| 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 | 39.4 | Very low | 47.7 | Very low | 231 Ų | 231 | 178.8 Ų | 178.8 | 100% | 1.138 | 89% | 0.892 | S | S | * | * | 0 | 94.3 | 0 | -56.6 | 164.9 | 100.3 | 0 | 0 | 106.3 | |||||
| 2 | T | 40.2 | Very low | 48.5 | Very low | 143 Ų | 143 | 183.8 Ų | 183.8 | 88% | 0.877 | 89% | 0.893 | S | S | * | * | 53.6 | 116.9 | 80.4 | 62 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 3 | G | 41.1 | Very low | 48.4 | Very low | 79 Ų | 79 | 183.8 Ų | 183.8 | 81% | 0.814 | 89% | 0.885 | S | S | * | * | cis | -177.7 | -179.4 | 1.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 4 | K | 52.9 | Low | 48.8 | Very low | 207 Ų | 207 | 189 Ų | 189 | 90% | 0.9 | 89% | 0.891 | S | S | * | * | trans | -78.1 | 143.8 | -177.4 | -56.5 | 169.1 | 176.1 | 177.2 | 0 | 113.1 | ||||
| 5 | K | 54.6 | Low | 48.4 | Very low | 205 Ų | 205 | 183.6 Ų | 183.6 | 89% | 0.891 | 88% | 0.882 | S | S | * | * | trans | -150.2 | 118.2 | 148.7 | -60.3 | -173 | -177.6 | 177.1 | 0 | 106.3 | ||||
| 6 | S | 51.8 | Low | 47.8 | Very low | 112 Ų | 112 | 177 Ų | 177 | 78% | 0.783 | 88% | 0.877 | S | S | * | * | 64.2 | 109.9 | 51.3 | -167.3 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 7 | S | 49.1 | Very low | 47.4 | Very low | 123 Ų | 123 | 177.3 Ų | 177.3 | 86% | 0.86 | 88% | 0.876 | S | S | * | * | trans | -155.3 | 70.9 | 157.4 | -132.5 | 0 | 0 | 0 | 0 | 112.1 | E9 | S7-E9 PolarHBondContact O-N 3.03Š| ||
| 8 | R | 47.9 | Very low | 47 | Very low | 239 Ų | 239 | 177.1 Ų | 177.1 | 90% | 0.902 | 87% | 0.872 | S | S | * | * | trans | -78.7 | 88.8 | 163.7 | 170.6 | -153.9 | -179.9 | 177.6 | 1.2 | 108.1 | ||||
| 9 | E | 46.8 | Very low | 46.6 | Very low | 172 Ų | 172 | 173.1 Ų | 173.1 | 80% | 0.804 | 87% | 0.87 | S | S | * | * | trans | -161.7 | 99.9 | 170 | -164.5 | 106.5 | 110.3 | 0 | 0 | 113.9 | S7 | S7-E9 PolarHBondContact O-N 3.03Š| ||
| 10 | K | 50.1 | Low | 46.2 | Very low | 211 Ų | 211 | 169.4 Ų | 169.4 | 92% | 0.917 | 87% | 0.868 | S | S | * | * | trans | -163.1 | 52 | 149.6 | -116.6 | 165.8 | -173.7 | 177.5 | 0 | 113.4 | ||||
| 11 | R | 50.7 | Low | 45.9 | Very low | 245 Ų | 245 | 166.5 Ų | 166.5 | 93% | 0.925 | 87% | 0.869 | S | S | * | * | trans | -98 | 84.5 | 167.4 | -167.1 | 180 | -175.1 | -168.4 | 2.2 | 109.8 | ||||
| 12 | R | 58 | Low | 45.8 | Very low | 239 Ų | 239 | 160.2 Ų | 160.2 | 90% | 0.902 | 85% | 0.854 | S | S | * | * | trans | -98.4 | 101.5 | 162.9 | -74.5 | -176.2 | 172.3 | -178.9 | -3.4 | 107.1 | ||||
| 13 | K | 46.3 | Very low | 45.7 | Very low | 183 Ų | 183 | 161.9 Ų | 161.9 | 80% | 0.796 | 86% | 0.857 | S | S | * | * | 45.1 | 95.5 | 87.3 | -97.6 | -162.7 | 174 | -172.3 | 0 | 112.8 | |||||
| 14 | R | 54.2 | Low | 45.4 | Very low | 257 Ų | 257 | 162.5 Ų | 162.5 | 97% | 0.97 | 85% | 0.854 | S | S | * | * | -133.6 | 131.5 | 126.2 | -71.4 | -165.2 | 173.2 | 179.1 | -2.2 | 107.7 | |||||
| 15 | S | 43.5 | Very low | 44.9 | Very low | 108 Ų | 108 | 156.9 Ų | 156.9 | 76% | 0.755 | 85% | 0.846 | S | S | * | * | trans | -142.5 | 144.7 | -178.2 | 55.9 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 16 | G | 38.9 | Very low | 44.9 | Very low | 78 Ų | 78 | 153 Ų | 153 | 80% | 0.804 | 84% | 0.842 | S | S | * | * | trans | 90.8 | 153.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 17 | Q | 40.8 | Very low | 44.2 | Very low | 182 Ų | 182 | 154 Ų | 154 | 85% | 0.85 | 84% | 0.838 | S | S | * | * | cis | -156.7 | 151.8 | -11.6 | -173.1 | 166.3 | -6.5 | 0 | 0 | 109.5 | ||||
| 18 | E | 39.5 | Very low | 43.7 | Very low | 173 Ų | 173 | 155.1 Ų | 155.1 | 81% | 0.808 | 83% | 0.834 | S | S | * | * | trans | -24.5 | 137.7 | 163.3 | -157.9 | -175 | 146.1 | 0 | 0 | 117.2 | ||||
| 19 | A | 40.2 | Very low | 43.6 | Very low | 101 Ų | 101 | 149.8 Ų | 149.8 | 84% | 0.835 | 83% | 0.828 | S | S | * | * | trans | -151.5 | 125.7 | 154.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 20 | A | 38.8 | Very low | 44.1 | Very low | 100 Ų | 100 | 147.1 Ų | 147.1 | 83% | 0.826 | 83% | 0.825 | S | S | * | * | trans | -90.4 | 149.7 | 178 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 21 | A | 39.3 | Very low | 43.5 | Very low | 109 Ų | 109 | 143.4 Ų | 143.4 | 90% | 0.901 | 82% | 0.82 | S | S | * | * | trans | -148.5 | 113.2 | 160.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 22 | A | 36.3 | Very low | 43 | Very low | 98 Ų | 98 | 139.3 Ų | 139.3 | 81% | 0.81 | 82% | 0.815 | S | S | * | * | trans | -104.9 | 128 | 176.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 23 | L | 38.4 | Very low | 41.7 | Very low | 179 Ų | 179 | 131.7 Ų | 131.7 | 94% | 0.937 | 81% | 0.811 | S | S | * | * | trans | -157.1 | 145.4 | 164.7 | -65.7 | 177.7 | 0 | 0 | 0 | 106.9 | ||||
| 24 | A | 35.8 | Very low | 41.2 | Very low | 91 Ų | 91 | 126.7 Ų | 126.7 | 75% | 0.752 | 81% | 0.812 | S | S | * | * | cis | -161.3 | 147.8 | -28.7 | 0 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 25 | A | 42.1 | Very low | 40.5 | Very low | 90 Ų | 90 | 120.9 Ų | 120.9 | 74% | 0.744 | 81% | 0.805 | S | S | * | * | trans | -77.7 | 164.2 | 172 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 26 | P | 53.7 | Low | 40.4 | Very low | 122 Ų | 122 | 120.5 Ų | 120.5 | 79% | 0.792 | 81% | 0.809 | S | S | * | * | -125.5 | 137 | 98.6 | 35.4 | -30.1 | 0 | 0 | 0 | 111 | |||||
| 27 | D | 37.4 | Very low | 40.2 | Very low | 133 Ų | 133 | 120.7 Ų | 120.7 | 71% | 0.711 | 81% | 0.811 | S | S | * | * | cis | 77.8 | 143.7 | 45.7 | -146 | -30.9 | 0 | 0 | 0 | 114.1 | ||||
| 28 | L | 39.4 | Very low | 39.9 | Very low | 148 Ų | 148 | 116.1 Ų | 116.1 | 78% | 0.775 | 81% | 0.812 | S | S | * | * | trans | 85.1 | 128.1 | 176.4 | -51.9 | 180 | 0 | 0 | 0 | 118.3 | ||||
| 29 | V | 46.5 | Very low | 39.8 | Very low | 126 Ų | 126 | 114.1 Ų | 114.1 | 76% | 0.764 | 82% | 0.815 | S | S | * | * | cis | -163.7 | 169.3 | -36.4 | -107.6 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 30 | P | 57.2 | Low | 39.6 | Very low | 116 Ų | 116 | 112.7 Ų | 112.7 | 75% | 0.753 | 81% | 0.811 | S | S | * | * | trans | -113.3 | 179.1 | -158.6 | 43.1 | -37.1 | 0 | 0 | 0 | 117.4 | ||||
| 31 | V | 36.6 | Very low | 39.8 | Very low | 133 Ų | 133 | 113.9 Ų | 113.9 | 81% | 0.806 | 81% | 0.813 | S | S | * | * | trans | -144.7 | 145.8 | 158.9 | 126.7 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 32 | L | 39.4 | Very low | 39.6 | Very low | 159 Ų | 159 | 112.9 Ų | 112.9 | 83% | 0.832 | 81% | 0.813 | S | S | * | * | cis | 168.4 | 136.8 | -26.2 | -105.6 | 177.3 | 0 | 0 | 0 | 104.6 | ||||
| 33 | G | 32.4 | Very low | 39.5 | Very low | 79 Ų | 79 | 111.1 Ų | 111.1 | 81% | 0.814 | 81% | 0.805 | S | S | * | * | trans | 95.8 | 123.2 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 34 | G | 35.6 | Very low | 39.3 | Very low | 78 Ų | 78 | 108.3 Ų | 108.3 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | cis | 97.4 | 137.7 | 28.5 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 35 | T | 39.8 | Very low | 39.3 | Very low | 136 Ų | 136 | 110.4 Ų | 110.4 | 83% | 0.834 | 81% | 0.806 | S | S | * | * | cis | -165.7 | 154.2 | 14.6 | 133.6 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 36 | A | 40.3 | Very low | 38.8 | Very low | 100 Ų | 100 | 109.7 Ų | 109.7 | 83% | 0.826 | 81% | 0.807 | S | S | * | * | trans | 61.4 | 148.5 | 161.9 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 37 | G | 34.6 | Very low | 38 | Very low | 82 Ų | 82 | 107.7 Ų | 107.7 | 85% | 0.845 | 81% | 0.809 | S | S | * | * | cis | 129.5 | 127 | 6.5 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 38 | G | 33.9 | Very low | 37.9 | Very low | 85 Ų | 85 | 106.4 Ų | 106.4 | 88% | 0.876 | 82% | 0.817 | S | S | * | * | trans | 168.7 | 132.2 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 39 | C | 38.3 | Very low | 37.6 | Very low | 131 Ų | 131 | 103.4 Ų | 103.4 | 89% | 0.885 | 82% | 0.822 | S | S | * | * | trans | -127.7 | 156.4 | -169.2 | 57.8 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 40 | G | 36.2 | Very low | 36.8 | Very low | 71 Ų | 71 | 101.5 Ų | 101.5 | 73% | 0.732 | 83% | 0.827 | S | S | * | * | trans | 78.6 | 170.9 | 163.6 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 41 | S | 42.5 | Very low | 35.6 | Very low | 126 Ų | 126 | 100 Ų | 100 | 88% | 0.881 | 83% | 0.833 | S | S | * | * | cis | -175.1 | 137.8 | -15.9 | -98.8 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 42 | G | 35.5 | Very low | 35.6 | Very low | 87 Ų | 87 | 98.3 Ų | 98.3 | 90% | 0.897 | 83% | 0.833 | S | S | * | * | trans | 69.9 | 166.3 | 172.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 43 | G | 33.1 | Very low | 35.5 | Very low | 62 Ų | 62 | 96.1 Ų | 96.1 | 64% | 0.639 | 83% | 0.831 | S | S | * | * | cis | -162.5 | 142.5 | -6.3 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 44 | C | 34.5 | Very low | 35.7 | Very low | 120 Ų | 120 | 99 Ų | 99 | 81% | 0.811 | 83% | 0.832 | S | S | * | * | 73.1 | 133.7 | 100.9 | 72.8 | 0 | 0 | 0 | 0 | 117.1 | |||||
| 45 | C | 35.6 | Very low | 35.7 | Very low | 135 Ų | 135 | 100.4 Ų | 100.4 | 91% | 0.912 | 84% | 0.836 | S | S | * | * | trans | 54.7 | 153.5 | 173 | 70.8 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 46 | G | 32.3 | Very low | 35.2 | Very low | 74 Ų | 74 | 97.5 Ų | 97.5 | 76% | 0.763 | 83% | 0.834 | S | S | * | * | cis | 151.6 | 150.4 | -7.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 47 | G | 36.3 | Very low | 34.8 | Very low | 80 Ų | 80 | 96.6 Ų | 96.6 | 83% | 0.825 | 83% | 0.834 | S | S | * | * | trans | 88.1 | 134.8 | 175 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 48 | A | 35.6 | Very low | 34.7 | Very low | 107 Ų | 107 | 97.2 Ų | 97.2 | 88% | 0.884 | 83% | 0.831 | S | S | * | * | cis | 106.9 | 131.2 | 21.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 49 | G | 32.5 | Very low | 34.7 | Very low | 84 Ų | 84 | 100.4 Ų | 100.4 | 87% | 0.866 | 82% | 0.824 | S | S | * | * | trans | 84.7 | 139.6 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 50 | G | 30.5 | Very low | 34.8 | Very low | 86 Ų | 86 | 104 Ų | 104 | 89% | 0.887 | 82% | 0.818 | S | S | * | * | cis | 122.5 | 126.2 | 5.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 51 | G | 32.7 | Very low | 34.8 | Very low | 84 Ų | 84 | 106.6 Ų | 106.6 | 87% | 0.866 | 83% | 0.825 | S | S | * | * | trans | 144.3 | 109.4 | 173.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 52 | A | 36.9 | Very low | 34.8 | Very low | 98 Ų | 98 | 109.3 Ų | 109.3 | 81% | 0.81 | 82% | 0.824 | S | S | * | * | trans | -91 | 151 | 162.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 53 | S | 37.1 | Very low | 35 | Very low | 114 Ų | 114 | 114.8 Ų | 114.8 | 80% | 0.797 | 82% | 0.818 | S | S | * | * | trans | -168.4 | 112.9 | 152 | -85.6 | 0 | 0 | 0 | 0 | 114 | ||||
| 54 | V | 35.2 | Very low | 35.7 | Very low | 138 Ų | 138 | 121.6 Ų | 121.6 | 84% | 0.836 | 82% | 0.824 | S | S | * | * | trans | 12.2 | 157 | 137 | -65 | 0 | 0 | 0 | 0 | 123.9 | ||||
| 55 | A | 35.9 | Very low | 36.1 | Very low | 108 Ų | 108 | 123.2 Ų | 123.2 | 89% | 0.893 | 82% | 0.818 | S | S | * | * | trans | 83.5 | 142.5 | 161.9 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 56 | G | 30.1 | Very low | 37 | Very low | 76 Ų | 76 | 127.1 Ų | 127.1 | 78% | 0.784 | 81% | 0.813 | S | S | * | * | cis | 161.4 | 139.2 | -8.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 57 | G | 30.8 | Very low | 37.6 | Very low | 81 Ų | 81 | 134.7 Ų | 134.7 | 84% | 0.835 | 82% | 0.819 | S | S | * | * | trans | 67.2 | 174.4 | 172.2 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 58 | A | 33.2 | Very low | 37.9 | Very low | 94 Ų | 94 | 135.5 Ų | 135.5 | 78% | 0.777 | 81% | 0.812 | S | S | * | * | cis | -167.1 | 162.9 | -24.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 59 | E | 33.4 | Very low | 38.1 | Very low | 153 Ų | 153 | 136.8 Ų | 136.8 | 72% | 0.715 | 81% | 0.809 | S | S | * | * | trans | 61.6 | 103 | 154.7 | -70.7 | -96.6 | 74.4 | 0 | 0 | 120.8 | ||||
| 60 | R | 40.1 | Very low | 38.1 | Very low | 205 Ų | 205 | 139.7 Ų | 139.7 | 77% | 0.774 | 80% | 0.804 | S | S | * | * | 51.8 | 108.3 | 109 | -167.5 | -177.6 | -168 | 171.8 | 5.4 | 119.2 | |||||
| 61 | S | 37.9 | Very low | 38.8 | Very low | 126 Ų | 126 | 140.5 Ų | 140.5 | 88% | 0.881 | 80% | 0.797 | S | S | * | * | trans | -151.5 | 96.9 | 142.6 | -94.3 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 62 | E | 41 | Very low | 39.2 | Very low | 183 Ų | 183 | 141.7 Ų | 141.7 | 86% | 0.855 | 79% | 0.791 | S | S | * | * | trans | -82.4 | 120.3 | 167.6 | -178.7 | -166.1 | 149.3 | 0 | 0 | 109.4 | ||||
| 63 | R | 40.1 | Very low | 39.2 | Very low | 202 Ų | 202 | 142.6 Ų | 142.6 | 76% | 0.762 | 79% | 0.792 | S | S | * | * | trans | -168.2 | 123.6 | 165.4 | -108.7 | 155.3 | -166.2 | -148.9 | 4.8 | 113.6 | ||||
| 64 | R | 47.9 | Very low | 39 | Very low | 205 Ų | 205 | 142.2 Ų | 142.2 | 77% | 0.774 | 79% | 0.789 | S | S | * | * | trans | 74.2 | 148.9 | 144.7 | -62.1 | 164.9 | -176.8 | -172 | 0.6 | 117.2 | ||||
| 65 | K | 42.6 | Very low | 39 | Very low | 155 Ų | 155 | 142 Ų | 142 | 67% | 0.674 | 79% | 0.788 | S | S | * | * | cis | -173.6 | 143.3 | -15.8 | 174.9 | 161.1 | -179.5 | 172.5 | 0 | 109.5 | ||||
| 66 | R | 53.9 | Low | 39.1 | Very low | 216 Ų | 216 | 143 Ų | 143 | 82% | 0.815 | 79% | 0.788 | S | S | * | * | trans | 78.5 | 123.5 | 160.6 | -81.5 | 166 | 179.7 | 175.5 | -6.4 | 120.4 | ||||
| 67 | R | 46.8 | Very low | 39.1 | Very low | 234 Ų | 234 | 142.8 Ų | 142.8 | 88% | 0.883 | 79% | 0.787 | S | S | * | * | trans | -65.4 | 152.8 | 151.5 | -57.7 | 168 | 174.1 | 160.9 | -4.3 | 110.6 | ||||
| 68 | S | 42.6 | Very low | 39.5 | Very low | 97 Ų | 97 | 144.1 Ų | 144.1 | 68% | 0.678 | 78% | 0.783 | S | S | * | * | 147.9 | 137.7 | 111 | -78.3 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 69 | T | 39.9 | Very low | 39.5 | Very low | 134 Ų | 134 | 146.3 Ų | 146.3 | 82% | 0.822 | 78% | 0.781 | S | S | * | * | trans | 54.3 | 129.3 | 146.1 | 57.4 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 70 | D | 31.9 | Very low | 39.8 | Very low | 144 Ų | 144 | 146.1 Ų | 146.1 | 77% | 0.77 | 78% | 0.78 | S | S | * | * | -163 | -177.2 | 57.6 | 178.9 | -112.9 | 0 | 0 | 0 | 112.5 | |||||
| 71 | S | 45.5 | Very low | 39.8 | Very low | 104 Ų | 104 | 144.4 Ų | 144.4 | 73% | 0.727 | 78% | 0.781 | S | S | * | * | trans | 100.7 | 86.5 | 151.9 | -54.7 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 72 | S | 40.3 | Very low | 39.5 | Very low | 108 Ų | 108 | 145.5 Ų | 145.5 | 76% | 0.755 | 77% | 0.772 | S | S | * | * | trans | -89.4 | 164.6 | 161.2 | 53.2 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 73 | S | 36.3 | Very low | 39.6 | Very low | 118 Ų | 118 | 143.6 Ų | 143.6 | 83% | 0.825 | 77% | 0.773 | S | S | * | * | trans | 79.2 | 152.2 | 172.4 | 90.6 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 74 | S | 34.5 | Very low | 39.9 | Very low | 105 Ų | 105 | 141.1 Ų | 141.1 | 73% | 0.734 | 77% | 0.768 | S | S | * | * | cis | -153.2 | 166.7 | 7.8 | 61.4 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 75 | V | 34.4 | Very low | 39.6 | Very low | 133 Ų | 133 | 141.8 Ų | 141.8 | 81% | 0.806 | 77% | 0.772 | S | S | * | * | trans | -31.5 | 128.6 | 176.2 | -77 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 76 | S | 37.3 | Very low | 39.7 | Very low | 129 Ų | 129 | 142.8 Ų | 142.8 | 90% | 0.902 | 78% | 0.784 | S | S | * | * | 53.6 | 127.9 | 117.1 | -148.4 | 0 | 0 | 0 | 0 | 123.2 | |||||
