| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 41.3 | Very low | 38.1 | Very low | 235 Ų | 235 | 141.5 Ų | 141.5 | 100% | 1.158 | 81% | 0.813 | S | S | * | * | 0 | 92.2 | 0 | -74 | 179.6 | 150.4 | 0 | 0 | 106.1 | |||||
| 2 | E | 36.2 | Very low | 37.8 | Very low | 174 Ų | 174 | 138.3 Ų | 138.3 | 81% | 0.813 | 81% | 0.805 | S | S | * | * | 74.1 | 90.7 | 105.6 | -79.1 | -169.3 | 164.3 | 0 | 0 | 111 | |||||
| 3 | T | 42.3 | Very low | 37.5 | Very low | 124 Ų | 124 | 135.8 Ų | 135.8 | 76% | 0.761 | 80% | 0.801 | S | S | * | * | 88.2 | 122.1 | 86.6 | 47.4 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 4 | K | 49.8 | Very low | 37.2 | Very low | 209 Ų | 209 | 134.1 Ų | 134.1 | 91% | 0.909 | 80% | 0.799 | S | S | * | * | trans | 151.6 | 104.7 | 147.2 | -84.5 | 168.3 | -174.4 | -174.4 | 0 | 105.9 | ||||
| 5 | G | 38.9 | Very low | 37.1 | Very low | 72 Ų | 72 | 131.3 Ų | 131.3 | 74% | 0.742 | 80% | 0.797 | S | S | * | * | cis | 91 | 88.7 | 32.6 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 6 | S | 38.2 | Very low | 37.7 | Very low | 125 Ų | 125 | 131.2 Ų | 131.2 | 87% | 0.874 | 80% | 0.8 | S | S | * | * | trans | -158.4 | 100.1 | 154.5 | -82.1 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 7 | T | 36.7 | Very low | 37.5 | Very low | 119 Ų | 119 | 133.7 Ų | 133.7 | 73% | 0.73 | 80% | 0.801 | S | S | * | * | trans | -31.9 | 130.7 | 156.8 | -46.3 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 8 | V | 31.8 | Very low | 37.2 | Very low | 145 Ų | 145 | 134.4 Ų | 134.4 | 88% | 0.879 | 80% | 0.799 | S | S | * | * | trans | -142.1 | 111.8 | 132.4 | 179.4 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 9 | T | 37.9 | Very low | 36.9 | Very low | 97 Ų | 97 | 132.9 Ų | 132.9 | 60% | 0.595 | 80% | 0.797 | S | S | * | * | trans | -87.7 | 142.7 | 164.6 | -34.4 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 10 | I | 32.4 | Very low | 36.6 | Very low | 164 Ų | 164 | 132.4 Ų | 132.4 | 84% | 0.841 | 80% | 0.799 | S | S | * | * | 174.3 | 133.6 | 117.4 | -82.6 | 154.8 | 0 | 0 | 0 | 110.5 | |||||
| 11 | S | 34.1 | Very low | 36.3 | Very low | 92 Ų | 92 | 129.9 Ų | 129.9 | 64% | 0.643 | 80% | 0.8 | S | S | * | * | trans | -79.5 | 152.1 | -179 | -37.1 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 12 | S | 34.2 | Very low | 35.8 | Very low | 103 Ų | 103 | 125.9 Ų | 125.9 | 72% | 0.72 | 78% | 0.784 | S | S | * | * | trans | 38.8 | 129.2 | 132.6 | 61.8 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 13 | S | 33.8 | Very low | 35.7 | Very low | 107 Ų | 107 | 124.5 Ų | 124.5 | 75% | 0.748 | 79% | 0.787 | S | S | * | * | 97 | 143.1 | 129.4 | 79.2 | 0 | 0 | 0 | 0 | 120.9 | |||||
| 14 | S | 33 | Very low | 35.2 | Very low | 111 Ų | 111 | 125.3 Ų | 125.3 | 78% | 0.776 | 79% | 0.787 | S | S | * | * | trans | 91 | 124 | 150.2 | 68.3 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 15 | A | 36.4 | Very low | 34.3 | Very low | 93 Ų | 93 | 125.5 Ų | 125.5 | 77% | 0.769 | 79% | 0.788 | S | S | * | * | trans | -64.3 | 161.8 | 155.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 16 | P | 45.5 | Very low | 34 | Very low | 129 Ų | 129 | 133.1 Ų | 133.1 | 84% | 0.838 | 80% | 0.795 | S | S | * | * | -146.1 | 169.7 | 119.2 | 33.3 | -15.5 | 0 | 0 | 0 | 115.7 | |||||
| 17 | Q | 35.8 | Very low | 33.6 | Very low | 174 Ų | 174 | 133.8 Ų | 133.8 | 81% | 0.813 | 79% | 0.794 | S | S | * | * | trans | -75.1 | 157.3 | 176.6 | -66.3 | 178.6 | -27.9 | 0 | 0 | 114.5 | ||||
| 18 | N | 31.6 | Very low | 33.2 | Very low | 146 Ų | 146 | 133.2 Ų | 133.2 | 78% | 0.781 | 80% | 0.795 | S | S | * | * | trans | 49.2 | 118.4 | 144 | -75.1 | -7.8 | 0 | 0 | 0 | 121.4 | ||||
| 19 | S | 31.4 | Very low | 33.1 | Very low | 107 Ų | 107 | 131.2 Ų | 131.2 | 75% | 0.748 | 79% | 0.787 | S | S | * | * | 153.4 | 132.6 | 97.5 | 56.7 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 20 | S | 31.7 | Very low | 32.7 | Very low | 121 Ų | 121 | 132.2 Ų | 132.2 | 85% | 0.846 | 80% | 0.798 | S | S | * | * | trans | 52.1 | 119.1 | 146.2 | 41.8 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 21 | G | 30 | Very low | 32.8 | Very low | 80 Ų | 80 | 131.1 Ų | 131.1 | 83% | 0.825 | 79% | 0.794 | S | S | * | * | trans | -175.3 | 103.5 | 158 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 22 | N | 30.8 | Very low | 32.7 | Very low | 152 Ų | 152 | 134.8 Ų | 134.8 | 81% | 0.813 | 81% | 0.806 | S | S | * | * | trans | -49.8 | 140 | 179.6 | -79 | -12.3 | 0 | 0 | 0 | 116 | ||||
| 23 | T | 32.7 | Very low | 32.6 | Very low | 144 Ų | 144 | 134.7 Ų | 134.7 | 88% | 0.883 | 81% | 0.806 | S | S | * | * | trans | -147.3 | 132.9 | 132.3 | 32.4 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 24 | N | 33 | Very low | 32.5 | Very low | 142 Ų | 142 | 135.2 Ų | 135.2 | 76% | 0.759 | 81% | 0.808 | S | S | * | * | trans | -73.8 | 133.6 | -169.9 | -58.1 | -61.4 | 0 | 0 | 0 | 112.2 | ||||
| 25 | F | 30.4 | Very low | 32.4 | Very low | 212 Ų | 212 | 135.3 Ų | 135.3 | 93% | 0.93 | 81% | 0.807 | S | S | * | * | trans | -132.3 | 124.7 | 147 | -109.2 | -87.2 | 0 | 0 | 0 | 110 | ||||
| 26 | R | 32.8 | Very low | 32 | Very low | 233 Ų | 233 | 139.9 Ų | 139.9 | 88% | 0.879 | 81% | 0.812 | S | S | * | * | trans | -92.9 | 123.9 | -171.6 | -179.4 | -171.8 | -90.1 | -157.8 | -5.3 | 107.9 | ||||
| 27 | T | 30.1 | Very low | 31.3 | Very low | 138 Ų | 138 | 141.6 Ų | 141.6 | 85% | 0.847 | 81% | 0.814 | S | S | * | * | trans | -149.3 | 112.2 | 152.4 | -18.9 | 0 | 0 | 0 | 0 | 108.9 | S29 | T27-S29 PolarHBondContact O-N 3.11Š| ||
| 28 | S | 28.3 | Very low | 31.1 | Very low | 108 Ų | 108 | 137 Ų | 137 | 76% | 0.755 | 81% | 0.814 | S | S | * | * | trans | -68.2 | 113.9 | -177.4 | 39.2 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 29 | S | 29.3 | Very low | 31 | Very low | 103 Ų | 103 | 139.1 Ų | 139.1 | 72% | 0.72 | 82% | 0.819 | S | S | * | * | trans | -92.7 | 123.7 | 155.7 | 172.5 | 0 | 0 | 0 | 0 | 107.9 | T27 | T27-S29 PolarHBondContact O-N 3.11Š| ||
| 30 | S | 30.5 | Very low | 31 | Very low | 117 Ų | 117 | 139.7 Ų | 139.7 | 82% | 0.818 | 82% | 0.823 | S | S | * | * | trans | -108.2 | 101.9 | 166 | -65.4 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 31 | N | 33.2 | Very low | 31 | Very low | 142 Ų | 142 | 140.4 Ų | 140.4 | 76% | 0.759 | 82% | 0.823 | S | S | * | * | trans | -65.3 | 140.9 | 153.4 | -81 | -23.9 | 0 | 0 | 0 | 108.7 | ||||
| 32 | N | 31.9 | Very low | 31.3 | Very low | 168 Ų | 168 | 139.8 Ų | 139.8 | 90% | 0.898 | 82% | 0.816 | S | S | * | * | trans | -144 | 123.2 | 142.5 | -104 | -6.8 | 0 | 0 | 0 | 109.9 | ||||
| 33 | S | 32.1 | Very low | 31.3 | Very low | 102 Ų | 102 | 140.7 Ų | 140.7 | 71% | 0.713 | 82% | 0.82 | S | S | * | * | trans | -80.4 | 146.5 | 173.8 | 50 | 0 | 0 | 0 | 0 | 112 | ||||
| 34 | C | 31.4 | Very low | 31.4 | Very low | 117 Ų | 117 | 140.4 Ų | 140.4 | 79% | 0.791 | 82% | 0.818 | S | S | * | * | trans | 44.8 | 118.5 | 140.1 | -61 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 35 | C | 30.8 | Very low | 31.3 | Very low | 114 Ų | 114 | 143 Ų | 143 | 77% | 0.77 | 83% | 0.826 | S | S | * | * | 163.6 | 127.5 | 104.6 | -84.5 | 0 | 0 | 0 | 0 | 108.6 | |||||
| 36 | H | 29.5 | Very low | 31.3 | Very low | 188 Ų | 188 | 142.9 Ų | 142.9 | 87% | 0.87 | 82% | 0.819 | S | S | * | * | trans | -177 | 129.5 | 132.4 | -96.3 | -60.1 | 0 | 0 | 0 | 111.5 | ||||
| 37 | D | 30.9 | Very low | 31.6 | Very low | 165 Ų | 165 | 138.3 Ų | 138.3 | 88% | 0.882 | 82% | 0.817 | S | S | * | * | trans | -49.2 | 151 | 165.3 | -65.6 | -66.5 | 0 | 0 | 0 | 113.8 | ||||
| 38 | G | 30.1 | Very low | 31.9 | Very low | 78 Ų | 78 | 137.5 Ų | 137.5 | 80% | 0.804 | 82% | 0.815 | S | S | * | * | trans | 179.7 | 96.1 | 168.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 39 | Q | 30.4 | Very low | 32.2 | Very low | 190 Ų | 190 | 140.9 Ų | 140.9 | 89% | 0.888 | 82% | 0.818 | S | S | * | * | trans | -53.5 | 141.3 | 179.8 | -73.2 | 163.8 | -12.2 | 0 | 0 | 114.1 | ||||
| 40 | S | 30.6 | Very low | 32.6 | Very low | 120 Ų | 120 | 139.5 Ų | 139.5 | 84% | 0.839 | 82% | 0.821 | S | S | * | * | trans | -74.4 | 126.1 | 162.6 | -164 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 41 | T | 32.8 | Very low | 32.7 | Very low | 136 Ų | 136 | 145.5 Ų | 145.5 | 83% | 0.834 | 83% | 0.826 | S | S | * | * | trans | -124.4 | 113.7 | 156.5 | 27.2 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 42 | G | 34.9 | Very low | 32.7 | Very low | 67 Ų | 67 | 142.6 Ų | 142.6 | 69% | 0.691 | 83% | 0.829 | S | S | * | * | trans | -73.9 | 154.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 43 | L | 31.3 | Very low | 32.7 | Very low | 171 Ų | 171 | 141 Ų | 141 | 90% | 0.895 | 83% | 0.83 | S | S | * | * | trans | -140.1 | 105.4 | 159.6 | -97.2 | 163.9 | 0 | 0 | 0 | 109.3 | Q45 | L43-Q45 PolarHBondContact O-N 3.24Š| ||
| 44 | T | 34.8 | Very low | 32.8 | Very low | 137 Ų | 137 | 139 Ų | 139 | 84% | 0.84 | 83% | 0.825 | S | S | * | * | trans | -48.6 | 119.8 | 164.1 | -47.9 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 45 | Q | 31 | Very low | 33.2 | Very low | 196 Ų | 196 | 139.8 Ų | 139.8 | 92% | 0.916 | 83% | 0.829 | S | S | * | * | trans | -93.4 | 102.5 | 166.7 | -96.3 | 179 | 2.8 | 0 | 0 | 110.3 | L43 | L43-Q45 PolarHBondContact O-N 3.24Š| ||
| 46 | R | 30.4 | Very low | 33.4 | Very low | 211 Ų | 211 | 140.5 Ų | 140.5 | 80% | 0.796 | 83% | 0.83 | S | S | * | * | trans | -60.2 | 132.9 | 154.3 | -101.7 | -177.6 | 177.5 | -173.1 | -1 | 109.5 | ||||
| 47 | T | 40 | Very low | 33.9 | Very low | 136 Ų | 136 | 136.9 Ų | 136.9 | 83% | 0.834 | 82% | 0.823 | S | S | * | * | trans | -52.7 | 143.8 | 151.4 | 9.2 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 48 | P | 36.6 | Very low | 33.9 | Very low | 122 Ų | 122 | 134.9 Ų | 134.9 | 79% | 0.792 | 82% | 0.82 | S | S | * | * | -130 | 148.4 | 129.5 | 15 | 5 | 0 | 0 | 0 | 113.2 | |||||
| 49 | Q | 34.6 | Very low | 34 | Very low | 178 Ų | 178 | 139.2 Ų | 139.2 | 83% | 0.832 | 82% | 0.824 | S | S | * | * | trans | -48.6 | 144.5 | 175.2 | -73.5 | 149.6 | -31.6 | 0 | 0 | 113.4 | ||||
| 50 | G | 37 | Very low | 34.1 | Very low | 75 Ų | 75 | 141.4 Ų | 141.4 | 77% | 0.773 | 83% | 0.826 | S | S | * | * | trans | -64 | 145.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 51 | W | 32.8 | Very low | 34.1 | Very low | 243 Ų | 243 | 147.2 Ų | 147.2 | 92% | 0.92 | 83% | 0.829 | S | S | * | * | trans | -124.5 | 109 | 161 | -76.1 | 56.9 | 0 | 0 | 0 | 105.8 | ||||
| 52 | G | 33.4 | Very low | 34.3 | Very low | 81 Ų | 81 | 146.8 Ų | 146.8 | 84% | 0.835 | 83% | 0.827 | S | S | * | * | trans | -76.6 | 125.8 | 168.2 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 53 | C | 31.7 | Very low | 34.4 | Very low | 134 Ų | 134 | 148.7 Ų | 148.7 | 91% | 0.905 | 83% | 0.827 | S | S | * | * | trans | -98.3 | 104.5 | 163.3 | -87.2 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 54 | G | 33.7 | Very low | 34.6 | Very low | 59 Ų | 59 | 147.3 Ų | 147.3 | 61% | 0.608 | 82% | 0.821 | S | S | * | * | trans | -85 | 149.8 | 159.7 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 55 | P | 39.2 | Very low | 34.6 | Very low | 135 Ų | 135 | 151 Ų | 151 | 88% | 0.877 | 82% | 0.821 | S | S | * | * | trans | -79.3 | 134.3 | 179.4 | 32 | -30.4 | 0 | 0 | 0 | 109.9 | ||||
| 56 | T | 34.8 | Very low | 34.8 | Very low | 129 Ų | 129 | 149.7 Ų | 149.7 | 79% | 0.791 | 82% | 0.819 | S | S | * | * | trans | -111.2 | 135.8 | 169.2 | -41.6 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 57 | P | 40.1 | Very low | 34.9 | Very low | 111 Ų | 111 | 147.2 Ų | 147.2 | 72% | 0.721 | 82% | 0.82 | S | S | * | * | trans | -83.2 | 141.8 | -172.6 | -6.6 | 25.2 | 0 | 0 | 0 | 113.3 | L59 | P57-L59 PolarHBondContact O-N 2.84Š| ||
| 58 | C | 31.1 | Very low | 34.5 | Very low | 123 Ų | 123 | 149.8 Ų | 149.8 | 83% | 0.831 | 82% | 0.815 | S | S | * | * | trans | -76.3 | 110.9 | 173.2 | -43.3 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 59 | L | 32.3 | Very low | 34.6 | Very low | 169 Ų | 169 | 149.5 Ų | 149.5 | 89% | 0.885 | 81% | 0.813 | S | S | * | * | trans | -83.3 | 115.6 | 169.4 | -71.9 | 171.5 | 0 | 0 | 0 | 109.9 | P57 | P57-L59 PolarHBondContact O-N 2.84Š| ||
| 60 | Y | 32.4 | Very low | 34.5 | Very low | 237 Ų | 237 | 149.9 Ų | 149.9 | 93% | 0.929 | 81% | 0.808 | S | S | * | * | trans | -64.8 | 128.6 | 161.7 | -88.7 | -94.1 | 0 | 0 | 0 | 109.6 | ||||
| 61 | R | 31.8 | Very low | 34.5 | Very low | 241 Ų | 241 | 155.3 Ų | 155.3 | 91% | 0.909 | 81% | 0.813 | S | S | * | * | trans | -116.6 | 109.6 | 169.1 | -161 | 179.5 | -151.5 | -121.8 | 5.1 | 109.3 | ||||
| 62 | T | 36.2 | Very low | 34.2 | Very low | 127 Ų | 127 | 153.4 Ų | 153.4 | 78% | 0.779 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 145.9 | 164.5 | 7.9 | 0 | 0 | 0 | 0 | 111 | ||
| 63 | P | 37.8 | Very low | 34.2 | Very low | 108 Ų | 108 | 157.8 Ų | 157.8 | 70% | 0.701 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -101.4 | 121.6 | 155.3 | 5.9 | 13.9 | 0 | 0 | 0 | 110.8 | ||
| 64 | N | 34.9 | Very low | 34.7 | Very low | 142 Ų | 142 | 156.4 Ų | 156.4 | 76% | 0.759 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -73 | 132.3 | 161.7 | -85.5 | -43.7 | 0 | 0 | 0 | 109.9 | ||
| 65 | Y | 33.9 | Very low | 34.5 | Very low | 213 Ų | 213 | 159.8 Ų | 159.8 | 84% | 0.835 | 81% | 0.812 | S | S | * | * | trans | -131.3 | 103.8 | 148.4 | -72.1 | -72.9 | 0 | 0 | 0 | 109 | ||||
| 66 | L | 35.6 | Very low | 34.4 | Very low | 170 Ų | 170 | 161.2 Ų | 161.2 | 89% | 0.89 | 81% | 0.811 | S | S | * | * | trans | -85.3 | 109 | 163.6 | -73.8 | 168.5 | 0 | 0 | 0 | 107.5 | ||||
| 67 | I | 32.2 | Very low | 34.1 | Very low | 158 Ų | 158 | 163.9 Ų | 163.9 | 81% | 0.81 | 82% | 0.815 | S | S | * | * | trans | -104 | 116.8 | 160.8 | -65.4 | 179.7 | 0 | 0 | 0 | 107.7 | ||||
| 68 | R | 33.3 | Very low | 33.8 | Very low | 191 Ų | 191 | 165.5 Ų | 165.5 | 72% | 0.721 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 134.8 | 176.3 | -156.5 | -174.4 | -151.8 | -170.5 | 6.8 | 109 | ||
| 69 | P | 37.6 | Very low | 33.8 | Very low | 116 Ų | 116 | 165.7 Ų | 165.7 | 75% | 0.753 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -86.5 | 124.9 | 173.4 | 31.3 | -27.9 | 0 | 0 | 0 | 110 | ||
| 70 | Y | 33.1 | Very low | 34.1 | Very low | 186 Ų | 186 | 162.6 Ų | 162.6 | 73% | 0.729 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -87.1 | 117.1 | 164 | -80.6 | -77.2 | 0 | 0 | 0 | 109.2 | ||
| 71 | H | 36.1 | Very low | 34.2 | Very low | 189 Ų | 189 | 163 Ų | 163 | 88% | 0.875 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 131 | 160.5 | -86.5 | -71 | 0 | 0 | 0 | 110.3 | ||
| 72 | F | 27.6 | Very low | 34.7 | Very low | 202 Ų | 202 | 156.8 Ų | 156.8 | 89% | 0.886 | 80% | 0.804 | S | S | * | * | trans | -109 | 119.4 | 155.8 | -102.6 | -89.4 | 0 | 0 | 0 | 108.5 | ||||
| 73 | H | 33 | Very low | 34.7 | Very low | 173 Ų | 173 | 154.6 Ų | 154.6 | 80% | 0.801 | 81% | 0.806 | S | S | * | * | trans | -87.2 | 147.5 | 168.9 | -149.1 | -89.4 | 0 | 0 | 0 | 108.3 | ||||
| 74 | P | 41.5 | Very low | 34.8 | Very low | 105 Ų | 105 | 158.9 Ų | 158.9 | 68% | 0.682 | 82% | 0.817 | S | S | * | * | trans | -85.8 | 137.4 | -177.8 | 25.3 | -15.2 | 0 | 0 | 0 | 110.8 | ||||
| 75 | C | 30 | Very low | 35.6 | Very low | 131 Ų | 131 | 155 Ų | 155 | 89% | 0.885 | 81% | 0.811 | S | S | * | * | trans | -128.5 | 112.6 | 160.8 | -90 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 76 | L | 36.2 | Very low | 36.4 | Very low | 164 Ų | 164 | 153.2 Ų | 153.2 | 86% | 0.859 | 81% | 0.814 | S | S | * | * | trans | -53.6 | 130.3 | 156.7 | -175.1 | 78.6 | 0 | 0 | 0 | 110.3 | ||||
| 77 | E | 29.1 | Very low | 37.2 | Very low | 186 Ų | 186 | 149.8 Ų | 149.8 | 87% | 0.869 | 80% | 0.796 | S | S | * | * | trans | -167.1 | 151.4 | 131.6 | -113.3 | 177.3 | -168.4 | 0 | 0 | 112.3 | ||||
| 78 | D | 33.5 | Very low | 38.4 | Very low | 144 Ų | 144 | 146.4 Ų | 146.4 | 77% | 0.77 | 79% | 0.787 | S | S | * | * | trans | -62.4 | 146.3 | -164.3 | -71 | -52.6 | 0 | 0 | 0 | 116 | ||||
| 79 | C | 32.3 | Very low | 40 | Very low | 128 Ų | 128 | 144.2 Ų | 144.2 | 87% | 0.865 | 79% | 0.785 | S | S | * | * | trans | -145.3 | 94.3 | 135.6 | -119.6 | 0 | 0 | 0 | 0 | 110.5 | W81 | C79-W81 PolarHBondContact O-N 2.88Š| ||
| 80 | S | 38.7 | Very low | 41.4 | Very low | 104 Ų | 104 | 143.9 Ų | 143.9 | 73% | 0.727 | 77% | 0.773 | S | S | * | * | trans | -62.5 | 115.3 | 156.5 | 176.6 | 0 | 0 | 0 | 0 | 109 | ||||
| 81 | W | 34.7 | Very low | 43.5 | Very low | 244 Ų | 244 | 142.3 Ų | 142.3 | 92% | 0.924 | 77% | 0.77 | S | S | * | * | trans | -135.6 | 118.2 | 155.8 | -155.4 | -54.6 | 0 | 0 | 0 | 109.3 | C79 | C79-W81 PolarHBondContact O-N 2.88Š| ||
| 82 | C | 41.1 | Very low | 45.3 | Very low | 112 Ų | 112 | 138.7 Ų | 138.7 | 76% | 0.757 | 75% | 0.753 | S | S | * | * | trans | -64.1 | 143.9 | -177.4 | -56.5 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 83 | G | 35.9 | Very low | 47.6 | Very low | 81 Ų | 81 | 132.4 Ų | 132.4 | 84% | 0.835 | 73% | 0.732 | S | S | * | * | trans | -155.7 | 74.9 | 169 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 84 | E | 40.1 | Very low | 50 | Low | 197 Ų | 197 | 128.6 Ų | 128.6 | 92% | 0.921 | 72% | 0.715 | S | S | * | * | trans | -69.4 | 132.5 | 179.1 | -161.7 | 161.8 | -153.8 | 0 | 0 | 110.4 | ||||
| 85 | G | 52.6 | Low | 52 | Low | 62 Ų | 62 | 128.4 Ų | 128.4 | 64% | 0.639 | 71% | 0.705 | S | S | * | * | S | Bend | trans | 64.2 | 96.8 | 155.1 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||
| 86 | I | 49.6 | Very low | 54.7 | Low | 174 Ų | 174 | 126.4 Ų | 126.4 | 89% | 0.892 | 69% | 0.689 | S | S | * | * | S | Bend | trans | 148 | 69.2 | 144.3 | -68 | 149 | 0 | 0 | 0 | 106.8 | ||
| 87 | N | 53.8 | Low | 57.1 | Low | 98 Ų | 98 | 123.6 Ų | 123.6 | 52% | 0.524 | 68% | 0.675 | S | S | . | * | trans | -158.7 | 28.4 | 170.9 | -136.2 | 11 | 0 | 0 | 0 | 117.3 | H89 E90 K91 | N87-H89 PolarHBondContact O-N 2.94Å; N87-E90 PolarHBondContact ND2-OE2 3Å; N87-E90 PolarHBondContact O-N 3.27Å; N87-E90 VanDerWaalsContact OD1-CB 3.26Å; N87-E90 WeakPolarHBondContact OD1-CB 3.14Å; N87-E90 PolarHBondContact OD1-OE2 3.42Å; N87-K91 PolarHBondContact O-N 2.84Å | ||
| 88 | S | 57.4 | Low | 59.9 | Low | 88 Ų | 88 | 118.8 Ų | 118.8 | 62% | 0.615 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -59.4 | -34.7 | -176.3 | -149.4 | 0 | 0 | 0 | 0 | 113 | E92 | S88-E92 WeakPolarHBondContact O-CG 3.45Å; S88-E92 PolarHBondContact O-N 3.24Å |
| 89 | H | 65.8 | Low | 62.6 | Low | 144 Ų | 144 | 117.2 Ų | 117.2 | 67% | 0.667 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -73.2 | -41.9 | -178.1 | -172.8 | -73.9 | 0 | 0 | 0 | 112.9 | N87 K91 E92 T93 | N87-H89 PolarHBondContact O-N 2.94Å; H89-K91 VanDerWaalsContact C-N 3.32Å; H89-K91 PolarHBondContact O-N 2.74Å; H89-E92 PolarHBondContact O-N 2.87Å; H89-T93 WeakPolarHBondContact O-CG2 3.3Å; H89-T93 PolarHBondContact O-N 3.46Å; H89-T93 PolarHBondContact O-OG1 3.36Å |
| 90 | E | 68.1 | Low | 65.4 | Low | 110 Ų | 110 | 117.9 Ų | 117.9 | 51% | 0.514 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -68 | -36 | 178.2 | -164.3 | 175.7 | 176.3 | 0 | 0 | 111.1 | N87 T93 M94 | N87-E90 PolarHBondContact ND2-OE2 3Å; N87-E90 PolarHBondContact O-N 3.27Å; N87-E90 VanDerWaalsContact OD1-CB 3.26Å; N87-E90 WeakPolarHBondContact OD1-CB 3.14Å; N87-E90 PolarHBondContact OD1-OE2 3.42Å; E90-T93 VanDerWaalsContact CA-OG1 3.31Å; E90-T93 WeakPolarHBondContact CA-OG1 3.31Å; E90-T93 PolarHBondContact O-N 2.95Å; E90-T93 PolarHBondContact O-OG1 2.89Å; E90-M94 WeakPolarHBondContact O-CB 3.39Å; E90-M94 WeakPolarHBondContact O-CG 3.19Å; E90-M94 PolarHBondContact O-N 3.29Å |
| 91 | K | 75.8 | Confident | 67.9 | Low | 152 Ų | 152 | 117.5 Ų | 117.5 | 66% | 0.661 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -65.1 | -42.5 | 174.2 | -169.7 | 178.8 | 179.2 | -177.7 | 0 | 112.4 | N87 H89 M94 Q95 | N87-K91 PolarHBondContact O-N 2.84Å; H89-K91 VanDerWaalsContact C-N 3.32Å; H89-K91 PolarHBondContact O-N 2.74Å; K91-M94 PolarHBondContact O-N 3.15Å; K91-Q95 VanDerWaalsContact O-CB 3.31Å; K91-Q95 WeakPolarHBondContact O-CB 3.36Å; K91-Q95 PolarHBondContact O-N 3.45Å |
| 92 | E | 75.4 | Confident | 70.5 | Confident | 113 Ų | 113 | 108.6 Ų | 108.6 | 53% | 0.528 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -64 | -42.2 | 174.4 | -79.9 | 170.6 | -160.7 | 0 | 0 | 111.7 | S88 H89 M94 Q95 T96 | S88-E92 WeakPolarHBondContact O-CG 3.45Å; S88-E92 PolarHBondContact O-N 3.24Å; H89-E92 PolarHBondContact O-N 2.87Å; E92-M94 PolarHBondContact O-N 3.11Å; E92-Q95 WeakPolarHBondContact O-CB 3.47Å; E92-Q95 PolarHBondContact O-N 2.83Å; E92-Q95 VanDerWaalsContact O-N 3.17Å; E92-T96 PolarHBondContact O-N 3.29Å; E92-T96 PolarHBondContact O-OG1 3.18Å; E92-T96 VanDerWaalsContact O-OG1 3.06Å |
| 93 | T | 75.6 | Confident | 73 | Confident | 70 Ų | 70 | 106.5 Ų | 106.5 | 43% | 0.429 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -64.6 | -39.6 | 175.6 | 52.2 | 0 | 0 | 0 | 0 | 112.8 | H89 E90 Q95 T96 L97 | H89-T93 WeakPolarHBondContact O-CG2 3.3Å; H89-T93 PolarHBondContact O-N 3.46Å; H89-T93 PolarHBondContact O-OG1 3.36Å; E90-T93 VanDerWaalsContact CA-OG1 3.31Å; E90-T93 WeakPolarHBondContact CA-OG1 3.31Å; E90-T93 PolarHBondContact O-N 2.95Å; E90-T93 PolarHBondContact O-OG1 2.89Å; T93-Q95 VanDerWaalsContact C-N 3.31Å; T93-T96 PolarHBondContact O-N 2.87Å; T93-L97 WeakPolarHBondContact O-CB 3.41Å; T93-L97 PolarHBondContact O-N 3.42Å |
| 94 | M | 82.9 | Confident | 75.7 | Confident | 93 Ų | 93 | 108.4 Ų | 108.4 | 46% | 0.458 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -65.9 | -35.5 | 173.3 | -81.8 | -60 | -57.1 | 0 | 0 | 111.9 | E90 K91 E92 L97 N98 | E90-M94 WeakPolarHBondContact O-CB 3.39Å; E90-M94 WeakPolarHBondContact O-CG 3.19Å; E90-M94 PolarHBondContact O-N 3.29Å; K91-M94 PolarHBondContact O-N 3.15Å; E92-M94 PolarHBondContact O-N 3.11Å; M94-L97 PolarHBondContact O-N 3.49Å; M94-N98 VanDerWaalsContact O-CB 3.24Å; M94-N98 WeakPolarHBondContact O-CB 3.49Å; M94-N98 PolarHBondContact O-N 2.92Å; M94-N98 PolarHBondContact O-ND2 2.87Å |
| 95 | Q | 83.3 | Confident | 78.3 | Confident | 101 Ų | 101 | 103.7 Ų | 103.7 | 47% | 0.472 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -67.6 | -43.6 | 176.4 | -170.1 | 167.5 | -11.6 | 0 | 0 | 111.6 | K91 E92 T93 L97 N98 E99 | K91-Q95 VanDerWaalsContact O-CB 3.31Å; K91-Q95 WeakPolarHBondContact O-CB 3.36Å; K91-Q95 PolarHBondContact O-N 3.45Å; E92-Q95 WeakPolarHBondContact O-CB 3.47Å; E92-Q95 PolarHBondContact O-N 2.83Å; E92-Q95 VanDerWaalsContact O-N 3.17Å; T93-Q95 VanDerWaalsContact C-N 3.31Å; Q95-L97 VanDerWaalsContact C-N 3.34Å; Q95-L97 PolarHBondContact O-N 2.96Å; Q95-N98 PolarHBondContact O-N 2.91Å; Q95-E99 WeakPolarHBondContact O-CB 3.38Å; Q95-E99 WeakPolarHBondContact O-CG 3.26Å; Q95-E99 PolarHBondContact O-N 3.47Å |
| 96 | T | 85.8 | Confident | 80.2 | Confident | 89 Ų | 89 | 105.7 Ų | 105.7 | 55% | 0.546 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -63.5 | -38.9 | 174.3 | -50.7 | 0 | 0 | 0 | 0 | 112.2 | E92 T93 E99 R100 | E92-T96 PolarHBondContact O-N 3.29Å; E92-T96 PolarHBondContact O-OG1 3.18Å; E92-T96 VanDerWaalsContact O-OG1 3.06Å; T93-T96 PolarHBondContact O-N 2.87Å; T96-E99 PolarHBondContact O-N 3.22Å; T96-R100 WeakPolarHBondContact O-CB 3.33Å; T96-R100 PolarHBondContact O-N 3.42Å |
| 97 | L | 87.9 | Confident | 82.3 | Confident | 106 Ų | 106 | 104 Ų | 104 | 56% | 0.555 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -67.7 | -40.8 | 176.9 | -155.3 | 79.4 | 0 | 0 | 0 | 111.4 | T93 M94 Q95 R100 L101 | T93-L97 WeakPolarHBondContact O-CB 3.41Å; T93-L97 PolarHBondContact O-N 3.42Å; M94-L97 PolarHBondContact O-N 3.49Å; Q95-L97 VanDerWaalsContact C-N 3.34Å; Q95-L97 PolarHBondContact O-N 2.96Å; L97-R100 PolarHBondContact O-N 3.29Å; L97-L101 WeakPolarHBondContact O-CB 3.43Å; L97-L101 PolarHBondContact O-N 2.66Å |
| 98 | N | 87.8 | Confident | 84.3 | Confident | 85 Ų | 85 | 102.6 Ų | 102.6 | 46% | 0.455 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -66.9 | -38.9 | 175.6 | -73.9 | -19.6 | 0 | 0 | 0 | 112.1 | M94 Q95 R100 L101 A102 | M94-N98 VanDerWaalsContact O-CB 3.24Å; M94-N98 WeakPolarHBondContact O-CB 3.49Å; M94-N98 PolarHBondContact O-N 2.92Å; M94-N98 PolarHBondContact O-ND2 2.87Å; Q95-N98 PolarHBondContact O-N 2.91Å; N98-R100 VanDerWaalsContact C-N 3.32Å; N98-L101 PolarHBondContact O-N 3.27Å; N98-A102 WeakPolarHBondContact O-CB 3.36Å; N98-A102 PolarHBondContact O-N 2.99Å |
| 99 | E | 90.9 | Very high | 86 | Confident | 111 Ų | 111 | 106.6 Ų | 106.6 | 52% | 0.519 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.4 | -39.7 | 173.2 | -78.4 | 164 | -172.5 | 0 | 0 | 111.2 | Q95 T96 A102 S103 | Q95-E99 WeakPolarHBondContact O-CB 3.38Å; Q95-E99 WeakPolarHBondContact O-CG 3.26Å; Q95-E99 PolarHBondContact O-N 3.47Å; T96-E99 PolarHBondContact O-N 3.22Å; E99-A102 PolarHBondContact O-N 3.34Å; E99-S103 PolarHBondContact O-N 2.89Å |
| 100 | R | 90.4 | Very high | 87.4 | Confident | 142 Ų | 142 | 104.8 Ų | 104.8 | 54% | 0.536 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -66.9 | -42.9 | 174.1 | -171.7 | 174 | 175.3 | -173.3 | -5.1 | 111.8 | T96 L97 N98 A102 S103 Y104 | T96-R100 WeakPolarHBondContact O-CB 3.33Å; T96-R100 PolarHBondContact O-N 3.42Å; L97-R100 PolarHBondContact O-N 3.29Å; N98-R100 VanDerWaalsContact C-N 3.32Å; R100-A102 VanDerWaalsContact C-N 3.35Å; R100-S103 PolarHBondContact O-N 2.9Å; R100-S103 PolarHBondContact O-OG 3.42Å; R100-Y104 HydrophobicContact CG-CD2 3.99Å; R100-Y104 HydrophobicContact CG-CE2 3.59Å; R100-Y104 PolarHBondContact NE-OH 3.31Å; R100-Y104 PolarHBondContact NH2-OH 2.91Å; R100-Y104 VanDerWaalsContact O-CD2 3.25Å; R100-Y104 WeakPolarHBondContact O-CD2 3.19Å; R100-Y104 PolarHBondContact O-N 3.29Å |
| 101 | L | 91.1 | Very high | 88.7 | Confident | 95 Ų | 95 | 104 Ų | 104 | 50% | 0.497 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.8 | -43.1 | 174.4 | -179 | 62.7 | 0 | 0 | 0 | 111.2 | L97 N98 S103 Y104 L105 | L97-L101 WeakPolarHBondContact O-CB 3.43Å; L97-L101 PolarHBondContact O-N 2.66Å; N98-L101 PolarHBondContact O-N 3.27Å; L101-S103 VanDerWaalsContact C-N 3.3Å; L101-S103 PolarHBondContact O-N 3.45Å; L101-Y104 PolarHBondContact O-N 2.96Å; L101-Y104 VanDerWaalsContact O-N 3.15Å; L101-L105 HydrophobicContact CD1-CD1 4.49Å; L101-L105 HydrophobicContact CD1-CG 4.38Å; L101-L105 HydrophobicContact CG-CD1 4.14Å; L101-L105 HydrophobicContact CG-CG 4.46Å; L101-L105 WeakPolarHBondContact O-CG 3.45Å; L101-L105 PolarHBondContact O-N 2.82Å |
| 102 | A | 90.1 | Very high | 89.5 | Confident | 57 Ų | 57 | 102.6 Ų | 102.6 | 47% | 0.471 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -59.3 | -42 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | N98 E99 R100 Y104 L105 E106 | N98-A102 WeakPolarHBondContact O-CB 3.36Å; N98-A102 PolarHBondContact O-N 2.99Å; E99-A102 PolarHBondContact O-N 3.34Å; R100-A102 VanDerWaalsContact C-N 3.35Å; A102-Y104 VanDerWaalsContact C-N 3.35Å; A102-Y104 PolarHBondContact O-N 3.42Å; A102-L105 PolarHBondContact O-N 3.48Å; A102-E106 WeakPolarHBondContact O-CB 3.16Å; A102-E106 PolarHBondContact O-N 2.97Å |
