-CB 3.21Å; R138-E142 PolarHBondContact O-N 2.95Å; E142-N144 PolarHBondContact O-N 3.07Å; E142-A145 PolarHBondContact O-N 3.41Å; E142-E146 PolarHBondContact O-N 3.09Å |
| 143 | A | 93.3 | Very high | 92.7 | Very high | 39 Ų | 39 | 96.6 Ų | 96.6 | 32% | 0.322 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -64.3 | -38.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | S139 L140 E146 L147 | S139-A143 VanDerWaalsContact O-CB 3.32Å; S139-A143 WeakPolarHBondContact O-CB 3.26Å; S139-A143 PolarHBondContact O-N 2.94Å; L140-A143 PolarHBondContact O-N 3.3Å; A143-E146 PolarHBondContact O-N 3.47Å; A143-L147 WeakPolarHBondContact O-CB 3.45Å; A143-L147 VanDerWaalsContact O-CG 3.3Å; A143-L147 WeakPolarHBondContact O-CG 2.99Å; A143-L147 PolarHBondContact O-N 3.34Å |
| 144 | N | 91.8 | Very high | 92.6 | Very high | 95 Ų | 95 | 97.3 Ų | 97.3 | 51% | 0.508 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -65.5 | -44.3 | 174.4 | -81.8 | -7 | 0 | 0 | 0 | 111.3 | L140 E141 E142 E146 L147 E148 | L140-N144 VanDerWaalsContact O-CB 3.28Å; L140-N144 WeakPolarHBondContact O-CB 3.38Å; L140-N144 VanDerWaalsContact O-CG 3.3Å; L140-N144 PolarHBondContact O-N 2.79Å; E141-N144 PolarHBondContact O-N 2.77Å; E142-N144 PolarHBondContact O-N 3.07Å; N144-E146 VanDerWaalsContact C-N 3.3Å; N144-E146 PolarHBondContact O-N 3.41Å; N144-L147 PolarHBondContact O-N 2.92Å; N144-E148 WeakPolarHBondContact O-CG 3.34Å; N144-E148 PolarHBondContact O-N 3.22Å |
| 145 | A | 94.6 | Very high | 92.3 | Very high | 45 Ų | 45 | 99.7 Ų | 99.7 | 37% | 0.372 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61.2 | -38.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | E141 E142 N149 | E141-A145 WeakPolarHBondContact O-CB 3.21Å; E141-A145 PolarHBondContact O-N 3.39Å; E142-A145 PolarHBondContact O-N 3.41Å; A145-N149 WeakPolarHBondContact O-CB 3.49Å; A145-N149 VanDerWaalsContact O-CG 3.23Å; A145-N149 PolarHBondContact O-N 2.79Å; A145-N149 PolarHBondContact O-ND2 3.33Å; A145-N149 VanDerWaalsContact O-ND2 3.1Å |
| 146 | E | 95.5 | Very high | 91.9 | Very high | 108 Ų | 108 | 103.7 Ų | 103.7 | 51% | 0.505 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.7 | -42.1 | 174 | -156.4 | -157.3 | 175.9 | 0 | 0 | 112 | E142 A143 N144 N149 K150 | E142-E146 PolarHBondContact O-N 3.09Å; A143-E146 PolarHBondContact O-N 3.47Å; N144-E146 VanDerWaalsContact C-N 3.3Å; N144-E146 PolarHBondContact O-N 3.41Å; E146-N149 PolarHBondContact O-N 2.92Å; E146-K150 WeakPolarHBondContact O-CG 3.49Å; E146-K150 PolarHBondContact O-N 2.92Å; E146-K150 WeakPolarHBondContact OE1-CE 3.3Å; E146-K150 IonicContact OE1-NZ 3.59Å; E146-K150 PolarHBondContact OE1-NZ 3.46Å; E146-K150 IonicContact OE2-NZ 2.65Å; E146-K150 PolarHBondContact OE2-NZ 2.89Å |
| 147 | L | 93.4 | Very high | 91.4 | Very high | 94 Ų | 94 | 102.1 Ų | 102.1 | 49% | 0.492 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.9 | -42.6 | 175.9 | -72.7 | 171.2 | 0 | 0 | 0 | 112.3 | A143 N144 N149 K150 I151 | A143-L147 WeakPolarHBondContact O-CB 3.45Å; A143-L147 VanDerWaalsContact O-CG 3.3Å; A143-L147 WeakPolarHBondContact O-CG 2.99Å; A143-L147 PolarHBondContact O-N 3.34Å; N144-L147 PolarHBondContact O-N 2.92Å; L147-N149 VanDerWaalsContact C-N 3.31Å; L147-N149 PolarHBondContact O-N 3.22Å; L147-K150 PolarHBondContact O-N 2.67Å; L147-I151 WeakPolarHBondContact O-CB 3.46Å; L147-I151 VanDerWaalsContact O-CG1 3.23Å; L147-I151 WeakPolarHBondContact O-CG1 3.33Å; L147-I151 PolarHBondContact O-N 3.1Å |
| 148 | E | 92.8 | Very high | 90.7 | Very high | 120 Ų | 120 | 104 Ų | 104 | 56% | 0.561 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -59.9 | -41.1 | 174.3 | -76.4 | -177 | -171.4 | 0 | 0 | 112.1 | N144 I151 R152 | N144-E148 WeakPolarHBondContact O-CG 3.34Å; N144-E148 PolarHBondContact O-N 3.22Å; E148-I151 PolarHBondContact O-N 3.37Å; E148-R152 WeakPolarHBondContact O-CB 3.41Å; E148-R152 PolarHBondContact O-N 3.47Å |
| 149 | N | 94.1 | Very high | 89.7 | Confident | 84 Ų | 84 | 106 Ų | 106 | 45% | 0.449 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65.3 | -44.7 | 175.3 | -72.5 | -29.8 | 0 | 0 | 0 | 111.6 | A145 E146 L147 I151 R152 E153 | A145-N149 WeakPolarHBondContact O-CB 3.49Å; A145-N149 VanDerWaalsContact O-CG 3.23Å; A145-N149 PolarHBondContact O-N 2.79Å; A145-N149 PolarHBondContact O-ND2 3.33Å; A145-N149 VanDerWaalsContact O-ND2 3.1Å; E146-N149 PolarHBondContact O-N 2.92Å; L147-N149 VanDerWaalsContact C-N 3.31Å; L147-N149 PolarHBondContact O-N 3.22Å; N149-I151 VanDerWaalsContact C-N 3.33Å; N149-I151 PolarHBondContact O-N 3.19Å; N149-R152 PolarHBondContact O-N 2.94Å; N149-R152 PolarHBondContact OD1-NH1 3.36Å; N149-E153 WeakPolarHBondContact O-CB 3.41Å; N149-E153 PolarHBondContact O-N 2.88Å |
| 150 | K | 94.6 | Very high | 88.3 | Confident | 99 Ų | 99 | 108.7 Ų | 108.7 | 43% | 0.43 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.2 | -38.7 | 174.7 | -73.3 | 166.8 | -176.7 | 166.4 | 0 | 112.4 | E146 L147 W154 | E146-K150 WeakPolarHBondContact O-CG 3.49Å; E146-K150 PolarHBondContact O-N 2.92Å; E146-K150 WeakPolarHBondContact OE1-CE 3.3Å; E146-K150 IonicContact OE1-NZ 3.59Å; E146-K150 PolarHBondContact OE1-NZ 3.46Å; E146-K150 IonicContact OE2-NZ 2.65Å; E146-K150 PolarHBondContact OE2-NZ 2.89Å; L147-K150 PolarHBondContact O-N 2.67Å; K150-W154 VanDerWaalsContact O-CB 3.31Å; K150-W154 WeakPolarHBondContact O-CB 3.36Å; K150-W154 PolarHBondContact O-N 3.41Å |
| 151 | I | 91 | Very high | 86.9 | Confident | 96 Ų | 96 | 112.1 Ų | 112.1 | 49% | 0.492 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64.9 | -44.6 | 175 | -70.2 | 166.3 | 0 | 0 | 0 | 110.4 | L147 E148 N149 W154 Y155 | L147-I151 WeakPolarHBondContact O-CB 3.46Å; L147-I151 VanDerWaalsContact O-CG1 3.23Å; L147-I151 WeakPolarHBondContact O-CG1 3.33Å; L147-I151 PolarHBondContact O-N 3.1Å; E148-I151 PolarHBondContact O-N 3.37Å; N149-I151 VanDerWaalsContact C-N 3.33Å; N149-I151 PolarHBondContact O-N 3.19Å; I151-W154 PolarHBondContact O-N 2.84Å; I151-Y155 HydrophobicContact CG2-CD2 3.73Å; I151-Y155 HydrophobicContact CG2-CE2 3.55Å; I151-Y155 WeakPolarHBondContact O-CD2 3.44Å; I151-Y155 PolarHBondContact O-N 3.38Å |
| 152 | R | 91.3 | Very high | 85.3 | Confident | 125 Ų | 125 | 109.7 Ų | 109.7 | 47% | 0.472 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.1 | -48.2 | 177.7 | -164.4 | -178.8 | -55.9 | 115.6 | 8.9 | 111.7 | E148 N149 W154 Y155 E156 | E148-R152 WeakPolarHBondContact O-CB 3.41Å; E148-R152 PolarHBondContact O-N 3.47Å; N149-R152 PolarHBondContact O-N 2.94Å; N149-R152 PolarHBondContact OD1-NH1 3.36Å; R152-W154 VanDerWaalsContact C-N 3.31Å; R152-W154 PolarHBondContact O-N 2.92Å; R152-Y155 PolarHBondContact O-N 2.91Å; R152-Y155 VanDerWaalsContact O-N 3.17Å; R152-E156 WeakPolarHBondContact O-CG 3.38Å; R152-E156 PolarHBondContact O-N 2.78Å |
| 153 | E | 92 | Very high | 83.6 | Confident | 126 Ų | 126 | 106.2 Ų | 106.2 | 59% | 0.589 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61 | -38.2 | 176.5 | -175.1 | 177.9 | -162.2 | 0 | 0 | 112.2 | N149 E156 T157 | N149-E153 WeakPolarHBondContact O-CB 3.41Å; N149-E153 PolarHBondContact O-N 2.88Å; E153-E156 PolarHBondContact O-N 2.89Å; E153-T157 WeakPolarHBondContact O-CB 3.49Å; E153-T157 PolarHBondContact O-N 2.87Å; E153-T157 PolarHBondContact O-OG1 2.9Å |
| 154 | W | 87.5 | Confident | 81.9 | Confident | 139 Ų | 139 | 107.5 Ų | 107.5 | 53% | 0.527 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64.4 | -43.1 | 174.2 | -172.3 | 93.2 | 0 | 0 | 0 | 112 | K150 I151 R152 R158 | K150-W154 VanDerWaalsContact O-CB 3.31Å; K150-W154 WeakPolarHBondContact O-CB 3.36Å; K150-W154 PolarHBondContact O-N 3.41Å; I151-W154 PolarHBondContact O-N 2.84Å; R152-W154 VanDerWaalsContact C-N 3.31Å; R152-W154 PolarHBondContact O-N 2.92Å; W154-R158 WeakPolarHBondContact O-CB 3.27Å; W154-R158 PolarHBondContact O-N 3Å |
| 155 | Y | 83.9 | Confident | 80.2 | Confident | 149 Ų | 149 | 106.8 Ų | 106.8 | 58% | 0.584 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -66.8 | -38 | 175.8 | -81.2 | -62.9 | 0 | 0 | 0 | 112.9 | I151 R152 R159 | I151-Y155 HydrophobicContact CG2-CD2 3.73Å; I151-Y155 HydrophobicContact CG2-CE2 3.55Å; I151-Y155 WeakPolarHBondContact O-CD2 3.44Å; I151-Y155 PolarHBondContact O-N 3.38Å; R152-Y155 PolarHBondContact O-N 2.91Å; R152-Y155 VanDerWaalsContact O-N 3.17Å; Y155-R159 WeakPolarHBondContact O-CB 3.27Å; Y155-R159 PolarHBondContact O-N 3.3Å |
| 156 | E | 84.6 | Confident | 78.4 | Confident | 119 Ų | 119 | 112.7 Ų | 112.7 | 56% | 0.556 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -69.9 | -45.2 | 177.3 | -72.7 | 175.4 | -171.5 | 0 | 0 | 111.8 | R152 E153 R158 R159 T160 | R152-E156 WeakPolarHBondContact O-CG 3.38Å; R152-E156 PolarHBondContact O-N 2.78Å; E153-E156 PolarHBondContact O-N 2.89Å; E156-R158 VanDerWaalsContact C-N 3.33Å; E156-R158 PolarHBondContact O-N 3.35Å; E156-R159 PolarHBondContact O-N 2.92Å; E156-T160 WeakPolarHBondContact O-CG2 3.43Å; E156-T160 PolarHBondContact O-N 3.32Å; E156-T160 PolarHBondContact O-OG1 3.01Å |
| 157 | T | 81.3 | Confident | 77.1 | Confident | 83 Ų | 83 | 111 Ų | 111 | 51% | 0.509 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -61.9 | -40.9 | 174.1 | -59.9 | 0 | 0 | 0 | 0 | 111.2 | E153 T160 R161 | E153-T157 WeakPolarHBondContact O-CB 3.49Å; E153-T157 PolarHBondContact O-N 2.87Å; E153-T157 PolarHBondContact O-OG1 2.9Å; T157-T160 WeakPolarHBondContact CA-OG1 3.37Å; T157-T160 PolarHBondContact O-OG1 2.91Å; T157-R161 VanDerWaalsContact O-CB 3.27Å; T157-R161 WeakPolarHBondContact O-CB 3.27Å; T157-R161 PolarHBondContact O-N 3.34Å |
| 158 | R | 77.7 | Confident | 76 | Confident | 109 Ų | 109 | 112 Ų | 112 | 41% | 0.411 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -73 | -39.3 | 177.5 | -173.4 | 159.1 | -171.5 | 161 | 0.2 | 112.5 | W154 E156 T160 R161 D162 | W154-R158 WeakPolarHBondContact O-CB 3.27Å; W154-R158 PolarHBondContact O-N 3Å; E156-R158 VanDerWaalsContact C-N 3.33Å; E156-R158 PolarHBondContact O-N 3.35Å; R158-T160 VanDerWaalsContact C-N 3.32Å; R158-T160 PolarHBondContact O-N 2.97Å; R158-R161 PolarHBondContact O-N 2.93Å; R158-D162 WeakPolarHBondContact CG-OD2 3.46Å; R158-D162 IonicContact CZ-OD2 3.76Å; R158-D162 IonicContact NE-OD2 2.99Å; R158-D162 PolarHBondContact NE-OD2 3.5Å; R158-D162 IonicContact NH2-OD2 2.67Å; R158-D162 VanDerWaalsContact O-CB 3.23Å; R158-D162 WeakPolarHBondContact O-CB 3.32Å; R158-D162 VanDerWaalsContact O-CG 3.28Å; R158-D162 PolarHBondContact O-N 2.72Å |
| 159 | R | 70.7 | Confident | 75.2 | Confident | 202 Ų | 202 | 113.4 Ų | 113.4 | 76% | 0.762 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -61.5 | -40.9 | 175.5 | -177 | 175.1 | -175.8 | 146.4 | 1.8 | 111.7 | Y155 E156 A163 | Y155-R159 WeakPolarHBondContact O-CB 3.27Å; Y155-R159 PolarHBondContact O-N 3.3Å; E156-R159 PolarHBondContact O-N 2.92Å; R159-A163 WeakPolarHBondContact O-CB 3.34Å; R159-A163 PolarHBondContact O-N 3.36Å |
| 160 | T | 65 | Low | 74.8 | Confident | 101 Ų | 101 | 113.4 Ų | 113.4 | 62% | 0.62 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -71.2 | -40.2 | 175.6 | 49 | 0 | 0 | 0 | 0 | 112.2 | E156 T157 R158 G164 | E156-T160 WeakPolarHBondContact O-CG2 3.43Å; E156-T160 PolarHBondContact O-N 3.32Å; E156-T160 PolarHBondContact O-OG1 3.01Å; T157-T160 WeakPolarHBondContact CA-OG1 3.37Å; T157-T160 PolarHBondContact O-OG1 2.91Å; R158-T160 VanDerWaalsContact C-N 3.32Å; R158-T160 PolarHBondContact O-N 2.97Å; T160-G164 PolarHBondContact O-N 2.91Å; T160-G164 VanDerWaalsContact O-N 3.15Å |
| 161 | R | 61.5 | Low | 74.4 | Confident | 159 Ų | 159 | 116.1 Ų | 116.1 | 60% | 0.6 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -65 | -44.6 | 175.4 | -164.8 | -176 | 88.4 | 150.2 | 9.8 | 113.4 | T157 R158 G164 S165 | T157-R161 VanDerWaalsContact O-CB 3.27Å; T157-R161 WeakPolarHBondContact O-CB 3.27Å; T157-R161 PolarHBondContact O-N 3.34Å; R158-R161 PolarHBondContact O-N 2.93Å; R161-G164 CarbonylContact O-C 3.59Å; R161-G164 PolarHBondContact O-N 2.85Å; R161-S165 WeakPolarHBondContact O-CB 3.36Å; R161-S165 PolarHBondContact O-N 3.41Å; R161-S165 PolarHBondContact O-OG 2.87Å |
| 162 | D | 60 | Low | 74.2 | Confident | 62 Ų | 62 | 118 Ų | 118 | 33% | 0.332 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -77.7 | -31.7 | -175.4 | -66 | -5.5 | 0 | 0 | 0 | 110.4 | R158 G164 S165 Q166 | R158-D162 WeakPolarHBondContact CG-OD2 3.46Å; R158-D162 IonicContact CZ-OD2 3.76Å; R158-D162 IonicContact NE-OD2 2.99Å; R158-D162 PolarHBondContact NE-OD2 3.5Å; R158-D162 IonicContact NH2-OD2 2.67Å; R158-D162 VanDerWaalsContact O-CB 3.23Å; R158-D162 WeakPolarHBondContact O-CB 3.32Å; R158-D162 VanDerWaalsContact O-CG 3.28Å; R158-D162 PolarHBondContact O-N 2.72Å; D162-G164 VanDerWaalsContact C-N 3.3Å; D162-G164 PolarHBondContact O-N 3Å; D162-S165 PolarHBondContact O-N 2.74Å; D162-S165 VanDerWaalsContact O-N 3.11Å; D162-Q166 PolarHBondContact O-N 2.77Å |
| 163 | A | 59.4 | Low | 74.2 | Confident | 77 Ų | 77 | 119.5 Ų | 119.5 | 64% | 0.636 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -65.4 | -29.3 | 167.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | R159 | R159-A163 WeakPolarHBondContact O-CB 3.34Å; R159-A163 PolarHBondContact O-N 3.36Å |
| 164 | G | 57.3 | Low | 74.4 | Confident | 66 Ų | 66 | 117.1 Ų | 117.1 | 68% | 0.68 | 58% | 0.58 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.4 | -7.9 | 170.3 | 0 | 0 | 0 | 0 | 0 | 115 | T160 R161 D162 | T160-G164 PolarHBondContact O-N 2.91Å; T160-G164 VanDerWaalsContact O-N 3.15Å; R161-G164 CarbonylContact O-C 3.59Å; R161-G164 PolarHBondContact O-N 2.85Å; D162-G164 VanDerWaalsContact C-N 3.3Å; D162-G164 PolarHBondContact O-N 3Å |
| 165 | S | 56.3 | Low | 74.7 | Confident | 80 Ų | 80 | 114.8 Ų | 114.8 | 56% | 0.559 | 58% | 0.577 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.1 | 2.7 | -174.7 | -64.9 | 0 | 0 | 0 | 0 | 115 | R161 D162 S167 | R161-S165 WeakPolarHBondContact O-CB 3.36Å; R161-S165 PolarHBondContact O-N 3.41Å; R161-S165 PolarHBondContact O-OG 2.87Å; D162-S165 PolarHBondContact O-N 2.74Å; D162-S165 VanDerWaalsContact O-N 3.11Å; S165-S167 PolarHBondContact O-N 2.9Å |
| 166 | Q | 57.5 | Low | 75.3 | Confident | 168 Ų | 168 | 111.3 Ų | 111.3 | 79% | 0.785 | 57% | 0.568 | S | S | * | * | S | Bend | trans | -68.5 | 86.7 | 152.7 | -72.2 | -161.7 | -77.5 | 0 | 0 | 108.1 | D162 D168 | D162-Q166 PolarHBondContact O-N 2.77Å; Q166-D168 PolarHBondContact O-N 3.49Å |
| 167 | S | 66.5 | Low | 75.8 | Confident | 73 Ų | 73 | 109.8 Ų | 109.8 | 51% | 0.51 | 56% | 0.561 | S | S | . | * | trans | -52.9 | 127.7 | 170.4 | -90.3 | 0 | 0 | 0 | 0 | 109.5 | S165 Y169 | S165-S167 PolarHBondContact O-N 2.9Å; S167-Y169 WeakPolarHBondContact O-CD2 3.49Å; S167-Y169 WeakPolarHBondContact O-CE2 3.42Å; S167-Y169 PolarHBondContact O-N 2.85Å | ||
| 168 | D | 71.1 | Confident | 76.6 | Confident | 116 Ų | 116 | 109.9 Ų | 109.9 | 62% | 0.62 | 56% | 0.558 | S | S | * | * | trans | -68.5 | 77 | 179.4 | -71.7 | -44.4 | 0 | 0 | 0 | 111.6 | Q166 S170 K171 | Q166-D168 PolarHBondContact O-N 3.49Å; D168-S170 PolarHBondContact O-N 3.4Å; D168-K171 PolarHBondContact O-N 3.47Å | ||
| 169 | Y | 76.4 | Confident | 77.6 | Confident | 149 Ų | 149 | 109 Ų | 109 | 58% | 0.584 | 56% | 0.561 | S | S | * | * | G | 310 helix | trans | -63.3 | -9.9 | 176.7 | -64.6 | -73.8 | 0 | 0 | 0 | 113.1 | S167 K171 Y172 | S167-Y169 WeakPolarHBondContact O-CD2 3.49Å; S167-Y169 WeakPolarHBondContact O-CE2 3.42Å; S167-Y169 PolarHBondContact O-N 2.85Å; Y169-K171 PolarHBondContact O-N 2.87Å; Y169-Y172 HydrophobicContact CD1-CD2 4.01Å; Y169-Y172 HydrophobicContact CD1-CE2 4.12Å; Y169-Y172 PolarHBondContact O-N 2.93Å |
| 170 | S | 85.5 | Confident | 78.9 | Confident | 83 Ų | 83 | 104.2 Ų | 104.2 | 58% | 0.58 | 55% | 0.546 | S | S | * | . | G | 310 helix | trans | -46 | -36.9 | 173.6 | -169.6 | 0 | 0 | 0 | 0 | 113.3 | D168 Y172 Y173 P174 | D168-S170 PolarHBondContact O-N 3.4Å; S170-Y172 VanDerWaalsContact C-N 3.26Å; S170-Y172 PolarHBondContact O-N 2.88Å; S170-Y173 PolarHBondContact O-N 3.32Å; S170-P174 WeakPolarHBondContact O-CD 3.31Å |
| 171 | K | 85.5 | Confident | 80.4 | Confident | 157 Ų | 157 | 103.6 Ų | 103.6 | 68% | 0.683 | 54% | 0.539 | S | S | * | . | G | 310 helix | trans | -65.4 | -23.5 | 179.7 | -62 | 169.8 | -172.5 | 165.4 | 0 | 113.9 | D168 Y169 | D168-K171 PolarHBondContact O-N 3.47Å; Y169-K171 PolarHBondContact O-N 2.87Å |
| 172 | Y | 87.6 | Confident | 82.2 | Confident | 136 Ų | 136 | 102 Ų | 102 | 53% | 0.533 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -89.2 | -25 | -179.1 | -60 | -74.2 | 0 | 0 | 0 | 113.3 | Y169 S170 L175 I176 | Y169-Y172 HydrophobicContact CD1-CD2 4.01Å; Y169-Y172 HydrophobicContact CD1-CE2 4.12Å; Y169-Y172 PolarHBondContact O-N 2.93Å; S170-Y172 VanDerWaalsContact C-N 3.26Å; S170-Y172 PolarHBondContact O-N 2.88Å; Y172-L175 PolarHBondContact O-N 3.04Å; Y172-I176 WeakPolarHBondContact O-CB 3.16Å; Y172-I176 VanDerWaalsContact O-CG1 3.27Å; Y172-I176 WeakPolarHBondContact O-CG1 3.33Å; Y172-I176 PolarHBondContact O-N 2.85Å |
| 173 | Y | 91.6 | Very high | 84 | Confident | 156 Ų | 156 | 103.4 Ų | 103.4 | 61% | 0.612 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -56.4 | -46.8 | 177.4 | -66.1 | -55.2 | 0 | 0 | 0 | 114.6 | S170 L175 I176 E177 | S170-Y173 PolarHBondContact O-N 3.32Å; Y173-L175 VanDerWaalsContact C-N 3.32Å; Y173-L175 PolarHBondContact O-N 2.88Å; Y173-I176 PolarHBondContact O-N 2.87Å; Y173-E177 WeakPolarHBondContact O-CB 3.25Å; Y173-E177 PolarHBondContact O-N 3.29Å |
| 174 | P | 94.9 | Very high | 85.8 | Confident | 75 Ų | 75 | 103.7 Ų | 103.7 | 49% | 0.487 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -63.8 | -37.8 | 176.9 | 24.5 | -33.6 | 0 | 0 | 0 | 112 | S170 E177 D178 | S170-P174 WeakPolarHBondContact O-CD 3.31Å; P174-E177 PolarHBondContact O-N 3.26Å; P174-D178 WeakPolarHBondContact O-CB 3.36Å; P174-D178 PolarHBondContact O-N 2.96Å |
| 175 | L | 95.2 | Very high | 87.8 | Confident | 91 Ų | 91 | 104 Ų | 104 | 48% | 0.476 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -65.2 | -40.7 | 175.9 | 179.4 | 62.6 | 0 | 0 | 0 | 112.1 | Y172 Y173 E177 L179 | Y172-L175 PolarHBondContact O-N 3.04Å; Y173-L175 VanDerWaalsContact C-N 3.32Å; Y173-L175 PolarHBondContact O-N 2.88Å; L175-E177 VanDerWaalsContact C-N 3.34Å; L175-L179 HydrophobicContact CD1-CD1 4.48Å; L175-L179 HydrophobicContact CG-CD1 4.27Å; L175-L179 WeakPolarHBondContact O-CB 3.24Å; L175-L179 VanDerWaalsContact O-CG 3.23Å; L175-L179 WeakPolarHBondContact O-CG 3.41Å; L175-L179 PolarHBondContact O-N 3.41Å |
| 176 | I | 95 | Very high | 89.7 | Confident | 75 Ų | 75 | 102.9 Ų | 102.9 | 39% | 0.385 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -64 | -41.3 | 175.2 | -71.2 | 163.8 | 0 | 0 | 0 | 110.3 | Y172 Y173 L179 K180 | Y172-I176 WeakPolarHBondContact O-CB 3.16Å; Y172-I176 VanDerWaalsContact O-CG1 3.27Å; Y172-I176 WeakPolarHBondContact O-CG1 3.33Å; Y172-I176 PolarHBondContact O-N 2.85Å; Y173-I176 PolarHBondContact O-N 2.87Å; I176-L179 PolarHBondContact O-N 3.42Å; I176-K180 WeakPolarHBondContact O-CG 3.49Å; I176-K180 PolarHBondContact O-N 3.17Å |
| 177 | E | 96.8 | Very high | 91.7 | Very high | 87 Ų | 87 | 103.7 Ų | 103.7 | 41% | 0.407 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -69.3 | -41.7 | 178.9 | -155.1 | 58.6 | -150.3 | 0 | 0 | 111.9 | Y173 P174 L175 L179 K180 N181 | Y173-E177 WeakPolarHBondContact O-CB 3.25Å; Y173-E177 PolarHBondContact O-N 3.29Å; P174-E177 PolarHBondContact O-N 3.26Å; L175-E177 VanDerWaalsContact C-N 3.34Å; E177-L179 VanDerWaalsContact C-N 3.3Å; E177-L179 PolarHBondContact O-N 2.89Å; E177-K180 PolarHBondContact O-N 3.42Å; E177-K180 WeakPolarHBondContact OE2-CD 3.32Å; E177-K180 IonicContact OE2-NZ 2.69Å; E177-K180 PolarHBondContact OE2-NZ 2.95Å; E177-N181 WeakPolarHBondContact O-CB 3.47Å; E177-N181 VanDerWaalsContact O-CG 3.28Å; E177-N181 PolarHBondContact O-N 3.49Å; E177-N181 PolarHBondContact O-ND2 2.88Å; E177-N181 VanDerWaalsContact O-ND2 3.11Å |
| 178 | D | 97.4 | Very high | 93.2 | Very high | 86 Ų | 86 | 104.6 Ų | 104.6 | 46% | 0.46 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -58.4 | -40.3 | 170.8 | -80.4 | -9.5 | 0 | 0 | 0 | 112.3 | P174 N181 K182 | P174-D178 WeakPolarHBondContact O-CB 3.36Å; P174-D178 PolarHBondContact O-N 2.96Å; D178-N181 PolarHBondContact O-N 3.33Å; D178-K182 WeakPolarHBondContact O-CB 3.45Å; D178-K182 WeakPolarHBondContact O-CD 3.29Å; D178-K182 VanDerWaalsContact O-CG 3.24Å; D178-K182 WeakPolarHBondContact O-CG 3.23Å; D178-K182 PolarHBondContact O-N 3.38Å |
| 179 | L | 97.6 | Very high | 94.5 | Very high | 89 Ų | 89 | 101.9 Ų | 101.9 | 47% | 0.466 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -68 | -42.4 | 176.4 | -74.1 | 169.9 | 0 | 0 | 0 | 111.8 | L175 I176 E177 K182 I183 | L175-L179 HydrophobicContact CD1-CD1 4.48Å; L175-L179 HydrophobicContact CG-CD1 4.27Å; L175-L179 WeakPolarHBondContact O-CB 3.24Å; L175-L179 VanDerWaalsContact O-CG 3.23Å; L175-L179 WeakPolarHBondContact O-CG 3.41Å; L175-L179 PolarHBondContact O-N 3.41Å; I176-L179 PolarHBondContact O-N 3.42Å; E177-L179 VanDerWaalsContact C-N 3.3Å; E177-L179 PolarHBondContact O-N 2.89Å; L179-K182 PolarHBondContact O-N 3.44Å; L179-I183 VanDerWaalsContact O-CG1 3.3Å; L179-I183 WeakPolarHBondContact O-CG1 3.47Å; L179-I183 PolarHBondContact O-N 3.42Å |
| 180 | K | 97.9 | Very high | 95.5 | Very high | 103 Ų | 103 | 99.4 Ų | 99.4 | 45% | 0.448 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -59.7 | -46.5 | 172.3 | -71 | 172.6 | -168.2 | 163.3 | 0 | 111.3 | I176 E177 K182 I183 V184 | I176-K180 WeakPolarHBondContact O-CG 3.49Å; I176-K180 PolarHBondContact O-N 3.17Å; E177-K180 PolarHBondContact O-N 3.42Å; E177-K180 WeakPolarHBondContact OE2-CD 3.32Å; E177-K180 IonicContact OE2-NZ 2.69Å; E177-K180 PolarHBondContact OE2-NZ 2.95Å; K180-K182 VanDerWaalsContact C-N 3.31Å; K180-K182 PolarHBondContact O-N 3.01Å; K180-I183 PolarHBondContact O-N 2.95Å; K180-I183 VanDerWaalsContact O-N 3.1Å; K180-V184 WeakPolarHBondContact O-CG2 3.49Å; K180-V184 PolarHBondContact O-N 3Å |
| 181 | N | 98 | Very high | 96.1 | Very high | 88 Ų | 88 | 97.9 Ų | 97.9 | 47% | 0.471 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61 | -39.6 | 178.8 | -74.1 | -35.7 | 0 | 0 | 0 | 111.8 | E177 D178 V184 S185 | E177-N181 WeakPolarHBondContact O-CB 3.47Å; E177-N181 VanDerWaalsContact O-CG 3.28Å; E177-N181 PolarHBondContact O-N 3.49Å; E177-N181 PolarHBondContact O-ND2 2.88Å; E177-N181 VanDerWaalsContact O-ND2 3.11Å; D178-N181 PolarHBondContact O-N 3.33Å; N181-V184 PolarHBondContact O-N 3.38Å; N181-S185 WeakPolarHBondContact O-CB 3.32Å; N181-S185 PolarHBondContact O-N 3.39Å; N181-S185 PolarHBondContact O-OG 3.14Å |
| 182 | K | 98.2 | Very high | 96.7 | Very high | 125 Ų | 125 | 95.9 Ų | 95.9 | 54% | 0.543 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.8 | -39.1 | 171.9 | -73.3 | 165.3 | -174 | 169.3 | 0 | 112.9 | D178 L179 K180 S185 A186 | D178-K182 WeakPolarHBondContact O-CB 3.45Å; D178-K182 WeakPolarHBondContact O-CD 3.29Å; D178-K182 VanDerWaalsContact O-CG 3.24Å; D178-K182 WeakPolarHBondContact O-CG 3.23Å; D178-K182 PolarHBondContact O-N 3.38Å; L179-K182 PolarHBondContact O-N 3.44Å; K180-K182 VanDerWaalsContact C-N 3.31Å; K180-K182 PolarHBondContact O-N 3.01Å; K182-S185 PolarHBondContact O-OG 3.3Å; K182-A186 WeakPolarHBondContact O-CB 3.22Å; K182-A186 PolarHBondContact O-N 2.89Å |