| 77 | G | 30.8 | Very low | 39 | Very low | 73 Ų | 73 | 138.4 Ų | 138.4 | 75% | 0.753 | 78% | 0.776 | S | S | * | * | trans | 115.7 | 140.5 | 161.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 78 | S | 38.1 | Very low | 38.7 | Very low | 108 Ų | 108 | 132.3 Ų | 132.3 | 76% | 0.755 | 77% | 0.767 | S | S | * | * | cis | -164.9 | 161.1 | -13.5 | -165.8 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 79 | L | 34.3 | Very low | 38.6 | Very low | 140 Ų | 140 | 132.6 Ų | 132.6 | 73% | 0.733 | 76% | 0.764 | S | S | * | * | trans | 66.3 | 110 | 161.8 | -69 | 160.2 | 0 | 0 | 0 | 120.9 | ||||
| 80 | Q | 39.4 | Very low | 38.4 | Very low | 149 Ų | 149 | 131.5 Ų | 131.5 | 70% | 0.696 | 75% | 0.753 | S | S | * | * | 86.5 | 116.7 | 129.8 | -68.5 | -179.5 | -0.8 | 0 | 0 | 122 | |||||
| 81 | Q | 39.3 | Very low | 38.9 | Very low | 169 Ų | 169 | 132 Ų | 132 | 79% | 0.79 | 75% | 0.75 | S | S | * | * | trans | 67.9 | 128.9 | 143.5 | -58 | 165.5 | 26.8 | 0 | 0 | 115.3 | ||||
| 82 | E | 33.3 | Very low | 38.9 | Very low | 149 Ų | 149 | 134.7 Ų | 134.7 | 70% | 0.696 | 75% | 0.749 | S | S | * | * | cis | -131 | 137.3 | 37.1 | -62.1 | -176.6 | 73.8 | 0 | 0 | 114.3 | K84 | E82-K84 PolarHBondContact O-N 3.22Å; E82-K84 IonicContact OE1-NZ 3.02Å; E82-K84 PolarHBondContact OE1-NZ 3.29Å | ||
| 83 | T | 42.7 | Very low | 38.8 | Very low | 144 Ų | 144 | 137 Ų | 137 | 88% | 0.883 | 75% | 0.748 | S | S | * | * | trans | -86.4 | 93.7 | 167.3 | 46.3 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 84 | K | 45.9 | Very low | 39.1 | Very low | 150 Ų | 150 | 137.4 Ų | 137.4 | 65% | 0.652 | 74% | 0.74 | S | S | * | * | trans | -134.8 | 104.2 | 168 | -78.3 | 178.6 | -172.7 | 140 | 0 | 111.7 | E82 | E82-K84 PolarHBondContact O-N 3.22Å; E82-K84 IonicContact OE1-NZ 3.02Å; E82-K84 PolarHBondContact OE1-NZ 3.29Å | ||
| 85 | Y | 41.6 | Very low | 39.6 | Very low | 218 Ų | 218 | 139.1 Ų | 139.1 | 86% | 0.855 | 74% | 0.741 | S | S | * | * | trans | 44.8 | 104.1 | 149 | -56.8 | -87.3 | 0 | 0 | 0 | 118.7 | ||||
| 86 | L | 44.6 | Very low | 40 | Very low | 176 Ų | 176 | 138.8 Ų | 138.8 | 92% | 0.921 | 73% | 0.734 | S | S | * | * | trans | -172.7 | 81.5 | 143.3 | -106.2 | 167.4 | 0 | 0 | 0 | 112.6 | ||||
| 87 | L | 38.6 | Very low | 40.1 | Very low | 124 Ų | 124 | 136.2 Ų | 136.2 | 65% | 0.649 | 72% | 0.72 | S | S | * | * | trans | 162.8 | 121.8 | 138.5 | -96.5 | 177.8 | 0 | 0 | 0 | 111.7 | ||||
| 88 | P | 42.3 | Very low | 40.6 | Very low | 107 Ų | 107 | 141 Ų | 141 | 70% | 0.695 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -138 | 34.9 | 142.8 | 24.4 | -2.5 | 0 | 0 | 0 | 112.3 | ||
| 89 | T | 38.9 | Very low | 40.8 | Very low | 102 Ų | 102 | 143.3 Ų | 143.3 | 63% | 0.626 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -96.6 | -23.3 | -175.7 | -33.9 | 0 | 0 | 0 | 0 | 114 | ||
| 90 | L | 37.1 | Very low | 40.9 | Very low | 112 Ų | 112 | 141.3 Ų | 141.3 | 59% | 0.586 | 72% | 0.719 | S | S | * | * | S | Bend | trans | -79.9 | -33.1 | -170.6 | -162.3 | 152.3 | 0 | 0 | 0 | 113.2 | K92 E93 | L90-K92 PolarHBondContact O-N 3.24Å; L90-E93 PolarHBondContact O-N 3.43Å |
| 91 | E | 41.5 | Very low | 40.9 | Very low | 153 Ų | 153 | 142.1 Ų | 142.1 | 72% | 0.715 | 73% | 0.728 | S | S | * | * | H | α-helix | trans | -68 | -16.8 | -176.2 | -63.7 | 175.4 | 177 | 0 | 0 | 113.6 | ||
| 92 | K | 45.4 | Very low | 41.5 | Very low | 162 Ų | 162 | 138.8 Ų | 138.8 | 70% | 0.704 | 72% | 0.719 | S | S | * | * | H | α-helix | trans | -85.8 | -18.8 | 179.8 | -76 | -176.8 | 175 | 178.3 | 0 | 114.9 | L90 | L90-K92 PolarHBondContact O-N 3.24Å |
| 93 | E | 39.2 | Very low | 42.6 | Very low | 156 Ų | 156 | 139.3 Ų | 139.3 | 73% | 0.729 | 72% | 0.722 | S | S | * | * | H | α-helix | trans | -86.1 | -28.4 | 176.2 | -86.4 | -171.1 | 110.3 | 0 | 0 | 112.9 | L90 L96 | L90-E93 PolarHBondContact O-N 3.43Å; E93-L96 PolarHBondContact O-N 3.32Å |
| 94 | L | 42 | Very low | 43.4 | Very low | 126 Ų | 126 | 137.5 Ų | 137.5 | 66% | 0.66 | 70% | 0.703 | S | S | * | * | H | α-helix | trans | -73.6 | -26.4 | -179.5 | -107.2 | 169 | 0 | 0 | 0 | 113.7 | L96 | L94-L96 VanDerWaalsContact C-N 3.26Å; L94-L96 PolarHBondContact O-N 2.59Å |
| 95 | L | 45 | Very low | 43.9 | Very low | 142 Ų | 142 | 131.9 Ų | 131.9 | 74% | 0.743 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.5 | -10.7 | 175.2 | -64.5 | 175.5 | 0 | 0 | 0 | 113.6 | ||
| 96 | L | 43.7 | Very low | 44.8 | Very low | 126 Ų | 126 | 123.1 Ų | 123.1 | 66% | 0.66 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.8 | -12.5 | -179.3 | -107.1 | 155.6 | 0 | 0 | 0 | 113.2 | E93 L94 | E93-L96 PolarHBondContact O-N 3.32Å; L94-L96 VanDerWaalsContact C-N 3.26Å; L94-L96 PolarHBondContact O-N 2.59Å |
| 97 | A | 39.4 | Very low | 45.8 | Very low | 75 Ų | 75 | 118.9 Ų | 118.9 | 62% | 0.62 | 64% | 0.642 | S | S | * | * | S | Bend | trans | -90.6 | -4.9 | -171.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||
| 98 | E | 39.9 | Very low | 47.4 | Very low | 172 Ų | 172 | 117.1 Ų | 117.1 | 80% | 0.804 | 63% | 0.633 | S | S | * | * | trans | -118.1 | 18.3 | -173.7 | -147.1 | 162.5 | -161.3 | 0 | 0 | 113.8 | S100 | E98-S100 PolarHBondContact O-N 3.05Š| ||
| 99 | H | 43.6 | Very low | 48.8 | Very low | 157 Ų | 157 | 119 Ų | 119 | 73% | 0.727 | 64% | 0.637 | S | S | * | * | trans | -73.9 | 45.4 | 164.9 | -68.5 | -71.5 | 0 | 0 | 0 | 112.2 | D101 | H99-D101 PolarHBondContact O-N 3.04Š| ||
| 100 | S | 35.1 | Very low | 50.3 | Low | 98 Ų | 98 | 118.5 Ų | 118.5 | 69% | 0.685 | 64% | 0.643 | S | S | * | * | trans | -83.8 | 93 | 178.7 | -68.6 | 0 | 0 | 0 | 0 | 110.7 | E98 V102 | E98-S100 PolarHBondContact O-N 3.05Å; S100-V102 VanDerWaalsContact C-N 3.26Å; S100-V102 PolarHBondContact O-N 3.13Å | ||
| 101 | D | 40.4 | Very low | 52 | Low | 166 Ų | 166 | 117 Ų | 117 | 89% | 0.888 | 64% | 0.638 | S | S | * | * | S | Bend | trans | 51 | 31.8 | 151.5 | -153.4 | 41.8 | 0 | 0 | 0 | 117.3 | H99 | H99-D101 PolarHBondContact O-N 3.04Š|
| 102 | V | 50.6 | Low | 53.6 | Low | 100 Ų | 100 | 113.9 Ų | 113.9 | 61% | 0.606 | 63% | 0.633 | S | S | * | * | trans | -80.5 | 123.1 | 157.2 | 78.1 | 0 | 0 | 0 | 0 | 107.3 | S100 E104 | S100-V102 VanDerWaalsContact C-N 3.26Å; S100-V102 PolarHBondContact O-N 3.13Å; V102-E104 PolarHBondContact O-N 3.14Å | ||
| 103 | E | 56.5 | Low | 55.1 | Low | 159 Ų | 159 | 111.2 Ų | 111.2 | 74% | 0.743 | 63% | 0.626 | S | S | * | * | trans | -52 | 139.6 | 174.8 | -163 | -173.3 | 151.2 | 0 | 0 | 109.4 | G105 G106 | E103-G105 VanDerWaalsContact C-N 3.32Å; E103-G105 PolarHBondContact O-N 3.25Å; E103-G106 PolarHBondContact O-N 3Å | ||
| 104 | E | 59.6 | Low | 57.4 | Low | 106 Ų | 106 | 108 Ų | 108 | 50% | 0.495 | 61% | 0.609 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -69.4 | 81.7 | -170.9 | -173.4 | 175.2 | -145.7 | 0 | 0 | 112.5 | V102 K137 | V102-E104 PolarHBondContact O-N 3.14Å; E104-K137 WeakPolarHBondContact OE2-CE 3.3Å; E104-K137 IonicContact OE2-NZ 2.59Å |
| 105 | G | 57.5 | Low | 59.6 | Low | 33 Ų | 33 | 106.1 Ų | 106.1 | 34% | 0.34 | 61% | 0.605 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 130.1 | 4.1 | -166.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | E103 G135 | E103-G105 VanDerWaalsContact C-N 3.32Å; E103-G105 PolarHBondContact O-N 3.25Å; G105-G135 VanDerWaalsContact CA-CA 3.47Å |
| 106 | G | 60.5 | Low | 61.7 | Low | 34 Ų | 34 | 102.1 Ų | 102.1 | 35% | 0.351 | 59% | 0.586 | S | S | . | * | trans | -77.1 | 135.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | E103 D108 | E103-G106 PolarHBondContact O-N 3Å; G106-D108 PolarHBondContact O-N 3.44Å | ||
| 107 | L | 65.8 | Low | 63.9 | Low | 87 Ų | 87 | 99.2 Ų | 99.2 | 46% | 0.455 | 58% | 0.576 | S | S | . | * | trans | -78.9 | 115 | 172.5 | -72.5 | 171.5 | 0 | 0 | 0 | 110.1 | L109 L113 I133 | L107-L109 PolarHBondContact O-N 3.48Å; L107-L109 VanDerWaalsContact O-N 3.16Å; L107-L113 HydrophobicContact CD2-CD2 4.29Å; L107-I133 HydrophobicContact CD2-CB 4.13Å; L107-I133 HydrophobicContact CD2-CG1 3.67Å; L107-I133 HydrophobicContact CD2-CG2 3.93Å | ||
| 108 | D | 71.1 | Confident | 66.4 | Low | 86 Ų | 86 | 101.4 Ų | 101.4 | 46% | 0.46 | 57% | 0.572 | S | S | . | * | trans | -72.2 | 107.4 | 167.4 | -180 | 20.2 | 0 | 0 | 0 | 110.4 | G106 A110 V111 | G106-D108 PolarHBondContact O-N 3.44Å; D108-A110 PolarHBondContact O-N 3.28Å; D108-A110 VanDerWaalsContact OD1-CB 3.23Å; D108-A110 WeakPolarHBondContact OD1-CB 3.32Å; D108-A110 PolarHBondContact OD1-N 2.81Å; D108-V111 PolarHBondContact O-N 2.9Å; D108-V111 WeakPolarHBondContact OD2-CG2 3.25Å | ||
| 109 | L | 71.5 | Confident | 68.9 | Low | 147 Ų | 147 | 95.1 Ų | 95.1 | 77% | 0.77 | 54% | 0.541 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.8 | -9.7 | 177.6 | -60.7 | 176.3 | 0 | 0 | 0 | 113.2 | L107 V111 | L107-L109 PolarHBondContact O-N 3.48Å; L107-L109 VanDerWaalsContact O-N 3.16Å; L109-V111 VanDerWaalsContact C-N 3.34Å |
| 110 | A | 71.3 | Confident | 71.2 | Confident | 91 Ų | 91 | 87.9 Ų | 87.9 | 75% | 0.752 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.7 | -28.2 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | D108 | D108-A110 PolarHBondContact O-N 3.28Å; D108-A110 VanDerWaalsContact OD1-CB 3.23Å; D108-A110 WeakPolarHBondContact OD1-CB 3.32Å; D108-A110 PolarHBondContact OD1-N 2.81Å |
| 111 | V | 72.6 | Confident | 73.9 | Confident | 82 Ų | 82 | 88 Ų | 88 | 50% | 0.497 | 51% | 0.508 | S | S | . | . | S | Bend | trans | -83.5 | 129.3 | 171.1 | 174.8 | 0 | 0 | 0 | 0 | 109.7 | D108 L109 L113 | D108-V111 PolarHBondContact O-N 2.9Å; D108-V111 WeakPolarHBondContact OD2-CG2 3.25Å; L109-V111 VanDerWaalsContact C-N 3.34Å; V111-L113 PolarHBondContact O-N 3.25Å |
| 112 | S | 74.3 | Confident | 76.4 | Confident | 86 Ų | 86 | 83.8 Ų | 83.8 | 60% | 0.601 | 49% | 0.486 | S | S | * | . | trans | -63.8 | 107.8 | 176.9 | 63.6 | 0 | 0 | 0 | 0 | 110.7 | K114 | S112-K114 PolarHBondContact O-N 2.88Š| ||
| 113 | L | 78.2 | Confident | 78.4 | Confident | 106 Ų | 106 | 80.3 Ų | 80.3 | 56% | 0.555 | 46% | 0.463 | S | S | * | . | P | Polyproline II helix | trans | -62.7 | 120.6 | 173.9 | -59.3 | -178.9 | 0 | 0 | 0 | 109.7 | L107 V111 | L107-L113 HydrophobicContact CD2-CD2 4.29Å; V111-L113 PolarHBondContact O-N 3.25Å |
| 114 | K | 85.9 | Confident | 80.1 | Confident | 88 Ų | 88 | 78.2 Ų | 78.2 | 38% | 0.383 | 45% | 0.451 | S | S | . | . | P | Polyproline II helix | trans | -102.7 | 150.6 | 174.3 | -62.6 | -179.9 | -175.5 | 174.4 | 0 | 109.5 | S112 F118 Y119 | S112-K114 PolarHBondContact O-N 2.88Å; K114-F118 HydrophobicContact CB-CB 4.06Å; K114-F118 HydrophobicContact CB-CD1 4.38Å; K114-F118 HydrophobicContact CB-CG 4.24Å; K114-F118 HydrophobicContact CD-CB 4.38Å; K114-F118 HydrophobicContact CD-CD1 3.39Å; K114-F118 HydrophobicContact CD-CD2 4.04Å; K114-F118 HydrophobicContact CD-CE1 3.61Å; K114-F118 HydrophobicContact CD-CE2 4.21Å; K114-F118 HydrophobicContact CD-CG 3.65Å; K114-F118 HydrophobicContact CD-CZ 4.02Å; K114-F118 VanDerWaalsContact NZ-CE1 3.27Å; K114-F118 VanDerWaalsContact NZ-CZ 3.25Å; K114-Y119 HydrophobicContact CB-CE2 3.73Å |
| 115 | P | 89.1 | Confident | 81.6 | Confident | 87 Ų | 87 | 77.4 Ų | 77.4 | 57% | 0.565 | 45% | 0.447 | S | S | * | . | P | Polyproline II helix | trans | -61 | 148.8 | 173 | 28.4 | -35.9 | 0 | 0 | 0 | 110.2 | S117 F118 | P115-S117 PolarHBondContact O-N 3.35Å; P115-F118 WeakPolarHBondContact O-CB 3.19Å; P115-F118 PolarHBondContact O-N 3.4Å |
| 116 | V | 89 | Confident | 83.3 | Confident | 59 Ų | 59 | 76.5 Ų | 76.5 | 36% | 0.358 | 43% | 0.434 | S | S | . | . | G | 310 helix | trans | -52.8 | -33.5 | 179.7 | -179.1 | 0 | 0 | 0 | 0 | 111.6 | F118 Y119 M126 L175 | V116-F118 PolarHBondContact O-N 2.85Å; V116-Y119 PolarHBondContact O-N 2.93Å; V116-M126 HydrophobicContact CG1-CG 3.71Å; V116-M126 HydrophobicContact CG1-SD 3.69Å; V116-L175 HydrophobicContact CB-CD1 4.43Å; V116-L175 HydrophobicContact CG1-CD1 3.91Å; V116-L175 HydrophobicContact CG1-CD2 4.22Å |
| 117 | S | 89.9 | Confident | 84.8 | Confident | 64 Ų | 64 | 75.5 Ų | 75.5 | 45% | 0.448 | 42% | 0.421 | S | S | . | . | G | 310 helix | trans | -57.4 | -26.6 | 176.1 | 54.5 | 0 | 0 | 0 | 0 | 115 | P115 Y119 | P115-S117 PolarHBondContact O-N 3.35Å; S117-Y119 VanDerWaalsContact C-N 3.26Å; S117-Y119 PolarHBondContact O-N 2.93Å |
| 118 | F | 92.3 | Very high | 85.9 | Confident | 122 Ų | 122 | 74.3 Ų | 74.3 | 54% | 0.535 | 41% | 0.413 | S | S | . | . | G | 310 helix | trans | -65.5 | -30 | 174.9 | -179.7 | -90.2 | 0 | 0 | 0 | 112.6 | K114 P115 V116 | K114-F118 HydrophobicContact CB-CB 4.06Å; K114-F118 HydrophobicContact CB-CD1 4.38Å; K114-F118 HydrophobicContact CB-CG 4.24Å; K114-F118 HydrophobicContact CD-CB 4.38Å; K114-F118 HydrophobicContact CD-CD1 3.39Å; K114-F118 HydrophobicContact CD-CD2 4.04Å; K114-F118 HydrophobicContact CD-CE1 3.61Å; K114-F118 HydrophobicContact CD-CE2 4.21Å; K114-F118 HydrophobicContact CD-CG 3.65Å; K114-F118 HydrophobicContact CD-CZ 4.02Å; K114-F118 VanDerWaalsContact NZ-CE1 3.27Å; K114-F118 VanDerWaalsContact NZ-CZ 3.25Å; P115-F118 WeakPolarHBondContact O-CB 3.19Å; P115-F118 PolarHBondContact O-N 3.4Å; V116-F118 PolarHBondContact O-N 2.85Å |
| 119 | Y | 91.8 | Very high | 86.8 | Confident | 40 Ų | 40 | 73 Ų | 73 | 16% | 0.157 | 40% | 0.404 | C | S | . | . | G | 310 helix | trans | -94.5 | -0.6 | -172.7 | -58.3 | -86.2 | 0 | 0 | 0 | 113.5 | K114 V116 S117 S121 D122 E125 Q129 | K114-Y119 HydrophobicContact CB-CE2 3.73Å; V116-Y119 PolarHBondContact O-N 2.93Å; S117-Y119 VanDerWaalsContact C-N 3.26Å; S117-Y119 PolarHBondContact O-N 2.93Å; Y119-S121 PolarHBondContact O-N 2.82Å; Y119-D122 CarbonylContact O-C 3.47Å; Y119-D122 WeakPolarHBondContact O-CA 3.34Å; Y119-D122 PolarHBondContact O-N 3.08Å; Y119-E125 HydrophobicContact CD1-CB 4.4Å; Y119-Q129 HydrophobicContact CD1-CG 4.27Å; Y119-Q129 HydrophobicContact CE1-CG 3.91Å; Y119-Q129 HydrophobicContact CE2-CG 4.4Å |
| 120 | I | 92.8 | Very high | 87.6 | Confident | 5 Ų | 5 | 68 Ų | 68 | 3% | 0.026 | 38% | 0.381 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -61.1 | -32.1 | -172.7 | -68.6 | 176 | 0 | 0 | 0 | 112.9 | D122 M126 E168 I171 L172 L175 | I120-D122 PolarHBondContact O-N 3.36Å; I120-M126 HydrophobicContact CG1-SD 3.83Å; I120-E168 HydrophobicContact CG2-CB 3.67Å; I120-E168 HydrophobicContact CG2-CG 3.9Å; I120-I171 HydrophobicContact CD1-CG2 3.99Å; I120-I171 HydrophobicContact CG1-CG2 3.98Å; I120-I171 HydrophobicContact CG2-CB 4.3Å; I120-I171 HydrophobicContact CG2-CG2 4.32Å; I120-L172 HydrophobicContact CD1-CB 4.38Å; I120-L172 HydrophobicContact CD1-CD2 3.41Å; I120-L172 VanDerWaalsContact CD1-CD2 3.41Å; I120-L172 HydrophobicContact CD1-CG 3.51Å; I120-L175 HydrophobicContact CD1-CD1 3.73Å; I120-L175 HydrophobicContact CG1-CD1 4.33Å |
| 121 | S | 91.4 | Very high | 88.5 | Confident | 99 Ų | 99 | 65 Ų | 65 | 69% | 0.692 | 35% | 0.351 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.9 | -18.1 | 174.6 | -53 | 0 | 0 | 0 | 0 | 113.9 | Y119 | Y119-S121 PolarHBondContact O-N 2.82Š|
| 122 | D | 93.1 | Very high | 89.2 | Confident | 78 Ų | 78 | 64.1 Ų | 64.1 | 42% | 0.417 | 35% | 0.348 | S | S | . | . | S | Bend | trans | -126.6 | 87 | 166.6 | -168.2 | -34.2 | 0 | 0 | 0 | 109.9 | Y119 I120 K124 E125 M126 | Y119-D122 CarbonylContact O-C 3.47Å; Y119-D122 WeakPolarHBondContact O-CA 3.34Å; Y119-D122 PolarHBondContact O-N 3.08Å; I120-D122 PolarHBondContact O-N 3.36Å; D122-K124 PolarHBondContact O-N 3.17Å; D122-K124 WeakPolarHBondContact OD1-CA 3.44Å; D122-K124 WeakPolarHBondContact OD1-CB 3.49Å; D122-K124 PolarHBondContact OD1-N 2.91Å; D122-E125 HydrophobicContact CB-CB 4.09Å; D122-E125 HydrophobicContact CB-CG 4.37Å; D122-E125 PolarHBondContact O-N 3.38Å; D122-E125 VanDerWaalsContact O-N 3.13Å; D122-E125 PolarHBondContact OD1-N 3.42Å; D122-M126 PolarHBondContact O-N 2.92Å |