| 103 | S | 92.3 | Very high | 90.4 | Very high | 68 Ų | 68 | 98.8 Ų | 98.8 | 48% | 0.476 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65.2 | -34.9 | 175.4 | 79.1 | 0 | 0 | 0 | 0 | 113.4 | E99 R100 L101 K107 | E99-S103 PolarHBondContact O-N 2.89Å; R100-S103 PolarHBondContact O-N 2.9Å; R100-S103 PolarHBondContact O-OG 3.42Å; L101-S103 VanDerWaalsContact C-N 3.3Å; L101-S103 PolarHBondContact O-N 3.45Å; S103-K107 WeakPolarHBondContact O-CB 3.34Å; S103-K107 PolarHBondContact O-N 2.67Å |
| 104 | Y | 93.9 | Very high | 91.4 | Very high | 122 Ų | 122 | 100.3 Ų | 100.3 | 48% | 0.478 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -70.9 | -43.3 | 175.2 | -77.9 | -56 | 0 | 0 | 0 | 111.8 | R100 L101 A102 E106 K107 V108 | R100-Y104 HydrophobicContact CG-CD2 3.99Å; R100-Y104 HydrophobicContact CG-CE2 3.59Å; R100-Y104 PolarHBondContact NE-OH 3.31Å; R100-Y104 PolarHBondContact NH2-OH 2.91Å; R100-Y104 VanDerWaalsContact O-CD2 3.25Å; R100-Y104 WeakPolarHBondContact O-CD2 3.19Å; R100-Y104 PolarHBondContact O-N 3.29Å; L101-Y104 PolarHBondContact O-N 2.96Å; L101-Y104 VanDerWaalsContact O-N 3.15Å; A102-Y104 VanDerWaalsContact C-N 3.35Å; A102-Y104 PolarHBondContact O-N 3.42Å; Y104-E106 VanDerWaalsContact C-N 3.31Å; Y104-E106 PolarHBondContact O-N 3.31Å; Y104-K107 PolarHBondContact O-N 2.96Å; Y104-V108 WeakPolarHBondContact O-CG2 3.26Å; Y104-V108 PolarHBondContact O-N 3.47Å |
| 105 | L | 93.1 | Very high | 91.8 | Very high | 97 Ų | 97 | 100.6 Ų | 100.6 | 51% | 0.508 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.6 | -39.7 | 176 | -70.9 | 173.2 | 0 | 0 | 0 | 111.5 | L101 A102 K107 V108 R109 | L101-L105 HydrophobicContact CD1-CD1 4.49Å; L101-L105 HydrophobicContact CD1-CG 4.38Å; L101-L105 HydrophobicContact CG-CD1 4.14Å; L101-L105 HydrophobicContact CG-CG 4.46Å; L101-L105 WeakPolarHBondContact O-CG 3.45Å; L101-L105 PolarHBondContact O-N 2.82Å; A102-L105 PolarHBondContact O-N 3.48Å; L105-K107 VanDerWaalsContact C-N 3.34Å; L105-V108 PolarHBondContact O-N 2.88Å; L105-R109 WeakPolarHBondContact O-CG 3.1Å; L105-R109 PolarHBondContact O-N 2.85Å |
| 106 | E | 93.9 | Very high | 92.3 | Very high | 105 Ų | 105 | 98.6 Ų | 98.6 | 49% | 0.491 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.9 | -40.8 | 174.3 | -168.9 | 60.6 | -161 | 0 | 0 | 111.5 | A102 Y104 R109 M110 | A102-E106 WeakPolarHBondContact O-CB 3.16Å; A102-E106 PolarHBondContact O-N 2.97Å; Y104-E106 VanDerWaalsContact C-N 3.31Å; Y104-E106 PolarHBondContact O-N 3.31Å; E106-R109 PolarHBondContact O-N 3.43Å; E106-M110 WeakPolarHBondContact O-CG 3.27Å; E106-M110 PolarHBondContact O-N 3.12Å |
| 107 | K | 93.9 | Very high | 92.8 | Very high | 138 Ų | 138 | 99.9 Ų | 99.9 | 60% | 0.6 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -67.5 | -36.5 | 176.4 | -168.2 | 161.8 | -174 | 172.3 | 0 | 113 | S103 Y104 L105 M110 L111 | S103-K107 WeakPolarHBondContact O-CB 3.34Å; S103-K107 PolarHBondContact O-N 2.67Å; Y104-K107 PolarHBondContact O-N 2.96Å; L105-K107 VanDerWaalsContact C-N 3.34Å; K107-M110 PolarHBondContact O-N 3.13Å; K107-L111 HydrophobicContact CG-CD1 4.4Å; K107-L111 WeakPolarHBondContact O-CG 3.38Å; K107-L111 PolarHBondContact O-N 3.31Å |
| 108 | V | 95 | Very high | 93 | Very high | 69 Ų | 69 | 99.2 Ų | 99.2 | 42% | 0.418 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64 | -45.6 | 173.5 | 170.2 | 0 | 0 | 0 | 0 | 110.1 | Y104 L105 M110 L111 E112 | Y104-V108 WeakPolarHBondContact O-CG2 3.26Å; Y104-V108 PolarHBondContact O-N 3.47Å; L105-V108 PolarHBondContact O-N 2.88Å; V108-M110 VanDerWaalsContact C-N 3.33Å; V108-M110 PolarHBondContact O-N 2.83Å; V108-L111 PolarHBondContact O-N 3.23Å; V108-E112 HydrophobicContact CG1-CG 4.22Å; V108-E112 WeakPolarHBondContact O-CB 3.26Å; V108-E112 WeakPolarHBondContact O-CG 3.5Å; V108-E112 PolarHBondContact O-N 3.32Å |
| 109 | R | 92.8 | Very high | 93.2 | Very high | 172 Ų | 172 | 101 Ų | 101 | 65% | 0.649 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -59.9 | -41.6 | 176.1 | -74.1 | 177.5 | 179.9 | -178.8 | -0 | 112.9 | L105 E106 E112 G113 | L105-R109 WeakPolarHBondContact O-CG 3.1Å; L105-R109 PolarHBondContact O-N 2.85Å; E106-R109 PolarHBondContact O-N 3.43Å; R109-E112 PolarHBondContact O-N 3.45Å; R109-G113 PolarHBondContact O-N 2.81Å |
| 110 | M | 95.8 | Very high | 93.3 | Very high | 105 Ų | 105 | 100.3 Ų | 100.3 | 52% | 0.517 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61 | -47 | 174.6 | -75.6 | -65 | -56 | 0 | 0 | 111.8 | E106 K107 V108 G113 E114 | E106-M110 WeakPolarHBondContact O-CG 3.27Å; E106-M110 PolarHBondContact O-N 3.12Å; K107-M110 PolarHBondContact O-N 3.13Å; V108-M110 VanDerWaalsContact C-N 3.33Å; V108-M110 PolarHBondContact O-N 2.83Å; M110-G113 PolarHBondContact O-N 3.45Å; M110-E114 WeakPolarHBondContact O-CG 3.13Å; M110-E114 PolarHBondContact O-N 3.45Å |
| 111 | L | 94.2 | Very high | 93.4 | Very high | 93 Ų | 93 | 99 Ų | 99 | 49% | 0.487 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67.4 | -36.7 | 179 | -72.2 | 171.4 | 0 | 0 | 0 | 112.7 | K107 V108 G113 E114 N115 | K107-L111 HydrophobicContact CG-CD1 4.4Å; K107-L111 WeakPolarHBondContact O-CG 3.38Å; K107-L111 PolarHBondContact O-N 3.31Å; V108-L111 PolarHBondContact O-N 3.23Å; L111-G113 VanDerWaalsContact C-N 3.33Å; L111-E114 PolarHBondContact O-N 2.87Å; L111-N115 WeakPolarHBondContact O-CB 3.22Å; L111-N115 PolarHBondContact O-N 2.92Å |
| 112 | E | 93.8 | Very high | 93.2 | Very high | 123 Ų | 123 | 99.7 Ų | 99.7 | 58% | 0.575 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -63.5 | -39.8 | 172.9 | -74.5 | 173.7 | 166.8 | 0 | 0 | 111.3 | V108 R109 N115 S116 | V108-E112 HydrophobicContact CG1-CG 4.22Å; V108-E112 WeakPolarHBondContact O-CB 3.26Å; V108-E112 WeakPolarHBondContact O-CG 3.5Å; V108-E112 PolarHBondContact O-N 3.32Å; R109-E112 PolarHBondContact O-N 3.45Å; E112-N115 PolarHBondContact O-N 3.38Å; E112-S116 WeakPolarHBondContact O-CB 3.38Å; E112-S116 PolarHBondContact O-N 3.5Å |
| 113 | G | 94.5 | Very high | 93 | Very high | 34 Ų | 34 | 103.6 Ų | 103.6 | 35% | 0.351 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.6 | -50.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | R109 M110 L111 N115 S116 E117 | R109-G113 PolarHBondContact O-N 2.81Å; M110-G113 PolarHBondContact O-N 3.45Å; L111-G113 VanDerWaalsContact C-N 3.33Å; G113-N115 VanDerWaalsContact C-N 3.34Å; G113-N115 PolarHBondContact O-N 2.9Å; G113-S116 PolarHBondContact O-N 2.85Å; G113-E117 WeakPolarHBondContact O-CG 3.27Å; G113-E117 PolarHBondContact O-N 3.48Å |
| 114 | E | 95.3 | Very high | 92.7 | Very high | 102 Ų | 102 | 105.1 Ų | 105.1 | 48% | 0.477 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.2 | -40.5 | 177.3 | -72.2 | 177.4 | -178.5 | 0 | 0 | 112.2 | M110 L111 E117 L118 | M110-E114 WeakPolarHBondContact O-CG 3.13Å; M110-E114 PolarHBondContact O-N 3.45Å; L111-E114 PolarHBondContact O-N 2.87Å; E114-E117 PolarHBondContact O-N 3.39Å; E114-L118 WeakPolarHBondContact O-CG 3.42Å; E114-L118 PolarHBondContact O-N 3.36Å |
| 115 | N | 92.1 | Very high | 92.1 | Very high | 98 Ų | 98 | 104.6 Ų | 104.6 | 52% | 0.524 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.4 | -43.5 | 176.2 | -115.1 | 8.1 | 0 | 0 | 0 | 111.5 | L111 E112 G113 E117 L118 E119 | L111-N115 WeakPolarHBondContact O-CB 3.22Å; L111-N115 PolarHBondContact O-N 2.92Å; E112-N115 PolarHBondContact O-N 3.38Å; G113-N115 VanDerWaalsContact C-N 3.34Å; G113-N115 PolarHBondContact O-N 2.9Å; N115-E117 VanDerWaalsContact C-N 3.31Å; N115-E117 PolarHBondContact O-N 2.91Å; N115-L118 PolarHBondContact O-N 2.92Å; N115-E119 WeakPolarHBondContact O-CB 3.39Å; N115-E119 WeakPolarHBondContact O-CG 3.44Å; N115-E119 PolarHBondContact O-N 2.87Å |
| 116 | S | 93.8 | Very high | 91.2 | Very high | 59 Ų | 59 | 103.6 Ų | 103.6 | 41% | 0.413 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.3 | -39.7 | 176.7 | -174.5 | 0 | 0 | 0 | 0 | 111.6 | E112 G113 E119 N120 | E112-S116 WeakPolarHBondContact O-CB 3.38Å; E112-S116 PolarHBondContact O-N 3.5Å; G113-S116 PolarHBondContact O-N 2.85Å; S116-E119 PolarHBondContact O-N 2.83Å; S116-N120 WeakPolarHBondContact O-CB 3.47Å; S116-N120 VanDerWaalsContact O-CG 3.26Å; S116-N120 PolarHBondContact O-N 3.21Å; S116-N120 PolarHBondContact O-ND2 2.78Å |
| 117 | E | 95.2 | Very high | 90.1 | Very high | 116 Ų | 116 | 102.3 Ų | 102.3 | 54% | 0.542 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.3 | -39.7 | 174.1 | -73.2 | -174.7 | -169.3 | 0 | 0 | 112.9 | G113 E114 N115 K121 | G113-E117 WeakPolarHBondContact O-CG 3.27Å; G113-E117 PolarHBondContact O-N 3.48Å; E114-E117 PolarHBondContact O-N 3.39Å; N115-E117 VanDerWaalsContact C-N 3.31Å; N115-E117 PolarHBondContact O-N 2.91Å; E117-K121 WeakPolarHBondContact O-CG 3.36Å; E117-K121 PolarHBondContact O-N 3.34Å |
| 118 | L | 94 | Very high | 89 | Confident | 93 Ų | 93 | 100.6 Ų | 100.6 | 49% | 0.487 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -68.2 | -42 | 176.6 | -72.8 | 172.7 | 0 | 0 | 0 | 111.9 | E114 N115 N120 K121 I122 | E114-L118 WeakPolarHBondContact O-CG 3.42Å; E114-L118 PolarHBondContact O-N 3.36Å; N115-L118 PolarHBondContact O-N 2.92Å; L118-N120 VanDerWaalsContact C-N 3.33Å; L118-N120 PolarHBondContact O-N 3.44Å; L118-K121 PolarHBondContact O-N 3.07Å; L118-I122 VanDerWaalsContact O-CG1 3.31Å; L118-I122 WeakPolarHBondContact O-CG1 3.39Å; L118-I122 PolarHBondContact O-N 3.03Å |
| 119 | E | 91 | Very high | 87.2 | Confident | 123 Ų | 123 | 101.1 Ų | 101.1 | 58% | 0.575 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -59.3 | -44.6 | 174.1 | -75.4 | 178.3 | 176.2 | 0 | 0 | 111.3 | N115 S116 K121 I122 Q123 | N115-E119 WeakPolarHBondContact O-CB 3.39Å; N115-E119 WeakPolarHBondContact O-CG 3.44Å; N115-E119 PolarHBondContact O-N 2.87Å; S116-E119 PolarHBondContact O-N 2.83Å; E119-K121 PolarHBondContact O-N 3.42Å; E119-I122 PolarHBondContact O-N 3.33Å; E119-Q123 WeakPolarHBondContact O-CB 3.26Å; E119-Q123 PolarHBondContact O-N 2.82Å |
| 120 | N | 92.2 | Very high | 85.5 | Confident | 95 Ų | 95 | 99.9 Ų | 99.9 | 51% | 0.508 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -61.8 | -42 | 176 | -74.9 | -42 | 0 | 0 | 0 | 112 | S116 L118 Q123 E124 | S116-N120 WeakPolarHBondContact O-CB 3.47Å; S116-N120 VanDerWaalsContact O-CG 3.26Å; S116-N120 PolarHBondContact O-N 3.21Å; S116-N120 PolarHBondContact O-ND2 2.78Å; L118-N120 VanDerWaalsContact C-N 3.33Å; L118-N120 PolarHBondContact O-N 3.44Å; N120-Q123 PolarHBondContact O-N 3.37Å; N120-E124 WeakPolarHBondContact O-CB 3.08Å; N120-E124 PolarHBondContact O-N 3.49Å |
| 121 | K | 92.9 | Very high | 83.6 | Confident | 114 Ų | 114 | 99.7 Ų | 99.7 | 50% | 0.496 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -65.2 | -41.7 | 175.8 | -75.8 | 168.1 | -176.4 | 158.3 | 0 | 112.3 | E117 L118 E119 Q123 E124 E125 | E117-K121 WeakPolarHBondContact O-CG 3.36Å; E117-K121 PolarHBondContact O-N 3.34Å; L118-K121 PolarHBondContact O-N 3.07Å; E119-K121 PolarHBondContact O-N 3.42Å; K121-Q123 VanDerWaalsContact C-N 3.34Å; K121-E124 PolarHBondContact O-N 2.87Å; K121-E125 WeakPolarHBondContact O-CG 3.46Å; K121-E125 PolarHBondContact O-N 3.49Å |
| 122 | I | 87.4 | Confident | 81.8 | Confident | 110 Ų | 110 | 100.4 Ų | 100.4 | 56% | 0.564 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -61.7 | -46.1 | 175.8 | -69.4 | 165.6 | 0 | 0 | 0 | 109.8 | L118 E119 E124 E125 C126 | L118-I122 VanDerWaalsContact O-CG1 3.31Å; L118-I122 WeakPolarHBondContact O-CG1 3.39Å; L118-I122 PolarHBondContact O-N 3.03Å; E119-I122 PolarHBondContact O-N 3.33Å; I122-E124 VanDerWaalsContact C-N 3.34Å; I122-E124 PolarHBondContact O-N 2.82Å; I122-E125 PolarHBondContact O-N 3.32Å; I122-C126 WeakPolarHBondContact O-CB 3.37Å; I122-C126 PolarHBondContact O-N 2.92Å; I122-C126 PolarHBondContact O-SG 2.91Å |
| 123 | Q | 85.6 | Confident | 80.2 | Confident | 139 Ų | 139 | 102.3 Ų | 102.3 | 65% | 0.65 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -63.5 | -41 | 179.3 | -172.8 | 171.9 | -6.6 | 0 | 0 | 111.9 | E119 N120 K121 C126 S127 | E119-Q123 WeakPolarHBondContact O-CB 3.26Å; E119-Q123 PolarHBondContact O-N 2.82Å; N120-Q123 PolarHBondContact O-N 3.37Å; K121-Q123 VanDerWaalsContact C-N 3.34Å; Q123-C126 PolarHBondContact O-N 3.26Å; Q123-S127 WeakPolarHBondContact O-CB 3.36Å; Q123-S127 PolarHBondContact O-N 3.5Å; Q123-S127 PolarHBondContact O-OG 3.27Å |
| 124 | E | 86.7 | Confident | 78.4 | Confident | 100 Ų | 100 | 104 Ų | 104 | 47% | 0.467 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -62.3 | -46.9 | 176.3 | -162.6 | -170.5 | 154.2 | 0 | 0 | 111.3 | N120 K121 I122 S127 K128 | N120-E124 WeakPolarHBondContact O-CB 3.08Å; N120-E124 PolarHBondContact O-N 3.49Å; K121-E124 PolarHBondContact O-N 2.87Å; I122-E124 VanDerWaalsContact C-N 3.34Å; I122-E124 PolarHBondContact O-N 2.82Å; E124-S127 PolarHBondContact O-N 3.32Å; E124-S127 PolarHBondContact O-OG 2.84Å; E124-K128 WeakPolarHBondContact O-CG 3.25Å; E124-K128 PolarHBondContact O-N 3.41Å; E124-K128 WeakPolarHBondContact OE1-CE 3.32Å; E124-K128 IonicContact OE1-NZ 2.74Å; E124-K128 PolarHBondContact OE1-NZ 2.76Å |
| 125 | E | 80 | Confident | 76.8 | Confident | 111 Ų | 111 | 103.6 Ų | 103.6 | 52% | 0.519 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -67.6 | -38.6 | 177.7 | -68.5 | -55.1 | 129.9 | 0 | 0 | 112.8 | K121 I122 S127 K128 A129 | K121-E125 WeakPolarHBondContact O-CG 3.46Å; K121-E125 PolarHBondContact O-N 3.49Å; I122-E125 PolarHBondContact O-N 3.32Å; E125-S127 VanDerWaalsContact C-N 3.28Å; E125-S127 PolarHBondContact O-N 2.85Å; E125-K128 PolarHBondContact O-N 3.11Å; E125-K128 IonicContact OE1-NZ 2.84Å; E125-K128 PolarHBondContact OE1-NZ 3.46Å; E125-A129 WeakPolarHBondContact O-CB 3.42Å; E125-A129 PolarHBondContact O-N 3.02Å |
| 126 | C | 75.1 | Confident | 75.3 | Confident | 77 Ų | 77 | 103.6 Ų | 103.6 | 52% | 0.52 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -62.9 | -36 | 172.2 | -73.9 | 0 | 0 | 0 | 0 | 112.1 | I122 Q123 A129 | I122-C126 WeakPolarHBondContact O-CB 3.37Å; I122-C126 PolarHBondContact O-N 2.92Å; I122-C126 PolarHBondContact O-SG 2.91Å; Q123-C126 PolarHBondContact O-N 3.26Å; C126-A129 PolarHBondContact O-N 3.46Å |
| 127 | S | 72 | Confident | 74.1 | Confident | 78 Ų | 78 | 103.2 Ų | 103.2 | 55% | 0.545 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -71.1 | -34.9 | 176.1 | 76.6 | 0 | 0 | 0 | 0 | 112.4 | Q123 E124 E125 A129 L130 | Q123-S127 WeakPolarHBondContact O-CB 3.36Å; Q123-S127 PolarHBondContact O-N 3.5Å; Q123-S127 PolarHBondContact O-OG 3.27Å; E124-S127 PolarHBondContact O-N 3.32Å; E124-S127 PolarHBondContact O-OG 2.84Å; E125-S127 VanDerWaalsContact C-N 3.28Å; E125-S127 PolarHBondContact O-N 2.85Å; S127-A129 VanDerWaalsContact C-N 3.34Å; S127-L130 PolarHBondContact O-N 3.47Å |
| 128 | K | 68.9 | Low | 73.5 | Confident | 102 Ų | 102 | 103.7 Ų | 103.7 | 44% | 0.443 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -71.4 | -27.6 | 173.1 | -69.8 | 169 | -172.4 | 161.1 | 0 | 112.7 | E124 E125 L130 P131 | E124-K128 WeakPolarHBondContact O-CG 3.25Å; E124-K128 PolarHBondContact O-N 3.41Å; E124-K128 WeakPolarHBondContact OE1-CE 3.32Å; E124-K128 IonicContact OE1-NZ 2.74Å; E124-K128 PolarHBondContact OE1-NZ 2.76Å; E125-K128 PolarHBondContact O-N 3.11Å; E125-K128 IonicContact OE1-NZ 2.84Å; E125-K128 PolarHBondContact OE1-NZ 3.46Å; K128-L130 PolarHBondContact O-N 3.23Å; K128-P131 WeakPolarHBondContact O-CD 3.32Å; K128-P131 WeakPolarHBondContact O-CG 3.31Å |
| 129 | A | 57.7 | Low | 72.9 | Confident | 80 Ų | 80 | 101.9 Ų | 101.9 | 66% | 0.661 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.9 | 0.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | E125 C126 S127 P131 | E125-A129 WeakPolarHBondContact O-CB 3.42Å; E125-A129 PolarHBondContact O-N 3.02Å; C126-A129 PolarHBondContact O-N 3.46Å; S127-A129 VanDerWaalsContact C-N 3.34Å; A129-P131 VanDerWaalsContact O-CD 3.27Å; A129-P131 WeakPolarHBondContact O-CD 3.21Å |
| 130 | L | 58.1 | Low | 72.7 | Confident | 145 Ų | 145 | 103.3 Ų | 103.3 | 76% | 0.759 | 57% | 0.566 | S | S | * | * | trans | -103.9 | 52.7 | 167.1 | -90 | 135 | 0 | 0 | 0 | 113.3 | S127 K128 V132 | S127-L130 PolarHBondContact O-N 3.47Å; K128-L130 PolarHBondContact O-N 3.23Å; L130-V132 VanDerWaalsContact C-N 3.33Å; L130-V132 PolarHBondContact O-N 2.94Å | ||
| 131 | P | 54.9 | Low | 72.5 | Confident | 101 Ų | 101 | 105.5 Ų | 105.5 | 66% | 0.656 | 57% | 0.568 | S | S | * | * | trans | -71 | 102.7 | 153.5 | -0.2 | 21.4 | 0 | 0 | 0 | 106 | K128 A129 L133 | K128-P131 WeakPolarHBondContact O-CD 3.32Å; K128-P131 WeakPolarHBondContact O-CG 3.31Å; A129-P131 VanDerWaalsContact O-CD 3.27Å; A129-P131 WeakPolarHBondContact O-CD 3.21Å; P131-L133 PolarHBondContact O-N 3.28Å | ||
| 132 | V | 56.9 | Low | 72.4 | Confident | 108 Ų | 108 | 103.4 Ų | 103.4 | 66% | 0.655 | 57% | 0.565 | S | S | * | * | trans | 27.9 | 101.1 | 142.8 | -175.8 | 0 | 0 | 0 | 0 | 113 | L130 C134 P135 | L130-V132 VanDerWaalsContact C-N 3.33Å; L130-V132 PolarHBondContact O-N 2.94Å; V132-C134 PolarHBondContact O-N 3.47Å; V132-P135 HydrophobicContact CG1-CG 4.3Å | ||
| 133 | L | 58.9 | Low | 72.7 | Confident | 164 Ų | 164 | 101 Ų | 101 | 86% | 0.859 | 56% | 0.556 | S | S | * | * | S | Bend | trans | -42 | 117.9 | 159.3 | -72 | 170.8 | 0 | 0 | 0 | 107.5 | P131 | P131-L133 PolarHBondContact O-N 3.28Š|
| 134 | C | 57.9 | Low | 73.1 | Confident | 70 Ų | 70 | 98.2 Ų | 98.2 | 47% | 0.473 | 54% | 0.544 | S | S | . | . | trans | -39.2 | 127.5 | -167.9 | -157.2 | 0 | 0 | 0 | 0 | 111.2 | V132 D136 C137 | V132-C134 PolarHBondContact O-N 3.47Å; C134-D136 PolarHBondContact O-N 3.44Å; C134-C137 WeakPolarHBondContact O-CB 3.42Å; C134-C137 PolarHBondContact O-N 2.94Å | ||
| 135 | P | 61.3 | Low | 73.5 | Confident | 93 Ų | 93 | 99.3 Ų | 99.3 | 60% | 0.604 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -50.8 | -25.7 | 175.7 | -28.6 | 36 | 0 | 0 | 0 | 113.5 | V132 C137 | V132-P135 HydrophobicContact CG1-CG 4.3Å; P135-C137 VanDerWaalsContact C-N 3.34Å; P135-C137 PolarHBondContact O-N 3.23Å |
| 136 | D | 61.3 | Low | 74.3 | Confident | 97 Ų | 97 | 100.2 Ų | 100.2 | 52% | 0.519 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -71.6 | -21.3 | 176.6 | -58.6 | -27.2 | 0 | 0 | 0 | 113.8 | C134 S139 Y140 | C134-D136 PolarHBondContact O-N 3.44Å; D136-S139 PolarHBondContact O-N 3.21Å; D136-S139 PolarHBondContact O-OG 3.21Å; D136-Y140 HydrophobicContact CB-CE2 4.29Å; D136-Y140 WeakPolarHBondContact O-CD2 3.28Å; D136-Y140 WeakPolarHBondContact O-CE2 3.33Å; D136-Y140 PolarHBondContact O-N 2.94Å |
| 137 | C | 67.7 | Low | 75.4 | Confident | 51 Ų | 51 | 101.6 Ų | 101.6 | 35% | 0.345 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -69.5 | -37.5 | -179.8 | -162.3 | 0 | 0 | 0 | 0 | 111.9 | C134 P135 S139 Y140 Y141 | C134-C137 WeakPolarHBondContact O-CB 3.42Å; C134-C137 PolarHBondContact O-N 2.94Å; P135-C137 VanDerWaalsContact C-N 3.34Å; P135-C137 PolarHBondContact O-N 3.23Å; C137-S139 VanDerWaalsContact C-N 3.33Å; C137-S139 PolarHBondContact O-N 3.06Å; C137-Y140 PolarHBondContact O-N 3.31Å; C137-Y141 WeakPolarHBondContact O-CD2 3.41Å; C137-Y141 PolarHBondContact O-N 3.21Å; C137-Y141 VanDerWaalsContact SG-CE2 3.59Å |
| 138 | L | 82 | Confident | 76.6 | Confident | 126 Ų | 126 | 103.2 Ų | 103.2 | 66% | 0.66 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -65.5 | -35.6 | 176.9 | -68.9 | 173 | 0 | 0 | 0 | 112 | Y140 Y141 T142 | L138-Y140 VanDerWaalsContact C-N 3.33Å; L138-Y140 PolarHBondContact O-N 3.45Å; L138-Y141 PolarHBondContact O-N 2.85Å; L138-T142 WeakPolarHBondContact O-CG2 3.24Å; L138-T142 PolarHBondContact O-N 3.35Å; L138-T142 VanDerWaalsContact O-N 3.07Å |
| 139 | S | 82.7 | Confident | 78 | Confident | 55 Ų | 55 | 104.7 Ų | 104.7 | 39% | 0.385 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -69.4 | -30.2 | 177.6 | 71.1 | 0 | 0 | 0 | 0 | 112.7 | D136 C137 T142 T143 | D136-S139 PolarHBondContact O-N 3.21Å; D136-S139 PolarHBondContact O-OG 3.21Å; C137-S139 VanDerWaalsContact C-N 3.33Å; C137-S139 PolarHBondContact O-N 3.06Å; S139-T142 WeakPolarHBondContact CA-OG1 3.32Å; S139-T142 PolarHBondContact O-OG1 2.84Å; S139-T143 WeakPolarHBondContact O-CG2 3.28Å; S139-T143 PolarHBondContact O-N 3.06Å; S139-T143 VanDerWaalsContact O-N 3.09Å; S139-T143 PolarHBondContact O-OG1 2.96Å |
| 140 | Y | 86.1 | Confident | 79.9 | Confident | 154 Ų | 154 | 107.8 Ų | 107.8 | 60% | 0.604 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -67.5 | -39.4 | 170.5 | -67.4 | -62.6 | 0 | 0 | 0 | 112.1 | D136 C137 L138 T143 I144 | D136-Y140 HydrophobicContact CB-CE2 4.29Å; D136-Y140 WeakPolarHBondContact O-CD2 3.28Å; D136-Y140 WeakPolarHBondContact O-CE2 3.33Å; D136-Y140 PolarHBondContact O-N 2.94Å; C137-Y140 PolarHBondContact O-N 3.31Å; L138-Y140 VanDerWaalsContact C-N 3.33Å; L138-Y140 PolarHBondContact O-N 3.45Å; Y140-T143 WeakPolarHBondContact CA-OG1 3.37Å; Y140-T143 PolarHBondContact O-N 3.48Å; Y140-T143 PolarHBondContact O-OG1 3.42Å; Y140-I144 WeakPolarHBondContact O-CB 3.39Å; Y140-I144 WeakPolarHBondContact O-CD1 3.32Å; Y140-I144 WeakPolarHBondContact O-CG1 3.25Å; Y140-I144 PolarHBondContact O-N 3.42Å |
| 141 | Y | 87.6 | Confident | 81.8 | Confident | 141 Ų | 141 | 106 Ų | 106 | 55% | 0.553 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -66.3 | -42.7 | 176.3 | -72.9 | -68.5 | 0 | 0 | 0 | 112.4 | C137 L138 T143 I144 E145 | C137-Y141 WeakPolarHBondContact O-CD2 3.41Å; C137-Y141 PolarHBondContact O-N 3.21Å; C137-Y141 VanDerWaalsContact SG-CE2 3.59Å; L138-Y141 PolarHBondContact O-N 2.85Å; Y141-T143 PolarHBondContact O-N 3.39Å; Y141-I144 PolarHBondContact O-N 2.86Å; Y141-E145 WeakPolarHBondContact O-CG 3.39Å; Y141-E145 PolarHBondContact O-N 3.34Å |
| 142 | T | 90.6 | Very high | 83.9 | Confident | 70 Ų | 70 | 106.8 Ų | 106.8 | 43% | 0.429 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -63.1 | -41.6 | 177 | 58 | 0 | 0 | 0 | 0 | 111.9 | L138 S139 E145 E146 | L138-T142 WeakPolarHBondContact O-CG2 3.24Å; L138-T142 PolarHBondContact O-N 3.35Å; L138-T142 VanDerWaalsContact O-N 3.07Å; S139-T142 WeakPolarHBondContact CA-OG1 3.32Å; S139-T142 PolarHBondContact O-OG1 2.84Å; T142-E145 PolarHBondContact O-N 3.1Å; T142-E146 WeakPolarHBondContact O-CG 3.33Å; T142-E146 PolarHBondContact O-N 2.77Å |
| 143 | T | 93.7 | Very high | 85.8 | Confident | 60 Ų | 60 | 105.3 Ų | 105.3 | 37% | 0.368 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -67.3 | -36.1 | 176.8 | 50.7 | 0 | 0 | 0 | 0 | 112.4 | S139 Y140 Y141 L147 | S139-T143 WeakPolarHBondContact O-CG2 3.28Å; S139-T143 PolarHBondContact O-N 3.06Å; S139-T143 VanDerWaalsContact O-N 3.09Å; S139-T143 PolarHBondContact O-OG1 2.96Å; Y140-T143 WeakPolarHBondContact CA-OG1 3.37Å; Y140-T143 PolarHBondContact O-N 3.48Å; Y140-T143 PolarHBondContact O-OG1 3.42Å; Y141-T143 PolarHBondContact O-N 3.39Å; T143-L147 WeakPolarHBondContact O-CB 3.41Å; T143-L147 VanDerWaalsContact O-CG 3.24Å; T143-L147 WeakPolarHBondContact O-CG 3.4Å; T143-L147 PolarHBondContact O-N 3.23Å |
| 144 | I | 94.3 | Very high | 87.7 | Confident | 79 Ų | 79 | 100.8 Ų | 100.8 | 41% | 0.405 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.5 | -45.2 | 173.4 | -71.1 | 164.3 | 0 | 0 | 0 | 110.7 | Y140 Y141 L147 Q148 | Y140-I144 WeakPolarHBondContact O-CB 3.39Å; Y140-I144 WeakPolarHBondContact O-CD1 3.32Å; Y140-I144 WeakPolarHBondContact O-CG1 3.25Å; Y140-I144 PolarHBondContact O-N 3.42Å; Y141-I144 PolarHBondContact O-N 2.86Å; I144-L147 PolarHBondContact O-N 3.31Å; I144-Q148 HydrophobicContact CG2-CG 4.36Å; I144-Q148 WeakPolarHBondContact O-CB 3.39Å; I144-Q148 VanDerWaalsContact O-CG 3.27Å; I144-Q148 WeakPolarHBondContact O-CG 3.44Å; I144-Q148 PolarHBondContact O-N 2.81Å |
| 145 | E | 95.9 | Very high | 89.6 | Confident | 124 Ų | 124 | 104 Ų | 104 | 58% | 0.579 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -61.5 | -45.2 | 177 | -74.8 | 177.4 | -178.8 | 0 | 0 | 111.8 | Y141 T142 L147 Q148 Q149 | Y141-E145 WeakPolarHBondContact O-CG 3.39Å; Y141-E145 PolarHBondContact O-N 3.34Å; T142-E145 PolarHBondContact O-N 3.1Å; E145-L147 VanDerWaalsContact C-N 3.34Å; E145-L147 PolarHBondContact O-N 3.34Å; E145-Q148 PolarHBondContact O-N 2.91Å; E145-Q149 WeakPolarHBondContact O-CB 3.47Å; E145-Q149 PolarHBondContact O-N 3.47Å |
| 146 | E | 97.1 | Very high | 91.3 | Very high | 129 Ų | 129 | 102.5 Ų | 102.5 | 60% | 0.603 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -59 | -43.7 | 175.4 | -74.7 | 173.9 | -172 | 0 | 0 | 112 | T142 Q149 K150 | T142-E146 WeakPolarHBondContact O-CG 3.33Å; T142-E146 PolarHBondContact O-N 2.77Å; E146-Q149 PolarHBondContact O-N 3.34Å; E146-K150 WeakPolarHBondContact O-CB 3.22Å; E146-K150 PolarHBondContact O-N 2.94Å |
| 147 | L | 97.8 | Very high | 93 | Very high | 106 Ų | 106 | 101.7 Ų | 101.7 | 56% | 0.555 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -65.7 | -42.9 | 176.8 | -73.4 | 173.2 | 0 | 0 | 0 | 111.8 | T143 I144 E145 K150 I151 | T143-L147 WeakPolarHBondContact O-CB 3.41Å; T143-L147 VanDerWaalsContact O-CG 3.24Å; T143-L147 WeakPolarHBondContact O-CG 3.4Å; T143-L147 PolarHBondContact O-N 3.23Å; I144-L147 PolarHBondContact O-N 3.31Å; E145-L147 VanDerWaalsContact C-N 3.34Å; E145-L147 PolarHBondContact O-N 3.34Å; L147-K150 PolarHBondContact O-N 3.36Å; L147-I151 VanDerWaalsContact O-CG1 3.25Å; L147-I151 WeakPolarHBondContact O-CG1 3.43Å; L147-I151 PolarHBondContact O-N 2.88Å |
| 148 | Q | 97.8 | Very high | 94.4 | Very high | 113 Ų | 113 | 104 Ų | 104 | 53% | 0.528 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -60.9 | -45.1 | 175.7 | -74.8 | 176.3 | 1 | 0 | 0 | 111.2 | I144 E145 K150 I151 L152 | I144-Q148 HydrophobicContact CG2-CG 4.36Å; I144-Q148 WeakPolarHBondContact O-CB 3.39Å; I144-Q148 VanDerWaalsContact O-CG 3.27Å; I144-Q148 WeakPolarHBondContact O-CG 3.44Å; I144-Q148 PolarHBondContact O-N 2.81Å; E145-Q148 PolarHBondContact O-N 2.91Å; Q148-K150 VanDerWaalsContact C-N 3.34Å; Q148-K150 PolarHBondContact O-N 3.36Å; Q148-I151 PolarHBondContact O-N 3.29Å; Q148-L152 WeakPolarHBondContact O-CG 3.32Å; Q148-L152 PolarHBondContact O-N 2.95Å |
| 149 | Q | 98.1 | Very high | 95.1 | Very high | 133 Ų | 133 | 101.1 Ų | 101.1 | 62% | 0.621 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -64.1 | -40.4 | 177.5 | -170.9 | 158.1 | 1 | 0 | 0 | 111.5 | E145 E146 I151 L152 C153 | E145-Q149 WeakPolarHBondContact O-CB 3.47Å; E145-Q149 PolarHBondContact O-N 3.47Å; E146-Q149 PolarHBondContact O-N 3.34Å; Q149-I151 PolarHBondContact O-N 2.91Å; Q149-L152 PolarHBondContact O-N 3.45Å; Q149-C153 WeakPolarHBondContact O-CB 3.35Å; Q149-C153 PolarHBondContact O-N 2.83Å; Q149-C153 PolarHBondContact O-SG 3.34Å |
| 150 | K | 98.3 | Very high | 95.8 | Very high | 145 Ų | 145 | 104.2 Ų | 104.2 | 63% | 0.63 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -62.4 | -41 | 174.3 | -167.2 | 172 | -175.5 | 176 | 0 | 112.1 | E146 L147 Q148 C153 T154 | E146-K150 WeakPolarHBondContact O-CB 3.22Å; E146-K150 PolarHBondContact O-N 2.94Å; L147-K150 PolarHBondContact O-N 3.36Å; Q148-K150 VanDerWaalsContact C-N 3.34Å; Q148-K150 PolarHBondContact O-N 3.36Å; K150-C153 PolarHBondContact O-N 2.76Å; K150-T154 VanDerWaalsContact O-CG2 3.28Å; K150-T154 WeakPolarHBondContact O-CG2 3.47Å; K150-T154 PolarHBondContact O-N 2.92Å; K150-T154 PolarHBondContact O-OG1 3.42Å; K150-T154 VanDerWaalsContact O-OG1 3.07Å |