| 183 | I | 98 | Very high | 97.2 | Very high | 92 Ų | 92 | 93.6 Ų | 93.6 | 47% | 0.472 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -66.2 | -42.6 | 175.4 | -69.2 | 162.7 | 0 | 0 | 0 | 110.7 | L179 K180 R187 | L179-I183 VanDerWaalsContact O-CG1 3.3Å; L179-I183 WeakPolarHBondContact O-CG1 3.47Å; L179-I183 PolarHBondContact O-N 3.42Å; K180-I183 PolarHBondContact O-N 2.95Å; K180-I183 VanDerWaalsContact O-N 3.1Å; I183-R187 WeakPolarHBondContact O-CB 3.28Å; I183-R187 VanDerWaalsContact O-CG 3.29Å; I183-R187 WeakPolarHBondContact O-CG 3.42Å; I183-R187 PolarHBondContact O-N 2.98Å |
| 184 | V | 98.3 | Very high | 97.4 | Very high | 83 Ų | 83 | 90.4 Ų | 90.4 | 50% | 0.503 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -65.7 | -46.5 | 177.9 | 172.9 | 0 | 0 | 0 | 0 | 111 | K180 N181 A186 R187 V188 | K180-V184 WeakPolarHBondContact O-CG2 3.49Å; K180-V184 PolarHBondContact O-N 3Å; N181-V184 PolarHBondContact O-N 3.38Å; V184-A186 PolarHBondContact O-N 2.97Å; V184-R187 PolarHBondContact O-N 2.96Å; V184-V188 WeakPolarHBondContact O-CG2 3.16Å; V184-V188 PolarHBondContact O-N 2.91Å |
| 185 | S | 98.1 | Very high | 97.6 | Very high | 71 Ų | 71 | 93 Ų | 93 | 50% | 0.497 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65.5 | -38 | 178 | 66.8 | 0 | 0 | 0 | 0 | 112.4 | N181 K182 V188 S189 | N181-S185 WeakPolarHBondContact O-CB 3.32Å; N181-S185 PolarHBondContact O-N 3.39Å; N181-S185 PolarHBondContact O-OG 3.14Å; K182-S185 PolarHBondContact O-OG 3.3Å; S185-V188 PolarHBondContact O-N 2.68Å; S185-S189 WeakPolarHBondContact O-CB 3.46Å; S185-S189 PolarHBondContact O-N 2.89Å |
| 186 | A | 97.6 | Very high | 97.7 | Very high | 58 Ų | 58 | 93.8 Ų | 93.8 | 48% | 0.479 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63 | -40.3 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | K182 V184 S189 N190 | K182-A186 WeakPolarHBondContact O-CB 3.22Å; K182-A186 PolarHBondContact O-N 2.89Å; V184-A186 PolarHBondContact O-N 2.97Å; A186-S189 PolarHBondContact O-N 3.46Å; A186-N190 VanDerWaalsContact O-CB 3.29Å; A186-N190 WeakPolarHBondContact O-CB 3.37Å; A186-N190 PolarHBondContact O-N 2.98Å |
| 187 | R | 97.8 | Very high | 97.8 | Very high | 185 Ų | 185 | 93.9 Ų | 93.9 | 70% | 0.698 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -64.7 | -43.4 | 174.8 | -77.1 | 175.3 | 177.8 | -163.9 | -0.7 | 112.4 | I183 V184 N190 A191 | I183-R187 WeakPolarHBondContact O-CB 3.28Å; I183-R187 VanDerWaalsContact O-CG 3.29Å; I183-R187 WeakPolarHBondContact O-CG 3.42Å; I183-R187 PolarHBondContact O-N 2.98Å; V184-R187 PolarHBondContact O-N 2.96Å; R187-N190 PolarHBondContact O-N 3.43Å; R187-A191 PolarHBondContact O-N 2.87Å |
| 188 | V | 98.4 | Very high | 97.9 | Very high | 92 Ų | 92 | 93.2 Ų | 93.2 | 56% | 0.558 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -64.3 | -44.3 | 176.5 | 172.6 | 0 | 0 | 0 | 0 | 110.9 | V184 S185 N190 A191 Q192 | V184-V188 WeakPolarHBondContact O-CG2 3.16Å; V184-V188 PolarHBondContact O-N 2.91Å; S185-V188 PolarHBondContact O-N 2.68Å; V188-N190 PolarHBondContact O-N 2.77Å; V188-A191 PolarHBondContact O-N 3.18Å; V188-Q192 WeakPolarHBondContact O-CB 3.42Å; V188-Q192 PolarHBondContact O-N 3.06Å |
| 189 | S | 98.2 | Very high | 97.9 | Very high | 59 Ų | 59 | 94.7 Ų | 94.7 | 41% | 0.413 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.7 | -42.9 | 174.7 | -177.5 | 0 | 0 | 0 | 0 | 112.1 | S185 A186 Q192 L193 | S185-S189 WeakPolarHBondContact O-CB 3.46Å; S185-S189 PolarHBondContact O-N 2.89Å; A186-S189 PolarHBondContact O-N 3.46Å; S189-Q192 PolarHBondContact O-N 3.2Å; S189-L193 WeakPolarHBondContact O-CG 3.49Å; S189-L193 PolarHBondContact O-N 2.69Å |
| 190 | N | 97.9 | Very high | 97.8 | Very high | 97 Ų | 97 | 93.2 Ų | 93.2 | 52% | 0.519 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.3 | -44.8 | 175.7 | -172.2 | -87.7 | 0 | 0 | 0 | 112.1 | A186 R187 V188 Q192 L193 L194 | A186-N190 VanDerWaalsContact O-CB 3.29Å; A186-N190 WeakPolarHBondContact O-CB 3.37Å; A186-N190 PolarHBondContact O-N 2.98Å; R187-N190 PolarHBondContact O-N 3.43Å; V188-N190 PolarHBondContact O-N 2.77Å; N190-Q192 VanDerWaalsContact C-N 3.33Å; N190-Q192 PolarHBondContact O-N 3.31Å; N190-L193 PolarHBondContact O-N 2.75Å; N190-L194 WeakPolarHBondContact O-CG 3.42Å; N190-L194 PolarHBondContact O-N 2.93Å |
| 191 | A | 97.8 | Very high | 97.6 | Very high | 50 Ų | 50 | 96 Ų | 96 | 41% | 0.413 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.6 | -39.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | R187 V188 L194 L195 | R187-A191 PolarHBondContact O-N 2.87Å; V188-A191 PolarHBondContact O-N 3.18Å; A191-L194 PolarHBondContact O-N 3.38Å; A191-L195 WeakPolarHBondContact O-CG 3.46Å; A191-L195 PolarHBondContact O-N 2.94Å |
| 192 | Q | 98.2 | Very high | 97.6 | Very high | 116 Ų | 116 | 97.7 Ų | 97.7 | 54% | 0.542 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.9 | -40 | 175.1 | -174 | 175.2 | 1.9 | 0 | 0 | 112.2 | V188 S189 N190 L195 Q196 | V188-Q192 WeakPolarHBondContact O-CB 3.42Å; V188-Q192 PolarHBondContact O-N 3.06Å; S189-Q192 PolarHBondContact O-N 3.2Å; N190-Q192 VanDerWaalsContact C-N 3.33Å; N190-Q192 PolarHBondContact O-N 3.31Å; Q192-L195 PolarHBondContact O-N 2.94Å; Q192-Q196 WeakPolarHBondContact O-CG 3.33Å; Q192-Q196 PolarHBondContact O-N 3.02Å |
| 193 | L | 97.7 | Very high | 97.4 | Very high | 88 Ų | 88 | 93.5 Ų | 93.5 | 46% | 0.461 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.3 | -41.1 | 174.4 | -73 | 170.6 | 0 | 0 | 0 | 112 | S189 N190 Q196 I197 | S189-L193 WeakPolarHBondContact O-CG 3.49Å; S189-L193 PolarHBondContact O-N 2.69Å; N190-L193 PolarHBondContact O-N 2.75Å; L193-Q196 PolarHBondContact O-N 2.84Å; L193-I197 VanDerWaalsContact O-CG1 3.28Å; L193-I197 WeakPolarHBondContact O-CG1 3.48Å; L193-I197 PolarHBondContact O-N 3.47Å |
| 194 | L | 97.3 | Very high | 97.3 | Very high | 88 Ų | 88 | 91.9 Ų | 91.9 | 46% | 0.461 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -59.9 | -46.1 | 174.6 | -71.2 | 171.4 | 0 | 0 | 0 | 111.4 | N190 A191 Q196 I197 D198 | N190-L194 WeakPolarHBondContact O-CG 3.42Å; N190-L194 PolarHBondContact O-N 2.93Å; A191-L194 PolarHBondContact O-N 3.38Å; L194-Q196 VanDerWaalsContact C-N 3.3Å; L194-Q196 PolarHBondContact O-N 3.41Å; L194-I197 PolarHBondContact O-N 3.26Å; L194-D198 PolarHBondContact O-N 2.61Å |
| 195 | L | 98.1 | Very high | 97.1 | Very high | 129 Ų | 129 | 92.3 Ų | 92.3 | 68% | 0.675 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.4 | -36.4 | 175.2 | -69.5 | 172.8 | 0 | 0 | 0 | 112.8 | A191 Q192 N199 | A191-L195 WeakPolarHBondContact O-CG 3.46Å; A191-L195 PolarHBondContact O-N 2.94Å; Q192-L195 PolarHBondContact O-N 2.94Å; L195-N199 VanDerWaalsContact O-CB 3.25Å; L195-N199 WeakPolarHBondContact O-CB 3.36Å; L195-N199 PolarHBondContact O-N 2.92Å |
| 196 | Q | 97.4 | Very high | 97.1 | Very high | 108 Ų | 108 | 93.3 Ų | 93.3 | 51% | 0.505 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -68.8 | -39.6 | 174.2 | -74.3 | 176.8 | -4.4 | 0 | 0 | 112.4 | Q192 L193 L194 A200 | Q192-Q196 WeakPolarHBondContact O-CG 3.33Å; Q192-Q196 PolarHBondContact O-N 3.02Å; L193-Q196 PolarHBondContact O-N 2.84Å; L194-Q196 VanDerWaalsContact C-N 3.3Å; L194-Q196 PolarHBondContact O-N 3.41Å; Q196-A200 VanDerWaalsContact O-CB 3.3Å; Q196-A200 WeakPolarHBondContact O-CB 3.3Å; Q196-A200 PolarHBondContact O-N 3.41Å |
| 197 | I | 97.3 | Very high | 97 | Very high | 78 Ų | 78 | 97.4 Ų | 97.4 | 40% | 0.4 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.6 | -47 | 175.2 | -71.5 | 162.5 | 0 | 0 | 0 | 110.3 | L193 L194 A200 R201 | L193-I197 VanDerWaalsContact O-CG1 3.28Å; L193-I197 WeakPolarHBondContact O-CG1 3.48Å; L193-I197 PolarHBondContact O-N 3.47Å; L194-I197 PolarHBondContact O-N 3.26Å; I197-A200 PolarHBondContact O-N 2.88Å; I197-R201 WeakPolarHBondContact O-CB 3.36Å; I197-R201 VanDerWaalsContact O-CG 3.29Å; I197-R201 WeakPolarHBondContact O-CG 3.45Å; I197-R201 PolarHBondContact O-N 2.68Å |
| 198 | D | 98.2 | Very high | 96.9 | Very high | 73 Ų | 73 | 93 Ų | 93 | 39% | 0.39 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -70.2 | -36 | -179.4 | -68.6 | -24.2 | 0 | 0 | 0 | 111.8 | L194 R201 L202 | L194-D198 PolarHBondContact O-N 2.61Å; D198-R201 PolarHBondContact O-N 3.27Å; D198-R201 IonicContact OD1-NH1 3.13Å; D198-R201 PolarHBondContact OD1-NH1 3.19Å; D198-R201 VanDerWaalsContact OD1-NH1 3.13Å; D198-L202 WeakPolarHBondContact O-CB 3.44Å; D198-L202 VanDerWaalsContact O-CG 3.3Å; D198-L202 WeakPolarHBondContact O-CG 3.48Å; D198-L202 PolarHBondContact O-N 2.88Å |
| 199 | N | 97.3 | Very high | 96.7 | Very high | 116 Ų | 116 | 92.7 Ų | 92.7 | 62% | 0.62 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -62.3 | -44.3 | 170.7 | -173.8 | -95.4 | 0 | 0 | 0 | 112.2 | L195 L202 A203 | L195-N199 VanDerWaalsContact O-CB 3.25Å; L195-N199 WeakPolarHBondContact O-CB 3.36Å; L195-N199 PolarHBondContact O-N 2.92Å; N199-L202 PolarHBondContact O-N 3.44Å; N199-A203 WeakPolarHBondContact O-CB 3.26Å; N199-A203 PolarHBondContact O-N 2.83Å |
| 200 | A | 95.7 | Very high | 96.7 | Very high | 58 Ų | 58 | 95.2 Ų | 95.2 | 48% | 0.479 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.5 | -37.3 | 177 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q196 I197 A204 | Q196-A200 VanDerWaalsContact O-CB 3.3Å; Q196-A200 WeakPolarHBondContact O-CB 3.3Å; Q196-A200 PolarHBondContact O-N 3.41Å; I197-A200 PolarHBondContact O-N 2.88Å; A200-A204 WeakPolarHBondContact O-CB 3.22Å; A200-A204 PolarHBondContact O-N 2.98Å |
| 201 | R | 95.3 | Very high | 96.6 | Very high | 163 Ų | 163 | 97.7 Ų | 97.7 | 62% | 0.615 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63.6 | -48.8 | 173 | -77.3 | 168.7 | 168.9 | 172.2 | -7.4 | 111.9 | I197 D198 A203 A204 E205 | I197-R201 WeakPolarHBondContact O-CB 3.36Å; I197-R201 VanDerWaalsContact O-CG 3.29Å; I197-R201 WeakPolarHBondContact O-CG 3.45Å; I197-R201 PolarHBondContact O-N 2.68Å; D198-R201 PolarHBondContact O-N 3.27Å; D198-R201 IonicContact OD1-NH1 3.13Å; D198-R201 PolarHBondContact OD1-NH1 3.19Å; D198-R201 VanDerWaalsContact OD1-NH1 3.13Å; R201-A203 VanDerWaalsContact C-N 3.33Å; R201-A203 PolarHBondContact O-N 3.38Å; R201-A204 PolarHBondContact O-N 3.46Å; R201-E205 WeakPolarHBondContact O-CB 3.47Å; R201-E205 PolarHBondContact O-N 3.5Å |
| 202 | L | 96.4 | Very high | 96.4 | Very high | 122 Ų | 122 | 99.3 Ų | 99.3 | 64% | 0.639 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -60.5 | -43.3 | 176.8 | -71.8 | 171.6 | 0 | 0 | 0 | 111.1 | D198 N199 E205 D206 | D198-L202 WeakPolarHBondContact O-CB 3.44Å; D198-L202 VanDerWaalsContact O-CG 3.3Å; D198-L202 WeakPolarHBondContact O-CG 3.48Å; D198-L202 PolarHBondContact O-N 2.88Å; N199-L202 PolarHBondContact O-N 3.44Å; L202-E205 PolarHBondContact O-N 2.92Å; L202-D206 WeakPolarHBondContact O-CB 3.39Å; L202-D206 PolarHBondContact O-N 2.92Å |
| 203 | A | 95.6 | Very high | 96.2 | Very high | 37 Ų | 37 | 98.5 Ų | 98.5 | 31% | 0.306 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.1 | -41.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | N199 R201 D206 F207 | N199-A203 WeakPolarHBondContact O-CB 3.26Å; N199-A203 PolarHBondContact O-N 2.83Å; R201-A203 VanDerWaalsContact C-N 3.33Å; R201-A203 PolarHBondContact O-N 3.38Å; A203-D206 WeakPolarHBondContact O-CB 3.26Å; A203-D206 PolarHBondContact O-N 3.49Å; A203-F207 WeakPolarHBondContact O-CD2 3.26Å; A203-F207 WeakPolarHBondContact O-CG 3.49Å; A203-F207 PolarHBondContact O-N 3.49Å |
| 204 | A | 94.3 | Very high | 96.1 | Very high | 59 Ų | 59 | 98.6 Ų | 98.6 | 49% | 0.488 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.4 | -41.5 | 176 | 0 | 0 | 0 | 0 | 0 | 112 | A200 R201 F207 R208 | A200-A204 WeakPolarHBondContact O-CB 3.22Å; A200-A204 PolarHBondContact O-N 2.98Å; R201-A204 PolarHBondContact O-N 3.46Å; A204-F207 PolarHBondContact O-N 3.43Å; A204-R208 PolarHBondContact O-N 3.02Å |
| 205 | E | 95.4 | Very high | 96 | Very high | 92 Ų | 92 | 97.5 Ų | 97.5 | 43% | 0.43 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -67.6 | -40 | 177.2 | -170.6 | 68.5 | 171.3 | 0 | 0 | 111.9 | R201 L202 F207 R208 M209 | R201-E205 WeakPolarHBondContact O-CB 3.47Å; R201-E205 PolarHBondContact O-N 3.5Å; L202-E205 PolarHBondContact O-N 2.92Å; E205-F207 VanDerWaalsContact C-N 3.29Å; E205-F207 PolarHBondContact O-N 3.03Å; E205-R208 WeakPolarHBondContact O-CB 3.18Å; E205-R208 PolarHBondContact O-N 3.04Å; E205-R208 IonicContact OE1-CZ 3.99Å; E205-R208 IonicContact OE1-NE 3.67Å; E205-R208 PolarHBondContact OE1-NE 3.24Å; E205-R208 IonicContact OE1-NH2 2.68Å; E205-R208 PolarHBondContact OE1-NH2 3.36Å; E205-R208 IonicContact OE2-CZ 3.58Å; E205-R208 IonicContact OE2-NE 2.77Å; E205-R208 PolarHBondContact OE2-NE 2.91Å; E205-R208 IonicContact OE2-NH2 3.54Å; E205-M209 WeakPolarHBondContact O-CG 3.27Å; E205-M209 PolarHBondContact O-N 2.71Å |
| 206 | D | 97.7 | Very high | 95.7 | Very high | 92 Ų | 92 | 93.6 Ų | 93.6 | 49% | 0.492 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -57 | -41.8 | 170.9 | -116.5 | 42.1 | 0 | 0 | 0 | 111.9 | L202 A203 K210 | L202-D206 WeakPolarHBondContact O-CB 3.39Å; L202-D206 PolarHBondContact O-N 2.92Å; A203-D206 WeakPolarHBondContact O-CB 3.26Å; A203-D206 PolarHBondContact O-N 3.49Å; D206-K210 WeakPolarHBondContact O-CB 3.43Å; D206-K210 VanDerWaalsContact O-CD 3.28Å; D206-K210 WeakPolarHBondContact O-CD 3.43Å; D206-K210 WeakPolarHBondContact O-CG 3.45Å; D206-K210 PolarHBondContact O-N 3.42Å; D206-K210 VanDerWaalsContact O-N 3.08Å; D206-K210 IonicContact OD2-NZ 3.45Å; D206-K210 PolarHBondContact OD2-NZ 3.16Å |
| 207 | F | 95.7 | Very high | 95.6 | Very high | 143 Ų | 143 | 93.6 Ų | 93.6 | 63% | 0.627 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -72 | -37 | 175.6 | -71.9 | -55.4 | 0 | 0 | 0 | 112.5 | A203 A204 E205 K210 Y211 | A203-F207 WeakPolarHBondContact O-CD2 3.26Å; A203-F207 WeakPolarHBondContact O-CG 3.49Å; A203-F207 PolarHBondContact O-N 3.49Å; A204-F207 PolarHBondContact O-N 3.43Å; E205-F207 VanDerWaalsContact C-N 3.29Å; E205-F207 PolarHBondContact O-N 3.03Å; F207-K210 PolarHBondContact O-N 2.98Å; F207-Y211 WeakPolarHBondContact O-CB 3.43Å; F207-Y211 PolarHBondContact O-N 3.36Å |
| 208 | R | 96.1 | Very high | 95.6 | Very high | 94 Ų | 94 | 96.3 Ų | 96.3 | 36% | 0.355 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -59.3 | -51.8 | 173.8 | -171.7 | -173.6 | 67.9 | 71.4 | 6 | 110.8 | A204 E205 K210 Y211 E212 | A204-R208 PolarHBondContact O-N 3.02Å; E205-R208 WeakPolarHBondContact O-CB 3.18Å; E205-R208 PolarHBondContact O-N 3.04Å; E205-R208 IonicContact OE1-CZ 3.99Å; E205-R208 IonicContact OE1-NE 3.67Å; E205-R208 PolarHBondContact OE1-NE 3.24Å; E205-R208 IonicContact OE1-NH2 2.68Å; E205-R208 PolarHBondContact OE1-NH2 3.36Å; E205-R208 IonicContact OE2-CZ 3.58Å; E205-R208 IonicContact OE2-NE 2.77Å; E205-R208 PolarHBondContact OE2-NE 2.91Å; E205-R208 IonicContact OE2-NH2 3.54Å; R208-K210 PolarHBondContact O-N 3.29Å; R208-Y211 PolarHBondContact O-N 3.11Å; R208-E212 WeakPolarHBondContact CG-OE1 3.41Å; R208-E212 IonicContact CZ-OE1 2.95Å; R208-E212 IonicContact CZ-OE2 3.16Å; R208-E212 IonicContact NH1-OE1 2.58Å; R208-E212 PolarHBondContact NH1-OE1 3.5Å; R208-E212 IonicContact NH1-OE2 2.65Å; R208-E212 PolarHBondContact NH1-OE2 3Å; R208-E212 WeakPolarHBondContact O-CG 3.4Å; R208-E212 PolarHBondContact O-N 2.95Å |
| 209 | M | 93.2 | Very high | 95.4 | Very high | 85 Ų | 85 | 98.2 Ų | 98.2 | 42% | 0.419 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61.7 | -40.3 | 178 | -69.8 | -63.3 | -61.5 | 0 | 0 | 112.4 | E205 N213 | E205-M209 WeakPolarHBondContact O-CG 3.27Å; E205-M209 PolarHBondContact O-N 2.71Å; M209-N213 WeakPolarHBondContact O-CB 3.43Å; M209-N213 VanDerWaalsContact O-CG 3.26Å; M209-N213 PolarHBondContact O-N 3.42Å; M209-N213 VanDerWaalsContact O-N 3.08Å; M209-N213 PolarHBondContact O-ND2 3.35Å; M209-N213 VanDerWaalsContact O-ND2 3.17Å |
| 210 | K | 97.4 | Very high | 95.3 | Very high | 111 Ų | 111 | 96.5 Ų | 96.5 | 48% | 0.483 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -65 | -40.7 | 174.8 | -74.2 | 163.6 | -166.1 | 150.1 | 0 | 112.1 | D206 F207 R208 E214 | D206-K210 WeakPolarHBondContact O-CB 3.43Å; D206-K210 VanDerWaalsContact O-CD 3.28Å; D206-K210 WeakPolarHBondContact O-CD 3.43Å; D206-K210 WeakPolarHBondContact O-CG 3.45Å; D206-K210 PolarHBondContact O-N 3.42Å; D206-K210 VanDerWaalsContact O-N 3.08Å; D206-K210 IonicContact OD2-NZ 3.45Å; D206-K210 PolarHBondContact OD2-NZ 3.16Å; F207-K210 PolarHBondContact O-N 2.98Å; R208-K210 PolarHBondContact O-N 3.29Å; K210-E214 WeakPolarHBondContact O-CB 3.35Å; K210-E214 PolarHBondContact O-N 3.06Å |
| 211 | Y | 95.9 | Very high | 95.4 | Very high | 150 Ų | 150 | 97.5 Ų | 97.5 | 59% | 0.588 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -64.7 | -44.6 | 176.4 | 172.3 | -99.7 | 0 | 0 | 0 | 112.1 | F207 R208 N213 E214 L215 | F207-Y211 WeakPolarHBondContact O-CB 3.43Å; F207-Y211 PolarHBondContact O-N 3.36Å; R208-Y211 PolarHBondContact O-N 3.11Å; Y211-N213 PolarHBondContact O-N 3.28Å; Y211-E214 PolarHBondContact O-N 2.67Å; Y211-L215 HydrophobicContact CE1-CD2 4.17Å; Y211-L215 VanDerWaalsContact O-CB 3.28Å; Y211-L215 WeakPolarHBondContact O-CB 3.34Å; Y211-L215 PolarHBondContact O-N 2.73Å |
| 212 | E | 95.1 | Very high | 95.5 | Very high | 84 Ų | 84 | 94.7 Ų | 94.7 | 39% | 0.393 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -63.6 | -41.1 | 178.2 | -74.9 | 169.6 | -170.9 | 0 | 0 | 112.1 | R208 L215 A216 | R208-E212 WeakPolarHBondContact CG-OE1 3.41Å; R208-E212 IonicContact CZ-OE1 2.95Å; R208-E212 IonicContact CZ-OE2 3.16Å; R208-E212 IonicContact NH1-OE1 2.58Å; R208-E212 PolarHBondContact NH1-OE1 3.5Å; R208-E212 IonicContact NH1-OE2 2.65Å; R208-E212 PolarHBondContact NH1-OE2 3Å; R208-E212 WeakPolarHBondContact O-CG 3.4Å; R208-E212 PolarHBondContact O-N 2.95Å; E212-L215 PolarHBondContact O-N 2.93Å; E212-A216 WeakPolarHBondContact O-CB 3.22Å; E212-A216 PolarHBondContact O-N 3.38Å |
| 213 | N | 94.1 | Very high | 95.5 | Very high | 98 Ų | 98 | 91.7 Ų | 91.7 | 52% | 0.524 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -63.1 | -46.2 | 173.5 | -72.3 | -28.4 | 0 | 0 | 0 | 112.2 | M209 Y211 L215 A216 L217 | M209-N213 WeakPolarHBondContact O-CB 3.43Å; M209-N213 VanDerWaalsContact O-CG 3.26Å; M209-N213 PolarHBondContact O-N 3.42Å; M209-N213 VanDerWaalsContact O-N 3.08Å; M209-N213 PolarHBondContact O-ND2 3.35Å; M209-N213 VanDerWaalsContact O-ND2 3.17Å; Y211-N213 PolarHBondContact O-N 3.28Å; N213-L215 VanDerWaalsContact C-N 3.31Å; N213-L215 PolarHBondContact O-N 3.46Å; N213-A216 PolarHBondContact O-N 2.88Å; N213-L217 WeakPolarHBondContact O-CG 3.44Å; N213-L217 PolarHBondContact O-N 2.99Å |
| 214 | E | 95.5 | Very high | 95.6 | Very high | 91 Ų | 91 | 94.6 Ų | 94.6 | 43% | 0.425 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -65 | -34.3 | 177.3 | 178.6 | 65.9 | -170.5 | 0 | 0 | 112.2 | K210 Y211 R218 | K210-E214 WeakPolarHBondContact O-CB 3.35Å; K210-E214 PolarHBondContact O-N 3.06Å; Y211-E214 PolarHBondContact O-N 2.67Å; E214-R218 PolarHBondContact O-N 2.96Å; E214-R218 IonicContact OE1-CZ 2.95Å; E214-R218 IonicContact OE1-NH1 3.13Å; E214-R218 PolarHBondContact OE1-NH1 3.13Å; E214-R218 IonicContact OE1-NH2 2.67Å |
| 215 | L | 93.8 | Very high | 95.7 | Very high | 65 Ų | 65 | 95.5 Ų | 95.5 | 34% | 0.34 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -67.4 | -45.3 | 174.6 | 179.3 | 61.8 | 0 | 0 | 0 | 111.3 | Y211 E212 N213 L217 R218 Q219 | Y211-L215 HydrophobicContact CE1-CD2 4.17Å; Y211-L215 VanDerWaalsContact O-CB 3.28Å; Y211-L215 WeakPolarHBondContact O-CB 3.34Å; Y211-L215 PolarHBondContact O-N 2.73Å; E212-L215 PolarHBondContact O-N 2.93Å; N213-L215 VanDerWaalsContact C-N 3.31Å; N213-L215 PolarHBondContact O-N 3.46Å; L215-L217 VanDerWaalsContact C-N 3.34Å; L215-L217 PolarHBondContact O-N 3.02Å; L215-R218 PolarHBondContact O-N 2.71Å; L215-Q219 HydrophobicContact CD1-CG 4.49Å; L215-Q219 WeakPolarHBondContact O-CG 3.35Å; L215-Q219 PolarHBondContact O-N 3.17Å |
| 216 | A | 92.9 | Very high | 95.8 | Very high | 47 Ų | 47 | 94.6 Ų | 94.6 | 39% | 0.388 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -63.1 | -39.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112 | E212 N213 Q219 T220 | E212-A216 WeakPolarHBondContact O-CB 3.22Å; E212-A216 PolarHBondContact O-N 3.38Å; N213-A216 PolarHBondContact O-N 2.88Å; A216-Q219 PolarHBondContact O-N 3.18Å; A216-T220 PolarHBondContact O-N 2.88Å; A216-T220 PolarHBondContact O-OG1 2.92Å |
| 217 | L | 95.1 | Very high | 95.8 | Very high | 108 Ų | 108 | 91.9 Ų | 91.9 | 57% | 0.565 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -63.3 | -44.5 | 172.4 | -71.6 | 172 | 0 | 0 | 0 | 111.5 | N213 L215 T220 V221 | N213-L217 WeakPolarHBondContact O-CG 3.44Å; N213-L217 PolarHBondContact O-N 2.99Å; L215-L217 VanDerWaalsContact C-N 3.34Å; L215-L217 PolarHBondContact O-N 3.02Å; L217-T220 WeakPolarHBondContact O-CB 3.33Å; L217-T220 PolarHBondContact O-N 3.41Å; L217-V221 WeakPolarHBondContact O-CG2 3.16Å; L217-V221 PolarHBondContact O-N 3.01Å |
| 218 | R | 96.3 | Very high | 95.9 | Very high | 134 Ų | 134 | 90.9 Ų | 90.9 | 51% | 0.506 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -59.3 | -48.2 | 174.2 | -96.7 | -165.2 | 177.4 | 66.4 | 13.9 | 112.9 | E214 L215 T220 V221 E222 | E214-R218 PolarHBondContact O-N 2.96Å; E214-R218 IonicContact OE1-CZ 2.95Å; E214-R218 IonicContact OE1-NH1 3.13Å; E214-R218 PolarHBondContact OE1-NH1 3.13Å; E214-R218 IonicContact OE1-NH2 2.67Å; L215-R218 PolarHBondContact O-N 2.71Å; R218-T220 PolarHBondContact O-N 3.48Å; R218-V221 PolarHBondContact O-N 3.16Å; R218-E222 WeakPolarHBondContact O-CB 3.5Å; R218-E222 WeakPolarHBondContact O-CG 3.5Å; R218-E222 PolarHBondContact O-N 3.41Å |
| 219 | Q | 94.4 | Very high | 96 | Very high | 113 Ų | 113 | 93.4 Ų | 93.4 | 53% | 0.528 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -59.3 | -38.4 | 178.4 | -73.3 | 173.5 | -11.1 | 0 | 0 | 111.7 | L215 A216 A223 | L215-Q219 HydrophobicContact CD1-CG 4.49Å; L215-Q219 WeakPolarHBondContact O-CG 3.35Å; L215-Q219 PolarHBondContact O-N 3.17Å; A216-Q219 PolarHBondContact O-N 3.18Å; Q219-A223 WeakPolarHBondContact O-CB 3.33Å; Q219-A223 PolarHBondContact O-N 3.43Å |
| 220 | T | 95.6 | Very high | 96.2 | Very high | 80 Ų | 80 | 98.2 Ų | 98.2 | 49% | 0.491 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.2 | -50.4 | 174.2 | -51.6 | 0 | 0 | 0 | 0 | 111.2 | A216 L217 R218 E222 A223 D224 | A216-T220 PolarHBondContact O-N 2.88Å; A216-T220 PolarHBondContact O-OG1 2.92Å; L217-T220 WeakPolarHBondContact O-CB 3.33Å; L217-T220 PolarHBondContact O-N 3.41Å; R218-T220 PolarHBondContact O-N 3.48Å; T220-E222 VanDerWaalsContact C-N 3.33Å; T220-E222 PolarHBondContact O-N 2.83Å; T220-A223 WeakPolarHBondContact O-CB 3.36Å; T220-A223 PolarHBondContact O-N 2.85Å; T220-A223 VanDerWaalsContact O-N 3.16Å; T220-D224 PolarHBondContact O-N 3.24Å |