| 123 | K | 92.4 | Very high | 89.8 | Confident | 28 Ų | 28 | 63.6 Ų | 63.6 | 12% | 0.122 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -52.2 | -27.5 | 178.5 | -59.5 | 173.3 | -177.4 | 177.5 | 0 | 113.4 | L127 L163 E164 L166 I171 | K123-L127 WeakPolarHBondContact O-CB 3.24Å; K123-L127 PolarHBondContact O-N 3.24Å; K123-L127 VanDerWaalsContact O-N 3.12Å; K123-L163 WeakPolarHBondContact CD-O 3.3Å; K123-L163 WeakPolarHBondContact CE-O 3.35Å; K123-L163 PolarHBondContact NZ-O 3.41Å; K123-E164 WeakPolarHBondContact CD-OE1 3.29Å; K123-E164 PolarHBondContact NZ-O 3.33Å; K123-E164 IonicContact NZ-OE1 3.8Å; K123-E164 PolarHBondContact NZ-OE1 2.82Å; K123-L166 WeakPolarHBondContact CE-O 3.41Å; K123-L166 PolarHBondContact NZ-O 3.49Å; K123-I171 HydrophobicContact CD-CD1 4.42Å; K123-I171 HydrophobicContact CG-CD1 4.29Å |
| 124 | K | 91.9 | Very high | 90.2 | Very high | 114 Ų | 114 | 60.7 Ų | 60.7 | 50% | 0.496 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -79.2 | -44.4 | -178.3 | -56.7 | 179.4 | -172 | 171.5 | 0 | 110.5 | D122 L127 Q128 Q160 | D122-K124 PolarHBondContact O-N 3.17Å; D122-K124 WeakPolarHBondContact OD1-CA 3.44Å; D122-K124 WeakPolarHBondContact OD1-CB 3.49Å; D122-K124 PolarHBondContact OD1-N 2.91Å; K124-L127 PolarHBondContact O-N 3.47Å; K124-Q128 WeakPolarHBondContact O-CB 3.41Å; K124-Q128 PolarHBondContact O-N 3.4Å; K124-Q160 HydrophobicContact CG-CG 4.17Å |
| 125 | E | 91.8 | Very high | 90.3 | Very high | 89 Ų | 89 | 56.8 Ų | 56.8 | 42% | 0.416 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -63.1 | -43.7 | 171.3 | -77.1 | -59.3 | 127.3 | 0 | 0 | 111.2 | Y119 D122 L127 Q128 Q129 | Y119-E125 HydrophobicContact CD1-CB 4.4Å; D122-E125 HydrophobicContact CB-CB 4.09Å; D122-E125 HydrophobicContact CB-CG 4.37Å; D122-E125 PolarHBondContact O-N 3.38Å; D122-E125 VanDerWaalsContact O-N 3.13Å; D122-E125 PolarHBondContact OD1-N 3.42Å; E125-L127 VanDerWaalsContact C-N 3.27Å; E125-L127 PolarHBondContact O-N 3.25Å; E125-Q128 WeakPolarHBondContact O-CB 3.45Å; E125-Q128 PolarHBondContact O-N 3.18Å; E125-Q128 VanDerWaalsContact O-N 3.13Å; E125-Q129 WeakPolarHBondContact O-CG 3.28Å; E125-Q129 PolarHBondContact O-N 3.1Å |
| 126 | M | 92.7 | Very high | 90.3 | Very high | 14 Ų | 14 | 56 Ų | 56 | 7% | 0.069 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -53.6 | -46.6 | 174.3 | -170.3 | -179 | 70.9 | 0 | 0 | 111.6 | V116 I120 D122 C130 L163 I171 | V116-M126 HydrophobicContact CG1-CG 3.71Å; V116-M126 HydrophobicContact CG1-SD 3.69Å; I120-M126 HydrophobicContact CG1-SD 3.83Å; D122-M126 PolarHBondContact O-N 2.92Å; M126-C130 PolarHBondContact O-N 3.12Å; M126-C130 PolarHBondContact O-SG 2.92Å; M126-L163 HydrophobicContact CE-CD2 3.39Å; M126-L163 HydrophobicContact CE-CG 4.1Å; M126-I171 HydrophobicContact CE-CG2 4.06Å; M126-I171 HydrophobicContact SD-CG2 4.21Å |
| 127 | L | 91.9 | Very high | 90.2 | Very high | 13 Ų | 13 | 59 Ų | 59 | 7% | 0.068 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -68.1 | -40.5 | 178.3 | -166.7 | 70.4 | 0 | 0 | 0 | 112.3 | K123 K124 E125 C130 F131 K156 C159 Q160 L163 | K123-L127 WeakPolarHBondContact O-CB 3.24Å; K123-L127 PolarHBondContact O-N 3.24Å; K123-L127 VanDerWaalsContact O-N 3.12Å; K124-L127 PolarHBondContact O-N 3.47Å; E125-L127 VanDerWaalsContact C-N 3.27Å; E125-L127 PolarHBondContact O-N 3.25Å; L127-C130 PolarHBondContact O-N 3.13Å; L127-F131 HydrophobicContact CD1-CD2 3.96Å; L127-F131 HydrophobicContact CD1-CE2 3.56Å; L127-F131 HydrophobicContact CG-CD2 3.98Å; L127-F131 HydrophobicContact CG-CE2 3.89Å; L127-F131 VanDerWaalsContact O-CD2 3.3Å; L127-F131 WeakPolarHBondContact O-CD2 3.42Å; L127-F131 PolarHBondContact O-N 3.21Å; L127-K156 HydrophobicContact CD2-CG 3.92Å; L127-K156 VanDerWaalsContact CD2-O 3.3Å; L127-K156 WeakPolarHBondContact CD2-O 3.44Å; L127-C159 HydrophobicContact CD1-CB 3.79Å; L127-C159 HydrophobicContact CD2-CB 3.99Å; L127-Q160 HydrophobicContact CD2-CB 3.74Å; L127-Q160 HydrophobicContact CD2-CG 4.43Å; L127-L163 HydrophobicContact CB-CD2 4.34Å; L127-L163 HydrophobicContact CD1-CD2 4.12Å |
| 128 | Q | 89.9 | Confident | 90.2 | Very high | 63 Ų | 63 | 61.7 Ų | 61.7 | 29% | 0.294 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -58.4 | -48.2 | 175.5 | -179.2 | 61.9 | 39.6 | 0 | 0 | 111.1 | K124 E125 F131 C132 | K124-Q128 WeakPolarHBondContact O-CB 3.41Å; K124-Q128 PolarHBondContact O-N 3.4Å; E125-Q128 WeakPolarHBondContact O-CB 3.45Å; E125-Q128 PolarHBondContact O-N 3.18Å; E125-Q128 VanDerWaalsContact O-N 3.13Å; Q128-F131 PolarHBondContact O-N 3.01Å; Q128-C132 PolarHBondContact NE2-SG 3.44Å; Q128-C132 PolarHBondContact O-N 3.46Å; Q128-C132 PolarHBondContact O-SG 3.18Å |
| 129 | Q | 89.4 | Confident | 90 | Very high | 58 Ų | 58 | 56.7 Ų | 56.7 | 27% | 0.271 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -61.3 | -45.8 | 176.9 | -62.2 | -55.1 | -36.4 | 0 | 0 | 110.9 | Y119 E125 F131 C132 I133 | Y119-Q129 HydrophobicContact CD1-CG 4.27Å; Y119-Q129 HydrophobicContact CE1-CG 3.91Å; Y119-Q129 HydrophobicContact CE2-CG 4.4Å; E125-Q129 WeakPolarHBondContact O-CG 3.28Å; E125-Q129 PolarHBondContact O-N 3.1Å; Q129-F131 PolarHBondContact O-N 2.68Å; Q129-C132 PolarHBondContact O-N 2.79Å; Q129-I133 HydrophobicContact CB-CD1 4.41Å; Q129-I133 WeakPolarHBondContact O-CB 3.37Å; Q129-I133 WeakPolarHBondContact O-CD1 3.3Å; Q129-I133 WeakPolarHBondContact O-CG1 3.32Å; Q129-I133 PolarHBondContact O-N 3.42Å |
| 130 | C | 89 | Confident | 89.9 | Confident | 41 Ų | 41 | 59 Ų | 59 | 28% | 0.277 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -58.3 | -43.7 | 177.2 | -67.5 | 0 | 0 | 0 | 0 | 112.8 | M126 L127 I134 | M126-C130 PolarHBondContact O-N 3.12Å; M126-C130 PolarHBondContact O-SG 2.92Å; L127-C130 PolarHBondContact O-N 3.13Å; C130-I134 WeakPolarHBondContact O-CB 3.26Å; C130-I134 WeakPolarHBondContact O-CD1 3.33Å; C130-I134 WeakPolarHBondContact O-CG1 3.48Å; C130-I134 PolarHBondContact O-N 3.22Å; C130-I134 VanDerWaalsContact O-N 3.08Å |
| 131 | F | 89.3 | Confident | 89.8 | Confident | 29 Ų | 29 | 67 Ų | 67 | 13% | 0.127 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -69.8 | -40.1 | 179.6 | -85.4 | -118.9 | 0 | 0 | 0 | 112.1 | L127 Q128 Q129 I134 G135 L139 V152 I155 K156 | L127-F131 HydrophobicContact CD1-CD2 3.96Å; L127-F131 HydrophobicContact CD1-CE2 3.56Å; L127-F131 HydrophobicContact CG-CD2 3.98Å; L127-F131 HydrophobicContact CG-CE2 3.89Å; L127-F131 VanDerWaalsContact O-CD2 3.3Å; L127-F131 WeakPolarHBondContact O-CD2 3.42Å; L127-F131 PolarHBondContact O-N 3.21Å; Q128-F131 PolarHBondContact O-N 3.01Å; Q129-F131 PolarHBondContact O-N 2.68Å; F131-I134 PolarHBondContact O-N 3.13Å; F131-G135 PolarHBondContact O-N 2.77Å; F131-L139 HydrophobicContact CD1-CD2 3.68Å; F131-L139 HydrophobicContact CE1-CD2 3.41Å; F131-L139 VanDerWaalsContact CE1-CD2 3.41Å; F131-L139 HydrophobicContact CZ-CD2 4.16Å; F131-V152 HydrophobicContact CD1-CG1 4.16Å; F131-V152 HydrophobicContact CE1-CG1 4.29Å; F131-I155 HydrophobicContact CE1-CG2 4.26Å; F131-I155 HydrophobicContact CZ-CG2 4.15Å; F131-K156 HydrophobicContact CD1-CB 4.31Å; F131-K156 HydrophobicContact CD1-CG 4.5Å; F131-K156 HydrophobicContact CE1-CB 3.82Å; F131-K156 HydrophobicContact CE1-CG 4.36Å; F131-K156 HydrophobicContact CZ-CB 4.13Å |
| 132 | C | 86.4 | Confident | 89.7 | Confident | 63 Ų | 63 | 67.4 Ų | 67.4 | 43% | 0.426 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -61.3 | -45.9 | 173.2 | -75.8 | 0 | 0 | 0 | 0 | 112.3 | Q128 Q129 I134 | Q128-C132 PolarHBondContact NE2-SG 3.44Å; Q128-C132 PolarHBondContact O-N 3.46Å; Q128-C132 PolarHBondContact O-SG 3.18Å; Q129-C132 PolarHBondContact O-N 2.79Å; C132-I134 VanDerWaalsContact C-N 3.3Å; C132-I134 PolarHBondContact O-N 3.04Å |
| 133 | I | 87.1 | Confident | 89.5 | Confident | 76 Ų | 76 | 64.9 Ų | 64.9 | 39% | 0.39 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -64.9 | -33.1 | -179.6 | -68.9 | 165.5 | 0 | 0 | 0 | 112.1 | L107 Q129 | L107-I133 HydrophobicContact CD2-CB 4.13Å; L107-I133 HydrophobicContact CD2-CG1 3.67Å; L107-I133 HydrophobicContact CD2-CG2 3.93Å; Q129-I133 HydrophobicContact CB-CD1 4.41Å; Q129-I133 WeakPolarHBondContact O-CB 3.37Å; Q129-I133 WeakPolarHBondContact O-CD1 3.3Å; Q129-I133 WeakPolarHBondContact O-CG1 3.32Å; Q129-I133 PolarHBondContact O-N 3.42Å |
| 134 | I | 87.7 | Confident | 89.6 | Confident | 44 Ų | 44 | 67.3 Ų | 67.3 | 23% | 0.226 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -80.8 | -43.6 | 179.6 | -68.4 | 167.5 | 0 | 0 | 0 | 110.8 | C130 F131 C132 K138 L139 M142 | C130-I134 WeakPolarHBondContact O-CB 3.26Å; C130-I134 WeakPolarHBondContact O-CD1 3.33Å; C130-I134 WeakPolarHBondContact O-CG1 3.48Å; C130-I134 PolarHBondContact O-N 3.22Å; C130-I134 VanDerWaalsContact O-N 3.08Å; F131-I134 PolarHBondContact O-N 3.13Å; C132-I134 VanDerWaalsContact C-N 3.3Å; C132-I134 PolarHBondContact O-N 3.04Å; I134-K138 HydrophobicContact CG2-CB 4.13Å; I134-K138 HydrophobicContact CG2-CD 4.22Å; I134-K138 HydrophobicContact CG2-CG 4.21Å; I134-K138 VanDerWaalsContact O-CB 3.25Å; I134-K138 WeakPolarHBondContact O-CB 3.36Å; I134-K138 WeakPolarHBondContact O-CD 2.96Å; I134-L139 HydrophobicContact CG2-CB 3.88Å; I134-L139 HydrophobicContact CG2-CD1 4.44Å; I134-M142 HydrophobicContact CD1-CE 4.23Å; I134-M142 HydrophobicContact CG1-CE 4.39Å; I134-M142 HydrophobicContact CG2-CE 3.42Å; I134-M142 VanDerWaalsContact CG2-CE 3.42Å |
| 135 | G | 88.4 | Confident | 89.5 | Confident | 6 Ų | 6 | 67.1 Ų | 67.1 | 6% | 0.062 | 34% | 0.335 | C | S | . | . | trans | 77.2 | 145.4 | -172 | 0 | 0 | 0 | 0 | 0 | 113.3 | G105 F131 K137 K138 L139 | G105-G135 VanDerWaalsContact CA-CA 3.47Å; F131-G135 PolarHBondContact O-N 2.77Å; G135-K137 PolarHBondContact O-N 3.49Å; G135-K138 PolarHBondContact O-N 3.42Å; G135-L139 WeakPolarHBondContact O-CB 3.32Å; G135-L139 PolarHBondContact O-N 3.25Å | ||
| 136 | E | 88.2 | Confident | 89.4 | Confident | 71 Ų | 71 | 68.8 Ų | 68.8 | 33% | 0.332 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -57.3 | -47.6 | -174.1 | 170.7 | 160.4 | -178.9 | 0 | 0 | 112.5 | K138 L139 Q140 V152 | E136-K138 VanDerWaalsContact C-N 3.27Å; E136-K138 PolarHBondContact O-N 3Å; E136-L139 WeakPolarHBondContact O-CB 3.44Å; E136-L139 PolarHBondContact O-N 3.02Å; E136-L139 VanDerWaalsContact O-N 3.14Å; E136-Q140 HydrophobicContact CG-CG 4.26Å; E136-Q140 PolarHBondContact O-N 3.23Å; E136-Q140 PolarHBondContact OE1-NE2 2.84Å; E136-V152 HydrophobicContact CG-CG2 3.78Å; E136-V152 WeakPolarHBondContact OE1-CG2 3.4Å |
| 137 | K | 87.4 | Confident | 89.1 | Confident | 122 Ų | 122 | 71 Ų | 71 | 53% | 0.53 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -61.8 | -34.2 | -175.5 | -61.9 | 170.2 | -170.3 | 162.6 | 0 | 112.8 | E104 G135 K141 | E104-K137 WeakPolarHBondContact OE2-CE 3.3Å; E104-K137 IonicContact OE2-NZ 2.59Å; G135-K137 PolarHBondContact O-N 3.49Å; K137-K141 WeakPolarHBondContact O-CG 3.36Å |
| 138 | K | 89.4 | Confident | 88.9 | Confident | 121 Ų | 121 | 74.6 Ų | 74.6 | 53% | 0.526 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -80 | -40.3 | 176.4 | -173.8 | -178.2 | 176.3 | -177.4 | 0 | 110.7 | I134 G135 E136 K141 M142 | I134-K138 HydrophobicContact CG2-CB 4.13Å; I134-K138 HydrophobicContact CG2-CD 4.22Å; I134-K138 HydrophobicContact CG2-CG 4.21Å; I134-K138 VanDerWaalsContact O-CB 3.25Å; I134-K138 WeakPolarHBondContact O-CB 3.36Å; I134-K138 WeakPolarHBondContact O-CD 2.96Å; G135-K138 PolarHBondContact O-N 3.42Å; E136-K138 VanDerWaalsContact C-N 3.27Å; E136-K138 PolarHBondContact O-N 3Å; K138-K141 PolarHBondContact O-N 2.95Å; K138-M142 HydrophobicContact CG-CE 4.22Å; K138-M142 HydrophobicContact CG-SD 4.26Å; K138-M142 WeakPolarHBondContact O-CG 3.45Å; K138-M142 PolarHBondContact O-N 3.04Å |
| 139 | L | 88.8 | Confident | 88.7 | Confident | 17 Ų | 17 | 78.7 Ų | 78.7 | 9% | 0.089 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -56.7 | -52 | 175.2 | -177.9 | 67.5 | 0 | 0 | 0 | 111 | F131 I134 G135 E136 K141 M142 L143 V152 | F131-L139 HydrophobicContact CD1-CD2 3.68Å; F131-L139 HydrophobicContact CE1-CD2 3.41Å; F131-L139 VanDerWaalsContact CE1-CD2 3.41Å; F131-L139 HydrophobicContact CZ-CD2 4.16Å; I134-L139 HydrophobicContact CG2-CB 3.88Å; I134-L139 HydrophobicContact CG2-CD1 4.44Å; G135-L139 WeakPolarHBondContact O-CB 3.32Å; G135-L139 PolarHBondContact O-N 3.25Å; E136-L139 WeakPolarHBondContact O-CB 3.44Å; E136-L139 PolarHBondContact O-N 3.02Å; E136-L139 VanDerWaalsContact O-N 3.14Å; L139-K141 PolarHBondContact O-N 3.01Å; L139-M142 PolarHBondContact O-N 3.2Å; L139-L143 HydrophobicContact CD1-CD1 4.43Å; L139-L143 HydrophobicContact CD1-CG 4.31Å; L139-L143 HydrophobicContact CG-CD1 3.94Å; L139-L143 HydrophobicContact CG-CG 4.28Å; L139-L143 VanDerWaalsContact O-CG 3.32Å; L139-L143 WeakPolarHBondContact O-CG 3.43Å; L139-L143 PolarHBondContact O-N 3.19Å; L139-V152 HydrophobicContact CD2-CG1 4.38Å |
| 140 | Q | 88.5 | Confident | 88.6 | Confident | 87 Ų | 87 | 78 Ų | 78 | 41% | 0.407 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -57.8 | -32.8 | 177.9 | -69.4 | -168.2 | 15.5 | 0 | 0 | 113.2 | E136 K148 | E136-Q140 HydrophobicContact CG-CG 4.26Å; E136-Q140 PolarHBondContact O-N 3.23Å; E136-Q140 PolarHBondContact OE1-NE2 2.84Å; Q140-K148 WeakPolarHBondContact O-CE 3.47Å |
| 141 | K | 90.1 | Very high | 88.7 | Confident | 173 Ų | 173 | 78.2 Ų | 78.2 | 75% | 0.752 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -73.7 | -31.4 | 175.3 | -72 | 175.5 | -178.3 | -178.7 | 0 | 113.3 | K137 K138 L139 | K137-K141 WeakPolarHBondContact O-CG 3.36Å; K138-K141 PolarHBondContact O-N 2.95Å; L139-K141 PolarHBondContact O-N 3.01Å |
| 142 | M | 89.5 | Confident | 88.7 | Confident | 109 Ų | 109 | 78.1 Ų | 78.1 | 54% | 0.537 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -85.9 | -19.8 | 178.6 | -65.4 | -172.9 | -49.8 | 0 | 0 | 113.6 | I134 K138 L139 | I134-M142 HydrophobicContact CD1-CE 4.23Å; I134-M142 HydrophobicContact CG1-CE 4.39Å; I134-M142 HydrophobicContact CG2-CE 3.42Å; I134-M142 VanDerWaalsContact CG2-CE 3.42Å; K138-M142 HydrophobicContact CG-CE 4.22Å; K138-M142 HydrophobicContact CG-SD 4.26Å; K138-M142 WeakPolarHBondContact O-CG 3.45Å; K138-M142 PolarHBondContact O-N 3.04Å; L139-M142 PolarHBondContact O-N 3.2Å |
| 143 | L | 90.7 | Very high | 88.9 | Confident | 24 Ų | 24 | 81.6 Ų | 81.6 | 13% | 0.126 | 42% | 0.416 | C | S | . | . | S | Bend | trans | -70.9 | 144.8 | 179.2 | -76.4 | 168.4 | 0 | 0 | 0 | 112.1 | L139 L147 K148 I155 | L139-L143 HydrophobicContact CD1-CD1 4.43Å; L139-L143 HydrophobicContact CD1-CG 4.31Å; L139-L143 HydrophobicContact CG-CD1 3.94Å; L139-L143 HydrophobicContact CG-CG 4.28Å; L139-L143 VanDerWaalsContact O-CG 3.32Å; L139-L143 WeakPolarHBondContact O-CG 3.43Å; L139-L143 PolarHBondContact O-N 3.19Å; L143-L147 HydrophobicContact CB-CB 4.37Å; L143-L147 HydrophobicContact CD2-CB 4.17Å; L143-L147 HydrophobicContact CD2-CD1 3.96Å; L143-K148 HydrophobicContact CB-CG 4.36Å; L143-K148 WeakPolarHBondContact O-CE 3.17Å; L143-I155 HydrophobicContact CD1-CD1 3.55Å; L143-I155 HydrophobicContact CD1-CG1 4.34Å; L143-I155 HydrophobicContact CD1-CG2 4.24Å; L143-I155 HydrophobicContact CD2-CG2 4.28Å |