| 151 | I | 98 | Very high | 96.3 | Very high | 108 Ų | 108 | 100.1 Ų | 100.1 | 55% | 0.554 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -63 | -42.4 | 175.1 | -70.1 | 163.9 | 0 | 0 | 0 | 111 | L147 Q148 Q149 T154 K155 | L147-I151 VanDerWaalsContact O-CG1 3.25Å; L147-I151 WeakPolarHBondContact O-CG1 3.43Å; L147-I151 PolarHBondContact O-N 2.88Å; Q148-I151 PolarHBondContact O-N 3.29Å; Q149-I151 PolarHBondContact O-N 2.91Å; I151-T154 WeakPolarHBondContact CA-OG1 3.31Å; I151-T154 PolarHBondContact O-OG1 3.32Å; I151-K155 VanDerWaalsContact O-CB 3.23Å; I151-K155 WeakPolarHBondContact O-CB 3.33Å; I151-K155 PolarHBondContact O-N 3.35Å |
| 152 | L | 97.6 | Very high | 96.7 | Very high | 117 Ų | 117 | 97.2 Ų | 97.2 | 61% | 0.613 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -65.7 | -44.7 | 178 | -69.8 | 174.6 | 0 | 0 | 0 | 111.6 | Q148 Q149 K155 A156 | Q148-L152 WeakPolarHBondContact O-CG 3.32Å; Q148-L152 PolarHBondContact O-N 2.95Å; Q149-L152 PolarHBondContact O-N 3.45Å; L152-K155 PolarHBondContact O-N 2.96Å; L152-A156 WeakPolarHBondContact O-CB 3.29Å; L152-A156 PolarHBondContact O-N 2.85Å |
| 153 | C | 97.9 | Very high | 96.9 | Very high | 76 Ų | 76 | 97.5 Ų | 97.5 | 51% | 0.514 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.5 | -45.9 | 176.1 | -70.5 | 0 | 0 | 0 | 0 | 111.8 | Q149 K150 K155 A156 E157 | Q149-C153 WeakPolarHBondContact O-CB 3.35Å; Q149-C153 PolarHBondContact O-N 2.83Å; Q149-C153 PolarHBondContact O-SG 3.34Å; K150-C153 PolarHBondContact O-N 2.76Å; C153-K155 VanDerWaalsContact C-N 3.34Å; C153-K155 PolarHBondContact O-N 2.87Å; C153-A156 PolarHBondContact O-N 2.85Å; C153-E157 WeakPolarHBondContact O-CB 3.27Å; C153-E157 PolarHBondContact O-N 3.03Å |
| 154 | T | 97.7 | Very high | 97 | Very high | 69 Ų | 69 | 99.3 Ų | 99.3 | 42% | 0.423 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -67.1 | -35.2 | 177.8 | 56.8 | 0 | 0 | 0 | 0 | 112.1 | K150 I151 E157 N158 | K150-T154 VanDerWaalsContact O-CG2 3.28Å; K150-T154 WeakPolarHBondContact O-CG2 3.47Å; K150-T154 PolarHBondContact O-N 2.92Å; K150-T154 PolarHBondContact O-OG1 3.42Å; K150-T154 VanDerWaalsContact O-OG1 3.07Å; I151-T154 WeakPolarHBondContact CA-OG1 3.31Å; I151-T154 PolarHBondContact O-OG1 3.32Å; T154-E157 PolarHBondContact O-N 3.43Å; T154-N158 WeakPolarHBondContact O-CB 3.45Å; T154-N158 VanDerWaalsContact O-CG 3.24Å; T154-N158 PolarHBondContact O-N 3.29Å; T154-N158 PolarHBondContact O-ND2 2.89Å |
| 155 | K | 97.4 | Very high | 97.1 | Very high | 138 Ų | 138 | 99.4 Ų | 99.4 | 60% | 0.6 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -64.9 | -43.7 | 174 | -176.9 | 179.8 | 178.7 | -178.4 | 0 | 112.1 | I151 L152 C153 E157 N158 S159 | I151-K155 VanDerWaalsContact O-CB 3.23Å; I151-K155 WeakPolarHBondContact O-CB 3.33Å; I151-K155 PolarHBondContact O-N 3.35Å; L152-K155 PolarHBondContact O-N 2.96Å; C153-K155 VanDerWaalsContact C-N 3.34Å; C153-K155 PolarHBondContact O-N 2.87Å; K155-E157 VanDerWaalsContact C-N 3.34Å; K155-N158 PolarHBondContact O-N 3.32Å; K155-S159 PolarHBondContact O-N 3.24Å; K155-S159 PolarHBondContact O-OG 3.34Å |
| 156 | A | 97.4 | Very high | 97.1 | Very high | 62 Ų | 62 | 97.2 Ų | 97.2 | 51% | 0.512 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.5 | -44.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | L152 C153 S159 R160 | L152-A156 WeakPolarHBondContact O-CB 3.29Å; L152-A156 PolarHBondContact O-N 2.85Å; C153-A156 PolarHBondContact O-N 2.85Å; A156-S159 WeakPolarHBondContact O-CB 3.46Å; A156-S159 PolarHBondContact O-N 3.19Å; A156-R160 PolarHBondContact O-N 3.02Å |
| 157 | E | 97.9 | Very high | 96.8 | Very high | 79 Ų | 79 | 96.4 Ų | 96.4 | 37% | 0.369 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.4 | -41.7 | 178 | -175.1 | 60.5 | -172.2 | 0 | 0 | 112.4 | C153 T154 K155 S159 R160 L161 | C153-E157 WeakPolarHBondContact O-CB 3.27Å; C153-E157 PolarHBondContact O-N 3.03Å; T154-E157 PolarHBondContact O-N 3.43Å; K155-E157 VanDerWaalsContact C-N 3.34Å; E157-S159 VanDerWaalsContact C-N 3.3Å; E157-S159 PolarHBondContact O-N 3.42Å; E157-R160 WeakPolarHBondContact O-CB 3.26Å; E157-R160 PolarHBondContact O-N 3.4Å; E157-R160 IonicContact OE1-CZ 3.65Å; E157-R160 IonicContact OE1-NE 3.34Å; E157-R160 PolarHBondContact OE1-NE 3.46Å; E157-R160 IonicContact OE1-NH2 3.81Å; E157-R160 PolarHBondContact OE1-NH2 2.98Å; E157-R160 IonicContact OE2-CZ 3.36Å; E157-R160 IonicContact OE2-NE 3.3Å; E157-R160 PolarHBondContact OE2-NE 3.48Å; E157-R160 IonicContact OE2-NH2 2.64Å; E157-L161 HydrophobicContact CG-CD1 4.33Å; E157-L161 WeakPolarHBondContact O-CB 3.36Å; E157-L161 WeakPolarHBondContact O-CG 3.46Å; E157-L161 PolarHBondContact O-N 2.95Å |
| 158 | N | 97.4 | Very high | 96.6 | Very high | 99 Ų | 99 | 95 Ų | 95 | 53% | 0.529 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59.3 | -41.9 | 172.7 | -78.7 | -16.3 | 0 | 0 | 0 | 111.6 | T154 K155 R160 L161 V162 | T154-N158 WeakPolarHBondContact O-CB 3.45Å; T154-N158 VanDerWaalsContact O-CG 3.24Å; T154-N158 PolarHBondContact O-N 3.29Å; T154-N158 PolarHBondContact O-ND2 2.89Å; K155-N158 PolarHBondContact O-N 3.32Å; N158-R160 VanDerWaalsContact C-N 3.33Å; N158-R160 PolarHBondContact O-N 3.22Å; N158-L161 PolarHBondContact O-N 2.91Å; N158-V162 VanDerWaalsContact O-CG2 3.27Å; N158-V162 WeakPolarHBondContact O-CG2 3.4Å; N158-V162 PolarHBondContact O-N 2.99Å |
| 159 | S | 95.6 | Very high | 96.4 | Very high | 66 Ų | 66 | 95.2 Ų | 95.2 | 46% | 0.462 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.6 | -39.7 | 177.6 | -53.5 | 0 | 0 | 0 | 0 | 111.6 | K155 A156 E157 S163 | K155-S159 PolarHBondContact O-N 3.24Å; K155-S159 PolarHBondContact O-OG 3.34Å; A156-S159 WeakPolarHBondContact O-CB 3.46Å; A156-S159 PolarHBondContact O-N 3.19Å; E157-S159 VanDerWaalsContact C-N 3.3Å; E157-S159 PolarHBondContact O-N 3.42Å; S159-S163 PolarHBondContact O-N 3.36Å; S159-S163 VanDerWaalsContact O-N 3.08Å; S159-S163 PolarHBondContact O-OG 3.06Å |
| 160 | R | 98 | Very high | 96 | Very high | 121 Ų | 121 | 94.2 Ų | 94.2 | 46% | 0.457 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.6 | -46.7 | 174 | -168.5 | -170.4 | 72.4 | 71.8 | -0.8 | 111.4 | A156 E157 N158 S163 Q164 | A156-R160 PolarHBondContact O-N 3.02Å; E157-R160 WeakPolarHBondContact O-CB 3.26Å; E157-R160 PolarHBondContact O-N 3.4Å; E157-R160 IonicContact OE1-CZ 3.65Å; E157-R160 IonicContact OE1-NE 3.34Å; E157-R160 PolarHBondContact OE1-NE 3.46Å; E157-R160 IonicContact OE1-NH2 3.81Å; E157-R160 PolarHBondContact OE1-NH2 2.98Å; E157-R160 IonicContact OE2-CZ 3.36Å; E157-R160 IonicContact OE2-NE 3.3Å; E157-R160 PolarHBondContact OE2-NE 3.48Å; E157-R160 IonicContact OE2-NH2 2.64Å; N158-R160 VanDerWaalsContact C-N 3.33Å; N158-R160 PolarHBondContact O-N 3.22Å; R160-S163 PolarHBondContact O-N 2.92Å; R160-Q164 PolarHBondContact O-N 2.87Å |
| 161 | L | 96.6 | Very high | 95.5 | Very high | 67 Ų | 67 | 89.4 Ų | 89.4 | 35% | 0.351 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -64.7 | -42.8 | 179 | -71.9 | 174.5 | 0 | 0 | 0 | 112.1 | E157 N158 S163 Q164 I165 | E157-L161 HydrophobicContact CG-CD1 4.33Å; E157-L161 WeakPolarHBondContact O-CB 3.36Å; E157-L161 WeakPolarHBondContact O-CG 3.46Å; E157-L161 PolarHBondContact O-N 2.95Å; N158-L161 PolarHBondContact O-N 2.91Å; L161-S163 VanDerWaalsContact C-N 3.33Å; L161-S163 PolarHBondContact O-N 2.89Å; L161-Q164 PolarHBondContact O-N 2.97Å; L161-I165 VanDerWaalsContact O-CG1 3.26Å; L161-I165 WeakPolarHBondContact O-CG1 3.41Å; L161-I165 PolarHBondContact O-N 3.06Å |
| 162 | V | 96.5 | Very high | 95.2 | Very high | 80 Ų | 80 | 86.5 Ų | 86.5 | 49% | 0.485 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -58.6 | -46.7 | 174.5 | 169.6 | 0 | 0 | 0 | 0 | 110.5 | N158 Q164 I165 D166 | N158-V162 VanDerWaalsContact O-CG2 3.27Å; N158-V162 WeakPolarHBondContact O-CG2 3.4Å; N158-V162 PolarHBondContact O-N 2.99Å; V162-Q164 VanDerWaalsContact C-N 3.3Å; V162-Q164 PolarHBondContact O-N 3.3Å; V162-I165 WeakPolarHBondContact O-CB 3.32Å; V162-I165 PolarHBondContact O-N 3.12Å; V162-I165 VanDerWaalsContact O-N 3.14Å; V162-D166 PolarHBondContact O-N 3.04Å |
| 163 | S | 94.9 | Very high | 94.9 | Very high | 76 Ų | 76 | 84.3 Ų | 84.3 | 53% | 0.531 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -61.3 | -38.6 | 177.1 | -55.2 | 0 | 0 | 0 | 0 | 112.3 | S159 R160 L161 D166 N167 | S159-S163 PolarHBondContact O-N 3.36Å; S159-S163 VanDerWaalsContact O-N 3.08Å; S159-S163 PolarHBondContact O-OG 3.06Å; R160-S163 PolarHBondContact O-N 2.92Å; L161-S163 VanDerWaalsContact C-N 3.33Å; L161-S163 PolarHBondContact O-N 2.89Å; S163-D166 PolarHBondContact O-N 3.49Å; S163-N167 WeakPolarHBondContact O-CB 3.32Å; S163-N167 PolarHBondContact O-N 3.24Å |
| 164 | Q | 95.1 | Very high | 94.6 | Very high | 98 Ų | 98 | 85.7 Ų | 85.7 | 46% | 0.458 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -68.9 | -36.8 | 176.1 | -171.4 | 173.7 | 0.4 | 0 | 0 | 112 | R160 L161 V162 T168 | R160-Q164 PolarHBondContact O-N 2.87Å; L161-Q164 PolarHBondContact O-N 2.97Å; V162-Q164 VanDerWaalsContact C-N 3.3Å; V162-Q164 PolarHBondContact O-N 3.3Å; Q164-T168 VanDerWaalsContact O-CG2 3.32Å; Q164-T168 WeakPolarHBondContact O-CG2 3.48Å; Q164-T168 PolarHBondContact O-N 2.9Å; Q164-T168 PolarHBondContact O-OG1 3.39Å |
| 165 | I | 95.8 | Very high | 94.4 | Very high | 82 Ų | 82 | 88.2 Ų | 88.2 | 42% | 0.421 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63.7 | -46.1 | 173.7 | -71.3 | 164.1 | 0 | 0 | 0 | 109.9 | L161 V162 N167 T168 K169 | L161-I165 VanDerWaalsContact O-CG1 3.26Å; L161-I165 WeakPolarHBondContact O-CG1 3.41Å; L161-I165 PolarHBondContact O-N 3.06Å; V162-I165 WeakPolarHBondContact O-CB 3.32Å; V162-I165 PolarHBondContact O-N 3.12Å; V162-I165 VanDerWaalsContact O-N 3.14Å; I165-N167 PolarHBondContact O-N 3.4Å; I165-T168 WeakPolarHBondContact CA-OG1 3.2Å; I165-T168 PolarHBondContact O-N 2.97Å; I165-T168 PolarHBondContact O-OG1 3.43Å; I165-K169 HydrophobicContact CG2-CD 4.03Å; I165-K169 HydrophobicContact CG2-CG 4.45Å; I165-K169 WeakPolarHBondContact O-CB 3.39Å; I165-K169 VanDerWaalsContact O-CG 3.32Å; I165-K169 WeakPolarHBondContact O-CG 3.44Å; I165-K169 PolarHBondContact O-N 2.91Å |
| 166 | D | 95.9 | Very high | 94.2 | Very high | 78 Ų | 78 | 87.9 Ų | 87.9 | 42% | 0.417 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -65.8 | -40.4 | 180 | -66.3 | -21.9 | 0 | 0 | 0 | 111.3 | V162 S163 K169 L170 | V162-D166 PolarHBondContact O-N 3.04Å; S163-D166 PolarHBondContact O-N 3.49Å; D166-K169 PolarHBondContact O-N 3.03Å; D166-L170 WeakPolarHBondContact O-CG 3.34Å; D166-L170 PolarHBondContact O-N 3.49Å |
| 167 | N | 92 | Very high | 93.8 | Very high | 111 Ų | 111 | 87.5 Ų | 87.5 | 59% | 0.594 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -61.7 | -44.4 | 174 | -174.9 | -91 | 0 | 0 | 0 | 112.7 | S163 I165 L170 A171 | S163-N167 WeakPolarHBondContact O-CB 3.32Å; S163-N167 PolarHBondContact O-N 3.24Å; I165-N167 PolarHBondContact O-N 3.4Å; N167-L170 PolarHBondContact O-N 2.98Å; N167-A171 WeakPolarHBondContact O-CB 3.41Å; N167-A171 PolarHBondContact O-N 3.34Å |
| 168 | T | 92.1 | Very high | 93.5 | Very high | 77 Ų | 77 | 88.5 Ų | 88.5 | 47% | 0.472 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -69.3 | -33.6 | 178.6 | 52.3 | 0 | 0 | 0 | 0 | 112.4 | Q164 I165 A172 | Q164-T168 VanDerWaalsContact O-CG2 3.32Å; Q164-T168 WeakPolarHBondContact O-CG2 3.48Å; Q164-T168 PolarHBondContact O-N 2.9Å; Q164-T168 PolarHBondContact O-OG1 3.39Å; I165-T168 WeakPolarHBondContact CA-OG1 3.2Å; I165-T168 PolarHBondContact O-N 2.97Å; I165-T168 PolarHBondContact O-OG1 3.43Å; T168-A172 WeakPolarHBondContact O-CB 3.44Å; T168-A172 PolarHBondContact O-N 3.39Å |
| 169 | K | 94 | Very high | 93.4 | Very high | 118 Ų | 118 | 91 Ų | 91 | 51% | 0.513 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63.9 | -48.6 | 171.8 | -76.4 | 173.5 | 179.9 | 172.1 | 0 | 111.9 | I165 D166 A171 A172 D173 | I165-K169 HydrophobicContact CG2-CD 4.03Å; I165-K169 HydrophobicContact CG2-CG 4.45Å; I165-K169 WeakPolarHBondContact O-CB 3.39Å; I165-K169 VanDerWaalsContact O-CG 3.32Å; I165-K169 WeakPolarHBondContact O-CG 3.44Å; I165-K169 PolarHBondContact O-N 2.91Å; D166-K169 PolarHBondContact O-N 3.03Å; K169-A171 VanDerWaalsContact C-N 3.33Å; K169-A171 PolarHBondContact O-N 2.87Å; K169-A172 WeakPolarHBondContact O-CB 3.47Å; K169-A172 PolarHBondContact O-N 2.9Å; K169-A172 VanDerWaalsContact O-N 3.12Å; K169-D173 PolarHBondContact O-N 3.49Å |
| 170 | L | 90.6 | Very high | 93.2 | Very high | 111 Ų | 111 | 93.3 Ų | 93.3 | 58% | 0.581 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -58.1 | -46.8 | 176.6 | -71.7 | 172.3 | 0 | 0 | 0 | 111.1 | D166 N167 A172 D173 D174 | D166-L170 WeakPolarHBondContact O-CG 3.34Å; D166-L170 PolarHBondContact O-N 3.49Å; N167-L170 PolarHBondContact O-N 2.98Å; L170-A172 VanDerWaalsContact C-N 3.31Å; L170-A172 PolarHBondContact O-N 3.18Å; L170-D173 PolarHBondContact O-N 2.93Å; L170-D174 PolarHBondContact O-N 2.94Å |
| 171 | A | 88.1 | Confident | 92.8 | Very high | 45 Ų | 45 | 90.1 Ų | 90.1 | 37% | 0.372 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61.4 | -37.8 | 176 | 0 | 0 | 0 | 0 | 0 | 112.8 | N167 K169 L175 | N167-A171 WeakPolarHBondContact O-CB 3.41Å; N167-A171 PolarHBondContact O-N 3.34Å; K169-A171 VanDerWaalsContact C-N 3.33Å; K169-A171 PolarHBondContact O-N 2.87Å; A171-L175 VanDerWaalsContact O-CG 3.28Å; A171-L175 WeakPolarHBondContact O-CG 3.44Å; A171-L175 PolarHBondContact O-N 2.97Å |
| 172 | A | 90.5 | Very high | 92.6 | Very high | 46 Ų | 46 | 92.9 Ų | 92.9 | 38% | 0.38 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -69 | -37.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | T168 K169 L170 L175 R176 | T168-A172 WeakPolarHBondContact O-CB 3.44Å; T168-A172 PolarHBondContact O-N 3.39Å; K169-A172 WeakPolarHBondContact O-CB 3.47Å; K169-A172 PolarHBondContact O-N 2.9Å; K169-A172 VanDerWaalsContact O-N 3.12Å; L170-A172 VanDerWaalsContact C-N 3.31Å; L170-A172 PolarHBondContact O-N 3.18Å; A172-L175 PolarHBondContact O-N 3.28Å; A172-R176 WeakPolarHBondContact O-CB 3.42Å; A172-R176 PolarHBondContact O-N 3.49Å |
| 173 | D | 90.8 | Very high | 92.4 | Very high | 72 Ų | 72 | 92 Ų | 92 | 39% | 0.385 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -69.6 | -39.4 | 176 | -70.3 | -24.9 | 0 | 0 | 0 | 111.3 | K169 L170 L175 R176 A177 | K169-D173 PolarHBondContact O-N 3.49Å; L170-D173 PolarHBondContact O-N 2.93Å; D173-L175 PolarHBondContact O-N 3.5Å; D173-R176 WeakPolarHBondContact O-CB 3.33Å; D173-R176 PolarHBondContact O-N 3.23Å; D173-R176 IonicContact OD1-CZ 3.43Å; D173-R176 IonicContact OD1-NH1 2.84Å; D173-R176 PolarHBondContact OD1-NH1 3.07Å; D173-R176 IonicContact OD1-NH2 2.78Å; D173-R176 PolarHBondContact OD1-NH2 3.28Å; D173-A177 PolarHBondContact O-N 3.06Å |
| 174 | D | 92.7 | Very high | 92.2 | Very high | 104 Ų | 104 | 91.6 Ų | 91.6 | 56% | 0.556 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -59.7 | -45.1 | 172.3 | -72.7 | -17.6 | 0 | 0 | 0 | 111.4 | L170 R176 A177 N178 | L170-D174 PolarHBondContact O-N 2.94Å; D174-R176 VanDerWaalsContact C-N 3.32Å; D174-R176 PolarHBondContact O-N 3.49Å; D174-A177 PolarHBondContact O-N 3.49Å; D174-N178 WeakPolarHBondContact O-CB 3.4Å; D174-N178 PolarHBondContact O-N 3.31Å; D174-N178 PolarHBondContact O-ND2 2.96Å; D174-N178 VanDerWaalsContact O-ND2 3.11Å |
| 175 | L | 92.7 | Very high | 92.1 | Very high | 122 Ų | 122 | 91.2 Ų | 91.2 | 64% | 0.639 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -64.5 | -36.8 | 175.6 | -72 | 175.4 | 0 | 0 | 0 | 112.2 | A171 A172 D173 Y179 | A171-L175 VanDerWaalsContact O-CG 3.28Å; A171-L175 WeakPolarHBondContact O-CG 3.44Å; A171-L175 PolarHBondContact O-N 2.97Å; A172-L175 PolarHBondContact O-N 3.28Å; D173-L175 PolarHBondContact O-N 3.5Å; L175-Y179 WeakPolarHBondContact O-CB 3.44Å; L175-Y179 PolarHBondContact O-N 2.91Å |
| 176 | R | 93.6 | Very high | 92 | Very high | 132 Ų | 132 | 94.8 Ų | 94.8 | 50% | 0.498 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -65 | -47.1 | 176 | -167.8 | -174.2 | -53.8 | 125.9 | 17.9 | 111 | A172 D173 D174 N178 Y179 E180 | A172-R176 WeakPolarHBondContact O-CB 3.42Å; A172-R176 PolarHBondContact O-N 3.49Å; D173-R176 WeakPolarHBondContact O-CB 3.33Å; D173-R176 PolarHBondContact O-N 3.23Å; D173-R176 IonicContact OD1-CZ 3.43Å; D173-R176 IonicContact OD1-NH1 2.84Å; D173-R176 PolarHBondContact OD1-NH1 3.07Å; D173-R176 IonicContact OD1-NH2 2.78Å; D173-R176 PolarHBondContact OD1-NH2 3.28Å; D174-R176 VanDerWaalsContact C-N 3.32Å; D174-R176 PolarHBondContact O-N 3.49Å; R176-N178 VanDerWaalsContact C-N 3.34Å; R176-N178 PolarHBondContact O-N 3.08Å; R176-Y179 WeakPolarHBondContact O-CB 3.24Å; R176-Y179 PolarHBondContact O-N 2.93Å; R176-E180 WeakPolarHBondContact O-CG 3.5Å; R176-E180 PolarHBondContact O-N 2.91Å |
| 177 | A | 88.3 | Confident | 92 | Very high | 54 Ų | 54 | 96.4 Ų | 96.4 | 45% | 0.446 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.2 | -43.1 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | D173 D174 Y179 E180 A181 | D173-A177 PolarHBondContact O-N 3.06Å; D174-A177 PolarHBondContact O-N 3.49Å; A177-Y179 PolarHBondContact O-N 3.32Å; A177-E180 PolarHBondContact O-N 2.67Å; A177-A181 WeakPolarHBondContact O-CB 3.37Å; A177-A181 PolarHBondContact O-N 2.92Å |
| 178 | N | 92.5 | Very high | 92.1 | Very high | 99 Ų | 99 | 96 Ų | 96 | 53% | 0.529 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62 | -42.2 | 174.8 | -72.4 | -30.5 | 0 | 0 | 0 | 112 | D174 R176 A181 E182 | D174-N178 WeakPolarHBondContact O-CB 3.4Å; D174-N178 PolarHBondContact O-N 3.31Å; D174-N178 PolarHBondContact O-ND2 2.96Å; D174-N178 VanDerWaalsContact O-ND2 3.11Å; R176-N178 VanDerWaalsContact C-N 3.34Å; R176-N178 PolarHBondContact O-N 3.08Å; N178-A181 PolarHBondContact O-N 2.73Å; N178-E182 WeakPolarHBondContact O-CB 3.33Å; N178-E182 WeakPolarHBondContact O-CG 3.49Å; N178-E182 PolarHBondContact O-N 3.43Å |
| 179 | Y | 94.9 | Very high | 92.4 | Very high | 153 Ų | 153 | 96.3 Ų | 96.3 | 60% | 0.6 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -62.9 | -44 | 176.2 | 170.2 | -99 | 0 | 0 | 0 | 112.3 | L175 R176 A177 E182 L183 | L175-Y179 WeakPolarHBondContact O-CB 3.44Å; L175-Y179 PolarHBondContact O-N 2.91Å; R176-Y179 WeakPolarHBondContact O-CB 3.24Å; R176-Y179 PolarHBondContact O-N 2.93Å; A177-Y179 PolarHBondContact O-N 3.32Å; Y179-E182 PolarHBondContact O-N 2.78Å; Y179-L183 HydrophobicContact CE1-CD2 4.25Å; Y179-L183 VanDerWaalsContact O-CB 3.25Å; Y179-L183 WeakPolarHBondContact O-CB 3.3Å; Y179-L183 PolarHBondContact O-N 3.03Å |
| 180 | E | 91.8 | Very high | 92.5 | Very high | 113 Ų | 113 | 94.4 Ų | 94.4 | 53% | 0.528 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.4 | -41.4 | 177.6 | -72.8 | 172.3 | -172.7 | 0 | 0 | 111.6 | R176 A177 L183 S184 | R176-E180 WeakPolarHBondContact O-CG 3.5Å; R176-E180 PolarHBondContact O-N 2.91Å; A177-E180 PolarHBondContact O-N 2.67Å; E180-L183 PolarHBondContact O-N 3Å; E180-S184 PolarHBondContact O-N 3Å |
| 181 | A | 89.6 | Confident | 92.8 | Very high | 55 Ų | 55 | 91.8 Ų | 91.8 | 46% | 0.455 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -62.8 | -49.4 | 175 | 0 | 0 | 0 | 0 | 0 | 111.9 | A177 N178 L183 S184 L185 | A177-A181 WeakPolarHBondContact O-CB 3.37Å; A177-A181 PolarHBondContact O-N 2.92Å; N178-A181 PolarHBondContact O-N 2.73Å; A181-L183 VanDerWaalsContact C-N 3.34Å; A181-L183 PolarHBondContact O-N 3.04Å; A181-S184 PolarHBondContact O-N 2.84Å; A181-S184 PolarHBondContact O-OG 2.88Å; A181-L185 PolarHBondContact O-N 3.4Å |
| 182 | E | 91.4 | Very high | 93.2 | Very high | 125 Ų | 125 | 94.2 Ų | 94.2 | 58% | 0.584 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -62.2 | -39.5 | 176.7 | -77.8 | -66.2 | 163.1 | 0 | 0 | 112.4 | N178 Y179 S184 L185 R186 | N178-E182 WeakPolarHBondContact O-CB 3.33Å; N178-E182 WeakPolarHBondContact O-CG 3.49Å; N178-E182 PolarHBondContact O-N 3.43Å; Y179-E182 PolarHBondContact O-N 2.78Å; E182-S184 VanDerWaalsContact C-N 3.34Å; E182-S184 PolarHBondContact O-N 3.4Å; E182-L185 PolarHBondContact O-N 3.44Å; E182-R186 VanDerWaalsContact O-CB 3.31Å; E182-R186 WeakPolarHBondContact O-CB 3.42Å; E182-R186 PolarHBondContact O-N 3.36Å |
| 183 | L | 94.1 | Very high | 93.5 | Very high | 61 Ų | 61 | 94 Ų | 94 | 32% | 0.319 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.6 | -44.2 | 175.3 | 179.8 | 63.2 | 0 | 0 | 0 | 111.1 | Y179 E180 A181 R186 Q187 | Y179-L183 HydrophobicContact CE1-CD2 4.25Å; Y179-L183 VanDerWaalsContact O-CB 3.25Å; Y179-L183 WeakPolarHBondContact O-CB 3.3Å; Y179-L183 PolarHBondContact O-N 3.03Å; E180-L183 PolarHBondContact O-N 3Å; A181-L183 VanDerWaalsContact C-N 3.34Å; A181-L183 PolarHBondContact O-N 3.04Å; L183-R186 PolarHBondContact O-N 3.34Å; L183-Q187 WeakPolarHBondContact O-CG 3.46Å; L183-Q187 PolarHBondContact O-N 3.39Å |
| 184 | S | 88.9 | Confident | 93.8 | Very high | 68 Ų | 68 | 94.4 Ų | 94.4 | 48% | 0.476 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63.4 | -41.5 | 177.6 | 76.8 | 0 | 0 | 0 | 0 | 112.1 | E180 A181 E182 Q187 L188 | E180-S184 PolarHBondContact O-N 3Å; A181-S184 PolarHBondContact O-N 2.84Å; A181-S184 PolarHBondContact O-OG 2.88Å; E182-S184 VanDerWaalsContact C-N 3.34Å; E182-S184 PolarHBondContact O-N 3.4Å; S184-Q187 PolarHBondContact O-N 2.87Å; S184-L188 PolarHBondContact O-N 3.28Å |
| 185 | L | 92.9 | Very high | 94.1 | Very high | 90 Ų | 90 | 90.7 Ų | 90.7 | 47% | 0.471 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -65.3 | -43.1 | 176.2 | -179.6 | 61.8 | 0 | 0 | 0 | 111.1 | A181 E182 Q187 L188 V189 | A181-L185 PolarHBondContact O-N 3.4Å; E182-L185 PolarHBondContact O-N 3.44Å; L185-Q187 PolarHBondContact O-N 2.84Å; L185-L188 WeakPolarHBondContact O-CB 3.34Å; L185-L188 PolarHBondContact O-N 2.81Å; L185-V189 HydrophobicContact CD1-CG2 4.48Å; L185-V189 WeakPolarHBondContact O-CG2 3.34Å; L185-V189 PolarHBondContact O-N 2.88Å |
| 186 | R | 95.6 | Very high | 94.3 | Very high | 157 Ų | 157 | 90.6 Ų | 90.6 | 59% | 0.592 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -59.3 | -46.5 | 175.8 | -175.4 | -168.3 | 168.1 | 88 | 9.7 | 111.2 | E182 L183 L188 V189 E190 | E182-R186 VanDerWaalsContact O-CB 3.31Å; E182-R186 WeakPolarHBondContact O-CB 3.42Å; E182-R186 PolarHBondContact O-N 3.36Å; L183-R186 PolarHBondContact O-N 3.34Å; R186-L188 VanDerWaalsContact C-N 3.3Å; R186-L188 PolarHBondContact O-N 2.91Å; R186-V189 PolarHBondContact O-N 3.01Å; R186-E190 HydrophobicContact CG-CG 4.41Å; R186-E190 IonicContact CZ-OE1 2.75Å; R186-E190 IonicContact NE-OE1 3.74Å; R186-E190 PolarHBondContact NE-OE1 3.41Å; R186-E190 IonicContact NH2-OE1 3.71Å; R186-E190 PolarHBondContact NH2-OE1 3.25Å; R186-E190 WeakPolarHBondContact O-CB 3.38Å; R186-E190 WeakPolarHBondContact O-CG 3.33Å; R186-E190 PolarHBondContact O-N 3.07Å |
| 187 | Q | 95.2 | Very high | 94.5 | Very high | 112 Ų | 112 | 90.2 Ų | 90.2 | 52% | 0.523 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -61 | -39.6 | 178.2 | -74.7 | 173.8 | -12.8 | 0 | 0 | 112 | L183 S184 L185 E190 A191 | L183-Q187 WeakPolarHBondContact O-CG 3.46Å; L183-Q187 PolarHBondContact O-N 3.39Å; S184-Q187 PolarHBondContact O-N 2.87Å; L185-Q187 PolarHBondContact O-N 2.84Å; Q187-E190 PolarHBondContact O-N 3.48Å; Q187-A191 WeakPolarHBondContact O-CB 3.37Å; Q187-A191 PolarHBondContact O-N 2.97Å |
| 188 | L | 94.5 | Very high | 95 | Very high | 102 Ų | 102 | 93.9 Ų | 93.9 | 53% | 0.534 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.6 | -49.1 | 174.7 | -178.8 | 64.2 | 0 | 0 | 0 | 111.4 | S184 L185 R186 E190 A191 D192 | S184-L188 PolarHBondContact O-N 3.28Å; L185-L188 WeakPolarHBondContact O-CB 3.34Å; L185-L188 PolarHBondContact O-N 2.81Å; R186-L188 VanDerWaalsContact C-N 3.3Å; R186-L188 PolarHBondContact O-N 2.91Å; L188-E190 VanDerWaalsContact C-N 3.31Å; L188-E190 PolarHBondContact O-N 2.77Å; L188-A191 WeakPolarHBondContact O-CB 3.46Å; L188-A191 PolarHBondContact O-N 3.33Å; L188-A191 VanDerWaalsContact O-N 3.17Å; L188-D192 PolarHBondContact O-N 3.32Å |
| 189 | V | 97 | Very high | 95.3 | Very high | 84 Ų | 84 | 93.8 Ų | 93.8 | 51% | 0.509 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.8 | -38.3 | 177.8 | 172.7 | 0 | 0 | 0 | 0 | 111.6 | L185 R186 D192 A193 | L185-V189 HydrophobicContact CD1-CG2 4.48Å; L185-V189 WeakPolarHBondContact O-CG2 3.34Å; L185-V189 PolarHBondContact O-N 2.88Å; R186-V189 PolarHBondContact O-N 3.01Å; V189-D192 PolarHBondContact O-N 2.92Å; V189-A193 VanDerWaalsContact O-CB 3.29Å; V189-A193 WeakPolarHBondContact O-CB 3.41Å; V189-A193 PolarHBondContact O-N 3.31Å |
| 190 | E | 97.4 | Very high | 95.5 | Very high | 77 Ų | 77 | 91.5 Ų | 91.5 | 36% | 0.36 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -64.8 | -40.6 | 174.4 | -77.5 | 179.9 | 173.8 | 0 | 0 | 111.9 | R186 Q187 L188 A193 N194 | R186-E190 HydrophobicContact CG-CG 4.41Å; R186-E190 IonicContact CZ-OE1 2.75Å; R186-E190 IonicContact NE-OE1 3.74Å; R186-E190 PolarHBondContact NE-OE1 3.41Å; R186-E190 IonicContact NH2-OE1 3.71Å; R186-E190 PolarHBondContact NH2-OE1 3.25Å; R186-E190 WeakPolarHBondContact O-CB 3.38Å; R186-E190 WeakPolarHBondContact O-CG 3.33Å; R186-E190 PolarHBondContact O-N 3.07Å; Q187-E190 PolarHBondContact O-N 3.48Å; L188-E190 VanDerWaalsContact C-N 3.31Å; L188-E190 PolarHBondContact O-N 2.77Å; E190-A193 PolarHBondContact O-N 3.01Å; E190-N194 WeakPolarHBondContact O-CB 3.45Å; E190-N194 PolarHBondContact O-N 3.44Å; E190-N194 PolarHBondContact O-ND2 2.86Å; E190-N194 VanDerWaalsContact O-ND2 3.09Å |
| 191 | A | 95.4 | Very high | 95.8 | Very high | 57 Ų | 57 | 90.8 Ų | 90.8 | 47% | 0.471 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -62.2 | -46.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | Q187 L188 N194 G195 | Q187-A191 WeakPolarHBondContact O-CB 3.37Å; Q187-A191 PolarHBondContact O-N 2.97Å; L188-A191 WeakPolarHBondContact O-CB 3.46Å; L188-A191 PolarHBondContact O-N 3.33Å; L188-A191 VanDerWaalsContact O-N 3.17Å; A191-N194 PolarHBondContact O-N 2.89Å; A191-G195 PolarHBondContact O-N 3.46Å |
| 192 | D | 97.2 | Very high | 96.2 | Very high | 95 Ų | 95 | 92.8 Ų | 92.8 | 51% | 0.508 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.3 | -45 | 176.7 | -72.1 | -13.9 | 0 | 0 | 0 | 111.7 | L188 V189 N194 G195 L196 | L188-D192 PolarHBondContact O-N 3.32Å; V189-D192 PolarHBondContact O-N 2.92Å; D192-N194 VanDerWaalsContact C-N 3.3Å; D192-N194 PolarHBondContact O-N 3.38Å; D192-G195 PolarHBondContact O-N 2.92Å; D192-L196 WeakPolarHBondContact O-CG 3.48Å; D192-L196 PolarHBondContact O-N 3.03Å |
| 193 | A | 97.3 | Very high | 96.6 | Very high | 41 Ų | 41 | 91.7 Ų | 91.7 | 34% | 0.339 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.2 | -38.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | V189 E190 K197 | V189-A193 VanDerWaalsContact O-CB 3.29Å; V189-A193 WeakPolarHBondContact O-CB 3.41Å; V189-A193 PolarHBondContact O-N 3.31Å; E190-A193 PolarHBondContact O-N 3.01Å; A193-K197 WeakPolarHBondContact O-CG 3.48Å; A193-K197 PolarHBondContact O-N 2.98Å |