| 221 | V | 98.1 | Very high | 96.3 | Very high | 80 Ų | 80 | 96.4 Ų | 96.4 | 49% | 0.485 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -64.4 | -35.8 | 178.6 | 172.4 | 0 | 0 | 0 | 0 | 112.2 | L217 R218 D224 I225 | L217-V221 WeakPolarHBondContact O-CG2 3.16Å; L217-V221 PolarHBondContact O-N 3.01Å; R218-V221 PolarHBondContact O-N 3.16Å; V221-D224 PolarHBondContact O-N 3Å; V221-I225 HydrophobicContact CG1-CD1 3.89Å; V221-I225 HydrophobicContact CG1-CG1 4.46Å; V221-I225 WeakPolarHBondContact O-CB 3.32Å; V221-I225 VanDerWaalsContact O-CG1 3.24Å; V221-I225 WeakPolarHBondContact O-CG1 3.38Å; V221-I225 PolarHBondContact O-N 3.23Å |
| 222 | E | 97.1 | Very high | 96.4 | Very high | 104 Ų | 104 | 94.3 Ų | 94.3 | 49% | 0.486 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -67.5 | -37.7 | 174 | -75.6 | 176.1 | -168 | 0 | 0 | 111.8 | R218 T220 N226 | R218-E222 WeakPolarHBondContact O-CB 3.5Å; R218-E222 WeakPolarHBondContact O-CG 3.5Å; R218-E222 PolarHBondContact O-N 3.41Å; T220-E222 VanDerWaalsContact C-N 3.33Å; T220-E222 PolarHBondContact O-N 2.83Å; E222-N226 WeakPolarHBondContact O-CB 3.4Å; E222-N226 VanDerWaalsContact O-CG 3.24Å; E222-N226 PolarHBondContact O-N 3.47Å; E222-N226 PolarHBondContact O-ND2 3.42Å |
| 223 | A | 95.8 | Very high | 96.6 | Very high | 59 Ų | 59 | 95.1 Ų | 95.1 | 49% | 0.488 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.8 | -45.3 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | Q219 T220 N226 G227 | Q219-A223 WeakPolarHBondContact O-CB 3.33Å; Q219-A223 PolarHBondContact O-N 3.43Å; T220-A223 WeakPolarHBondContact O-CB 3.36Å; T220-A223 PolarHBondContact O-N 2.85Å; T220-A223 VanDerWaalsContact O-N 3.16Å; A223-N226 PolarHBondContact O-N 3.3Å; A223-G227 PolarHBondContact O-N 3.41Å |
| 224 | D | 97.7 | Very high | 96.8 | Very high | 98 Ų | 98 | 96.5 Ų | 96.5 | 52% | 0.524 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.3 | -45 | 176.1 | -69.9 | -21.9 | 0 | 0 | 0 | 111.9 | T220 V221 N226 G227 L228 | T220-D224 PolarHBondContact O-N 3.24Å; V221-D224 PolarHBondContact O-N 3Å; D224-N226 VanDerWaalsContact C-N 3.32Å; D224-N226 PolarHBondContact O-N 3.39Å; D224-G227 PolarHBondContact O-N 2.94Å; D224-G227 VanDerWaalsContact O-N 3.16Å; D224-L228 WeakPolarHBondContact O-CG 3.5Å; D224-L228 PolarHBondContact O-N 2.95Å |
| 225 | I | 97.7 | Very high | 96.9 | Very high | 78 Ų | 78 | 97.2 Ų | 97.2 | 40% | 0.4 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.1 | -42 | 175.5 | -72.2 | 165.3 | 0 | 0 | 0 | 111 | V221 G227 L228 R229 | V221-I225 HydrophobicContact CG1-CD1 3.89Å; V221-I225 HydrophobicContact CG1-CG1 4.46Å; V221-I225 WeakPolarHBondContact O-CB 3.32Å; V221-I225 VanDerWaalsContact O-CG1 3.24Å; V221-I225 WeakPolarHBondContact O-CG1 3.38Å; V221-I225 PolarHBondContact O-N 3.23Å; I225-G227 VanDerWaalsContact C-N 3.34Å; I225-L228 PolarHBondContact O-N 3.31Å; I225-R229 VanDerWaalsContact O-CG 3.32Å; I225-R229 WeakPolarHBondContact O-CG 3.41Å; I225-R229 PolarHBondContact O-N 3.47Å |
| 226 | N | 96.9 | Very high | 97.1 | Very high | 72 Ų | 72 | 97.7 Ų | 97.7 | 39% | 0.385 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -70.8 | -30 | 177.3 | -71 | -38.4 | 0 | 0 | 0 | 112.5 | E222 A223 D224 R229 R230 | E222-N226 WeakPolarHBondContact O-CB 3.4Å; E222-N226 VanDerWaalsContact O-CG 3.24Å; E222-N226 PolarHBondContact O-N 3.47Å; E222-N226 PolarHBondContact O-ND2 3.42Å; A223-N226 PolarHBondContact O-N 3.3Å; D224-N226 VanDerWaalsContact C-N 3.32Å; D224-N226 PolarHBondContact O-N 3.39Å; N226-R229 PolarHBondContact OD1-NH1 2.89Å; N226-R230 PolarHBondContact O-N 3.48Å |
| 227 | G | 97.9 | Very high | 97.4 | Very high | 35 Ų | 35 | 101.6 Ų | 101.6 | 36% | 0.361 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -65.4 | -49.5 | 168.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | A223 D224 I225 R229 R230 V231 | A223-G227 PolarHBondContact O-N 3.41Å; D224-G227 PolarHBondContact O-N 2.94Å; D224-G227 VanDerWaalsContact O-N 3.16Å; I225-G227 VanDerWaalsContact C-N 3.34Å; G227-R229 VanDerWaalsContact C-N 3.3Å; G227-R229 PolarHBondContact O-N 2.97Å; G227-R230 WeakPolarHBondContact O-CB 3.4Å; G227-R230 PolarHBondContact O-N 3.46Å; G227-R230 VanDerWaalsContact O-N 3.11Å; G227-V231 PolarHBondContact O-N 3.15Å |
| 228 | L | 97.7 | Very high | 97.5 | Very high | 122 Ų | 122 | 99.6 Ų | 99.6 | 64% | 0.639 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -61.6 | -35.4 | 177.2 | -70.6 | 172.9 | 0 | 0 | 0 | 112.7 | D224 I225 V231 L232 | D224-L228 WeakPolarHBondContact O-CG 3.5Å; D224-L228 PolarHBondContact O-N 2.95Å; I225-L228 PolarHBondContact O-N 3.31Å; L228-V231 PolarHBondContact O-N 3.01Å; L228-L232 WeakPolarHBondContact O-CB 3.32Å; L228-L232 PolarHBondContact O-N 2.85Å |
| 229 | R | 98.1 | Very high | 97.6 | Very high | 148 Ų | 148 | 100.4 Ų | 100.4 | 56% | 0.558 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -61.3 | -46.4 | 171.4 | -77.1 | 170 | 175 | 170.5 | -3.8 | 112 | I225 N226 G227 V231 L232 D233 | I225-R229 VanDerWaalsContact O-CG 3.32Å; I225-R229 WeakPolarHBondContact O-CG 3.41Å; I225-R229 PolarHBondContact O-N 3.47Å; N226-R229 PolarHBondContact OD1-NH1 2.89Å; G227-R229 VanDerWaalsContact C-N 3.3Å; G227-R229 PolarHBondContact O-N 2.97Å; R229-V231 VanDerWaalsContact C-N 3.34Å; R229-V231 PolarHBondContact O-N 3.47Å; R229-L232 WeakPolarHBondContact O-CB 3.43Å; R229-L232 PolarHBondContact O-N 3.36Å; R229-L232 VanDerWaalsContact O-N 3.16Å; R229-D233 VanDerWaalsContact O-CG 3.3Å; R229-D233 PolarHBondContact O-N 2.9Å |
| 230 | R | 98.1 | Very high | 97.8 | Very high | 186 Ų | 186 | 97.4 Ų | 97.4 | 70% | 0.702 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -59.7 | -43.1 | 175.4 | -77.9 | -177.8 | 153.3 | 103.8 | -0.2 | 112.5 | N226 G227 L232 D233 E234 | N226-R230 PolarHBondContact O-N 3.48Å; G227-R230 WeakPolarHBondContact O-CB 3.4Å; G227-R230 PolarHBondContact O-N 3.46Å; G227-R230 VanDerWaalsContact O-N 3.11Å; R230-L232 VanDerWaalsContact C-N 3.32Å; R230-L232 PolarHBondContact O-N 3.17Å; R230-D233 PolarHBondContact O-N 3.27Å; R230-E234 WeakPolarHBondContact O-CB 3.35Å; R230-E234 PolarHBondContact O-N 2.97Å |
| 231 | V | 98.5 | Very high | 97.9 | Very high | 73 Ų | 73 | 97.9 Ų | 97.9 | 44% | 0.442 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.3 | -37.5 | 176.2 | 174.9 | 0 | 0 | 0 | 0 | 111.2 | G227 L228 R229 E234 L235 | G227-V231 PolarHBondContact O-N 3.15Å; L228-V231 PolarHBondContact O-N 3.01Å; R229-V231 VanDerWaalsContact C-N 3.34Å; R229-V231 PolarHBondContact O-N 3.47Å; V231-E234 PolarHBondContact O-N 3.27Å; V231-L235 HydrophobicContact CG1-CD1 4.01Å; V231-L235 HydrophobicContact CG1-CG 4.4Å; V231-L235 WeakPolarHBondContact O-CB 3.47Å; V231-L235 VanDerWaalsContact O-CG 3.26Å; V231-L235 WeakPolarHBondContact O-CG 3.36Å; V231-L235 PolarHBondContact O-N 3.03Å |
| 232 | L | 98.5 | Very high | 97.9 | Very high | 106 Ų | 106 | 98.9 Ų | 98.9 | 56% | 0.555 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -65.1 | -42.2 | 173.8 | 178.2 | 62.9 | 0 | 0 | 0 | 112.2 | L228 R229 R230 L235 T236 | L228-L232 WeakPolarHBondContact O-CB 3.32Å; L228-L232 PolarHBondContact O-N 2.85Å; R229-L232 WeakPolarHBondContact O-CB 3.43Å; R229-L232 PolarHBondContact O-N 3.36Å; R229-L232 VanDerWaalsContact O-N 3.16Å; R230-L232 VanDerWaalsContact C-N 3.32Å; R230-L232 PolarHBondContact O-N 3.17Å; L232-L235 PolarHBondContact O-N 3.16Å; L232-T236 WeakPolarHBondContact O-CB 3.47Å; L232-T236 PolarHBondContact O-N 2.95Å; L232-T236 PolarHBondContact O-OG1 2.84Å |
| 233 | D | 98.4 | Very high | 98 | Very high | 100 Ų | 100 | 98.1 Ų | 98.1 | 54% | 0.535 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.3 | -44 | 176.4 | -64.6 | -29.8 | 0 | 0 | 0 | 110.8 | R229 R230 T236 L237 | R229-D233 VanDerWaalsContact O-CG 3.3Å; R229-D233 PolarHBondContact O-N 2.9Å; R230-D233 PolarHBondContact O-N 3.27Å; D233-T236 WeakPolarHBondContact O-CB 3.26Å; D233-T236 PolarHBondContact O-N 3.4Å; D233-L237 WeakPolarHBondContact O-CG 3.44Å; D233-L237 PolarHBondContact O-N 2.77Å |
| 234 | E | 98.4 | Very high | 98.1 | Very high | 127 Ų | 127 | 97.7 Ų | 97.7 | 59% | 0.593 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -62.4 | -45.7 | 175.2 | -175.1 | 176.4 | -175.4 | 0 | 0 | 112.3 | R230 V231 T236 L237 T238 | R230-E234 WeakPolarHBondContact O-CB 3.35Å; R230-E234 PolarHBondContact O-N 2.97Å; V231-E234 PolarHBondContact O-N 3.27Å; E234-T236 VanDerWaalsContact C-N 3.26Å; E234-T236 PolarHBondContact O-N 2.79Å; E234-L237 PolarHBondContact O-N 3.18Å; E234-T238 WeakPolarHBondContact O-CG2 3.49Å; E234-T238 PolarHBondContact O-N 3.48Å; E234-T238 PolarHBondContact O-OG1 2.94Å |
| 235 | L | 98.2 | Very high | 98.1 | Very high | 106 Ų | 106 | 97.3 Ų | 97.3 | 56% | 0.555 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -63.2 | -32.6 | 173.6 | -73.9 | 173 | 0 | 0 | 0 | 112.3 | V231 L232 T238 R239 | V231-L235 HydrophobicContact CG1-CD1 4.01Å; V231-L235 HydrophobicContact CG1-CG 4.4Å; V231-L235 WeakPolarHBondContact O-CB 3.47Å; V231-L235 VanDerWaalsContact O-CG 3.26Å; V231-L235 WeakPolarHBondContact O-CG 3.36Å; V231-L235 PolarHBondContact O-N 3.03Å; L232-L235 PolarHBondContact O-N 3.16Å; L235-T238 WeakPolarHBondContact CA-OG1 3.24Å; L235-T238 PolarHBondContact O-OG1 3.33Å; L235-T238 VanDerWaalsContact O-OG1 3.06Å; L235-R239 VanDerWaalsContact O-CB 3.3Å; L235-R239 WeakPolarHBondContact O-CB 3.47Å; L235-R239 PolarHBondContact O-N 2.98Å |
| 236 | T | 98.4 | Very high | 98.1 | Very high | 75 Ų | 75 | 99 Ų | 99 | 46% | 0.46 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -70.9 | -39.5 | 176.2 | -58 | 0 | 0 | 0 | 0 | 111.3 | L232 D233 E234 A240 | L232-T236 WeakPolarHBondContact O-CB 3.47Å; L232-T236 PolarHBondContact O-N 2.95Å; L232-T236 PolarHBondContact O-OG1 2.84Å; D233-T236 WeakPolarHBondContact O-CB 3.26Å; D233-T236 PolarHBondContact O-N 3.4Å; E234-T236 VanDerWaalsContact C-N 3.26Å; E234-T236 PolarHBondContact O-N 2.79Å; T236-A240 WeakPolarHBondContact O-CB 3.46Å; T236-A240 PolarHBondContact O-N 3.31Å |
| 237 | L | 98.3 | Very high | 98.2 | Very high | 130 Ų | 130 | 101.6 Ų | 101.6 | 68% | 0.681 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -65.8 | -46.7 | 173.9 | -70.9 | 173.9 | 0 | 0 | 0 | 112.2 | D233 E234 R239 A240 D241 | D233-L237 WeakPolarHBondContact O-CG 3.44Å; D233-L237 PolarHBondContact O-N 2.77Å; E234-L237 PolarHBondContact O-N 3.18Å; L237-R239 VanDerWaalsContact C-N 3.31Å; L237-R239 PolarHBondContact O-N 2.79Å; L237-A240 PolarHBondContact O-N 3.33Å; L237-A240 VanDerWaalsContact O-N 3.17Å; L237-D241 PolarHBondContact O-N 2.88Å |
| 238 | T | 98.3 | Very high | 98.2 | Very high | 66 Ų | 66 | 103.2 Ų | 103.2 | 41% | 0.405 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.1 | -35.8 | 177.1 | 54.1 | 0 | 0 | 0 | 0 | 112.2 | E234 L235 L242 | E234-T238 WeakPolarHBondContact O-CG2 3.49Å; E234-T238 PolarHBondContact O-N 3.48Å; E234-T238 PolarHBondContact O-OG1 2.94Å; L235-T238 WeakPolarHBondContact CA-OG1 3.24Å; L235-T238 PolarHBondContact O-OG1 3.33Å; L235-T238 VanDerWaalsContact O-OG1 3.06Å; T238-L242 VanDerWaalsContact O-CG 3.32Å; T238-L242 WeakPolarHBondContact O-CG 3.34Å; T238-L242 PolarHBondContact O-N 2.89Å |
| 239 | R | 98.4 | Very high | 98.2 | Very high | 150 Ų | 150 | 102.2 Ų | 102.2 | 57% | 0.566 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -61.5 | -47.2 | 170.5 | 176.9 | -178.2 | 164.7 | -131.7 | -17.9 | 111.6 | L235 L237 D241 L242 E243 | L235-R239 VanDerWaalsContact O-CB 3.3Å; L235-R239 WeakPolarHBondContact O-CB 3.47Å; L235-R239 PolarHBondContact O-N 2.98Å; L237-R239 VanDerWaalsContact C-N 3.31Å; L237-R239 PolarHBondContact O-N 2.79Å; R239-D241 VanDerWaalsContact C-N 3.33Å; R239-D241 PolarHBondContact O-N 2.91Å; R239-L242 PolarHBondContact O-N 2.92Å; R239-E243 HydrophobicContact CG-CG 4.33Å; R239-E243 IonicContact CZ-OE1 3.39Å; R239-E243 IonicContact CZ-OE2 3.64Å; R239-E243 IonicContact NE-OE1 2.64Å; R239-E243 PolarHBondContact NE-OE1 2.92Å; R239-E243 IonicContact NE-OE2 2.79Å; R239-E243 IonicContact NH2-OE1 2.76Å; R239-E243 PolarHBondContact NH2-OE1 3.17Å; R239-E243 IonicContact NH2-OE2 2.69Å; R239-E243 PolarHBondContact NH2-OE2 2.88Å; R239-E243 WeakPolarHBondContact O-CB 3.46Å; R239-E243 WeakPolarHBondContact O-CG 3.35Å; R239-E243 PolarHBondContact O-N 3.25Å |
| 240 | A | 98.2 | Very high | 98.1 | Very high | 51 Ų | 51 | 99.2 Ų | 99.2 | 42% | 0.421 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.1 | -37.5 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | T236 L237 E243 A244 | T236-A240 WeakPolarHBondContact O-CB 3.46Å; T236-A240 PolarHBondContact O-N 3.31Å; L237-A240 PolarHBondContact O-N 3.33Å; L237-A240 VanDerWaalsContact O-N 3.17Å; A240-E243 PolarHBondContact O-N 3.46Å; A240-A244 WeakPolarHBondContact O-CB 3.43Å; A240-A244 PolarHBondContact O-N 2.96Å |
| 241 | D | 98.3 | Very high | 98.1 | Very high | 90 Ų | 90 | 96.3 Ų | 96.3 | 48% | 0.481 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.7 | -47.6 | 172.5 | 177.4 | 39.7 | 0 | 0 | 0 | 111.7 | L237 R239 E243 A244 Q245 | L237-D241 PolarHBondContact O-N 2.88Å; R239-D241 VanDerWaalsContact C-N 3.33Å; R239-D241 PolarHBondContact O-N 2.91Å; D241-E243 VanDerWaalsContact C-N 3.33Å; D241-E243 PolarHBondContact O-N 3.38Å; D241-A244 PolarHBondContact O-N 3.48Å; D241-Q245 WeakPolarHBondContact O-CG 3.5Å; D241-Q245 PolarHBondContact O-N 3.38Å; D241-Q245 PolarHBondContact OD1-NE2 3.44Å; D241-Q245 PolarHBondContact OD2-NE2 2.96Å |
| 242 | L | 98.1 | Very high | 98 | Very high | 101 Ų | 101 | 98.2 Ų | 98.2 | 53% | 0.529 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.9 | -35.4 | 175.2 | -70.1 | 172.1 | 0 | 0 | 0 | 113 | T238 R239 L246 | T238-L242 VanDerWaalsContact O-CG 3.32Å; T238-L242 WeakPolarHBondContact O-CG 3.34Å; T238-L242 PolarHBondContact O-N 2.89Å; R239-L242 PolarHBondContact O-N 2.92Å; L242-L246 WeakPolarHBondContact O-CB 3.4Å; L242-L246 WeakPolarHBondContact O-CG 3.47Å; L242-L246 PolarHBondContact O-N 3.39Å |
| 243 | E | 97.8 | Very high | 97.9 | Very high | 88 Ų | 88 | 97.7 Ų | 97.7 | 41% | 0.411 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -66.8 | -42.1 | 174.4 | -75.9 | 176.2 | 165.9 | 0 | 0 | 111.4 | R239 A240 D241 L246 E247 | R239-E243 HydrophobicContact CG-CG 4.33Å; R239-E243 IonicContact CZ-OE1 3.39Å; R239-E243 IonicContact CZ-OE2 3.64Å; R239-E243 IonicContact NE-OE1 2.64Å; R239-E243 PolarHBondContact NE-OE1 2.92Å; R239-E243 IonicContact NE-OE2 2.79Å; R239-E243 IonicContact NH2-OE1 2.76Å; R239-E243 PolarHBondContact NH2-OE1 3.17Å; R239-E243 IonicContact NH2-OE2 2.69Å; R239-E243 PolarHBondContact NH2-OE2 2.88Å; R239-E243 WeakPolarHBondContact O-CB 3.46Å; R239-E243 WeakPolarHBondContact O-CG 3.35Å; R239-E243 PolarHBondContact O-N 3.25Å; A240-E243 PolarHBondContact O-N 3.46Å; D241-E243 VanDerWaalsContact C-N 3.33Å; D241-E243 PolarHBondContact O-N 3.38Å; E243-L246 PolarHBondContact O-N 2.9Å; E243-E247 WeakPolarHBondContact O-CB 3.44Å; E243-E247 PolarHBondContact O-N 3.29Å |
| 244 | A | 97.8 | Very high | 97.8 | Very high | 49 Ų | 49 | 95.6 Ų | 95.6 | 41% | 0.405 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -66.1 | -37.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | A240 D241 E247 T248 | A240-A244 WeakPolarHBondContact O-CB 3.43Å; A240-A244 PolarHBondContact O-N 2.96Å; D241-A244 PolarHBondContact O-N 3.48Å; A244-E247 PolarHBondContact O-N 3.39Å; A244-T248 WeakPolarHBondContact O-CB 3.22Å; A244-T248 PolarHBondContact O-N 2.95Å; A244-T248 PolarHBondContact O-OG1 3.35Å |
| 245 | Q | 98.1 | Very high | 97.7 | Very high | 90 Ų | 90 | 97.1 Ų | 97.1 | 42% | 0.421 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.3 | -40.4 | 173.4 | -71.4 | 171.4 | 35.7 | 0 | 0 | 111.8 | D241 L249 | D241-Q245 WeakPolarHBondContact O-CG 3.5Å; D241-Q245 PolarHBondContact O-N 3.38Å; D241-Q245 PolarHBondContact OD1-NE2 3.44Å; D241-Q245 PolarHBondContact OD2-NE2 2.96Å; Q245-L249 WeakPolarHBondContact O-CB 3.45Å; Q245-L249 VanDerWaalsContact O-CG 3.3Å; Q245-L249 WeakPolarHBondContact O-CG 3.47Å; Q245-L249 PolarHBondContact O-N 2.89Å |
| 246 | L | 97.9 | Very high | 97.6 | Very high | 114 Ų | 114 | 98 Ų | 98 | 60% | 0.597 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -63.9 | -45.1 | 173.2 | -77 | 171.4 | 0 | 0 | 0 | 111.8 | L242 E243 L249 T250 | L242-L246 WeakPolarHBondContact O-CB 3.4Å; L242-L246 WeakPolarHBondContact O-CG 3.47Å; L242-L246 PolarHBondContact O-N 3.39Å; E243-L246 PolarHBondContact O-N 2.9Å; L246-L249 PolarHBondContact O-N 3.23Å; L246-T250 WeakPolarHBondContact O-CG2 3.41Å; L246-T250 PolarHBondContact O-N 3.35Å; L246-T250 PolarHBondContact O-OG1 2.91Å |
| 247 | E | 98 | Very high | 97.5 | Very high | 126 Ų | 126 | 101.1 Ų | 101.1 | 59% | 0.589 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -59 | -51.1 | 177.2 | -170.9 | 161.1 | -142.5 | 0 | 0 | 110.5 | E243 A244 L249 T250 E251 | E243-E247 WeakPolarHBondContact O-CB 3.44Å; E243-E247 PolarHBondContact O-N 3.29Å; A244-E247 PolarHBondContact O-N 3.39Å; E247-L249 PolarHBondContact O-N 3.45Å; E247-T250 WeakPolarHBondContact CA-OG1 3.46Å; E247-T250 CarbonylContact O-C 3.57Å; E247-T250 WeakPolarHBondContact O-CA 3.34Å; E247-T250 PolarHBondContact O-N 2.92Å; E247-T250 PolarHBondContact O-OG1 2.98Å; E247-E251 PolarHBondContact O-N 3.42Å |
| 248 | T | 98.1 | Very high | 97.4 | Very high | 69 Ų | 69 | 100.5 Ų | 100.5 | 42% | 0.423 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -53.3 | -49.6 | 175.2 | -52.5 | 0 | 0 | 0 | 0 | 112 | A244 T250 E251 E252 | A244-T248 WeakPolarHBondContact O-CB 3.22Å; A244-T248 PolarHBondContact O-N 2.95Å; A244-T248 PolarHBondContact O-OG1 3.35Å; T248-T250 VanDerWaalsContact C-N 3.3Å; T248-T250 PolarHBondContact O-N 3.49Å; T248-E251 PolarHBondContact O-N 2.96Å; T248-E252 WeakPolarHBondContact O-CG 3.36Å; T248-E252 PolarHBondContact O-N 2.94Å |
| 249 | L | 97.6 | Very high | 97.2 | Very high | 102 Ų | 102 | 100 Ų | 100 | 53% | 0.534 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64.1 | -32.8 | 177.9 | -74.6 | 168.8 | 0 | 0 | 0 | 112.7 | Q245 L246 E247 L253 | Q245-L249 WeakPolarHBondContact O-CB 3.45Å; Q245-L249 VanDerWaalsContact O-CG 3.3Å; Q245-L249 WeakPolarHBondContact O-CG 3.47Å; Q245-L249 PolarHBondContact O-N 2.89Å; L246-L249 PolarHBondContact O-N 3.23Å; E247-L249 PolarHBondContact O-N 3.45Å; L249-L253 WeakPolarHBondContact O-CB 3.36Å; L249-L253 PolarHBondContact O-N 3.36Å; L249-L253 VanDerWaalsContact O-N 3.09Å |
| 250 | T | 97.7 | Very high | 96.9 | Very high | 85 Ų | 85 | 98.1 Ų | 98.1 | 52% | 0.521 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -73.5 | -34.7 | 174.6 | 58.7 | 0 | 0 | 0 | 0 | 112.8 | L246 E247 T248 L253 A254 | L246-T250 WeakPolarHBondContact O-CG2 3.41Å; L246-T250 PolarHBondContact O-N 3.35Å; L246-T250 PolarHBondContact O-OG1 2.91Å; E247-T250 WeakPolarHBondContact CA-OG1 3.46Å; E247-T250 CarbonylContact O-C 3.57Å; E247-T250 WeakPolarHBondContact O-CA 3.34Å; E247-T250 PolarHBondContact O-N 2.92Å; E247-T250 PolarHBondContact O-OG1 2.98Å; T248-T250 VanDerWaalsContact C-N 3.3Å; T248-T250 PolarHBondContact O-N 3.49Å; T250-L253 PolarHBondContact O-N 2.88Å; T250-A254 WeakPolarHBondContact O-CB 3.33Å; T250-A254 PolarHBondContact O-N 3.43Å |
| 251 | E | 97.3 | Very high | 96.7 | Very high | 125 Ų | 125 | 101.3 Ų | 101.3 | 58% | 0.584 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -65.5 | -45.9 | 172.3 | -70.4 | -171.3 | 159.1 | 0 | 0 | 111.3 | E247 T248 L253 A254 Y255 | E247-E251 PolarHBondContact O-N 3.42Å; T248-E251 PolarHBondContact O-N 2.96Å; E251-L253 VanDerWaalsContact C-N 3.33Å; E251-L253 PolarHBondContact O-N 3.15Å; E251-A254 PolarHBondContact O-N 2.96Å; E251-Y255 WeakPolarHBondContact O-CB 3.44Å; E251-Y255 PolarHBondContact O-N 3.07Å |
| 252 | E | 96.9 | Very high | 96.2 | Very high | 112 Ų | 112 | 101.6 Ų | 101.6 | 52% | 0.523 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -57.5 | -44.8 | 173.9 | -73.8 | -178.8 | 175.9 | 0 | 0 | 111.7 | T248 Y255 M256 | T248-E252 WeakPolarHBondContact O-CG 3.36Å; T248-E252 PolarHBondContact O-N 2.94Å; E252-Y255 PolarHBondContact O-N 3.5Å; E252-M256 WeakPolarHBondContact O-CB 3.27Å; E252-M256 VanDerWaalsContact O-CG 3.31Å; E252-M256 WeakPolarHBondContact O-CG 3.4Å; E252-M256 PolarHBondContact O-N 3.36Å |
| 253 | L | 96.3 | Very high | 95.7 | Very high | 95 Ų | 95 | 100.9 Ų | 100.9 | 50% | 0.497 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.7 | -39.8 | 178.2 | -156.1 | 173.7 | 0 | 0 | 0 | 111.3 | L249 T250 E251 K257 | L249-L253 WeakPolarHBondContact O-CB 3.36Å; L249-L253 PolarHBondContact O-N 3.36Å; L249-L253 VanDerWaalsContact O-N 3.09Å; T250-L253 PolarHBondContact O-N 2.88Å; E251-L253 VanDerWaalsContact C-N 3.33Å; E251-L253 PolarHBondContact O-N 3.15Å; L253-K257 HydrophobicContact CD2-CD 3.68Å; L253-K257 HydrophobicContact CD2-CG 4.14Å; L253-K257 WeakPolarHBondContact O-CB 3.44Å; L253-K257 WeakPolarHBondContact O-CG 3.47Å; L253-K257 PolarHBondContact O-N 3.28Å; L253-K257 VanDerWaalsContact O-N 3.07Å |
| 254 | A | 96.4 | Very high | 95.2 | Very high | 57 Ų | 57 | 101.3 Ų | 101.3 | 47% | 0.471 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -66.2 | -42 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112 | T250 E251 K257 K258 | T250-A254 WeakPolarHBondContact O-CB 3.33Å; T250-A254 PolarHBondContact O-N 3.43Å; E251-A254 PolarHBondContact O-N 2.96Å; A254-K257 PolarHBondContact O-N 2.96Å; A254-K258 WeakPolarHBondContact O-CB 3.47Å; A254-K258 PolarHBondContact O-N 3.45Å |
| 255 | Y | 96.6 | Very high | 94.6 | Very high | 158 Ų | 158 | 104.1 Ų | 104.1 | 62% | 0.62 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61.7 | -48.4 | 176.1 | -178.8 | -97.7 | 0 | 0 | 0 | 111.4 | E251 E252 K257 K258 N259 | E251-Y255 WeakPolarHBondContact O-CB 3.44Å; E251-Y255 PolarHBondContact O-N 3.07Å; E252-Y255 PolarHBondContact O-N 3.5Å; Y255-K257 VanDerWaalsContact C-N 3.34Å; Y255-K257 PolarHBondContact O-N 2.87Å; Y255-K258 PolarHBondContact O-N 3.43Å; Y255-N259 WeakPolarHBondContact O-CB 3.36Å; Y255-N259 PolarHBondContact O-N 2.93Å |
| 256 | M | 95.3 | Very high | 93.7 | Very high | 125 Ų | 125 | 103.1 Ų | 103.1 | 62% | 0.616 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -61.9 | -39 | 177.3 | -72.1 | -61.1 | -64.5 | 0 | 0 | 112.6 | E252 H260 | E252-M256 WeakPolarHBondContact O-CB 3.27Å; E252-M256 VanDerWaalsContact O-CG 3.31Å; E252-M256 WeakPolarHBondContact O-CG 3.4Å; E252-M256 PolarHBondContact O-N 3.36Å; M256-H260 WeakPolarHBondContact O-CB 3.45Å; M256-H260 PolarHBondContact O-N 3.01Å |
| 257 | K | 95.5 | Very high | 92.5 | Very high | 141 Ų | 141 | 105.6 Ų | 105.6 | 61% | 0.613 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63.4 | -47 | 173.1 | -81.6 | 173.2 | 172.7 | 169.4 | 0 | 112 | L253 A254 Y255 H260 E261 | L253-K257 HydrophobicContact CD2-CD 3.68Å; L253-K257 HydrophobicContact CD2-CG 4.14Å; L253-K257 WeakPolarHBondContact O-CB 3.44Å; L253-K257 WeakPolarHBondContact O-CG 3.47Å; L253-K257 PolarHBondContact O-N 3.28Å; L253-K257 VanDerWaalsContact O-N 3.07Å; A254-K257 PolarHBondContact O-N 2.96Å; Y255-K257 VanDerWaalsContact C-N 3.34Å; Y255-K257 PolarHBondContact O-N 2.87Å; K257-H260 PolarHBondContact O-N 3.42Å; K257-E261 PolarHBondContact O-N 3.17Å |