| 144 | P | 92.8 | Very high | 89.2 | Confident | 79 Ų | 79 | 83 Ų | 83 | 51% | 0.513 | 42% | 0.421 | S | S | . | . | trans | -59.3 | 149.3 | 167.1 | -22.5 | 33.2 | 0 | 0 | 0 | 112.1 | V146 L147 K148 | P144-V146 PolarHBondContact O-N 3.14Å; P144-L147 PolarHBondContact O-N 3.06Å; P144-K148 PolarHBondContact O-N 3.05Å | ||
| 145 | D | 89.6 | Confident | 89.5 | Confident | 111 Ų | 111 | 81.3 Ų | 81.3 | 59% | 0.594 | 41% | 0.412 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.6 | -26.3 | -177.4 | -60.8 | -40.4 | 0 | 0 | 0 | 114.3 | L147 K148 N149 | D145-L147 VanDerWaalsContact C-N 3.29Å; D145-L147 PolarHBondContact O-N 2.89Å; D145-K148 WeakPolarHBondContact OD1-CD 3.37Å; D145-K148 VanDerWaalsContact OD1-CE 3.26Å; D145-K148 WeakPolarHBondContact OD1-CE 3.46Å; D145-K148 IonicContact OD1-NZ 2.84Å; D145-K148 PolarHBondContact OD1-NZ 3.3Å; D145-N149 PolarHBondContact O-ND2 3.25Å |
| 146 | V | 90.8 | Very high | 89.6 | Confident | 123 Ų | 123 | 84.1 Ų | 84.1 | 75% | 0.745 | 42% | 0.423 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.7 | -36 | 174 | -173.7 | 0 | 0 | 0 | 0 | 111.7 | P144 | P144-V146 PolarHBondContact O-N 3.14Š|
| 147 | L | 86.6 | Confident | 89.9 | Confident | 60 Ų | 60 | 87.3 Ų | 87.3 | 31% | 0.314 | 44% | 0.436 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -93.6 | -15.9 | -177.7 | -60.8 | -176.9 | 0 | 0 | 0 | 113.4 | L143 P144 D145 N149 C150 | L143-L147 HydrophobicContact CB-CB 4.37Å; L143-L147 HydrophobicContact CD2-CB 4.17Å; L143-L147 HydrophobicContact CD2-CD1 3.96Å; P144-L147 PolarHBondContact O-N 3.06Å; D145-L147 VanDerWaalsContact C-N 3.29Å; D145-L147 PolarHBondContact O-N 2.89Å; L147-N149 PolarHBondContact O-N 2.77Å; L147-N149 VanDerWaalsContact O-N 3.13Å; L147-C150 WeakPolarHBondContact O-CB 3.46Å; L147-C150 PolarHBondContact O-N 2.96Å |
| 148 | K | 87.8 | Confident | 90.1 | Very high | 89 Ų | 89 | 85.6 Ų | 85.6 | 39% | 0.387 | 43% | 0.432 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63 | -16.6 | 177.4 | -68 | -176.8 | -170.2 | 166.8 | 0 | 114.4 | Q140 L143 P144 D145 | Q140-K148 WeakPolarHBondContact O-CE 3.47Å; L143-K148 HydrophobicContact CB-CG 4.36Å; L143-K148 WeakPolarHBondContact O-CE 3.17Å; P144-K148 PolarHBondContact O-N 3.05Å; D145-K148 WeakPolarHBondContact OD1-CD 3.37Å; D145-K148 VanDerWaalsContact OD1-CE 3.26Å; D145-K148 WeakPolarHBondContact OD1-CE 3.46Å; D145-K148 IonicContact OD1-NZ 2.84Å; D145-K148 PolarHBondContact OD1-NZ 3.3Å |
| 149 | N | 85.8 | Confident | 90.3 | Very high | 149 Ų | 149 | 82 Ų | 82 | 80% | 0.797 | 42% | 0.421 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94.2 | -4.6 | 177.5 | -56.7 | -69.4 | 0 | 0 | 0 | 113.2 | D145 L147 | D145-N149 PolarHBondContact O-ND2 3.25Å; L147-N149 PolarHBondContact O-N 2.77Å; L147-N149 VanDerWaalsContact O-N 3.13Å |
| 150 | C | 87 | Confident | 90.5 | Very high | 43 Ų | 43 | 84.1 Ų | 84.1 | 29% | 0.291 | 43% | 0.431 | S | S | . | . | S | Bend | trans | -87.3 | 152.6 | 174.3 | -62.7 | 0 | 0 | 0 | 0 | 110.3 | L147 E154 I155 | L147-C150 WeakPolarHBondContact O-CB 3.46Å; L147-C150 PolarHBondContact O-N 2.96Å; C150-E154 HydrophobicContact CB-CB 4.4Å; C150-I155 HydrophobicContact CB-CD1 4.12Å; C150-I155 HydrophobicContact CB-CG1 3.79Å |
| 151 | S | 90.4 | Very high | 90.8 | Very high | 47 Ų | 47 | 85.1 Ų | 85.1 | 33% | 0.329 | 44% | 0.436 | S | S | . | . | trans | -73.2 | 156.3 | 174.3 | 95.7 | 0 | 0 | 0 | 0 | 111.2 | E153 E154 I155 | S151-E153 WeakPolarHBondContact CB-OE2 3.49Å; S151-E153 PolarHBondContact O-N 3.46Å; S151-E153 PolarHBondContact OG-N 3.36Å; S151-E153 PolarHBondContact OG-OE2 3.28Å; S151-E154 PolarHBondContact N-OE2 2.93Å; S151-E154 WeakPolarHBondContact O-CB 3.37Å; S151-E154 PolarHBondContact O-N 2.98Å; S151-E154 VanDerWaalsContact O-N 3.08Å; S151-E154 PolarHBondContact OG-N 2.93Å; S151-I155 WeakPolarHBondContact O-CD1 3.46Å; S151-I155 WeakPolarHBondContact O-CG1 3.49Å; S151-I155 PolarHBondContact O-N 3.49Å | ||
| 152 | V | 89.6 | Confident | 91 | Very high | 27 Ų | 27 | 82.7 Ų | 82.7 | 16% | 0.164 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -61.6 | -33.1 | 178.8 | 177.4 | 0 | 0 | 0 | 0 | 111.5 | F131 E136 L139 I155 K156 | F131-V152 HydrophobicContact CD1-CG1 4.16Å; F131-V152 HydrophobicContact CE1-CG1 4.29Å; E136-V152 HydrophobicContact CG-CG2 3.78Å; E136-V152 WeakPolarHBondContact OE1-CG2 3.4Å; L139-V152 HydrophobicContact CD2-CG1 4.38Å; V152-I155 PolarHBondContact O-N 2.92Å; V152-K156 WeakPolarHBondContact O-CB 3.36Å; V152-K156 PolarHBondContact O-N 3.47Å |
| 153 | E | 91.4 | Very high | 91.1 | Very high | 136 Ų | 136 | 79 Ų | 79 | 64% | 0.636 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -65.5 | -40.8 | 173.9 | -53.1 | 80.5 | -178 | 0 | 0 | 112.2 | S151 K157 | S151-E153 WeakPolarHBondContact CB-OE2 3.49Å; S151-E153 PolarHBondContact O-N 3.46Å; S151-E153 PolarHBondContact OG-N 3.36Å; S151-E153 PolarHBondContact OG-OE2 3.28Å; E153-K157 VanDerWaalsContact O-CB 3.31Å; E153-K157 WeakPolarHBondContact O-CB 3.41Å; E153-K157 PolarHBondContact O-N 3.35Å |
| 154 | E | 93.6 | Very high | 91.2 | Very high | 105 Ų | 105 | 82.8 Ų | 82.8 | 49% | 0.491 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -65.7 | -46.3 | 174.8 | -68.5 | 178.1 | 149.1 | 0 | 0 | 111.3 | C150 S151 K156 K157 L158 | C150-E154 HydrophobicContact CB-CB 4.4Å; S151-E154 PolarHBondContact N-OE2 2.93Å; S151-E154 WeakPolarHBondContact O-CB 3.37Å; S151-E154 PolarHBondContact O-N 2.98Å; S151-E154 VanDerWaalsContact O-N 3.08Å; S151-E154 PolarHBondContact OG-N 2.93Å; E154-K156 VanDerWaalsContact C-N 3.35Å; E154-K156 PolarHBondContact O-N 3.32Å; E154-K157 WeakPolarHBondContact O-CB 3.33Å; E154-K157 PolarHBondContact O-N 3.05Å; E154-L158 WeakPolarHBondContact O-CG 3.17Å; E154-L158 PolarHBondContact O-N 3.4Å |
| 155 | I | 92.3 | Very high | 91.2 | Very high | 8 Ų | 8 | 85.5 Ų | 85.5 | 4% | 0.041 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -59.9 | -46.7 | 177.3 | -65.9 | 154 | 0 | 0 | 0 | 110.3 | F131 L143 C150 S151 V152 K157 L158 C159 | F131-I155 HydrophobicContact CE1-CG2 4.26Å; F131-I155 HydrophobicContact CZ-CG2 4.15Å; L143-I155 HydrophobicContact CD1-CD1 3.55Å; L143-I155 HydrophobicContact CD1-CG1 4.34Å; L143-I155 HydrophobicContact CD1-CG2 4.24Å; L143-I155 HydrophobicContact CD2-CG2 4.28Å; C150-I155 HydrophobicContact CB-CD1 4.12Å; C150-I155 HydrophobicContact CB-CG1 3.79Å; S151-I155 WeakPolarHBondContact O-CD1 3.46Å; S151-I155 WeakPolarHBondContact O-CG1 3.49Å; S151-I155 PolarHBondContact O-N 3.49Å; V152-I155 PolarHBondContact O-N 2.92Å; I155-K157 PolarHBondContact O-N 2.9Å; I155-L158 PolarHBondContact O-N 3.22Å; I155-C159 PolarHBondContact O-N 2.55Å; I155-C159 PolarHBondContact O-SG 2.61Å |
| 156 | K | 91.5 | Very high | 91.3 | Very high | 65 Ų | 65 | 82.3 Ų | 82.3 | 28% | 0.283 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -60.7 | -43.6 | 175.9 | -174.7 | -173.7 | -178.9 | -172.2 | 0 | 111.5 | L127 F131 V152 E154 C159 Q160 | L127-K156 HydrophobicContact CD2-CG 3.92Å; L127-K156 VanDerWaalsContact CD2-O 3.3Å; L127-K156 WeakPolarHBondContact CD2-O 3.44Å; F131-K156 HydrophobicContact CD1-CB 4.31Å; F131-K156 HydrophobicContact CD1-CG 4.5Å; F131-K156 HydrophobicContact CE1-CB 3.82Å; F131-K156 HydrophobicContact CE1-CG 4.36Å; F131-K156 HydrophobicContact CZ-CB 4.13Å; V152-K156 WeakPolarHBondContact O-CB 3.36Å; V152-K156 PolarHBondContact O-N 3.47Å; E154-K156 VanDerWaalsContact C-N 3.35Å; E154-K156 PolarHBondContact O-N 3.32Å; K156-C159 PolarHBondContact O-N 2.76Å; K156-Q160 WeakPolarHBondContact O-CB 3.25Å; K156-Q160 PolarHBondContact O-N 2.97Å |
| 157 | K | 93.6 | Very high | 91.4 | Very high | 138 Ų | 138 | 79.7 Ų | 79.7 | 60% | 0.6 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -60.9 | -46.8 | 176.3 | -176.6 | -168.6 | 170.8 | -163.8 | 0 | 111.6 | E153 E154 I155 C159 Q160 E161 | E153-K157 VanDerWaalsContact O-CB 3.31Å; E153-K157 WeakPolarHBondContact O-CB 3.41Å; E153-K157 PolarHBondContact O-N 3.35Å; E154-K157 WeakPolarHBondContact O-CB 3.33Å; E154-K157 PolarHBondContact O-N 3.05Å; I155-K157 PolarHBondContact O-N 2.9Å; K157-C159 PolarHBondContact O-N 3.44Å; K157-Q160 WeakPolarHBondContact O-CB 3.37Å; K157-Q160 PolarHBondContact O-N 3.28Å; K157-E161 PolarHBondContact O-N 2.89Å |
| 158 | L | 93.2 | Very high | 91.7 | Very high | 87 Ų | 87 | 81.5 Ų | 81.5 | 46% | 0.455 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -61.8 | -42.9 | 177.6 | -70 | 171.4 | 0 | 0 | 0 | 111.5 | E154 I155 Q160 E161 Q162 | E154-L158 WeakPolarHBondContact O-CG 3.17Å; E154-L158 PolarHBondContact O-N 3.4Å; I155-L158 PolarHBondContact O-N 3.22Å; L158-Q160 VanDerWaalsContact C-N 3.34Å; L158-Q160 PolarHBondContact O-N 3.4Å; L158-E161 PolarHBondContact O-N 3.08Å; L158-Q162 VanDerWaalsContact O-CG 3.28Å; L158-Q162 WeakPolarHBondContact O-CG 3.4Å; L158-Q162 PolarHBondContact O-N 3.24Å |
| 159 | C | 93.1 | Very high | 91.9 | Very high | 44 Ų | 44 | 85.8 Ų | 85.8 | 30% | 0.297 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -63.1 | -40.6 | 175 | -64.1 | 0 | 0 | 0 | 0 | 111.7 | L127 I155 K156 K157 Q162 L163 | L127-C159 HydrophobicContact CD1-CB 3.79Å; L127-C159 HydrophobicContact CD2-CB 3.99Å; I155-C159 PolarHBondContact O-N 2.55Å; I155-C159 PolarHBondContact O-SG 2.61Å; K156-C159 PolarHBondContact O-N 2.76Å; K157-C159 PolarHBondContact O-N 3.44Å; C159-Q162 PolarHBondContact O-N 2.94Å; C159-L163 WeakPolarHBondContact O-CB 3.47Å; C159-L163 WeakPolarHBondContact O-CD1 3.28Å; C159-L163 PolarHBondContact O-N 3.33Å |
| 160 | Q | 93.9 | Very high | 92.2 | Very high | 62 Ų | 62 | 84 Ų | 84 | 29% | 0.29 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -64 | -43.3 | 177.2 | -165.6 | -161.1 | -52.8 | 0 | 0 | 111.9 | K124 L127 K156 K157 L158 L163 E164 | K124-Q160 HydrophobicContact CG-CG 4.17Å; L127-Q160 HydrophobicContact CD2-CB 3.74Å; L127-Q160 HydrophobicContact CD2-CG 4.43Å; K156-Q160 WeakPolarHBondContact O-CB 3.25Å; K156-Q160 PolarHBondContact O-N 2.97Å; K157-Q160 WeakPolarHBondContact O-CB 3.37Å; K157-Q160 PolarHBondContact O-N 3.28Å; L158-Q160 VanDerWaalsContact C-N 3.34Å; L158-Q160 PolarHBondContact O-N 3.4Å; Q160-L163 PolarHBondContact O-N 3.48Å; Q160-E164 WeakPolarHBondContact O-CB 3.44Å; Q160-E164 PolarHBondContact O-N 2.84Å |
| 161 | E | 94.5 | Very high | 92.5 | Very high | 109 Ų | 109 | 82.5 Ų | 82.5 | 51% | 0.509 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -61.2 | -44.9 | 176.7 | -173.7 | 168.2 | -177.2 | 0 | 0 | 111.2 | K157 L158 E164 L165 | K157-E161 PolarHBondContact O-N 2.89Å; L158-E161 PolarHBondContact O-N 3.08Å; E161-E164 WeakPolarHBondContact O-CB 3.28Å; E161-E164 PolarHBondContact O-N 3.41Å; E161-L165 PolarHBondContact O-N 3.3Å |
| 162 | Q | 94 | Very high | 92.6 | Very high | 122 Ų | 122 | 83.3 Ų | 83.3 | 57% | 0.57 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -66.3 | -37.9 | 176.5 | -67.2 | -67.8 | 91.2 | 0 | 0 | 113 | L158 C159 E164 L166 | L158-Q162 VanDerWaalsContact O-CG 3.28Å; L158-Q162 WeakPolarHBondContact O-CG 3.4Å; L158-Q162 PolarHBondContact O-N 3.24Å; C159-Q162 PolarHBondContact O-N 2.94Å; Q162-E164 VanDerWaalsContact C-N 3.32Å; Q162-L166 WeakPolarHBondContact O-CG 3.41Å |
| 163 | L | 91.6 | Very high | 92.7 | Very high | 32 Ų | 32 | 85.6 Ų | 85.6 | 17% | 0.168 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -65.5 | -35 | 172.4 | -100.5 | 57.5 | 0 | 0 | 0 | 111.9 | K123 M126 L127 C159 Q160 L165 L166 | K123-L163 WeakPolarHBondContact CD-O 3.3Å; K123-L163 WeakPolarHBondContact CE-O 3.35Å; K123-L163 PolarHBondContact NZ-O 3.41Å; M126-L163 HydrophobicContact CE-CD2 3.39Å; M126-L163 HydrophobicContact CE-CG 4.1Å; L127-L163 HydrophobicContact CB-CD2 4.34Å; L127-L163 HydrophobicContact CD1-CD2 4.12Å; C159-L163 WeakPolarHBondContact O-CB 3.47Å; C159-L163 WeakPolarHBondContact O-CD1 3.28Å; C159-L163 PolarHBondContact O-N 3.33Å; Q160-L163 PolarHBondContact O-N 3.48Å; L163-L165 VanDerWaalsContact C-N 3.28Å; L163-L165 PolarHBondContact O-N 2.88Å; L163-L166 PolarHBondContact O-N 2.88Å; L163-L166 VanDerWaalsContact O-N 3.08Å |
| 164 | E | 93.2 | Very high | 92.7 | Very high | 102 Ų | 102 | 83.2 Ų | 83.2 | 48% | 0.477 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -64.3 | -37 | -179.3 | -159.7 | 61.3 | -92.2 | 0 | 0 | 111.6 | K123 Q160 E161 Q162 L166 | K123-E164 WeakPolarHBondContact CD-OE1 3.29Å; K123-E164 PolarHBondContact NZ-O 3.33Å; K123-E164 IonicContact NZ-OE1 3.8Å; K123-E164 PolarHBondContact NZ-OE1 2.82Å; Q160-E164 WeakPolarHBondContact O-CB 3.44Å; Q160-E164 PolarHBondContact O-N 2.84Å; E161-E164 WeakPolarHBondContact O-CB 3.28Å; E161-E164 PolarHBondContact O-N 3.41Å; Q162-E164 VanDerWaalsContact C-N 3.32Å; E164-L166 PolarHBondContact O-N 3.26Å |
| 165 | L | 92.6 | Very high | 92.6 | Very high | 137 Ų | 137 | 82.5 Ų | 82.5 | 72% | 0.717 | 40% | 0.403 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.8 | -12.4 | 174 | -61.7 | 175.3 | 0 | 0 | 0 | 114.4 | E161 L163 | E161-L165 PolarHBondContact O-N 3.3Å; L163-L165 VanDerWaalsContact C-N 3.28Å; L163-L165 PolarHBondContact O-N 2.88Å |
| 166 | L | 90.9 | Very high | 92.6 | Very high | 44 Ų | 44 | 89.1 Ų | 89.1 | 23% | 0.23 | 43% | 0.434 | C | S | . | . | S | Bend | trans | -96.6 | 136.2 | 177.3 | -58.7 | 176 | 0 | 0 | 0 | 110.9 | K123 Q162 L163 E164 K170 I171 I174 | K123-L166 WeakPolarHBondContact CE-O 3.41Å; K123-L166 PolarHBondContact NZ-O 3.49Å; Q162-L166 WeakPolarHBondContact O-CG 3.41Å; L163-L166 PolarHBondContact O-N 2.88Å; L163-L166 VanDerWaalsContact O-N 3.08Å; E164-L166 PolarHBondContact O-N 3.26Å; L166-K170 HydrophobicContact CD2-CD 3.73Å; L166-K170 HydrophobicContact CD2-CG 4.32Å; L166-I171 HydrophobicContact CB-CD1 4.11Å; L166-I171 HydrophobicContact CB-CG1 3.77Å; L166-I171 HydrophobicContact CD1-CG1 4.31Å; L166-I174 HydrophobicContact CD1-CD1 4.46Å |
| 167 | S | 92.7 | Very high | 92.4 | Very high | 68 Ų | 68 | 88.1 Ų | 88.1 | 48% | 0.476 | 44% | 0.442 | S | S | . | . | trans | -72.9 | 150.6 | 170.3 | 65.5 | 0 | 0 | 0 | 0 | 111 | K169 K170 I171 | S167-K169 PolarHBondContact O-N 3.49Å; S167-K170 WeakPolarHBondContact O-CA 3.3Å; S167-K170 WeakPolarHBondContact O-CB 3.47Å; S167-K170 PolarHBondContact O-N 2.73Å; S167-K170 WeakPolarHBondContact OG-CB 3.31Å; S167-K170 PolarHBondContact OG-N 2.62Å; S167-I171 PolarHBondContact O-N 3.39Å | ||
| 168 | E | 93.3 | Very high | 91.9 | Very high | 98 Ų | 98 | 85.7 Ų | 85.7 | 46% | 0.458 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -53.7 | -41.6 | 178.4 | -65.6 | 178 | -151.1 | 0 | 0 | 112.2 | I120 K170 I171 L172 | I120-E168 HydrophobicContact CG2-CB 3.67Å; I120-E168 HydrophobicContact CG2-CG 3.9Å; E168-K170 VanDerWaalsContact C-N 3.33Å; E168-K170 PolarHBondContact O-N 3.03Å; E168-I171 PolarHBondContact O-N 3.16Å; E168-L172 PolarHBondContact O-N 3.37Å |
| 169 | K | 92.4 | Very high | 90.5 | Very high | 179 Ų | 179 | 87.1 Ų | 87.1 | 78% | 0.778 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -58 | -42.7 | 174.1 | -63.4 | -176.8 | -179 | 179.7 | 0 | 112.1 | S167 L172 K173 | S167-K169 PolarHBondContact O-N 3.49Å; K169-L172 PolarHBondContact O-N 2.94Å; K169-K173 WeakPolarHBondContact O-CB 3.21Å; K169-K173 PolarHBondContact O-N 3.49Å |