| 194 | N | 97.6 | Very high | 96.8 | Very high | 81 Ų | 81 | 92.5 Ų | 92.5 | 43% | 0.433 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -69.3 | -38.7 | 174.8 | -69.9 | -27.1 | 0 | 0 | 0 | 111.8 | E190 A191 D192 K197 Q198 | E190-N194 WeakPolarHBondContact O-CB 3.45Å; E190-N194 PolarHBondContact O-N 3.44Å; E190-N194 PolarHBondContact O-ND2 2.86Å; E190-N194 VanDerWaalsContact O-ND2 3.09Å; A191-N194 PolarHBondContact O-N 2.89Å; D192-N194 VanDerWaalsContact C-N 3.3Å; D192-N194 PolarHBondContact O-N 3.38Å; N194-K197 PolarHBondContact O-N 3.46Å; N194-Q198 WeakPolarHBondContact O-CG 3.24Å; N194-Q198 PolarHBondContact O-N 3.23Å |
| 195 | G | 97.9 | Very high | 97.2 | Very high | 26 Ų | 26 | 94.7 Ų | 94.7 | 27% | 0.268 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.1 | -44.8 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | A191 D192 K197 Q198 I199 | A191-G195 PolarHBondContact O-N 3.46Å; D192-G195 PolarHBondContact O-N 2.92Å; G195-K197 VanDerWaalsContact C-N 3.33Å; G195-K197 PolarHBondContact O-N 3.35Å; G195-Q198 PolarHBondContact O-N 2.89Å; G195-I199 WeakPolarHBondContact O-CG1 3.42Å; G195-I199 PolarHBondContact O-N 2.93Å |
| 196 | L | 97.5 | Very high | 97.5 | Very high | 120 Ų | 120 | 92.9 Ų | 92.9 | 63% | 0.628 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.9 | -37.7 | 175.7 | -71.3 | 175.1 | 0 | 0 | 0 | 112.5 | D192 I199 L200 | D192-L196 WeakPolarHBondContact O-CG 3.48Å; D192-L196 PolarHBondContact O-N 3.03Å; L196-I199 PolarHBondContact O-N 3.31Å; L196-L200 WeakPolarHBondContact O-CB 3.44Å; L196-L200 PolarHBondContact O-N 2.9Å |
| 197 | K | 98.4 | Very high | 97.6 | Very high | 124 Ų | 124 | 91.2 Ų | 91.2 | 54% | 0.539 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.3 | -44.9 | 173.1 | -75.1 | 171.8 | -174.9 | 170.4 | 0 | 111.9 | A193 N194 G195 I199 L200 D201 | A193-K197 WeakPolarHBondContact O-CG 3.48Å; A193-K197 PolarHBondContact O-N 2.98Å; N194-K197 PolarHBondContact O-N 3.46Å; G195-K197 VanDerWaalsContact C-N 3.33Å; G195-K197 PolarHBondContact O-N 3.35Å; K197-I199 VanDerWaalsContact C-N 3.33Å; K197-I199 PolarHBondContact O-N 3.43Å; K197-L200 WeakPolarHBondContact O-CB 3.34Å; K197-L200 PolarHBondContact O-N 3.38Å; K197-L200 VanDerWaalsContact O-N 3.15Å; K197-D201 VanDerWaalsContact O-CG 3.29Å; K197-D201 PolarHBondContact O-N 2.95Å |
| 198 | Q | 98.4 | Very high | 97.8 | Very high | 131 Ų | 131 | 88.2 Ų | 88.2 | 61% | 0.612 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -61.1 | -42.4 | 176.7 | -70 | 174.8 | 11.7 | 0 | 0 | 111.8 | N194 G195 L200 D201 V202 | N194-Q198 WeakPolarHBondContact O-CG 3.24Å; N194-Q198 PolarHBondContact O-N 3.23Å; G195-Q198 PolarHBondContact O-N 2.89Å; Q198-L200 VanDerWaalsContact C-N 3.33Å; Q198-L200 PolarHBondContact O-N 2.93Å; Q198-D201 PolarHBondContact O-N 2.95Å; Q198-V202 WeakPolarHBondContact O-CG2 3.47Å; Q198-V202 PolarHBondContact O-N 2.71Å |
| 199 | I | 98.4 | Very high | 98 | Very high | 98 Ų | 98 | 88 Ų | 88 | 50% | 0.503 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.7 | -43.4 | 175 | -66.6 | 166.8 | 0 | 0 | 0 | 110.5 | G195 L196 K197 D201 V202 L203 | G195-I199 WeakPolarHBondContact O-CG1 3.42Å; G195-I199 PolarHBondContact O-N 2.93Å; L196-I199 PolarHBondContact O-N 3.31Å; K197-I199 VanDerWaalsContact C-N 3.33Å; K197-I199 PolarHBondContact O-N 3.43Å; I199-D201 VanDerWaalsContact C-N 3.34Å; I199-D201 PolarHBondContact O-N 2.94Å; I199-V202 PolarHBondContact O-N 3.26Å; I199-L203 HydrophobicContact CG2-CD1 3.94Å; I199-L203 HydrophobicContact CG2-CG 4.32Å; I199-L203 WeakPolarHBondContact O-CB 3.4Å; I199-L203 VanDerWaalsContact O-CG 3.3Å; I199-L203 WeakPolarHBondContact O-CG 3.26Å; I199-L203 PolarHBondContact O-N 3.47Å |
| 200 | L | 98.6 | Very high | 98 | Very high | 105 Ų | 105 | 88.9 Ų | 88.9 | 55% | 0.55 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -60.6 | -42.5 | 176.2 | 179.3 | 64.5 | 0 | 0 | 0 | 111.9 | L196 K197 Q198 L203 T204 | L196-L200 WeakPolarHBondContact O-CB 3.44Å; L196-L200 PolarHBondContact O-N 2.9Å; K197-L200 WeakPolarHBondContact O-CB 3.34Å; K197-L200 PolarHBondContact O-N 3.38Å; K197-L200 VanDerWaalsContact O-N 3.15Å; Q198-L200 VanDerWaalsContact C-N 3.33Å; Q198-L200 PolarHBondContact O-N 2.93Å; L200-L203 PolarHBondContact O-N 3Å; L200-T204 WeakPolarHBondContact O-CB 3.45Å; L200-T204 PolarHBondContact O-N 3.43Å; L200-T204 PolarHBondContact O-OG1 3.37Å |
| 201 | D | 98.5 | Very high | 98 | Very high | 98 Ų | 98 | 89.8 Ų | 89.8 | 52% | 0.524 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63.3 | -44.8 | 178 | -67.1 | -23.8 | 0 | 0 | 0 | 111.2 | K197 Q198 I199 T204 L205 | K197-D201 VanDerWaalsContact O-CG 3.29Å; K197-D201 PolarHBondContact O-N 2.95Å; Q198-D201 PolarHBondContact O-N 2.95Å; I199-D201 VanDerWaalsContact C-N 3.34Å; I199-D201 PolarHBondContact O-N 2.94Å; D201-T204 PolarHBondContact O-N 2.89Å; D201-L205 WeakPolarHBondContact O-CG 3.41Å; D201-L205 PolarHBondContact O-N 3Å |
| 202 | V | 98.6 | Very high | 98.2 | Very high | 96 Ų | 96 | 89.6 Ų | 89.6 | 58% | 0.582 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -62 | -44.3 | 175.3 | 172.2 | 0 | 0 | 0 | 0 | 111.3 | Q198 I199 T204 L205 S206 | Q198-V202 WeakPolarHBondContact O-CG2 3.47Å; Q198-V202 PolarHBondContact O-N 2.71Å; I199-V202 PolarHBondContact O-N 3.26Å; V202-T204 VanDerWaalsContact C-N 3.32Å; V202-T204 PolarHBondContact O-N 3.36Å; V202-L205 PolarHBondContact O-N 2.83Å; V202-S206 WeakPolarHBondContact O-CB 3.44Å; V202-S206 PolarHBondContact O-N 3.47Å |
| 203 | L | 98.3 | Very high | 98.2 | Very high | 102 Ų | 102 | 93.3 Ų | 93.3 | 53% | 0.534 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.9 | -39.5 | 176.7 | -73.3 | 175.1 | 0 | 0 | 0 | 111.5 | I199 L200 S206 K207 | I199-L203 HydrophobicContact CG2-CD1 3.94Å; I199-L203 HydrophobicContact CG2-CG 4.32Å; I199-L203 WeakPolarHBondContact O-CB 3.4Å; I199-L203 VanDerWaalsContact O-CG 3.3Å; I199-L203 WeakPolarHBondContact O-CG 3.26Å; I199-L203 PolarHBondContact O-N 3.47Å; L200-L203 PolarHBondContact O-N 3Å; L203-S206 WeakPolarHBondContact CA-OG 3.35Å; L203-S206 PolarHBondContact O-N 3.43Å; L203-S206 PolarHBondContact O-OG 3.28Å; L203-K207 WeakPolarHBondContact O-CB 3.35Å; L203-K207 PolarHBondContact O-N 3.23Å |
| 204 | T | 98.6 | Very high | 98.3 | Very high | 78 Ų | 78 | 95.7 Ų | 95.7 | 48% | 0.479 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64.2 | -42.8 | 177.8 | -57.5 | 0 | 0 | 0 | 0 | 111.3 | L200 D201 V202 K207 A208 | L200-T204 WeakPolarHBondContact O-CB 3.45Å; L200-T204 PolarHBondContact O-N 3.43Å; L200-T204 PolarHBondContact O-OG1 3.37Å; D201-T204 PolarHBondContact O-N 2.89Å; V202-T204 VanDerWaalsContact C-N 3.32Å; V202-T204 PolarHBondContact O-N 3.36Å; T204-K207 PolarHBondContact O-N 2.88Å; T204-A208 PolarHBondContact O-N 3.29Å |
| 205 | L | 98.5 | Very high | 98.3 | Very high | 115 Ų | 115 | 97.4 Ų | 97.4 | 60% | 0.602 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -61.8 | -49.1 | 172.7 | -74.8 | 168.1 | 0 | 0 | 0 | 111.5 | D201 V202 K207 A208 D209 | D201-L205 WeakPolarHBondContact O-CG 3.41Å; D201-L205 PolarHBondContact O-N 3Å; V202-L205 PolarHBondContact O-N 2.83Å; L205-K207 PolarHBondContact O-N 3.48Å; L205-A208 WeakPolarHBondContact O-CB 3.3Å; L205-A208 PolarHBondContact O-N 3.3Å; L205-A208 VanDerWaalsContact O-N 3.07Å; L205-D209 PolarHBondContact O-N 3.05Å |
| 206 | S | 98.3 | Very high | 98.3 | Very high | 51 Ų | 51 | 98.7 Ų | 98.7 | 36% | 0.357 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -60.6 | -34.6 | 179.2 | 74.8 | 0 | 0 | 0 | 0 | 112.9 | V202 L203 L210 | V202-S206 WeakPolarHBondContact O-CB 3.44Å; V202-S206 PolarHBondContact O-N 3.47Å; L203-S206 WeakPolarHBondContact CA-OG 3.35Å; L203-S206 PolarHBondContact O-N 3.43Å; L203-S206 PolarHBondContact O-OG 3.28Å; S206-L210 WeakPolarHBondContact O-CG 3.5Å; S206-L210 PolarHBondContact O-N 2.93Å |
| 207 | K | 98.4 | Very high | 98.3 | Very high | 123 Ų | 123 | 97.9 Ų | 97.9 | 54% | 0.535 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -66.3 | -47.3 | 174.2 | 177.5 | -176.5 | 165.9 | -175 | 0 | 110.6 | L203 T204 L205 D209 L210 E211 | L203-K207 WeakPolarHBondContact O-CB 3.35Å; L203-K207 PolarHBondContact O-N 3.23Å; T204-K207 PolarHBondContact O-N 2.88Å; L205-K207 PolarHBondContact O-N 3.48Å; K207-D209 VanDerWaalsContact C-N 3.31Å; K207-D209 PolarHBondContact O-N 3.15Å; K207-L210 PolarHBondContact O-N 3.46Å; K207-E211 WeakPolarHBondContact CE-OE1 3.36Å; K207-E211 HydrophobicContact CG-CG 4.44Å; K207-E211 IonicContact NZ-OE1 3.63Å; K207-E211 WeakPolarHBondContact O-CB 3.36Å; K207-E211 WeakPolarHBondContact O-CG 3.49Å; K207-E211 PolarHBondContact O-N 2.94Å |
| 208 | A | 98.3 | Very high | 98.3 | Very high | 48 Ų | 48 | 95.4 Ų | 95.4 | 40% | 0.397 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60.6 | -40.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | T204 L205 L210 E211 A212 | T204-A208 PolarHBondContact O-N 3.29Å; L205-A208 WeakPolarHBondContact O-CB 3.3Å; L205-A208 PolarHBondContact O-N 3.3Å; L205-A208 VanDerWaalsContact O-N 3.07Å; A208-L210 PolarHBondContact O-N 3.41Å; A208-E211 PolarHBondContact O-N 3.06Å; A208-A212 WeakPolarHBondContact O-CB 3.45Å; A208-A212 PolarHBondContact O-N 2.89Å |
| 209 | D | 98.4 | Very high | 98.3 | Very high | 97 Ų | 97 | 95.1 Ų | 95.1 | 52% | 0.519 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.9 | -42.9 | 175.4 | -70.5 | -21.1 | 0 | 0 | 0 | 112.1 | L205 K207 A212 R213 | L205-D209 PolarHBondContact O-N 3.05Å; K207-D209 VanDerWaalsContact C-N 3.31Å; K207-D209 PolarHBondContact O-N 3.15Å; D209-A212 PolarHBondContact O-N 3.35Å; D209-R213 WeakPolarHBondContact O-CG 3.34Å; D209-R213 PolarHBondContact O-N 3.24Å |
| 210 | L | 98.3 | Very high | 98.2 | Very high | 103 Ų | 103 | 95.7 Ų | 95.7 | 54% | 0.539 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -66.4 | -41.9 | 175.7 | -74.8 | 170.6 | 0 | 0 | 0 | 111.8 | S206 K207 A208 A212 R213 V214 | S206-L210 WeakPolarHBondContact O-CG 3.5Å; S206-L210 PolarHBondContact O-N 2.93Å; K207-L210 PolarHBondContact O-N 3.46Å; A208-L210 PolarHBondContact O-N 3.41Å; L210-A212 VanDerWaalsContact C-N 3.33Å; L210-A212 PolarHBondContact O-N 2.87Å; L210-R213 PolarHBondContact O-N 2.99Å; L210-V214 WeakPolarHBondContact O-CG2 3.38Å; L210-V214 PolarHBondContact O-N 2.88Å |
| 211 | E | 98.1 | Very high | 98.2 | Very high | 96 Ų | 96 | 96.3 Ų | 96.3 | 45% | 0.449 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.3 | -41.4 | 175.4 | -74.6 | 176 | 167.5 | 0 | 0 | 111.4 | K207 A208 V214 Q215 | K207-E211 WeakPolarHBondContact CE-OE1 3.36Å; K207-E211 HydrophobicContact CG-CG 4.44Å; K207-E211 IonicContact NZ-OE1 3.63Å; K207-E211 WeakPolarHBondContact O-CB 3.36Å; K207-E211 WeakPolarHBondContact O-CG 3.49Å; K207-E211 PolarHBondContact O-N 2.94Å; A208-E211 PolarHBondContact O-N 3.06Å; E211-V214 PolarHBondContact O-N 3.39Å; E211-Q215 WeakPolarHBondContact O-CG 3.48Å; E211-Q215 PolarHBondContact O-N 3.4Å |
| 212 | A | 98.1 | Very high | 98.1 | Very high | 53 Ų | 53 | 96.9 Ų | 96.9 | 44% | 0.438 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.3 | -41.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | A208 D209 L210 V214 Q215 S216 | A208-A212 WeakPolarHBondContact O-CB 3.45Å; A208-A212 PolarHBondContact O-N 2.89Å; D209-A212 PolarHBondContact O-N 3.35Å; L210-A212 VanDerWaalsContact C-N 3.33Å; L210-A212 PolarHBondContact O-N 2.87Å; A212-V214 VanDerWaalsContact C-N 3.35Å; A212-V214 PolarHBondContact O-N 2.78Å; A212-Q215 PolarHBondContact O-N 3.49Å; A212-S216 WeakPolarHBondContact O-CB 3.4Å; A212-S216 PolarHBondContact O-N 3.4Å |
| 213 | R | 98.1 | Very high | 98 | Very high | 173 Ų | 173 | 95.9 Ų | 95.9 | 65% | 0.653 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62.5 | -41.3 | 173.9 | -72.7 | 175.8 | -174.9 | 179.4 | 2.7 | 112.1 | D209 L210 S216 L217 | D209-R213 WeakPolarHBondContact O-CG 3.34Å; D209-R213 PolarHBondContact O-N 3.24Å; L210-R213 PolarHBondContact O-N 2.99Å; R213-S216 PolarHBondContact O-N 3.49Å; R213-L217 WeakPolarHBondContact O-CG 3.5Å; R213-L217 PolarHBondContact O-N 3.19Å |
| 214 | V | 98.3 | Very high | 98 | Very high | 91 Ų | 91 | 96.6 Ų | 96.6 | 55% | 0.552 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -62.7 | -45.8 | 175.8 | 170.6 | 0 | 0 | 0 | 0 | 110.4 | L210 E211 A212 L217 T218 | L210-V214 WeakPolarHBondContact O-CG2 3.38Å; L210-V214 PolarHBondContact O-N 2.88Å; E211-V214 PolarHBondContact O-N 3.39Å; A212-V214 VanDerWaalsContact C-N 3.35Å; A212-V214 PolarHBondContact O-N 2.78Å; V214-L217 PolarHBondContact O-N 3.45Å; V214-T218 HydrophobicContact CG1-CG2 4.48Å; V214-T218 WeakPolarHBondContact O-CG2 2.81Å; V214-T218 PolarHBondContact O-N 3.28Å; V214-T218 PolarHBondContact O-OG1 3.32Å |
| 215 | Q | 98.1 | Very high | 97.9 | Very high | 118 Ų | 118 | 99.8 Ų | 99.8 | 55% | 0.551 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -59.8 | -48.9 | 177.1 | -72.8 | 173.1 | 7.1 | 0 | 0 | 111.7 | E211 A212 L217 T218 E219 | E211-Q215 WeakPolarHBondContact O-CG 3.48Å; E211-Q215 PolarHBondContact O-N 3.4Å; A212-Q215 PolarHBondContact O-N 3.49Å; Q215-L217 PolarHBondContact O-N 2.95Å; Q215-T218 WeakPolarHBondContact CA-OG1 3.43Å; Q215-T218 PolarHBondContact O-N 2.88Å; Q215-T218 VanDerWaalsContact O-N 3.08Å; Q215-T218 PolarHBondContact O-OG1 3.04Å; Q215-E219 WeakPolarHBondContact O-CG 3.27Å; Q215-E219 PolarHBondContact O-N 2.96Å |
| 216 | S | 98.1 | Very high | 97.8 | Very high | 53 Ų | 53 | 97 Ų | 97 | 37% | 0.371 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -54.2 | -48.6 | 175.6 | -171.4 | 0 | 0 | 0 | 0 | 112.1 | A212 R213 T218 E219 E220 | A212-S216 WeakPolarHBondContact O-CB 3.4Å; A212-S216 PolarHBondContact O-N 3.4Å; R213-S216 PolarHBondContact O-N 3.49Å; S216-T218 VanDerWaalsContact C-N 3.31Å; S216-T218 PolarHBondContact O-N 2.92Å; S216-E219 PolarHBondContact O-N 3.4Å; S216-E220 WeakPolarHBondContact O-CG 3.34Å; S216-E220 PolarHBondContact O-N 2.87Å |
| 217 | L | 98 | Very high | 97.7 | Very high | 102 Ų | 102 | 98.3 Ų | 98.3 | 53% | 0.534 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.5 | -35 | 178.4 | -72.5 | 170.9 | 0 | 0 | 0 | 112.6 | R213 V214 Q215 L221 | R213-L217 WeakPolarHBondContact O-CG 3.5Å; R213-L217 PolarHBondContact O-N 3.19Å; V214-L217 PolarHBondContact O-N 3.45Å; Q215-L217 PolarHBondContact O-N 2.95Å; L217-L221 WeakPolarHBondContact O-CB 3.33Å; L217-L221 WeakPolarHBondContact O-CG 3.49Å; L217-L221 PolarHBondContact O-N 3.43Å |
| 218 | T | 97.9 | Very high | 97.6 | Very high | 73 Ų | 73 | 97.6 Ų | 97.6 | 45% | 0.448 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -69.5 | -35.7 | 175.2 | 56.8 | 0 | 0 | 0 | 0 | 112.7 | V214 Q215 S216 L221 L222 | V214-T218 HydrophobicContact CG1-CG2 4.48Å; V214-T218 WeakPolarHBondContact O-CG2 2.81Å; V214-T218 PolarHBondContact O-N 3.28Å; V214-T218 PolarHBondContact O-OG1 3.32Å; Q215-T218 WeakPolarHBondContact CA-OG1 3.43Å; Q215-T218 PolarHBondContact O-N 2.88Å; Q215-T218 VanDerWaalsContact O-N 3.08Å; Q215-T218 PolarHBondContact O-OG1 3.04Å; S216-T218 VanDerWaalsContact C-N 3.31Å; S216-T218 PolarHBondContact O-N 2.92Å; T218-L221 PolarHBondContact O-N 3.04Å; T218-L222 WeakPolarHBondContact O-CB 3.42Å; T218-L222 PolarHBondContact O-N 3.48Å |
| 219 | E | 97.8 | Very high | 97.4 | Very high | 124 Ų | 124 | 100.6 Ų | 100.6 | 58% | 0.579 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -67.6 | -43.6 | 173.8 | -70.7 | 175.1 | -175.2 | 0 | 0 | 111.1 | Q215 S216 L221 L222 T223 | Q215-E219 WeakPolarHBondContact O-CG 3.27Å; Q215-E219 PolarHBondContact O-N 2.96Å; S216-E219 PolarHBondContact O-N 3.4Å; E219-L221 PolarHBondContact O-N 2.69Å; E219-L222 PolarHBondContact O-N 3.21Å; E219-T223 WeakPolarHBondContact O-CG2 3.4Å; E219-T223 PolarHBondContact O-N 3.42Å; E219-T223 PolarHBondContact O-OG1 3.03Å; E219-T223 VanDerWaalsContact O-OG1 3.06Å |
| 220 | E | 97.5 | Very high | 97.2 | Very high | 110 Ų | 110 | 102 Ų | 102 | 51% | 0.514 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -59.3 | -43.6 | 173.4 | -74.2 | 173.1 | -155.5 | 0 | 0 | 111.9 | S216 T223 L224 | S216-E220 WeakPolarHBondContact O-CG 3.34Å; S216-E220 PolarHBondContact O-N 2.87Å; E220-T223 WeakPolarHBondContact CA-OG1 3.37Å; E220-T223 PolarHBondContact O-N 3.18Å; E220-T223 PolarHBondContact O-OG1 3.16Å; E220-L224 WeakPolarHBondContact O-CB 3.36Å; E220-L224 PolarHBondContact O-N 3Å |
| 221 | L | 97.1 | Very high | 96.9 | Very high | 119 Ų | 119 | 102.7 Ų | 102.7 | 62% | 0.623 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -64.1 | -41.1 | 175.2 | -81.4 | 174.3 | 0 | 0 | 0 | 112.7 | L217 T218 E219 K225 | L217-L221 WeakPolarHBondContact O-CB 3.33Å; L217-L221 WeakPolarHBondContact O-CG 3.49Å; L217-L221 PolarHBondContact O-N 3.43Å; T218-L221 PolarHBondContact O-N 3.04Å; E219-L221 PolarHBondContact O-N 2.69Å; L221-K225 WeakPolarHBondContact O-CB 3.41Å; L221-K225 PolarHBondContact O-N 2.98Å |
| 222 | L | 97.6 | Very high | 96.6 | Very high | 110 Ų | 110 | 101.1 Ų | 101.1 | 58% | 0.576 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -63.8 | -48.4 | 177.3 | -101.1 | 165.1 | 0 | 0 | 0 | 111.3 | T218 E219 L224 K225 T226 | T218-L222 WeakPolarHBondContact O-CB 3.42Å; T218-L222 PolarHBondContact O-N 3.48Å; E219-L222 PolarHBondContact O-N 3.21Å; L222-L224 VanDerWaalsContact C-N 3.35Å; L222-L224 PolarHBondContact O-N 2.99Å; L222-K225 PolarHBondContact O-N 3.29Å; L222-T226 WeakPolarHBondContact O-CG2 3.47Å; L222-T226 PolarHBondContact O-N 3.28Å; L222-T226 PolarHBondContact O-OG1 2.96Å |
| 223 | T | 97.1 | Very high | 96.1 | Very high | 75 Ų | 75 | 102.2 Ų | 102.2 | 46% | 0.46 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.6 | -41.1 | 178.7 | 54 | 0 | 0 | 0 | 0 | 111.8 | E219 E220 K225 T226 N227 | E219-T223 WeakPolarHBondContact O-CG2 3.4Å; E219-T223 PolarHBondContact O-N 3.42Å; E219-T223 PolarHBondContact O-OG1 3.03Å; E219-T223 VanDerWaalsContact O-OG1 3.06Å; E220-T223 WeakPolarHBondContact CA-OG1 3.37Å; E220-T223 PolarHBondContact O-N 3.18Å; E220-T223 PolarHBondContact O-OG1 3.16Å; T223-K225 VanDerWaalsContact C-N 3.32Å; T223-K225 PolarHBondContact O-N 2.94Å; T223-T226 WeakPolarHBondContact CA-OG1 3.31Å; T223-T226 PolarHBondContact O-N 3.39Å; T223-T226 PolarHBondContact O-OG1 3.44Å; T223-N227 VanDerWaalsContact O-CB 3.29Å; T223-N227 WeakPolarHBondContact O-CB 3.43Å; T223-N227 PolarHBondContact O-N 3.28Å; T223-N227 PolarHBondContact O-ND2 3.38Å; T223-N227 PolarHBondContact O-OD1 3.06Å |
| 224 | L | 97.3 | Very high | 95.6 | Very high | 117 Ų | 117 | 96.6 Ų | 96.6 | 61% | 0.613 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -62.6 | -40.3 | 175.3 | -170.1 | 67.3 | 0 | 0 | 0 | 111.7 | E220 L222 H228 | E220-L224 WeakPolarHBondContact O-CB 3.36Å; E220-L224 PolarHBondContact O-N 3Å; L222-L224 VanDerWaalsContact C-N 3.35Å; L222-L224 PolarHBondContact O-N 2.99Å; L224-H228 VanDerWaalsContact O-CB 3.31Å; L224-H228 WeakPolarHBondContact O-CB 3.35Å; L224-H228 PolarHBondContact O-N 2.91Å |
| 225 | K | 97.1 | Very high | 95 | Very high | 144 Ų | 144 | 96.7 Ų | 96.7 | 63% | 0.626 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -67.3 | -44.3 | 177.8 | -172.4 | -176.7 | 175.6 | -172.6 | 0 | 112.1 | L221 L222 T223 H228 E229 | L221-K225 WeakPolarHBondContact O-CB 3.41Å; L221-K225 PolarHBondContact O-N 2.98Å; L222-K225 PolarHBondContact O-N 3.29Å; T223-K225 VanDerWaalsContact C-N 3.32Å; T223-K225 PolarHBondContact O-N 2.94Å; K225-H228 PolarHBondContact O-N 2.96Å; K225-E229 WeakPolarHBondContact O-CB 3.43Å; K225-E229 PolarHBondContact O-N 3.4Å |
| 226 | T | 96.9 | Very high | 94.1 | Very high | 58 Ų | 58 | 97 Ų | 97 | 36% | 0.356 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.9 | -42.8 | 177.5 | 54.3 | 0 | 0 | 0 | 0 | 111.2 | L222 T223 H228 E229 E230 | L222-T226 WeakPolarHBondContact O-CG2 3.47Å; L222-T226 PolarHBondContact O-N 3.28Å; L222-T226 PolarHBondContact O-OG1 2.96Å; T223-T226 WeakPolarHBondContact CA-OG1 3.31Å; T223-T226 PolarHBondContact O-N 3.39Å; T223-T226 PolarHBondContact O-OG1 3.44Å; T226-H228 VanDerWaalsContact C-N 3.32Å; T226-H228 PolarHBondContact O-N 3.28Å; T226-E229 PolarHBondContact O-N 3.26Å; T226-E230 WeakPolarHBondContact O-CB 3.43Å; T226-E230 WeakPolarHBondContact O-CG 3.4Å; T226-E230 PolarHBondContact O-N 3.44Å |
| 227 | N | 95.8 | Very high | 93.1 | Very high | 78 Ų | 78 | 99 Ų | 99 | 42% | 0.417 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.7 | -44.9 | 175.4 | -69.1 | -7.9 | 0 | 0 | 0 | 110.9 | T223 E229 E230 E231 | T223-N227 VanDerWaalsContact O-CB 3.29Å; T223-N227 WeakPolarHBondContact O-CB 3.43Å; T223-N227 PolarHBondContact O-N 3.28Å; T223-N227 PolarHBondContact O-ND2 3.38Å; T223-N227 PolarHBondContact O-OD1 3.06Å; N227-E229 PolarHBondContact O-N 3.43Å; N227-E230 PolarHBondContact O-N 3.47Å; N227-E231 WeakPolarHBondContact O-CB 3.35Å; N227-E231 VanDerWaalsContact O-CG 3.32Å; N227-E231 WeakPolarHBondContact O-CG 3.31Å; N227-E231 PolarHBondContact O-N 3.43Å |
| 228 | H | 95.6 | Very high | 91.9 | Very high | 107 Ų | 107 | 99.6 Ų | 99.6 | 50% | 0.495 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.8 | -41.2 | 176.8 | -177.2 | 58.8 | 0 | 0 | 0 | 112.6 | L224 K225 T226 E231 I232 | L224-H228 VanDerWaalsContact O-CB 3.31Å; L224-H228 WeakPolarHBondContact O-CB 3.35Å; L224-H228 PolarHBondContact O-N 2.91Å; K225-H228 PolarHBondContact O-N 2.96Å; T226-H228 VanDerWaalsContact C-N 3.32Å; T226-H228 PolarHBondContact O-N 3.28Å; H228-E231 PolarHBondContact O-N 3.17Å; H228-I232 WeakPolarHBondContact NE2-CD1 3.38Å; H228-I232 WeakPolarHBondContact O-CB 3.4Å; H228-I232 WeakPolarHBondContact O-CG1 3.4Å; H228-I232 PolarHBondContact O-N 2.94Å |
| 229 | E | 95.1 | Very high | 90.2 | Very high | 111 Ų | 111 | 102.1 Ų | 102.1 | 52% | 0.519 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.7 | -42.7 | 175.8 | -172.9 | 170.2 | -179.2 | 0 | 0 | 111.6 | K225 T226 N227 I232 N233 | K225-E229 WeakPolarHBondContact O-CB 3.43Å; K225-E229 PolarHBondContact O-N 3.4Å; T226-E229 PolarHBondContact O-N 3.26Å; N227-E229 PolarHBondContact O-N 3.43Å; E229-I232 PolarHBondContact O-N 2.83Å; E229-N233 WeakPolarHBondContact O-CB 3.34Å; E229-N233 PolarHBondContact O-N 3.35Å; E229-N233 PolarHBondContact O-ND2 2.92Å; E229-N233 VanDerWaalsContact O-ND2 3.1Å |
| 230 | E | 93.6 | Very high | 88 | Confident | 127 Ų | 127 | 99.3 Ų | 99.3 | 59% | 0.593 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -63.1 | -42.6 | 173.5 | -73.6 | 177 | -169 | 0 | 0 | 112.4 | T226 N227 N233 S234 | T226-E230 WeakPolarHBondContact O-CB 3.43Å; T226-E230 WeakPolarHBondContact O-CG 3.4Å; T226-E230 PolarHBondContact O-N 3.44Å; N227-E230 PolarHBondContact O-N 3.47Å; E230-N233 PolarHBondContact O-N 2.63Å; E230-S234 VanDerWaalsContact O-CB 3.25Å; E230-S234 WeakPolarHBondContact O-CB 3.44Å; E230-S234 PolarHBondContact O-N 3.36Å |
| 231 | E | 92.9 | Very high | 85.8 | Confident | 118 Ų | 118 | 101.4 Ų | 101.4 | 55% | 0.551 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -63 | -45.8 | 174.8 | -78.1 | 178.2 | -177.1 | 0 | 0 | 111.4 | N227 H228 N233 S234 L235 | N227-E231 WeakPolarHBondContact O-CB 3.35Å; N227-E231 VanDerWaalsContact O-CG 3.32Å; N227-E231 WeakPolarHBondContact O-CG 3.31Å; N227-E231 PolarHBondContact O-N 3.43Å; H228-E231 PolarHBondContact O-N 3.17Å; E231-N233 VanDerWaalsContact C-N 3.35Å; E231-N233 PolarHBondContact O-N 3.46Å; E231-S234 PolarHBondContact O-N 2.88Å; E231-L235 WeakPolarHBondContact O-CB 3.42Å; E231-L235 VanDerWaalsContact O-CG 3.28Å; E231-L235 WeakPolarHBondContact O-CG 3.29Å; E231-L235 PolarHBondContact O-N 3.09Å |
| 232 | I | 90.3 | Very high | 83.3 | Confident | 63 Ų | 63 | 106 Ų | 106 | 32% | 0.323 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -59.4 | -47.2 | 174.1 | -75 | 175.2 | 0 | 0 | 0 | 110.3 | H228 E229 S234 L235 Q236 | H228-I232 WeakPolarHBondContact NE2-CD1 3.38Å; H228-I232 WeakPolarHBondContact O-CB 3.4Å; H228-I232 WeakPolarHBondContact O-CG1 3.4Å; H228-I232 PolarHBondContact O-N 2.94Å; E229-I232 PolarHBondContact O-N 2.83Å; I232-S234 VanDerWaalsContact C-N 3.35Å; I232-S234 PolarHBondContact O-N 2.91Å; I232-L235 PolarHBondContact O-N 2.97Å; I232-Q236 HydrophobicContact CG2-CG 4.26Å; I232-Q236 WeakPolarHBondContact O-CB 3.36Å; I232-Q236 VanDerWaalsContact O-CG 3.28Å; I232-Q236 WeakPolarHBondContact O-CG 3.42Å; I232-Q236 PolarHBondContact O-N 2.91Å |
| 233 | N | 88.3 | Confident | 80.8 | Confident | 75 Ų | 75 | 107.8 Ų | 107.8 | 40% | 0.401 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -63.1 | -41.8 | 178.9 | -72.4 | -28.4 | 0 | 0 | 0 | 111.3 | E229 E230 E231 Q236 C237 | E229-N233 WeakPolarHBondContact O-CB 3.34Å; E229-N233 PolarHBondContact O-N 3.35Å; E229-N233 PolarHBondContact O-ND2 2.92Å; E229-N233 VanDerWaalsContact O-ND2 3.1Å; E230-N233 PolarHBondContact O-N 2.63Å; E231-N233 VanDerWaalsContact C-N 3.35Å; E231-N233 PolarHBondContact O-N 3.46Å; N233-Q236 PolarHBondContact O-N 3.23Å; N233-C237 WeakPolarHBondContact O-CB 3.39Å; N233-C237 PolarHBondContact O-N 2.88Å; N233-C237 PolarHBondContact O-SG 3.42Å |
| 234 | S | 87.8 | Confident | 78 | Confident | 56 Ų | 56 | 111.4 Ų | 111.4 | 39% | 0.392 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -61.8 | -47.2 | 175.1 | 179.2 | 0 | 0 | 0 | 0 | 111.3 | E230 E231 I232 C237 Q238 | E230-S234 VanDerWaalsContact O-CB 3.25Å; E230-S234 WeakPolarHBondContact O-CB 3.44Å; E230-S234 PolarHBondContact O-N 3.36Å; E231-S234 PolarHBondContact O-N 2.88Å; I232-S234 VanDerWaalsContact C-N 3.35Å; I232-S234 PolarHBondContact O-N 2.91Å; S234-C237 PolarHBondContact O-N 2.87Å; S234-Q238 WeakPolarHBondContact O-CB 3.48Å; S234-Q238 VanDerWaalsContact O-CG 3.24Å; S234-Q238 WeakPolarHBondContact O-CG 3.48Å; S234-Q238 PolarHBondContact O-N 3.33Å; S234-Q238 PolarHBondContact OG-NE2 3.28Å; S234-Q238 VanDerWaalsContact OG-NE2 3.11Å |
| 235 | L | 85.4 | Confident | 75.6 | Confident | 93 Ų | 93 | 113.1 Ų | 113.1 | 49% | 0.487 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -64.2 | -40.9 | 175.9 | -71.3 | 173.2 | 0 | 0 | 0 | 111.5 | E231 I232 Q238 L239 | E231-L235 WeakPolarHBondContact O-CB 3.42Å; E231-L235 VanDerWaalsContact O-CG 3.28Å; E231-L235 WeakPolarHBondContact O-CG 3.29Å; E231-L235 PolarHBondContact O-N 3.09Å; I232-L235 PolarHBondContact O-N 2.97Å; L235-Q238 PolarHBondContact O-N 2.98Å; L235-L239 WeakPolarHBondContact O-CB 3.46Å; L235-L239 WeakPolarHBondContact O-CD1 3.31Å; L235-L239 PolarHBondContact O-N 3.5Å |
| 236 | Q | 78.9 | Confident | 72.7 | Confident | 124 Ų | 124 | 114.4 Ų | 114.4 | 58% | 0.579 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -64.3 | -40.1 | 174.4 | -76.5 | 179.4 | 6 | 0 | 0 | 112.2 | I232 N233 L239 G240 | I232-Q236 HydrophobicContact CG2-CG 4.26Å; I232-Q236 WeakPolarHBondContact O-CB 3.36Å; I232-Q236 VanDerWaalsContact O-CG 3.28Å; I232-Q236 WeakPolarHBondContact O-CG 3.42Å; I232-Q236 PolarHBondContact O-N 2.91Å; N233-Q236 PolarHBondContact O-N 3.23Å; Q236-L239 PolarHBondContact O-N 2.88Å; Q236-G240 WeakPolarHBondContact O-CA 3.35Å; Q236-G240 PolarHBondContact O-N 3.05Å |
| 237 | C | 77.4 | Confident | 70.2 | Confident | 95 Ų | 95 | 118 Ų | 118 | 64% | 0.642 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -64.5 | -39.8 | 172.4 | -73.7 | 0 | 0 | 0 | 0 | 111.7 | N233 S234 G240 | N233-C237 WeakPolarHBondContact O-CB 3.39Å; N233-C237 PolarHBondContact O-N 2.88Å; N233-C237 PolarHBondContact O-SG 3.42Å; S234-C237 PolarHBondContact O-N 2.87Å; C237-G240 PolarHBondContact O-N 3.28Å |