| 258 | K | 96.2 | Very high | 91 | Very high | 117 Ų | 117 | 107.7 Ų | 107.7 | 51% | 0.509 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -63.1 | -45.3 | 179.3 | 179.8 | 178.4 | 168 | -177.9 | 0 | 111.3 | A254 Y255 H260 E261 E262 | A254-K258 WeakPolarHBondContact O-CB 3.47Å; A254-K258 PolarHBondContact O-N 3.45Å; Y255-K258 PolarHBondContact O-N 3.43Å; K258-H260 VanDerWaalsContact C-N 3.31Å; K258-H260 PolarHBondContact O-N 3.12Å; K258-E261 PolarHBondContact O-N 2.66Å; K258-E261 VanDerWaalsContact O-N 3.17Å; K258-E262 WeakPolarHBondContact CE-OE1 3.45Å; K258-E262 HydrophobicContact CG-CG 4.41Å; K258-E262 IonicContact NZ-OE1 2.66Å; K258-E262 PolarHBondContact NZ-OE1 2.92Å; K258-E262 WeakPolarHBondContact O-CB 3.4Å; K258-E262 WeakPolarHBondContact O-CG 3.38Å; K258-E262 PolarHBondContact O-N 2.78Å |
| 259 | N | 94.2 | Very high | 89.3 | Confident | 54 Ų | 54 | 108.4 Ų | 108.4 | 29% | 0.289 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -61.2 | -40.9 | 176.9 | -174.5 | 79.2 | 0 | 0 | 0 | 111.4 | Y255 E261 E262 E263 | Y255-N259 WeakPolarHBondContact O-CB 3.36Å; Y255-N259 PolarHBondContact O-N 2.93Å; N259-E261 PolarHBondContact O-N 3.08Å; N259-E262 PolarHBondContact O-N 3.26Å; N259-E263 PolarHBondContact ND2-OE1 2.73Å; N259-E263 WeakPolarHBondContact O-CB 3.45Å; N259-E263 WeakPolarHBondContact O-CG 3.45Å; N259-E263 PolarHBondContact O-N 3.01Å |
| 260 | H | 92.9 | Very high | 87 | Confident | 112 Ų | 112 | 106.5 Ų | 106.5 | 52% | 0.519 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -64.7 | -38.2 | 174.5 | -174.7 | 53.9 | 0 | 0 | 0 | 113.1 | M256 K257 K258 L264 | M256-H260 WeakPolarHBondContact O-CB 3.45Å; M256-H260 PolarHBondContact O-N 3.01Å; K257-H260 PolarHBondContact O-N 3.42Å; K258-H260 VanDerWaalsContact C-N 3.31Å; K258-H260 PolarHBondContact O-N 3.12Å; H260-L264 WeakPolarHBondContact O-CB 3.4Å; H260-L264 VanDerWaalsContact O-CG 3.31Å; H260-L264 WeakPolarHBondContact O-CG 3.33Å; H260-L264 PolarHBondContact O-N 2.67Å |
| 261 | E | 93.1 | Very high | 85 | Confident | 117 Ų | 117 | 104.7 Ų | 104.7 | 55% | 0.547 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -68.4 | -41 | 175.2 | -176.5 | 166.6 | -157.8 | 0 | 0 | 112.1 | K257 K258 N259 L264 Q265 | K257-E261 PolarHBondContact O-N 3.17Å; K258-E261 PolarHBondContact O-N 2.66Å; K258-E261 VanDerWaalsContact O-N 3.17Å; N259-E261 PolarHBondContact O-N 3.08Å; E261-L264 PolarHBondContact O-N 2.69Å; E261-Q265 WeakPolarHBondContact O-CB 3.47Å; E261-Q265 VanDerWaalsContact O-CG 3.29Å; E261-Q265 WeakPolarHBondContact O-CG 3.28Å; E261-Q265 PolarHBondContact O-N 3.17Å |
| 262 | E | 89.4 | Confident | 82.5 | Confident | 97 Ų | 97 | 105.4 Ų | 105.4 | 45% | 0.453 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -65.6 | -39.7 | 173.6 | -73.8 | -179.2 | 169.3 | 0 | 0 | 111.9 | K258 N259 Q265 S266 | K258-E262 WeakPolarHBondContact CE-OE1 3.45Å; K258-E262 HydrophobicContact CG-CG 4.41Å; K258-E262 IonicContact NZ-OE1 2.66Å; K258-E262 PolarHBondContact NZ-OE1 2.92Å; K258-E262 WeakPolarHBondContact O-CB 3.4Å; K258-E262 WeakPolarHBondContact O-CG 3.38Å; K258-E262 PolarHBondContact O-N 2.78Å; N259-E262 PolarHBondContact O-N 3.26Å; E262-Q265 PolarHBondContact O-N 2.96Å; E262-S266 VanDerWaalsContact O-CB 3.31Å; E262-S266 WeakPolarHBondContact O-CB 3.28Å; E262-S266 PolarHBondContact O-N 3.5Å |
| 263 | E | 87.6 | Confident | 80.1 | Confident | 86 Ų | 86 | 103.6 Ų | 103.6 | 40% | 0.402 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -59.5 | -50.9 | 171.8 | -79.7 | 173.6 | -169.5 | 0 | 0 | 110.9 | N259 Q265 S266 F267 | N259-E263 PolarHBondContact ND2-OE1 2.73Å; N259-E263 WeakPolarHBondContact O-CB 3.45Å; N259-E263 WeakPolarHBondContact O-CG 3.45Å; N259-E263 PolarHBondContact O-N 3.01Å; E263-Q265 PolarHBondContact O-N 3.2Å; E263-S266 PolarHBondContact O-N 3.43Å; E263-S266 VanDerWaalsContact O-N 3.1Å; E263-S266 PolarHBondContact O-OG 2.83Å; E263-F267 HydrophobicContact CB-CE2 4.49Å; E263-F267 WeakPolarHBondContact O-CD2 3.18Å; E263-F267 PolarHBondContact O-N 3.32Å |
| 264 | L | 85.5 | Confident | 77.8 | Confident | 96 Ų | 96 | 108.4 Ų | 108.4 | 50% | 0.503 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -59 | -44.2 | 176.7 | -74.3 | 172.1 | 0 | 0 | 0 | 112.2 | H260 E261 S266 F267 Q268 | H260-L264 WeakPolarHBondContact O-CB 3.4Å; H260-L264 VanDerWaalsContact O-CG 3.31Å; H260-L264 WeakPolarHBondContact O-CG 3.33Å; H260-L264 PolarHBondContact O-N 2.67Å; E261-L264 PolarHBondContact O-N 2.69Å; L264-S266 VanDerWaalsContact C-N 3.32Å; L264-S266 PolarHBondContact O-N 2.79Å; L264-F267 PolarHBondContact O-N 3.39Å; L264-Q268 WeakPolarHBondContact O-CB 3.4Å; L264-Q268 PolarHBondContact O-N 3.24Å |
| 265 | Q | 85.2 | Confident | 75.2 | Confident | 108 Ų | 108 | 111.9 Ų | 111.9 | 51% | 0.505 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -63.6 | -36.7 | 174.6 | -73.3 | 179.9 | 27.3 | 0 | 0 | 111.8 | E261 E262 E263 Q268 A269 | E261-Q265 WeakPolarHBondContact O-CB 3.47Å; E261-Q265 VanDerWaalsContact O-CG 3.29Å; E261-Q265 WeakPolarHBondContact O-CG 3.28Å; E261-Q265 PolarHBondContact O-N 3.17Å; E262-Q265 PolarHBondContact O-N 2.96Å; E263-Q265 PolarHBondContact O-N 3.2Å; Q265-Q268 CarbonylContact O-C 3.6Å; Q265-Q268 PolarHBondContact O-N 3.02Å; Q265-A269 VanDerWaalsContact O-CB 3.24Å; Q265-A269 WeakPolarHBondContact O-CB 3.38Å; Q265-A269 PolarHBondContact O-N 3.34Å |
| 266 | S | 79.7 | Confident | 72.3 | Confident | 69 Ų | 69 | 110.7 Ų | 110.7 | 48% | 0.483 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -68.5 | -38.4 | 176.9 | 80 | 0 | 0 | 0 | 0 | 112.4 | E262 E263 L264 Q268 G270 | E262-S266 VanDerWaalsContact O-CB 3.31Å; E262-S266 WeakPolarHBondContact O-CB 3.28Å; E262-S266 PolarHBondContact O-N 3.5Å; E263-S266 PolarHBondContact O-N 3.43Å; E263-S266 VanDerWaalsContact O-N 3.1Å; E263-S266 PolarHBondContact O-OG 2.83Å; L264-S266 VanDerWaalsContact C-N 3.32Å; L264-S266 PolarHBondContact O-N 2.79Å; S266-Q268 VanDerWaalsContact C-N 3.27Å; S266-Q268 PolarHBondContact O-N 3.08Å; S266-G270 WeakPolarHBondContact O-CA 3.43Å; S266-G270 PolarHBondContact O-N 2.89Å |
| 267 | F | 72.8 | Confident | 69.8 | Low | 166 Ų | 166 | 110.6 Ų | 110.6 | 73% | 0.728 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -66.8 | -28.8 | 171.4 | -73.6 | -63.4 | 0 | 0 | 0 | 112.4 | E263 L264 | E263-F267 HydrophobicContact CB-CE2 4.49Å; E263-F267 WeakPolarHBondContact O-CD2 3.18Å; E263-F267 PolarHBondContact O-N 3.32Å; L264-F267 PolarHBondContact O-N 3.39Å |
| 268 | Q | 67.8 | Low | 67.1 | Low | 170 Ų | 170 | 112.4 Ų | 112.4 | 79% | 0.794 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -83.7 | -34.3 | 178 | -166.1 | 171.9 | 20.3 | 0 | 0 | 113.3 | L264 Q265 S266 | L264-Q268 WeakPolarHBondContact O-CB 3.4Å; L264-Q268 PolarHBondContact O-N 3.24Å; Q265-Q268 CarbonylContact O-C 3.6Å; Q265-Q268 PolarHBondContact O-N 3.02Å; S266-Q268 VanDerWaalsContact C-N 3.27Å; S266-Q268 PolarHBondContact O-N 3.08Å |
| 269 | A | 61.8 | Low | 64.5 | Low | 85 Ų | 85 | 114.9 Ų | 114.9 | 70% | 0.702 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -82.6 | -24.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q265 G271 | Q265-A269 VanDerWaalsContact O-CB 3.24Å; Q265-A269 WeakPolarHBondContact O-CB 3.38Å; Q265-A269 PolarHBondContact O-N 3.34Å; A269-G271 PolarHBondContact O-N 3.34Å |
| 270 | G | 49.1 | Very low | 61.9 | Low | 61 Ų | 61 | 120.2 Ų | 120.2 | 63% | 0.629 | 67% | 0.673 | S | S | * | * | trans | -71.3 | 32.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | S266 | S266-G270 WeakPolarHBondContact O-CA 3.43Å; S266-G270 PolarHBondContact O-N 2.89Å | ||
| 271 | G | 55.5 | Low | 59.3 | Low | 47 Ų | 47 | 118.4 Ų | 118.4 | 49% | 0.485 | 68% | 0.677 | S | S | . | * | S | Bend | trans | -63.6 | 145.1 | 159 | 0 | 0 | 0 | 0 | 0 | 109.6 | A269 G273 | A269-G271 PolarHBondContact O-N 3.34Å; G271-G273 PolarHBondContact O-N 2.9Å |
| 272 | P | 44.9 | Very low | 57.1 | Low | 141 Ų | 141 | 117.3 Ų | 117.3 | 92% | 0.916 | 69% | 0.688 | S | S | * | * | trans | -65.3 | 102.9 | -172.7 | 26.1 | -34.3 | 0 | 0 | 0 | 111.3 | E274 | P272-E274 PolarHBondContact O-N 3.5Š| ||
| 273 | G | 46.8 | Very low | 55.4 | Low | 73 Ų | 73 | 119 Ų | 119 | 75% | 0.753 | 71% | 0.708 | S | S | * | * | trans | -89.9 | 98.3 | -178.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | G271 | G271-G273 PolarHBondContact O-N 2.9Š| ||
| 274 | E | 48.6 | Very low | 54 | Low | 196 Ų | 196 | 118.6 Ų | 118.6 | 92% | 0.916 | 73% | 0.727 | S | S | * | * | trans | -90.7 | 111.4 | 161.5 | -177.6 | 176.7 | -172.6 | 0 | 0 | 108.4 | P272 | P272-E274 PolarHBondContact O-N 3.5Š| ||
| 275 | V | 40.5 | Very low | 53 | Low | 131 Ų | 131 | 119.7 Ų | 119.7 | 79% | 0.794 | 74% | 0.737 | S | S | * | * | trans | -135.7 | 117.3 | 178.1 | -176.6 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 276 | N | 35.7 | Very low | 52.2 | Low | 132 Ų | 132 | 118 Ų | 118 | 71% | 0.706 | 73% | 0.732 | S | S | * | * | trans | -79.6 | 154.2 | 175.9 | -174.4 | 37.3 | 0 | 0 | 0 | 111.6 | ||||
| 277 | V | 44.1 | Very low | 52.1 | Low | 124 Ų | 124 | 120.3 Ų | 120.3 | 75% | 0.752 | 74% | 0.738 | S | S | * | * | trans | -120.7 | 126.5 | -177.8 | 177.9 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 278 | E | 36.9 | Very low | 52.5 | Low | 178 Ų | 178 | 116.6 Ų | 116.6 | 83% | 0.832 | 73% | 0.729 | S | S | * | * | trans | -122.7 | 144.6 | 168.8 | -70.4 | -174.7 | -172.5 | 0 | 0 | 110.7 | ||||
| 279 | M | 42.6 | Very low | 53.3 | Low | 169 Ų | 169 | 115.5 Ų | 115.5 | 83% | 0.833 | 72% | 0.722 | S | S | * | * | trans | -135.4 | 131.3 | -165.8 | 172.3 | -175.5 | 168.5 | 0 | 0 | 109 | A281 | M279-A281 HydrophobicContact CE-CB 4.12Š| ||
| 280 | D | 38.8 | Very low | 54.4 | Low | 167 Ų | 167 | 115 Ų | 115 | 89% | 0.893 | 71% | 0.71 | S | S | * | * | trans | -120.8 | 139.2 | 171.4 | -171.5 | 15.9 | 0 | 0 | 0 | 109.9 | ||||
| 281 | A | 38.7 | Very low | 56.2 | Low | 73 Ų | 73 | 116.9 Ų | 116.9 | 60% | 0.603 | 71% | 0.705 | S | S | * | * | trans | -147.3 | 120.1 | -169.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | M279 | M279-A281 HydrophobicContact CE-CB 4.12Š| ||
| 282 | A | 46.8 | Very low | 57.7 | Low | 94 Ų | 94 | 119.2 Ų | 119.2 | 78% | 0.777 | 71% | 0.706 | S | S | * | * | P | Polyproline II helix | trans | -86.6 | 165.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | ||
| 283 | P | 55.1 | Low | 59.9 | Low | 132 Ų | 132 | 117.7 Ų | 117.7 | 86% | 0.857 | 69% | 0.687 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 144 | -156.7 | 28.5 | -34.9 | 0 | 0 | 0 | 115.1 | ||
| 284 | G | 56.9 | Low | 61.9 | Low | 79 Ų | 79 | 118.6 Ų | 118.6 | 81% | 0.814 | 67% | 0.673 | S | S | * | * | P | Polyproline II helix | trans | -76.3 | 132.7 | -165.9 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||
| 285 | V | 65.3 | Low | 64 | Low | 118 Ų | 118 | 117.7 Ų | 117.7 | 72% | 0.715 | 66% | 0.661 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 150 | 150 | 175.8 | 0 | 0 | 0 | 0 | 108.7 | L287 V290 | V285-L287 PolarHBondContact O-N 3.23Å; V285-V290 HydrophobicContact CG1-CG2 4.19Å |
| 286 | D | 68.4 | Low | 66.5 | Low | 74 Ų | 74 | 113.9 Ų | 113.9 | 40% | 0.396 | 64% | 0.643 | S | S | . | * | trans | -68 | 78.1 | 173.6 | -175.6 | 2.7 | 0 | 0 | 0 | 110.7 | T288 K289 | D286-T288 PolarHBondContact O-N 3.37Å; D286-T288 VanDerWaalsContact O-N 3.12Å; D286-T288 PolarHBondContact OD1-OG1 3.46Å; D286-T288 VanDerWaalsContact OD1-OG1 3.07Å; D286-K289 PolarHBondContact O-N 2.76Å; D286-K289 VanDerWaalsContact O-N 3.07Å; D286-K289 WeakPolarHBondContact OD2-CD 3.46Å; D286-K289 VanDerWaalsContact OD2-CE 3.28Å; D286-K289 WeakPolarHBondContact OD2-CE 3.32Å; D286-K289 IonicContact OD2-NZ 3.84Å; D286-K289 PolarHBondContact OD2-NZ 2.89Å | ||
| 287 | L | 77.1 | Confident | 69.1 | Low | 116 Ų | 116 | 112.9 Ų | 112.9 | 61% | 0.607 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -55.8 | -31.1 | -171.8 | -173.9 | 64.8 | 0 | 0 | 0 | 111.9 | V285 K289 V290 L291 | V285-L287 PolarHBondContact O-N 3.23Å; L287-K289 VanDerWaalsContact C-N 3.34Å; L287-K289 PolarHBondContact O-N 3Å; L287-V290 PolarHBondContact O-N 2.77Å; L287-L291 HydrophobicContact CD1-CD1 4.48Å; L287-L291 HydrophobicContact CD1-CG 4.47Å; L287-L291 HydrophobicContact CD2-CD1 4.31Å; L287-L291 HydrophobicContact CG-CD1 3.82Å; L287-L291 HydrophobicContact CG-CG 4.27Å; L287-L291 VanDerWaalsContact O-CB 3.28Å; L287-L291 WeakPolarHBondContact O-CB 3.33Å; L287-L291 WeakPolarHBondContact O-CG 3.42Å; L287-L291 PolarHBondContact O-N 2.87Å |
| 288 | T | 82.3 | Confident | 71.5 | Confident | 88 Ų | 88 | 114.3 Ų | 114.3 | 54% | 0.54 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -56.7 | -43.6 | 177.2 | -25.6 | 0 | 0 | 0 | 0 | 112.5 | D286 N292 | D286-T288 PolarHBondContact O-N 3.37Å; D286-T288 VanDerWaalsContact O-N 3.12Å; D286-T288 PolarHBondContact OD1-OG1 3.46Å; D286-T288 VanDerWaalsContact OD1-OG1 3.07Å; T288-N292 WeakPolarHBondContact O-CB 3.32Å; T288-N292 VanDerWaalsContact O-CG 3.22Å; T288-N292 PolarHBondContact O-N 2.64Å; T288-N292 PolarHBondContact O-ND2 3.34Å |
| 289 | K | 83.8 | Confident | 74.2 | Confident | 147 Ų | 147 | 112.2 Ų | 112.2 | 64% | 0.639 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -72.5 | -42.9 | -179 | -70.7 | -178.3 | -179.1 | 123.8 | 0 | 111.5 | D286 L287 N292 E293 | D286-K289 PolarHBondContact O-N 2.76Å; D286-K289 VanDerWaalsContact O-N 3.07Å; D286-K289 WeakPolarHBondContact OD2-CD 3.46Å; D286-K289 VanDerWaalsContact OD2-CE 3.28Å; D286-K289 WeakPolarHBondContact OD2-CE 3.32Å; D286-K289 IonicContact OD2-NZ 3.84Å; D286-K289 PolarHBondContact OD2-NZ 2.89Å; L287-K289 VanDerWaalsContact C-N 3.34Å; L287-K289 PolarHBondContact O-N 3Å; K289-N292 PolarHBondContact O-N 2.9Å; K289-E293 WeakPolarHBondContact O-CB 3.33Å; K289-E293 PolarHBondContact O-N 3.36Å |
| 290 | V | 84.9 | Confident | 76.7 | Confident | 76 Ų | 76 | 107.2 Ų | 107.2 | 46% | 0.461 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -65.7 | -40.9 | 178.2 | -178.1 | 0 | 0 | 0 | 0 | 111 | V285 L287 M294 | V285-V290 HydrophobicContact CG1-CG2 4.19Å; L287-V290 PolarHBondContact O-N 2.77Å; V290-M294 HydrophobicContact CG1-CG 4.45Å; V290-M294 VanDerWaalsContact O-CB 3.32Å; V290-M294 WeakPolarHBondContact O-CB 3.07Å; V290-M294 WeakPolarHBondContact O-CG 3.48Å; V290-M294 PolarHBondContact O-N 3.11Å |
| 291 | L | 86.2 | Confident | 79.3 | Confident | 100 Ų | 100 | 105.2 Ų | 105.2 | 52% | 0.524 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -62.1 | -43.1 | 173.5 | -83.6 | 168.5 | 0 | 0 | 0 | 112.5 | L287 R295 | L287-L291 HydrophobicContact CD1-CD1 4.48Å; L287-L291 HydrophobicContact CD1-CG 4.47Å; L287-L291 HydrophobicContact CD2-CD1 4.31Å; L287-L291 HydrophobicContact CG-CD1 3.82Å; L287-L291 HydrophobicContact CG-CG 4.27Å; L287-L291 VanDerWaalsContact O-CB 3.28Å; L287-L291 WeakPolarHBondContact O-CB 3.33Å; L287-L291 WeakPolarHBondContact O-CG 3.42Å; L287-L291 PolarHBondContact O-N 2.87Å; L291-R295 VanDerWaalsContact O-CB 3.26Å; L291-R295 WeakPolarHBondContact O-CB 3.48Å; L291-R295 PolarHBondContact O-N 2.89Å |
| 292 | N | 88.4 | Confident | 81.9 | Confident | 95 Ų | 95 | 104.7 Ų | 104.7 | 51% | 0.508 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -69.2 | -40.1 | 179.6 | -74.9 | -22.9 | 0 | 0 | 0 | 112.4 | T288 K289 R295 A296 | T288-N292 WeakPolarHBondContact O-CB 3.32Å; T288-N292 VanDerWaalsContact O-CG 3.22Å; T288-N292 PolarHBondContact O-N 2.64Å; T288-N292 PolarHBondContact O-ND2 3.34Å; K289-N292 PolarHBondContact O-N 2.9Å; N292-R295 PolarHBondContact O-N 3.19Å; N292-A296 WeakPolarHBondContact O-CB 3.41Å; N292-A296 PolarHBondContact O-N 3.08Å |
| 293 | E | 89.9 | Confident | 84.2 | Confident | 110 Ų | 110 | 103.7 Ų | 103.7 | 51% | 0.514 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -64.7 | -47.2 | 174.4 | -178.9 | 58.3 | -148.4 | 0 | 0 | 111.3 | K289 R295 A296 Q297 | K289-E293 WeakPolarHBondContact O-CB 3.33Å; K289-E293 PolarHBondContact O-N 3.36Å; E293-R295 VanDerWaalsContact C-N 3.29Å; E293-R295 PolarHBondContact O-N 3.39Å; E293-A296 PolarHBondContact O-N 2.87Å; E293-Q297 WeakPolarHBondContact O-CG 3.37Å; E293-Q297 PolarHBondContact O-N 3.28Å; E293-Q297 PolarHBondContact OE1-NE2 3.27Å |
| 294 | M | 89.3 | Confident | 86.1 | Confident | 91 Ų | 91 | 102.1 Ų | 102.1 | 45% | 0.448 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -56.1 | -44.4 | 172.6 | -75.5 | -108.3 | -71.6 | 0 | 0 | 111.4 | V290 Q297 Y298 | V290-M294 HydrophobicContact CG1-CG 4.45Å; V290-M294 VanDerWaalsContact O-CB 3.32Å; V290-M294 WeakPolarHBondContact O-CB 3.07Å; V290-M294 WeakPolarHBondContact O-CG 3.48Å; V290-M294 PolarHBondContact O-N 3.11Å; M294-Q297 PolarHBondContact O-N 2.9Å; M294-Y298 HydrophobicContact CE-CE2 4.3Å; M294-Y298 WeakPolarHBondContact O-CD2 3.3Å; M294-Y298 PolarHBondContact O-N 3.43Å; M294-Y298 HydrophobicContact SD-CE2 4.37Å |
| 295 | R | 92.4 | Very high | 87.8 | Confident | 178 Ų | 178 | 103.5 Ų | 103.5 | 67% | 0.672 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -61.5 | -45.3 | 178.2 | -168.6 | 179.8 | -159.8 | 137.5 | 6.6 | 111.8 | L291 N292 E293 Q297 Y298 E299 | L291-R295 VanDerWaalsContact O-CB 3.26Å; L291-R295 WeakPolarHBondContact O-CB 3.48Å; L291-R295 PolarHBondContact O-N 2.89Å; N292-R295 PolarHBondContact O-N 3.19Å; E293-R295 VanDerWaalsContact C-N 3.29Å; E293-R295 PolarHBondContact O-N 3.39Å; R295-Q297 VanDerWaalsContact C-N 3.34Å; R295-Q297 PolarHBondContact O-N 2.88Å; R295-Y298 PolarHBondContact O-N 3.41Å; R295-E299 VanDerWaalsContact O-CB 3.28Å; R295-E299 WeakPolarHBondContact O-CB 3.46Å; R295-E299 PolarHBondContact O-N 3.43Å |
| 296 | A | 92.1 | Very high | 89.2 | Confident | 50 Ų | 50 | 102.8 Ų | 102.8 | 41% | 0.413 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62.9 | -39.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | N292 E293 E299 A300 | N292-A296 WeakPolarHBondContact O-CB 3.41Å; N292-A296 PolarHBondContact O-N 3.08Å; E293-A296 PolarHBondContact O-N 2.87Å; A296-E299 PolarHBondContact O-N 2.93Å; A296-A300 VanDerWaalsContact O-CB 3.28Å; A296-A300 WeakPolarHBondContact O-CB 3.39Å; A296-A300 PolarHBondContact O-N 3.03Å |
| 297 | Q | 92 | Very high | 90.6 | Very high | 112 Ų | 112 | 103.8 Ų | 103.8 | 52% | 0.523 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -66.6 | -42.5 | 175.1 | -69.6 | 178.8 | 17 | 0 | 0 | 112.3 | E293 M294 R295 M301 | E293-Q297 WeakPolarHBondContact O-CG 3.37Å; E293-Q297 PolarHBondContact O-N 3.28Å; E293-Q297 PolarHBondContact OE1-NE2 3.27Å; M294-Q297 PolarHBondContact O-N 2.9Å; R295-Q297 VanDerWaalsContact C-N 3.34Å; R295-Q297 PolarHBondContact O-N 2.88Å; Q297-M301 VanDerWaalsContact O-CB 3.27Å; Q297-M301 WeakPolarHBondContact O-CB 3Å; Q297-M301 PolarHBondContact O-N 2.93Å |
| 298 | Y | 93.6 | Very high | 91.4 | Very high | 153 Ų | 153 | 102.3 Ų | 102.3 | 60% | 0.6 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -66.1 | -39.4 | 174.5 | -81 | -63.2 | 0 | 0 | 0 | 112.6 | M294 R295 M301 A302 | M294-Y298 HydrophobicContact CE-CE2 4.3Å; M294-Y298 WeakPolarHBondContact O-CD2 3.3Å; M294-Y298 PolarHBondContact O-N 3.43Å; M294-Y298 HydrophobicContact SD-CE2 4.37Å; R295-Y298 PolarHBondContact O-N 3.41Å; Y298-M301 PolarHBondContact O-N 3.37Å; Y298-A302 VanDerWaalsContact O-CB 3.27Å; Y298-A302 WeakPolarHBondContact O-CB 3.5Å; Y298-A302 PolarHBondContact O-N 3.31Å |
| 299 | E | 93.6 | Very high | 92 | Very high | 135 Ų | 135 | 100.5 Ų | 100.5 | 63% | 0.631 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -67.1 | -43.2 | 177.6 | -171.3 | 163.5 | -157 | 0 | 0 | 111.2 | R295 A296 A302 E303 | R295-E299 VanDerWaalsContact O-CB 3.28Å; R295-E299 WeakPolarHBondContact O-CB 3.46Å; R295-E299 PolarHBondContact O-N 3.43Å; A296-E299 PolarHBondContact O-N 2.93Å; E299-A302 PolarHBondContact O-N 3.25Å; E299-E303 WeakPolarHBondContact O-CB 3.41Å; E299-E303 PolarHBondContact O-N 2.94Å |
| 300 | A | 94.6 | Very high | 92.6 | Very high | 63 Ų | 63 | 98 Ų | 98 | 52% | 0.521 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.7 | -41.2 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | A296 Q304 | A296-A300 VanDerWaalsContact O-CB 3.28Å; A296-A300 WeakPolarHBondContact O-CB 3.39Å; A296-A300 PolarHBondContact O-N 3.03Å; A300-Q304 VanDerWaalsContact O-CB 3.27Å; A300-Q304 WeakPolarHBondContact O-CB 3.37Å; A300-Q304 PolarHBondContact O-N 2.87Å |
| 301 | M | 93.2 | Very high | 93.1 | Very high | 126 Ų | 126 | 97 Ų | 97 | 62% | 0.621 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -67.7 | -40.5 | 177.4 | -172.3 | -177.7 | -64 | 0 | 0 | 112.1 | Q297 Y298 N305 | Q297-M301 VanDerWaalsContact O-CB 3.27Å; Q297-M301 WeakPolarHBondContact O-CB 3Å; Q297-M301 PolarHBondContact O-N 2.93Å; Y298-M301 PolarHBondContact O-N 3.37Å; M301-N305 VanDerWaalsContact O-CB 3.24Å; M301-N305 WeakPolarHBondContact O-CB 3.35Å; M301-N305 PolarHBondContact O-N 2.98Å |
| 302 | A | 93.6 | Very high | 93.6 | Very high | 62 Ų | 62 | 100.3 Ų | 100.3 | 51% | 0.512 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -66 | -43.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | Y298 E299 N305 R306 | Y298-A302 VanDerWaalsContact O-CB 3.27Å; Y298-A302 WeakPolarHBondContact O-CB 3.5Å; Y298-A302 PolarHBondContact O-N 3.31Å; E299-A302 PolarHBondContact O-N 3.25Å; A302-N305 PolarHBondContact O-N 3.49Å; A302-R306 WeakPolarHBondContact O-CB 3.41Å; A302-R306 PolarHBondContact O-N 3.41Å |
| 303 | E | 94.7 | Very high | 93.9 | Very high | 72 Ų | 72 | 102 Ų | 102 | 34% | 0.336 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -68.2 | -34.6 | 177.6 | 175.6 | 62.6 | -175.1 | 0 | 0 | 112.4 | E299 R306 K307 | E299-E303 WeakPolarHBondContact O-CB 3.41Å; E299-E303 PolarHBondContact O-N 2.94Å; E303-R306 IonicContact OE1-CZ 2.73Å; E303-R306 IonicContact OE1-NH2 2.79Å; E303-R306 PolarHBondContact OE1-NH2 2.75Å; E303-R306 IonicContact OE2-CZ 3.83Å; E303-R306 VanDerWaalsContact OE2-CZ 3.28Å; E303-R306 IonicContact OE2-NE 2.7Å; E303-R306 PolarHBondContact OE2-NE 3.06Å; E303-R306 IonicContact OE2-NH2 3.43Å; E303-R306 PolarHBondContact OE2-NH2 3.4Å; E303-K307 WeakPolarHBondContact O-CG 3.29Å; E303-K307 PolarHBondContact O-N 2.91Å; E303-K307 WeakPolarHBondContact OE1-CE 3.45Å; E303-K307 IonicContact OE1-NZ 3.77Å; E303-K307 PolarHBondContact OE1-NZ 2.88Å |
| 304 | Q | 94.9 | Very high | 94.3 | Very high | 99 Ų | 99 | 101.6 Ų | 101.6 | 46% | 0.463 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -68.2 | -48.3 | 171.7 | -177.4 | 57.6 | 38.6 | 0 | 0 | 111.2 | A300 R306 K307 D308 | A300-Q304 VanDerWaalsContact O-CB 3.27Å; A300-Q304 WeakPolarHBondContact O-CB 3.37Å; A300-Q304 PolarHBondContact O-N 2.87Å; Q304-R306 VanDerWaalsContact C-N 3.31Å; Q304-R306 PolarHBondContact O-N 2.92Å; Q304-K307 WeakPolarHBondContact O-CB 3.34Å; Q304-K307 PolarHBondContact O-N 3.35Å; Q304-K307 VanDerWaalsContact O-N 3.1Å; Q304-D308 PolarHBondContact NE2-OD1 3.46Å; Q304-D308 PolarHBondContact NE2-OD2 2.75Å; Q304-D308 PolarHBondContact O-N 2.92Å |
| 305 | N | 94.1 | Very high | 94.6 | Very high | 108 Ų | 108 | 101.9 Ų | 101.9 | 58% | 0.578 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -59.2 | -41.1 | 177.1 | -170.4 | -17.2 | 0 | 0 | 0 | 111.6 | M301 A302 K307 D308 A309 | M301-N305 VanDerWaalsContact O-CB 3.24Å; M301-N305 WeakPolarHBondContact O-CB 3.35Å; M301-N305 PolarHBondContact O-N 2.98Å; A302-N305 PolarHBondContact O-N 3.49Å; N305-K307 PolarHBondContact O-N 2.92Å; N305-D308 PolarHBondContact O-N 3.26Å; N305-A309 VanDerWaalsContact O-CB 3.31Å; N305-A309 WeakPolarHBondContact O-CB 3.25Å; N305-A309 PolarHBondContact O-N 3.32Å |