| 170 | K | 92.4 | Very high | 88.9 | Confident | 112 Ų | 112 | 86.7 Ų | 86.7 | 49% | 0.487 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -69.5 | -36.9 | 178.7 | -175.1 | 169.2 | 178.2 | 179.6 | 0 | 111.6 | L166 S167 E168 K173 I174 | L166-K170 HydrophobicContact CD2-CD 3.73Å; L166-K170 HydrophobicContact CD2-CG 4.32Å; S167-K170 WeakPolarHBondContact O-CA 3.3Å; S167-K170 WeakPolarHBondContact O-CB 3.47Å; S167-K170 PolarHBondContact O-N 2.73Å; S167-K170 WeakPolarHBondContact OG-CB 3.31Å; S167-K170 PolarHBondContact OG-N 2.62Å; E168-K170 VanDerWaalsContact C-N 3.33Å; E168-K170 PolarHBondContact O-N 3.03Å; K170-K173 PolarHBondContact O-N 3.48Å; K170-I174 HydrophobicContact CG-CD1 4.06Å; K170-I174 WeakPolarHBondContact O-CD1 3.3Å; K170-I174 VanDerWaalsContact O-CG1 3.23Å; K170-I174 WeakPolarHBondContact O-CG1 3.44Å; K170-I174 PolarHBondContact O-N 2.89Å |
| 171 | I | 93.2 | Very high | 87.1 | Confident | 11 Ų | 11 | 92 Ų | 92 | 6% | 0.056 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -64.5 | -45.8 | 174.5 | -62 | 170.3 | 0 | 0 | 0 | 110.5 | I120 K123 M126 L166 S167 E168 I174 L175 | I120-I171 HydrophobicContact CD1-CG2 3.99Å; I120-I171 HydrophobicContact CG1-CG2 3.98Å; I120-I171 HydrophobicContact CG2-CB 4.3Å; I120-I171 HydrophobicContact CG2-CG2 4.32Å; K123-I171 HydrophobicContact CD-CD1 4.42Å; K123-I171 HydrophobicContact CG-CD1 4.29Å; M126-I171 HydrophobicContact CE-CG2 4.06Å; M126-I171 HydrophobicContact SD-CG2 4.21Å; L166-I171 HydrophobicContact CB-CD1 4.11Å; L166-I171 HydrophobicContact CB-CG1 3.77Å; L166-I171 HydrophobicContact CD1-CG1 4.31Å; S167-I171 PolarHBondContact O-N 3.39Å; E168-I171 PolarHBondContact O-N 3.16Å; I171-I174 PolarHBondContact O-N 2.86Å; I171-L175 HydrophobicContact CG2-CD1 3.98Å; I171-L175 WeakPolarHBondContact O-CG 3.31Å; I171-L175 PolarHBondContact O-N 3.49Å; I171-L175 VanDerWaalsContact O-N 3.07Å |
| 172 | L | 91.6 | Very high | 84.9 | Confident | 64 Ų | 64 | 93.1 Ų | 93.1 | 34% | 0.335 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -55.6 | -53.2 | 172.7 | -82.7 | 167.9 | 0 | 0 | 0 | 111.6 | I120 E168 K169 I174 L175 E176 | I120-L172 HydrophobicContact CD1-CB 4.38Å; I120-L172 HydrophobicContact CD1-CD2 3.41Å; I120-L172 VanDerWaalsContact CD1-CD2 3.41Å; I120-L172 HydrophobicContact CD1-CG 3.51Å; E168-L172 PolarHBondContact O-N 3.37Å; K169-L172 PolarHBondContact O-N 2.94Å; L172-I174 VanDerWaalsContact C-N 3.28Å; L172-I174 PolarHBondContact O-N 3.34Å; L172-L175 PolarHBondContact O-N 3.21Å; L172-E176 WeakPolarHBondContact O-CG 3.5Å; L172-E176 PolarHBondContact O-N 2.9Å |
| 173 | K | 91.9 | Very high | 82.7 | Confident | 75 Ų | 75 | 91.8 Ų | 91.8 | 33% | 0.326 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -54.7 | -42.5 | -179.3 | -153.1 | -164.9 | 171 | -177.7 | 0 | 112.3 | K169 K170 E176 G177 D178 G180 | K169-K173 WeakPolarHBondContact O-CB 3.21Å; K169-K173 PolarHBondContact O-N 3.49Å; K170-K173 PolarHBondContact O-N 3.48Å; K173-E176 PolarHBondContact O-N 2.96Å; K173-G177 PolarHBondContact O-N 3.44Å; K173-D178 WeakPolarHBondContact CD-O 3.49Å; K173-D178 WeakPolarHBondContact CE-O 3.19Å; K173-D178 WeakPolarHBondContact CE-OD1 3.23Å; K173-D178 WeakPolarHBondContact CE-OD2 3.43Å; K173-D178 HydrophobicContact CG-CB 3.9Å; K173-D178 VanDerWaalsContact CG-O 3.28Å; K173-D178 WeakPolarHBondContact CG-O 3.32Å; K173-D178 IonicContact NZ-OD1 3.78Å; K173-D178 IonicContact NZ-OD2 2.77Å; K173-D178 CarbonylContact O-C 3.07Å; K173-D178 PolarHBondContact O-N 3.34Å; K173-G180 PolarHBondContact NZ-O 3.23Å |
| 174 | I | 92.2 | Very high | 80.6 | Confident | 85 Ų | 85 | 98.5 Ų | 98.5 | 44% | 0.436 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -65 | -42.1 | 175.8 | -69.3 | 163.2 | 0 | 0 | 0 | 111.8 | L166 K170 I171 L172 G177 | L166-I174 HydrophobicContact CD1-CD1 4.46Å; K170-I174 HydrophobicContact CG-CD1 4.06Å; K170-I174 WeakPolarHBondContact O-CD1 3.3Å; K170-I174 VanDerWaalsContact O-CG1 3.23Å; K170-I174 WeakPolarHBondContact O-CG1 3.44Å; K170-I174 PolarHBondContact O-N 2.89Å; I171-I174 PolarHBondContact O-N 2.86Å; L172-I174 VanDerWaalsContact C-N 3.28Å; L172-I174 PolarHBondContact O-N 3.34Å; I174-G177 PolarHBondContact O-N 3.08Å |
| 175 | L | 90.9 | Very high | 78.2 | Confident | 91 Ų | 91 | 100 Ų | 100 | 48% | 0.476 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -70.9 | -29.7 | 179.9 | -70.9 | 167.3 | 0 | 0 | 0 | 113.1 | V116 I120 I171 L172 G177 | V116-L175 HydrophobicContact CB-CD1 4.43Å; V116-L175 HydrophobicContact CG1-CD1 3.91Å; V116-L175 HydrophobicContact CG1-CD2 4.22Å; I120-L175 HydrophobicContact CD1-CD1 3.73Å; I120-L175 HydrophobicContact CG1-CD1 4.33Å; I171-L175 HydrophobicContact CG2-CD1 3.98Å; I171-L175 WeakPolarHBondContact O-CG 3.31Å; I171-L175 PolarHBondContact O-N 3.49Å; I171-L175 VanDerWaalsContact O-N 3.07Å; L172-L175 PolarHBondContact O-N 3.21Å; L175-G177 PolarHBondContact O-N 3.41Å |
| 176 | E | 91.5 | Very high | 76.2 | Confident | 147 Ų | 147 | 102.6 Ų | 102.6 | 69% | 0.687 | 54% | 0.539 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.1 | -8.8 | 172.7 | -71.2 | 169.2 | -171.8 | 0 | 0 | 112.6 | L172 K173 D178 | L172-E176 WeakPolarHBondContact O-CG 3.5Å; L172-E176 PolarHBondContact O-N 2.9Å; K173-E176 PolarHBondContact O-N 2.96Å; E176-D178 VanDerWaalsContact C-N 3.3Å |
| 177 | G | 88.5 | Confident | 73.8 | Confident | 44 Ų | 44 | 107.9 Ų | 107.9 | 45% | 0.454 | 56% | 0.562 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 84.8 | -1.1 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | K173 I174 L175 N179 | K173-G177 PolarHBondContact O-N 3.44Å; I174-G177 PolarHBondContact O-N 3.08Å; L175-G177 PolarHBondContact O-N 3.41Å; G177-N179 PolarHBondContact O-N 3.37Å; G177-N179 PolarHBondContact O-ND2 3.49Å |
| 178 | D | 82.6 | Confident | 71.6 | Confident | 86 Ų | 86 | 114.2 Ų | 114.2 | 46% | 0.46 | 59% | 0.585 | S | S | . | * | trans | -78.4 | 71.8 | 171 | -179 | 2.6 | 0 | 0 | 0 | 109.7 | K173 E176 G180 | K173-D178 WeakPolarHBondContact CD-O 3.49Å; K173-D178 WeakPolarHBondContact CE-O 3.19Å; K173-D178 WeakPolarHBondContact CE-OD1 3.23Å; K173-D178 WeakPolarHBondContact CE-OD2 3.43Å; K173-D178 HydrophobicContact CG-CB 3.9Å; K173-D178 VanDerWaalsContact CG-O 3.28Å; K173-D178 WeakPolarHBondContact CG-O 3.32Å; K173-D178 IonicContact NZ-OD1 3.78Å; K173-D178 IonicContact NZ-OD2 2.77Å; K173-D178 CarbonylContact O-C 3.07Å; K173-D178 PolarHBondContact O-N 3.34Å; E176-D178 VanDerWaalsContact C-N 3.3Å; D178-G180 PolarHBondContact O-N 2.93Å; D178-G180 PolarHBondContact OD1-N 2.96Å; D178-G180 VanDerWaalsContact OD1-N 3.08Å | ||
| 179 | N | 62.8 | Low | 69.3 | Low | 117 Ų | 117 | 113.3 Ų | 113.3 | 63% | 0.626 | 59% | 0.594 | S | S | * | * | trans | -78 | 47 | 166.8 | 38.3 | 60.7 | 0 | 0 | 0 | 111.1 | G177 L181 | G177-N179 PolarHBondContact O-N 3.37Å; G177-N179 PolarHBondContact O-ND2 3.49Å; N179-L181 PolarHBondContact O-N 2.76Å | ||
| 180 | G | 60.7 | Low | 67.5 | Low | 35 Ų | 35 | 112.6 Ų | 112.6 | 36% | 0.361 | 60% | 0.599 | S | S | . | * | trans | -58.9 | 86.6 | 158.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | K173 D178 D182 | K173-G180 PolarHBondContact NZ-O 3.23Å; D178-G180 PolarHBondContact O-N 2.93Å; D178-G180 PolarHBondContact OD1-N 2.96Å; D178-G180 VanDerWaalsContact OD1-N 3.08Å; G180-D182 PolarHBondContact O-N 2.93Å | ||
| 181 | L | 55.5 | Low | 65.2 | Low | 174 Ų | 174 | 114.3 Ų | 114.3 | 91% | 0.911 | 61% | 0.613 | S | S | * | * | trans | -65.7 | 29.8 | 161.2 | -65.1 | 167.5 | 0 | 0 | 0 | 111.1 | N179 T183 | N179-L181 PolarHBondContact O-N 2.76Å; L181-T183 VanDerWaalsContact C-N 3.33Å; L181-T183 PolarHBondContact O-N 3.3Å | ||
| 182 | D | 49.4 | Very low | 63.1 | Low | 133 Ų | 133 | 117 Ų | 117 | 71% | 0.711 | 64% | 0.644 | S | S | * | * | trans | -78.2 | 93.6 | -178.9 | -155.5 | -10.7 | 0 | 0 | 0 | 107.9 | G180 | G180-D182 PolarHBondContact O-N 2.93Š| ||
| 183 | T | 46.5 | Very low | 60.6 | Low | 94 Ų | 94 | 120.1 Ų | 120.1 | 58% | 0.577 | 67% | 0.67 | S | S | * | * | trans | 57.3 | 120.2 | 147.3 | -39.4 | 0 | 0 | 0 | 0 | 117.6 | L181 M185 | L181-T183 VanDerWaalsContact C-N 3.33Å; L181-T183 PolarHBondContact O-N 3.3Å; T183-M185 HydrophobicContact CG2-CB 3.8Å; T183-M185 PolarHBondContact O-N 3.02Å | ||
| 184 | D | 47.2 | Very low | 58.6 | Low | 172 Ų | 172 | 125.4 Ų | 125.4 | 92% | 0.92 | 69% | 0.692 | S | S | * | * | trans | -63 | 79.8 | 154.7 | -170.8 | 59.2 | 0 | 0 | 0 | 108.8 | ||||
| 185 | M | 44.4 | Very low | 56.6 | Low | 134 Ų | 134 | 128.3 Ų | 128.3 | 66% | 0.66 | 71% | 0.714 | S | S | * | * | trans | -131.4 | 99.9 | 177.2 | -173.9 | 83.1 | 178.2 | 0 | 0 | 106.7 | T183 E187 | T183-M185 HydrophobicContact CG2-CB 3.8Å; T183-M185 PolarHBondContact O-N 3.02Å; M185-E187 PolarHBondContact O-N 2.83Å; M185-E187 VanDerWaalsContact O-N 3.1Å | ||
| 186 | E | 49.2 | Very low | 54 | Low | 192 Ų | 192 | 128.2 Ų | 128.2 | 90% | 0.897 | 73% | 0.726 | S | S | * | * | trans | -67.4 | 107.2 | 165.7 | -67.7 | -157.7 | 156.1 | 0 | 0 | 108.7 | ||||
| 187 | E | 40.3 | Very low | 51.9 | Low | 154 Ų | 154 | 127.7 Ų | 127.7 | 72% | 0.72 | 74% | 0.739 | S | S | * | * | trans | -129.1 | 96.6 | 157.7 | -160.7 | 163.9 | -155.9 | 0 | 0 | 109 | M185 A189 | M185-E187 PolarHBondContact O-N 2.83Å; M185-E187 VanDerWaalsContact O-N 3.1Å; E187-A189 VanDerWaalsContact C-N 3.3Å; E187-A189 HydrophobicContact CG-CB 4.5Å; E187-A189 PolarHBondContact O-N 3.2Å | ||
| 188 | E | 46.8 | Very low | 50 | Low | 201 Ų | 201 | 132.3 Ų | 132.3 | 94% | 0.939 | 75% | 0.753 | S | S | * | * | trans | -63.7 | 91.1 | 165 | -78 | -86.8 | 114.9 | 0 | 0 | 108.7 | ||||
| 189 | A | 46.1 | Very low | 48.2 | Very low | 80 Ų | 80 | 135.6 Ų | 135.6 | 66% | 0.661 | 77% | 0.77 | S | S | * | * | trans | -125.9 | 93.5 | 171.8 | 0 | 0 | 0 | 0 | 0 | 110.5 | E187 D191 | E187-A189 VanDerWaalsContact C-N 3.3Å; E187-A189 HydrophobicContact CG-CB 4.5Å; E187-A189 PolarHBondContact O-N 3.2Å; A189-D191 PolarHBondContact O-N 3.39Å | ||
| 190 | D | 53.3 | Low | 47.8 | Very low | 163 Ų | 163 | 138.4 Ų | 138.4 | 87% | 0.872 | 78% | 0.783 | S | S | * | * | trans | -52.1 | 116 | 156.3 | 177.2 | 56.6 | 0 | 0 | 0 | 110.7 | ||||
| 191 | D | 44.2 | Very low | 47.2 | Very low | 149 Ų | 149 | 141.2 Ų | 141.2 | 80% | 0.797 | 80% | 0.797 | S | S | * | * | -160.6 | 142.4 | 129 | -165.4 | -135.7 | 0 | 0 | 0 | 110.7 | A189 | A189-D191 PolarHBondContact O-N 3.39Š| |||
| 192 | G | 49.9 | Very low | 47.3 | Very low | 68 Ų | 68 | 141.3 Ų | 141.3 | 70% | 0.701 | 79% | 0.793 | S | S | * | * | trans | -96.4 | 117.6 | -174.3 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 193 | C | 38.9 | Very low | 47.4 | Very low | 129 Ų | 129 | 143.1 Ų | 143.1 | 87% | 0.872 | 80% | 0.797 | S | S | * | * | trans | -127 | 123.3 | 161.1 | -137.5 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 194 | K | 50.3 | Low | 47.4 | Very low | 185 Ų | 185 | 145.9 Ų | 145.9 | 80% | 0.804 | 81% | 0.808 | S | S | * | * | trans | -91.7 | 159.7 | 165.1 | -64.1 | 177.7 | 177.8 | 179.1 | 0 | 108.5 | ||||
| 195 | V | 48.7 | Very low | 47.6 | Very low | 147 Ų | 147 | 142.4 Ų | 142.4 | 89% | 0.891 | 80% | 0.803 | S | S | * | * | trans | 77.5 | 154.5 | 167.4 | -45.8 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 196 | A | 37.6 | Very low | 47.9 | Very low | 88 Ų | 88 | 141 Ų | 141 | 73% | 0.727 | 81% | 0.806 | S | S | * | * | trans | 79.3 | 72.9 | 179.7 | 0 | 0 | 0 | 0 | 0 | 117.3 | D198 | A196-D198 PolarHBondContact O-N 2.98Š| ||
| 197 | S | 46.3 | Very low | 48 | Very low | 136 Ų | 136 | 138.7 Ų | 138.7 | 95% | 0.951 | 80% | 0.804 | S | S | * | * | trans | -67.9 | 82.6 | 145.8 | -64.4 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 198 | D | 48.5 | Very low | 48.1 | Very low | 142 Ų | 142 | 138.2 Ų | 138.2 | 76% | 0.759 | 81% | 0.807 | S | S | * | * | trans | -145.2 | 89.1 | 172.5 | -137.1 | -37.4 | 0 | 0 | 0 | 108.7 | A196 | A196-D198 PolarHBondContact O-N 2.98Š| ||
| 199 | L | 46.2 | Very low | 48.6 | Very low | 155 Ų | 155 | 132.8 Ų | 132.8 | 81% | 0.812 | 79% | 0.791 | S | S | * | * | trans | -167.4 | 62.2 | 164.3 | -106.5 | 167.4 | 0 | 0 | 0 | 110 | S201 | L199-S201 PolarHBondContact O-N 3.22Š| ||
| 200 | I | 52.9 | Low | 49.3 | Very low | 175 Ų | 175 | 136.1 Ų | 136.1 | 90% | 0.897 | 80% | 0.803 | S | S | * | * | trans | -65.6 | 95.9 | 149.3 | -81.1 | 171.4 | 0 | 0 | 0 | 106.4 | ||||
| 201 | S | 48.9 | Very low | 49.3 | Very low | 94 Ų | 94 | 134 Ų | 134 | 66% | 0.657 | 80% | 0.801 | S | S | * | * | trans | -135.8 | 47.3 | 166.5 | -169.4 | 0 | 0 | 0 | 0 | 109.7 | L199 Q203 | L199-S201 PolarHBondContact O-N 3.22Å; S201-Q203 PolarHBondContact O-N 3.42Å | ||
| 202 | Q | 57.6 | Low | 49.2 | Very low | 176 Ų | 176 | 131.7 Ų | 131.7 | 82% | 0.822 | 80% | 0.797 | S | S | * | * | trans | -84.4 | 78.3 | 174.1 | -174.2 | -174.5 | 95.3 | 0 | 0 | 109.7 | ||||
| 203 | Q | 51.2 | Low | 48.8 | Very low | 172 Ų | 172 | 134.8 Ų | 134.8 | 80% | 0.804 | 80% | 0.797 | S | S | * | * | trans | 172.3 | 95.8 | 155.9 | -100.1 | 155.5 | 89.8 | 0 | 0 | 110 | S201 | S201-Q203 PolarHBondContact O-N 3.42Š| ||
| 204 | D | 47.9 | Very low | 48.9 | Very low | 152 Ų | 152 | 138.5 Ų | 138.5 | 81% | 0.813 | 79% | 0.792 | S | S | * | * | trans | -179.7 | 64.7 | 142.3 | -101.5 | -40.4 | 0 | 0 | 0 | 110.6 | C206 | D204-C206 VanDerWaalsContact C-N 3.26Å; D204-C206 PolarHBondContact O-N 2.91Å | ||
| 205 | A | 49.9 | Very low | 48.2 | Very low | 98 Ų | 98 | 137.7 Ų | 137.7 | 81% | 0.81 | 79% | 0.791 | S | S | * | * | trans | -88.4 | 74 | 158.9 | 0 | 0 | 0 | 0 | 0 | 107.6 | V207 | A205-V207 PolarHBondContact O-N 3.44Š| ||
| 206 | C | 50.3 | Low | 47.4 | Very low | 105 Ų | 105 | 136 Ų | 136 | 71% | 0.709 | 78% | 0.778 | S | S | * | * | trans | -65 | 118.7 | -173.3 | 46.6 | 0 | 0 | 0 | 0 | 112.1 | D204 | D204-C206 VanDerWaalsContact C-N 3.26Å; D204-C206 PolarHBondContact O-N 2.91Å | ||
| 207 | V | 52.9 | Low | 47.3 | Very low | 144 Ų | 144 | 140.9 Ų | 140.9 | 87% | 0.873 | 78% | 0.782 | S | S | * | * | trans | -102.2 | 78.3 | 178.2 | -173.8 | 0 | 0 | 0 | 0 | 109.8 | A205 | A205-V207 PolarHBondContact O-N 3.44Š| ||
| 208 | D | 40.8 | Very low | 47 | Very low | 144 Ų | 144 | 143 Ų | 143 | 77% | 0.77 | 78% | 0.777 | S | S | * | * | trans | -166.8 | 147.7 | 159 | -147.9 | 31 | 0 | 0 | 0 | 107.8 | ||||
| 209 | S | 58.2 | Low | 47.2 | Very low | 87 Ų | 87 | 140.7 Ų | 140.7 | 61% | 0.608 | 77% | 0.77 | S | S | * | * | cis | -146.6 | 146.6 | 18 | -40.7 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 210 | T | 61.3 | Low | 46.6 | Very low | 150 Ų | 150 | 142.6 Ų | 142.6 | 92% | 0.92 | 78% | 0.775 | S | S | * | * | trans | -93.1 | 96.3 | 155.3 | 49.7 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 211 | S | 52.1 | Low | 45.6 | Very low | 117 Ų | 117 | 137.6 Ų | 137.6 | 82% | 0.818 | 77% | 0.766 | S | S | * | * | trans | -152.7 | 152.9 | 174.6 | -167.3 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 212 | S | 41.9 | Very low | 44.9 | Very low | 102 Ų | 102 | 140.5 Ų | 140.5 | 71% | 0.713 | 77% | 0.773 | S | S | * | * | trans | -127.3 | 142.4 | -156.4 | 65.2 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 213 | L | 42.1 | Very low | 44 | Very low | 133 Ų | 133 | 140.3 Ų | 140.3 | 70% | 0.696 | 77% | 0.772 | S | S | * | * | trans | 76.9 | 144.3 | 141.5 | -154.6 | 72.2 | 0 | 0 | 0 | 118.9 | ||||
| 214 | R | 41.1 | Very low | 43.3 | Very low | 206 Ų | 206 | 137.5 Ų | 137.5 | 78% | 0.777 | 77% | 0.771 | S | S | * | * | trans | 91.5 | 78.6 | 165.5 | -47.6 | -63.4 | -179.8 | -166.8 | -3.3 | 119.1 | ||||
| 215 | E | 34.9 | Very low | 43 | Very low | 168 Ų | 168 | 139.3 Ų | 139.3 | 79% | 0.785 | 77% | 0.772 | S | S | * | * | 31.2 | 107.1 | 116.7 | -165.7 | -164.9 | 132.7 | 0 | 0 | 120.7 | |||||