| 238 | Q | 72.6 | Confident | 67.3 | Low | 115 Ų | 115 | 120.3 Ų | 120.3 | 54% | 0.537 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -67.1 | -38.7 | 175.7 | -73.8 | 175.8 | 44 | 0 | 0 | 112.4 | S234 L235 | S234-Q238 WeakPolarHBondContact O-CB 3.48Å; S234-Q238 VanDerWaalsContact O-CG 3.24Å; S234-Q238 WeakPolarHBondContact O-CG 3.48Å; S234-Q238 PolarHBondContact O-N 3.33Å; S234-Q238 PolarHBondContact OG-NE2 3.28Å; S234-Q238 VanDerWaalsContact OG-NE2 3.11Å; L235-Q238 PolarHBondContact O-N 2.98Å |
| 239 | L | 62.2 | Low | 64.7 | Low | 126 Ų | 126 | 119.7 Ų | 119.7 | 66% | 0.66 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -78.9 | -22.9 | 175 | -86.6 | 99.7 | 0 | 0 | 0 | 113.1 | L235 Q236 | L235-L239 WeakPolarHBondContact O-CB 3.46Å; L235-L239 WeakPolarHBondContact O-CD1 3.31Å; L235-L239 PolarHBondContact O-N 3.5Å; Q236-L239 PolarHBondContact O-N 2.88Å |
| 240 | G | 52.3 | Low | 62.4 | Low | 64 Ų | 64 | 118.1 Ų | 118.1 | 66% | 0.66 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -73.9 | -24.7 | -178.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | Q236 C237 | Q236-G240 WeakPolarHBondContact O-CA 3.35Å; Q236-G240 PolarHBondContact O-N 3.05Å; C237-G240 PolarHBondContact O-N 3.28Å |
| 241 | D | 50.4 | Low | 60.5 | Low | 154 Ų | 154 | 117.4 Ų | 117.4 | 82% | 0.824 | 66% | 0.655 | S | S | * | * | S | Bend | trans | -123.6 | 7.7 | -176.1 | -122.2 | 3.8 | 0 | 0 | 0 | 114.2 | ||
| 242 | R | 45.2 | Very low | 58.8 | Low | 215 Ų | 215 | 117.8 Ų | 117.8 | 81% | 0.811 | 67% | 0.67 | S | S | * | * | trans | -142.6 | 71.8 | 178.1 | -70.6 | -170.8 | 162.2 | -163.7 | -5.8 | 113 | ||||
| 243 | I | 44.5 | Very low | 57.5 | Low | 148 Ų | 148 | 120.2 Ų | 120.2 | 76% | 0.759 | 68% | 0.683 | S | S | * | * | trans | -102 | 79.3 | 142.4 | -56.3 | 177.8 | 0 | 0 | 0 | 107.1 | ||||
| 244 | N | 37.9 | Very low | 56.4 | Low | 152 Ų | 152 | 120.9 Ų | 120.9 | 81% | 0.813 | 69% | 0.686 | S | S | * | * | trans | -136.4 | 103.2 | 149.1 | -93.2 | -28 | 0 | 0 | 0 | 105.4 | E246 | N244-E246 PolarHBondContact O-N 3.22Å; N244-E246 VanDerWaalsContact O-N 3.15Å | ||
| 245 | I | 48.6 | Very low | 55.8 | Low | 152 Ų | 152 | 123.8 Ų | 123.8 | 78% | 0.779 | 70% | 0.697 | S | S | * | * | trans | -76.4 | 95 | 171.4 | -61.1 | 169 | 0 | 0 | 0 | 105.8 | V247 | I245-V247 HydrophobicContact CG2-CG2 4.22Š| ||
| 246 | E | 35.3 | Very low | 55.6 | Low | 172 Ų | 172 | 125 Ų | 125 | 80% | 0.804 | 70% | 0.704 | S | S | * | * | trans | -112.4 | 111.8 | 156.9 | -81.9 | -174 | 163.4 | 0 | 0 | 108.3 | N244 T248 | N244-E246 PolarHBondContact O-N 3.22Å; N244-E246 VanDerWaalsContact O-N 3.15Å; E246-T248 PolarHBondContact O-N 2.9Å; E246-T248 VanDerWaalsContact O-N 3.11Å | ||
| 247 | V | 44.6 | Very low | 55.7 | Low | 134 Ų | 134 | 125.3 Ų | 125.3 | 81% | 0.812 | 71% | 0.706 | S | S | * | * | trans | -70.8 | 95.5 | 173.8 | 174.9 | 0 | 0 | 0 | 0 | 107.4 | I245 | I245-V247 HydrophobicContact CG2-CG2 4.22Š| ||
| 248 | T | 34.7 | Very low | 56.1 | Low | 126 Ų | 126 | 124.3 Ų | 124.3 | 77% | 0.773 | 69% | 0.693 | S | S | * | * | trans | -97.5 | 102.5 | 166.3 | -29.5 | 0 | 0 | 0 | 0 | 107.7 | E246 A250 | E246-T248 PolarHBondContact O-N 2.9Å; E246-T248 VanDerWaalsContact O-N 3.11Å; T248-A250 PolarHBondContact O-N 3.42Å | ||
| 249 | A | 40.9 | Very low | 56.7 | Low | 93 Ų | 93 | 123.6 Ų | 123.6 | 77% | 0.769 | 69% | 0.692 | S | S | * | * | trans | -56.9 | 108.1 | 173.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 250 | A | 46.1 | Very low | 58 | Low | 78 Ų | 78 | 122.2 Ų | 122.2 | 65% | 0.645 | 68% | 0.683 | S | S | * | * | trans | -65.5 | 152.1 | 168.1 | 0 | 0 | 0 | 0 | 0 | 109.4 | T248 | T248-A250 PolarHBondContact O-N 3.42Š| ||
| 251 | P | 55 | Low | 59.8 | Low | 112 Ų | 112 | 125.1 Ų | 125.1 | 73% | 0.727 | 68% | 0.679 | S | S | * | * | trans | -60.2 | 147.6 | -170.6 | -12.9 | 27.3 | 0 | 0 | 0 | 110.1 | I253 | P251-I253 VanDerWaalsContact C-N 3.34Å; P251-I253 PolarHBondContact O-N 2.98Å | ||
| 252 | S | 55.8 | Low | 61.6 | Low | 126 Ų | 126 | 122.4 Ų | 122.4 | 88% | 0.881 | 66% | 0.663 | S | S | * | * | trans | -53.1 | 94.7 | 178.8 | 55 | 0 | 0 | 0 | 0 | 111 | ||||
| 253 | I | 63.2 | Low | 63.9 | Low | 114 Ų | 114 | 119.4 Ų | 119.4 | 59% | 0.585 | 65% | 0.651 | S | S | * | * | trans | -71.2 | 130.8 | 167.4 | -65.5 | 158.6 | 0 | 0 | 0 | 105.9 | P251 L255 I258 | P251-I253 VanDerWaalsContact C-N 3.34Å; P251-I253 PolarHBondContact O-N 2.98Å; I253-L255 VanDerWaalsContact C-N 3.35Å; I253-L255 PolarHBondContact O-N 3.34Å; I253-I258 HydrophobicContact CB-CD1 4.35Å; I253-I258 HydrophobicContact CG2-CD1 3.35Å; I253-I258 HydrophobicContact CG2-CG1 3.86Å | ||
| 254 | D | 65.5 | Low | 66.1 | Low | 89 Ų | 89 | 115.3 Ų | 115.3 | 48% | 0.476 | 64% | 0.635 | S | S | . | * | trans | -61 | 99.3 | 176 | -176.7 | 10.2 | 0 | 0 | 0 | 108.9 | N256 Q257 I258 | D254-N256 PolarHBondContact O-N 2.99Å; D254-N256 VanDerWaalsContact O-N 3.11Å; D254-N256 WeakPolarHBondContact OD1-CB 3.37Å; D254-N256 PolarHBondContact OD1-N 2.68Å; D254-Q257 HydrophobicContact CB-CB 4.14Å; D254-Q257 WeakPolarHBondContact O-CB 3.31Å; D254-Q257 PolarHBondContact O-N 3.22Å; D254-I258 PolarHBondContact O-N 2.99Å | ||
| 255 | L | 75.3 | Confident | 68.7 | Low | 117 Ų | 117 | 115.9 Ų | 115.9 | 61% | 0.613 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -56.3 | -29.4 | -178 | -175.7 | 65.6 | 0 | 0 | 0 | 111 | I253 L259 | I253-L255 VanDerWaalsContact C-N 3.35Å; I253-L255 PolarHBondContact O-N 3.34Å; L255-L259 HydrophobicContact CD1-CD1 4.45Å; L255-L259 HydrophobicContact CD1-CG 4.41Å; L255-L259 HydrophobicContact CD2-CD1 4.42Å; L255-L259 HydrophobicContact CG-CD1 3.89Å; L255-L259 HydrophobicContact CG-CG 4.29Å; L255-L259 VanDerWaalsContact O-CB 3.3Å; L255-L259 WeakPolarHBondContact O-CB 3.33Å; L255-L259 WeakPolarHBondContact O-CG 3.36Å; L255-L259 PolarHBondContact O-N 2.84Å |
| 256 | N | 80.3 | Confident | 70.8 | Confident | 120 Ų | 120 | 115.6 Ų | 115.6 | 64% | 0.642 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -66.6 | -36.9 | 175.1 | -73.1 | -59.7 | 0 | 0 | 0 | 112.2 | D254 Q260 | D254-N256 PolarHBondContact O-N 2.99Å; D254-N256 VanDerWaalsContact O-N 3.11Å; D254-N256 WeakPolarHBondContact OD1-CB 3.37Å; D254-N256 PolarHBondContact OD1-N 2.68Å; N256-Q260 WeakPolarHBondContact O-CB 3.47Å; N256-Q260 PolarHBondContact O-N 3.49Å |
| 257 | Q | 82.6 | Confident | 73.6 | Confident | 130 Ų | 130 | 112.9 Ų | 112.9 | 61% | 0.607 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -66.3 | -44.4 | 178.2 | -169.5 | 177.7 | 5.5 | 0 | 0 | 111.4 | D254 Q260 E261 | D254-Q257 HydrophobicContact CB-CB 4.14Å; D254-Q257 WeakPolarHBondContact O-CB 3.31Å; D254-Q257 PolarHBondContact O-N 3.22Å; Q257-Q260 PolarHBondContact O-N 3.45Å; Q257-E261 WeakPolarHBondContact O-CB 3.25Å; Q257-E261 PolarHBondContact O-N 2.83Å |
| 258 | I | 85.3 | Confident | 76 | Confident | 74 Ų | 74 | 109.8 Ų | 109.8 | 38% | 0.379 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -66.1 | -44.8 | 176.1 | -69.4 | -179.5 | 0 | 0 | 0 | 111.4 | I253 D254 Q260 E261 M262 | I253-I258 HydrophobicContact CB-CD1 4.35Å; I253-I258 HydrophobicContact CG2-CD1 3.35Å; I253-I258 HydrophobicContact CG2-CG1 3.86Å; D254-I258 PolarHBondContact O-N 2.99Å; I258-Q260 VanDerWaalsContact C-N 3.28Å; I258-Q260 PolarHBondContact O-N 2.94Å; I258-E261 PolarHBondContact O-N 3.34Å; I258-M262 HydrophobicContact CG2-CG 4.35Å; I258-M262 WeakPolarHBondContact O-CB 3.36Å; I258-M262 VanDerWaalsContact O-CG 3.31Å; I258-M262 WeakPolarHBondContact O-CG 3.46Å; I258-M262 PolarHBondContact O-N 3.45Å |
| 259 | L | 85.8 | Confident | 78.8 | Confident | 100 Ų | 100 | 107.3 Ų | 107.3 | 52% | 0.524 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -63.6 | -36.6 | 178.3 | -73.6 | 173.2 | 0 | 0 | 0 | 111.6 | L255 R263 | L255-L259 HydrophobicContact CD1-CD1 4.45Å; L255-L259 HydrophobicContact CD1-CG 4.41Å; L255-L259 HydrophobicContact CD2-CD1 4.42Å; L255-L259 HydrophobicContact CG-CD1 3.89Å; L255-L259 HydrophobicContact CG-CG 4.29Å; L255-L259 VanDerWaalsContact O-CB 3.3Å; L255-L259 WeakPolarHBondContact O-CB 3.33Å; L255-L259 WeakPolarHBondContact O-CG 3.36Å; L255-L259 PolarHBondContact O-N 2.84Å; L259-R263 WeakPolarHBondContact O-CB 3.31Å; L259-R263 PolarHBondContact O-N 2.94Å |
| 260 | Q | 88.6 | Confident | 81.4 | Confident | 97 Ų | 97 | 107.4 Ų | 107.4 | 45% | 0.453 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -69.4 | -42.2 | 174.8 | -173.8 | 62.1 | 20.9 | 0 | 0 | 111.6 | N256 Q257 I258 R263 C264 | N256-Q260 WeakPolarHBondContact O-CB 3.47Å; N256-Q260 PolarHBondContact O-N 3.49Å; Q257-Q260 PolarHBondContact O-N 3.45Å; I258-Q260 VanDerWaalsContact C-N 3.28Å; I258-Q260 PolarHBondContact O-N 2.94Å; Q260-R263 PolarHBondContact O-N 2.68Å; Q260-C264 WeakPolarHBondContact O-CB 3.42Å; Q260-C264 PolarHBondContact O-N 2.87Å; Q260-C264 PolarHBondContact O-SG 3.1Å |
| 261 | E | 89.2 | Confident | 83.7 | Confident | 125 Ų | 125 | 107.2 Ų | 107.2 | 58% | 0.584 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -62.1 | -44.9 | 174.9 | -175.3 | 174.3 | -175.7 | 0 | 0 | 111.5 | Q257 I258 R263 C264 R265 | Q257-E261 WeakPolarHBondContact O-CB 3.25Å; Q257-E261 PolarHBondContact O-N 2.83Å; I258-E261 PolarHBondContact O-N 3.34Å; E261-R263 VanDerWaalsContact C-N 3.35Å; E261-R263 PolarHBondContact O-N 2.76Å; E261-C264 PolarHBondContact O-N 2.84Å; E261-R265 VanDerWaalsContact O-CG 3.26Å; E261-R265 WeakPolarHBondContact O-CG 3.31Å; E261-R265 PolarHBondContact O-N 2.84Å |
| 262 | M | 90.2 | Very high | 85.6 | Confident | 97 Ų | 97 | 104.9 Ų | 104.9 | 48% | 0.478 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -58.6 | -44.8 | 173.1 | -77.5 | -75.7 | -77.9 | 0 | 0 | 111.5 | I258 R265 Y266 | I258-M262 HydrophobicContact CG2-CG 4.35Å; I258-M262 WeakPolarHBondContact O-CB 3.36Å; I258-M262 VanDerWaalsContact O-CG 3.31Å; I258-M262 WeakPolarHBondContact O-CG 3.46Å; I258-M262 PolarHBondContact O-N 3.45Å; M262-R265 PolarHBondContact O-N 3.43Å; M262-Y266 HydrophobicContact CE-CE2 3.9Å; M262-Y266 WeakPolarHBondContact O-CD2 3.25Å; M262-Y266 PolarHBondContact O-N 3.39Å |
| 263 | R | 92.6 | Very high | 87.5 | Confident | 151 Ų | 151 | 103 Ų | 103 | 57% | 0.57 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -61.3 | -48 | 175.8 | -175.5 | -180 | -71.2 | 178.1 | -1.7 | 111.5 | L259 Q260 E261 R265 Y266 E267 | L259-R263 WeakPolarHBondContact O-CB 3.31Å; L259-R263 PolarHBondContact O-N 2.94Å; Q260-R263 PolarHBondContact O-N 2.68Å; E261-R263 VanDerWaalsContact C-N 3.35Å; E261-R263 PolarHBondContact O-N 2.76Å; R263-R265 VanDerWaalsContact C-N 3.28Å; R263-R265 PolarHBondContact O-N 2.78Å; R263-Y266 PolarHBondContact O-N 2.93Å; R263-E267 WeakPolarHBondContact CD-OE1 3.29Å; R263-E267 HydrophobicContact CG-CG 4.31Å; R263-E267 WeakPolarHBondContact CG-OE1 3.38Å; R263-E267 WeakPolarHBondContact O-CB 3.41Å; R263-E267 WeakPolarHBondContact O-CG 3.38Å; R263-E267 PolarHBondContact O-N 2.98Å |
| 264 | C | 90.9 | Very high | 89 | Confident | 62 Ų | 62 | 102.5 Ų | 102.5 | 42% | 0.419 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.4 | -38 | 176.4 | -69.5 | 0 | 0 | 0 | 0 | 112.2 | Q260 E261 S268 | Q260-C264 WeakPolarHBondContact O-CB 3.42Å; Q260-C264 PolarHBondContact O-N 2.87Å; Q260-C264 PolarHBondContact O-SG 3.1Å; E261-C264 PolarHBondContact O-N 2.84Å; C264-S268 VanDerWaalsContact O-CB 3.27Å; C264-S268 WeakPolarHBondContact O-CB 3.28Å; C264-S268 PolarHBondContact O-N 3.23Å |
| 265 | R | 92 | Very high | 90.5 | Very high | 165 Ų | 165 | 103 Ų | 103 | 62% | 0.623 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -65.5 | -44.4 | 175.2 | -71.8 | -72.2 | -63.6 | 179.8 | 0.8 | 111.8 | E261 M262 R263 S268 I269 | E261-R265 VanDerWaalsContact O-CG 3.26Å; E261-R265 WeakPolarHBondContact O-CG 3.31Å; E261-R265 PolarHBondContact O-N 2.84Å; M262-R265 PolarHBondContact O-N 3.43Å; R263-R265 VanDerWaalsContact C-N 3.28Å; R263-R265 PolarHBondContact O-N 2.78Å; R265-S268 PolarHBondContact O-N 2.97Å; R265-I269 WeakPolarHBondContact O-CD1 3.44Å; R265-I269 VanDerWaalsContact O-CG1 3.27Å; R265-I269 WeakPolarHBondContact O-CG1 3.43Å; R265-I269 PolarHBondContact O-N 3.29Å |
| 266 | Y | 93.4 | Very high | 91.5 | Very high | 146 Ų | 146 | 101.9 Ų | 101.9 | 57% | 0.573 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -67.4 | -43.4 | 176.5 | -81 | -64.9 | 0 | 0 | 0 | 112.5 | M262 R263 S268 I269 V270 | M262-Y266 HydrophobicContact CE-CE2 3.9Å; M262-Y266 WeakPolarHBondContact O-CD2 3.25Å; M262-Y266 PolarHBondContact O-N 3.39Å; R263-Y266 PolarHBondContact O-N 2.93Å; Y266-S268 VanDerWaalsContact C-N 3.28Å; Y266-S268 PolarHBondContact O-N 3.41Å; Y266-I269 PolarHBondContact O-N 2.93Å; Y266-V270 WeakPolarHBondContact O-CB 3.41Å; Y266-V270 VanDerWaalsContact O-CG2 3.26Å; Y266-V270 WeakPolarHBondContact O-CG2 3.25Å; Y266-V270 PolarHBondContact O-N 3.42Å |
| 267 | E | 93.8 | Very high | 92.3 | Very high | 114 Ų | 114 | 99.7 Ų | 99.7 | 53% | 0.533 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -59.9 | -41.3 | 175.3 | -75.4 | 173.1 | -175.9 | 0 | 0 | 111 | R263 V270 E271 | R263-E267 WeakPolarHBondContact CD-OE1 3.29Å; R263-E267 HydrophobicContact CG-CG 4.31Å; R263-E267 WeakPolarHBondContact CG-OE1 3.38Å; R263-E267 WeakPolarHBondContact O-CB 3.41Å; R263-E267 WeakPolarHBondContact O-CG 3.38Å; R263-E267 PolarHBondContact O-N 2.98Å; E267-V270 PolarHBondContact O-N 2.89Å; E267-E271 WeakPolarHBondContact O-CB 3.45Å; E267-E271 PolarHBondContact O-N 3.46Å |
| 268 | S | 95 | Very high | 92.9 | Very high | 70 Ų | 70 | 97.9 Ų | 97.9 | 49% | 0.49 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -61.3 | -47.6 | 173.7 | -174.5 | 0 | 0 | 0 | 0 | 112.2 | C264 R265 Y266 V270 E271 T272 | C264-S268 VanDerWaalsContact O-CB 3.27Å; C264-S268 WeakPolarHBondContact O-CB 3.28Å; C264-S268 PolarHBondContact O-N 3.23Å; R265-S268 PolarHBondContact O-N 2.97Å; Y266-S268 VanDerWaalsContact C-N 3.28Å; Y266-S268 PolarHBondContact O-N 3.41Å; S268-V270 PolarHBondContact O-N 3.49Å; S268-E271 PolarHBondContact O-N 2.96Å; S268-T272 WeakPolarHBondContact O-CG2 3.31Å; S268-T272 PolarHBondContact O-N 3.46Å; S268-T272 PolarHBondContact O-OG1 3.24Å |
| 269 | I | 93.8 | Very high | 93.5 | Very high | 73 Ų | 73 | 99.4 Ų | 99.4 | 37% | 0.374 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -64 | -41.2 | 178.3 | -68.6 | 163.9 | 0 | 0 | 0 | 111.6 | R265 Y266 E271 T272 N273 | R265-I269 WeakPolarHBondContact O-CD1 3.44Å; R265-I269 VanDerWaalsContact O-CG1 3.27Å; R265-I269 WeakPolarHBondContact O-CG1 3.43Å; R265-I269 PolarHBondContact O-N 3.29Å; Y266-I269 PolarHBondContact O-N 2.93Å; I269-E271 VanDerWaalsContact C-N 3.33Å; I269-T272 WeakPolarHBondContact CA-OG1 3.11Å; I269-T272 PolarHBondContact O-N 2.89Å; I269-T272 PolarHBondContact O-OG1 2.74Å; I269-N273 VanDerWaalsContact O-CB 3.26Å; I269-N273 WeakPolarHBondContact O-CB 3.46Å; I269-N273 PolarHBondContact O-N 3.1Å; I269-N273 PolarHBondContact O-ND2 3.49Å; I269-N273 PolarHBondContact O-OD1 3.3Å |
| 270 | V | 94.6 | Very high | 94 | Very high | 96 Ų | 96 | 101.6 Ų | 101.6 | 58% | 0.582 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -65.3 | -40.9 | 177.4 | 170.1 | 0 | 0 | 0 | 0 | 110.4 | Y266 E267 S268 N273 R274 | Y266-V270 WeakPolarHBondContact O-CB 3.41Å; Y266-V270 VanDerWaalsContact O-CG2 3.26Å; Y266-V270 WeakPolarHBondContact O-CG2 3.25Å; Y266-V270 PolarHBondContact O-N 3.42Å; E267-V270 PolarHBondContact O-N 2.89Å; S268-V270 PolarHBondContact O-N 3.49Å; V270-N273 PolarHBondContact O-N 2.92Å; V270-R274 WeakPolarHBondContact O-CB 3.35Å; V270-R274 PolarHBondContact O-N 3.2Å |
| 271 | E | 94.9 | Very high | 94.4 | Very high | 73 Ų | 73 | 102.5 Ų | 102.5 | 34% | 0.341 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -70.1 | -37.2 | 178.3 | -177.9 | 61.3 | -169.7 | 0 | 0 | 112.6 | E267 S268 I269 R274 K275 | E267-E271 WeakPolarHBondContact O-CB 3.45Å; E267-E271 PolarHBondContact O-N 3.46Å; S268-E271 PolarHBondContact O-N 2.96Å; I269-E271 VanDerWaalsContact C-N 3.33Å; E271-R274 VanDerWaalsContact CD-NH2 3.3Å; E271-R274 IonicContact OE1-CZ 2.92Å; E271-R274 IonicContact OE1-NE 3.64Å; E271-R274 IonicContact OE1-NH2 2.91Å; E271-R274 PolarHBondContact OE1-NH2 2.92Å; E271-R274 IonicContact OE2-CZ 3.84Å; E271-R274 IonicContact OE2-NE 3.52Å; E271-R274 PolarHBondContact OE2-NE 3.48Å; E271-R274 IonicContact OE2-NH2 3.06Å; E271-R274 PolarHBondContact OE2-NH2 2.92Å; E271-K275 WeakPolarHBondContact O-CG 3.42Å; E271-K275 PolarHBondContact O-N 2.86Å; E271-K275 VanDerWaalsContact O-N 3.13Å; E271-K275 WeakPolarHBondContact OE1-CE 3.39Å; E271-K275 IonicContact OE1-NZ 2.68Å; E271-K275 PolarHBondContact OE1-NZ 3.36Å |
| 272 | T | 95.1 | Very high | 94.8 | Very high | 63 Ų | 63 | 101.7 Ų | 101.7 | 39% | 0.387 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -66.2 | -47 | 171.4 | 54.6 | 0 | 0 | 0 | 0 | 110.7 | S268 I269 R274 K275 D276 | S268-T272 WeakPolarHBondContact O-CG2 3.31Å; S268-T272 PolarHBondContact O-N 3.46Å; S268-T272 PolarHBondContact O-OG1 3.24Å; I269-T272 WeakPolarHBondContact CA-OG1 3.11Å; I269-T272 PolarHBondContact O-N 2.89Å; I269-T272 PolarHBondContact O-OG1 2.74Å; T272-R274 VanDerWaalsContact C-N 3.29Å; T272-R274 PolarHBondContact O-N 3.39Å; T272-K275 PolarHBondContact O-N 2.97Å; T272-K275 VanDerWaalsContact O-N 3.12Å; T272-D276 WeakPolarHBondContact O-CB 3.41Å; T272-D276 PolarHBondContact O-N 3.46Å |
| 273 | N | 94.6 | Very high | 95.2 | Very high | 87 Ų | 87 | 100.5 Ų | 100.5 | 47% | 0.465 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -59.6 | -40.2 | 177.6 | -71.9 | -13.1 | 0 | 0 | 0 | 111.9 | I269 V270 D276 V277 | I269-N273 VanDerWaalsContact O-CB 3.26Å; I269-N273 WeakPolarHBondContact O-CB 3.46Å; I269-N273 PolarHBondContact O-N 3.1Å; I269-N273 PolarHBondContact O-ND2 3.49Å; I269-N273 PolarHBondContact O-OD1 3.3Å; V270-N273 PolarHBondContact O-N 2.92Å; N273-D276 PolarHBondContact O-N 2.97Å; N273-V277 WeakPolarHBondContact O-CB 3.49Å; N273-V277 VanDerWaalsContact O-CG2 3.22Å; N273-V277 WeakPolarHBondContact O-CG2 3.32Å; N273-V277 PolarHBondContact O-N 2.93Å |
| 274 | R | 96.3 | Very high | 95.4 | Very high | 103 Ų | 103 | 97.1 Ų | 97.1 | 39% | 0.389 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -60.7 | -46.9 | 175.5 | -173.3 | -173.6 | 67 | 72.6 | 1.7 | 111.2 | V270 E271 T272 V277 E278 | V270-R274 WeakPolarHBondContact O-CB 3.35Å; V270-R274 PolarHBondContact O-N 3.2Å; E271-R274 VanDerWaalsContact CD-NH2 3.3Å; E271-R274 IonicContact OE1-CZ 2.92Å; E271-R274 IonicContact OE1-NE 3.64Å; E271-R274 IonicContact OE1-NH2 2.91Å; E271-R274 PolarHBondContact OE1-NH2 2.92Å; E271-R274 IonicContact OE2-CZ 3.84Å; E271-R274 IonicContact OE2-NE 3.52Å; E271-R274 PolarHBondContact OE2-NE 3.48Å; E271-R274 IonicContact OE2-NH2 3.06Å; E271-R274 PolarHBondContact OE2-NH2 2.92Å; T272-R274 VanDerWaalsContact C-N 3.29Å; T272-R274 PolarHBondContact O-N 3.39Å; R274-V277 PolarHBondContact O-N 3.27Å; R274-E278 IonicContact CZ-OE1 3.42Å; R274-E278 IonicContact NH1-OE1 2.63Å; R274-E278 PolarHBondContact NH1-OE1 3.06Å; R274-E278 IonicContact NH1-OE2 2.66Å; R274-E278 PolarHBondContact NH1-OE2 3.39Å; R274-E278 WeakPolarHBondContact O-CG 3.44Å; R274-E278 PolarHBondContact O-N 3.22Å |
| 275 | K | 96.5 | Very high | 95.6 | Very high | 99 Ų | 99 | 99.6 Ų | 99.6 | 43% | 0.43 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -64.9 | -41.6 | 177.5 | -73 | 172.7 | -177 | 163 | 0 | 112.3 | E271 T272 V277 E278 L279 | E271-K275 WeakPolarHBondContact O-CG 3.42Å; E271-K275 PolarHBondContact O-N 2.86Å; E271-K275 VanDerWaalsContact O-N 3.13Å; E271-K275 WeakPolarHBondContact OE1-CE 3.39Å; E271-K275 IonicContact OE1-NZ 2.68Å; E271-K275 PolarHBondContact OE1-NZ 3.36Å; T272-K275 PolarHBondContact O-N 2.97Å; T272-K275 VanDerWaalsContact O-N 3.12Å; K275-V277 VanDerWaalsContact C-N 3.33Å; K275-V277 PolarHBondContact O-N 3.11Å; K275-E278 PolarHBondContact O-N 2.89Å; K275-L279 WeakPolarHBondContact O-CB 3.47Å; K275-L279 VanDerWaalsContact O-CG 3.31Å; K275-L279 WeakPolarHBondContact O-CG 3.49Å; K275-L279 PolarHBondContact O-N 3.49Å |
| 276 | D | 96.1 | Very high | 95.9 | Very high | 94 Ų | 94 | 97.7 Ų | 97.7 | 50% | 0.503 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -65 | -40.3 | 179.6 | -66.5 | -18.7 | 0 | 0 | 0 | 111 | T272 N273 W280 | T272-D276 WeakPolarHBondContact O-CB 3.41Å; T272-D276 PolarHBondContact O-N 3.46Å; N273-D276 PolarHBondContact O-N 2.97Å; D276-W280 VanDerWaalsContact O-CB 3.26Å; D276-W280 WeakPolarHBondContact O-CB 3.39Å; D276-W280 PolarHBondContact O-N 3.18Å |
| 277 | V | 96.6 | Very high | 96 | Very high | 74 Ų | 74 | 95.6 Ų | 95.6 | 45% | 0.448 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -66.2 | -44.3 | 174.2 | 169.9 | 0 | 0 | 0 | 0 | 111.4 | N273 R274 K275 W280 F281 | N273-V277 WeakPolarHBondContact O-CB 3.49Å; N273-V277 VanDerWaalsContact O-CG2 3.22Å; N273-V277 WeakPolarHBondContact O-CG2 3.32Å; N273-V277 PolarHBondContact O-N 2.93Å; R274-V277 PolarHBondContact O-N 3.27Å; K275-V277 VanDerWaalsContact C-N 3.33Å; K275-V277 PolarHBondContact O-N 3.11Å; V277-W280 PolarHBondContact O-N 3.36Å; V277-F281 HydrophobicContact CG1-CD2 3.48Å; V277-F281 VanDerWaalsContact CG1-CD2 3.48Å; V277-F281 HydrophobicContact CG1-CE2 3.3Å; V277-F281 WeakPolarHBondContact O-CB 3.34Å; V277-F281 WeakPolarHBondContact O-CD2 3.49Å; V277-F281 PolarHBondContact O-N 3.41Å |
| 278 | E | 96.4 | Very high | 96.2 | Very high | 92 Ų | 92 | 94.7 Ų | 94.7 | 43% | 0.43 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -61.9 | -43.8 | 175.5 | -79 | 172.4 | -169.6 | 0 | 0 | 112.2 | R274 K275 F281 N282 | R274-E278 IonicContact CZ-OE1 3.42Å; R274-E278 IonicContact NH1-OE1 2.63Å; R274-E278 PolarHBondContact NH1-OE1 3.06Å; R274-E278 IonicContact NH1-OE2 2.66Å; R274-E278 PolarHBondContact NH1-OE2 3.39Å; R274-E278 WeakPolarHBondContact O-CG 3.44Å; R274-E278 PolarHBondContact O-N 3.22Å; K275-E278 PolarHBondContact O-N 2.89Å; E278-F281 PolarHBondContact O-N 3.14Å; E278-N282 WeakPolarHBondContact O-CB 3.28Å; E278-N282 PolarHBondContact O-N 3.28Å; E278-N282 PolarHBondContact O-ND2 3.48Å |
| 279 | L | 97.1 | Very high | 96.3 | Very high | 106 Ų | 106 | 96 Ų | 96 | 56% | 0.555 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -61.9 | -47.8 | 175.2 | -76.9 | 167.1 | 0 | 0 | 0 | 110.9 | K275 F281 N282 T283 | K275-L279 WeakPolarHBondContact O-CB 3.47Å; K275-L279 VanDerWaalsContact O-CG 3.31Å; K275-L279 WeakPolarHBondContact O-CG 3.49Å; K275-L279 PolarHBondContact O-N 3.49Å; L279-F281 PolarHBondContact O-N 3.01Å; L279-N282 PolarHBondContact O-N 2.95Å; L279-T283 PolarHBondContact O-N 2.87Å; L279-T283 PolarHBondContact O-OG1 3.47Å; L279-T283 VanDerWaalsContact O-OG1 3.07Å |
| 280 | W | 96.9 | Very high | 96.4 | Very high | 147 Ų | 147 | 98.7 Ų | 98.7 | 56% | 0.557 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -58.5 | -47.1 | 177 | -179.5 | 81.4 | 0 | 0 | 0 | 111.7 | D276 V277 N282 T283 Q284 | D276-W280 VanDerWaalsContact O-CB 3.26Å; D276-W280 WeakPolarHBondContact O-CB 3.39Å; D276-W280 PolarHBondContact O-N 3.18Å; V277-W280 PolarHBondContact O-N 3.36Å; W280-N282 PolarHBondContact O-N 2.97Å; W280-T283 PolarHBondContact O-N 3.28Å; W280-Q284 HydrophobicContact CD2-CG 4.07Å; W280-Q284 HydrophobicContact CE3-CG 4.46Å; W280-Q284 HydrophobicContact CH2-CG 4.18Å; W280-Q284 HydrophobicContact CZ2-CG 3.74Å; W280-Q284 WeakPolarHBondContact O-CG 3.33Å; W280-Q284 PolarHBondContact O-N 2.99Å |
| 281 | F | 97.5 | Very high | 96.5 | Very high | 116 Ų | 116 | 100.6 Ų | 100.6 | 51% | 0.509 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.4 | -44.1 | 175.7 | -83.9 | -60.7 | 0 | 0 | 0 | 112.1 | V277 E278 L279 Q284 M285 | V277-F281 HydrophobicContact CG1-CD2 3.48Å; V277-F281 VanDerWaalsContact CG1-CD2 3.48Å; V277-F281 HydrophobicContact CG1-CE2 3.3Å; V277-F281 WeakPolarHBondContact O-CB 3.34Å; V277-F281 WeakPolarHBondContact O-CD2 3.49Å; V277-F281 PolarHBondContact O-N 3.41Å; E278-F281 PolarHBondContact O-N 3.14Å; L279-F281 PolarHBondContact O-N 3.01Å; F281-Q284 PolarHBondContact O-N 3.41Å; F281-M285 WeakPolarHBondContact O-CB 3.33Å; F281-M285 VanDerWaalsContact O-CG 3.25Å; F281-M285 WeakPolarHBondContact O-CG 3.5Å; F281-M285 PolarHBondContact O-N 2.81Å |
| 282 | N | 97.1 | Very high | 96.6 | Very high | 108 Ų | 108 | 101.1 Ų | 101.1 | 58% | 0.578 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -64.2 | -41.5 | 178.3 | -72.8 | -34.3 | 0 | 0 | 0 | 111.8 | E278 L279 W280 M285 E286 | E278-N282 WeakPolarHBondContact O-CB 3.28Å; E278-N282 PolarHBondContact O-N 3.28Å; E278-N282 PolarHBondContact O-ND2 3.48Å; L279-N282 PolarHBondContact O-N 2.95Å; W280-N282 PolarHBondContact O-N 2.97Å; N282-M285 PolarHBondContact O-N 2.75Å; N282-E286 WeakPolarHBondContact O-CB 3.35Å; N282-E286 PolarHBondContact O-N 3.38Å |
| 283 | T | 97.1 | Very high | 96.8 | Very high | 71 Ų | 71 | 102.7 Ų | 102.7 | 44% | 0.436 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.8 | -48.7 | 175.5 | -60.4 | 0 | 0 | 0 | 0 | 111.2 | L279 W280 M285 E286 E287 | L279-T283 PolarHBondContact O-N 2.87Å; L279-T283 PolarHBondContact O-OG1 3.47Å; L279-T283 VanDerWaalsContact O-OG1 3.07Å; W280-T283 PolarHBondContact O-N 3.28Å; T283-M285 VanDerWaalsContact C-N 3.3Å; T283-M285 PolarHBondContact O-N 2.87Å; T283-E286 PolarHBondContact O-N 2.92Å; T283-E287 WeakPolarHBondContact O-CG 3.36Å; T283-E287 PolarHBondContact O-N 3.37Å |
| 284 | Q | 97.3 | Very high | 96.9 | Very high | 80 Ų | 80 | 101.7 Ų | 101.7 | 37% | 0.374 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.1 | -37.9 | 177.3 | -67.8 | -46.6 | 112.3 | 0 | 0 | 112.4 | W280 F281 L288 | W280-Q284 HydrophobicContact CD2-CG 4.07Å; W280-Q284 HydrophobicContact CE3-CG 4.46Å; W280-Q284 HydrophobicContact CH2-CG 4.18Å; W280-Q284 HydrophobicContact CZ2-CG 3.74Å; W280-Q284 WeakPolarHBondContact O-CG 3.33Å; W280-Q284 PolarHBondContact O-N 2.99Å; F281-Q284 PolarHBondContact O-N 3.41Å; Q284-L288 WeakPolarHBondContact O-CB 3.32Å; Q284-L288 PolarHBondContact O-N 3.34Å |
| 285 | M | 96.3 | Very high | 96.8 | Very high | 115 Ų | 115 | 99.9 Ų | 99.9 | 57% | 0.567 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -66 | -42.5 | 176.3 | -78.8 | -62.3 | -56.8 | 0 | 0 | 111.9 | F281 N282 T283 L288 N289 | F281-M285 WeakPolarHBondContact O-CB 3.33Å; F281-M285 VanDerWaalsContact O-CG 3.25Å; F281-M285 WeakPolarHBondContact O-CG 3.5Å; F281-M285 PolarHBondContact O-N 2.81Å; N282-M285 PolarHBondContact O-N 2.75Å; T283-M285 VanDerWaalsContact C-N 3.3Å; T283-M285 PolarHBondContact O-N 2.87Å; M285-L288 PolarHBondContact O-N 2.96Å; M285-N289 WeakPolarHBondContact O-CB 3.5Å; M285-N289 PolarHBondContact O-N 3.43Å |
| 286 | E | 96.9 | Very high | 96.9 | Very high | 125 Ų | 125 | 98.6 Ų | 98.6 | 58% | 0.584 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -65.3 | -43.7 | 177.5 | -171.3 | 61.4 | -152.1 | 0 | 0 | 111.4 | N282 T283 L288 N289 Q290 | N282-E286 WeakPolarHBondContact O-CB 3.35Å; N282-E286 PolarHBondContact O-N 3.38Å; T283-E286 PolarHBondContact O-N 2.92Å; E286-L288 PolarHBondContact O-N 3Å; E286-N289 PolarHBondContact O-N 2.95Å; E286-Q290 WeakPolarHBondContact O-CB 3.47Å; E286-Q290 PolarHBondContact O-N 3.29Å |