| 306 | R | 94.8 | Very high | 94.8 | Very high | 103 Ų | 103 | 98 Ų | 98 | 39% | 0.389 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -57.1 | -47.6 | 172.7 | -172.8 | -173.9 | 66.8 | 73.8 | 0.8 | 112 | A302 E303 Q304 A309 E310 | A302-R306 WeakPolarHBondContact O-CB 3.41Å; A302-R306 PolarHBondContact O-N 3.41Å; E303-R306 IonicContact OE1-CZ 2.73Å; E303-R306 IonicContact OE1-NH2 2.79Å; E303-R306 PolarHBondContact OE1-NH2 2.75Å; E303-R306 IonicContact OE2-CZ 3.83Å; E303-R306 VanDerWaalsContact OE2-CZ 3.28Å; E303-R306 IonicContact OE2-NE 2.7Å; E303-R306 PolarHBondContact OE2-NE 3.06Å; E303-R306 IonicContact OE2-NH2 3.43Å; E303-R306 PolarHBondContact OE2-NH2 3.4Å; Q304-R306 VanDerWaalsContact C-N 3.31Å; Q304-R306 PolarHBondContact O-N 2.92Å; R306-A309 PolarHBondContact O-N 3Å; R306-E310 WeakPolarHBondContact CG-OE1 3.38Å; R306-E310 IonicContact CZ-OE1 2.67Å; R306-E310 IonicContact NH1-OE1 3.64Å; R306-E310 PolarHBondContact NH1-OE1 3.26Å; R306-E310 IonicContact NH1-OE2 3.44Å; R306-E310 PolarHBondContact NH1-OE2 2.99Å; R306-E310 WeakPolarHBondContact O-CB 3.3Å; R306-E310 WeakPolarHBondContact O-CG 3.28Å; R306-E310 PolarHBondContact O-N 3.34Å |
| 307 | K | 96.4 | Very high | 94.9 | Very high | 95 Ų | 95 | 96.5 Ų | 96.5 | 41% | 0.413 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -65.1 | -40.9 | 177.9 | -74.7 | 167 | -177.5 | 151.2 | 0 | 112.6 | E303 Q304 N305 E310 A311 | E303-K307 WeakPolarHBondContact O-CG 3.29Å; E303-K307 PolarHBondContact O-N 2.91Å; E303-K307 WeakPolarHBondContact OE1-CE 3.45Å; E303-K307 IonicContact OE1-NZ 3.77Å; E303-K307 PolarHBondContact OE1-NZ 2.88Å; Q304-K307 WeakPolarHBondContact O-CB 3.34Å; Q304-K307 PolarHBondContact O-N 3.35Å; Q304-K307 VanDerWaalsContact O-N 3.1Å; N305-K307 PolarHBondContact O-N 2.92Å; K307-E310 PolarHBondContact O-N 2.97Å; K307-A311 VanDerWaalsContact O-CB 3.29Å; K307-A311 WeakPolarHBondContact O-CB 3.31Å; K307-A311 PolarHBondContact O-N 3.33Å |
| 308 | D | 95.3 | Very high | 95.1 | Very high | 85 Ų | 85 | 97.3 Ų | 97.3 | 46% | 0.455 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -68.4 | -38.5 | 178.9 | -67.5 | -29.4 | 0 | 0 | 0 | 111.3 | Q304 N305 A311 W312 | Q304-D308 PolarHBondContact NE2-OD1 3.46Å; Q304-D308 PolarHBondContact NE2-OD2 2.75Å; Q304-D308 PolarHBondContact O-N 2.92Å; N305-D308 PolarHBondContact O-N 3.26Å; D308-A311 PolarHBondContact O-N 3.47Å; D308-W312 VanDerWaalsContact O-CB 3.23Å; D308-W312 WeakPolarHBondContact O-CB 3.39Å; D308-W312 PolarHBondContact O-N 2.92Å |
| 309 | A | 94.2 | Very high | 95.2 | Very high | 51 Ų | 51 | 94.1 Ų | 94.1 | 42% | 0.421 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -65.5 | -42.6 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | N305 R306 W312 F313 | N305-A309 VanDerWaalsContact O-CB 3.31Å; N305-A309 WeakPolarHBondContact O-CB 3.25Å; N305-A309 PolarHBondContact O-N 3.32Å; R306-A309 PolarHBondContact O-N 3Å; A309-W312 PolarHBondContact O-N 3.25Å; A309-F313 WeakPolarHBondContact O-CB 3.3Å; A309-F313 PolarHBondContact O-N 3.35Å |
| 310 | E | 95.8 | Very high | 95.4 | Very high | 93 Ų | 93 | 92.3 Ų | 92.3 | 44% | 0.435 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -63.1 | -45 | 174.1 | -78.4 | 169.3 | -166.2 | 0 | 0 | 111.7 | R306 K307 F313 L314 | R306-E310 WeakPolarHBondContact CG-OE1 3.38Å; R306-E310 IonicContact CZ-OE1 2.67Å; R306-E310 IonicContact NH1-OE1 3.64Å; R306-E310 PolarHBondContact NH1-OE1 3.26Å; R306-E310 IonicContact NH1-OE2 3.44Å; R306-E310 PolarHBondContact NH1-OE2 2.99Å; R306-E310 WeakPolarHBondContact O-CB 3.3Å; R306-E310 WeakPolarHBondContact O-CG 3.28Å; R306-E310 PolarHBondContact O-N 3.34Å; K307-E310 PolarHBondContact O-N 2.97Å; E310-F313 PolarHBondContact O-N 2.93Å; E310-L314 WeakPolarHBondContact O-CB 3.48Å; E310-L314 VanDerWaalsContact O-CG 3.25Å; E310-L314 WeakPolarHBondContact O-CG 3.35Å; E310-L314 PolarHBondContact O-N 3.29Å |
| 311 | A | 95.7 | Very high | 95.4 | Very high | 55 Ų | 55 | 97.3 Ų | 97.3 | 46% | 0.455 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -62.7 | -44.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | K307 D308 L314 E315 | K307-A311 VanDerWaalsContact O-CB 3.29Å; K307-A311 WeakPolarHBondContact O-CB 3.31Å; K307-A311 PolarHBondContact O-N 3.33Å; D308-A311 PolarHBondContact O-N 3.47Å; A311-L314 PolarHBondContact O-N 2.9Å; A311-E315 WeakPolarHBondContact O-CB 3.09Å; A311-E315 PolarHBondContact O-N 3.33Å |
| 312 | W | 96.1 | Very high | 95.6 | Very high | 170 Ų | 170 | 98.8 Ų | 98.8 | 64% | 0.644 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -62.9 | -44.1 | 176.3 | -177.3 | 90.8 | 0 | 0 | 0 | 112.2 | D308 A309 L314 E315 K316 | D308-W312 VanDerWaalsContact O-CB 3.23Å; D308-W312 WeakPolarHBondContact O-CB 3.39Å; D308-W312 PolarHBondContact O-N 2.92Å; A309-W312 PolarHBondContact O-N 3.25Å; W312-L314 PolarHBondContact O-N 3.45Å; W312-E315 PolarHBondContact O-N 2.9Å; W312-K316 HydrophobicContact CD2-CG 4.37Å; W312-K316 HydrophobicContact CH2-CG 4.34Å; W312-K316 HydrophobicContact CZ2-CG 4.02Å; W312-K316 PolarHBondContact O-N 2.95Å |
| 313 | F | 96.6 | Very high | 95.8 | Very high | 132 Ų | 132 | 101.5 Ų | 101.5 | 58% | 0.579 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -64.5 | -39.6 | 176.4 | -177.8 | -95.3 | 0 | 0 | 0 | 112 | A309 E310 S317 | A309-F313 WeakPolarHBondContact O-CB 3.3Å; A309-F313 PolarHBondContact O-N 3.35Å; E310-F313 PolarHBondContact O-N 2.93Å; F313-S317 WeakPolarHBondContact CE1-OG 3.4Å; F313-S317 WeakPolarHBondContact O-CB 3.45Å; F313-S317 PolarHBondContact O-N 3.01Å; F313-S317 PolarHBondContact O-OG 3.06Å |
| 314 | L | 96.3 | Very high | 95.8 | Very high | 100 Ų | 100 | 102.6 Ų | 102.6 | 52% | 0.524 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -66.6 | -38.1 | 174.9 | -74.6 | 170.9 | 0 | 0 | 0 | 112.2 | E310 A311 W312 R318 | E310-L314 WeakPolarHBondContact O-CB 3.48Å; E310-L314 VanDerWaalsContact O-CG 3.25Å; E310-L314 WeakPolarHBondContact O-CG 3.35Å; E310-L314 PolarHBondContact O-N 3.29Å; A311-L314 PolarHBondContact O-N 2.9Å; W312-L314 PolarHBondContact O-N 3.45Å; L314-R318 WeakPolarHBondContact O-CB 3.39Å; L314-R318 PolarHBondContact O-N 2.91Å |
| 315 | E | 96.7 | Very high | 95.9 | Very high | 98 Ų | 98 | 100.3 Ų | 100.3 | 46% | 0.458 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -62.4 | -54.6 | 174.5 | -167.4 | 59.5 | -123.4 | 0 | 0 | 110.8 | A311 W312 S317 R318 E319 | A311-E315 WeakPolarHBondContact O-CB 3.09Å; A311-E315 PolarHBondContact O-N 3.33Å; W312-E315 PolarHBondContact O-N 2.9Å; E315-S317 VanDerWaalsContact C-N 3.33Å; E315-S317 PolarHBondContact O-N 3.01Å; E315-R318 WeakPolarHBondContact O-CA 3.39Å; E315-R318 WeakPolarHBondContact O-CB 3.29Å; E315-R318 PolarHBondContact O-N 3.32Å; E315-R318 IonicContact OE1-CZ 2.79Å; E315-R318 IonicContact OE1-NH1 2.77Å; E315-R318 PolarHBondContact OE1-NH1 3.13Å; E315-R318 IonicContact OE2-CZ 2.94Å; E315-R318 IonicContact OE2-NH1 3.84Å; E315-R318 PolarHBondContact OE2-NH1 2.87Å; E315-R318 IonicContact OE2-NH2 3.28Å; E315-E319 PolarHBondContact O-N 3.41Å |
| 316 | K | 96.3 | Very high | 96 | Very high | 96 Ų | 96 | 97.7 Ų | 97.7 | 42% | 0.417 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -63.5 | -36 | 178.4 | -72 | -53.2 | -170.1 | -179.1 | 0 | 113.3 | W312 R318 E319 L320 | W312-K316 HydrophobicContact CD2-CG 4.37Å; W312-K316 HydrophobicContact CH2-CG 4.34Å; W312-K316 HydrophobicContact CZ2-CG 4.02Å; W312-K316 PolarHBondContact O-N 2.95Å; K316-R318 VanDerWaalsContact C-N 3.28Å; K316-R318 PolarHBondContact O-N 2.95Å; K316-E319 WeakPolarHBondContact CD-OE2 3.28Å; K316-E319 WeakPolarHBondContact CE-OE2 3.34Å; K316-E319 IonicContact NZ-OE1 3.78Å; K316-E319 IonicContact NZ-OE2 2.75Å; K316-E319 PolarHBondContact NZ-OE2 2.91Å; K316-L320 VanDerWaalsContact O-CB 3.28Å; K316-L320 WeakPolarHBondContact O-CB 3.48Å; K316-L320 PolarHBondContact O-N 2.67Å |
| 317 | S | 94.9 | Very high | 96.1 | Very high | 19 Ų | 19 | 97.7 Ų | 97.7 | 13% | 0.133 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -64.8 | -30.9 | 171.5 | -65.9 | 0 | 0 | 0 | 0 | 112.9 | F313 E315 R321 | F313-S317 WeakPolarHBondContact CE1-OG 3.4Å; F313-S317 WeakPolarHBondContact O-CB 3.45Å; F313-S317 PolarHBondContact O-N 3.01Å; F313-S317 PolarHBondContact O-OG 3.06Å; E315-S317 VanDerWaalsContact C-N 3.33Å; E315-S317 PolarHBondContact O-N 3.01Å; S317-R321 WeakPolarHBondContact O-CB 3.31Å; S317-R321 WeakPolarHBondContact O-CD 3.33Å; S317-R321 WeakPolarHBondContact O-CG 3.42Å; S317-R321 PolarHBondContact O-N 3.2Å; S317-R321 VanDerWaalsContact O-N 3.14Å |
| 318 | R | 96.5 | Very high | 96.2 | Very high | 129 Ų | 129 | 96.4 Ų | 96.4 | 49% | 0.487 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -78.7 | -42.6 | 178.6 | -162.3 | -173.7 | -42.6 | 105.2 | 3.4 | 111.7 | L314 E315 K316 R321 K322 | L314-R318 WeakPolarHBondContact O-CB 3.39Å; L314-R318 PolarHBondContact O-N 2.91Å; E315-R318 WeakPolarHBondContact O-CA 3.39Å; E315-R318 WeakPolarHBondContact O-CB 3.29Å; E315-R318 PolarHBondContact O-N 3.32Å; E315-R318 IonicContact OE1-CZ 2.79Å; E315-R318 IonicContact OE1-NH1 2.77Å; E315-R318 PolarHBondContact OE1-NH1 3.13Å; E315-R318 IonicContact OE2-CZ 2.94Å; E315-R318 IonicContact OE2-NH1 3.84Å; E315-R318 PolarHBondContact OE2-NH1 2.87Å; E315-R318 IonicContact OE2-NH2 3.28Å; K316-R318 VanDerWaalsContact C-N 3.28Å; K316-R318 PolarHBondContact O-N 2.95Å; R318-R321 PolarHBondContact O-N 3.4Å; R318-K322 WeakPolarHBondContact O-CB 3.4Å; R318-K322 PolarHBondContact O-N 3.39Å |
| 319 | E | 95.6 | Very high | 96.2 | Very high | 86 Ų | 86 | 98.8 Ų | 98.8 | 40% | 0.402 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -57.4 | -53.6 | 172.8 | -172.5 | 172.4 | -135.7 | 0 | 0 | 110.4 | E315 K316 R321 K322 E323 | E315-E319 PolarHBondContact O-N 3.41Å; K316-E319 WeakPolarHBondContact CD-OE2 3.28Å; K316-E319 WeakPolarHBondContact CE-OE2 3.34Å; K316-E319 IonicContact NZ-OE1 3.78Å; K316-E319 IonicContact NZ-OE2 2.75Å; K316-E319 PolarHBondContact NZ-OE2 2.91Å; E319-R321 PolarHBondContact O-N 3.34Å; E319-K322 WeakPolarHBondContact O-CB 3.27Å; E319-K322 PolarHBondContact O-N 3.47Å; E319-E323 PolarHBondContact O-N 2.9Å |
| 320 | L | 96.1 | Very high | 96.3 | Very high | 97 Ų | 97 | 102.1 Ų | 102.1 | 51% | 0.508 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -59 | -41.3 | 177.4 | -178.5 | 62.1 | 0 | 0 | 0 | 112.7 | K316 K322 E323 I324 | K316-L320 VanDerWaalsContact O-CB 3.28Å; K316-L320 WeakPolarHBondContact O-CB 3.48Å; K316-L320 PolarHBondContact O-N 2.67Å; L320-K322 VanDerWaalsContact C-N 3.32Å; L320-K322 PolarHBondContact O-N 2.8Å; L320-E323 PolarHBondContact O-N 3.32Å; L320-I324 HydrophobicContact CD1-CD1 4.11Å; L320-I324 HydrophobicContact CD1-CG1 4.34Å; L320-I324 HydrophobicContact CG-CD1 3.88Å; L320-I324 WeakPolarHBondContact O-CB 3.28Å; L320-I324 WeakPolarHBondContact O-CG1 3.24Å; L320-I324 PolarHBondContact O-N 2.89Å |
| 321 | R | 96.3 | Very high | 96.4 | Very high | 167 Ų | 167 | 102.9 Ų | 102.9 | 63% | 0.63 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -63 | -37.2 | 175.1 | -78.9 | 171.9 | -168.9 | 139.4 | 3.5 | 112.6 | S317 R318 E319 S325 | S317-R321 WeakPolarHBondContact O-CB 3.31Å; S317-R321 WeakPolarHBondContact O-CD 3.33Å; S317-R321 WeakPolarHBondContact O-CG 3.42Å; S317-R321 PolarHBondContact O-N 3.2Å; S317-R321 VanDerWaalsContact O-N 3.14Å; R318-R321 PolarHBondContact O-N 3.4Å; E319-R321 PolarHBondContact O-N 3.34Å; R321-S325 PolarHBondContact O-N 2.91Å; R321-S325 PolarHBondContact O-OG 2.98Å |
| 322 | K | 96.9 | Very high | 96.4 | Very high | 158 Ų | 158 | 105 Ų | 105 | 69% | 0.687 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -70.7 | -38.4 | 177.4 | -175.3 | -174.7 | 175 | -170.4 | 0 | 111.7 | R318 E319 L320 S325 S326 | R318-K322 WeakPolarHBondContact O-CB 3.4Å; R318-K322 PolarHBondContact O-N 3.39Å; E319-K322 WeakPolarHBondContact O-CB 3.27Å; E319-K322 PolarHBondContact O-N 3.47Å; L320-K322 VanDerWaalsContact C-N 3.32Å; L320-K322 PolarHBondContact O-N 2.8Å; K322-S325 PolarHBondContact O-N 2.95Å; K322-S325 PolarHBondContact O-OG 3.07Å; K322-S326 VanDerWaalsContact O-CB 3.27Å; K322-S326 WeakPolarHBondContact O-CB 3.48Å; K322-S326 PolarHBondContact O-N 2.86Å |
| 323 | E | 96.6 | Very high | 96.5 | Very high | 118 Ų | 118 | 100.2 Ų | 100.2 | 55% | 0.551 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -65 | -44.4 | 172.2 | -70.7 | -176.2 | 165.7 | 0 | 0 | 111.2 | E319 L320 S325 S326 N327 | E319-E323 PolarHBondContact O-N 2.9Å; L320-E323 PolarHBondContact O-N 3.32Å; E323-S325 PolarHBondContact O-N 3.35Å; E323-S326 PolarHBondContact O-N 3.46Å; E323-N327 WeakPolarHBondContact O-CB 3.49Å; E323-N327 PolarHBondContact O-N 3.09Å |
| 324 | I | 96.6 | Very high | 96.4 | Very high | 95 Ų | 95 | 96.8 Ų | 96.8 | 49% | 0.487 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -60.6 | -43.4 | 175.5 | -70.5 | 166.2 | 0 | 0 | 0 | 111.2 | L320 T328 | L320-I324 HydrophobicContact CD1-CD1 4.11Å; L320-I324 HydrophobicContact CD1-CG1 4.34Å; L320-I324 HydrophobicContact CG-CD1 3.88Å; L320-I324 WeakPolarHBondContact O-CB 3.28Å; L320-I324 WeakPolarHBondContact O-CG1 3.24Å; L320-I324 PolarHBondContact O-N 2.89Å; I324-T328 VanDerWaalsContact O-CB 3.26Å; I324-T328 WeakPolarHBondContact O-CB 3.29Å; I324-T328 PolarHBondContact O-N 3.1Å; I324-T328 PolarHBondContact O-OG1 3.44Å |
| 325 | S | 96.6 | Very high | 96.4 | Very high | 52 Ų | 52 | 98.1 Ų | 98.1 | 36% | 0.364 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -66.1 | -46.6 | 177.6 | 68.4 | 0 | 0 | 0 | 0 | 111.6 | R321 K322 E323 N327 T328 E329 | R321-S325 PolarHBondContact O-N 2.91Å; R321-S325 PolarHBondContact O-OG 2.98Å; K322-S325 PolarHBondContact O-N 2.95Å; K322-S325 PolarHBondContact O-OG 3.07Å; E323-S325 PolarHBondContact O-N 3.35Å; S325-N327 PolarHBondContact O-N 3.02Å; S325-T328 PolarHBondContact O-N 3.06Å; S325-E329 WeakPolarHBondContact O-CG 3.45Å; S325-E329 PolarHBondContact O-N 3.38Å |
| 326 | S | 96.8 | Very high | 96.4 | Very high | 52 Ų | 52 | 96.1 Ų | 96.1 | 36% | 0.364 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -58.2 | -45.8 | 176.4 | 180 | 0 | 0 | 0 | 0 | 112.3 | K322 E323 E329 Q330 | K322-S326 VanDerWaalsContact O-CB 3.27Å; K322-S326 WeakPolarHBondContact O-CB 3.48Å; K322-S326 PolarHBondContact O-N 2.86Å; E323-S326 PolarHBondContact O-N 3.46Å; S326-E329 PolarHBondContact O-N 3.03Å; S326-Q330 VanDerWaalsContact O-CG 3.32Å; S326-Q330 WeakPolarHBondContact O-CG 3.39Å; S326-Q330 PolarHBondContact O-N 3.37Å |
| 327 | N | 96.6 | Very high | 96.4 | Very high | 103 Ų | 103 | 97.3 Ų | 97.3 | 55% | 0.551 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -68.3 | -37 | 177.7 | -167.7 | -1.3 | 0 | 0 | 0 | 111.3 | E323 S325 Q330 L331 | E323-N327 WeakPolarHBondContact O-CB 3.49Å; E323-N327 PolarHBondContact O-N 3.09Å; S325-N327 PolarHBondContact O-N 3.02Å; N327-Q330 PolarHBondContact O-N 3.48Å; N327-L331 VanDerWaalsContact O-CB 3.26Å; N327-L331 WeakPolarHBondContact O-CB 3.38Å; N327-L331 PolarHBondContact O-N 2.99Å |
| 328 | T | 96.8 | Very high | 96.5 | Very high | 69 Ų | 69 | 99.6 Ų | 99.6 | 42% | 0.423 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.4 | -43 | 174.1 | -58.8 | 0 | 0 | 0 | 0 | 111.5 | I324 S325 L331 Q332 | I324-T328 VanDerWaalsContact O-CB 3.26Å; I324-T328 WeakPolarHBondContact O-CB 3.29Å; I324-T328 PolarHBondContact O-N 3.1Å; I324-T328 PolarHBondContact O-OG1 3.44Å; S325-T328 PolarHBondContact O-N 3.06Å; T328-L331 PolarHBondContact O-N 3.21Å; T328-Q332 WeakPolarHBondContact O-CG 3.31Å; T328-Q332 PolarHBondContact O-N 2.93Å |
| 329 | E | 96.9 | Very high | 96.5 | Very high | 135 Ų | 135 | 95.9 Ų | 95.9 | 63% | 0.631 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -62.7 | -45.9 | 175.8 | -73.9 | 168.5 | -157.5 | 0 | 0 | 111.7 | S325 S326 L331 Q332 S333 | S325-E329 WeakPolarHBondContact O-CG 3.45Å; S325-E329 PolarHBondContact O-N 3.38Å; S326-E329 PolarHBondContact O-N 3.03Å; E329-L331 VanDerWaalsContact C-N 3.34Å; E329-L331 PolarHBondContact O-N 3.17Å; E329-Q332 PolarHBondContact O-N 2.88Å; E329-S333 PolarHBondContact O-N 3.46Å; E329-S333 PolarHBondContact O-OG 2.91Å |
| 330 | Q | 95.9 | Very high | 96.6 | Very high | 121 Ų | 121 | 95.9 Ų | 95.9 | 57% | 0.565 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -62.3 | -38.3 | 174.7 | -71.3 | 175 | 2 | 0 | 0 | 112.6 | S326 N327 S333 S334 | S326-Q330 VanDerWaalsContact O-CG 3.32Å; S326-Q330 WeakPolarHBondContact O-CG 3.39Å; S326-Q330 PolarHBondContact O-N 3.37Å; N327-Q330 PolarHBondContact O-N 3.48Å; Q330-S333 WeakPolarHBondContact CA-OG 3.38Å; Q330-S333 PolarHBondContact O-N 2.91Å; Q330-S333 PolarHBondContact O-OG 2.95Å; Q330-S334 WeakPolarHBondContact O-CB 3.31Å; Q330-S334 PolarHBondContact O-N 3.48Å |
| 331 | L | 96.9 | Very high | 96.5 | Very high | 109 Ų | 109 | 95.6 Ų | 95.6 | 57% | 0.571 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -68.4 | -38.2 | 176.3 | -174.2 | 65.2 | 0 | 0 | 0 | 111.6 | N327 T328 E329 K335 | N327-L331 VanDerWaalsContact O-CB 3.26Å; N327-L331 WeakPolarHBondContact O-CB 3.38Å; N327-L331 PolarHBondContact O-N 2.99Å; T328-L331 PolarHBondContact O-N 3.21Å; E329-L331 VanDerWaalsContact C-N 3.34Å; E329-L331 PolarHBondContact O-N 3.17Å; L331-K335 WeakPolarHBondContact O-CB 3.42Å; L331-K335 PolarHBondContact O-N 3.25Å |
| 332 | Q | 96.9 | Very high | 96.4 | Very high | 100 Ų | 100 | 94 Ų | 94 | 47% | 0.467 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -68.5 | -41.7 | 173.8 | -65.7 | -45.8 | -47.5 | 0 | 0 | 112 | T328 E329 K335 S336 | T328-Q332 WeakPolarHBondContact O-CG 3.31Å; T328-Q332 PolarHBondContact O-N 2.93Å; E329-Q332 PolarHBondContact O-N 2.88Å; Q332-K335 WeakPolarHBondContact O-CB 3.29Å; Q332-K335 PolarHBondContact O-N 3.4Å; Q332-S336 PolarHBondContact O-N 3.09Å; Q332-S336 PolarHBondContact O-OG 3.16Å |
| 333 | S | 96.8 | Very high | 96.3 | Very high | 68 Ų | 68 | 92.5 Ų | 92.5 | 48% | 0.476 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -65.7 | -45.7 | 179.9 | 65.6 | 0 | 0 | 0 | 0 | 111.9 | E329 Q330 K335 S336 E337 | E329-S333 PolarHBondContact O-N 3.46Å; E329-S333 PolarHBondContact O-OG 2.91Å; Q330-S333 WeakPolarHBondContact CA-OG 3.38Å; Q330-S333 PolarHBondContact O-N 2.91Å; Q330-S333 PolarHBondContact O-OG 2.95Å; S333-K335 VanDerWaalsContact C-N 3.31Å; S333-K335 PolarHBondContact O-N 2.99Å; S333-S336 WeakPolarHBondContact CA-OG 3.45Å; S333-S336 PolarHBondContact O-N 3.09Å; S333-S336 PolarHBondContact O-OG 2.65Å; S333-E337 PolarHBondContact O-N 3.43Å |
| 334 | S | 95.4 | Very high | 96.2 | Very high | 60 Ų | 60 | 92.3 Ų | 92.3 | 42% | 0.42 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -60.5 | -40.2 | 172.8 | -178.3 | 0 | 0 | 0 | 0 | 111.8 | Q330 S336 E337 V338 | Q330-S334 WeakPolarHBondContact O-CB 3.31Å; Q330-S334 PolarHBondContact O-N 3.48Å; S334-S336 PolarHBondContact O-N 3.21Å; S334-E337 PolarHBondContact O-N 2.92Å; S334-V338 WeakPolarHBondContact O-CB 3.32Å; S334-V338 WeakPolarHBondContact O-CG2 3.24Å; S334-V338 PolarHBondContact O-N 3.36Å |
| 335 | K | 97.3 | Very high | 96.1 | Very high | 128 Ų | 128 | 92.4 Ų | 92.4 | 56% | 0.557 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -62.7 | -41.6 | 174.4 | -177.6 | -178.4 | 176.2 | -172.9 | 0 | 112.2 | L331 Q332 S333 T339 | L331-K335 WeakPolarHBondContact O-CB 3.42Å; L331-K335 PolarHBondContact O-N 3.25Å; Q332-K335 WeakPolarHBondContact O-CB 3.29Å; Q332-K335 PolarHBondContact O-N 3.4Å; S333-K335 VanDerWaalsContact C-N 3.31Å; S333-K335 PolarHBondContact O-N 2.99Å; K335-T339 WeakPolarHBondContact O-CG2 3.46Å; K335-T339 PolarHBondContact O-N 2.92Å |
| 336 | S | 96.4 | Very high | 96 | Very high | 56 Ų | 56 | 95.9 Ų | 95.9 | 39% | 0.392 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.2 | -47.6 | 174.6 | 42 | 0 | 0 | 0 | 0 | 111.8 | Q332 S333 S334 V338 T339 D340 | Q332-S336 PolarHBondContact O-N 3.09Å; Q332-S336 PolarHBondContact O-OG 3.16Å; S333-S336 WeakPolarHBondContact CA-OG 3.45Å; S333-S336 PolarHBondContact O-N 3.09Å; S333-S336 PolarHBondContact O-OG 2.65Å; S334-S336 PolarHBondContact O-N 3.21Å; S336-V338 VanDerWaalsContact C-N 3.33Å; S336-V338 PolarHBondContact O-N 3.48Å; S336-T339 CarbonylContact O-C 3.59Å; S336-T339 WeakPolarHBondContact O-CA 3.48Å; S336-T339 PolarHBondContact O-N 3.44Å; S336-T339 PolarHBondContact O-OG1 2.88Å; S336-D340 PolarHBondContact O-N 2.94Å |
| 337 | E | 96.5 | Very high | 95.8 | Very high | 121 Ų | 121 | 98.5 Ų | 98.5 | 57% | 0.565 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -56.9 | -45.4 | 177.5 | -176.1 | 179.2 | -166.7 | 0 | 0 | 111.5 | S333 S334 T339 D340 L341 | S333-E337 PolarHBondContact O-N 3.43Å; S334-E337 PolarHBondContact O-N 2.92Å; E337-T339 VanDerWaalsContact C-N 3.3Å; E337-T339 PolarHBondContact O-N 3.26Å; E337-D340 PolarHBondContact O-N 3.32Å; E337-L341 HydrophobicContact CG-CD1 4.11Å; E337-L341 HydrophobicContact CG-CG 4.47Å; E337-L341 WeakPolarHBondContact O-CB 3.47Å; E337-L341 WeakPolarHBondContact O-CG 3.44Å; E337-L341 PolarHBondContact O-N 3.24Å |
| 338 | V | 96.9 | Very high | 95.4 | Very high | 67 Ų | 67 | 99 Ų | 99 | 41% | 0.406 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.7 | -35.7 | 174.2 | 169.9 | 0 | 0 | 0 | 0 | 112.2 | S334 S336 K342 | S334-V338 WeakPolarHBondContact O-CB 3.32Å; S334-V338 WeakPolarHBondContact O-CG2 3.24Å; S334-V338 PolarHBondContact O-N 3.36Å; S336-V338 VanDerWaalsContact C-N 3.33Å; S336-V338 PolarHBondContact O-N 3.48Å; V338-K342 HydrophobicContact CG1-CD 4.26Å; V338-K342 WeakPolarHBondContact O-CB 3.32Å; V338-K342 VanDerWaalsContact O-CG 3.22Å; V338-K342 WeakPolarHBondContact O-CG 3.4Å; V338-K342 PolarHBondContact O-N 3.27Å; V338-K342 VanDerWaalsContact O-N 3.15Å |
| 339 | T | 96.7 | Very high | 95.1 | Very high | 52 Ų | 52 | 100.2 Ų | 100.2 | 32% | 0.319 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -71.6 | -35.1 | 174.3 | 60.7 | 0 | 0 | 0 | 0 | 113 | K335 S336 E337 K342 R343 | K335-T339 WeakPolarHBondContact O-CG2 3.46Å; K335-T339 PolarHBondContact O-N 2.92Å; S336-T339 CarbonylContact O-C 3.59Å; S336-T339 WeakPolarHBondContact O-CA 3.48Å; S336-T339 PolarHBondContact O-N 3.44Å; S336-T339 PolarHBondContact O-OG1 2.88Å; E337-T339 VanDerWaalsContact C-N 3.3Å; E337-T339 PolarHBondContact O-N 3.26Å; T339-K342 PolarHBondContact O-N 2.95Å; T339-R343 WeakPolarHBondContact O-CG 3.47Å; T339-R343 PolarHBondContact O-N 3.37Å; T339-R343 PolarHBondContact OG1-NH1 2.93Å; T339-R343 VanDerWaalsContact OG1-NH1 3.13Å |
| 340 | D | 96.4 | Very high | 95 | Very high | 85 Ų | 85 | 99.1 Ų | 99.1 | 46% | 0.455 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -75.9 | -38.3 | -179.7 | -68.1 | -31.1 | 0 | 0 | 0 | 112.1 | S336 E337 K342 R343 M344 | S336-D340 PolarHBondContact O-N 2.94Å; E337-D340 PolarHBondContact O-N 3.32Å; D340-K342 VanDerWaalsContact C-N 3.33Å; D340-K342 PolarHBondContact O-N 2.86Å; D340-R343 PolarHBondContact O-N 2.93Å; D340-R343 IonicContact OD1-CZ 2.67Å; D340-R343 IonicContact OD1-NH1 2.89Å; D340-R343 PolarHBondContact OD1-NH1 3.2Å; D340-M344 WeakPolarHBondContact O-CB 3.2Å; D340-M344 PolarHBondContact O-N 2.99Å |
| 341 | L | 95.1 | Very high | 94.9 | Very high | 92 Ų | 92 | 98 Ų | 98 | 48% | 0.482 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.1 | -40.8 | 168.6 | -69.4 | 172.3 | 0 | 0 | 0 | 111.4 | E337 M344 V345 | E337-L341 HydrophobicContact CG-CD1 4.11Å; E337-L341 HydrophobicContact CG-CG 4.47Å; E337-L341 WeakPolarHBondContact O-CB 3.47Å; E337-L341 WeakPolarHBondContact O-CG 3.44Å; E337-L341 PolarHBondContact O-N 3.24Å; L341-M344 PolarHBondContact O-N 2.9Å; L341-V345 WeakPolarHBondContact O-CG2 3.37Å; L341-V345 PolarHBondContact O-N 3.39Å |