| 216 | N | 33.5 | Very low | 42.8 | Very low | 113 Ų | 113 | 143.6 Ų | 143.6 | 60% | 0.604 | 78% | 0.776 | S | S | * | * | -173.4 | 141.1 | 116.5 | -112.7 | -93.7 | 0 | 0 | 0 | 115.6 | |||||
| 217 | K | 35.7 | Very low | 42.1 | Very low | 190 Ų | 190 | 142.1 Ų | 142.1 | 83% | 0.826 | 78% | 0.778 | S | S | * | * | trans | 47.4 | 116 | 149.1 | -72.4 | 170.5 | -172.8 | -177.7 | 0 | 123.2 | ||||
| 218 | Q | 38.2 | Very low | 41.9 | Very low | 181 Ų | 181 | 144 Ų | 144 | 85% | 0.846 | 77% | 0.774 | S | S | * | * | trans | -69.2 | 179.2 | 149.4 | -104.1 | -161 | 4.9 | 0 | 0 | 113.4 | ||||
| 219 | P | 53.8 | Low | 42 | Very low | 93 Ų | 93 | 140 Ų | 140 | 60% | 0.604 | 77% | 0.767 | S | S | * | * | cis | -134.4 | -159.2 | -11.7 | 29 | -4.3 | 0 | 0 | 0 | 113.8 | ||||
| 220 | E | 32.5 | Very low | 41.5 | Very low | 195 Ų | 195 | 143.3 Ų | 143.3 | 91% | 0.911 | 77% | 0.773 | S | S | * | * | trans | 77.5 | 139.1 | 170.4 | -50.9 | -176.3 | 110.8 | 0 | 0 | 115.9 | ||||
| 221 | G | 32 | Very low | 41.1 | Very low | 69 Ų | 69 | 143 Ų | 143 | 71% | 0.711 | 77% | 0.765 | S | S | * | * | cis | 172.2 | 166.1 | -7.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 222 | L | 34.3 | Very low | 41.3 | Very low | 155 Ų | 155 | 143.4 Ų | 143.4 | 81% | 0.812 | 77% | 0.769 | S | S | * | * | trans | 72.7 | 114.2 | 157.1 | -52.3 | 177.6 | 0 | 0 | 0 | 122.6 | ||||
| 223 | E | 39.7 | Very low | 41.8 | Very low | 173 Ų | 173 | 145.7 Ų | 145.7 | 81% | 0.808 | 77% | 0.773 | S | S | * | * | 40.7 | 140.1 | 120.5 | -46.9 | -176.3 | 162.8 | 0 | 0 | 123.3 | |||||
| 224 | S | 37.1 | Very low | 42.3 | Very low | 112 Ų | 112 | 144.5 Ų | 144.5 | 78% | 0.783 | 77% | 0.771 | S | S | * | * | trans | 125.5 | 111.6 | 153.5 | -61.4 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 225 | K | 41 | Very low | 42.8 | Very low | 191 Ų | 191 | 142.3 Ų | 142.3 | 83% | 0.83 | 77% | 0.774 | S | S | * | * | 69.4 | 108.4 | 85.9 | -83.4 | -164.1 | 173.9 | -172.7 | 0 | 116.5 | |||||
| 226 | Q | 44.8 | Very low | 43.9 | Very low | 188 Ų | 188 | 139.4 Ų | 139.4 | 88% | 0.879 | 77% | 0.772 | S | S | * | * | 46.1 | 105.1 | 128.2 | -173.1 | -179.4 | -2.7 | 0 | 0 | 119 | |||||
| 227 | G | 36.5 | Very low | 45 | Very low | 73 Ų | 73 | 142 Ų | 142 | 75% | 0.753 | 78% | 0.784 | S | S | * | * | trans | 167.7 | 104.4 | 158.2 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 228 | K | 47.9 | Very low | 45.7 | Very low | 183 Ų | 183 | 139.9 Ų | 139.9 | 80% | 0.796 | 78% | 0.781 | S | S | * | * | trans | 37.8 | 113.2 | 137.2 | -164.8 | 173.7 | -173.9 | -76.1 | 0 | 120.6 | E230 | K228-E230 IonicContact NZ-OE1 2.58Å; K228-E230 PolarHBondContact NZ-OE1 3.02Å; K228-E230 IonicContact NZ-OE2 3.81Å | ||
| 229 | G | 44.2 | Very low | 46.5 | Very low | 60 Ų | 60 | 135 Ų | 135 | 62% | 0.619 | 77% | 0.772 | S | S | * | * | trans | -174.4 | 130.8 | 153.4 | 0 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 230 | E | 47.8 | Very low | 46.5 | Very low | 157 Ų | 157 | 138 Ų | 138 | 73% | 0.734 | 78% | 0.783 | S | S | * | * | cis | 84.3 | 33.7 | 20.4 | 113.6 | -174.3 | 83.8 | 0 | 0 | 116.9 | K228 | K228-E230 IonicContact NZ-OE1 2.58Å; K228-E230 PolarHBondContact NZ-OE1 3.02Å; K228-E230 IonicContact NZ-OE2 3.81Å | ||
| 231 | D | 52.3 | Low | 47.8 | Very low | 143 Ų | 143 | 133.1 Ų | 133.1 | 77% | 0.765 | 78% | 0.776 | S | S | * | * | trans | -134.8 | 112 | 150.6 | 62.9 | -63.8 | 0 | 0 | 0 | 111 | ||||
| 232 | S | 56.9 | Low | 49.1 | Very low | 127 Ų | 127 | 139.8 Ų | 139.8 | 89% | 0.888 | 78% | 0.781 | S | S | * | * | trans | -148.2 | 69 | 161.8 | -171.4 | 0 | 0 | 0 | 0 | 106.3 | V234 | S232-V234 PolarHBondContact O-N 3.29Š| ||
| 233 | D | 51.8 | Low | 50.4 | Low | 150 Ų | 150 | 138.9 Ų | 138.9 | 80% | 0.802 | 78% | 0.777 | S | S | * | * | trans | -74.3 | 121.5 | -176.1 | -97.6 | -31.2 | 0 | 0 | 0 | 110.8 | ||||
| 234 | V | 52 | Low | 51.4 | Low | 107 Ų | 107 | 135.3 Ų | 135.3 | 65% | 0.648 | 77% | 0.772 | S | S | * | * | trans | 49.2 | 102 | 136.1 | -164.1 | 0 | 0 | 0 | 0 | 116.9 | S232 | S232-V234 PolarHBondContact O-N 3.29Š| ||
| 235 | L | 50.9 | Low | 52.3 | Low | 161 Ų | 161 | 137 Ų | 137 | 84% | 0.843 | 77% | 0.772 | S | S | * | * | -150.5 | 82.2 | 117.3 | -81.1 | -163.5 | 0 | 0 | 0 | 109.6 | I237 | L235-I237 PolarHBondContact O-N 2.76Å; L235-I237 VanDerWaalsContact O-N 3.12Å | |||
| 236 | S | 58.3 | Low | 52.7 | Low | 106 Ų | 106 | 135.9 Ų | 135.9 | 74% | 0.741 | 77% | 0.773 | S | S | * | * | trans | -64.7 | 108.4 | 162.6 | -57.8 | 0 | 0 | 0 | 0 | 108.7 | N238 | S236-N238 VanDerWaalsContact C-N 3.27Å; S236-N238 PolarHBondContact O-N 3.24Å | ||
| 237 | I | 56.5 | Low | 53.4 | Low | 167 Ų | 167 | 135.9 Ų | 135.9 | 86% | 0.856 | 77% | 0.773 | S | S | * | * | trans | -69 | 90.3 | 171.7 | -71.2 | 171.9 | 0 | 0 | 0 | 108 | L235 | L235-I237 PolarHBondContact O-N 2.76Å; L235-I237 VanDerWaalsContact O-N 3.12Å | ||
| 238 | N | 50.7 | Low | 53.9 | Low | 146 Ų | 146 | 135.1 Ų | 135.1 | 78% | 0.781 | 77% | 0.765 | S | S | * | * | trans | -85 | 159.9 | 156.2 | -81.1 | -8.3 | 0 | 0 | 0 | 109.2 | S236 | S236-N238 VanDerWaalsContact C-N 3.27Å; S236-N238 PolarHBondContact O-N 3.24Å | ||
| 239 | A | 54.6 | Low | 53.8 | Low | 79 Ų | 79 | 132.1 Ų | 132.1 | 65% | 0.653 | 77% | 0.765 | S | S | * | * | trans | -71.4 | -177.8 | -175.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 240 | D | 55.5 | Low | 53.3 | Low | 157 Ų | 157 | 135.1 Ų | 135.1 | 84% | 0.84 | 77% | 0.774 | S | S | * | * | trans | 88.2 | 90.2 | 159 | -46.2 | -31.6 | 0 | 0 | 0 | 118.1 | ||||
| 241 | A | 58.5 | Low | 53.1 | Low | 92 Ų | 92 | 135 Ų | 135 | 76% | 0.76 | 78% | 0.779 | S | S | * | * | trans | -178.5 | 151.6 | 131.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 242 | Y | 58.9 | Low | 52.9 | Low | 208 Ų | 208 | 136.3 Ų | 136.3 | 82% | 0.816 | 78% | 0.781 | S | S | * | * | trans | 69.3 | 101 | -166.9 | -72.4 | -92.2 | 0 | 0 | 0 | 113.4 | ||||
| 243 | D | 61.7 | Low | 52.1 | Low | 137 Ų | 137 | 138.1 Ų | 138.1 | 73% | 0.733 | 78% | 0.78 | S | S | * | * | cis | 56.7 | 73.8 | 17.4 | -161.5 | 21.9 | 0 | 0 | 0 | 113.8 | ||||
| 244 | S | 60.7 | Low | 51.3 | Low | 98 Ų | 98 | 135.9 Ų | 135.9 | 69% | 0.685 | 78% | 0.783 | S | S | * | * | trans | -139.3 | 99.7 | 160.1 | -82 | 0 | 0 | 0 | 0 | 107.3 | I246 | S244-I246 PolarHBondContact O-N 3.36Š| ||
| 245 | D | 55.7 | Low | 50.5 | Low | 148 Ų | 148 | 135.9 Ų | 135.9 | 79% | 0.791 | 79% | 0.794 | S | S | * | * | trans | -55.6 | 129.4 | 171.8 | -67 | -56.7 | 0 | 0 | 0 | 111.4 | ||||
| 246 | I | 51.1 | Low | 49.7 | Very low | 167 Ų | 167 | 133 Ų | 133 | 86% | 0.856 | 79% | 0.794 | S | S | * | * | trans | -141.4 | 111.9 | 149.8 | -165.6 | 72.5 | 0 | 0 | 0 | 108.4 | S244 G248 | S244-I246 PolarHBondContact O-N 3.36Å; I246-G248 PolarHBondContact O-N 2.92Å; I246-G248 VanDerWaalsContact O-N 3.12Å | ||
| 247 | E | 58.8 | Low | 48.5 | Very low | 187 Ų | 187 | 132 Ų | 132 | 87% | 0.874 | 79% | 0.792 | S | S | * | * | trans | -64 | 110.6 | -174.3 | -66.3 | 165.2 | 108.7 | 0 | 0 | 111 | ||||
| 248 | G | 46.7 | Very low | 47.1 | Very low | 57 Ų | 57 | 130.3 Ų | 130.3 | 59% | 0.588 | 79% | 0.789 | S | S | * | * | trans | -77.3 | 127.9 | 155.6 | 0 | 0 | 0 | 0 | 0 | 108.6 | I246 C250 | I246-G248 PolarHBondContact O-N 2.92Å; I246-G248 VanDerWaalsContact O-N 3.12Å; G248-C250 PolarHBondContact O-N 2.91Å | ||
| 249 | P | 45.1 | Very low | 46.3 | Very low | 121 Ų | 121 | 127.5 Ų | 127.5 | 79% | 0.786 | 79% | 0.786 | S | S | * | * | trans | -68.2 | 100.4 | 176 | 27.2 | -32.9 | 0 | 0 | 0 | 109.6 | N251 | P249-N251 PolarHBondContact O-N 3.42Š| ||
| 250 | C | 35.5 | Very low | 44.9 | Very low | 122 Ų | 122 | 130.5 Ų | 130.5 | 82% | 0.824 | 80% | 0.796 | S | S | * | * | trans | -74.1 | 101.3 | 166.5 | -70 | 0 | 0 | 0 | 0 | 109.1 | G248 E252 | G248-C250 PolarHBondContact O-N 2.91Å; C250-E252 VanDerWaalsContact C-N 3.35Å; C250-E252 PolarHBondContact O-N 3.32Å; C250-E252 VanDerWaalsContact O-N 3.13Å | ||
| 251 | N | 43.4 | Very low | 43.6 | Very low | 155 Ų | 155 | 127.4 Ų | 127.4 | 83% | 0.829 | 79% | 0.793 | S | S | * | * | trans | -72.8 | 97.2 | 154 | 42.3 | -65.9 | 0 | 0 | 0 | 108.4 | P249 | P249-N251 PolarHBondContact O-N 3.42Š| ||
| 252 | E | 47.9 | Very low | 42.1 | Very low | 171 Ų | 171 | 127.8 Ų | 127.8 | 80% | 0.799 | 80% | 0.796 | S | S | * | * | trans | -57.7 | 136.9 | 166.1 | 62 | -165.9 | 137 | 0 | 0 | 111 | C250 | C250-E252 VanDerWaalsContact C-N 3.35Å; C250-E252 PolarHBondContact O-N 3.32Å; C250-E252 VanDerWaalsContact O-N 3.13Å | ||
| 253 | D | 39.8 | Very low | 40.7 | Very low | 165 Ų | 165 | 122 Ų | 122 | 88% | 0.882 | 79% | 0.792 | S | S | * | * | -160.3 | 112.3 | 124.8 | -118 | -37.8 | 0 | 0 | 0 | 109.4 | |||||
| 254 | A | 36 | Very low | 39.2 | Very low | 103 Ų | 103 | 122.3 Ų | 122.3 | 85% | 0.851 | 80% | 0.798 | S | S | * | * | trans | -102.1 | 115.3 | -177.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 255 | A | 34.1 | Very low | 37.9 | Very low | 106 Ų | 106 | 121.9 Ų | 121.9 | 88% | 0.876 | 80% | 0.8 | S | S | * | * | trans | -139.5 | 133.3 | 160.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 256 | A | 34.6 | Very low | 36.8 | Very low | 102 Ų | 102 | 121.2 Ų | 121.2 | 84% | 0.843 | 80% | 0.802 | S | S | * | * | trans | -88.6 | 174.2 | -167 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 257 | A | 32.4 | Very low | 36.6 | Very low | 85 Ų | 85 | 118.8 Ų | 118.8 | 70% | 0.702 | 80% | 0.797 | S | S | * | * | trans | 96.5 | 130.9 | 149.8 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 258 | T | 27.8 | Very low | 35.2 | Very low | 131 Ų | 131 | 114.6 Ų | 114.6 | 80% | 0.804 | 79% | 0.794 | S | S | * | * | trans | 59.9 | 106.5 | 145.7 | 51.4 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 259 | A | 32.8 | Very low | 34.5 | Very low | 87 Ų | 87 | 117.7 Ų | 117.7 | 72% | 0.719 | 81% | 0.807 | S | S | * | * | 37.1 | 135.6 | 121.4 | 0 | 0 | 0 | 0 | 0 | 121.1 | |||||
| 260 | T | 25.3 | Very low | 34.1 | Very low | 141 Ų | 141 | 115.9 Ų | 115.9 | 87% | 0.865 | 80% | 0.802 | S | S | * | * | trans | 95 | 129.8 | 158.3 | 71 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 261 | A | 28.1 | Very low | 34.6 | Very low | 92 Ų | 92 | 115.4 Ų | 115.4 | 76% | 0.76 | 80% | 0.798 | S | S | * | * | trans | 66.4 | 107.2 | 145.1 | 0 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 262 | A | 27.9 | Very low | 34 | Very low | 101 Ų | 101 | 116.9 Ų | 116.9 | 84% | 0.835 | 80% | 0.8 | S | S | * | * | 74.6 | 140.7 | 123.9 | 0 | 0 | 0 | 0 | 0 | 122.5 | |||||
| 263 | A | 29.5 | Very low | 34 | Very low | 87 Ų | 87 | 114.6 Ų | 114.6 | 72% | 0.719 | 80% | 0.797 | S | S | * | * | trans | 81.2 | 110.7 | 145.5 | 0 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 264 | V | 30.5 | Very low | 34.3 | Very low | 142 Ų | 142 | 112.9 Ų | 112.9 | 86% | 0.861 | 80% | 0.795 | S | S | * | * | 69.4 | 133.5 | 119 | 172.9 | 0 | 0 | 0 | 0 | 121 | |||||
| 265 | A | 33.1 | Very low | 34.5 | Very low | 90 Ų | 90 | 116.6 Ų | 116.6 | 74% | 0.744 | 79% | 0.794 | S | S | * | * | trans | 98.3 | 118.5 | 152.2 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 266 | T | 32 | Very low | 34.5 | Very low | 133 Ų | 133 | 123.6 Ų | 123.6 | 82% | 0.816 | 80% | 0.798 | S | S | * | * | trans | -52.3 | 161.1 | 143.4 | 32.4 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 267 | P | 46.3 | Very low | 34.5 | Very low | 117 Ų | 117 | 124.7 Ų | 124.7 | 76% | 0.76 | 79% | 0.794 | S | S | * | * | cis | -156.1 | 173.5 | 48 | 43 | -21.1 | 0 | 0 | 0 | 120.6 | ||||
| 268 | A | 30.1 | Very low | 35.2 | Very low | 98 Ų | 98 | 126.4 Ų | 126.4 | 81% | 0.81 | 80% | 0.796 | S | S | * | * | trans | 40.2 | 126.5 | 141.6 | 0 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 269 | S | 31.8 | Very low | 35.8 | Very low | 122 Ų | 122 | 131.9 Ų | 131.9 | 85% | 0.853 | 80% | 0.802 | S | S | * | * | -172 | 145.5 | 109.2 | -168.3 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 270 | A | 36.9 | Very low | 36.6 | Very low | 84 Ų | 84 | 132.5 Ų | 132.5 | 69% | 0.694 | 80% | 0.801 | S | S | * | * | trans | -87.9 | 179.8 | 162.5 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 271 | P | 46.6 | Very low | 38 | Very low | 112 Ų | 112 | 132.7 Ų | 132.7 | 73% | 0.727 | 79% | 0.792 | S | S | * | * | -153.6 | -173.7 | 60 | 42.3 | -20 | 0 | 0 | 0 | 118 | |||||
| 272 | E | 31.3 | Very low | 39.2 | Very low | 186 Ų | 186 | 131.4 Ų | 131.4 | 87% | 0.869 | 78% | 0.782 | S | S | * | * | trans | 84.7 | 142.4 | 158.2 | -61.6 | -160.2 | 115.5 | 0 | 0 | 121.7 | ||||
| 273 | V | 46.3 | Very low | 40.6 | Very low | 123 Ų | 123 | 128.9 Ų | 128.9 | 75% | 0.745 | 77% | 0.766 | S | S | * | * | trans | -135.5 | 152.1 | -166.2 | 177.5 | 0 | 0 | 0 | 0 | 107 | ||||
| 274 | P | 46.5 | Very low | 42.1 | Very low | 128 Ų | 128 | 132 Ų | 132 | 83% | 0.831 | 77% | 0.765 | S | S | * | * | trans | -120.6 | 137.4 | 144.1 | 34.2 | -27.4 | 0 | 0 | 0 | 112.2 | ||||
| 275 | E | 39.9 | Very low | 44 | Very low | 181 Ų | 181 | 129.2 Ų | 129.2 | 85% | 0.846 | 74% | 0.744 | S | S | * | * | trans | -72.6 | 155.3 | -170.2 | -55.3 | 170.7 | 98.7 | 0 | 0 | 113.4 | ||||
| 276 | R | 34.9 | Very low | 46.3 | Very low | 254 Ų | 254 | 130 Ų | 130 | 96% | 0.958 | 74% | 0.736 | S | S | * | * | trans | -134.8 | 131 | 148.3 | -145.4 | 180 | -168.5 | -155.4 | 4 | 111.5 | ||||
| 277 | T | 33.8 | Very low | 49 | Very low | 124 Ų | 124 | 127.9 Ų | 127.9 | 76% | 0.761 | 72% | 0.72 | S | S | * | * | trans | -83.8 | 124.4 | -155 | -34 | 0 | 0 | 0 | 0 | 114 | ||||
| 278 | V | 47.3 | Very low | 51 | Low | 122 Ų | 122 | 127.5 Ų | 127.5 | 74% | 0.739 | 71% | 0.711 | S | S | * | * | trans | 16 | 122.5 | 146.3 | -172 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 279 | R | 41.9 | Very low | 53.8 | Low | 245 Ų | 245 | 128 Ų | 128 | 93% | 0.925 | 70% | 0.696 | S | S | * | * | trans | -134.6 | 98.4 | 142 | -80.2 | -162.5 | 171.2 | -164.9 | -2.5 | 111.2 | ||||
| 280 | S | 48.2 | Very low | 56.6 | Low | 100 Ų | 100 | 127 Ų | 127 | 70% | 0.699 | 68% | 0.677 | S | S | * | * | trans | 44 | 70.3 | 157.5 | -53.8 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 281 | E | 55.8 | Low | 59.3 | Low | 145 Ų | 145 | 127.1 Ų | 127.1 | 68% | 0.678 | 67% | 0.666 | S | S | * | * | trans | -65.1 | -36.4 | 174.4 | -163.6 | -179.1 | 141.1 | 0 | 0 | 113.3 | G283 Q284 I285 | E281-G283 PolarHBondContact O-N 3.15Å; E281-Q284 PolarHBondContact O-N 3.3Å; E281-I285 HydrophobicContact CG-CD1 3.94Å; E281-I285 HydrophobicContact CG-CG1 4.38Å; E281-I285 PolarHBondContact O-N 3.19Å | ||
| 282 | A | 53.5 | Low | 61.5 | Low | 66 Ų | 66 | 126.3 Ų | 126.3 | 55% | 0.545 | 65% | 0.654 | S | S | . | * | H | α-helix | trans | -50.9 | -53.5 | -172.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | Q284 I285 D286 | A282-Q284 PolarHBondContact O-N 3.06Å; A282-I285 PolarHBondContact O-N 2.91Å; A282-I285 VanDerWaalsContact O-N 3.13Å; A282-D286 PolarHBondContact O-N 2.91Å; A282-D286 VanDerWaalsContact O-OD2 3.09Å |
| 283 | G | 57.2 | Low | 64.4 | Low | 48 Ų | 48 | 122.8 Ų | 122.8 | 50% | 0.495 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -70.4 | -14 | -177.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | E281 D287 | E281-G283 PolarHBondContact O-N 3.15Å; G283-D287 PolarHBondContact O-N 3.49Å |