| 287 | E | 96.6 | Very high | 96.9 | Very high | 102 Ų | 102 | 99.6 Ų | 99.6 | 48% | 0.477 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -59 | -46.3 | 174.8 | -74.5 | 178.3 | -179.1 | 0 | 0 | 111.8 | T283 N289 Q290 Q291 | T283-E287 WeakPolarHBondContact O-CG 3.36Å; T283-E287 PolarHBondContact O-N 3.37Å; E287-N289 VanDerWaalsContact C-N 3.34Å; E287-N289 PolarHBondContact O-N 3.12Å; E287-Q290 PolarHBondContact O-N 3.08Å; E287-Q291 WeakPolarHBondContact O-CB 3.43Å; E287-Q291 PolarHBondContact O-N 3.46Å |
| 288 | L | 96.8 | Very high | 96.9 | Very high | 95 Ų | 95 | 101.7 Ų | 101.7 | 50% | 0.497 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.1 | -43 | 176.6 | -177.9 | 64.4 | 0 | 0 | 0 | 111.2 | Q284 M285 E286 Q290 Q291 V292 | Q284-L288 WeakPolarHBondContact O-CB 3.32Å; Q284-L288 PolarHBondContact O-N 3.34Å; M285-L288 PolarHBondContact O-N 2.96Å; E286-L288 PolarHBondContact O-N 3Å; L288-Q290 VanDerWaalsContact C-N 3.35Å; L288-Q290 PolarHBondContact O-N 2.9Å; L288-Q291 PolarHBondContact O-N 3.44Å; L288-V292 VanDerWaalsContact O-CG2 3.32Å; L288-V292 WeakPolarHBondContact O-CG2 3.45Å; L288-V292 PolarHBondContact O-N 3.39Å |
| 289 | N | 97.1 | Very high | 96.9 | Very high | 96 Ų | 96 | 103.8 Ų | 103.8 | 51% | 0.513 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.9 | -43.8 | 178 | -128.8 | 2 | 0 | 0 | 0 | 111.1 | M285 E286 E287 Q291 V292 V293 | M285-N289 WeakPolarHBondContact O-CB 3.5Å; M285-N289 PolarHBondContact O-N 3.43Å; E286-N289 PolarHBondContact O-N 2.95Å; E287-N289 VanDerWaalsContact C-N 3.34Å; E287-N289 PolarHBondContact O-N 3.12Å; N289-Q291 VanDerWaalsContact C-N 3.33Å; N289-Q291 PolarHBondContact O-N 3.13Å; N289-V292 PolarHBondContact O-N 2.84Å; N289-V293 WeakPolarHBondContact O-CG2 3.46Å; N289-V293 PolarHBondContact O-N 3.48Å |
| 290 | Q | 97.3 | Very high | 96.8 | Very high | 130 Ų | 130 | 102.4 Ų | 102.4 | 61% | 0.607 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63.2 | -39.6 | 176.7 | -170.8 | 171.7 | 62.5 | 0 | 0 | 111.5 | E286 E287 L288 V293 T294 | E286-Q290 WeakPolarHBondContact O-CB 3.47Å; E286-Q290 PolarHBondContact O-N 3.29Å; E287-Q290 PolarHBondContact O-N 3.08Å; L288-Q290 VanDerWaalsContact C-N 3.35Å; L288-Q290 PolarHBondContact O-N 2.9Å; Q290-V293 PolarHBondContact O-N 3.1Å; Q290-T294 WeakPolarHBondContact O-CB 3.38Å; Q290-T294 PolarHBondContact O-N 3Å; Q290-T294 PolarHBondContact O-OG1 3.33Å |
| 291 | Q | 96.6 | Very high | 96.8 | Very high | 136 Ų | 136 | 98 Ų | 98 | 64% | 0.636 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -64.4 | -43.6 | 174.7 | -170.3 | 179.3 | 12.1 | 0 | 0 | 111.8 | E287 L288 N289 T294 S295 | E287-Q291 WeakPolarHBondContact O-CB 3.43Å; E287-Q291 PolarHBondContact O-N 3.46Å; L288-Q291 PolarHBondContact O-N 3.44Å; N289-Q291 VanDerWaalsContact C-N 3.33Å; N289-Q291 PolarHBondContact O-N 3.13Å; Q291-T294 PolarHBondContact O-N 3.32Å; Q291-S295 VanDerWaalsContact O-CB 3.27Å; Q291-S295 WeakPolarHBondContact O-CB 3.32Å; Q291-S295 PolarHBondContact O-N 2.9Å |
| 292 | V | 97.4 | Very high | 96.6 | Very high | 84 Ų | 84 | 95.9 Ų | 95.9 | 51% | 0.509 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.5 | -44.4 | 176.9 | 169.4 | 0 | 0 | 0 | 0 | 111.1 | L288 N289 S295 S296 | L288-V292 VanDerWaalsContact O-CG2 3.32Å; L288-V292 WeakPolarHBondContact O-CG2 3.45Å; L288-V292 PolarHBondContact O-N 3.39Å; N289-V292 PolarHBondContact O-N 2.84Å; V292-S295 PolarHBondContact O-N 3.44Å; V292-S296 VanDerWaalsContact O-CB 3.26Å; V292-S296 WeakPolarHBondContact O-CB 3.43Å; V292-S296 PolarHBondContact O-N 3.37Å |
| 293 | V | 97.4 | Very high | 96.6 | Very high | 96 Ų | 96 | 95.8 Ų | 95.8 | 58% | 0.582 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -62.3 | -45.2 | 176.6 | 171.7 | 0 | 0 | 0 | 0 | 110.9 | N289 Q290 S296 Q297 | N289-V293 WeakPolarHBondContact O-CG2 3.46Å; N289-V293 PolarHBondContact O-N 3.48Å; Q290-V293 PolarHBondContact O-N 3.1Å; V293-S296 PolarHBondContact O-N 2.87Å; V293-Q297 WeakPolarHBondContact O-CB 3.48Å; V293-Q297 PolarHBondContact O-N 3.48Å |
| 294 | T | 97 | Very high | 96.5 | Very high | 67 Ų | 67 | 98 Ų | 98 | 41% | 0.411 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.7 | -45.4 | 179.2 | -56.1 | 0 | 0 | 0 | 0 | 111.3 | Q290 Q291 Q297 Q298 | Q290-T294 WeakPolarHBondContact O-CB 3.38Å; Q290-T294 PolarHBondContact O-N 3Å; Q290-T294 PolarHBondContact O-OG1 3.33Å; Q291-T294 PolarHBondContact O-N 3.32Å; T294-Q297 PolarHBondContact O-N 2.96Å; T294-Q298 WeakPolarHBondContact O-CG 3.29Å; T294-Q298 PolarHBondContact O-N 3.45Å |
| 295 | S | 95.5 | Very high | 96.4 | Very high | 64 Ų | 64 | 98.3 Ų | 98.3 | 45% | 0.448 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.9 | -44.1 | 177.6 | -179.3 | 0 | 0 | 0 | 0 | 111.8 | Q291 V292 Q297 Q298 Q299 | Q291-S295 VanDerWaalsContact O-CB 3.27Å; Q291-S295 WeakPolarHBondContact O-CB 3.32Å; Q291-S295 PolarHBondContact O-N 2.9Å; V292-S295 PolarHBondContact O-N 3.44Å; S295-Q297 PolarHBondContact O-N 3.19Å; S295-Q298 PolarHBondContact O-N 3.41Å; S295-Q299 WeakPolarHBondContact O-CB 3.35Å; S295-Q299 PolarHBondContact O-N 2.89Å |
| 296 | S | 97 | Very high | 96.4 | Very high | 73 Ų | 73 | 96.8 Ų | 96.8 | 51% | 0.51 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.4 | -43 | 175.8 | -178.3 | 0 | 0 | 0 | 0 | 112 | V292 V293 Q299 H300 | V292-S296 VanDerWaalsContact O-CB 3.26Å; V292-S296 WeakPolarHBondContact O-CB 3.43Å; V292-S296 PolarHBondContact O-N 3.37Å; V293-S296 PolarHBondContact O-N 2.87Å; S296-Q299 PolarHBondContact O-N 2.95Å; S296-H300 WeakPolarHBondContact O-CB 3.46Å; S296-H300 PolarHBondContact O-N 2.95Å |
| 297 | Q | 96.9 | Very high | 96.3 | Very high | 114 Ų | 114 | 94.2 Ų | 94.2 | 53% | 0.533 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.6 | -43.2 | 177 | -175.8 | 66.9 | -3.2 | 0 | 0 | 111.8 | V293 T294 S295 H300 C301 | V293-Q297 WeakPolarHBondContact O-CB 3.48Å; V293-Q297 PolarHBondContact O-N 3.48Å; T294-Q297 PolarHBondContact O-N 2.96Å; S295-Q297 PolarHBondContact O-N 3.19Å; Q297-H300 PolarHBondContact O-N 3.32Å; Q297-C301 PolarHBondContact O-N 3.4Å; Q297-C301 PolarHBondContact O-SG 3.35Å; Q297-C301 VanDerWaalsContact O-SG 3.34Å |
| 298 | Q | 95.9 | Very high | 96.3 | Very high | 119 Ų | 119 | 95 Ų | 95 | 56% | 0.556 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -60.6 | -46.2 | 174.9 | -74.4 | 174.7 | -9.8 | 0 | 0 | 111.4 | T294 S295 H300 C301 C302 | T294-Q298 WeakPolarHBondContact O-CG 3.29Å; T294-Q298 PolarHBondContact O-N 3.45Å; S295-Q298 PolarHBondContact O-N 3.41Å; Q298-H300 VanDerWaalsContact C-N 3.29Å; Q298-H300 PolarHBondContact O-N 2.96Å; Q298-C301 WeakPolarHBondContact O-CB 3.4Å; Q298-C301 PolarHBondContact O-N 2.87Å; Q298-C302 PolarHBondContact O-N 2.93Å; Q298-C302 PolarHBondContact O-SG 2.9Å |
| 299 | Q | 96.2 | Very high | 96 | Very high | 135 Ų | 135 | 96.1 Ų | 96.1 | 63% | 0.631 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -58.6 | -42.2 | 176.7 | -177.9 | 179.2 | -23.3 | 0 | 0 | 111.6 | S295 S296 C302 Q303 | S295-Q299 WeakPolarHBondContact O-CB 3.35Å; S295-Q299 PolarHBondContact O-N 2.89Å; S296-Q299 PolarHBondContact O-N 2.95Å; Q299-C302 PolarHBondContact O-N 3.36Å; Q299-Q303 WeakPolarHBondContact O-CB 3.44Å; Q299-Q303 PolarHBondContact O-N 3.14Å |
| 300 | H | 96.9 | Very high | 95.9 | Very high | 77 Ų | 77 | 99.4 Ų | 99.4 | 36% | 0.356 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67.8 | -37.2 | 177.5 | -178.4 | -116.1 | 0 | 0 | 0 | 112.7 | S296 Q297 Q298 Q303 K304 | S296-H300 WeakPolarHBondContact O-CB 3.46Å; S296-H300 PolarHBondContact O-N 2.95Å; Q297-H300 PolarHBondContact O-N 3.32Å; Q298-H300 VanDerWaalsContact C-N 3.29Å; Q298-H300 PolarHBondContact O-N 2.96Å; H300-Q303 PolarHBondContact O-N 2.84Å; H300-K304 WeakPolarHBondContact CE1-CE 3.43Å; H300-K304 PolarHBondContact CE1-NZ 2.99Å; H300-K304 VanDerWaalsContact CE1-NZ 3.35Å; H300-K304 WeakPolarHBondContact O-CG 3.46Å; H300-K304 PolarHBondContact O-N 3.44Å |
| 301 | C | 95.7 | Very high | 95.7 | Very high | 54 Ų | 54 | 101.4 Ų | 101.4 | 37% | 0.365 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.2 | -51.6 | 171.1 | -70.2 | 0 | 0 | 0 | 0 | 111.1 | Q297 Q298 Q303 K304 D305 | Q297-C301 PolarHBondContact O-N 3.4Å; Q297-C301 PolarHBondContact O-SG 3.35Å; Q297-C301 VanDerWaalsContact O-SG 3.34Å; Q298-C301 WeakPolarHBondContact O-CB 3.4Å; Q298-C301 PolarHBondContact O-N 2.87Å; C301-Q303 PolarHBondContact O-N 3.46Å; C301-K304 WeakPolarHBondContact O-CB 3.49Å; C301-K304 PolarHBondContact O-N 3.14Å; C301-D305 VanDerWaalsContact O-CG 3.32Å; C301-D305 PolarHBondContact O-N 3.12Å |
| 302 | C | 94.4 | Very high | 95.3 | Very high | 72 Ų | 72 | 98 Ų | 98 | 49% | 0.486 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -58.1 | -38.3 | 176.9 | -63.3 | 0 | 0 | 0 | 0 | 112.1 | Q298 Q299 D305 I306 | Q298-C302 PolarHBondContact O-N 2.93Å; Q298-C302 PolarHBondContact O-SG 2.9Å; Q299-C302 PolarHBondContact O-N 3.36Å; C302-D305 PolarHBondContact O-N 3.35Å; C302-I306 VanDerWaalsContact O-CG1 3.24Å; C302-I306 WeakPolarHBondContact O-CG1 3.44Å; C302-I306 PolarHBondContact O-N 2.93Å |
| 303 | Q | 97.2 | Very high | 95.1 | Very high | 106 Ų | 106 | 100.9 Ų | 100.9 | 50% | 0.495 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.3 | -40.6 | 176.5 | -173.6 | 176.6 | 7.4 | 0 | 0 | 112.3 | Q299 H300 C301 I306 I307 | Q299-Q303 WeakPolarHBondContact O-CB 3.44Å; Q299-Q303 PolarHBondContact O-N 3.14Å; H300-Q303 PolarHBondContact O-N 2.84Å; C301-Q303 PolarHBondContact O-N 3.46Å; Q303-I306 PolarHBondContact O-N 2.92Å; Q303-I307 HydrophobicContact CG-CD1 4.27Å; Q303-I307 VanDerWaalsContact O-CG1 3.3Å; Q303-I307 WeakPolarHBondContact O-CG1 3.5Å; Q303-I307 PolarHBondContact O-N 3.25Å; Q303-I307 VanDerWaalsContact O-N 3.12Å |
| 304 | K | 95 | Very high | 94.7 | Very high | 117 Ų | 117 | 100.1 Ų | 100.1 | 51% | 0.509 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63.3 | -45.8 | 174.5 | -76.8 | 175.5 | 170.6 | 174.8 | 0 | 111.5 | H300 C301 I306 I307 E308 | H300-K304 WeakPolarHBondContact CE1-CE 3.43Å; H300-K304 PolarHBondContact CE1-NZ 2.99Å; H300-K304 VanDerWaalsContact CE1-NZ 3.35Å; H300-K304 WeakPolarHBondContact O-CG 3.46Å; H300-K304 PolarHBondContact O-N 3.44Å; C301-K304 WeakPolarHBondContact O-CB 3.49Å; C301-K304 PolarHBondContact O-N 3.14Å; K304-I306 VanDerWaalsContact C-N 3.31Å; K304-I306 PolarHBondContact O-N 3.44Å; K304-I307 WeakPolarHBondContact O-CB 3.27Å; K304-I307 PolarHBondContact O-N 2.86Å; K304-E308 PolarHBondContact O-N 2.95Å |
| 305 | D | 93.8 | Very high | 94.3 | Very high | 88 Ų | 88 | 99.9 Ų | 99.9 | 47% | 0.471 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.5 | -42.5 | 178.9 | -61.3 | -14.6 | 0 | 0 | 0 | 110.9 | C301 C302 I307 E308 L309 | C301-D305 VanDerWaalsContact O-CG 3.32Å; C301-D305 PolarHBondContact O-N 3.12Å; C302-D305 PolarHBondContact O-N 3.35Å; D305-I307 VanDerWaalsContact C-N 3.32Å; D305-I307 PolarHBondContact O-N 3.3Å; D305-E308 PolarHBondContact O-N 3.2Å; D305-L309 WeakPolarHBondContact O-CB 3.42Å; D305-L309 VanDerWaalsContact O-CG 3.26Å; D305-L309 WeakPolarHBondContact O-CG 3.28Å; D305-L309 PolarHBondContact O-N 3.35Å |
| 306 | I | 96.2 | Very high | 93.7 | Very high | 83 Ų | 83 | 102.8 Ų | 102.8 | 43% | 0.426 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -59.9 | -42.3 | 174.6 | -70.5 | 165.3 | 0 | 0 | 0 | 111.3 | C302 Q303 K304 R310 | C302-I306 VanDerWaalsContact O-CG1 3.24Å; C302-I306 WeakPolarHBondContact O-CG1 3.44Å; C302-I306 PolarHBondContact O-N 2.93Å; Q303-I306 PolarHBondContact O-N 2.92Å; K304-I306 VanDerWaalsContact C-N 3.31Å; K304-I306 PolarHBondContact O-N 3.44Å; I306-R310 WeakPolarHBondContact O-CB 3.46Å; I306-R310 VanDerWaalsContact O-CG 3.24Å; I306-R310 WeakPolarHBondContact O-CG 3.46Å; I306-R310 PolarHBondContact O-N 3.31Å |
| 307 | I | 96.4 | Very high | 93.2 | Very high | 70 Ų | 70 | 103.1 Ų | 103.1 | 36% | 0.359 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67.3 | -42.3 | 179.1 | -68.8 | 165.2 | 0 | 0 | 0 | 110.5 | Q303 K304 D305 R310 R311 | Q303-I307 HydrophobicContact CG-CD1 4.27Å; Q303-I307 VanDerWaalsContact O-CG1 3.3Å; Q303-I307 WeakPolarHBondContact O-CG1 3.5Å; Q303-I307 PolarHBondContact O-N 3.25Å; Q303-I307 VanDerWaalsContact O-N 3.12Å; K304-I307 WeakPolarHBondContact O-CB 3.27Å; K304-I307 PolarHBondContact O-N 2.86Å; D305-I307 VanDerWaalsContact C-N 3.32Å; D305-I307 PolarHBondContact O-N 3.3Å; I307-R310 PolarHBondContact O-N 2.89Å; I307-R311 WeakPolarHBondContact O-CG 3.26Å; I307-R311 PolarHBondContact O-N 2.82Å |
| 308 | E | 95 | Very high | 93 | Very high | 120 Ų | 120 | 102.2 Ų | 102.2 | 56% | 0.561 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -64.8 | -47 | 177.9 | -172.5 | 166.1 | -173.9 | 0 | 0 | 111.6 | K304 D305 R310 R311 T312 | K304-E308 PolarHBondContact O-N 2.95Å; D305-E308 PolarHBondContact O-N 3.2Å; E308-R310 VanDerWaalsContact C-N 3.3Å; E308-R310 PolarHBondContact O-N 2.92Å; E308-R311 WeakPolarHBondContact O-CA 3.06Å; E308-R311 WeakPolarHBondContact O-CB 3.49Å; E308-R311 PolarHBondContact O-N 3.39Å; E308-T312 WeakPolarHBondContact O-CG2 3.44Å; E308-T312 PolarHBondContact O-N 3.49Å; E308-T312 PolarHBondContact O-OG1 3.08Å |
| 309 | L | 90.6 | Very high | 92.7 | Very high | 117 Ų | 117 | 101.3 Ų | 101.3 | 61% | 0.613 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -59.7 | -38.3 | 174.8 | -72.1 | 172.8 | 0 | 0 | 0 | 112.5 | D305 T312 R313 | D305-L309 WeakPolarHBondContact O-CB 3.42Å; D305-L309 VanDerWaalsContact O-CG 3.26Å; D305-L309 WeakPolarHBondContact O-CG 3.28Å; D305-L309 PolarHBondContact O-N 3.35Å; L309-T312 WeakPolarHBondContact CA-OG1 3.36Å; L309-T312 PolarHBondContact O-OG1 3.02Å; L309-R313 VanDerWaalsContact O-CB 3.27Å; L309-R313 WeakPolarHBondContact O-CB 3.35Å; L309-R313 PolarHBondContact O-N 2.89Å |
| 310 | R | 94.5 | Very high | 92 | Very high | 165 Ų | 165 | 99.6 Ų | 99.6 | 62% | 0.623 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -66 | -38.7 | 173.7 | -75.7 | 173.9 | -177 | -176 | 2.9 | 111.9 | I306 I307 E308 N314 | I306-R310 WeakPolarHBondContact O-CB 3.46Å; I306-R310 VanDerWaalsContact O-CG 3.24Å; I306-R310 WeakPolarHBondContact O-CG 3.46Å; I306-R310 PolarHBondContact O-N 3.31Å; I307-R310 PolarHBondContact O-N 2.89Å; E308-R310 VanDerWaalsContact C-N 3.3Å; E308-R310 PolarHBondContact O-N 2.92Å; R310-N314 WeakPolarHBondContact O-CB 3.38Å; R310-N314 PolarHBondContact O-N 3Å; R310-N314 PolarHBondContact O-ND2 2.86Å |
| 311 | R | 93.6 | Very high | 91.6 | Very high | 173 Ų | 173 | 100.9 Ų | 100.9 | 65% | 0.653 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -65.7 | -45.7 | 176.2 | -73.5 | 172.8 | -178.1 | 159.5 | 0.8 | 111.4 | I307 E308 N314 A315 | I307-R311 WeakPolarHBondContact O-CG 3.26Å; I307-R311 PolarHBondContact O-N 2.82Å; E308-R311 WeakPolarHBondContact O-CA 3.06Å; E308-R311 WeakPolarHBondContact O-CB 3.49Å; E308-R311 PolarHBondContact O-N 3.39Å; R311-N314 PolarHBondContact O-N 3.49Å; R311-A315 WeakPolarHBondContact O-CB 3.42Å; R311-A315 PolarHBondContact O-N 2.98Å |
| 312 | T | 88.9 | Confident | 91.1 | Very high | 65 Ų | 65 | 100.3 Ų | 100.3 | 40% | 0.399 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.7 | -43.5 | 178.1 | 58.4 | 0 | 0 | 0 | 0 | 111.1 | E308 L309 N314 A315 L316 | E308-T312 WeakPolarHBondContact O-CG2 3.44Å; E308-T312 PolarHBondContact O-N 3.49Å; E308-T312 PolarHBondContact O-OG1 3.08Å; L309-T312 WeakPolarHBondContact CA-OG1 3.36Å; L309-T312 PolarHBondContact O-OG1 3.02Å; T312-N314 PolarHBondContact O-N 3.22Å; T312-A315 PolarHBondContact O-N 3.46Å; T312-L316 WeakPolarHBondContact O-CB 3.23Å; T312-L316 WeakPolarHBondContact O-CG 3.34Å; T312-L316 PolarHBondContact O-N 3.26Å |
| 313 | R | 93.2 | Very high | 90.6 | Very high | 143 Ų | 143 | 102.1 Ų | 102.1 | 54% | 0.54 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -55.3 | -50.5 | 174 | -166.8 | -154.2 | 101.2 | 174.6 | 9.7 | 111.7 | L309 A315 L316 E317 | L309-R313 VanDerWaalsContact O-CB 3.27Å; L309-R313 WeakPolarHBondContact O-CB 3.35Å; L309-R313 PolarHBondContact O-N 2.89Å; R313-A315 VanDerWaalsContact C-N 3.34Å; R313-A315 PolarHBondContact O-N 3.21Å; R313-L316 PolarHBondContact O-N 3.02Å; R313-E317 IonicContact CZ-OE1 3.42Å; R313-E317 IonicContact CZ-OE2 2.67Å; R313-E317 VanDerWaalsContact NE-CD 3.34Å; R313-E317 IonicContact NE-OE1 2.73Å; R313-E317 PolarHBondContact NE-OE1 3.33Å; R313-E317 IonicContact NE-OE2 2.92Å; R313-E317 PolarHBondContact NE-OE2 2.85Å; R313-E317 IonicContact NH2-OE1 3.27Å; R313-E317 PolarHBondContact NH2-OE1 3.35Å; R313-E317 IonicContact NH2-OE2 3.82Å; R313-E317 PolarHBondContact NH2-OE2 3Å; R313-E317 WeakPolarHBondContact O-CG 3.37Å; R313-E317 PolarHBondContact O-N 3.46Å |
| 314 | N | 89.1 | Confident | 90 | Very high | 81 Ų | 81 | 100.8 Ų | 100.8 | 43% | 0.433 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.9 | -38.6 | -179.9 | -69.4 | -13.2 | 0 | 0 | 0 | 111.8 | R310 R311 T312 E317 V318 | R310-N314 WeakPolarHBondContact O-CB 3.38Å; R310-N314 PolarHBondContact O-N 3Å; R310-N314 PolarHBondContact O-ND2 2.86Å; R311-N314 PolarHBondContact O-N 3.49Å; T312-N314 PolarHBondContact O-N 3.22Å; N314-E317 PolarHBondContact O-N 3.25Å; N314-V318 WeakPolarHBondContact O-CG2 3.49Å; N314-V318 PolarHBondContact O-N 3.45Å |
| 315 | A | 88.1 | Confident | 89.7 | Confident | 62 Ų | 62 | 103.6 Ų | 103.6 | 51% | 0.512 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.6 | -44.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | R311 T312 R313 V318 E319 | R311-A315 WeakPolarHBondContact O-CB 3.42Å; R311-A315 PolarHBondContact O-N 2.98Å; T312-A315 PolarHBondContact O-N 3.46Å; R313-A315 VanDerWaalsContact C-N 3.34Å; R313-A315 PolarHBondContact O-N 3.21Å; A315-V318 PolarHBondContact O-N 3.41Å; A315-E319 PolarHBondContact O-N 3.43Å |
| 316 | L | 82.8 | Confident | 89.3 | Confident | 125 Ų | 125 | 104.2 Ų | 104.2 | 65% | 0.654 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -65 | -37.8 | 175.6 | -69.5 | 173.4 | 0 | 0 | 0 | 112.2 | T312 R313 E319 L320 | T312-L316 WeakPolarHBondContact O-CB 3.23Å; T312-L316 WeakPolarHBondContact O-CG 3.34Å; T312-L316 PolarHBondContact O-N 3.26Å; R313-L316 PolarHBondContact O-N 3.02Å; L316-E319 PolarHBondContact O-N 3.31Å; L316-L320 VanDerWaalsContact O-CB 3.31Å; L316-L320 WeakPolarHBondContact O-CB 3.44Å; L316-L320 PolarHBondContact O-N 2.93Å |
| 317 | E | 87.9 | Confident | 89.1 | Confident | 79 Ų | 79 | 105.2 Ų | 105.2 | 37% | 0.369 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.9 | -41.2 | 174.2 | -77.8 | 174.6 | 173.2 | 0 | 0 | 112.1 | R313 N314 Q321 | R313-E317 IonicContact CZ-OE1 3.42Å; R313-E317 IonicContact CZ-OE2 2.67Å; R313-E317 VanDerWaalsContact NE-CD 3.34Å; R313-E317 IonicContact NE-OE1 2.73Å; R313-E317 PolarHBondContact NE-OE1 3.33Å; R313-E317 IonicContact NE-OE2 2.92Å; R313-E317 PolarHBondContact NE-OE2 2.85Å; R313-E317 IonicContact NH2-OE1 3.27Å; R313-E317 PolarHBondContact NH2-OE1 3.35Å; R313-E317 IonicContact NH2-OE2 3.82Å; R313-E317 PolarHBondContact NH2-OE2 3Å; R313-E317 WeakPolarHBondContact O-CG 3.37Å; R313-E317 PolarHBondContact O-N 3.46Å; N314-E317 PolarHBondContact O-N 3.25Å; E317-Q321 WeakPolarHBondContact O-CG 3.45Å; E317-Q321 PolarHBondContact O-N 2.98Å |
| 318 | V | 92.1 | Very high | 88.7 | Confident | 96 Ų | 96 | 105.6 Ų | 105.6 | 58% | 0.582 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -66.3 | -43.6 | 175.7 | 173.8 | 0 | 0 | 0 | 0 | 111.1 | N314 A315 L320 Q321 A322 | N314-V318 WeakPolarHBondContact O-CG2 3.49Å; N314-V318 PolarHBondContact O-N 3.45Å; A315-V318 PolarHBondContact O-N 3.41Å; V318-L320 VanDerWaalsContact C-N 3.35Å; V318-L320 PolarHBondContact O-N 3.43Å; V318-Q321 PolarHBondContact O-N 2.64Å; V318-A322 PolarHBondContact O-N 2.92Å |
| 319 | E | 88.3 | Confident | 88.5 | Confident | 99 Ų | 99 | 102.3 Ų | 102.3 | 46% | 0.463 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.4 | -45.2 | 177.2 | -172.3 | 57.3 | -142 | 0 | 0 | 110.8 | A315 L316 Q321 A322 Q323 | A315-E319 PolarHBondContact O-N 3.43Å; L316-E319 PolarHBondContact O-N 3.31Å; E319-Q321 VanDerWaalsContact C-N 3.31Å; E319-Q321 PolarHBondContact O-N 3.3Å; E319-A322 WeakPolarHBondContact O-CB 3.39Å; E319-A322 PolarHBondContact O-N 3.36Å; E319-Q323 WeakPolarHBondContact O-CG 3.35Å; E319-Q323 PolarHBondContact O-N 3.33Å; E319-Q323 PolarHBondContact OE1-NE2 2.84Å |
| 320 | L | 82.8 | Confident | 88.4 | Confident | 100 Ų | 100 | 102.3 Ų | 102.3 | 52% | 0.524 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -58.3 | -42.8 | 175.6 | -179.7 | 142.8 | 0 | 0 | 0 | 111.9 | L316 V318 Q323 H324 | L316-L320 VanDerWaalsContact O-CB 3.31Å; L316-L320 WeakPolarHBondContact O-CB 3.44Å; L316-L320 PolarHBondContact O-N 2.93Å; V318-L320 VanDerWaalsContact C-N 3.35Å; V318-L320 PolarHBondContact O-N 3.43Å; L320-Q323 PolarHBondContact O-N 2.9Å; L320-H324 VanDerWaalsContact CD2-CD2 3.47Å; L320-H324 WeakPolarHBondContact CD2-CD2 3.48Å; L320-H324 PolarHBondContact O-CD2 3.48Å; L320-H324 VanDerWaalsContact O-CD2 3.29Å; L320-H324 PolarHBondContact O-N 3.22Å |
| 321 | Q | 88.7 | Confident | 88.2 | Confident | 103 Ų | 103 | 99.3 Ų | 99.3 | 48% | 0.481 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -65.1 | -37.7 | 174.4 | -72.4 | 178.9 | 12.1 | 0 | 0 | 112.6 | E317 V318 E319 H324 R325 | E317-Q321 WeakPolarHBondContact O-CG 3.45Å; E317-Q321 PolarHBondContact O-N 2.98Å; V318-Q321 PolarHBondContact O-N 2.64Å; E319-Q321 VanDerWaalsContact C-N 3.31Å; E319-Q321 PolarHBondContact O-N 3.3Å; Q321-H324 PolarHBondContact O-N 2.86Å; Q321-R325 WeakPolarHBondContact O-CG 3.45Å; Q321-R325 PolarHBondContact O-N 2.83Å |
| 322 | A | 84.5 | Confident | 88.1 | Confident | 43 Ų | 43 | 94.7 Ų | 94.7 | 36% | 0.355 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -64.7 | -42.9 | 176 | 0 | 0 | 0 | 0 | 0 | 111.4 | V318 E319 R325 M326 | V318-A322 PolarHBondContact O-N 2.92Å; E319-A322 WeakPolarHBondContact O-CB 3.39Å; E319-A322 PolarHBondContact O-N 3.36Å; A322-R325 PolarHBondContact O-N 3.49Å; A322-M326 PolarHBondContact O-N 3.48Å |
| 323 | Q | 82.9 | Confident | 88.2 | Confident | 109 Ų | 109 | 96.4 Ų | 96.4 | 51% | 0.509 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.8 | -41.5 | 175.8 | -65.4 | -56.5 | -31.6 | 0 | 0 | 112.1 | E319 L320 M326 R327 | E319-Q323 WeakPolarHBondContact O-CG 3.35Å; E319-Q323 PolarHBondContact O-N 3.33Å; E319-Q323 PolarHBondContact OE1-NE2 2.84Å; L320-Q323 PolarHBondContact O-N 2.9Å; Q323-M326 PolarHBondContact O-N 3.31Å; Q323-R327 PolarHBondContact O-N 2.85Å |
| 324 | H | 85.4 | Confident | 88 | Confident | 78 Ų | 78 | 93.8 Ų | 93.8 | 36% | 0.361 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -60.1 | -46.3 | 173.1 | -77.2 | -44.5 | 0 | 0 | 0 | 112.4 | L320 Q321 M326 R327 D328 | L320-H324 VanDerWaalsContact CD2-CD2 3.47Å; L320-H324 WeakPolarHBondContact CD2-CD2 3.48Å; L320-H324 PolarHBondContact O-CD2 3.48Å; L320-H324 VanDerWaalsContact O-CD2 3.29Å; L320-H324 PolarHBondContact O-N 3.22Å; Q321-H324 PolarHBondContact O-N 2.86Å; H324-M326 VanDerWaalsContact C-N 3.3Å; H324-M326 PolarHBondContact O-N 2.8Å; H324-R327 PolarHBondContact ND1-NH1 3.32Å; H324-R327 PolarHBondContact ND1-NH2 2.86Å; H324-R327 PolarHBondContact O-N 3.14Å; H324-D328 PolarHBondContact O-N 3.23Å |
| 325 | R | 89.3 | Confident | 88.2 | Confident | 177 Ų | 177 | 93.7 Ų | 93.7 | 67% | 0.668 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -61.7 | -38.6 | 176.4 | -70.3 | 175.6 | -173.2 | 171.3 | 5.7 | 112.4 | Q321 A322 S329 | Q321-R325 WeakPolarHBondContact O-CG 3.45Å; Q321-R325 PolarHBondContact O-N 2.83Å; A322-R325 PolarHBondContact O-N 3.49Å; R325-S329 WeakPolarHBondContact O-CB 3.47Å; R325-S329 PolarHBondContact O-N 3.4Å; R325-S329 PolarHBondContact O-OG 3.3Å |
| 326 | M | 85.5 | Confident | 88.6 | Confident | 100 Ų | 100 | 95.1 Ų | 95.1 | 49% | 0.493 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62.3 | -51 | 175.9 | -177.2 | 63.3 | 74.3 | 0 | 0 | 110.7 | A322 Q323 H324 D328 S329 Q330 | A322-M326 PolarHBondContact O-N 3.48Å; Q323-M326 PolarHBondContact O-N 3.31Å; H324-M326 VanDerWaalsContact C-N 3.3Å; H324-M326 PolarHBondContact O-N 2.8Å; M326-D328 PolarHBondContact O-N 3.36Å; M326-S329 PolarHBondContact O-N 3.12Å; M326-S329 PolarHBondContact O-OG 3.46Å; M326-Q330 WeakPolarHBondContact O-CG 3.38Å; M326-Q330 PolarHBondContact O-N 3.44Å; M326-Q330 HydrophobicContact SD-CG 4.49Å |
| 327 | R | 90.9 | Very high | 88.9 | Confident | 105 Ų | 105 | 91.8 Ų | 91.8 | 40% | 0.396 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -55 | -51.5 | 175.8 | 179.7 | -156.8 | 60.9 | -149.5 | -5.9 | 111.3 | Q323 H324 S329 Q330 E331 | Q323-R327 PolarHBondContact O-N 2.85Å; H324-R327 PolarHBondContact ND1-NH1 3.32Å; H324-R327 PolarHBondContact ND1-NH2 2.86Å; H324-R327 PolarHBondContact O-N 3.14Å; R327-S329 VanDerWaalsContact C-N 3.25Å; R327-S329 PolarHBondContact O-N 2.92Å; R327-Q330 PolarHBondContact O-N 2.94Å; R327-E331 WeakPolarHBondContact CD-OE1 3.4Å; R327-E331 HydrophobicContact CG-CG 4.37Å; R327-E331 WeakPolarHBondContact CG-OE1 3.41Å; R327-E331 IonicContact NE-OE1 3.06Å; R327-E331 WeakPolarHBondContact O-CG 3.34Å; R327-E331 PolarHBondContact O-N 3.23Å |
| 328 | D | 89.1 | Confident | 89.2 | Confident | 77 Ų | 77 | 93.2 Ų | 93.2 | 41% | 0.412 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -60.2 | -37.9 | -178.3 | -62 | -11 | 0 | 0 | 0 | 111.3 | H324 M326 C332 | H324-D328 PolarHBondContact O-N 3.23Å; M326-D328 PolarHBondContact O-N 3.36Å; D328-C332 WeakPolarHBondContact O-CB 2.84Å; D328-C332 PolarHBondContact O-N 3.02Å |
| 329 | S | 90.7 | Very high | 89.3 | Confident | 51 Ų | 51 | 91 Ų | 91 | 36% | 0.357 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -66.8 | -38.7 | 175.6 | 77.4 | 0 | 0 | 0 | 0 | 112.7 | R325 M326 R327 C332 I333 | R325-S329 WeakPolarHBondContact O-CB 3.47Å; R325-S329 PolarHBondContact O-N 3.4Å; R325-S329 PolarHBondContact O-OG 3.3Å; M326-S329 PolarHBondContact O-N 3.12Å; M326-S329 PolarHBondContact O-OG 3.46Å; R327-S329 VanDerWaalsContact C-N 3.25Å; R327-S329 PolarHBondContact O-N 2.92Å; S329-C332 PolarHBondContact O-N 3.44Å; S329-I333 VanDerWaalsContact O-CG1 3.31Å; S329-I333 WeakPolarHBondContact O-CG1 3.28Å; S329-I333 PolarHBondContact O-N 2.96Å |
| 330 | Q | 88.5 | Confident | 89.8 | Confident | 117 Ų | 117 | 93.8 Ų | 93.8 | 55% | 0.547 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -69.9 | -41.6 | 177.8 | -71.3 | 175 | -18.3 | 0 | 0 | 111.5 | M326 R327 C332 I333 L334 | M326-Q330 WeakPolarHBondContact O-CG 3.38Å; M326-Q330 PolarHBondContact O-N 3.44Å; M326-Q330 HydrophobicContact SD-CG 4.49Å; R327-Q330 PolarHBondContact O-N 2.94Å; Q330-C332 VanDerWaalsContact C-N 3.33Å; Q330-C332 PolarHBondContact O-N 3.46Å; Q330-I333 PolarHBondContact O-N 2.91Å; Q330-L334 WeakPolarHBondContact O-CB 3.25Å; Q330-L334 PolarHBondContact O-N 3.47Å |
| 331 | E | 90.5 | Very high | 90.3 | Very high | 102 Ų | 102 | 96.4 Ų | 96.4 | 48% | 0.477 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -61.5 | -41.3 | 173.1 | -72.5 | 175.7 | -175.4 | 0 | 0 | 111.3 | R327 L334 T335 | R327-E331 WeakPolarHBondContact CD-OE1 3.4Å; R327-E331 HydrophobicContact CG-CG 4.37Å; R327-E331 WeakPolarHBondContact CG-OE1 3.41Å; R327-E331 IonicContact NE-OE1 3.06Å; R327-E331 WeakPolarHBondContact O-CG 3.34Å; R327-E331 PolarHBondContact O-N 3.23Å; E331-L334 PolarHBondContact O-N 2.93Å; E331-T335 WeakPolarHBondContact O-CB 3.45Å; E331-T335 VanDerWaalsContact O-CG2 3.31Å; E331-T335 WeakPolarHBondContact O-CG2 3.36Å; E331-T335 PolarHBondContact O-N 2.9Å; E331-T335 PolarHBondContact O-OG1 3.07Å |