| 342 | K | 93 | Very high | 94.5 | Very high | 132 Ų | 132 | 97.2 Ų | 97.2 | 57% | 0.574 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -63 | -41.8 | 174.2 | -77.7 | 173.8 | -179.5 | -177.5 | 0 | 112.6 | V338 T339 D340 V345 Q346 | V338-K342 HydrophobicContact CG1-CD 4.26Å; V338-K342 WeakPolarHBondContact O-CB 3.32Å; V338-K342 VanDerWaalsContact O-CG 3.22Å; V338-K342 WeakPolarHBondContact O-CG 3.4Å; V338-K342 PolarHBondContact O-N 3.27Å; V338-K342 VanDerWaalsContact O-N 3.15Å; T339-K342 PolarHBondContact O-N 2.95Å; D340-K342 VanDerWaalsContact C-N 3.33Å; D340-K342 PolarHBondContact O-N 2.86Å; K342-V345 PolarHBondContact O-N 2.93Å; K342-Q346 WeakPolarHBondContact O-CG 3.4Å; K342-Q346 PolarHBondContact O-N 3.36Å |
| 343 | R | 94.8 | Very high | 94.3 | Very high | 128 Ų | 128 | 97.2 Ų | 97.2 | 48% | 0.483 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.2 | -42.9 | 172.9 | -71.6 | 171 | -176 | 113.2 | 6.4 | 111.5 | T339 D340 Q346 N347 | T339-R343 WeakPolarHBondContact O-CG 3.47Å; T339-R343 PolarHBondContact O-N 3.37Å; T339-R343 PolarHBondContact OG1-NH1 2.93Å; T339-R343 VanDerWaalsContact OG1-NH1 3.13Å; D340-R343 PolarHBondContact O-N 2.93Å; D340-R343 IonicContact OD1-CZ 2.67Å; D340-R343 IonicContact OD1-NH1 2.89Å; D340-R343 PolarHBondContact OD1-NH1 3.2Å; R343-Q346 PolarHBondContact O-N 3.38Å; R343-N347 WeakPolarHBondContact O-CB 3.4Å; R343-N347 PolarHBondContact O-N 2.89Å; R343-N347 PolarHBondContact O-ND2 3.35Å; R343-N347 PolarHBondContact O-OD1 3.45Å |
| 344 | M | 95.3 | Very high | 94.1 | Very high | 113 Ų | 113 | 96.4 Ų | 96.4 | 56% | 0.557 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -62.8 | -44.6 | 178 | -173.4 | 179.3 | -68 | 0 | 0 | 111.8 | D340 L341 N347 L348 | D340-M344 WeakPolarHBondContact O-CB 3.2Å; D340-M344 PolarHBondContact O-N 2.99Å; L341-M344 PolarHBondContact O-N 2.9Å; M344-N347 PolarHBondContact O-N 2.94Å; M344-L348 HydrophobicContact CG-CD1 4.14Å; M344-L348 WeakPolarHBondContact O-CB 3.47Å; M344-L348 WeakPolarHBondContact O-CG 3.04Å; M344-L348 PolarHBondContact O-N 3.47Å |
| 345 | V | 94.2 | Very high | 94 | Very high | 97 Ų | 97 | 98.3 Ų | 98.3 | 59% | 0.588 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -60.9 | -44.3 | 174.4 | 170.2 | 0 | 0 | 0 | 0 | 111.2 | L341 K342 N347 L348 E349 | L341-V345 WeakPolarHBondContact O-CG2 3.37Å; L341-V345 PolarHBondContact O-N 3.39Å; K342-V345 PolarHBondContact O-N 2.93Å; V345-N347 PolarHBondContact O-N 3.21Å; V345-L348 PolarHBondContact O-N 2.94Å; V345-E349 WeakPolarHBondContact O-CB 3.49Å; V345-E349 PolarHBondContact O-N 3.49Å |
| 346 | Q | 93.9 | Very high | 93.6 | Very high | 126 Ų | 126 | 96.3 Ų | 96.3 | 59% | 0.589 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -61.8 | -41.8 | 175.8 | -74.4 | 174.9 | -24.5 | 0 | 0 | 112.5 | K342 R343 E349 I350 | K342-Q346 WeakPolarHBondContact O-CG 3.4Å; K342-Q346 PolarHBondContact O-N 3.36Å; R343-Q346 PolarHBondContact O-N 3.38Å; Q346-E349 PolarHBondContact O-N 2.87Å; Q346-I350 WeakPolarHBondContact O-CD1 3.48Å; Q346-I350 VanDerWaalsContact O-CG1 3.26Å; Q346-I350 WeakPolarHBondContact O-CG1 3.48Å; Q346-I350 PolarHBondContact O-N 3.2Å |
| 347 | N | 92.9 | Very high | 93.4 | Very high | 107 Ų | 107 | 96.7 Ų | 96.7 | 57% | 0.572 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -65.7 | -41.4 | 176.9 | -68.7 | -13.7 | 0 | 0 | 0 | 112 | R343 M344 V345 I350 E351 | R343-N347 WeakPolarHBondContact O-CB 3.4Å; R343-N347 PolarHBondContact O-N 2.89Å; R343-N347 PolarHBondContact O-ND2 3.35Å; R343-N347 PolarHBondContact O-OD1 3.45Å; M344-N347 PolarHBondContact O-N 2.94Å; V345-N347 PolarHBondContact O-N 3.21Å; N347-I350 PolarHBondContact O-N 2.91Å; N347-E351 PolarHBondContact O-N 3.41Å |
| 348 | L | 89.4 | Confident | 93.2 | Very high | 114 Ų | 114 | 96.1 Ų | 96.1 | 60% | 0.597 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -67.2 | -36.2 | 176.3 | -72.4 | 171.4 | 0 | 0 | 0 | 112.3 | M344 V345 E351 L352 | M344-L348 HydrophobicContact CG-CD1 4.14Å; M344-L348 WeakPolarHBondContact O-CB 3.47Å; M344-L348 WeakPolarHBondContact O-CG 3.04Å; M344-L348 PolarHBondContact O-N 3.47Å; V345-L348 PolarHBondContact O-N 2.94Å; L348-E351 PolarHBondContact O-N 2.96Å; L348-L352 WeakPolarHBondContact O-CB 3.46Å; L348-L352 PolarHBondContact O-N 3.09Å |
| 349 | E | 90.5 | Very high | 93 | Very high | 93 Ų | 93 | 98 Ų | 98 | 44% | 0.435 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.4 | -45.2 | 173 | -173.7 | 61.1 | -136.1 | 0 | 0 | 110.9 | V345 Q346 E351 L352 Q353 | V345-E349 WeakPolarHBondContact O-CB 3.49Å; V345-E349 PolarHBondContact O-N 3.49Å; Q346-E349 PolarHBondContact O-N 2.87Å; E349-E351 VanDerWaalsContact C-N 3.3Å; E349-E351 PolarHBondContact O-N 3.5Å; E349-L352 WeakPolarHBondContact O-CB 3.5Å; E349-L352 PolarHBondContact O-N 3.02Å; E349-Q353 WeakPolarHBondContact O-CG 3.24Å; E349-Q353 PolarHBondContact O-N 3.29Å; E349-Q353 PolarHBondContact OE1-NE2 3.14Å |
| 350 | I | 93.8 | Very high | 92.8 | Very high | 113 Ų | 113 | 99.1 Ų | 99.1 | 58% | 0.579 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60 | -41.2 | 175.7 | -69.2 | 163.1 | 0 | 0 | 0 | 111.1 | Q346 N347 Q353 S354 | Q346-I350 WeakPolarHBondContact O-CD1 3.48Å; Q346-I350 VanDerWaalsContact O-CG1 3.26Å; Q346-I350 WeakPolarHBondContact O-CG1 3.48Å; Q346-I350 PolarHBondContact O-N 3.2Å; N347-I350 PolarHBondContact O-N 2.91Å; I350-Q353 PolarHBondContact O-N 3.42Å; I350-S354 WeakPolarHBondContact O-CB 3.44Å; I350-S354 PolarHBondContact O-N 3.4Å |
| 351 | E | 94.6 | Very high | 92.7 | Very high | 97 Ų | 97 | 98.7 Ų | 98.7 | 45% | 0.453 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -67.9 | -38.1 | 175.8 | -172.3 | 58.5 | -159.7 | 0 | 0 | 112 | N347 L348 E349 Q353 S354 Q355 | N347-E351 PolarHBondContact O-N 3.41Å; L348-E351 PolarHBondContact O-N 2.96Å; E349-E351 VanDerWaalsContact C-N 3.3Å; E349-E351 PolarHBondContact O-N 3.5Å; E351-Q353 VanDerWaalsContact C-N 3.35Å; E351-Q353 PolarHBondContact O-N 3.41Å; E351-S354 PolarHBondContact O-N 2.98Å; E351-S354 PolarHBondContact O-OG 3.43Å; E351-S354 PolarHBondContact OE2-OG 2.88Å; E351-Q355 HydrophobicContact CG-CG 4.45Å; E351-Q355 WeakPolarHBondContact O-CB 3.5Å; E351-Q355 WeakPolarHBondContact O-CG 3.3Å; E351-Q355 PolarHBondContact O-N 3.41Å; E351-Q355 PolarHBondContact OE1-NE2 2.95Å |
| 352 | L | 87.6 | Confident | 92.7 | Very high | 92 Ų | 92 | 99.2 Ų | 99.2 | 48% | 0.482 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.2 | -45.5 | 172.4 | 178.8 | 61.9 | 0 | 0 | 0 | 111.3 | L348 E349 Q355 L356 | L348-L352 WeakPolarHBondContact O-CB 3.46Å; L348-L352 PolarHBondContact O-N 3.09Å; E349-L352 WeakPolarHBondContact O-CB 3.5Å; E349-L352 PolarHBondContact O-N 3.02Å; L352-Q355 PolarHBondContact O-N 3.31Å; L352-L356 HydrophobicContact CD1-CD1 4.32Å; L352-L356 HydrophobicContact CD1-CG 4.42Å; L352-L356 HydrophobicContact CG-CD1 4.16Å; L352-L356 WeakPolarHBondContact O-CB 3.34Å; L352-L356 VanDerWaalsContact O-CG 3.27Å; L352-L356 WeakPolarHBondContact O-CG 3.44Å; L352-L356 PolarHBondContact O-N 2.83Å |
| 353 | Q | 93.5 | Very high | 92.7 | Very high | 101 Ų | 101 | 97.8 Ų | 97.8 | 47% | 0.472 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -66.5 | -36.2 | 177.5 | -61.3 | -54.7 | -35.3 | 0 | 0 | 112.3 | E349 I350 E351 L356 A357 | E349-Q353 WeakPolarHBondContact O-CG 3.24Å; E349-Q353 PolarHBondContact O-N 3.29Å; E349-Q353 PolarHBondContact OE1-NE2 3.14Å; I350-Q353 PolarHBondContact O-N 3.42Å; E351-Q353 VanDerWaalsContact C-N 3.35Å; E351-Q353 PolarHBondContact O-N 3.41Å; Q353-L356 PolarHBondContact O-N 2.87Å; Q353-A357 WeakPolarHBondContact O-CB 3.41Å; Q353-A357 PolarHBondContact O-N 2.86Å |
| 354 | S | 92.4 | Very high | 92.6 | Very high | 51 Ų | 51 | 93.1 Ų | 93.1 | 36% | 0.357 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65.7 | -43.6 | 176.3 | 81.4 | 0 | 0 | 0 | 0 | 111.5 | I350 E351 A357 M358 | I350-S354 WeakPolarHBondContact O-CB 3.44Å; I350-S354 PolarHBondContact O-N 3.4Å; E351-S354 PolarHBondContact O-N 2.98Å; E351-S354 PolarHBondContact O-OG 3.43Å; E351-S354 PolarHBondContact OE2-OG 2.88Å; S354-A357 PolarHBondContact O-N 3.4Å; S354-M358 WeakPolarHBondContact O-CB 3.48Å; S354-M358 PolarHBondContact O-N 2.95Å |
| 355 | Q | 93.2 | Very high | 92.6 | Very high | 100 Ų | 100 | 90.5 Ų | 90.5 | 47% | 0.467 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -67.8 | -37.4 | 177.2 | -65.7 | -63.5 | -25.8 | 0 | 0 | 112.1 | E351 L352 M358 K359 | E351-Q355 HydrophobicContact CG-CG 4.45Å; E351-Q355 WeakPolarHBondContact O-CB 3.5Å; E351-Q355 WeakPolarHBondContact O-CG 3.3Å; E351-Q355 PolarHBondContact O-N 3.41Å; E351-Q355 PolarHBondContact OE1-NE2 2.95Å; L352-Q355 PolarHBondContact O-N 3.31Å; Q355-M358 PolarHBondContact O-N 2.96Å; Q355-K359 WeakPolarHBondContact O-CB 3.47Å; Q355-K359 PolarHBondContact O-N 3.34Å |
| 356 | L | 88.3 | Confident | 92.6 | Very high | 86 Ų | 86 | 90.2 Ų | 90.2 | 45% | 0.45 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64.7 | -41.4 | 172.9 | -73.9 | 171.9 | 0 | 0 | 0 | 112.1 | L352 Q353 K359 S360 | L352-L356 HydrophobicContact CD1-CD1 4.32Å; L352-L356 HydrophobicContact CD1-CG 4.42Å; L352-L356 HydrophobicContact CG-CD1 4.16Å; L352-L356 WeakPolarHBondContact O-CB 3.34Å; L352-L356 VanDerWaalsContact O-CG 3.27Å; L352-L356 WeakPolarHBondContact O-CG 3.44Å; L352-L356 PolarHBondContact O-N 2.83Å; Q353-L356 PolarHBondContact O-N 2.87Å; L356-K359 PolarHBondContact O-N 3.43Å; L356-S360 WeakPolarHBondContact O-CB 3.37Å; L356-S360 PolarHBondContact O-N 3.48Å |
| 357 | A | 92 | Very high | 92.6 | Very high | 63 Ų | 63 | 87 Ų | 87 | 52% | 0.521 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -64.4 | -42.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q353 S354 S360 S361 | Q353-A357 WeakPolarHBondContact O-CB 3.41Å; Q353-A357 PolarHBondContact O-N 2.86Å; S354-A357 PolarHBondContact O-N 3.4Å; A357-S360 PolarHBondContact O-N 3.1Å; A357-S361 PolarHBondContact O-N 3.17Å |
| 358 | M | 92 | Very high | 92.7 | Very high | 109 Ų | 109 | 89 Ų | 89 | 54% | 0.537 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.4 | -45.8 | 174.8 | -176.9 | 173.9 | 177.8 | 0 | 0 | 111.7 | S354 Q355 S360 S361 L362 | S354-M358 WeakPolarHBondContact O-CB 3.48Å; S354-M358 PolarHBondContact O-N 2.95Å; Q355-M358 PolarHBondContact O-N 2.96Å; M358-S360 PolarHBondContact O-N 3.16Å; M358-S361 PolarHBondContact O-N 2.96Å; M358-L362 HydrophobicContact CE-CD1 4.23Å; M358-L362 HydrophobicContact CG-CD1 4.26Å; M358-L362 WeakPolarHBondContact O-CG 3.42Å; M358-L362 PolarHBondContact O-N 3.18Å |
| 359 | K | 94 | Very high | 93 | Very high | 106 Ų | 106 | 87 Ų | 87 | 46% | 0.461 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -56.9 | -50.4 | 174.5 | -178.5 | -175.2 | 177.5 | -82.4 | 0 | 111.2 | Q355 L356 S361 L362 E363 | Q355-K359 WeakPolarHBondContact O-CB 3.47Å; Q355-K359 PolarHBondContact O-N 3.34Å; L356-K359 PolarHBondContact O-N 3.43Å; K359-S361 VanDerWaalsContact C-N 3.29Å; K359-S361 PolarHBondContact O-N 3.21Å; K359-L362 PolarHBondContact O-N 2.91Å; K359-L362 VanDerWaalsContact O-N 3.15Å; K359-E363 WeakPolarHBondContact CE-OE1 3.49Å; K359-E363 HydrophobicContact CG-CG 4.43Å; K359-E363 IonicContact NZ-OE1 3.96Å; K359-E363 PolarHBondContact NZ-OE1 2.92Å; K359-E363 IonicContact NZ-OE2 2.75Å; K359-E363 PolarHBondContact NZ-OE2 3.28Å; K359-E363 WeakPolarHBondContact O-CG 3.4Å; K359-E363 PolarHBondContact O-N 2.86Å |
| 360 | S | 92.3 | Very high | 93.2 | Very high | 77 Ų | 77 | 88.3 Ų | 88.3 | 54% | 0.538 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.7 | -36.5 | 179.8 | -174.9 | 0 | 0 | 0 | 0 | 112.5 | L356 A357 M358 G364 | L356-S360 WeakPolarHBondContact O-CB 3.37Å; L356-S360 PolarHBondContact O-N 3.48Å; A357-S360 PolarHBondContact O-N 3.1Å; M358-S360 PolarHBondContact O-N 3.16Å; S360-G364 PolarHBondContact O-N 3.09Å |
| 361 | S | 93.9 | Very high | 93.2 | Very high | 75 Ų | 75 | 84.5 Ų | 84.5 | 52% | 0.524 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -65.4 | -42.7 | 174.6 | -173 | 0 | 0 | 0 | 0 | 111.7 | A357 M358 K359 G364 S365 | A357-S361 PolarHBondContact O-N 3.17Å; M358-S361 PolarHBondContact O-N 2.96Å; K359-S361 VanDerWaalsContact C-N 3.29Å; K359-S361 PolarHBondContact O-N 3.21Å; S361-G364 PolarHBondContact O-N 2.86Å; S361-S365 PolarHBondContact O-N 2.94Å; S361-S365 PolarHBondContact O-OG 3.41Å; S361-S365 VanDerWaalsContact O-OG 3.07Å |
| 362 | L | 94.5 | Very high | 93.4 | Very high | 103 Ų | 103 | 81.3 Ų | 81.3 | 54% | 0.539 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -68.8 | -39.7 | 178.2 | -69.5 | 172.3 | 0 | 0 | 0 | 112.3 | M358 K359 G364 S365 L366 | M358-L362 HydrophobicContact CE-CD1 4.23Å; M358-L362 HydrophobicContact CG-CD1 4.26Å; M358-L362 WeakPolarHBondContact O-CG 3.42Å; M358-L362 PolarHBondContact O-N 3.18Å; K359-L362 PolarHBondContact O-N 2.91Å; K359-L362 VanDerWaalsContact O-N 3.15Å; L362-G364 VanDerWaalsContact C-N 3.34Å; L362-S365 PolarHBondContact O-N 2.86Å; L362-L366 WeakPolarHBondContact O-CB 3.42Å; L362-L366 PolarHBondContact O-N 2.88Å |
| 363 | E | 93.6 | Very high | 93.8 | Very high | 102 Ų | 102 | 84.6 Ų | 84.6 | 48% | 0.477 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -64.4 | -38.8 | 173.7 | -71.6 | 176.4 | 142.9 | 0 | 0 | 111.5 | K359 L366 A367 | K359-E363 WeakPolarHBondContact CE-OE1 3.49Å; K359-E363 HydrophobicContact CG-CG 4.43Å; K359-E363 IonicContact NZ-OE1 3.96Å; K359-E363 PolarHBondContact NZ-OE1 2.92Å; K359-E363 IonicContact NZ-OE2 2.75Å; K359-E363 PolarHBondContact NZ-OE2 3.28Å; K359-E363 WeakPolarHBondContact O-CG 3.4Å; K359-E363 PolarHBondContact O-N 2.86Å; E363-L366 PolarHBondContact O-N 3.4Å; E363-A367 WeakPolarHBondContact O-CB 3.47Å; E363-A367 PolarHBondContact O-N 2.75Å |
| 364 | G | 93.4 | Very high | 94 | Very high | 31 Ų | 31 | 83.8 Ų | 83.8 | 32% | 0.32 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -62.2 | -50.4 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | S360 S361 L362 L366 A367 E368 | S360-G364 PolarHBondContact O-N 3.09Å; S361-G364 PolarHBondContact O-N 2.86Å; L362-G364 VanDerWaalsContact C-N 3.34Å; G364-L366 VanDerWaalsContact C-N 3.3Å; G364-L366 PolarHBondContact O-N 2.93Å; G364-A367 PolarHBondContact O-N 2.92Å; G364-E368 WeakPolarHBondContact O-CG 3.23Å; G364-E368 PolarHBondContact O-N 3.11Å |
| 365 | S | 94.7 | Very high | 94.2 | Very high | 58 Ų | 58 | 85.6 Ų | 85.6 | 41% | 0.406 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60 | -38.6 | 176.2 | -60.3 | 0 | 0 | 0 | 0 | 112.6 | S361 L362 E368 T369 | S361-S365 PolarHBondContact O-N 2.94Å; S361-S365 PolarHBondContact O-OG 3.41Å; S361-S365 VanDerWaalsContact O-OG 3.07Å; L362-S365 PolarHBondContact O-N 2.86Å; S365-E368 PolarHBondContact O-N 2.86Å; S365-T369 WeakPolarHBondContact O-CG2 3.47Å; S365-T369 PolarHBondContact O-N 3.25Å; S365-T369 PolarHBondContact O-OG1 2.83Å |
| 366 | L | 94.3 | Very high | 94.4 | Very high | 91 Ų | 91 | 86.2 Ų | 86.2 | 48% | 0.476 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.6 | -52.2 | 174.5 | -179.8 | 61.9 | 0 | 0 | 0 | 110.6 | L362 E363 G364 E368 T369 E370 | L362-L366 WeakPolarHBondContact O-CB 3.42Å; L362-L366 PolarHBondContact O-N 2.88Å; E363-L366 PolarHBondContact O-N 3.4Å; G364-L366 VanDerWaalsContact C-N 3.3Å; G364-L366 PolarHBondContact O-N 2.93Å; L366-E368 VanDerWaalsContact C-N 3.31Å; L366-E368 PolarHBondContact O-N 3.38Å; L366-T369 PolarHBondContact O-N 3.26Å; L366-T369 VanDerWaalsContact O-N 3.08Å; L366-T369 PolarHBondContact O-OG1 2.95Å; L366-E370 HydrophobicContact CD1-CG 4.18Å; L366-E370 HydrophobicContact CG-CG 4.4Å; L366-E370 WeakPolarHBondContact O-CG 3.27Å; L366-E370 PolarHBondContact O-N 2.58Å |
| 367 | A | 93.1 | Very high | 94.8 | Very high | 58 Ų | 58 | 88 Ų | 88 | 48% | 0.479 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.4 | -37.2 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113 | E363 G364 G371 | E363-A367 WeakPolarHBondContact O-CB 3.47Å; E363-A367 PolarHBondContact O-N 2.75Å; G364-A367 PolarHBondContact O-N 2.92Å; A367-G371 PolarHBondContact O-N 3.29Å |
| 368 | E | 96.2 | Very high | 95.1 | Very high | 149 Ų | 149 | 87.9 Ų | 87.9 | 70% | 0.696 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.2 | -44.6 | 172.5 | -75.2 | 177.5 | -173.7 | 0 | 0 | 111.9 | G364 S365 L366 G372 | G364-E368 WeakPolarHBondContact O-CG 3.23Å; G364-E368 PolarHBondContact O-N 3.11Å; S365-E368 PolarHBondContact O-N 2.86Å; L366-E368 VanDerWaalsContact C-N 3.31Å; L366-E368 PolarHBondContact O-N 3.38Å; E368-G372 PolarHBondContact O-N 3.11Å |
| 369 | T | 94.8 | Very high | 95.4 | Very high | 73 Ų | 73 | 89.2 Ų | 89.2 | 45% | 0.448 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -66.8 | -43.8 | 177 | 59.8 | 0 | 0 | 0 | 0 | 112.5 | S365 L366 G372 Y373 | S365-T369 WeakPolarHBondContact O-CG2 3.47Å; S365-T369 PolarHBondContact O-N 3.25Å; S365-T369 PolarHBondContact O-OG1 2.83Å; L366-T369 PolarHBondContact O-N 3.26Å; L366-T369 VanDerWaalsContact O-N 3.08Å; L366-T369 PolarHBondContact O-OG1 2.95Å; T369-G372 PolarHBondContact O-N 2.71Å; T369-Y373 WeakPolarHBondContact O-CD2 3.43Å; T369-Y373 PolarHBondContact O-N 3.44Å |
| 370 | E | 95.3 | Very high | 95.6 | Very high | 119 Ų | 119 | 87.7 Ų | 87.7 | 56% | 0.556 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -62.2 | -43.5 | 176.4 | -70.6 | -178.3 | 162.4 | 0 | 0 | 111.5 | L366 Y373 C374 | L366-E370 HydrophobicContact CD1-CG 4.18Å; L366-E370 HydrophobicContact CG-CG 4.4Å; L366-E370 WeakPolarHBondContact O-CG 3.27Å; L366-E370 PolarHBondContact O-N 2.58Å; E370-Y373 PolarHBondContact O-N 3.1Å; E370-C374 WeakPolarHBondContact O-CB 3.14Å; E370-C374 PolarHBondContact O-N 3.34Å |
| 371 | G | 94.5 | Very high | 95.8 | Very high | 34 Ų | 34 | 89.6 Ų | 89.6 | 35% | 0.351 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.2 | -42.6 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | A367 C374 C375 | A367-G371 PolarHBondContact O-N 3.29Å; G371-C374 PolarHBondContact O-N 2.85Å; G371-C375 PolarHBondContact O-N 3.42Å; G371-C375 PolarHBondContact O-SG 2.98Å |
| 372 | G | 97.2 | Very high | 96 | Very high | 30 Ų | 30 | 92.4 Ų | 92.4 | 31% | 0.309 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -59.5 | -49.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | E368 T369 C374 C375 Q376 | E368-G372 PolarHBondContact O-N 3.11Å; T369-G372 PolarHBondContact O-N 2.71Å; G372-C374 PolarHBondContact O-N 3.32Å; G372-C375 PolarHBondContact O-N 2.87Å; G372-Q376 WeakPolarHBondContact O-CG 3.24Å; G372-Q376 PolarHBondContact O-N 3.03Å |
| 373 | Y | 96.8 | Very high | 96.2 | Very high | 160 Ų | 160 | 92.4 Ų | 92.4 | 63% | 0.627 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -64.6 | -37.5 | 175.9 | -72.1 | -58.6 | 0 | 0 | 0 | 112.6 | T369 E370 Q376 L377 | T369-Y373 WeakPolarHBondContact O-CD2 3.43Å; T369-Y373 PolarHBondContact O-N 3.44Å; E370-Y373 PolarHBondContact O-N 3.1Å; Y373-Q376 PolarHBondContact O-N 2.94Å; Y373-L377 WeakPolarHBondContact O-CB 3.44Å; Y373-L377 PolarHBondContact O-N 2.93Å |
| 374 | C | 96.8 | Very high | 96.4 | Very high | 85 Ų | 85 | 90.9 Ų | 90.9 | 57% | 0.574 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -61.9 | -43.3 | 174.9 | -171.7 | 0 | 0 | 0 | 0 | 111.6 | E370 G371 G372 L377 S378 | E370-C374 WeakPolarHBondContact O-CB 3.14Å; E370-C374 PolarHBondContact O-N 3.34Å; G371-C374 PolarHBondContact O-N 2.85Å; G372-C374 PolarHBondContact O-N 3.32Å; C374-L377 PolarHBondContact O-N 3.33Å; C374-S378 WeakPolarHBondContact O-CB 3.39Å; C374-S378 PolarHBondContact O-N 3.35Å |
| 375 | C | 96.6 | Very high | 96.6 | Very high | 88 Ų | 88 | 90.8 Ų | 90.8 | 60% | 0.595 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -64.1 | -44.2 | 175.5 | -66.3 | 0 | 0 | 0 | 0 | 112.1 | G371 G372 S378 Q379 | G371-C375 PolarHBondContact O-N 3.42Å; G371-C375 PolarHBondContact O-SG 2.98Å; G372-C375 PolarHBondContact O-N 2.87Å; C375-S378 PolarHBondContact O-N 3.42Å; C375-Q379 PolarHBondContact O-N 3.16Å |
| 376 | Q | 97.9 | Very high | 96.8 | Very high | 113 Ų | 113 | 90.2 Ų | 90.2 | 53% | 0.528 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.3 | -45.1 | 175.6 | -71.4 | 173.6 | 14.4 | 0 | 0 | 111.8 | G372 Y373 S378 Q379 V380 | G372-Q376 WeakPolarHBondContact O-CG 3.24Å; G372-Q376 PolarHBondContact O-N 3.03Å; Y373-Q376 PolarHBondContact O-N 2.94Å; Q376-S378 VanDerWaalsContact C-N 3.33Å; Q376-S378 PolarHBondContact O-N 2.83Å; Q376-Q379 PolarHBondContact O-N 2.98Å; Q376-V380 WeakPolarHBondContact O-CG2 3.39Å; Q376-V380 PolarHBondContact O-N 2.78Å |
| 377 | L | 97.8 | Very high | 97 | Very high | 124 Ų | 124 | 89.9 Ų | 89.9 | 65% | 0.649 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -62.9 | -40.4 | 177.3 | -173.7 | 65.8 | 0 | 0 | 0 | 111.5 | Y373 C374 V380 Q381 | Y373-L377 WeakPolarHBondContact O-CB 3.44Å; Y373-L377 PolarHBondContact O-N 2.93Å; C374-L377 PolarHBondContact O-N 3.33Å; L377-V380 PolarHBondContact O-N 3.13Å; L377-Q381 WeakPolarHBondContact O-CB 3.41Å; L377-Q381 PolarHBondContact O-N 3.44Å |
| 378 | S | 97.4 | Very high | 97.2 | Very high | 60 Ų | 60 | 92.4 Ų | 92.4 | 42% | 0.42 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62 | -44 | 174.3 | -168.7 | 0 | 0 | 0 | 0 | 112 | C374 C375 Q376 Q381 Q382 | C374-S378 WeakPolarHBondContact O-CB 3.39Å; C374-S378 PolarHBondContact O-N 3.35Å; C375-S378 PolarHBondContact O-N 3.42Å; Q376-S378 VanDerWaalsContact C-N 3.33Å; Q376-S378 PolarHBondContact O-N 2.83Å; S378-Q381 PolarHBondContact O-N 3.36Å; S378-Q382 WeakPolarHBondContact O-CG 3.28Å; S378-Q382 PolarHBondContact O-N 3.32Å |
| 379 | Q | 98.3 | Very high | 97.3 | Very high | 137 Ų | 137 | 92 Ų | 92 | 64% | 0.64 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -62.9 | -43.4 | 176.2 | -179.3 | 176.7 | 74.1 | 0 | 0 | 112.2 | C375 Q376 Q382 L383 | C375-Q379 PolarHBondContact O-N 3.16Å; Q376-Q379 PolarHBondContact O-N 2.98Å; Q379-Q382 PolarHBondContact O-N 3.13Å; Q379-L383 PolarHBondContact O-N 3.28Å |
| 380 | V | 97.6 | Very high | 97.4 | Very high | 75 Ų | 75 | 94.2 Ų | 94.2 | 46% | 0.455 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64 | -41.2 | 175.3 | 172 | 0 | 0 | 0 | 0 | 111 | Q376 L377 Q382 L383 I384 | Q376-V380 WeakPolarHBondContact O-CG2 3.39Å; Q376-V380 PolarHBondContact O-N 2.78Å; L377-V380 PolarHBondContact O-N 3.13Å; V380-Q382 PolarHBondContact O-N 3.46Å; V380-L383 PolarHBondContact O-N 3.29Å; V380-I384 HydrophobicContact CG1-CD1 3.86Å; V380-I384 HydrophobicContact CG1-CG1 4.44Å; V380-I384 VanDerWaalsContact O-CG1 3.31Å; V380-I384 WeakPolarHBondContact O-CG1 3.47Å; V380-I384 PolarHBondContact O-N 3.3Å |
| 381 | Q | 97.5 | Very high | 97.6 | Very high | 117 Ų | 117 | 93.5 Ų | 93.5 | 55% | 0.547 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.3 | -37.5 | 176.8 | -173.8 | 60.4 | 62.7 | 0 | 0 | 112.6 | L377 S378 G385 | L377-Q381 WeakPolarHBondContact O-CB 3.41Å; L377-Q381 PolarHBondContact O-N 3.44Å; S378-Q381 PolarHBondContact O-N 3.36Å; Q381-G385 PolarHBondContact O-N 3.17Å |