| 284 | Q | 60.9 | Low | 66.6 | Low | 152 Ų | 152 | 122.9 Ų | 122.9 | 71% | 0.71 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -84.2 | -32.3 | 171.3 | -81 | -173.6 | -16.9 | 0 | 0 | 112 | E281 A282 L288 | E281-Q284 PolarHBondContact O-N 3.3Å; A282-Q284 PolarHBondContact O-N 3.06Å; Q284-L288 VanDerWaalsContact O-CB 3.25Å; Q284-L288 WeakPolarHBondContact O-CB 3.49Å; Q284-L288 PolarHBondContact O-N 3.13Å; Q284-L288 VanDerWaalsContact O-N 3.14Å |
| 285 | I | 68.9 | Low | 68.7 | Low | 83 Ų | 83 | 119.5 Ų | 119.5 | 43% | 0.426 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -68 | -49.3 | 173 | -57.4 | 165.9 | 0 | 0 | 0 | 109.1 | E281 A282 D287 L288 E289 | E281-I285 HydrophobicContact CG-CD1 3.94Å; E281-I285 HydrophobicContact CG-CG1 4.38Å; E281-I285 PolarHBondContact O-N 3.19Å; A282-I285 PolarHBondContact O-N 2.91Å; A282-I285 VanDerWaalsContact O-N 3.13Å; I285-D287 VanDerWaalsContact C-N 3.33Å; I285-D287 PolarHBondContact O-N 2.97Å; I285-L288 PolarHBondContact O-N 2.86Å; I285-E289 VanDerWaalsContact O-CB 3.29Å; I285-E289 WeakPolarHBondContact O-CB 3.44Å; I285-E289 PolarHBondContact O-N 3.33Å |
| 286 | D | 81.6 | Confident | 71.2 | Confident | 108 Ų | 108 | 114 Ų | 114 | 58% | 0.578 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -56 | -42.5 | 177.9 | -74.8 | -65 | 0 | 0 | 0 | 112.9 | A282 K290 | A282-D286 PolarHBondContact O-N 2.91Å; A282-D286 VanDerWaalsContact O-OD2 3.09Å; D286-K290 VanDerWaalsContact O-CB 3.32Å; D286-K290 WeakPolarHBondContact O-CB 3.12Å; D286-K290 PolarHBondContact O-N 2.89Å |
| 287 | D | 89.6 | Confident | 73.8 | Confident | 88 Ų | 88 | 105.3 Ų | 105.3 | 47% | 0.471 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -73.5 | -36.8 | -178.4 | -141.9 | -125.2 | 0 | 0 | 0 | 112 | G283 I285 K290 D291 | G283-D287 PolarHBondContact O-N 3.49Å; I285-D287 VanDerWaalsContact C-N 3.33Å; I285-D287 PolarHBondContact O-N 2.97Å; D287-K290 IonicContact OD1-NZ 2.61Å; D287-K290 IonicContact OD2-NZ 3.78Å; D287-K290 PolarHBondContact OD2-NZ 3.33Å; D287-D291 PolarHBondContact O-N 3.22Å |
| 288 | L | 88.9 | Confident | 76.5 | Confident | 109 Ų | 109 | 106.1 Ų | 106.1 | 57% | 0.571 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -67.8 | -41.1 | 173.7 | -179.7 | 62 | 0 | 0 | 0 | 111.9 | Q284 I285 D291 I292 | Q284-L288 VanDerWaalsContact O-CB 3.25Å; Q284-L288 WeakPolarHBondContact O-CB 3.49Å; Q284-L288 PolarHBondContact O-N 3.13Å; Q284-L288 VanDerWaalsContact O-N 3.14Å; I285-L288 PolarHBondContact O-N 2.86Å; L288-D291 PolarHBondContact O-N 3.16Å; L288-I292 HydrophobicContact CD1-CD1 4.34Å; L288-I292 HydrophobicContact CG-CD1 4.02Å; L288-I292 WeakPolarHBondContact O-CD1 3.36Å; L288-I292 VanDerWaalsContact O-CG1 3.24Å; L288-I292 WeakPolarHBondContact O-CG1 3.5Å; L288-I292 PolarHBondContact O-N 3.44Å |
| 289 | E | 88.6 | Confident | 78.3 | Confident | 107 Ų | 107 | 106.8 Ų | 106.8 | 50% | 0.5 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -62.4 | -44.7 | 176.2 | -169 | 165.5 | 153.8 | 0 | 0 | 110.4 | I285 D291 I292 E293 | I285-E289 VanDerWaalsContact O-CB 3.29Å; I285-E289 WeakPolarHBondContact O-CB 3.44Å; I285-E289 PolarHBondContact O-N 3.33Å; E289-D291 PolarHBondContact O-N 3.41Å; E289-I292 PolarHBondContact O-N 3.34Å; E289-E293 WeakPolarHBondContact O-CG 3.35Å; E289-E293 PolarHBondContact O-N 3.29Å |
| 290 | K | 90 | Very high | 80.3 | Confident | 103 Ų | 103 | 100.4 Ų | 100.4 | 45% | 0.448 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62.9 | -37.3 | 174.2 | -168.2 | -159.7 | 74.8 | -142.9 | 0 | 113.1 | D286 D287 K294 | D286-K290 VanDerWaalsContact O-CB 3.32Å; D286-K290 WeakPolarHBondContact O-CB 3.12Å; D286-K290 PolarHBondContact O-N 2.89Å; D287-K290 IonicContact OD1-NZ 2.61Å; D287-K290 IonicContact OD2-NZ 3.78Å; D287-K290 PolarHBondContact OD2-NZ 3.33Å; K290-K294 WeakPolarHBondContact O-CB 3.42Å; K290-K294 PolarHBondContact O-N 3.27Å |
| 291 | D | 93.6 | Very high | 81.6 | Confident | 85 Ų | 85 | 98.2 Ų | 98.2 | 46% | 0.455 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -72.2 | -35.2 | 175.3 | -86.9 | -4.8 | 0 | 0 | 0 | 112.4 | D287 L288 E289 K294 S295 | D287-D291 PolarHBondContact O-N 3.22Å; L288-D291 PolarHBondContact O-N 3.16Å; E289-D291 PolarHBondContact O-N 3.41Å; D291-K294 PolarHBondContact O-N 3.44Å; D291-S295 WeakPolarHBondContact O-CB 3.34Å; D291-S295 PolarHBondContact O-N 2.87Å |
| 292 | I | 93 | Very high | 81.9 | Confident | 96 Ų | 96 | 97 Ų | 97 | 49% | 0.492 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.9 | -51.6 | 170.5 | -69.4 | 162.3 | 0 | 0 | 0 | 109.9 | L288 E289 K294 S295 V296 | L288-I292 HydrophobicContact CD1-CD1 4.34Å; L288-I292 HydrophobicContact CG-CD1 4.02Å; L288-I292 WeakPolarHBondContact O-CD1 3.36Å; L288-I292 VanDerWaalsContact O-CG1 3.24Å; L288-I292 WeakPolarHBondContact O-CG1 3.5Å; L288-I292 PolarHBondContact O-N 3.44Å; E289-I292 PolarHBondContact O-N 3.34Å; I292-K294 VanDerWaalsContact C-N 3.29Å; I292-K294 PolarHBondContact O-N 2.96Å; I292-S295 PolarHBondContact O-N 3.35Å; I292-S295 VanDerWaalsContact O-N 3.17Å; I292-V296 HydrophobicContact CG2-CG2 4.26Å; I292-V296 WeakPolarHBondContact O-CB 3.23Å; I292-V296 VanDerWaalsContact O-CG2 3.28Å; I292-V296 WeakPolarHBondContact O-CG2 3.12Å; I292-V296 PolarHBondContact O-N 3.23Å |
| 293 | E | 92.3 | Very high | 82 | Confident | 111 Ų | 111 | 97.9 Ų | 97.9 | 52% | 0.519 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -57.5 | -42.6 | 176.6 | -74.3 | -173.1 | 168 | 0 | 0 | 111.9 | E289 V296 N297 | E289-E293 WeakPolarHBondContact O-CG 3.35Å; E289-E293 PolarHBondContact O-N 3.29Å; E293-V296 PolarHBondContact O-N 3.37Å; E293-N297 WeakPolarHBondContact O-CB 3.47Å; E293-N297 PolarHBondContact O-N 2.89Å; E293-N297 PolarHBondContact O-ND2 3.48Å |
| 294 | K | 92.4 | Very high | 81.5 | Confident | 125 Ų | 125 | 104 Ų | 104 | 54% | 0.543 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -64.2 | -42.1 | 177.4 | -176.5 | 177.4 | 168.5 | -63.8 | 0 | 111.7 | K290 D291 I292 E298 | K290-K294 WeakPolarHBondContact O-CB 3.42Å; K290-K294 PolarHBondContact O-N 3.27Å; D291-K294 PolarHBondContact O-N 3.44Å; I292-K294 VanDerWaalsContact C-N 3.29Å; I292-K294 PolarHBondContact O-N 2.96Å; K294-E298 WeakPolarHBondContact O-CB 3.37Å; K294-E298 PolarHBondContact O-N 2.93Å; K294-E298 VanDerWaalsContact O-N 3.08Å |
| 295 | S | 90.1 | Very high | 80.8 | Confident | 58 Ų | 58 | 102.4 Ų | 102.4 | 41% | 0.406 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -67.3 | -40 | 175.5 | -175.8 | 0 | 0 | 0 | 0 | 112.3 | D291 I292 E298 I299 | D291-S295 WeakPolarHBondContact O-CB 3.34Å; D291-S295 PolarHBondContact O-N 2.87Å; I292-S295 PolarHBondContact O-N 3.35Å; I292-S295 VanDerWaalsContact O-N 3.17Å; S295-E298 PolarHBondContact O-N 3.32Å; S295-I299 VanDerWaalsContact O-CG1 3.3Å; S295-I299 WeakPolarHBondContact O-CG1 3.43Å; S295-I299 PolarHBondContact O-N 3.12Å |
| 296 | V | 92.9 | Very high | 79.5 | Confident | 66 Ų | 66 | 103.8 Ų | 103.8 | 40% | 0.4 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -63.6 | -42.8 | 176.1 | 167.1 | 0 | 0 | 0 | 0 | 111.1 | I292 E293 E298 I299 L300 | I292-V296 HydrophobicContact CG2-CG2 4.26Å; I292-V296 WeakPolarHBondContact O-CB 3.23Å; I292-V296 VanDerWaalsContact O-CG2 3.28Å; I292-V296 WeakPolarHBondContact O-CG2 3.12Å; I292-V296 PolarHBondContact O-N 3.23Å; E293-V296 PolarHBondContact O-N 3.37Å; V296-E298 VanDerWaalsContact C-N 3.32Å; V296-E298 PolarHBondContact O-N 3.32Å; V296-I299 PolarHBondContact O-N 2.88Å; V296-L300 HydrophobicContact CG1-CD1 3.65Å; V296-L300 HydrophobicContact CG1-CG 4.45Å; V296-L300 VanDerWaalsContact O-CB 3.32Å; V296-L300 WeakPolarHBondContact O-CB 3.41Å; V296-L300 WeakPolarHBondContact O-CG 3.35Å; V296-L300 PolarHBondContact O-N 3.2Å |
| 297 | N | 90.2 | Very high | 77.9 | Confident | 70 Ų | 70 | 104 Ų | 104 | 37% | 0.374 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -67.3 | -30.8 | 175.5 | -75.6 | -55.3 | 0 | 0 | 0 | 113.2 | E293 G301 L302 | E293-N297 WeakPolarHBondContact O-CB 3.47Å; E293-N297 PolarHBondContact O-N 2.89Å; E293-N297 PolarHBondContact O-ND2 3.48Å; N297-G301 PolarHBondContact O-N 2.96Å; N297-L302 PolarHBondContact O-N 3.07Å |
| 298 | E | 89.7 | Confident | 75.1 | Confident | 142 Ų | 142 | 110 Ų | 110 | 66% | 0.664 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -70.5 | -44.7 | 173.9 | -170.6 | 171.6 | 158.7 | 0 | 0 | 111.5 | K294 S295 V296 G301 | K294-E298 WeakPolarHBondContact O-CB 3.37Å; K294-E298 PolarHBondContact O-N 2.93Å; K294-E298 VanDerWaalsContact O-N 3.08Å; S295-E298 PolarHBondContact O-N 3.32Å; V296-E298 VanDerWaalsContact C-N 3.32Å; V296-E298 PolarHBondContact O-N 3.32Å; E298-G301 PolarHBondContact O-N 2.93Å |
| 299 | I | 84.6 | Confident | 72.7 | Confident | 136 Ų | 136 | 113 Ų | 113 | 70% | 0.697 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -68.6 | -41 | 178.3 | -67.3 | 164.3 | 0 | 0 | 0 | 111.9 | S295 V296 G301 | S295-I299 VanDerWaalsContact O-CG1 3.3Å; S295-I299 WeakPolarHBondContact O-CG1 3.43Å; S295-I299 PolarHBondContact O-N 3.12Å; V296-I299 PolarHBondContact O-N 2.88Å; I299-G301 VanDerWaalsContact C-N 3.27Å; I299-G301 PolarHBondContact O-N 3.38Å |
| 300 | L | 84.1 | Confident | 70.6 | Confident | 110 Ų | 110 | 112.9 Ų | 112.9 | 58% | 0.576 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81 | -4.2 | 178.8 | -66.8 | 171.6 | 0 | 0 | 0 | 113.5 | V296 L302 | V296-L300 HydrophobicContact CG1-CD1 3.65Å; V296-L300 HydrophobicContact CG1-CG 4.45Å; V296-L300 VanDerWaalsContact O-CB 3.32Å; V296-L300 WeakPolarHBondContact O-CB 3.41Å; V296-L300 WeakPolarHBondContact O-CG 3.35Å; V296-L300 PolarHBondContact O-N 3.2Å; L300-L302 HydrophobicContact CB-CD1 3.93Å; L300-L302 HydrophobicContact CB-CG 3.8Å; L300-L302 HydrophobicContact CD1-CD1 4.19Å; L300-L302 PolarHBondContact O-N 2.91Å |
| 301 | G | 76.5 | Confident | 67.8 | Low | 55 Ų | 55 | 117 Ų | 117 | 57% | 0.567 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 64.3 | 22.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 115 | N297 E298 I299 A303 | N297-G301 PolarHBondContact O-N 2.96Å; E298-G301 PolarHBondContact O-N 2.93Å; I299-G301 VanDerWaalsContact C-N 3.27Å; I299-G301 PolarHBondContact O-N 3.38Å; G301-A303 VanDerWaalsContact C-N 3.29Å; G301-A303 PolarHBondContact O-N 3.08Å |
| 302 | L | 61 | Low | 64.9 | Low | 118 Ų | 118 | 117.6 Ų | 117.6 | 62% | 0.618 | 66% | 0.656 | S | S | * | * | trans | -80.8 | -4 | -170.7 | -61.9 | 177 | 0 | 0 | 0 | 114.3 | N297 L300 E304 | N297-L302 PolarHBondContact O-N 3.07Å; L300-L302 HydrophobicContact CB-CD1 3.93Å; L300-L302 HydrophobicContact CB-CG 3.8Å; L300-L302 HydrophobicContact CD1-CD1 4.19Å; L300-L302 PolarHBondContact O-N 2.91Å; L302-E304 PolarHBondContact O-N 3.07Å | ||
| 303 | A | 55.1 | Low | 62.2 | Low | 86 Ų | 86 | 117.5 Ų | 117.5 | 71% | 0.711 | 67% | 0.67 | S | S | * | * | trans | -90.2 | 88.9 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112 | G301 | G301-A303 VanDerWaalsContact C-N 3.29Å; G301-A303 PolarHBondContact O-N 3.08Å | ||
| 304 | E | 47.5 | Very low | 59.9 | Low | 176 Ų | 176 | 118.8 Ų | 118.8 | 82% | 0.822 | 69% | 0.685 | S | S | * | * | trans | -82.7 | 132.6 | 175.7 | -67.4 | -166.2 | 132 | 0 | 0 | 113.7 | L302 | L302-E304 PolarHBondContact O-N 3.07Š| ||
| 305 | S | 45.3 | Very low | 57.3 | Low | 118 Ų | 118 | 120.4 Ų | 120.4 | 83% | 0.825 | 70% | 0.699 | S | S | * | * | trans | 75.3 | 151.2 | 158.5 | 86.2 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 306 | S | 43.4 | Very low | 54.6 | Low | 112 Ų | 112 | 122.8 Ų | 122.8 | 78% | 0.783 | 71% | 0.712 | S | S | * | * | cis | -177.5 | -164.9 | -26.9 | -142.2 | 0 | 0 | 0 | 0 | 107 | ||||
| 307 | P | 46.8 | Very low | 52.6 | Low | 114 Ų | 114 | 125.5 Ų | 125.5 | 74% | 0.74 | 73% | 0.728 | S | S | * | * | cis | -132.9 | 136.8 | -22.9 | 33.1 | -14.1 | 0 | 0 | 0 | 114.9 | ||||
| 308 | K | 31 | Very low | 50.4 | Low | 212 Ų | 212 | 127.9 Ų | 127.9 | 92% | 0.922 | 75% | 0.747 | S | S | * | * | trans | -152.9 | 95 | 144.7 | -157.3 | 154.5 | -170.2 | 164.3 | 0 | 113.3 | ||||
| 309 | E | 39 | Very low | 48.5 | Very low | 172 Ų | 172 | 126.1 Ų | 126.1 | 80% | 0.804 | 75% | 0.748 | S | S | * | * | trans | -69 | 167.7 | 170.1 | -84.3 | -145.1 | 102.2 | 0 | 0 | 113.4 | ||||
| 310 | P | 44.3 | Very low | 46.7 | Very low | 106 Ų | 106 | 125.7 Ų | 125.7 | 69% | 0.688 | 75% | 0.754 | S | S | * | * | cis | -130.3 | 163.3 | 8.2 | 38.5 | -22.8 | 0 | 0 | 0 | 116.2 | ||||
| 311 | K | 30.3 | Very low | 44.6 | Very low | 188 Ų | 188 | 129.1 Ų | 129.1 | 82% | 0.817 | 77% | 0.767 | S | S | * | * | 143 | 112.9 | 109.8 | -162.9 | 171.2 | -172.5 | -178.6 | 0 | 115.8 | |||||
| 312 | A | 33.8 | Very low | 43.3 | Very low | 98 Ų | 98 | 133.4 Ų | 133.4 | 81% | 0.81 | 78% | 0.777 | S | S | * | * | trans | 84.3 | 153.4 | 150.6 | 0 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 313 | A | 36.9 | Very low | 43.3 | Very low | 95 Ų | 95 | 134 Ų | 134 | 79% | 0.785 | 79% | 0.786 | S | S | * | * | trans | 82.2 | 86.2 | 168.3 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 314 | T | 42.5 | Very low | 43.8 | Very low | 137 Ų | 137 | 137.2 Ų | 137.2 | 84% | 0.84 | 79% | 0.786 | S | S | * | * | trans | -45.5 | 128.7 | 152.3 | -55.5 | 0 | 0 | 0 | 0 | 112 | ||||
| 315 | L | 37.5 | Very low | 44.8 | Very low | 159 Ų | 159 | 132 Ų | 132 | 83% | 0.832 | 77% | 0.768 | S | S | * | * | trans | -146.5 | 121.8 | 156.7 | -129.6 | 151.8 | 0 | 0 | 0 | 111.7 | ||||
| 316 | T | 33.3 | Very low | 46.6 | Very low | 109 Ų | 109 | 129 Ų | 129 | 67% | 0.669 | 75% | 0.746 | S | S | * | * | trans | -45.3 | 135.5 | 173.3 | 36.7 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 317 | V | 52.3 | Low | 48.7 | Very low | 122 Ų | 122 | 127.5 Ų | 127.5 | 74% | 0.739 | 74% | 0.74 | S | S | * | * | trans | 12.3 | 137.4 | 132.9 | -178 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 318 | P | 43.8 | Very low | 51 | Low | 120 Ų | 120 | 129.2 Ų | 129.2 | 78% | 0.779 | 74% | 0.739 | S | S | * | * | trans | -113.8 | 148 | 131.3 | 34.8 | -30.4 | 0 | 0 | 0 | 113.2 | ||||
| 319 | P | 48.9 | Very low | 53.9 | Low | 105 Ų | 105 | 124.5 Ų | 124.5 | 68% | 0.682 | 72% | 0.72 | S | S | * | * | trans | -88.5 | -176.7 | -179.4 | 42.9 | -40.3 | 0 | 0 | 0 | 111.1 | ||||
| 320 | P | 46.4 | Very low | 56.5 | Low | 128 Ų | 128 | 121 Ų | 121 | 83% | 0.831 | 71% | 0.706 | S | S | * | * | trans | -71 | 145.6 | -160.3 | 31.1 | -34.2 | 0 | 0 | 0 | 112.8 | ||||
| 321 | E | 41 | Very low | 58.8 | Low | 182 Ų | 182 | 121.5 Ų | 121.5 | 85% | 0.85 | 70% | 0.699 | S | S | * | * | trans | -65.3 | 148.1 | -178.3 | -61.5 | -173.8 | 119.7 | 0 | 0 | 112.7 | V323 | E321-V323 PolarHBondContact O-N 3.19Å; E321-V323 VanDerWaalsContact O-N 3.1Å | ||
| 322 | D | 48.7 | Very low | 62 | Low | 145 Ų | 145 | 118.1 Ų | 118.1 | 78% | 0.775 | 69% | 0.689 | S | S | * | * | trans | -46.3 | 112.7 | 166.7 | -119.6 | -92.6 | 0 | 0 | 0 | 110.3 | Q324 | D322-Q324 PolarHBondContact O-N 2.98Š| ||
| 323 | V | 60.9 | Low | 64.9 | Low | 131 Ų | 131 | 118.2 Ų | 118.2 | 79% | 0.794 | 68% | 0.676 | S | S | * | * | trans | -73.2 | 82.3 | 172.7 | -177.3 | 0 | 0 | 0 | 0 | 107.6 | E321 | E321-V323 PolarHBondContact O-N 3.19Å; E321-V323 VanDerWaalsContact O-N 3.1Å | ||
| 324 | Q | 65.3 | Low | 67.8 | Low | 152 Ų | 152 | 118.4 Ų | 118.4 | 71% | 0.71 | 66% | 0.661 | S | S | * | * | trans | -43 | 124.1 | 169 | -80.2 | -79.4 | -46.7 | 0 | 0 | 108.7 | D322 S326 | D322-Q324 PolarHBondContact O-N 2.98Å; Q324-S326 PolarHBondContact O-N 3.41Å | ||
| 325 | P | 69.9 | Low | 70.4 | Confident | 68 Ų | 68 | 116.4 Ų | 116.4 | 44% | 0.442 | 64% | 0.644 | S | S | . | * | trans | -59.9 | 119.4 | 179.4 | 24.4 | -32.5 | 0 | 0 | 0 | 108.2 | L330 | P325-L330 HydrophobicContact CG-CD2 4.49Š| ||