| 332 | C | 91.9 | Very high | 90.8 | Very high | 76 Ų | 76 | 95.5 Ų | 95.5 | 51% | 0.514 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -62.4 | -43.6 | 174.7 | -171.4 | 0 | 0 | 0 | 0 | 112.1 | D328 S329 Q330 T335 E336 | D328-C332 WeakPolarHBondContact O-CB 2.84Å; D328-C332 PolarHBondContact O-N 3.02Å; S329-C332 PolarHBondContact O-N 3.44Å; Q330-C332 VanDerWaalsContact C-N 3.33Å; Q330-C332 PolarHBondContact O-N 3.46Å; C332-T335 WeakPolarHBondContact CA-OG1 3.43Å; C332-T335 PolarHBondContact O-OG1 3.13Å; C332-E336 VanDerWaalsContact O-CB 3.31Å; C332-E336 WeakPolarHBondContact O-CB 3.07Å; C332-E336 PolarHBondContact O-N 3.14Å |
| 333 | I | 90.5 | Very high | 91.4 | Very high | 101 Ų | 101 | 97.1 Ų | 97.1 | 52% | 0.518 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -65.2 | -43.1 | 176.9 | -68.7 | 165.1 | 0 | 0 | 0 | 110.2 | S329 Q330 E336 T337 | S329-I333 VanDerWaalsContact O-CG1 3.31Å; S329-I333 WeakPolarHBondContact O-CG1 3.28Å; S329-I333 PolarHBondContact O-N 2.96Å; Q330-I333 PolarHBondContact O-N 2.91Å; I333-E336 PolarHBondContact O-N 2.95Å; I333-T337 HydrophobicContact CG2-CG2 4.27Å; I333-T337 VanDerWaalsContact O-CG2 3.25Å; I333-T337 WeakPolarHBondContact O-CG2 3.27Å; I333-T337 PolarHBondContact O-N 3.26Å; I333-T337 PolarHBondContact O-OG1 3.01Å |
| 334 | L | 89.6 | Confident | 92.1 | Very high | 89 Ų | 89 | 95.9 Ų | 95.9 | 47% | 0.466 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -59.2 | -54.3 | 178.6 | -178.3 | 144.4 | 0 | 0 | 0 | 110.7 | Q330 E331 E336 T337 E338 | Q330-L334 WeakPolarHBondContact O-CB 3.25Å; Q330-L334 PolarHBondContact O-N 3.47Å; E331-L334 PolarHBondContact O-N 2.93Å; L334-E336 VanDerWaalsContact C-N 3.31Å; L334-E336 PolarHBondContact O-N 3.32Å; L334-T337 PolarHBondContact O-N 3.35Å; L334-T337 VanDerWaalsContact O-N 3.1Å; L334-T337 PolarHBondContact O-OG1 3.49Å; L334-E338 VanDerWaalsContact CD2-CD 3.45Å; L334-E338 HydrophobicContact CD2-CG 4.31Å; L334-E338 WeakPolarHBondContact CD2-OE1 3.44Å; L334-E338 WeakPolarHBondContact O-CG 3.39Å; L334-E338 PolarHBondContact O-N 3.4Å |
| 335 | T | 93 | Very high | 92.7 | Very high | 78 Ų | 78 | 96.9 Ų | 96.9 | 48% | 0.479 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60 | -39 | 178.6 | 52.8 | 0 | 0 | 0 | 0 | 112.4 | E331 C332 A339 | E331-T335 WeakPolarHBondContact O-CB 3.45Å; E331-T335 VanDerWaalsContact O-CG2 3.31Å; E331-T335 WeakPolarHBondContact O-CG2 3.36Å; E331-T335 PolarHBondContact O-N 2.9Å; E331-T335 PolarHBondContact O-OG1 3.07Å; C332-T335 WeakPolarHBondContact CA-OG1 3.43Å; C332-T335 PolarHBondContact O-OG1 3.13Å; T335-A339 VanDerWaalsContact O-CB 3.31Å; T335-A339 WeakPolarHBondContact O-CB 3.45Å; T335-A339 PolarHBondContact O-N 2.86Å |
| 336 | E | 94.9 | Very high | 93.1 | Very high | 93 Ų | 93 | 91.6 Ų | 91.6 | 44% | 0.435 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -64.6 | -43.4 | 175 | -175 | 178.4 | -172.3 | 0 | 0 | 111.7 | C332 I333 L334 A339 R340 | C332-E336 VanDerWaalsContact O-CB 3.31Å; C332-E336 WeakPolarHBondContact O-CB 3.07Å; C332-E336 PolarHBondContact O-N 3.14Å; I333-E336 PolarHBondContact O-N 2.95Å; L334-E336 VanDerWaalsContact C-N 3.31Å; L334-E336 PolarHBondContact O-N 3.32Å; E336-A339 PolarHBondContact O-N 3.44Å; E336-R340 VanDerWaalsContact O-CG 3.29Å; E336-R340 WeakPolarHBondContact O-CG 3.33Å; E336-R340 PolarHBondContact O-N 2.87Å; E336-R340 IonicContact OE1-CZ 2.76Å; E336-R340 IonicContact OE1-NE 2.81Å; E336-R340 PolarHBondContact OE1-NE 2.88Å; E336-R340 IonicContact OE1-NH2 3.12Å; E336-R340 PolarHBondContact OE1-NH2 2.85Å |
| 337 | T | 90.6 | Very high | 93.7 | Very high | 55 Ų | 55 | 93 Ų | 93 | 34% | 0.337 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -66 | -42.4 | 178 | 59.9 | 0 | 0 | 0 | 0 | 111.9 | I333 L334 R340 Y341 | I333-T337 HydrophobicContact CG2-CG2 4.27Å; I333-T337 VanDerWaalsContact O-CG2 3.25Å; I333-T337 WeakPolarHBondContact O-CG2 3.27Å; I333-T337 PolarHBondContact O-N 3.26Å; I333-T337 PolarHBondContact O-OG1 3.01Å; L334-T337 PolarHBondContact O-N 3.35Å; L334-T337 VanDerWaalsContact O-N 3.1Å; L334-T337 PolarHBondContact O-OG1 3.49Å; T337-R340 PolarHBondContact O-N 3.42Å; T337-Y341 WeakPolarHBondContact O-CD2 3.46Å; T337-Y341 PolarHBondContact O-N 3.31Å |
| 338 | E | 94.4 | Very high | 94.1 | Very high | 108 Ų | 108 | 92 Ų | 92 | 51% | 0.505 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.8 | -45 | 174.5 | -71.2 | 179.6 | 160.8 | 0 | 0 | 111.4 | L334 R340 Y341 T342 | L334-E338 VanDerWaalsContact CD2-CD 3.45Å; L334-E338 HydrophobicContact CD2-CG 4.31Å; L334-E338 WeakPolarHBondContact CD2-OE1 3.44Å; L334-E338 WeakPolarHBondContact O-CG 3.39Å; L334-E338 PolarHBondContact O-N 3.4Å; E338-R340 VanDerWaalsContact C-N 3.31Å; E338-R340 PolarHBondContact O-N 3.35Å; E338-Y341 PolarHBondContact O-N 2.96Å; E338-T342 WeakPolarHBondContact O-CB 3.38Å; E338-T342 VanDerWaalsContact O-CG2 3.25Å; E338-T342 WeakPolarHBondContact O-CG2 3.3Å; E338-T342 PolarHBondContact O-N 2.79Å; E338-T342 PolarHBondContact O-OG1 3.3Å |
| 339 | A | 94 | Very high | 94.5 | Very high | 51 Ų | 51 | 93.9 Ų | 93.9 | 42% | 0.421 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -60.4 | -39.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | T335 E336 T342 T343 | T335-A339 VanDerWaalsContact O-CB 3.31Å; T335-A339 WeakPolarHBondContact O-CB 3.45Å; T335-A339 PolarHBondContact O-N 2.86Å; E336-A339 PolarHBondContact O-N 3.44Å; A339-T342 VanDerWaalsContact C-OG1 3.32Å; A339-T342 VanDerWaalsContact CA-OG1 3.28Å; A339-T342 WeakPolarHBondContact CA-OG1 3.15Å; A339-T342 PolarHBondContact O-OG1 3.38Å; A339-T343 WeakPolarHBondContact O-CB 3.43Å; A339-T343 PolarHBondContact O-N 3.25Å; A339-T343 VanDerWaalsContact O-N 3.1Å; A339-T343 PolarHBondContact O-OG1 3.18Å |
| 340 | R | 97.4 | Very high | 94.8 | Very high | 156 Ų | 156 | 93 Ų | 93 | 59% | 0.589 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -65.8 | -46.4 | 175.5 | -72.6 | 172.9 | -177.3 | -168.3 | 3.3 | 111.8 | E336 T337 E338 T343 L344 | E336-R340 VanDerWaalsContact O-CG 3.29Å; E336-R340 WeakPolarHBondContact O-CG 3.33Å; E336-R340 PolarHBondContact O-N 2.87Å; E336-R340 IonicContact OE1-CZ 2.76Å; E336-R340 IonicContact OE1-NE 2.81Å; E336-R340 PolarHBondContact OE1-NE 2.88Å; E336-R340 IonicContact OE1-NH2 3.12Å; E336-R340 PolarHBondContact OE1-NH2 2.85Å; T337-R340 PolarHBondContact O-N 3.42Å; E338-R340 VanDerWaalsContact C-N 3.31Å; E338-R340 PolarHBondContact O-N 3.35Å; R340-T343 PolarHBondContact O-N 3.4Å; R340-L344 PolarHBondContact O-N 2.99Å |
| 341 | Y | 95.1 | Very high | 95.3 | Very high | 156 Ų | 156 | 92.3 Ų | 92.3 | 61% | 0.612 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -69 | -38.6 | -180 | -76.9 | -63.5 | 0 | 0 | 0 | 112.8 | T337 E338 T343 L344 L345 | T337-Y341 WeakPolarHBondContact O-CD2 3.46Å; T337-Y341 PolarHBondContact O-N 3.31Å; E338-Y341 PolarHBondContact O-N 2.96Å; Y341-T343 VanDerWaalsContact C-N 3.32Å; Y341-T343 PolarHBondContact O-N 2.85Å; Y341-L344 PolarHBondContact O-N 3.41Å; Y341-L345 WeakPolarHBondContact O-CB 3.45Å; Y341-L345 VanDerWaalsContact O-CG 3.31Å; Y341-L345 WeakPolarHBondContact O-CG 3.36Å; Y341-L345 PolarHBondContact O-N 2.87Å |
| 342 | T | 97.9 | Very high | 95.7 | Very high | 84 Ų | 84 | 90.5 Ų | 90.5 | 52% | 0.515 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -61.6 | -41.8 | 174 | 49.2 | 0 | 0 | 0 | 0 | 111.3 | E338 A339 L345 A346 | E338-T342 WeakPolarHBondContact O-CB 3.38Å; E338-T342 VanDerWaalsContact O-CG2 3.25Å; E338-T342 WeakPolarHBondContact O-CG2 3.3Å; E338-T342 PolarHBondContact O-N 2.79Å; E338-T342 PolarHBondContact O-OG1 3.3Å; A339-T342 VanDerWaalsContact C-OG1 3.32Å; A339-T342 VanDerWaalsContact CA-OG1 3.28Å; A339-T342 WeakPolarHBondContact CA-OG1 3.15Å; A339-T342 PolarHBondContact O-OG1 3.38Å; T342-L345 PolarHBondContact O-N 2.91Å; T342-A346 WeakPolarHBondContact O-CB 3.35Å; T342-A346 PolarHBondContact O-N 2.96Å |
| 343 | T | 97.6 | Very high | 96 | Very high | 77 Ų | 77 | 92.3 Ų | 92.3 | 47% | 0.472 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63.2 | -44 | 174.2 | -56.3 | 0 | 0 | 0 | 0 | 111.8 | A339 R340 Y341 A346 Q347 | A339-T343 WeakPolarHBondContact O-CB 3.43Å; A339-T343 PolarHBondContact O-N 3.25Å; A339-T343 VanDerWaalsContact O-N 3.1Å; A339-T343 PolarHBondContact O-OG1 3.18Å; R340-T343 PolarHBondContact O-N 3.4Å; Y341-T343 VanDerWaalsContact C-N 3.32Å; Y341-T343 PolarHBondContact O-N 2.85Å; T343-A346 PolarHBondContact O-N 3.41Å; T343-Q347 WeakPolarHBondContact O-CG 3.43Å; T343-Q347 PolarHBondContact O-N 3.47Å |
| 344 | L | 98.1 | Very high | 96.4 | Very high | 83 Ų | 83 | 92.1 Ų | 92.1 | 44% | 0.435 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -62.4 | -43.7 | 176.7 | 178.3 | 62.4 | 0 | 0 | 0 | 111.9 | R340 Y341 A346 Q347 I348 | R340-L344 PolarHBondContact O-N 2.99Å; Y341-L344 PolarHBondContact O-N 3.41Å; L344-A346 VanDerWaalsContact C-N 3.33Å; L344-A346 PolarHBondContact O-N 2.98Å; L344-Q347 PolarHBondContact O-N 3.45Å; L344-I348 HydrophobicContact CD1-CD1 4.21Å; L344-I348 HydrophobicContact CD1-CG1 4.44Å; L344-I348 HydrophobicContact CG-CD1 4.09Å; L344-I348 WeakPolarHBondContact O-CG1 3.24Å; L344-I348 PolarHBondContact O-N 3.36Å |
| 345 | L | 97.9 | Very high | 96.8 | Very high | 99 Ų | 99 | 92.2 Ų | 92.2 | 52% | 0.518 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61.4 | -42.7 | 175.8 | -74.5 | 170.4 | 0 | 0 | 0 | 111.3 | Y341 T342 Q347 I348 Q349 | Y341-L345 WeakPolarHBondContact O-CB 3.45Å; Y341-L345 VanDerWaalsContact O-CG 3.31Å; Y341-L345 WeakPolarHBondContact O-CG 3.36Å; Y341-L345 PolarHBondContact O-N 2.87Å; T342-L345 PolarHBondContact O-N 2.91Å; L345-Q347 VanDerWaalsContact C-N 3.33Å; L345-Q347 PolarHBondContact O-N 3.4Å; L345-I348 PolarHBondContact O-N 3.23Å; L345-Q349 VanDerWaalsContact O-CB 3.32Å; L345-Q349 WeakPolarHBondContact O-CB 3.32Å; L345-Q349 PolarHBondContact O-N 2.95Å |
| 346 | A | 97.8 | Very high | 97 | Very high | 65 Ų | 65 | 93.9 Ų | 93.9 | 54% | 0.537 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61.9 | -40 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | T342 T343 L344 Q349 G350 | T342-A346 WeakPolarHBondContact O-CB 3.35Å; T342-A346 PolarHBondContact O-N 2.96Å; T343-A346 PolarHBondContact O-N 3.41Å; L344-A346 VanDerWaalsContact C-N 3.33Å; L344-A346 PolarHBondContact O-N 2.98Å; A346-Q349 PolarHBondContact O-N 3.22Å; A346-G350 PolarHBondContact O-N 3.11Å |
| 347 | Q | 98.3 | Very high | 97.2 | Very high | 130 Ų | 130 | 91.3 Ų | 91.3 | 61% | 0.607 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -63.6 | -46.5 | 175.3 | -72 | 176.4 | 33 | 0 | 0 | 112.2 | T343 L344 L345 Q349 G350 L351 | T343-Q347 WeakPolarHBondContact O-CG 3.43Å; T343-Q347 PolarHBondContact O-N 3.47Å; L344-Q347 PolarHBondContact O-N 3.45Å; L345-Q347 VanDerWaalsContact C-N 3.33Å; L345-Q347 PolarHBondContact O-N 3.4Å; Q347-Q349 VanDerWaalsContact C-N 3.34Å; Q347-G350 PolarHBondContact O-N 3.27Å; Q347-L351 PolarHBondContact O-N 2.97Å |
| 348 | I | 97.8 | Very high | 97.5 | Very high | 85 Ų | 85 | 93.9 Ų | 93.9 | 44% | 0.436 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.1 | -43.5 | 177.6 | -66.7 | 169.3 | 0 | 0 | 0 | 110.2 | L344 L345 G350 L351 I352 | L344-I348 HydrophobicContact CD1-CD1 4.21Å; L344-I348 HydrophobicContact CD1-CG1 4.44Å; L344-I348 HydrophobicContact CG-CD1 4.09Å; L344-I348 WeakPolarHBondContact O-CG1 3.24Å; L344-I348 PolarHBondContact O-N 3.36Å; L345-I348 PolarHBondContact O-N 3.23Å; I348-G350 VanDerWaalsContact C-N 3.3Å; I348-G350 PolarHBondContact O-N 2.96Å; I348-L351 PolarHBondContact O-N 2.65Å; I348-L351 VanDerWaalsContact O-N 3.14Å; I348-I352 HydrophobicContact CG2-CD1 3.99Å; I348-I352 HydrophobicContact CG2-CG1 4.48Å; I348-I352 WeakPolarHBondContact O-CG1 3.45Å; I348-I352 PolarHBondContact O-N 3.46Å |
| 349 | Q | 97.8 | Very high | 97.7 | Very high | 116 Ų | 116 | 91.9 Ų | 91.9 | 54% | 0.542 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61 | -40.1 | 176.7 | -171 | 62.4 | 28.1 | 0 | 0 | 111.8 | L345 A346 Q347 I352 H353 | L345-Q349 VanDerWaalsContact O-CB 3.32Å; L345-Q349 WeakPolarHBondContact O-CB 3.32Å; L345-Q349 PolarHBondContact O-N 2.95Å; A346-Q349 PolarHBondContact O-N 3.22Å; Q347-Q349 VanDerWaalsContact C-N 3.34Å; Q349-I352 PolarHBondContact O-N 3.34Å; Q349-H353 WeakPolarHBondContact O-CB 3.44Å; Q349-H353 PolarHBondContact O-N 3.45Å |
| 350 | G | 98.3 | Very high | 97.9 | Very high | 31 Ų | 31 | 92.2 Ų | 92.2 | 32% | 0.32 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -62.4 | -40.4 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | A346 Q347 I348 H353 N354 | A346-G350 PolarHBondContact O-N 3.11Å; Q347-G350 PolarHBondContact O-N 3.27Å; I348-G350 VanDerWaalsContact C-N 3.3Å; I348-G350 PolarHBondContact O-N 2.96Å; G350-H353 PolarHBondContact O-N 2.93Å; G350-N354 PolarHBondContact O-N 3.48Å; G350-N354 PolarHBondContact O-ND2 3.37Å |
| 351 | L | 98.4 | Very high | 97.9 | Very high | 104 Ų | 104 | 90.3 Ų | 90.3 | 55% | 0.545 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -65.9 | -42.2 | 175.5 | -178.5 | 136.3 | 0 | 0 | 0 | 112.1 | Q347 I348 H353 N354 L355 | Q347-L351 PolarHBondContact O-N 2.97Å; I348-L351 PolarHBondContact O-N 2.65Å; I348-L351 VanDerWaalsContact O-N 3.14Å; L351-H353 VanDerWaalsContact C-N 3.35Å; L351-N354 PolarHBondContact O-N 3.49Å; L351-L355 HydrophobicContact CD2-CD1 3.76Å; L351-L355 HydrophobicContact CD2-CG 4.45Å; L351-L355 HydrophobicContact CG-CD1 4.47Å; L351-L355 WeakPolarHBondContact O-CG 3.38Å; L351-L355 PolarHBondContact O-N 3.28Å |
| 352 | I | 98 | Very high | 98.1 | Very high | 64 Ų | 64 | 88.5 Ų | 88.5 | 33% | 0.328 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -57.8 | -50.5 | 174.1 | -68.7 | 167.9 | 0 | 0 | 0 | 109.6 | I348 Q349 N354 L355 E356 | I348-I352 HydrophobicContact CG2-CD1 3.99Å; I348-I352 HydrophobicContact CG2-CG1 4.48Å; I348-I352 WeakPolarHBondContact O-CG1 3.45Å; I348-I352 PolarHBondContact O-N 3.46Å; Q349-I352 PolarHBondContact O-N 3.34Å; I352-N354 VanDerWaalsContact C-N 3.31Å; I352-N354 PolarHBondContact O-N 3Å; I352-L355 PolarHBondContact O-N 3.02Å; I352-L355 VanDerWaalsContact O-N 3.1Å; I352-E356 HydrophobicContact CG2-CG 4.16Å; I352-E356 WeakPolarHBondContact CG2-OE1 3.11Å; I352-E356 WeakPolarHBondContact O-CB 3.47Å; I352-E356 WeakPolarHBondContact O-CG 3.5Å; I352-E356 PolarHBondContact O-N 3.45Å |
| 353 | H | 98.4 | Very high | 98.1 | Very high | 114 Ų | 114 | 93 Ų | 93 | 53% | 0.528 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -58.8 | -41.8 | 179.7 | -172.8 | 61.6 | 0 | 0 | 0 | 112.6 | Q349 G350 L351 L355 E356 A357 | Q349-H353 WeakPolarHBondContact O-CB 3.44Å; Q349-H353 PolarHBondContact O-N 3.45Å; G350-H353 PolarHBondContact O-N 2.93Å; L351-H353 VanDerWaalsContact C-N 3.35Å; H353-L355 PolarHBondContact O-N 3.46Å; H353-E356 PolarHBondContact O-N 2.88Å; H353-A357 WeakPolarHBondContact O-CB 3.33Å; H353-A357 PolarHBondContact O-N 3.33Å |
| 354 | N | 98.3 | Very high | 98.1 | Very high | 96 Ų | 96 | 91 Ų | 91 | 51% | 0.513 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -65.3 | -36.7 | 177 | -70.5 | -21.9 | 0 | 0 | 0 | 112.7 | G350 L351 I352 Q358 | G350-N354 PolarHBondContact O-N 3.48Å; G350-N354 PolarHBondContact O-ND2 3.37Å; L351-N354 PolarHBondContact O-N 3.49Å; I352-N354 VanDerWaalsContact C-N 3.31Å; I352-N354 PolarHBondContact O-N 3Å; N354-Q358 WeakPolarHBondContact O-CG 3.4Å; N354-Q358 PolarHBondContact O-N 3.06Å; N354-Q358 VanDerWaalsContact O-N 3.13Å; N354-Q358 PolarHBondContact O-NE2 3.28Å; N354-Q358 VanDerWaalsContact O-NE2 3.08Å |
| 355 | L | 98.4 | Very high | 98.1 | Very high | 91 Ų | 91 | 88.5 Ų | 88.5 | 48% | 0.476 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -72.2 | -41.4 | 175.6 | -71.9 | 178 | 0 | 0 | 0 | 111.4 | L351 I352 H353 A357 Q358 V359 | L351-L355 HydrophobicContact CD2-CD1 3.76Å; L351-L355 HydrophobicContact CD2-CG 4.45Å; L351-L355 HydrophobicContact CG-CD1 4.47Å; L351-L355 WeakPolarHBondContact O-CG 3.38Å; L351-L355 PolarHBondContact O-N 3.28Å; I352-L355 PolarHBondContact O-N 3.02Å; I352-L355 VanDerWaalsContact O-N 3.1Å; H353-L355 PolarHBondContact O-N 3.46Å; L355-A357 VanDerWaalsContact C-N 3.32Å; L355-A357 PolarHBondContact O-N 2.99Å; L355-Q358 PolarHBondContact O-N 3.5Å; L355-V359 WeakPolarHBondContact O-CG2 3.37Å; L355-V359 PolarHBondContact O-N 2.81Å |
| 356 | E | 97.9 | Very high | 98.1 | Very high | 113 Ų | 113 | 89 Ų | 89 | 53% | 0.528 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -59.4 | -43.5 | 174.6 | -73 | 174.6 | 162.5 | 0 | 0 | 111.4 | I352 H353 V359 A360 | I352-E356 HydrophobicContact CG2-CG 4.16Å; I352-E356 WeakPolarHBondContact CG2-OE1 3.11Å; I352-E356 WeakPolarHBondContact O-CB 3.47Å; I352-E356 WeakPolarHBondContact O-CG 3.5Å; I352-E356 PolarHBondContact O-N 3.45Å; H353-E356 PolarHBondContact O-N 2.88Å; E356-V359 PolarHBondContact O-N 3.39Å; E356-A360 WeakPolarHBondContact O-CB 2.93Å; E356-A360 PolarHBondContact O-N 2.96Å |
| 357 | A | 97.9 | Very high | 98.2 | Very high | 40 Ų | 40 | 91 Ų | 91 | 33% | 0.331 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -61.5 | -47.7 | 175 | 0 | 0 | 0 | 0 | 0 | 111.8 | H353 L355 V359 A360 D361 | H353-A357 WeakPolarHBondContact O-CB 3.33Å; H353-A357 PolarHBondContact O-N 3.33Å; L355-A357 VanDerWaalsContact C-N 3.32Å; L355-A357 PolarHBondContact O-N 2.99Å; A357-V359 VanDerWaalsContact C-N 3.31Å; A357-V359 PolarHBondContact O-N 2.94Å; A357-A360 WeakPolarHBondContact O-CB 3.37Å; A357-A360 PolarHBondContact O-N 3.07Å; A357-A360 VanDerWaalsContact O-N 3.12Å; A357-D361 PolarHBondContact O-N 3.27Å |
| 358 | Q | 98.4 | Very high | 98.1 | Very high | 109 Ų | 109 | 91.4 Ų | 91.4 | 51% | 0.509 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -59.6 | -40.6 | 176.2 | -77.5 | 171.7 | 75.9 | 0 | 0 | 112.6 | N354 L355 D361 I362 | N354-Q358 WeakPolarHBondContact O-CG 3.4Å; N354-Q358 PolarHBondContact O-N 3.06Å; N354-Q358 VanDerWaalsContact O-N 3.13Å; N354-Q358 PolarHBondContact O-NE2 3.28Å; N354-Q358 VanDerWaalsContact O-NE2 3.08Å; L355-Q358 PolarHBondContact O-N 3.5Å; Q358-D361 PolarHBondContact O-N 3.3Å; Q358-I362 VanDerWaalsContact O-CG1 3.29Å; Q358-I362 WeakPolarHBondContact O-CG1 3.49Å; Q358-I362 PolarHBondContact O-N 3.47Å |
| 359 | V | 98.3 | Very high | 98.1 | Very high | 66 Ų | 66 | 92.1 Ų | 92.1 | 40% | 0.4 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -64.8 | -41.6 | 175.7 | 170.3 | 0 | 0 | 0 | 0 | 110.9 | L355 E356 A357 R363 | L355-V359 WeakPolarHBondContact O-CG2 3.37Å; L355-V359 PolarHBondContact O-N 2.81Å; E356-V359 PolarHBondContact O-N 3.39Å; A357-V359 VanDerWaalsContact C-N 3.31Å; A357-V359 PolarHBondContact O-N 2.94Å; V359-R363 WeakPolarHBondContact O-CB 3.35Å; V359-R363 VanDerWaalsContact O-CG 3.28Å; V359-R363 WeakPolarHBondContact O-CG 3.38Å; V359-R363 PolarHBondContact O-N 3.36Å |
| 360 | A | 98.1 | Very high | 98.1 | Very high | 57 Ų | 57 | 90.4 Ų | 90.4 | 47% | 0.471 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -62.7 | -42.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | E356 A357 R363 G364 | E356-A360 WeakPolarHBondContact O-CB 2.93Å; E356-A360 PolarHBondContact O-N 2.96Å; A357-A360 WeakPolarHBondContact O-CB 3.37Å; A357-A360 PolarHBondContact O-N 3.07Å; A357-A360 VanDerWaalsContact O-N 3.12Å; A360-R363 PolarHBondContact O-N 3.23Å; A360-G364 PolarHBondContact O-N 3.48Å |
| 361 | D | 98.2 | Very high | 98.1 | Very high | 116 Ų | 116 | 94.2 Ų | 94.2 | 62% | 0.62 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -62.9 | -45.7 | 177.6 | -71.4 | -21.7 | 0 | 0 | 0 | 112 | A357 Q358 G364 A365 | A357-D361 PolarHBondContact O-N 3.27Å; Q358-D361 PolarHBondContact O-N 3.3Å; D361-G364 PolarHBondContact O-N 3.09Å; D361-A365 WeakPolarHBondContact O-CB 3.31Å; D361-A365 PolarHBondContact O-N 3.42Å |
| 362 | I | 98.2 | Very high | 98.1 | Very high | 119 Ų | 119 | 95.2 Ų | 95.2 | 61% | 0.61 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -63 | -43.6 | 177.2 | -68.5 | 167 | 0 | 0 | 0 | 110.6 | Q358 A365 L366 | Q358-I362 VanDerWaalsContact O-CG1 3.29Å; Q358-I362 WeakPolarHBondContact O-CG1 3.49Å; Q358-I362 PolarHBondContact O-N 3.47Å; I362-A365 PolarHBondContact O-N 3.03Å; I362-L366 WeakPolarHBondContact O-CB 3.27Å; I362-L366 PolarHBondContact O-N 3.04Å |
| 363 | R | 98.1 | Very high | 98.1 | Very high | 178 Ų | 178 | 99.5 Ų | 99.5 | 67% | 0.672 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -60.6 | -45.5 | 175.6 | -75.7 | 174.3 | 177.8 | 175.1 | 0.8 | 111.3 | V359 A360 A365 L366 E367 | V359-R363 WeakPolarHBondContact O-CB 3.35Å; V359-R363 VanDerWaalsContact O-CG 3.28Å; V359-R363 WeakPolarHBondContact O-CG 3.38Å; V359-R363 PolarHBondContact O-N 3.36Å; A360-R363 PolarHBondContact O-N 3.23Å; R363-A365 VanDerWaalsContact C-N 3.31Å; R363-A365 PolarHBondContact O-N 3.35Å; R363-L366 PolarHBondContact O-N 3.43Å; R363-E367 WeakPolarHBondContact O-CB 3.15Å; R363-E367 PolarHBondContact O-N 2.92Å |
| 364 | G | 98.2 | Very high | 98 | Very high | 34 Ų | 34 | 98.8 Ų | 98.8 | 35% | 0.351 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.6 | -35.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | A360 D361 R368 | A360-G364 PolarHBondContact O-N 3.48Å; D361-G364 PolarHBondContact O-N 3.09Å; G364-R368 WeakPolarHBondContact O-CG 3.32Å; G364-R368 PolarHBondContact O-N 3.42Å; G364-R368 VanDerWaalsContact O-N 3.14Å; G364-R368 PolarHBondContact O-NE 3.45Å |
| 365 | A | 98.1 | Very high | 98 | Very high | 31 Ų | 31 | 98.7 Ų | 98.7 | 26% | 0.256 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -68.4 | -42.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | D361 I362 R363 R368 Q369 | D361-A365 WeakPolarHBondContact O-CB 3.31Å; D361-A365 PolarHBondContact O-N 3.42Å; I362-A365 PolarHBondContact O-N 3.03Å; R363-A365 VanDerWaalsContact C-N 3.31Å; R363-A365 PolarHBondContact O-N 3.35Å; A365-R368 VanDerWaalsContact CA-NH2 3.31Å; A365-R368 PolarHBondContact O-N 2.68Å; A365-Q369 WeakPolarHBondContact O-CG 3.45Å; A365-Q369 PolarHBondContact O-N 3.4Å |
| 366 | L | 98.1 | Very high | 98 | Very high | 110 Ų | 110 | 99.5 Ų | 99.5 | 58% | 0.576 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.5 | -43.9 | 176.3 | -177.6 | 64.6 | 0 | 0 | 0 | 111.4 | I362 R363 R368 Q369 N370 | I362-L366 WeakPolarHBondContact O-CB 3.27Å; I362-L366 PolarHBondContact O-N 3.04Å; R363-L366 PolarHBondContact O-N 3.43Å; L366-R368 VanDerWaalsContact C-N 3.34Å; L366-R368 PolarHBondContact O-N 3.26Å; L366-Q369 PolarHBondContact O-N 2.88Å; L366-N370 WeakPolarHBondContact O-CB 3.43Å; L366-N370 PolarHBondContact O-N 3.19Å |
| 367 | E | 98.1 | Very high | 98 | Very high | 108 Ų | 108 | 98.1 Ų | 98.1 | 51% | 0.505 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -59.7 | -44.6 | 177.4 | -167.6 | 67.4 | -150.1 | 0 | 0 | 111.3 | R363 N370 Q371 | R363-E367 WeakPolarHBondContact O-CB 3.15Å; R363-E367 PolarHBondContact O-N 2.92Å; E367-N370 PolarHBondContact O-N 3.07Å; E367-Q371 WeakPolarHBondContact O-CG 3.5Å; E367-Q371 PolarHBondContact O-N 2.95Å |
| 368 | R | 97.9 | Very high | 98 | Very high | 137 Ų | 137 | 101.4 Ų | 101.4 | 52% | 0.517 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62 | -45.9 | 174.7 | -78.1 | -175.4 | -69.9 | 99.4 | -6.2 | 112.4 | G364 A365 L366 N370 Q371 E372 | G364-R368 WeakPolarHBondContact O-CG 3.32Å; G364-R368 PolarHBondContact O-N 3.42Å; G364-R368 VanDerWaalsContact O-N 3.14Å; G364-R368 PolarHBondContact O-NE 3.45Å; A365-R368 VanDerWaalsContact CA-NH2 3.31Å; A365-R368 PolarHBondContact O-N 2.68Å; L366-R368 VanDerWaalsContact C-N 3.34Å; L366-R368 PolarHBondContact O-N 3.26Å; R368-N370 VanDerWaalsContact C-N 3.29Å; R368-N370 PolarHBondContact O-N 3.01Å; R368-Q371 PolarHBondContact O-N 3.35Å; R368-E372 WeakPolarHBondContact O-CG 3.37Å; R368-E372 PolarHBondContact O-N 2.83Å |
| 369 | Q | 97.8 | Very high | 97.9 | Very high | 100 Ų | 100 | 98.4 Ų | 98.4 | 47% | 0.467 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.8 | -41.1 | 176.2 | -77.1 | -174.1 | -24.7 | 0 | 0 | 111.6 | A365 L366 Q371 E372 Y373 | A365-Q369 WeakPolarHBondContact O-CG 3.45Å; A365-Q369 PolarHBondContact O-N 3.4Å; L366-Q369 PolarHBondContact O-N 2.88Å; Q369-Q371 VanDerWaalsContact C-N 3.34Å; Q369-Q371 PolarHBondContact O-N 3.47Å; Q369-E372 PolarHBondContact O-N 3.47Å; Q369-Y373 HydrophobicContact CB-CD2 4.44Å; Q369-Y373 HydrophobicContact CB-CE2 4.37Å; Q369-Y373 WeakPolarHBondContact O-CD2 3.34Å; Q369-Y373 PolarHBondContact O-N 3.25Å |
| 370 | N | 97.6 | Very high | 97.9 | Very high | 81 Ų | 81 | 100.3 Ų | 100.3 | 43% | 0.433 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.7 | -44.1 | 177.3 | -163.5 | 31.7 | 0 | 0 | 0 | 111.3 | L366 E367 R368 E372 Y373 E374 | L366-N370 WeakPolarHBondContact O-CB 3.43Å; L366-N370 PolarHBondContact O-N 3.19Å; E367-N370 PolarHBondContact O-N 3.07Å; R368-N370 VanDerWaalsContact C-N 3.29Å; R368-N370 PolarHBondContact O-N 3.01Å; N370-E372 PolarHBondContact O-N 2.95Å; N370-Y373 PolarHBondContact O-N 3.49Å; N370-E374 WeakPolarHBondContact O-CG 3.39Å; N370-E374 PolarHBondContact O-N 3.41Å |
| 371 | Q | 97.8 | Very high | 97.9 | Very high | 110 Ų | 110 | 100.1 Ų | 100.1 | 51% | 0.514 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.2 | -42.1 | 174.2 | -69.1 | 169.3 | 9.8 | 0 | 0 | 112.4 | E367 R368 Q369 Y373 E374 V375 | E367-Q371 WeakPolarHBondContact O-CG 3.5Å; E367-Q371 PolarHBondContact O-N 2.95Å; R368-Q371 PolarHBondContact O-N 3.35Å; Q369-Q371 VanDerWaalsContact C-N 3.34Å; Q369-Q371 PolarHBondContact O-N 3.47Å; Q371-Y373 VanDerWaalsContact C-N 3.35Å; Q371-E374 PolarHBondContact O-N 3.22Å; Q371-V375 WeakPolarHBondContact O-CG2 3.35Å; Q371-V375 PolarHBondContact O-N 3.3Å; Q371-V375 VanDerWaalsContact O-N 3.12Å |
| 372 | E | 97.8 | Very high | 97.8 | Very high | 126 Ų | 126 | 102 Ų | 102 | 59% | 0.589 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -63.3 | -39.3 | 175 | -70.9 | 170.6 | -166.5 | 0 | 0 | 112.1 | R368 Q369 N370 V375 L376 | R368-E372 WeakPolarHBondContact O-CG 3.37Å; R368-E372 PolarHBondContact O-N 2.83Å; Q369-E372 PolarHBondContact O-N 3.47Å; N370-E372 PolarHBondContact O-N 2.95Å; E372-V375 PolarHBondContact O-N 2.82Å; E372-L376 WeakPolarHBondContact O-CB 3.4Å; E372-L376 PolarHBondContact O-N 3.42Å |
| 373 | Y | 97.9 | Very high | 97.8 | Very high | 153 Ų | 153 | 100.7 Ų | 100.7 | 60% | 0.6 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -64.8 | -43.5 | 175.7 | -82.5 | -63.6 | 0 | 0 | 0 | 112.6 | Q369 N370 Q371 L376 L377 | Q369-Y373 HydrophobicContact CB-CD2 4.44Å; Q369-Y373 HydrophobicContact CB-CE2 4.37Å; Q369-Y373 WeakPolarHBondContact O-CD2 3.34Å; Q369-Y373 PolarHBondContact O-N 3.25Å; N370-Y373 PolarHBondContact O-N 3.49Å; Q371-Y373 VanDerWaalsContact C-N 3.35Å; Y373-L376 PolarHBondContact O-N 3.26Å; Y373-L377 WeakPolarHBondContact O-CB 3.25Å; Y373-L377 PolarHBondContact O-N 3.29Å |