| 382 | Q | 97.9 | Very high | 97.7 | Very high | 134 Ų | 134 | 98.5 Ų | 98.5 | 63% | 0.626 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -64.6 | -44 | 172.8 | -72.7 | 172.3 | 8.6 | 0 | 0 | 111.6 | S378 Q379 V380 G385 S386 | S378-Q382 WeakPolarHBondContact O-CG 3.28Å; S378-Q382 PolarHBondContact O-N 3.32Å; Q379-Q382 PolarHBondContact O-N 3.13Å; V380-Q382 PolarHBondContact O-N 3.46Å; Q382-G385 PolarHBondContact O-N 3.43Å; Q382-S386 PolarHBondContact O-N 3.22Å |
| 383 | L | 98.4 | Very high | 97.8 | Very high | 102 Ų | 102 | 102.1 Ų | 102.1 | 53% | 0.534 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.3 | -46.3 | 176.4 | 179.4 | 61.5 | 0 | 0 | 0 | 111.3 | Q379 V380 G385 S386 L387 | Q379-L383 PolarHBondContact O-N 3.28Å; V380-L383 PolarHBondContact O-N 3.29Å; L383-G385 PolarHBondContact O-N 3.4Å; L383-S386 PolarHBondContact O-N 3.03Å; L383-S386 PolarHBondContact O-OG 3.45Å; L383-L387 HydrophobicContact CD1-CD1 4.27Å; L383-L387 HydrophobicContact CD1-CG 4.4Å; L383-L387 HydrophobicContact CG-CD1 4.16Å; L383-L387 WeakPolarHBondContact O-CG 3.2Å; L383-L387 PolarHBondContact O-N 3.37Å |
| 384 | I | 97.7 | Very high | 97.8 | Very high | 71 Ų | 71 | 99.2 Ų | 99.2 | 36% | 0.364 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -56.5 | -50.7 | 175.1 | -69.5 | 165.6 | 0 | 0 | 0 | 110.3 | V380 S386 L387 E388 | V380-I384 HydrophobicContact CG1-CD1 3.86Å; V380-I384 HydrophobicContact CG1-CG1 4.44Å; V380-I384 VanDerWaalsContact O-CG1 3.31Å; V380-I384 WeakPolarHBondContact O-CG1 3.47Å; V380-I384 PolarHBondContact O-N 3.3Å; I384-S386 VanDerWaalsContact C-N 3.31Å; I384-S386 PolarHBondContact O-N 3.48Å; I384-L387 PolarHBondContact O-N 3.47Å; I384-L387 VanDerWaalsContact O-N 3.09Å; I384-E388 HydrophobicContact CG2-CG 4.22Å; I384-E388 WeakPolarHBondContact O-CG 3.45Å; I384-E388 PolarHBondContact O-N 3.28Å |
| 385 | G | 98.2 | Very high | 97.9 | Very high | 29 Ų | 29 | 103 Ų | 103 | 30% | 0.299 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -57.3 | -41.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | Q381 Q382 L383 L387 E388 E389 | Q381-G385 PolarHBondContact O-N 3.17Å; Q382-G385 PolarHBondContact O-N 3.43Å; L383-G385 PolarHBondContact O-N 3.4Å; G385-L387 VanDerWaalsContact C-N 3.35Å; G385-L387 PolarHBondContact O-N 3.49Å; G385-E388 PolarHBondContact O-N 2.91Å; G385-E389 WeakPolarHBondContact O-CB 3.16Å; G385-E389 PolarHBondContact O-N 3.48Å |
| 386 | S | 98.3 | Very high | 97.9 | Very high | 46 Ų | 46 | 101.2 Ų | 101.2 | 32% | 0.322 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -66.3 | -33.8 | 176.9 | 74.4 | 0 | 0 | 0 | 0 | 113.5 | Q382 L383 I384 Q390 | Q382-S386 PolarHBondContact O-N 3.22Å; L383-S386 PolarHBondContact O-N 3.03Å; L383-S386 PolarHBondContact O-OG 3.45Å; I384-S386 VanDerWaalsContact C-N 3.31Å; I384-S386 PolarHBondContact O-N 3.48Å; S386-Q390 VanDerWaalsContact O-CG 3.28Å; S386-Q390 WeakPolarHBondContact O-CG 3.12Å; S386-Q390 PolarHBondContact O-N 2.75Å |
| 387 | L | 98.2 | Very high | 98 | Very high | 84 Ų | 84 | 98.7 Ų | 98.7 | 44% | 0.44 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -75.6 | -35.8 | 175.7 | -69.8 | 171.4 | 0 | 0 | 0 | 111.7 | L383 I384 G385 Q390 L391 | L383-L387 HydrophobicContact CD1-CD1 4.27Å; L383-L387 HydrophobicContact CD1-CG 4.4Å; L383-L387 HydrophobicContact CG-CD1 4.16Å; L383-L387 WeakPolarHBondContact O-CG 3.2Å; L383-L387 PolarHBondContact O-N 3.37Å; I384-L387 PolarHBondContact O-N 3.47Å; I384-L387 VanDerWaalsContact O-N 3.09Å; G385-L387 VanDerWaalsContact C-N 3.35Å; G385-L387 PolarHBondContact O-N 3.49Å; L387-Q390 PolarHBondContact O-N 3.26Å; L387-L391 WeakPolarHBondContact O-CB 3Å; L387-L391 VanDerWaalsContact O-CG 3.3Å; L387-L391 WeakPolarHBondContact O-CG 3.23Å; L387-L391 PolarHBondContact O-N 3.45Å |
| 388 | E | 97.8 | Very high | 97.9 | Very high | 110 Ų | 110 | 95.4 Ų | 95.4 | 51% | 0.514 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.9 | -42.6 | 172.8 | -72.7 | 178.8 | 154.7 | 0 | 0 | 111.5 | I384 G385 L391 Q392 | I384-E388 HydrophobicContact CG2-CG 4.22Å; I384-E388 WeakPolarHBondContact O-CG 3.45Å; I384-E388 PolarHBondContact O-N 3.28Å; G385-E388 PolarHBondContact O-N 2.91Å; E388-L391 PolarHBondContact O-N 3.33Å; E388-Q392 WeakPolarHBondContact O-CG 3.11Å; E388-Q392 PolarHBondContact O-N 3.06Å |
| 389 | E | 98 | Very high | 98 | Very high | 140 Ų | 140 | 99.2 Ų | 99.2 | 65% | 0.654 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62.7 | -46.6 | 173.9 | -174.9 | 174.9 | -161.6 | 0 | 0 | 111.7 | G385 L391 Q392 Q393 | G385-E389 WeakPolarHBondContact O-CB 3.16Å; G385-E389 PolarHBondContact O-N 3.48Å; E389-L391 VanDerWaalsContact C-N 3.33Å; E389-L391 PolarHBondContact O-N 3.01Å; E389-Q392 PolarHBondContact O-N 2.78Å; E389-Q393 PolarHBondContact O-N 2.9Å |
| 390 | Q | 98.1 | Very high | 97.9 | Very high | 120 Ų | 120 | 100.6 Ų | 100.6 | 56% | 0.561 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -60 | -40.7 | 174.3 | -74.7 | 175.7 | 11.6 | 0 | 0 | 112.5 | S386 L387 Q393 V394 | S386-Q390 VanDerWaalsContact O-CG 3.28Å; S386-Q390 WeakPolarHBondContact O-CG 3.12Å; S386-Q390 PolarHBondContact O-N 2.75Å; L387-Q390 PolarHBondContact O-N 3.26Å; Q390-Q393 PolarHBondContact O-N 3.06Å; Q390-V394 WeakPolarHBondContact O-CG2 3.48Å; Q390-V394 PolarHBondContact O-N 3.03Å |
| 391 | L | 97.9 | Very high | 97.9 | Very high | 104 Ų | 104 | 103.7 Ų | 103.7 | 55% | 0.545 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -66.7 | -37.2 | 175.7 | -77.8 | 170.7 | 0 | 0 | 0 | 112.5 | L387 E388 E389 R395 | L387-L391 WeakPolarHBondContact O-CB 3Å; L387-L391 VanDerWaalsContact O-CG 3.3Å; L387-L391 WeakPolarHBondContact O-CG 3.23Å; L387-L391 PolarHBondContact O-N 3.45Å; E388-L391 PolarHBondContact O-N 3.33Å; E389-L391 VanDerWaalsContact C-N 3.33Å; E389-L391 PolarHBondContact O-N 3.01Å; L391-R395 WeakPolarHBondContact O-CB 3.33Å; L391-R395 VanDerWaalsContact O-CG 3.27Å; L391-R395 WeakPolarHBondContact O-CG 3.11Å; L391-R395 PolarHBondContact O-N 2.79Å; L391-R395 VanDerWaalsContact O-N 3.09Å |
| 392 | Q | 97.7 | Very high | 97.9 | Very high | 139 Ų | 139 | 102.3 Ų | 102.3 | 65% | 0.65 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -65.3 | -44.7 | 173 | -76.3 | -176.9 | 1.3 | 0 | 0 | 111.4 | E388 E389 R395 A396 | E388-Q392 WeakPolarHBondContact O-CG 3.11Å; E388-Q392 PolarHBondContact O-N 3.06Å; E389-Q392 PolarHBondContact O-N 2.78Å; Q392-R395 PolarHBondContact O-N 3.11Å; Q392-A396 PolarHBondContact O-N 3.32Å |
| 393 | Q | 98.1 | Very high | 97.9 | Very high | 106 Ų | 106 | 98.5 Ų | 98.5 | 50% | 0.495 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -59.7 | -48.9 | 177.4 | -177.9 | 57.5 | 41.4 | 0 | 0 | 111.6 | E389 Q390 R395 A396 D397 | E389-Q393 PolarHBondContact O-N 2.9Å; Q390-Q393 PolarHBondContact O-N 3.06Å; Q393-R395 VanDerWaalsContact C-N 3.3Å; Q393-R395 PolarHBondContact O-N 2.93Å; Q393-A396 PolarHBondContact O-N 3.45Å; Q393-D397 VanDerWaalsContact NE2-CG 3.3Å; Q393-D397 PolarHBondContact NE2-OD1 3.41Å; Q393-D397 PolarHBondContact NE2-OD2 2.95Å; Q393-D397 PolarHBondContact O-N 3.3Å |
| 394 | V | 98.2 | Very high | 97.9 | Very high | 99 Ų | 99 | 97.5 Ų | 97.5 | 60% | 0.6 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -62.6 | -35.6 | 178 | 171.5 | 0 | 0 | 0 | 0 | 112.1 | Q390 A398 | Q390-V394 WeakPolarHBondContact O-CG2 3.48Å; Q390-V394 PolarHBondContact O-N 3.03Å; V394-A398 WeakPolarHBondContact O-CB 3.23Å; V394-A398 PolarHBondContact O-N 3.38Å |
| 395 | R | 98 | Very high | 97.9 | Very high | 166 Ų | 166 | 99.3 Ų | 99.3 | 63% | 0.626 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -65.8 | -47.1 | 173.5 | -76.3 | 174.3 | -177.8 | 179.5 | 3.5 | 111.8 | L391 Q392 Q393 D397 A398 E399 | L391-R395 WeakPolarHBondContact O-CB 3.33Å; L391-R395 VanDerWaalsContact O-CG 3.27Å; L391-R395 WeakPolarHBondContact O-CG 3.11Å; L391-R395 PolarHBondContact O-N 2.79Å; L391-R395 VanDerWaalsContact O-N 3.09Å; Q392-R395 PolarHBondContact O-N 3.11Å; Q393-R395 VanDerWaalsContact C-N 3.3Å; Q393-R395 PolarHBondContact O-N 2.93Å; R395-D397 VanDerWaalsContact C-N 3.32Å; R395-D397 PolarHBondContact O-N 3.01Å; R395-A398 PolarHBondContact O-N 2.89Å; R395-E399 WeakPolarHBondContact O-CG 3.48Å; R395-E399 PolarHBondContact O-N 2.81Å |
| 396 | A | 97.9 | Very high | 97.8 | Very high | 49 Ų | 49 | 103.4 Ų | 103.4 | 41% | 0.405 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.3 | -40.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112 | Q392 Q393 E399 R400 | Q392-A396 PolarHBondContact O-N 3.32Å; Q393-A396 PolarHBondContact O-N 3.45Å; A396-E399 PolarHBondContact O-N 2.98Å; A396-R400 WeakPolarHBondContact O-CB 3.3Å; A396-R400 PolarHBondContact O-N 3.15Å |
| 397 | D | 98.1 | Very high | 97.8 | Very high | 61 Ų | 61 | 110.1 Ų | 110.1 | 33% | 0.326 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -67.1 | -38.2 | 175.3 | -74.1 | -36.4 | 0 | 0 | 0 | 112.2 | Q393 R395 R400 Q401 | Q393-D397 VanDerWaalsContact NE2-CG 3.3Å; Q393-D397 PolarHBondContact NE2-OD1 3.41Å; Q393-D397 PolarHBondContact NE2-OD2 2.95Å; Q393-D397 PolarHBondContact O-N 3.3Å; R395-D397 VanDerWaalsContact C-N 3.32Å; R395-D397 PolarHBondContact O-N 3.01Å; D397-R400 PolarHBondContact O-N 3.17Å; D397-Q401 WeakPolarHBondContact O-CB 3.19Å; D397-Q401 VanDerWaalsContact O-CG 3.31Å; D397-Q401 WeakPolarHBondContact O-CG 3.27Å; D397-Q401 PolarHBondContact O-N 3.35Å |
| 398 | A | 97.5 | Very high | 97.7 | Very high | 55 Ų | 55 | 111.6 Ų | 111.6 | 46% | 0.455 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -67.6 | -41.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | V394 R395 R400 Q401 N402 | V394-A398 WeakPolarHBondContact O-CB 3.23Å; V394-A398 PolarHBondContact O-N 3.38Å; R395-A398 PolarHBondContact O-N 2.89Å; A398-R400 VanDerWaalsContact C-N 3.34Å; A398-Q401 PolarHBondContact O-N 3.31Å; A398-N402 WeakPolarHBondContact O-CB 3.31Å; A398-N402 PolarHBondContact O-N 3.46Å |
| 399 | E | 97.6 | Very high | 97.7 | Very high | 139 Ų | 139 | 110.1 Ų | 110.1 | 65% | 0.65 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -61.6 | -42.8 | 173.7 | -75 | 173.1 | -169.8 | 0 | 0 | 111.3 | R395 A396 N402 A403 | R395-E399 WeakPolarHBondContact O-CG 3.48Å; R395-E399 PolarHBondContact O-N 2.81Å; A396-E399 PolarHBondContact O-N 2.98Å; E399-N402 PolarHBondContact O-N 2.84Å; E399-A403 PolarHBondContact O-N 2.97Å |
| 400 | R | 97.9 | Very high | 97.7 | Very high | 167 Ų | 167 | 105 Ų | 105 | 63% | 0.63 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -61.9 | -48.2 | 174.2 | -177.8 | -179.4 | 177.6 | 177.5 | 2.4 | 112.1 | A396 D397 A398 N402 A403 D404 | A396-R400 WeakPolarHBondContact O-CB 3.3Å; A396-R400 PolarHBondContact O-N 3.15Å; D397-R400 PolarHBondContact O-N 3.17Å; A398-R400 VanDerWaalsContact C-N 3.34Å; R400-N402 VanDerWaalsContact C-N 3.29Å; R400-N402 PolarHBondContact O-N 2.97Å; R400-A403 PolarHBondContact O-N 2.88Å; R400-D404 PolarHBondContact O-N 2.87Å |
| 401 | Q | 97.7 | Very high | 97.6 | Very high | 140 Ų | 140 | 101.9 Ų | 101.9 | 65% | 0.654 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -60.5 | -38.5 | 176.7 | -75.3 | 178.8 | 15.4 | 0 | 0 | 112.2 | D397 A398 D404 H405 | D397-Q401 WeakPolarHBondContact O-CB 3.19Å; D397-Q401 VanDerWaalsContact O-CG 3.31Å; D397-Q401 WeakPolarHBondContact O-CG 3.27Å; D397-Q401 PolarHBondContact O-N 3.35Å; A398-Q401 PolarHBondContact O-N 3.31Å; Q401-D404 PolarHBondContact O-N 3.44Å; Q401-H405 VanDerWaalsContact O-CB 3.31Å; Q401-H405 WeakPolarHBondContact O-CB 3.5Å; Q401-H405 PolarHBondContact O-N 2.86Å |
| 402 | N | 97.6 | Very high | 97.6 | Very high | 88 Ų | 88 | 102 Ų | 102 | 47% | 0.471 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.7 | -44.5 | 174.8 | -174.7 | 13.8 | 0 | 0 | 0 | 111.5 | A398 E399 R400 H405 Q406 | A398-N402 WeakPolarHBondContact O-CB 3.31Å; A398-N402 PolarHBondContact O-N 3.46Å; E399-N402 PolarHBondContact O-N 2.84Å; R400-N402 VanDerWaalsContact C-N 3.29Å; R400-N402 PolarHBondContact O-N 2.97Å; N402-H405 PolarHBondContact O-N 3.18Å; N402-Q406 VanDerWaalsContact O-CG 3.32Å; N402-Q406 WeakPolarHBondContact O-CG 3.46Å; N402-Q406 PolarHBondContact O-N 2.95Å; N402-Q406 PolarHBondContact OD1-NE2 3.41Å |
| 403 | A | 97.3 | Very high | 97.5 | Very high | 54 Ų | 54 | 97.8 Ų | 97.8 | 45% | 0.446 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.5 | -43 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | E399 R400 Q406 R407 | E399-A403 PolarHBondContact O-N 2.97Å; R400-A403 PolarHBondContact O-N 2.88Å; A403-Q406 PolarHBondContact O-N 3.2Å; A403-R407 WeakPolarHBondContact O-CB 3.43Å; A403-R407 PolarHBondContact O-N 3.06Å |
| 404 | D | 97.5 | Very high | 97.5 | Very high | 80 Ų | 80 | 99.3 Ų | 99.3 | 43% | 0.428 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65.5 | -37.6 | 175 | -76.7 | -31.8 | 0 | 0 | 0 | 111.7 | R400 Q401 R407 L408 | R400-D404 PolarHBondContact O-N 2.87Å; Q401-D404 PolarHBondContact O-N 3.44Å; D404-R407 WeakPolarHBondContact O-CB 3.46Å; D404-R407 PolarHBondContact O-N 2.93Å; D404-L408 WeakPolarHBondContact O-CG 3.34Å; D404-L408 PolarHBondContact O-N 3.43Å |
| 405 | H | 97.8 | Very high | 97.4 | Very high | 109 Ų | 109 | 98.8 Ų | 98.8 | 51% | 0.505 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.7 | -44.7 | 174.7 | -170.3 | 76.1 | 0 | 0 | 0 | 112.2 | Q401 N402 R407 L408 L409 | Q401-H405 VanDerWaalsContact O-CB 3.31Å; Q401-H405 WeakPolarHBondContact O-CB 3.5Å; Q401-H405 PolarHBondContact O-N 2.86Å; N402-H405 PolarHBondContact O-N 3.18Å; H405-R407 VanDerWaalsContact C-N 3.29Å; H405-R407 PolarHBondContact O-N 3.42Å; H405-L408 PolarHBondContact O-N 2.9Å; H405-L408 VanDerWaalsContact O-N 3.14Å; H405-L409 WeakPolarHBondContact O-CG 3.47Å; H405-L409 PolarHBondContact O-N 3.38Å |
| 406 | Q | 97 | Very high | 97.3 | Very high | 115 Ų | 115 | 95.5 Ų | 95.5 | 54% | 0.537 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -59.7 | -40.3 | 173.7 | -71.2 | 173 | 25.6 | 0 | 0 | 111.7 | N402 A403 L409 G410 | N402-Q406 VanDerWaalsContact O-CG 3.32Å; N402-Q406 WeakPolarHBondContact O-CG 3.46Å; N402-Q406 PolarHBondContact O-N 2.95Å; N402-Q406 PolarHBondContact OD1-NE2 3.41Å; A403-Q406 PolarHBondContact O-N 3.2Å; Q406-L409 PolarHBondContact O-N 2.84Å; Q406-G410 PolarHBondContact O-N 3.43Å |
| 407 | R | 97 | Very high | 97.1 | Very high | 187 Ų | 187 | 99 Ų | 99 | 71% | 0.706 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -61.9 | -43.1 | 173.5 | 179.6 | 179.9 | 175.7 | 138.5 | 0.6 | 111.9 | A403 D404 H405 G410 V411 | A403-R407 WeakPolarHBondContact O-CB 3.43Å; A403-R407 PolarHBondContact O-N 3.06Å; D404-R407 WeakPolarHBondContact O-CB 3.46Å; D404-R407 PolarHBondContact O-N 2.93Å; H405-R407 VanDerWaalsContact C-N 3.29Å; H405-R407 PolarHBondContact O-N 3.42Å; R407-G410 PolarHBondContact O-N 2.8Å; R407-V411 WeakPolarHBondContact O-CG2 3.28Å; R407-V411 PolarHBondContact O-N 3.39Å |
| 408 | L | 97.6 | Very high | 97 | Very high | 116 Ų | 116 | 100.4 Ų | 100.4 | 61% | 0.607 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -65.3 | -42.4 | 176.3 | -74.3 | 170.9 | 0 | 0 | 0 | 112.1 | D404 H405 G410 V411 K412 | D404-L408 WeakPolarHBondContact O-CG 3.34Å; D404-L408 PolarHBondContact O-N 3.43Å; H405-L408 PolarHBondContact O-N 2.9Å; H405-L408 VanDerWaalsContact O-N 3.14Å; L408-G410 VanDerWaalsContact C-N 3.3Å; L408-G410 PolarHBondContact O-N 2.83Å; L408-V411 PolarHBondContact O-N 3.49Å; L408-V411 VanDerWaalsContact O-N 3.09Å; L408-K412 WeakPolarHBondContact O-CB 3.2Å; L408-K412 PolarHBondContact O-N 3.18Å |
| 409 | L | 97 | Very high | 96.8 | Very high | 79 Ų | 79 | 101.9 Ų | 101.9 | 41% | 0.414 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59.3 | -41.1 | 172.4 | -70.1 | 175.6 | 0 | 0 | 0 | 111.5 | H405 Q406 V411 K412 A413 | H405-L409 WeakPolarHBondContact O-CG 3.47Å; H405-L409 PolarHBondContact O-N 3.38Å; Q406-L409 PolarHBondContact O-N 2.84Å; L409-V411 VanDerWaalsContact C-N 3.3Å; L409-V411 PolarHBondContact O-N 3.5Å; L409-K412 PolarHBondContact O-N 2.96Å; L409-A413 WeakPolarHBondContact O-CB 3.35Å; L409-A413 PolarHBondContact O-N 3.39Å |
| 410 | G | 97.4 | Very high | 96.6 | Very high | 32 Ų | 32 | 98.9 Ų | 98.9 | 33% | 0.33 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -68.1 | -22.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | Q406 R407 L408 R414 | Q406-G410 PolarHBondContact O-N 3.43Å; R407-G410 PolarHBondContact O-N 2.8Å; L408-G410 VanDerWaalsContact C-N 3.3Å; L408-G410 PolarHBondContact O-N 2.83Å; G410-R414 PolarHBondContact O-NE 3.26Å; G410-R414 PolarHBondContact O-NH2 2.98Å |
| 411 | V | 97.4 | Very high | 96.2 | Very high | 55 Ų | 55 | 94 Ų | 94 | 33% | 0.333 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -79.1 | -46.4 | 168.1 | 172.9 | 0 | 0 | 0 | 0 | 110.2 | R407 L408 L409 A413 R414 L415 | R407-V411 WeakPolarHBondContact O-CG2 3.28Å; R407-V411 PolarHBondContact O-N 3.39Å; L408-V411 PolarHBondContact O-N 3.49Å; L408-V411 VanDerWaalsContact O-N 3.09Å; L409-V411 VanDerWaalsContact C-N 3.3Å; L409-V411 PolarHBondContact O-N 3.5Å; V411-A413 PolarHBondContact O-N 2.82Å; V411-R414 WeakPolarHBondContact O-CB 3.44Å; V411-R414 PolarHBondContact O-N 3.41Å; V411-R414 VanDerWaalsContact O-N 3.09Å; V411-L415 HydrophobicContact CG1-CD1 3.96Å; V411-L415 HydrophobicContact CG1-CG 4.33Å; V411-L415 PolarHBondContact O-N 2.99Å |
| 412 | K | 97.1 | Very high | 96 | Very high | 107 Ų | 107 | 93.7 Ų | 93.7 | 47% | 0.465 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -54.3 | -50 | 177.2 | -178.9 | -179.5 | 175 | -72.9 | 0 | 111.5 | L408 L409 R414 L415 E416 | L408-K412 WeakPolarHBondContact O-CB 3.2Å; L408-K412 PolarHBondContact O-N 3.18Å; L409-K412 PolarHBondContact O-N 2.96Å; K412-R414 VanDerWaalsContact C-N 3.27Å; K412-R414 PolarHBondContact O-N 2.96Å; K412-L415 PolarHBondContact O-N 3.37Å; K412-E416 WeakPolarHBondContact CE-OE1 3.33Å; K412-E416 HydrophobicContact CG-CG 4.43Å; K412-E416 IonicContact NZ-OE1 3.88Å; K412-E416 PolarHBondContact NZ-OE1 3.4Å; K412-E416 IonicContact NZ-OE2 3.85Å; K412-E416 PolarHBondContact NZ-OE2 3.26Å; K412-E416 WeakPolarHBondContact O-CB 3.36Å; K412-E416 WeakPolarHBondContact O-CG 3.45Å; K412-E416 PolarHBondContact O-N 2.7Å |
| 413 | A | 96.3 | Very high | 95.7 | Very high | 49 Ų | 49 | 96 Ų | 96 | 41% | 0.405 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -60.3 | -33.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | L409 V411 M417 | L409-A413 WeakPolarHBondContact O-CB 3.35Å; L409-A413 PolarHBondContact O-N 3.39Å; V411-A413 PolarHBondContact O-N 2.82Å; A413-M417 WeakPolarHBondContact O-CG 3.32Å; A413-M417 PolarHBondContact O-N 3.19Å; A413-M417 VanDerWaalsContact O-N 3.13Å |
| 414 | R | 97.1 | Very high | 95.2 | Very high | 138 Ų | 138 | 100.4 Ų | 100.4 | 52% | 0.521 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -70.5 | -45.5 | 174 | -78.5 | 179.4 | -73.5 | 179.7 | -0.2 | 112.1 | G410 V411 K412 E416 M417 E418 | G410-R414 PolarHBondContact O-NE 3.26Å; G410-R414 PolarHBondContact O-NH2 2.98Å; V411-R414 WeakPolarHBondContact O-CB 3.44Å; V411-R414 PolarHBondContact O-N 3.41Å; V411-R414 VanDerWaalsContact O-N 3.09Å; K412-R414 VanDerWaalsContact C-N 3.27Å; K412-R414 PolarHBondContact O-N 2.96Å; R414-E416 VanDerWaalsContact C-N 3.27Å; R414-E416 PolarHBondContact O-N 3.1Å; R414-M417 HydrophobicContact CB-CE 4.49Å; R414-M417 HydrophobicContact CG-CE 3.98Å; R414-M417 WeakPolarHBondContact O-CB 3.09Å; R414-M417 PolarHBondContact O-N 3.34Å; R414-E418 WeakPolarHBondContact O-CG 3.28Å; R414-E418 PolarHBondContact O-N 2.91Å |
| 415 | L | 97 | Very high | 94.8 | Very high | 88 Ų | 88 | 102.9 Ų | 102.9 | 46% | 0.461 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63 | -34.6 | 175.1 | -66.6 | 173.9 | 0 | 0 | 0 | 112.1 | V411 K412 E418 I419 | V411-L415 HydrophobicContact CG1-CD1 3.96Å; V411-L415 HydrophobicContact CG1-CG 4.33Å; V411-L415 PolarHBondContact O-N 2.99Å; K412-L415 PolarHBondContact O-N 3.37Å; L415-E418 PolarHBondContact O-N 2.65Å; L415-I419 WeakPolarHBondContact O-CB 3.44Å; L415-I419 WeakPolarHBondContact O-CD1 3.48Å; L415-I419 VanDerWaalsContact O-CG1 3.24Å; L415-I419 WeakPolarHBondContact O-CG1 3.41Å; L415-I419 PolarHBondContact O-N 3.29Å |
| 416 | E | 95.6 | Very high | 94.1 | Very high | 98 Ų | 98 | 105 Ų | 105 | 46% | 0.458 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.6 | -40.9 | 173.8 | -74.2 | 174.7 | 144.2 | 0 | 0 | 111.7 | K412 R414 E420 | K412-E416 WeakPolarHBondContact CE-OE1 3.33Å; K412-E416 HydrophobicContact CG-CG 4.43Å; K412-E416 IonicContact NZ-OE1 3.88Å; K412-E416 PolarHBondContact NZ-OE1 3.4Å; K412-E416 IonicContact NZ-OE2 3.85Å; K412-E416 PolarHBondContact NZ-OE2 3.26Å; K412-E416 WeakPolarHBondContact O-CB 3.36Å; K412-E416 WeakPolarHBondContact O-CG 3.45Å; K412-E416 PolarHBondContact O-N 2.7Å; R414-E416 VanDerWaalsContact C-N 3.27Å; R414-E416 PolarHBondContact O-N 3.1Å; E416-E420 VanDerWaalsContact O-CB 3.28Å; E416-E420 WeakPolarHBondContact O-CB 3.46Å; E416-E420 PolarHBondContact O-N 2.94Å |
| 417 | M | 94.2 | Very high | 93.1 | Very high | 122 Ų | 122 | 106.2 Ų | 106.2 | 60% | 0.601 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -63.6 | -41.5 | 170.5 | -69.5 | -171.5 | -60.4 | 0 | 0 | 112.5 | A413 R414 E420 T421 | A413-M417 WeakPolarHBondContact O-CG 3.32Å; A413-M417 PolarHBondContact O-N 3.19Å; A413-M417 VanDerWaalsContact O-N 3.13Å; R414-M417 HydrophobicContact CB-CE 4.49Å; R414-M417 HydrophobicContact CG-CE 3.98Å; R414-M417 WeakPolarHBondContact O-CB 3.09Å; R414-M417 PolarHBondContact O-N 3.34Å; M417-E420 PolarHBondContact O-N 2.99Å; M417-T421 WeakPolarHBondContact O-CG2 3.49Å; M417-T421 PolarHBondContact O-N 2.81Å; M417-T421 PolarHBondContact O-OG1 3.44Å |
| 418 | E | 95.9 | Very high | 91.1 | Very high | 90 Ų | 90 | 99 Ų | 99 | 42% | 0.421 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.5 | -48.4 | 176.8 | -73.3 | 172.9 | -150.1 | 0 | 0 | 111.2 | R414 L415 E420 T421 Y422 | R414-E418 WeakPolarHBondContact O-CG 3.28Å; R414-E418 PolarHBondContact O-N 2.91Å; L415-E418 PolarHBondContact O-N 2.65Å; E418-E420 VanDerWaalsContact C-N 3.28Å; E418-E420 PolarHBondContact O-N 2.74Å; E418-T421 WeakPolarHBondContact CA-OG1 3.17Å; E418-T421 PolarHBondContact O-N 3.24Å; E418-T421 VanDerWaalsContact O-N 3.1Å; E418-T421 PolarHBondContact O-OG1 3.3Å; E418-Y422 HydrophobicContact CB-CD2 4.44Å; E418-Y422 HydrophobicContact CB-CE2 4.05Å; E418-Y422 WeakPolarHBondContact O-CD2 3.47Å; E418-Y422 PolarHBondContact O-N 2.9Å |
| 419 | I | 93.2 | Very high | 88.9 | Confident | 86 Ų | 86 | 101.8 Ų | 101.8 | 44% | 0.441 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -57.1 | -42.3 | 174.8 | -70.5 | 164.2 | 0 | 0 | 0 | 111.1 | L415 Y422 R423 | L415-I419 WeakPolarHBondContact O-CB 3.44Å; L415-I419 WeakPolarHBondContact O-CD1 3.48Å; L415-I419 VanDerWaalsContact O-CG1 3.24Å; L415-I419 WeakPolarHBondContact O-CG1 3.41Å; L415-I419 PolarHBondContact O-N 3.29Å; I419-Y422 PolarHBondContact O-N 3.4Å; I419-R423 WeakPolarHBondContact O-CG 3.5Å; I419-R423 PolarHBondContact O-N 2.76Å |