| 326 | S | 82 | Confident | 73.1 | Confident | 54 Ų | 54 | 113 Ų | 113 | 38% | 0.378 | 62% | 0.624 | S | S | . | * | trans | -53.6 | 144.4 | -179 | 167.9 | 0 | 0 | 0 | 0 | 109.6 | Q324 Q328 Q329 L330 | Q324-S326 PolarHBondContact O-N 3.41Å; S326-Q328 PolarHBondContact O-N 2.91Å; S326-Q328 PolarHBondContact OG-N 3.49Å; S326-Q329 WeakPolarHBondContact O-CA 3.23Å; S326-Q329 WeakPolarHBondContact O-CB 3.49Å; S326-Q329 PolarHBondContact O-N 3.07Å; S326-L330 PolarHBondContact O-N 3.39Å | ||
| 327 | A | 88.5 | Confident | 76.2 | Confident | 80 Ų | 80 | 113.6 Ų | 113.6 | 66% | 0.661 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -50.9 | -33.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q329 L330 E331 | A327-Q329 PolarHBondContact O-N 3.26Å; A327-L330 PolarHBondContact O-N 3.39Å; A327-E331 PolarHBondContact O-N 3.48Å |
| 328 | Q | 94.7 | Very high | 78.3 | Confident | 150 Ų | 150 | 114.7 Ų | 114.7 | 70% | 0.701 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -66.5 | -31.7 | 175.1 | -64.7 | 179.1 | -29.1 | 0 | 0 | 113.7 | S326 L332 | S326-Q328 PolarHBondContact O-N 2.91Å; S326-Q328 PolarHBondContact OG-N 3.49Å; Q328-L332 VanDerWaalsContact O-CB 3.3Å; Q328-L332 WeakPolarHBondContact O-CB 3.28Å; Q328-L332 PolarHBondContact O-N 2.99Å |
| 329 | Q | 92.8 | Very high | 80.9 | Confident | 114 Ų | 114 | 111.8 Ų | 111.8 | 53% | 0.533 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -73.7 | -36.3 | 176.1 | -64.7 | 174.7 | -64.7 | 0 | 0 | 111.2 | S326 A327 L333 | S326-Q329 WeakPolarHBondContact O-CA 3.23Å; S326-Q329 WeakPolarHBondContact O-CB 3.49Å; S326-Q329 PolarHBondContact O-N 3.07Å; A327-Q329 PolarHBondContact O-N 3.26Å; Q329-L333 WeakPolarHBondContact O-CB 3.43Å; Q329-L333 PolarHBondContact O-N 3.41Å |
| 330 | L | 92.2 | Very high | 83.2 | Confident | 97 Ų | 97 | 114.5 Ų | 114.5 | 51% | 0.508 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -68 | -43.9 | 173.1 | -67 | 173.9 | 0 | 0 | 0 | 111.6 | P325 S326 A327 L332 L333 E334 | P325-L330 HydrophobicContact CG-CD2 4.49Å; S326-L330 PolarHBondContact O-N 3.39Å; A327-L330 PolarHBondContact O-N 3.39Å; L330-L332 VanDerWaalsContact C-N 3.34Å; L330-L332 PolarHBondContact O-N 3.05Å; L330-L333 PolarHBondContact O-N 2.98Å; L330-E334 PolarHBondContact O-N 3.24Å |
| 331 | E | 93.9 | Very high | 85.6 | Confident | 118 Ų | 118 | 110.9 Ų | 110.9 | 55% | 0.551 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -59.7 | -43.4 | 174.3 | -173.3 | -177.5 | 176.4 | 0 | 0 | 111.8 | A327 E334 L335 | A327-E331 PolarHBondContact O-N 3.48Å; E331-E334 PolarHBondContact O-N 3.08Å; E331-L335 HydrophobicContact CG-CD1 4.2Å; E331-L335 WeakPolarHBondContact O-CB 3.5Å; E331-L335 WeakPolarHBondContact O-CG 3.35Å; E331-L335 PolarHBondContact O-N 3.25Å |
| 332 | L | 96.2 | Very high | 88.1 | Confident | 116 Ų | 116 | 106.8 Ų | 106.8 | 61% | 0.607 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -63.2 | -41.6 | 176.8 | -177 | 62.2 | 0 | 0 | 0 | 112.3 | Q328 L330 L335 E336 | Q328-L332 VanDerWaalsContact O-CB 3.3Å; Q328-L332 WeakPolarHBondContact O-CB 3.28Å; Q328-L332 PolarHBondContact O-N 2.99Å; L330-L332 VanDerWaalsContact C-N 3.34Å; L330-L332 PolarHBondContact O-N 3.05Å; L332-L335 PolarHBondContact O-N 2.84Å; L332-E336 WeakPolarHBondContact O-CB 3.39Å; L332-E336 PolarHBondContact O-N 3.17Å |
| 333 | L | 95.9 | Very high | 90.3 | Very high | 101 Ų | 101 | 107.5 Ų | 107.5 | 53% | 0.529 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -63.5 | -41.4 | 176 | 179 | 62.7 | 0 | 0 | 0 | 111.6 | Q329 L330 E336 M337 | Q329-L333 WeakPolarHBondContact O-CB 3.43Å; Q329-L333 PolarHBondContact O-N 3.41Å; L330-L333 PolarHBondContact O-N 2.98Å; L333-E336 PolarHBondContact O-N 2.77Å; L333-M337 WeakPolarHBondContact O-CB 3.47Å; L333-M337 WeakPolarHBondContact O-CG 3.42Å; L333-M337 PolarHBondContact O-N 2.91Å |
| 334 | E | 96.2 | Very high | 91.9 | Very high | 98 Ų | 98 | 104.2 Ų | 104.2 | 46% | 0.458 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -64.5 | -45 | 176.1 | -165.3 | -170.4 | 154.9 | 0 | 0 | 111.6 | L330 E331 E336 M337 R338 | L330-E334 PolarHBondContact O-N 3.24Å; E331-E334 PolarHBondContact O-N 3.08Å; E334-E336 VanDerWaalsContact C-N 3.3Å; E334-E336 PolarHBondContact O-N 3.01Å; E334-M337 PolarHBondContact O-N 3.17Å; E334-R338 WeakPolarHBondContact O-CB 3.45Å; E334-R338 VanDerWaalsContact O-CG 3.28Å; E334-R338 WeakPolarHBondContact O-CG 3.4Å; E334-R338 PolarHBondContact O-N 2.97Å; E334-R338 IonicContact OE1-CZ 2.68Å; E334-R338 IonicContact OE1-NE 3.03Å; E334-R338 PolarHBondContact OE1-NE 3.03Å; E334-R338 IonicContact OE1-NH2 2.73Å; E334-R338 PolarHBondContact OE1-NH2 3.12Å |
| 335 | L | 97.5 | Very high | 93 | Very high | 95 Ų | 95 | 103.1 Ų | 103.1 | 50% | 0.497 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -59.3 | -40.1 | 174.3 | -80.3 | 164.5 | 0 | 0 | 0 | 112 | E331 L332 R338 A339 | E331-L335 HydrophobicContact CG-CD1 4.2Å; E331-L335 WeakPolarHBondContact O-CB 3.5Å; E331-L335 WeakPolarHBondContact O-CG 3.35Å; E331-L335 PolarHBondContact O-N 3.25Å; L332-L335 PolarHBondContact O-N 2.84Å; L335-R338 PolarHBondContact O-N 3.04Å; L335-A339 VanDerWaalsContact O-CB 3.3Å; L335-A339 WeakPolarHBondContact O-CB 3.34Å; L335-A339 PolarHBondContact O-N 2.88Å |
| 336 | E | 95.8 | Very high | 93.9 | Very high | 88 Ų | 88 | 106 Ų | 106 | 41% | 0.411 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -66.2 | -45.1 | 176.4 | -160.1 | -164.5 | 124.4 | 0 | 0 | 112 | L332 L333 E334 R338 A339 R340 | L332-E336 WeakPolarHBondContact O-CB 3.39Å; L332-E336 PolarHBondContact O-N 3.17Å; L333-E336 PolarHBondContact O-N 2.77Å; E334-E336 VanDerWaalsContact C-N 3.3Å; E334-E336 PolarHBondContact O-N 3.01Å; E336-R338 PolarHBondContact O-N 3Å; E336-A339 PolarHBondContact O-N 3.18Å; E336-R340 WeakPolarHBondContact O-CG 3.36Å; E336-R340 PolarHBondContact O-N 3.22Å; E336-R340 IonicContact OE1-CZ 3.62Å; E336-R340 IonicContact OE1-NE 2.62Å; E336-R340 PolarHBondContact OE1-NE 2.89Å; E336-R340 IonicContact OE1-NH2 2.77Å; E336-R340 PolarHBondContact OE1-NH2 3.13Å |
| 337 | M | 97.9 | Very high | 94.3 | Very high | 121 Ų | 121 | 111 Ų | 111 | 60% | 0.596 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -57.8 | -47.1 | 174.6 | -79.9 | -115.2 | 53 | 0 | 0 | 111.7 | L333 E334 R340 A341 | L333-M337 WeakPolarHBondContact O-CB 3.47Å; L333-M337 WeakPolarHBondContact O-CG 3.42Å; L333-M337 PolarHBondContact O-N 2.91Å; E334-M337 PolarHBondContact O-N 3.17Å; M337-R340 PolarHBondContact O-N 3.22Å; M337-A341 WeakPolarHBondContact O-CB 3.36Å; M337-A341 PolarHBondContact O-N 3.41Å |
| 338 | R | 96.3 | Very high | 93.9 | Very high | 146 Ų | 146 | 109.7 Ų | 109.7 | 55% | 0.551 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -60.1 | -46.3 | 174.6 | -71.8 | 171.1 | 175.5 | -144.8 | 0.4 | 111.4 | E334 L335 E336 R340 A341 I342 | E334-R338 WeakPolarHBondContact O-CB 3.45Å; E334-R338 VanDerWaalsContact O-CG 3.28Å; E334-R338 WeakPolarHBondContact O-CG 3.4Å; E334-R338 PolarHBondContact O-N 2.97Å; E334-R338 IonicContact OE1-CZ 2.68Å; E334-R338 IonicContact OE1-NE 3.03Å; E334-R338 PolarHBondContact OE1-NE 3.03Å; E334-R338 IonicContact OE1-NH2 2.73Å; E334-R338 PolarHBondContact OE1-NH2 3.12Å; L335-R338 PolarHBondContact O-N 3.04Å; E336-R338 PolarHBondContact O-N 3Å; R338-R340 PolarHBondContact O-N 3.34Å; R338-A341 PolarHBondContact O-N 3.01Å; R338-I342 VanDerWaalsContact O-CG1 3.31Å; R338-I342 WeakPolarHBondContact O-CG1 3.13Å; R338-I342 PolarHBondContact O-N 3.1Å |
| 339 | A | 97.8 | Very high | 92.7 | Very high | 58 Ų | 58 | 104.5 Ų | 104.5 | 48% | 0.479 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.2 | -41.5 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | L335 E336 K343 | L335-A339 VanDerWaalsContact O-CB 3.3Å; L335-A339 WeakPolarHBondContact O-CB 3.34Å; L335-A339 PolarHBondContact O-N 2.88Å; E336-A339 PolarHBondContact O-N 3.18Å; A339-K343 WeakPolarHBondContact O-CB 2.86Å; A339-K343 PolarHBondContact O-N 3.48Å |
| 340 | R | 96.6 | Very high | 91.1 | Very high | 162 Ų | 162 | 104.2 Ų | 104.2 | 61% | 0.611 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -62.5 | -44.1 | 174.6 | -72.5 | 175.6 | -179.7 | -134.3 | 6.3 | 111.6 | E336 M337 R338 K343 A344 | E336-R340 WeakPolarHBondContact O-CG 3.36Å; E336-R340 PolarHBondContact O-N 3.22Å; E336-R340 IonicContact OE1-CZ 3.62Å; E336-R340 IonicContact OE1-NE 2.62Å; E336-R340 PolarHBondContact OE1-NE 2.89Å; E336-R340 IonicContact OE1-NH2 2.77Å; E336-R340 PolarHBondContact OE1-NH2 3.13Å; M337-R340 PolarHBondContact O-N 3.22Å; R338-R340 PolarHBondContact O-N 3.34Å; R340-K343 PolarHBondContact O-N 2.93Å; R340-A344 PolarHBondContact O-N 3.23Å |
| 341 | A | 96.7 | Very high | 89.7 | Confident | 53 Ų | 53 | 106.2 Ų | 106.2 | 44% | 0.438 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -63.6 | -48.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | M337 R338 K343 A344 L345 | M337-A341 WeakPolarHBondContact O-CB 3.36Å; M337-A341 PolarHBondContact O-N 3.41Å; R338-A341 PolarHBondContact O-N 3.01Å; A341-K343 VanDerWaalsContact C-N 3.34Å; A341-K343 PolarHBondContact O-N 3.42Å; A341-A344 PolarHBondContact O-N 3.4Å; A341-L345 WeakPolarHBondContact O-CG 3.47Å; A341-L345 PolarHBondContact O-N 3.34Å |
| 342 | I | 94.6 | Very high | 88.2 | Confident | 96 Ų | 96 | 108.7 Ų | 108.7 | 49% | 0.492 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -59.9 | -44.7 | 176.1 | -67.3 | 165.5 | 0 | 0 | 0 | 110.5 | R338 A344 L345 M346 | R338-I342 VanDerWaalsContact O-CG1 3.31Å; R338-I342 WeakPolarHBondContact O-CG1 3.13Å; R338-I342 PolarHBondContact O-N 3.1Å; I342-A344 VanDerWaalsContact C-N 3.32Å; I342-A344 PolarHBondContact O-N 2.82Å; I342-L345 PolarHBondContact O-N 2.99Å; I342-M346 HydrophobicContact CG2-CG 4.19Å; I342-M346 HydrophobicContact CG2-SD 3.8Å; I342-M346 WeakPolarHBondContact O-CB 3.5Å; I342-M346 VanDerWaalsContact O-CG 3.32Å; I342-M346 WeakPolarHBondContact O-CG 3.47Å; I342-M346 PolarHBondContact O-N 2.93Å |
| 343 | K | 94.6 | Very high | 86.5 | Confident | 159 Ų | 159 | 111 Ų | 111 | 69% | 0.691 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -60.8 | -39.2 | 177.5 | -174.4 | 174.9 | -177 | 176 | 0 | 112.5 | A339 R340 A341 K347 | A339-K343 WeakPolarHBondContact O-CB 2.86Å; A339-K343 PolarHBondContact O-N 3.48Å; R340-K343 PolarHBondContact O-N 2.93Å; A341-K343 VanDerWaalsContact C-N 3.34Å; A341-K343 PolarHBondContact O-N 3.42Å; K343-K347 VanDerWaalsContact O-CB 3.23Å; K343-K347 WeakPolarHBondContact O-CB 3.47Å; K343-K347 PolarHBondContact O-N 3.4Å |
| 344 | A | 93.7 | Very high | 84.8 | Confident | 62 Ų | 62 | 112.2 Ų | 112.2 | 51% | 0.512 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -66.1 | -44.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | R340 A341 I342 K347 A348 | R340-A344 PolarHBondContact O-N 3.23Å; A341-A344 PolarHBondContact O-N 3.4Å; I342-A344 VanDerWaalsContact C-N 3.32Å; I342-A344 PolarHBondContact O-N 2.82Å; A344-K347 PolarHBondContact O-N 2.92Å; A344-A348 WeakPolarHBondContact O-CB 3.39Å; A344-A348 PolarHBondContact O-N 3.06Å |
| 345 | L | 89.8 | Confident | 82.5 | Confident | 129 Ų | 129 | 117.6 Ų | 117.6 | 68% | 0.675 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -64.1 | -45.1 | 177.3 | -70.7 | 171.9 | 0 | 0 | 0 | 112.4 | A341 I342 K347 A348 G349 | A341-L345 WeakPolarHBondContact O-CG 3.47Å; A341-L345 PolarHBondContact O-N 3.34Å; I342-L345 PolarHBondContact O-N 2.99Å; L345-K347 VanDerWaalsContact C-N 3.35Å; L345-K347 PolarHBondContact O-N 2.9Å; L345-A348 CarbonylContact O-C 3.59Å; L345-A348 PolarHBondContact O-N 3.18Å; L345-G349 PolarHBondContact O-N 3.23Å |
| 346 | M | 89.1 | Confident | 81.8 | Confident | 129 Ų | 129 | 118.8 Ų | 118.8 | 64% | 0.635 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -59.2 | -46.9 | 174.1 | -69.6 | 177.4 | 76.6 | 0 | 0 | 110.7 | I342 A348 G349 D350 | I342-M346 HydrophobicContact CG2-CG 4.19Å; I342-M346 HydrophobicContact CG2-SD 3.8Å; I342-M346 WeakPolarHBondContact O-CB 3.5Å; I342-M346 VanDerWaalsContact O-CG 3.32Å; I342-M346 WeakPolarHBondContact O-CG 3.47Å; I342-M346 PolarHBondContact O-N 2.93Å; M346-A348 VanDerWaalsContact C-N 3.28Å; M346-A348 PolarHBondContact O-N 2.95Å; M346-G349 PolarHBondContact O-N 3.36Å; M346-G349 VanDerWaalsContact O-N 3.07Å; M346-D350 PolarHBondContact O-N 2.99Å |
| 347 | K | 89.3 | Confident | 81.1 | Confident | 160 Ų | 160 | 120.4 Ų | 120.4 | 70% | 0.696 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -64.4 | -30.6 | 179.2 | -171.1 | 61.5 | -179.6 | 177 | 0 | 113.3 | K343 A344 L345 | K343-K347 VanDerWaalsContact O-CB 3.23Å; K343-K347 WeakPolarHBondContact O-CB 3.47Å; K343-K347 PolarHBondContact O-N 3.4Å; A344-K347 PolarHBondContact O-N 2.92Å; L345-K347 VanDerWaalsContact C-N 3.35Å; L345-K347 PolarHBondContact O-N 2.9Å |
| 348 | A | 79.5 | Confident | 80.1 | Confident | 52 Ų | 52 | 120.3 Ų | 120.3 | 43% | 0.43 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -83.6 | -17.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | A344 L345 M346 I351 | A344-A348 WeakPolarHBondContact O-CB 3.39Å; A344-A348 PolarHBondContact O-N 3.06Å; L345-A348 CarbonylContact O-C 3.59Å; L345-A348 PolarHBondContact O-N 3.18Å; M346-A348 VanDerWaalsContact C-N 3.28Å; M346-A348 PolarHBondContact O-N 2.95Å; A348-I351 WeakPolarHBondContact O-CG1 3.33Å |
| 349 | G | 69.6 | Low | 79.2 | Confident | 41 Ų | 41 | 118.8 Ų | 118.8 | 42% | 0.423 | 64% | 0.643 | S | S | . | * | H | α-helix | trans | -78.2 | -37.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | L345 M346 I351 K352 | L345-G349 PolarHBondContact O-N 3.23Å; M346-G349 PolarHBondContact O-N 3.36Å; M346-G349 VanDerWaalsContact O-N 3.07Å; G349-I351 PolarHBondContact O-N 2.77Å; G349-K352 PolarHBondContact O-N 2.58Å |
| 350 | D | 60.8 | Low | 78 | Confident | 108 Ų | 108 | 122.6 Ų | 122.6 | 58% | 0.578 | 65% | 0.653 | S | S | * | * | G | 310 helix | trans | -66.3 | -19.9 | -177.3 | -81.7 | -44 | 0 | 0 | 0 | 114.5 | M346 K352 | M346-D350 PolarHBondContact O-N 2.99Å; D350-K352 PolarHBondContact O-N 3.33Å |
| 351 | I | 61.3 | Low | 76.8 | Confident | 138 Ų | 138 | 120 Ų | 120 | 71% | 0.708 | 66% | 0.656 | S | S | * | * | G | 310 helix | trans | -80.6 | 5.5 | 176.8 | 52.5 | 169.1 | 0 | 0 | 0 | 114.2 | A348 G349 | A348-I351 WeakPolarHBondContact O-CG1 3.33Å; G349-I351 PolarHBondContact O-N 2.77Å |
| 352 | K | 62.2 | Low | 75.3 | Confident | 170 Ų | 170 | 124.8 Ų | 124.8 | 74% | 0.739 | 67% | 0.672 | S | S | * | * | G | 310 helix | trans | -124.2 | 30.4 | -176.8 | -66.1 | -173.5 | -178.9 | 177.5 | 0 | 114.8 | G349 D350 P354 | G349-K352 PolarHBondContact O-N 2.58Å; D350-K352 PolarHBondContact O-N 3.33Å; K352-P354 VanDerWaalsContact O-CD 3.28Å; K352-P354 WeakPolarHBondContact O-CD 3.28Å |
| 353 | K | 60.7 | Low | 73.9 | Confident | 164 Ų | 164 | 127 Ų | 127 | 71% | 0.713 | 69% | 0.685 | S | S | * | * | trans | -100.1 | 96.6 | 162.1 | -72 | 175.6 | -176.8 | 161.2 | 0 | 109.2 | ||||
| 354 | P | 60.6 | Low | 72.1 | Confident | 128 Ų | 128 | 124.3 Ų | 124.3 | 83% | 0.831 | 69% | 0.685 | S | S | * | * | trans | -64.7 | 137.5 | 166.5 | 28.6 | -32.8 | 0 | 0 | 0 | 109.4 | K352 | K352-P354 VanDerWaalsContact O-CD 3.28Å; K352-P354 WeakPolarHBondContact O-CD 3.28Å | ||
| 355 | V | 49.1 | Very low | 70.2 | Confident | 211 Ų | 211 | 130 Ų | 130 | 100% | 1.279 | 70% | 0.701 | S | S | * | * | trans | -100.3 | 0 | 169.2 | 175.8 | 0 | 0 | 0 | 0 | 108.1 |
Retrieved 355 of 355 residues in 173.5 ms
(Link to these results)