| 420 | E | 93.1 | Very high | 86.6 | Confident | 77 Ų | 77 | 103 Ų | 103 | 36% | 0.36 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.3 | -39.4 | 176.8 | -177.5 | 61.3 | -161.5 | 0 | 0 | 112 | E416 M417 E418 R423 R424 | E416-E420 VanDerWaalsContact O-CB 3.28Å; E416-E420 WeakPolarHBondContact O-CB 3.46Å; E416-E420 PolarHBondContact O-N 2.94Å; M417-E420 PolarHBondContact O-N 2.99Å; E418-E420 VanDerWaalsContact C-N 3.28Å; E418-E420 PolarHBondContact O-N 2.74Å; E420-R423 PolarHBondContact O-N 3.5Å; E420-R423 IonicContact OE2-NH1 2.93Å; E420-R424 VanDerWaalsContact CG-NH2 3.28Å; E420-R424 WeakPolarHBondContact O-CG 3.43Å; E420-R424 PolarHBondContact O-N 2.97Å; E420-R424 VanDerWaalsContact O-N 3.16Å; E420-R424 IonicContact OE1-CZ 2.75Å; E420-R424 IonicContact OE1-NE 3.97Å; E420-R424 IonicContact OE1-NH2 2.61Å; E420-R424 PolarHBondContact OE1-NH2 2.96Å |
| 421 | T | 89.4 | Confident | 84.2 | Confident | 63 Ų | 63 | 110.6 Ų | 110.6 | 39% | 0.387 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -67.1 | -38.6 | 171.5 | 57.4 | 0 | 0 | 0 | 0 | 112.8 | M417 E418 R423 R424 L425 | M417-T421 WeakPolarHBondContact O-CG2 3.49Å; M417-T421 PolarHBondContact O-N 2.81Å; M417-T421 PolarHBondContact O-OG1 3.44Å; E418-T421 WeakPolarHBondContact CA-OG1 3.17Å; E418-T421 PolarHBondContact O-N 3.24Å; E418-T421 VanDerWaalsContact O-N 3.1Å; E418-T421 PolarHBondContact O-OG1 3.3Å; T421-R423 VanDerWaalsContact C-N 3.35Å; T421-R424 PolarHBondContact O-N 3.03Å; T421-L425 WeakPolarHBondContact O-CG 3.43Å; T421-L425 PolarHBondContact O-N 2.96Å; T421-L425 VanDerWaalsContact O-N 3.11Å |
| 422 | Y | 94.1 | Very high | 81.7 | Confident | 134 Ų | 134 | 111.2 Ų | 111.2 | 53% | 0.525 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -65.5 | -37.2 | 174.6 | -67.2 | -55.2 | 0 | 0 | 0 | 111.8 | E418 I419 L425 L426 | E418-Y422 HydrophobicContact CB-CD2 4.44Å; E418-Y422 HydrophobicContact CB-CE2 4.05Å; E418-Y422 WeakPolarHBondContact O-CD2 3.47Å; E418-Y422 PolarHBondContact O-N 2.9Å; I419-Y422 PolarHBondContact O-N 3.4Å; Y422-L425 PolarHBondContact O-N 3.38Å; Y422-L426 WeakPolarHBondContact O-CD1 3.36Å; Y422-L426 PolarHBondContact O-N 3.11Å |
| 423 | R | 90.4 | Very high | 79.3 | Confident | 137 Ų | 137 | 113 Ų | 113 | 52% | 0.517 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -59.9 | -50.2 | 173.7 | -78.8 | 177.4 | 179.5 | 159.7 | -2.1 | 111.8 | I419 E420 T421 L425 L426 E427 | I419-R423 WeakPolarHBondContact O-CG 3.5Å; I419-R423 PolarHBondContact O-N 2.76Å; E420-R423 PolarHBondContact O-N 3.5Å; E420-R423 IonicContact OE2-NH1 2.93Å; T421-R423 VanDerWaalsContact C-N 3.35Å; R423-L425 VanDerWaalsContact C-N 3.26Å; R423-L425 PolarHBondContact O-N 2.78Å; R423-L426 CarbonylContact O-C 3.55Å; R423-L426 PolarHBondContact O-N 2.84Å; R423-E427 WeakPolarHBondContact O-CB 3.4Å; R423-E427 WeakPolarHBondContact O-CG 3.31Å; R423-E427 PolarHBondContact O-N 2.79Å |
| 424 | R | 88.3 | Confident | 76.5 | Confident | 146 Ų | 146 | 114.2 Ų | 114.2 | 55% | 0.551 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -57 | -40 | 175.9 | -65.8 | 175.6 | -156.7 | 155.2 | 4.2 | 112.4 | E420 T421 G428 | E420-R424 VanDerWaalsContact CG-NH2 3.28Å; E420-R424 WeakPolarHBondContact O-CG 3.43Å; E420-R424 PolarHBondContact O-N 2.97Å; E420-R424 VanDerWaalsContact O-N 3.16Å; E420-R424 IonicContact OE1-CZ 2.75Å; E420-R424 IonicContact OE1-NE 3.97Å; E420-R424 IonicContact OE1-NH2 2.61Å; E420-R424 PolarHBondContact OE1-NH2 2.96Å; T421-R424 PolarHBondContact O-N 3.03Å; R424-G428 PolarHBondContact O-N 2.84Å |
| 425 | L | 88.6 | Confident | 74 | Confident | 133 Ų | 133 | 116.4 Ų | 116.4 | 70% | 0.696 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -68.8 | -31.3 | 176.5 | -69.6 | 170.3 | 0 | 0 | 0 | 113.3 | T421 Y422 R423 | T421-L425 WeakPolarHBondContact O-CG 3.43Å; T421-L425 PolarHBondContact O-N 2.96Å; T421-L425 VanDerWaalsContact O-N 3.11Å; Y422-L425 PolarHBondContact O-N 3.38Å; R423-L425 VanDerWaalsContact C-N 3.26Å; R423-L425 PolarHBondContact O-N 2.78Å |
| 426 | L | 82.9 | Confident | 70.9 | Confident | 154 Ų | 154 | 120 Ų | 120 | 81% | 0.806 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -84.4 | -33.2 | 176.8 | -92.9 | 89.8 | 0 | 0 | 0 | 113.9 | Y422 R423 | Y422-L426 WeakPolarHBondContact O-CD1 3.36Å; Y422-L426 PolarHBondContact O-N 3.11Å; R423-L426 CarbonylContact O-C 3.55Å; R423-L426 PolarHBondContact O-N 2.84Å |
| 427 | E | 75.8 | Confident | 68.4 | Low | 139 Ų | 139 | 123.8 Ų | 123.8 | 65% | 0.65 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -67.7 | -26.8 | 170.5 | -72.1 | 167.7 | -166.5 | 0 | 0 | 110.5 | R423 S430 | R423-E427 WeakPolarHBondContact O-CB 3.4Å; R423-E427 WeakPolarHBondContact O-CG 3.31Å; R423-E427 PolarHBondContact O-N 2.79Å; E427-S430 PolarHBondContact O-OG 3.43Å |
| 428 | G | 54.8 | Low | 65.6 | Low | 36 Ų | 36 | 123 Ų | 123 | 37% | 0.371 | 66% | 0.656 | S | S | . | * | trans | 87.3 | 163.7 | 164.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | R424 S430 | R424-G428 PolarHBondContact O-N 2.84Å; G428-S430 PolarHBondContact O-N 3.12Å | ||
| 429 | D | 51.3 | Low | 62.7 | Low | 174 Ų | 174 | 124 Ų | 124 | 93% | 0.93 | 67% | 0.673 | S | S | * | * | S | Bend | trans | -68.3 | 54.1 | 161 | -74.6 | -48 | 0 | 0 | 0 | 110.5 | Q431 | D429-Q431 VanDerWaalsContact C-N 3.27Å; D429-Q431 PolarHBondContact O-N 3.42Å |
| 430 | S | 48.2 | Very low | 59.7 | Low | 104 Ų | 104 | 125.2 Ų | 125.2 | 73% | 0.727 | 69% | 0.689 | S | S | * | * | trans | -95.6 | 33.7 | 174.2 | 78.2 | 0 | 0 | 0 | 0 | 112.1 | E427 G428 | E427-S430 PolarHBondContact O-OG 3.43Å; G428-S430 PolarHBondContact O-N 3.12Å | ||
| 431 | Q | 47.1 | Very low | 57.2 | Low | 192 Ų | 192 | 129.9 Ų | 129.9 | 90% | 0.897 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -131.9 | 77.9 | 156.9 | -152.3 | 163 | 26.8 | 0 | 0 | 109.1 | D429 | D429-Q431 VanDerWaalsContact C-N 3.27Å; D429-Q431 PolarHBondContact O-N 3.42Å |
| 432 | G | 44.8 | Very low | 54.4 | Low | 69 Ų | 69 | 132.3 Ų | 132.3 | 71% | 0.711 | 74% | 0.735 | S | S | * | * | trans | -64.8 | 131.9 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 433 | D | 46.5 | Very low | 51.8 | Low | 144 Ų | 144 | 132.6 Ų | 132.6 | 77% | 0.77 | 75% | 0.75 | S | S | * | * | trans | 48.5 | 96.3 | 148.9 | -151.5 | 19.6 | 0 | 0 | 0 | 117.7 | ||||
| 434 | G | 38.3 | Very low | 49 | Very low | 74 Ų | 74 | 131.7 Ų | 131.7 | 76% | 0.763 | 77% | 0.765 | S | S | * | * | trans | -152.9 | 90.1 | 167.6 | 0 | 0 | 0 | 0 | 0 | 108.6 | D436 | G434-D436 PolarHBondContact O-N 3.26Š| ||
| 435 | F | 44 | Very low | 46.3 | Very low | 184 Ų | 184 | 134 Ų | 134 | 81% | 0.807 | 78% | 0.779 | S | S | * | * | trans | -51.6 | 127.4 | 172.3 | -76.3 | -111.1 | 0 | 0 | 0 | 110 | ||||
| 436 | D | 33.4 | Very low | 43.7 | Very low | 163 Ų | 163 | 134 Ų | 134 | 87% | 0.872 | 79% | 0.787 | S | S | * | * | -154.9 | 151.3 | 118.5 | -117.8 | -23.8 | 0 | 0 | 0 | 114.3 | G434 | G434-D436 PolarHBondContact O-N 3.26Š| |||
| 437 | E | 41.7 | Very low | 41.2 | Very low | 179 Ų | 179 | 135.5 Ų | 135.5 | 84% | 0.836 | 79% | 0.79 | S | S | * | * | trans | -88.1 | 126.9 | -167.8 | 178 | -177.5 | 138.9 | 0 | 0 | 112 | ||||
| 438 | S | 35.4 | Very low | 39.3 | Very low | 106 Ų | 106 | 134.7 Ų | 134.7 | 74% | 0.741 | 80% | 0.795 | S | S | * | * | trans | -176.7 | 122.9 | 141 | 31.2 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 439 | S | 35.8 | Very low | 38.5 | Very low | 110 Ų | 110 | 138.9 Ų | 138.9 | 77% | 0.769 | 82% | 0.815 | S | S | * | * | trans | 8.6 | 135.3 | 141 | 62.9 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 440 | S | 30.6 | Very low | 37.8 | Very low | 112 Ų | 112 | 136 Ų | 136 | 78% | 0.783 | 81% | 0.809 | S | S | * | * | cis | -174.2 | 158.3 | 49.3 | 43.9 | 0 | 0 | 0 | 0 | 113 | ||||
| 441 | L | 39.5 | Very low | 37.2 | Very low | 174 Ų | 174 | 137.2 Ų | 137.2 | 91% | 0.911 | 81% | 0.812 | S | S | * | * | trans | -69.6 | 132.3 | 170 | -72.1 | 151.3 | 0 | 0 | 0 | 111.6 | ||||
| 442 | S | 30.1 | Very low | 36.4 | Very low | 114 Ų | 114 | 135.3 Ų | 135.3 | 80% | 0.797 | 81% | 0.808 | S | S | * | * | trans | -147.7 | 126.3 | 146.2 | 57.6 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 443 | V | 39.5 | Very low | 36 | Very low | 140 Ų | 140 | 137.2 Ų | 137.2 | 85% | 0.848 | 81% | 0.81 | S | S | * | * | trans | -79.2 | 134.9 | 176.9 | 170.2 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 444 | S | 32.7 | Very low | 35.6 | Very low | 118 Ų | 118 | 135.4 Ų | 135.4 | 83% | 0.825 | 81% | 0.808 | S | S | * | * | trans | -150.2 | 133.6 | 162.6 | -83.9 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 445 | K | 32.3 | Very low | 35.8 | Very low | 195 Ų | 195 | 141.2 Ų | 141.2 | 85% | 0.848 | 81% | 0.813 | S | S | * | * | trans | -44.2 | 150 | 176.9 | -100.2 | 166.1 | 167.1 | 172.6 | 0 | 114.6 | Q447 | K445-Q447 PolarHBondContact O-N 3.45Š| ||
| 446 | P | 32.3 | Very low | 35.5 | Very low | 133 Ų | 133 | 139.9 Ų | 139.9 | 86% | 0.864 | 81% | 0.814 | S | S | * | * | trans | -70.3 | 128.4 | 163.8 | 30.9 | -32.5 | 0 | 0 | 0 | 110.2 | ||||
| 447 | Q | 31.8 | Very low | 36.6 | Very low | 185 Ų | 185 | 137.2 Ų | 137.2 | 86% | 0.864 | 81% | 0.806 | S | S | * | * | trans | -116.1 | 140.1 | 171.5 | -159.4 | 166.6 | -4.8 | 0 | 0 | 109 | K445 | K445-Q447 PolarHBondContact O-N 3.45Š| ||
| 448 | T | 36.2 | Very low | 36.9 | Very low | 123 Ų | 123 | 135 Ų | 135 | 76% | 0.755 | 80% | 0.8 | S | S | * | * | trans | -64.4 | 136.4 | -169 | 48 | 0 | 0 | 0 | 0 | 113.7 | S450 | T448-S450 PolarHBondContact O-N 3.46Š| ||
| 449 | P | 37.7 | Very low | 37.7 | Very low | 123 Ų | 123 | 138 Ų | 138 | 80% | 0.799 | 80% | 0.799 | S | S | * | * | trans | -76.7 | 112.8 | 162.3 | 30.9 | -30.2 | 0 | 0 | 0 | 109.8 | V451 | P449-V451 PolarHBondContact O-N 2.99Š| ||
| 450 | S | 35.9 | Very low | 38.4 | Very low | 113 Ų | 113 | 135.8 Ų | 135.8 | 79% | 0.79 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 118.9 | 162.7 | 49.3 | 0 | 0 | 0 | 0 | 108.9 | T448 D452 | T448-S450 PolarHBondContact O-N 3.46Å; S450-D452 PolarHBondContact O-N 3.35Å |
| 451 | V | 34.8 | Very low | 39.7 | Very low | 131 Ų | 131 | 138 Ų | 138 | 79% | 0.794 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 120.5 | 175 | 176.3 | 0 | 0 | 0 | 0 | 109.2 | P449 | P449-V451 PolarHBondContact O-N 2.99Š|
| 452 | D | 30.8 | Very low | 40.5 | Very low | 152 Ų | 152 | 135.3 Ų | 135.3 | 81% | 0.813 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 127.3 | 172.7 | -162.7 | 2.1 | 0 | 0 | 0 | 109.5 | S450 S454 | S450-D452 PolarHBondContact O-N 3.35Å; D452-S454 PolarHBondContact O-N 2.98Å; D452-S454 VanDerWaalsContact O-N 3.17Å |
| 453 | S | 35.8 | Very low | 42 | Very low | 109 Ų | 109 | 133.2 Ų | 133.2 | 76% | 0.762 | 73% | 0.732 | S | S | * | * | trans | -85.9 | 93.1 | -173.8 | -174.1 | 0 | 0 | 0 | 0 | 110 | ||||
| 454 | S | 38.9 | Very low | 43.3 | Very low | 105 Ų | 105 | 132.5 Ų | 132.5 | 73% | 0.734 | 72% | 0.718 | S | S | * | * | trans | -55.6 | 146.2 | 171.2 | 53.5 | 0 | 0 | 0 | 0 | 111.9 | D452 | D452-S454 PolarHBondContact O-N 2.98Å; D452-S454 VanDerWaalsContact O-N 3.17Å | ||
| 455 | K | 42.8 | Very low | 44.5 | Very low | 197 Ų | 197 | 130.7 Ų | 130.7 | 86% | 0.857 | 70% | 0.702 | S | S | * | * | trans | -106.3 | 101.3 | -162.2 | -178.6 | -175.9 | -176.6 | -178.4 | 0 | 110.4 | P457 | K455-P457 WeakPolarHBondContact O-CD 3.45Š| ||
| 456 | D | 38.5 | Very low | 46.2 | Very low | 155 Ų | 155 | 125.1 Ų | 125.1 | 83% | 0.829 | 68% | 0.684 | S | S | * | * | trans | -84.4 | 121.6 | 173 | -70.7 | -32.2 | 0 | 0 | 0 | 111.1 | ||||
| 457 | P | 55.1 | Low | 47.8 | Very low | 108 Ų | 108 | 123.5 Ų | 123.5 | 70% | 0.701 | 67% | 0.672 | S | S | * | * | trans | -87 | 159.7 | 165.7 | 34.8 | -31.5 | 0 | 0 | 0 | 111.7 | K455 | K455-P457 WeakPolarHBondContact O-CD 3.45Š| ||
| 458 | N | 47.7 | Very low | 49.6 | Very low | 133 Ų | 133 | 119.7 Ų | 119.7 | 71% | 0.711 | 65% | 0.654 | S | S | * | * | trans | 74.3 | 83.6 | 177.6 | -60.4 | 9.9 | 0 | 0 | 0 | 116 | ||||
| 459 | K | 52.7 | Low | 50.7 | Low | 168 Ų | 168 | 119.6 Ų | 119.6 | 73% | 0.73 | 65% | 0.645 | S | S | * | * | trans | -124.5 | 91.7 | 160.2 | -168.3 | 174.4 | -172 | 173.5 | 0 | 109.5 | M487 | K459-M487 VanDerWaalsContact O-CE 3.31Å; K459-M487 WeakPolarHBondContact O-CE 3.44Å | ||
| 460 | T | 51.7 | Low | 52.5 | Low | 64 Ų | 64 | 118.6 Ų | 118.6 | 39% | 0.393 | 63% | 0.632 | S | S | . | * | trans | -74.2 | 140.5 | -178.7 | 63.2 | 0 | 0 | 0 | 0 | 111.3 | E486 | T460-E486 HydrophobicContact CG2-CB 4.22Å; T460-E486 HydrophobicContact CG2-CG 3.67Å; T460-E486 VanDerWaalsContact CG2-OE1 3.24Å; T460-E486 WeakPolarHBondContact CG2-OE1 3.34Å | ||
| 461 | R | 56.8 | Low | 53.3 | Low | 157 Ų | 157 | 116.9 Ų | 116.9 | 59% | 0.592 | 62% | 0.616 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -113.3 | 114.4 | -177.2 | -171.7 | 176.9 | 179.4 | 174.2 | -2.7 | 109.1 | I463 E485 | R461-I463 HydrophobicContact CG-CG1 4.28Å; R461-E485 PolarHBondContact N-O 2.84Å; R461-E485 PolarHBondContact O-N 2.85Å; R461-E485 VanDerWaalsContact O-N 3.09Å |
| 462 | K | 56.3 | Low | 53.8 | Low | 119 Ų | 119 | 118.9 Ų | 118.9 | 52% | 0.517 | 62% | 0.622 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -87.1 | 116.7 | 174.6 | -51.8 | -161.1 | -179.2 | -155.7 | 0 | 109.2 | E484 | K462-E484 HydrophobicContact CD-CG 4.05Å; K462-E484 WeakPolarHBondContact CD-OE1 3.48Å; K462-E484 VanDerWaalsContact CE-OE1 3.24Å; K462-E484 WeakPolarHBondContact CE-OE1 3.49Å; K462-E484 VanDerWaalsContact CE-OE2 3.28Å; K462-E484 WeakPolarHBondContact CE-OE2 3.14Å; K462-E484 HydrophobicContact CG-CG 4.01Å; K462-E484 IonicContact NZ-OE1 3.82Å; K462-E484 PolarHBondContact NZ-OE1 2.9Å; K462-E484 IonicContact NZ-OE2 3.57Å; K462-E484 PolarHBondContact NZ-OE2 2.78Å; K462-E484 VanDerWaalsContact NZ-OE2 3.16Å |
| 463 | I | 62.6 | Low | 55.7 | Low | 69 Ų | 69 | 115 Ų | 115 | 35% | 0.354 | 62% | 0.619 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -104 | 116.7 | 176.6 | -58.6 | 178.3 | 0 | 0 | 0 | 107.4 | R461 L483 | R461-I463 HydrophobicContact CG-CG1 4.28Å; I463-L483 PolarHBondContact N-O 2.94Å; I463-L483 PolarHBondContact O-N 3.46Å; I463-L483 VanDerWaalsContact O-N 3.1Å |
| 464 | K | 64.9 | Low | 56.8 | Low | 126 Ų | 126 | 117.1 Ų | 117.1 | 55% | 0.548 | 62% | 0.617 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -100.5 | 109.5 | 174.9 | -56.8 | -161.6 | -179.4 | -151.9 | 0 | 108.5 | E482 | K464-E482 HydrophobicContact CD-CG 4.09Å; K464-E482 WeakPolarHBondContact CD-OE1 3.36Å; K464-E482 VanDerWaalsContact CE-OE1 3.29Å; K464-E482 WeakPolarHBondContact CE-OE1 3.37Å; K464-E482 WeakPolarHBondContact CE-OE2 3.38Å; K464-E482 HydrophobicContact CG-CG 3.99Å; K464-E482 IonicContact NZ-OE1 3.59Å; K464-E482 PolarHBondContact NZ-OE1 3.49Å; K464-E482 IonicContact NZ-OE2 3.31Å; K464-E482 PolarHBondContact NZ-OE2 3.46Å |
| 465 | T | 59.3 | Low | 58.5 | Low | 80 Ų | 80 | 115.6 Ų | 115.6 | 49% | 0.491 | 60% | 0.603 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -100.1 | 117.4 | 175.8 | -57 | 0 | 0 | 0 | 0 | 108.1 | V467 Q481 | T465-V467 HydrophobicContact CG2-CG2 4.4Å; T465-Q481 PolarHBondContact N-O 2.89Å; T465-Q481 PolarHBondContact O-N 3.45Å |
| 466 | V | 67.1 | Low | 59.7 | Low | 78 Ų | 78 | 111.4 Ų | 111.4 | 47% | 0.473 | 59% | 0.593 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -101.7 | 116.6 | 176.6 | -173.9 | 0 | 0 | 0 | 0 | 107.8 | Q468 V480 | V466-Q468 HydrophobicContact CG1-CG 4.2Å; V466-V480 HydrophobicContact CG1-CG2 4.3Å; V466-V480 HydrophobicContact CG2-CG1 4.34Å; V466-V480 HydrophobicContact CG2-CG2 4.14Å |
| 467 | V | 65.6 | Low | 60.7 | Low | 99 Ų | 99 | 106.4 Ų | 106.4 | 60% | 0.6 | 57% | 0.571 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -100.3 | 124.3 | 172.7 | -176 | 0 | 0 | 0 | 0 | 107.7 | T465 S478 Q479 | T465-V467 HydrophobicContact CG2-CG2 4.4Å; V467-S478 WeakPolarHBondContact O-CA 3.48Å; V467-Q479 PolarHBondContact N-O 3.35Å; V467-Q479 PolarHBondContact O-N 2.89Å |
| 468 | Q | 71.1 | Confident | 61.3 | Low | 104 Ų | 104 | 104.5 Ų | 104.5 | 49% | 0.486 | 56% | 0.56 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -117 | 135.3 | 175.4 | -72.4 | -175.9 | -4.6 | 0 | 0 | 109.9 | V466 V475 S477 | V466-Q468 HydrophobicContact CG1-CG 4.2Å; Q468-V475 HydrophobicContact CB-CG1 4.2Å; Q468-V475 HydrophobicContact CG-CG1 4.14Å; Q468-S477 WeakPolarHBondContact CA-O 3.28Å |
| 469 | E | 58.8 | Low | 61.9 | Low | 121 Ų | 121 | 104.6 Ų | 104.6 | 57% | 0.565 | 56% | 0.556 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -104.2 | 116.9 | 173.7 | -167.2 | 174.4 | -160.8 | 0 | 0 | 108.6 | V476 S477 | E469-V476 PolarHBondContact O-N 2.89Å; E469-V476 VanDerWaalsContact O-N 3.11Å; E469-S477 WeakPolarHBondContact CB-OG 3.48Å; E469-S477 PolarHBondContact N-O 3.29Å; E469-S477 PolarHBondContact OE2-OG 2.93Å |
| 470 | I | 75.3 | Confident | 62.6 | Low | 103 Ų | 103 | 100.3 Ų | 100.3 | 53% | 0.528 | 54% | 0.543 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.8 | 120.7 | -173.8 | -50.1 | 180 | 0 | 0 | 0 | 108.3 | V475 | I470-V475 HydrophobicContact CG1-CG2 4.31Å |
| 471 | V | 52.4 | Low | 62.6 | Low | 77 Ų | 77 | 103.2 Ų | 103.2 | 47% | 0.467 | 55% | 0.553 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -125.8 | 128 | 175.1 | -178.3 | 0 | 0 | 0 | 0 | 107.6 | G473 E474 V476 | V471-G473 PolarHBondContact O-N 3.35Å; V471-G473 VanDerWaalsContact O-N 3.12Å; V471-E474 PolarHBondContact N-O 3.49Å; V471-E474 PolarHBondContact O-N 2.89Å; V471-V476 HydrophobicContact CB-CG2 4.48Å |
| 472 | N | 45.1 | Very low | 62.9 | Low | 172 Ų | 172 | 100.6 Ų | 100.6 | 92% | 0.92 | 55% | 0.547 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.7 | 26.7 | -178.5 | -56.2 | -26.3 | 0 | 0 | 0 | 115.3 | ||
| 473 | G | 71.8 | Confident | 62.8 | Low | 71 Ų | 71 | 101 Ų | 101 | 73% | 0.732 | 55% | 0.554 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 86.2 | 1.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 115.6 | V471 | V471-G473 PolarHBondContact O-N 3.35Å; V471-G473 VanDerWaalsContact O-N 3.12Å |
| 474 | E | 57.4 | Low | 62.4 | Low | 154 Ų | 154 | 103.4 Ų | 103.4 | 72% | 0.72 | 56% | 0.564 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -111.7 | 141.6 | 174.1 | -156.9 | 167.1 | -160.8 | 0 | 0 | 110.3 | V471 V476 | V471-E474 PolarHBondContact N-O 3.49Å; V471-E474 PolarHBondContact O-N 2.89Å; E474-V476 PolarHBondContact O-N 3.43Å |
| 475 | V | 76.2 | Confident | 61.6 | Low | 73 Ų | 73 | 103.1 Ų | 103.1 | 44% | 0.442 | 57% | 0.565 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -85.5 | 104.4 | -176.3 | -176.7 | 0 | 0 | 0 | 0 | 108.9 | Q468 I470 | Q468-V475 HydrophobicContact CB-CG1 4.2Å; Q468-V475 HydrophobicContact CG-CG1 4.14Å; I470-V475 HydrophobicContact CG1-CG2 4.31Å |
| 476 | V | 67.8 | Low | 61.3 | Low | 108 Ų | 108 | 106.3 Ų | 106.3 | 66% | 0.655 | 57% | 0.574 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -89.2 | -28.2 | -172.6 | -172.6 | 0 | 0 | 0 | 0 | 111.9 | E469 V471 E474 | E469-V476 PolarHBondContact O-N 2.89Å; E469-V476 VanDerWaalsContact O-N 3.11Å; V471-V476 HydrophobicContact CB-CG2 4.48Å; E474-V476 PolarHBondContact O-N 3.43Å |
| 477 | S | 59.3 | Low | 60.6 | Low | 51 Ų | 51 | 110.7 Ų | 110.7 | 36% | 0.357 | 59% | 0.591 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -143 | 147.5 | 171.8 | 84.8 | 0 | 0 | 0 | 0 | 112.1 | Q468 E469 | Q468-S477 WeakPolarHBondContact CA-O 3.28Å; E469-S477 WeakPolarHBondContact CB-OG 3.48Å; E469-S477 PolarHBondContact N-O 3.29Å; E469-S477 PolarHBondContact OE2-OG 2.93Å |
| 478 | S | 67.9 | Low | 60.3 | Low | 68 Ų | 68 | 111.3 Ų | 111.3 | 48% | 0.476 | 59% | 0.591 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -141.4 | 118.2 | 173.8 | 180 | 0 | 0 | 0 | 0 | 109 | V467 | V467-S478 WeakPolarHBondContact O-CA 3.48Å |
| 479 | Q | 60 | Low | 59.7 | Low | 135 Ų | 135 | 111.7 Ų | 111.7 | 63% | 0.631 | 60% | 0.597 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -119.7 | 128.4 | 177 | -167.8 | 169.7 | 7.2 | 0 | 0 | 110 | V467 | V467-Q479 PolarHBondContact N-O 3.35Å; V467-Q479 PolarHBondContact O-N 2.89Å |
| 480 | V | 67.2 | Low | 59.8 | Low | 77 Ų | 77 | 111.2 Ų | 111.2 | 47% | 0.467 | 60% | 0.598 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -103.3 | 124 | 178.5 | -174.2 | 0 | 0 | 0 | 0 | 108.2 | V466 E482 | V466-V480 HydrophobicContact CG1-CG2 4.3Å; V466-V480 HydrophobicContact CG2-CG1 4.34Å; V466-V480 HydrophobicContact CG2-CG2 4.14Å; V480-E482 HydrophobicContact CG1-CG 4.21Å |
| 481 | Q | 51.8 | Low | 58.9 | Low | 125 Ų | 125 | 111.6 Ų | 111.6 | 58% | 0.584 | 60% | 0.602 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -112.2 | 130.2 | 166.1 | -73.9 | -175.5 | -5.5 | 0 | 0 | 109.2 | T465 | T465-Q481 PolarHBondContact N-O 2.89Å; T465-Q481 PolarHBondContact O-N 3.45Å |
| 482 | E | 62.6 | Low | 59.3 | Low | 102 Ų | 102 | 113.8 Ų | 113.8 | 48% | 0.477 | 61% | 0.611 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -108.2 | 119.9 | 175.5 | -53 | -163.9 | -174.8 | 0 | 0 | 107.9 | K464 V480 | K464-E482 HydrophobicContact CD-CG 4.09Å; K464-E482 WeakPolarHBondContact CD-OE1 3.36Å; K464-E482 VanDerWaalsContact CE-OE1 3.29Å; K464-E482 WeakPolarHBondContact CE-OE1 3.37Å; K464-E482 WeakPolarHBondContact CE-OE2 3.38Å; K464-E482 HydrophobicContact CG-CG 3.99Å; K464-E482 IonicContact NZ-OE1 3.59Å; K464-E482 PolarHBondContact NZ-OE1 3.49Å; K464-E482 IonicContact NZ-OE2 3.31Å; K464-E482 PolarHBondContact NZ-OE2 3.46Å; V480-E482 HydrophobicContact CG1-CG 4.21Å |
| 483 | L | 54.1 | Low | 60.2 | Low | 128 Ų | 128 | 109.9 Ų | 109.9 | 67% | 0.67 | 59% | 0.59 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -115.5 | 131.4 | 170.9 | -82.7 | 165.2 | 0 | 0 | 0 | 108.7 | I463 | I463-L483 PolarHBondContact N-O 2.94Å; I463-L483 PolarHBondContact O-N 3.46Å; I463-L483 VanDerWaalsContact O-N 3.1Å |
| 484 | E | 53.8 | Low | 59.4 | Low | 119 Ų | 119 | 112.7 Ų | 112.7 | 56% | 0.556 | 58% | 0.58 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -100.7 | 120.5 | 175.3 | -55.2 | -164.2 | -175.4 | 0 | 0 | 108.3 | K462 | K462-E484 HydrophobicContact CD-CG 4.05Å; K462-E484 WeakPolarHBondContact CD-OE1 3.48Å; K462-E484 VanDerWaalsContact CE-OE1 3.24Å; K462-E484 WeakPolarHBondContact CE-OE1 3.49Å; K462-E484 VanDerWaalsContact CE-OE2 3.28Å; K462-E484 WeakPolarHBondContact CE-OE2 3.14Å; K462-E484 HydrophobicContact CG-CG 4.01Å; K462-E484 IonicContact NZ-OE1 3.82Å; K462-E484 PolarHBondContact NZ-OE1 2.9Å; K462-E484 IonicContact NZ-OE2 3.57Å; K462-E484 PolarHBondContact NZ-OE2 2.78Å; K462-E484 VanDerWaalsContact NZ-OE2 3.16Å |
| 485 | E | 49.9 | Very low | 59.6 | Low | 120 Ų | 120 | 109.5 Ų | 109.5 | 56% | 0.561 | 57% | 0.569 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -113 | 123.1 | 178.1 | -161.3 | 169.8 | -146 | 0 | 0 | 108.4 | R461 | R461-E485 PolarHBondContact N-O 2.84Å; R461-E485 PolarHBondContact O-N 2.85Å; R461-E485 VanDerWaalsContact O-N 3.09Å |
| 486 | E | 51.6 | Low | 58.2 | Low | 148 Ų | 148 | 112.6 Ų | 112.6 | 69% | 0.692 | 58% | 0.58 | S | S | * | * | trans | -82.5 | 135.6 | 169.3 | -56.1 | -149.1 | 117 | 0 | 0 | 109.1 | T460 | T460-E486 HydrophobicContact CG2-CB 4.22Å; T460-E486 HydrophobicContact CG2-CG 3.67Å; T460-E486 VanDerWaalsContact CG2-OE1 3.24Å; T460-E486 WeakPolarHBondContact CG2-OE1 3.34Å | ||
| 487 | M | 52.3 | Low | 57.3 | Low | 170 Ų | 170 | 113 Ų | 113 | 84% | 0.837 | 57% | 0.573 | S | S | * | * | trans | -104.2 | 0 | 177.8 | -68.3 | -168.9 | -58.5 | 0 | 0 | 111.8 | K459 | K459-M487 VanDerWaalsContact O-CE 3.31Å; K459-M487 WeakPolarHBondContact O-CE 3.44Å |
Retrieved 487 of 487 residues in 72.9 ms
(Link to these results)