| 374 | E | 97.8 | Very high | 97.7 | Very high | 100 Ų | 100 | 96.7 Ų | 96.7 | 47% | 0.467 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -60.3 | -46.1 | 175.9 | -72.2 | -61.9 | 145.9 | 0 | 0 | 111.2 | N370 Q371 L376 L377 D378 | N370-E374 WeakPolarHBondContact O-CG 3.39Å; N370-E374 PolarHBondContact O-N 3.41Å; Q371-E374 PolarHBondContact O-N 3.22Å; E374-L376 VanDerWaalsContact C-N 3.3Å; E374-L376 PolarHBondContact O-N 2.9Å; E374-L377 WeakPolarHBondContact O-CB 3.35Å; E374-L377 PolarHBondContact O-N 3.45Å; E374-L377 VanDerWaalsContact O-N 3.14Å; E374-D378 PolarHBondContact O-N 2.9Å |
| 375 | V | 97.8 | Very high | 97.6 | Very high | 94 Ų | 94 | 98.8 Ų | 98.8 | 57% | 0.57 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -60.5 | -41.3 | 175.6 | 173.1 | 0 | 0 | 0 | 0 | 111.3 | Q371 E372 D378 T379 | Q371-V375 WeakPolarHBondContact O-CG2 3.35Å; Q371-V375 PolarHBondContact O-N 3.3Å; Q371-V375 VanDerWaalsContact O-N 3.12Å; E372-V375 PolarHBondContact O-N 2.82Å; V375-D378 PolarHBondContact O-N 2.85Å; V375-T379 WeakPolarHBondContact O-CG2 3.38Å; V375-T379 PolarHBondContact O-N 3.47Å; V375-T379 PolarHBondContact O-OG1 3.5Å |
| 376 | L | 97.8 | Very high | 97.6 | Very high | 108 Ų | 108 | 100.8 Ų | 100.8 | 57% | 0.565 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -65.1 | -40.5 | 176.8 | -173.5 | 65.1 | 0 | 0 | 0 | 111.5 | E372 Y373 E374 T379 K380 | E372-L376 WeakPolarHBondContact O-CB 3.4Å; E372-L376 PolarHBondContact O-N 3.42Å; Y373-L376 PolarHBondContact O-N 3.26Å; E374-L376 VanDerWaalsContact C-N 3.3Å; E374-L376 PolarHBondContact O-N 2.9Å; L376-T379 WeakPolarHBondContact CA-OG1 3.35Å; L376-T379 PolarHBondContact O-N 3.35Å; L376-T379 PolarHBondContact O-OG1 2.83Å; L376-K380 WeakPolarHBondContact O-CB 3.44Å; L376-K380 PolarHBondContact O-N 3.46Å |
| 377 | L | 97.7 | Very high | 97.4 | Very high | 84 Ų | 84 | 99.3 Ų | 99.3 | 44% | 0.44 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -62.5 | -41.5 | 176.4 | -174.4 | 65 | 0 | 0 | 0 | 111.7 | Y373 E374 K380 S381 | Y373-L377 WeakPolarHBondContact O-CB 3.25Å; Y373-L377 PolarHBondContact O-N 3.29Å; E374-L377 WeakPolarHBondContact O-CB 3.35Å; E374-L377 PolarHBondContact O-N 3.45Å; E374-L377 VanDerWaalsContact O-N 3.14Å; L377-K380 PolarHBondContact O-N 3.48Å; L377-S381 WeakPolarHBondContact O-CB 3.41Å; L377-S381 PolarHBondContact O-N 3.39Å; L377-S381 PolarHBondContact O-OG 3.4Å |
| 378 | D | 97.9 | Very high | 97.3 | Very high | 108 Ų | 108 | 98.1 Ų | 98.1 | 58% | 0.578 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -61.2 | -47.4 | 174 | -78.8 | -16.1 | 0 | 0 | 0 | 111.6 | E374 V375 K380 S381 R382 | E374-D378 PolarHBondContact O-N 2.9Å; V375-D378 PolarHBondContact O-N 2.85Å; D378-K380 PolarHBondContact O-N 3.42Å; D378-S381 PolarHBondContact O-N 3.25Å; D378-R382 PolarHBondContact O-N 3.04Å |
| 379 | T | 97.8 | Very high | 97 | Very high | 46 Ų | 46 | 95.2 Ų | 95.2 | 28% | 0.282 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64.5 | -40.3 | 177.9 | 60.9 | 0 | 0 | 0 | 0 | 112.3 | V375 L376 R382 L383 | V375-T379 WeakPolarHBondContact O-CG2 3.38Å; V375-T379 PolarHBondContact O-N 3.47Å; V375-T379 PolarHBondContact O-OG1 3.5Å; L376-T379 WeakPolarHBondContact CA-OG1 3.35Å; L376-T379 PolarHBondContact O-N 3.35Å; L376-T379 PolarHBondContact O-OG1 2.83Å; T379-R382 PolarHBondContact O-N 2.98Å; T379-L383 WeakPolarHBondContact O-CG 3.49Å; T379-L383 PolarHBondContact O-N 3.34Å |
| 380 | K | 97.6 | Very high | 96.9 | Very high | 107 Ų | 107 | 97.1 Ų | 97.1 | 47% | 0.465 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -59.2 | -50.1 | 174 | 179.7 | -161.9 | 161.5 | -166.7 | 0 | 110.3 | L376 L377 D378 R382 L383 E384 | L376-K380 WeakPolarHBondContact O-CB 3.44Å; L376-K380 PolarHBondContact O-N 3.46Å; L377-K380 PolarHBondContact O-N 3.48Å; D378-K380 PolarHBondContact O-N 3.42Å; K380-R382 VanDerWaalsContact C-N 3.28Å; K380-R382 PolarHBondContact O-N 2.87Å; K380-L383 PolarHBondContact O-N 2.96Å; K380-L383 VanDerWaalsContact O-N 3.14Å; K380-E384 VanDerWaalsContact CE-CD 3.5Å; K380-E384 WeakPolarHBondContact CE-OE1 3.26Å; K380-E384 HydrophobicContact CG-CG 4.49Å; K380-E384 IonicContact NZ-OE1 3.46Å; K380-E384 PolarHBondContact NZ-OE1 3.47Å; K380-E384 WeakPolarHBondContact O-CG 3.39Å; K380-E384 PolarHBondContact O-N 3.19Å |
| 381 | S | 97.1 | Very high | 96.7 | Very high | 52 Ų | 52 | 100.9 Ų | 100.9 | 36% | 0.364 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -59.4 | -40.1 | 179.9 | -57 | 0 | 0 | 0 | 0 | 111.3 | L377 D378 E384 C385 | L377-S381 WeakPolarHBondContact O-CB 3.41Å; L377-S381 PolarHBondContact O-N 3.39Å; L377-S381 PolarHBondContact O-OG 3.4Å; D378-S381 PolarHBondContact O-N 3.25Å; S381-E384 PolarHBondContact O-N 3.48Å; S381-C385 PolarHBondContact O-N 3.19Å; S381-C385 VanDerWaalsContact O-N 3.11Å; S381-C385 PolarHBondContact O-SG 3.43Å; S381-C385 VanDerWaalsContact O-SG 3.4Å |
| 382 | R | 97.8 | Very high | 96.3 | Very high | 157 Ų | 157 | 99.1 Ų | 99.1 | 59% | 0.592 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -63.6 | -46.3 | 173.9 | -175 | 176.1 | 67.9 | -163.6 | -2.1 | 112.6 | D378 T379 K380 E384 C385 E386 | D378-R382 PolarHBondContact O-N 3.04Å; T379-R382 PolarHBondContact O-N 2.98Å; K380-R382 VanDerWaalsContact C-N 3.28Å; K380-R382 PolarHBondContact O-N 2.87Å; R382-E384 VanDerWaalsContact C-N 3.32Å; R382-E384 PolarHBondContact O-N 2.85Å; R382-C385 WeakPolarHBondContact O-CB 3.45Å; R382-C385 PolarHBondContact O-N 3Å; R382-E386 PolarHBondContact O-N 3.43Å |
| 383 | L | 97.3 | Very high | 96 | Very high | 91 Ų | 91 | 98.3 Ų | 98.3 | 48% | 0.476 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.3 | -36.8 | 177.9 | -71.3 | 173 | 0 | 0 | 0 | 112 | T379 K380 C385 E386 I387 | T379-L383 WeakPolarHBondContact O-CG 3.49Å; T379-L383 PolarHBondContact O-N 3.34Å; K380-L383 PolarHBondContact O-N 2.96Å; K380-L383 VanDerWaalsContact O-N 3.14Å; L383-C385 VanDerWaalsContact C-N 3.34Å; L383-E386 PolarHBondContact O-N 3.39Å; L383-I387 VanDerWaalsContact O-CG1 3.3Å; L383-I387 WeakPolarHBondContact O-CG1 3.31Å; L383-I387 PolarHBondContact O-N 3.38Å |
| 384 | E | 96.6 | Very high | 95.5 | Very high | 93 Ų | 93 | 96.2 Ų | 96.2 | 44% | 0.435 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.3 | -42.4 | 173.6 | -74.6 | 178.1 | 159 | 0 | 0 | 111.2 | K380 S381 R382 I387 T388 | K380-E384 VanDerWaalsContact CE-CD 3.5Å; K380-E384 WeakPolarHBondContact CE-OE1 3.26Å; K380-E384 HydrophobicContact CG-CG 4.49Å; K380-E384 IonicContact NZ-OE1 3.46Å; K380-E384 PolarHBondContact NZ-OE1 3.47Å; K380-E384 WeakPolarHBondContact O-CG 3.39Å; K380-E384 PolarHBondContact O-N 3.19Å; S381-E384 PolarHBondContact O-N 3.48Å; R382-E384 VanDerWaalsContact C-N 3.32Å; R382-E384 PolarHBondContact O-N 2.85Å; E384-I387 PolarHBondContact O-N 3.46Å; E384-T388 WeakPolarHBondContact O-CG2 3.45Å; E384-T388 PolarHBondContact O-N 2.89Å; E384-T388 PolarHBondContact O-OG1 3.24Å |
| 385 | C | 95.6 | Very high | 94.6 | Very high | 79 Ų | 79 | 98.2 Ų | 98.2 | 53% | 0.534 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.8 | -42.2 | 171.4 | -69.4 | 0 | 0 | 0 | 0 | 112.7 | S381 R382 L383 T388 T389 | S381-C385 PolarHBondContact O-N 3.19Å; S381-C385 VanDerWaalsContact O-N 3.11Å; S381-C385 PolarHBondContact O-SG 3.43Å; S381-C385 VanDerWaalsContact O-SG 3.4Å; R382-C385 WeakPolarHBondContact O-CB 3.45Å; R382-C385 PolarHBondContact O-N 3Å; L383-C385 VanDerWaalsContact C-N 3.34Å; C385-T388 WeakPolarHBondContact CA-OG1 3.24Å; C385-T388 PolarHBondContact O-N 3.04Å; C385-T388 PolarHBondContact O-OG1 2.91Å; C385-T389 WeakPolarHBondContact O-CG2 3.47Å; C385-T389 PolarHBondContact O-N 2.96Å; C385-T389 PolarHBondContact O-OG1 2.98Å |
| 386 | E | 97.2 | Very high | 93.5 | Very high | 72 Ų | 72 | 97 Ų | 97 | 34% | 0.336 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.2 | -44.9 | 175.5 | -71.7 | 174.7 | -157.4 | 0 | 0 | 111 | R382 L383 T388 T389 Y390 | R382-E386 PolarHBondContact O-N 3.43Å; L383-E386 PolarHBondContact O-N 3.39Å; E386-T388 PolarHBondContact O-N 2.9Å; E386-T389 PolarHBondContact O-N 3.3Å; E386-T389 PolarHBondContact O-OG1 3.34Å; E386-Y390 HydrophobicContact CB-CD2 4.34Å; E386-Y390 HydrophobicContact CB-CE2 3.92Å; E386-Y390 WeakPolarHBondContact O-CD2 3.37Å; E386-Y390 PolarHBondContact O-N 2.98Å |
| 387 | I | 95.1 | Very high | 92 | Very high | 80 Ų | 80 | 97.5 Ų | 97.5 | 41% | 0.41 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.7 | -42 | 177.2 | -69.3 | 165.6 | 0 | 0 | 0 | 111.7 | L383 E384 T389 Y390 R391 | L383-I387 VanDerWaalsContact O-CG1 3.3Å; L383-I387 WeakPolarHBondContact O-CG1 3.31Å; L383-I387 PolarHBondContact O-N 3.38Å; E384-I387 PolarHBondContact O-N 3.46Å; I387-T389 VanDerWaalsContact C-N 3.33Å; I387-T389 PolarHBondContact O-N 2.67Å; I387-Y390 PolarHBondContact O-N 2.84Å; I387-R391 HydrophobicContact CG2-CG 4.35Å; I387-R391 WeakPolarHBondContact O-CB 3.4Å; I387-R391 VanDerWaalsContact O-CG 3.32Å; I387-R391 WeakPolarHBondContact O-CG 3.41Å; I387-R391 PolarHBondContact O-N 3.17Å |
| 388 | T | 94.9 | Very high | 90.1 | Very high | 82 Ų | 82 | 99 Ų | 99 | 50% | 0.503 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64.2 | -39.6 | 176.8 | 56.4 | 0 | 0 | 0 | 0 | 111.3 | E384 C385 E386 R391 S392 | E384-T388 WeakPolarHBondContact O-CG2 3.45Å; E384-T388 PolarHBondContact O-N 2.89Å; E384-T388 PolarHBondContact O-OG1 3.24Å; C385-T388 WeakPolarHBondContact CA-OG1 3.24Å; C385-T388 PolarHBondContact O-N 3.04Å; C385-T388 PolarHBondContact O-OG1 2.91Å; E386-T388 PolarHBondContact O-N 2.9Å; T388-R391 PolarHBondContact O-N 2.78Å; T388-S392 PolarHBondContact O-N 2.92Å |
| 389 | T | 92.8 | Very high | 88.1 | Confident | 77 Ų | 77 | 97.1 Ų | 97.1 | 47% | 0.472 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.4 | -44 | 173.3 | 63.9 | 0 | 0 | 0 | 0 | 112.4 | C385 E386 I387 R391 S392 L393 | C385-T389 WeakPolarHBondContact O-CG2 3.47Å; C385-T389 PolarHBondContact O-N 2.96Å; C385-T389 PolarHBondContact O-OG1 2.98Å; E386-T389 PolarHBondContact O-N 3.3Å; E386-T389 PolarHBondContact O-OG1 3.34Å; I387-T389 VanDerWaalsContact C-N 3.33Å; I387-T389 PolarHBondContact O-N 2.67Å; T389-R391 PolarHBondContact O-N 3.22Å; T389-S392 PolarHBondContact O-N 3.4Å; T389-L393 WeakPolarHBondContact O-CG 3.4Å; T389-L393 PolarHBondContact O-N 3.45Å |
| 390 | Y | 95.7 | Very high | 86 | Confident | 139 Ų | 139 | 105.7 Ų | 105.7 | 55% | 0.545 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -62.9 | -40.7 | 176.9 | -68.4 | -49.8 | 0 | 0 | 0 | 112.2 | E386 I387 L393 L394 | E386-Y390 HydrophobicContact CB-CD2 4.34Å; E386-Y390 HydrophobicContact CB-CE2 3.92Å; E386-Y390 WeakPolarHBondContact O-CD2 3.37Å; E386-Y390 PolarHBondContact O-N 2.98Å; I387-Y390 PolarHBondContact O-N 2.84Å; Y390-L393 PolarHBondContact O-N 2.72Å; Y390-L394 WeakPolarHBondContact O-CG 3.33Å; Y390-L394 PolarHBondContact O-N 3.48Å |
| 391 | R | 92.6 | Very high | 83.7 | Confident | 160 Ų | 160 | 106.4 Ų | 106.4 | 60% | 0.604 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -61.6 | -44.8 | 174.6 | -75.7 | 176.5 | 178.7 | 168.8 | 1.4 | 111.8 | I387 T388 T389 L393 L394 E395 | I387-R391 HydrophobicContact CG2-CG 4.35Å; I387-R391 WeakPolarHBondContact O-CB 3.4Å; I387-R391 VanDerWaalsContact O-CG 3.32Å; I387-R391 WeakPolarHBondContact O-CG 3.41Å; I387-R391 PolarHBondContact O-N 3.17Å; T388-R391 PolarHBondContact O-N 2.78Å; T389-R391 PolarHBondContact O-N 3.22Å; R391-L393 VanDerWaalsContact C-N 3.35Å; R391-L393 PolarHBondContact O-N 3.41Å; R391-L394 PolarHBondContact O-N 3.21Å; R391-E395 WeakPolarHBondContact O-CG 3.46Å; R391-E395 PolarHBondContact O-N 3.39Å |
| 392 | S | 90.4 | Very high | 81.3 | Confident | 74 Ų | 74 | 109.5 Ų | 109.5 | 52% | 0.517 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -61.7 | -40.9 | 176.8 | 178.7 | 0 | 0 | 0 | 0 | 112.5 | T388 T389 S396 | T388-S392 PolarHBondContact O-N 2.92Å; T389-S392 PolarHBondContact O-N 3.4Å; S392-S396 WeakPolarHBondContact O-CB 3.38Å; S392-S396 PolarHBondContact O-N 3.3Å |
| 393 | L | 91.3 | Very high | 78.7 | Confident | 108 Ų | 108 | 108.1 Ų | 108.1 | 57% | 0.565 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -65 | -42.4 | 175.7 | -72.2 | 172.2 | 0 | 0 | 0 | 112.1 | T389 Y390 R391 S396 L397 | T389-L393 WeakPolarHBondContact O-CG 3.4Å; T389-L393 PolarHBondContact O-N 3.45Å; Y390-L393 PolarHBondContact O-N 2.72Å; R391-L393 VanDerWaalsContact C-N 3.35Å; R391-L393 PolarHBondContact O-N 3.41Å; L393-S396 PolarHBondContact O-N 3.46Å; L393-S396 PolarHBondContact O-OG 3.43Å; L393-L397 PolarHBondContact O-N 3.33Å; L393-L397 VanDerWaalsContact O-N 3.07Å |
| 394 | L | 86.3 | Confident | 75.9 | Confident | 110 Ų | 110 | 111.4 Ų | 111.4 | 58% | 0.576 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -63.4 | -45.1 | 176.7 | -76.8 | 164.7 | 0 | 0 | 0 | 111.8 | Y390 R391 S396 L397 D398 | Y390-L394 WeakPolarHBondContact O-CG 3.33Å; Y390-L394 PolarHBondContact O-N 3.48Å; R391-L394 PolarHBondContact O-N 3.21Å; L394-S396 VanDerWaalsContact C-N 3.27Å; L394-S396 PolarHBondContact O-N 2.81Å; L394-L397 PolarHBondContact O-N 2.87Å; L394-D398 PolarHBondContact O-N 3.34Å |
| 395 | E | 80.3 | Confident | 73.6 | Confident | 142 Ų | 142 | 112.4 Ų | 112.4 | 66% | 0.664 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -59.6 | -37.5 | 174 | -74.7 | 171.8 | -172.8 | 0 | 0 | 111.9 | R391 L397 G399 | R391-E395 WeakPolarHBondContact O-CG 3.46Å; R391-E395 PolarHBondContact O-N 3.39Å; E395-L397 VanDerWaalsContact C-N 3.29Å; E395-L397 PolarHBondContact O-N 3.15Å; E395-G399 PolarHBondContact O-N 2.88Å |
| 396 | S | 73.8 | Confident | 70.8 | Confident | 69 Ų | 69 | 114.8 Ų | 114.8 | 48% | 0.483 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -69.5 | -24.1 | 175.4 | 80.5 | 0 | 0 | 0 | 0 | 113.9 | S392 L393 L394 | S392-S396 WeakPolarHBondContact O-CB 3.38Å; S392-S396 PolarHBondContact O-N 3.3Å; L393-S396 PolarHBondContact O-N 3.46Å; L393-S396 PolarHBondContact O-OG 3.43Å; L394-S396 VanDerWaalsContact C-N 3.27Å; L394-S396 PolarHBondContact O-N 2.81Å |
| 397 | L | 66.6 | Low | 67.9 | Low | 117 Ų | 117 | 116 Ų | 116 | 61% | 0.613 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -85.3 | -39.8 | 176.3 | -127.2 | 97.4 | 0 | 0 | 0 | 111.9 | L393 L394 E395 G399 R400 | L393-L397 PolarHBondContact O-N 3.33Å; L393-L397 VanDerWaalsContact O-N 3.07Å; L394-L397 PolarHBondContact O-N 2.87Å; E395-L397 VanDerWaalsContact C-N 3.29Å; E395-L397 PolarHBondContact O-N 3.15Å; L397-G399 PolarHBondContact O-N 3.41Å; L397-R400 PolarHBondContact O-N 2.98Å |
| 398 | D | 57.2 | Low | 65.2 | Low | 116 Ų | 116 | 118.7 Ų | 118.7 | 62% | 0.62 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -66.2 | -23.7 | 175.8 | -83.8 | -17.6 | 0 | 0 | 0 | 112.2 | L394 R400 | L394-D398 PolarHBondContact O-N 3.34Å; D398-R400 PolarHBondContact O-N 3.36Å |
| 399 | G | 56.3 | Low | 62.4 | Low | 69 Ų | 69 | 123.9 Ų | 123.9 | 71% | 0.711 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68 | -7.4 | 168.7 | 0 | 0 | 0 | 0 | 0 | 115.5 | E395 L397 | E395-G399 PolarHBondContact O-N 2.88Å; L397-G399 PolarHBondContact O-N 3.41Å |
| 400 | R | 54.1 | Low | 59.4 | Low | 226 Ų | 226 | 126.6 Ų | 126.6 | 85% | 0.853 | 71% | 0.708 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -114.9 | 7 | -179.5 | -71.9 | -165 | -171.2 | -127.8 | 3.5 | 115.2 | L397 D398 | L397-R400 PolarHBondContact O-N 2.98Å; D398-R400 PolarHBondContact O-N 3.36Å |
| 401 | L | 49.9 | Very low | 56.3 | Low | 121 Ų | 121 | 128.5 Ų | 128.5 | 63% | 0.634 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -111.9 | 130.1 | 177.4 | -75.8 | 163.6 | 0 | 0 | 0 | 111.3 | C403 | L401-C403 PolarHBondContact O-N 2.94Š|
| 402 | P | 46 | Very low | 54 | Low | 118 Ų | 118 | 125.4 Ų | 125.4 | 77% | 0.766 | 72% | 0.722 | S | S | * | * | trans | -65.3 | 134 | 172.5 | -13 | 26.5 | 0 | 0 | 0 | 110.9 | N404 | P402-N404 PolarHBondContact O-N 3.01Š| ||
| 403 | C | 42.6 | Very low | 51.2 | Low | 128 Ų | 128 | 127.6 Ų | 127.6 | 87% | 0.865 | 74% | 0.737 | S | S | * | * | trans | -45.6 | 129.1 | 172.3 | -72.4 | 0 | 0 | 0 | 0 | 112.6 | L401 | L401-C403 PolarHBondContact O-N 2.94Š| ||
| 404 | N | 39 | Very low | 48.6 | Very low | 159 Ų | 159 | 131.7 Ų | 131.7 | 85% | 0.85 | 75% | 0.751 | S | S | * | * | trans | -110.6 | 124.8 | 156.6 | -102.6 | -35.3 | 0 | 0 | 0 | 109.7 | P402 C406 | P402-N404 PolarHBondContact O-N 3.01Å; N404-C406 PolarHBondContact O-N 3.44Å | ||
| 405 | P | 48.6 | Very low | 46.2 | Very low | 114 Ų | 114 | 135.3 Ų | 135.3 | 74% | 0.74 | 77% | 0.765 | S | S | * | * | trans | -87.6 | 107.7 | -173.1 | 33.4 | -30.5 | 0 | 0 | 0 | 110.6 | ||||
| 406 | C | 36.8 | Very low | 44.1 | Very low | 130 Ų | 130 | 135.4 Ų | 135.4 | 88% | 0.878 | 78% | 0.775 | S | S | * | * | trans | -133.6 | 79.4 | 153.1 | -91.4 | 0 | 0 | 0 | 0 | 109.1 | N404 T408 | N404-C406 PolarHBondContact O-N 3.44Å; C406-T408 PolarHBondContact O-N 2.99Å | ||
| 407 | A | 36.6 | Very low | 42.3 | Very low | 96 Ų | 96 | 143.4 Ų | 143.4 | 79% | 0.793 | 80% | 0.795 | S | S | * | * | trans | -68.5 | 117.3 | 160.1 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 408 | T | 36.6 | Very low | 40.9 | Very low | 137 Ų | 137 | 142 Ų | 142 | 84% | 0.84 | 80% | 0.801 | S | S | * | * | trans | -119.7 | 114.5 | 147.2 | -45.2 | 0 | 0 | 0 | 0 | 106.8 | C406 | C406-T408 PolarHBondContact O-N 2.99Š| ||
| 409 | K | 36.6 | Very low | 39.8 | Very low | 191 Ų | 191 | 144.8 Ų | 144.8 | 83% | 0.83 | 81% | 0.812 | S | S | * | * | trans | -66.3 | 131.6 | -179.6 | -63.3 | 170.6 | 176.2 | 178.6 | 0 | 109.9 | ||||
| 410 | C | 29.2 | Very low | 38.8 | Very low | 135 Ų | 135 | 150.1 Ų | 150.1 | 91% | 0.912 | 82% | 0.818 | S | S | * | * | trans | -142.1 | 104.5 | 154 | -96.1 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 411 | E | 30.8 | Very low | 37.7 | Very low | 179 Ų | 179 | 144.8 Ų | 144.8 | 84% | 0.836 | 82% | 0.815 | S | S | * | * | trans | -73.6 | 157.2 | 166.8 | -88.2 | -77.2 | 143.8 | 0 | 0 | 110.6 | ||||
| 412 | P | 45.3 | Very low | 36.9 | Very low | 94 Ų | 94 | 146.2 Ų | 146.2 | 61% | 0.61 | 82% | 0.822 | S | S | * | * | trans | -89.5 | 146.7 | -165.7 | 35.8 | -28.4 | 0 | 0 | 0 | 111.8 | ||||
| 413 | S | 31.9 | Very low | 36.3 | Very low | 120 Ų | 120 | 146.4 Ų | 146.4 | 84% | 0.839 | 82% | 0.821 | S | S | * | * | trans | -119.7 | 112.1 | 163.5 | 35.2 | 0 | 0 | 0 | 0 | 108.9 | Q415 | S413-Q415 PolarHBondContact O-N 2.83Š| ||
| 414 | F | 37.3 | Very low | 36.3 | Very low | 195 Ų | 195 | 146.1 Ų | 146.1 | 86% | 0.855 | 82% | 0.817 | S | S | * | * | trans | -60.8 | 122.3 | 164.6 | -72 | -91.5 | 0 | 0 | 0 | 109 | ||||
| 415 | Q | 34.8 | Very low | 36 | Very low | 186 Ų | 186 | 144.8 Ų | 144.8 | 87% | 0.869 | 82% | 0.815 | S | S | * | * | trans | -148.3 | 101.3 | 151 | -118.4 | 167.3 | 10.3 | 0 | 0 | 110.1 | S413 R417 | S413-Q415 PolarHBondContact O-N 2.83Å; Q415-R417 PolarHBondContact O-N 3.32Å; Q415-R417 VanDerWaalsContact O-N 3.13Å | ||
| 416 | T | 36.3 | Very low | 35.1 | Very low | 144 Ų | 144 | 149 Ų | 149 | 88% | 0.883 | 82% | 0.817 | S | S | * | * | trans | -42.1 | 109.8 | 159.2 | -41.9 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 417 | R | 35.7 | Very low | 35 | Very low | 236 Ų | 236 | 150 Ų | 150 | 89% | 0.891 | 81% | 0.813 | S | S | * | * | trans | -110.9 | 105.5 | 165 | -159.3 | 171.4 | -173.6 | 172.7 | 1.4 | 107.5 | Q415 M419 | Q415-R417 PolarHBondContact O-N 3.32Å; Q415-R417 VanDerWaalsContact O-N 3.13Å; R417-M419 PolarHBondContact O-N 3.46Å | ||
| 418 | A | 37.3 | Very low | 34.7 | Very low | 89 Ų | 89 | 150.2 Ų | 150.2 | 74% | 0.736 | 81% | 0.808 | S | S | * | * | trans | -50.6 | 125.9 | 161.2 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 419 | M | 34.3 | Very low | 34.6 | Very low | 174 Ų | 174 | 149.3 Ų | 149.3 | 86% | 0.857 | 81% | 0.807 | S | S | * | * | trans | -114.2 | 96.1 | 167.9 | -149.1 | 163.5 | -155.1 | 0 | 0 | 106.5 | R417 C421 | R417-M419 PolarHBondContact O-N 3.46Å; M419-C421 PolarHBondContact O-N 3.49Å | ||
| 420 | E | 34.8 | Very low | 34.4 | Very low | 180 Ų | 180 | 145.9 Ų | 145.9 | 84% | 0.841 | 81% | 0.807 | S | S | * | * | trans | -59.6 | 119.2 | 158.6 | -68.8 | 175.3 | 157.5 | 0 | 0 | 107.6 | ||||
| 421 | C | 30.4 | Very low | 34.6 | Very low | 115 Ų | 115 | 146.8 Ų | 146.8 | 78% | 0.777 | 80% | 0.802 | S | S | * | * | trans | -121.5 | 99.8 | 160.2 | -79.1 | 0 | 0 | 0 | 0 | 108.5 | M419 | M419-C421 PolarHBondContact O-N 3.49Š| ||
| 422 | L | 34.3 | Very low | 35.2 | Very low | 151 Ų | 151 | 144.6 Ų | 144.6 | 79% | 0.791 | 80% | 0.804 | S | S | * | * | trans | -61.5 | 152.5 | 160.1 | -80 | 154.6 | 0 | 0 | 0 | 111.1 | ||||
| 423 | T | 32.9 | Very low | 34.4 | Very low | 122 Ų | 122 | 142.9 Ų | 142.9 | 75% | 0.748 | 80% | 0.803 | S | S | * | * | trans | 92.7 | 121.9 | 158 | 69.8 | 0 | 0 | 0 | 0 | 119 | ||||
| 424 | P | 41.9 | Very low | 34.7 | Very low | 121 Ų | 121 | 144.1 Ų | 144.1 | 79% | 0.786 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -85.8 | 137.5 | 164.4 | 33.7 | -28.6 | 0 | 0 | 0 | 110.5 | ||
| 425 | V | 33 | Very low | 34.5 | Very low | 132 Ų | 132 | 143.2 Ų | 143.2 | 80% | 0.8 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -82.6 | 119.1 | 173.7 | 170.9 | 0 | 0 | 0 | 0 | 109.7 | I427 | V425-I427 HydrophobicContact CG1-CG1 4.35Š|
| 426 | Y | 31.3 | Very low | 34.7 | Very low | 202 Ų | 202 | 143 Ų | 143 | 79% | 0.792 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 131.1 | 159.1 | -99.9 | -106 | 0 | 0 | 0 | 110.4 | ||
| 427 | I | 33.5 | Very low | 34.7 | Very low | 151 Ų | 151 | 142.1 Ų | 142.1 | 77% | 0.774 | 79% | 0.79 | S | S | * | * | trans | -127.3 | 105.7 | 145.8 | -64 | -177.8 | 0 | 0 | 0 | 107.7 | V425 | V425-I427 HydrophobicContact CG1-CG1 4.35Š| ||
| 428 | S | 31.3 | Very low | 34.6 | Very low | 101 Ų | 101 | 135.9 Ų | 135.9 | 71% | 0.706 | 78% | 0.781 | S | S | * | * | trans | -74 | 132.1 | 159.1 | -60.2 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 429 | S | 33.5 | Very low | 35 | Very low | 117 Ų | 117 | 137.6 Ų | 137.6 | 82% | 0.818 | 79% | 0.787 | S | S | * | * | trans | -129 | 143.2 | 151.9 | 53.8 | 0 | 0 | 0 | 0 | 109 | ||||
| 430 | S | 32.3 | Very low | 35.2 | Very low | 119 Ų | 119 | 133.4 Ų | 133.4 | 83% | 0.832 | 78% | 0.78 | S | S | * | * | trans | -86.4 | 151.5 | -156.5 | 41.1 | 0 | 0 | 0 | 0 | 115 | ||||
| 431 | L | 34.8 | Very low | 36.1 | Very low | 154 Ų | 154 | 130.9 Ų | 130.9 | 81% | 0.806 | 78% | 0.783 | S | S | * | * | trans | -44.9 | 162.7 | 168.4 | -114.3 | 89.9 | 0 | 0 | 0 | 115.3 | ||||
| 432 | P | 41.5 | Very low | 37 | Very low | 134 Ų | 134 | 128 Ų | 128 | 87% | 0.87 | 77% | 0.773 | S | S | * | * | -149.1 | 149.9 | 62.9 | 36.4 | -15 | 0 | 0 | 0 | 118.7 | |||||
| 433 | G | 30.1 | Very low | 37.8 | Very low | 57 Ų | 57 | 126.6 Ų | 126.6 | 59% | 0.588 | 77% | 0.773 | S | S | * | * | trans | 160.7 | 77.1 | 158.4 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 434 | I | 37.2 | Very low | 39 | Very low | 147 Ų | 147 | 124.6 Ų | 124.6 | 75% | 0.754 | 76% | 0.761 | S | S | * | * | trans | 67.6 | 89.5 | 135.6 | -56.4 | 162.2 | 0 | 0 | 0 | 118.1 | ||||
| 435 | H | 34.3 | Very low | 39.6 | Very low | 176 Ų | 176 | 123.7 Ų | 123.7 | 82% | 0.815 | 76% | 0.758 | S | S | * | * | 164.7 | 125.6 | 109.3 | -101.4 | -70.3 | 0 | 0 | 0 | 110.4 | |||||
| 436 | K | 38.2 | Very low | 40.9 | Very low | 182 Ų | 182 | 125.9 Ų | 125.9 | 79% | 0.791 | 75% | 0.752 | S | S | * | * | trans | -65.5 | 139.4 | 176.4 | -74.6 | 172.5 | 171.7 | 176.4 | 0 | 111.9 | ||||
| 437 | P | 36.2 | Very low | 42.6 | Very low | 125 Ų | 125 | 119.9 Ų | 119.9 | 81% | 0.812 | 73% | 0.733 | S | S | * | * | trans | -91.7 | 106.6 | 144.5 | 26.9 | -14.2 | 0 | 0 | 0 | 108.4 | S439 | P437-S439 PolarHBondContact O-N 2.98Š| ||
| 438 | C | 33.3 | Very low | 44.5 | Very low | 105 Ų | 105 | 116.8 Ų | 116.8 | 71% | 0.709 | 72% | 0.717 | S | S | * | * | trans | -79.2 | 99.9 | 168.3 | -91.4 | 0 | 0 | 0 | 0 | 109.1 | A440 | C438-A440 PolarHBondContact O-N 2.67Š| ||
| 439 | S | 46.3 | Very low | 46.7 | Very low | 124 Ų | 124 | 114.7 Ų | 114.7 | 87% | 0.867 | 70% | 0.7 | S | S | * | * | trans | -74.7 | 92.8 | 151.5 | 49.9 | 0 | 0 | 0 | 0 | 108.3 | P437 | P437-S439 PolarHBondContact O-N 2.98Š| ||
| 440 | A | 37.3 | Very low | 49 | Very low | 86 Ų | 86 | 116.5 Ų | 116.5 | 71% | 0.711 | 69% | 0.693 | S | S | * | * | trans | -133.1 | 89.6 | 162.8 | 0 | 0 | 0 | 0 | 0 | 107.4 | C438 G442 | C438-A440 PolarHBondContact O-N 2.67Å; A440-G442 PolarHBondContact O-N 2.97Å | ||
| 441 | S | 54.6 | Low | 51.3 | Low | 128 Ų | 128 | 115 Ų | 115 | 90% | 0.895 | 68% | 0.675 | S | S | * | * | trans | -71.3 | 76.9 | 164.3 | 58.4 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 442 | G | 48.8 | Very low | 53.5 | Low | 54 Ų | 54 | 110.3 Ų | 110.3 | 56% | 0.557 | 66% | 0.655 | S | S | * | * | P | Polyproline II helix | trans | -73.4 | 145.2 | 159.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | A440 | A440-G442 PolarHBondContact O-N 2.97Š|
| 443 | P | 52.6 | Low | 55.5 | Low | 122 Ų | 122 | 107.8 Ų | 107.8 | 79% | 0.792 | 64% | 0.637 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 140.5 | 174.3 | 24.6 | -31.4 | 0 | 0 | 0 | 109.4 | S445 | P443-S445 PolarHBondContact O-N 3.21Š|
| 444 | P | 56.3 | Low | 58.2 | Low | 79 Ų | 79 | 109.3 Ų | 109.3 | 51% | 0.513 | 63% | 0.631 | S | S | . | * | P | Polyproline II helix | trans | -60.7 | 136.7 | -173.7 | 24.4 | -33.7 | 0 | 0 | 0 | 110.5 | R446 T476 | P444-R446 PolarHBondContact O-N 3.47Å; P444-T476 HydrophobicContact CB-CG2 3.51Å; P444-T476 HydrophobicContact CG-CG2 3.39Å |
| 445 | S | 55.5 | Low | 60.4 | Low | 103 Ų | 103 | 106.4 Ų | 106.4 | 72% | 0.72 | 62% | 0.62 | S | S | * | * | trans | -58.8 | 107.6 | 178.2 | -51 | 0 | 0 | 0 | 0 | 109.9 | P443 | P443-S445 PolarHBondContact O-N 3.21Š| ||
| 446 | R | 59.8 | Low | 63.1 | Low | 177 Ų | 177 | 104.1 Ų | 104.1 | 67% | 0.668 | 61% | 0.608 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -79.6 | 123.9 | 177.2 | -70.4 | -179.1 | 169.4 | -178.2 | -2.9 | 109.2 | P444 Y474 | P444-R446 PolarHBondContact O-N 3.47Å; R446-Y474 HydrophobicContact CB-CD1 4.46Å |
| 447 | I | 68.1 | Low | 65.4 | Low | 76 Ų | 76 | 101.5 Ų | 101.5 | 39% | 0.39 | 60% | 0.598 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -89.2 | 121.6 | 173.7 | -59.9 | 175.2 | 0 | 0 | 0 | 107.1 | V449 I475 R477 | I447-V449 HydrophobicContact CG2-CG2 3.88Å; I447-V449 PolarHBondContact O-N 3.39Å; I447-I475 PolarHBondContact N-O 2.91Å; I447-I475 PolarHBondContact O-N 2.89Å; I447-R477 HydrophobicContact CD1-CB 4.15Å; I447-R477 HydrophobicContact CD1-CG 4.02Å |
| 448 | L | 72.7 | Confident | 67.8 | Low | 86 Ų | 86 | 100.5 Ų | 100.5 | 45% | 0.45 | 59% | 0.585 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -80.2 | 112.7 | 172.5 | 175.5 | 62.9 | 0 | 0 | 0 | 108.9 | P472 Y474 | L448-P472 HydrophobicContact CD1-CB 3.61Å; L448-Y474 HydrophobicContact CB-CD1 3.92Å; L448-Y474 HydrophobicContact CB-CE1 3.73Å; L448-Y474 HydrophobicContact CD1-CD1 3.83Å; L448-Y474 HydrophobicContact CD1-CD2 4.39Å; L448-Y474 HydrophobicContact CD1-CE1 3.45Å; L448-Y474 VanDerWaalsContact CD1-CE1 3.45Å; L448-Y474 HydrophobicContact CD1-CE2 4.05Å; L448-Y474 HydrophobicContact CD1-CG 4.29Å; L448-Y474 HydrophobicContact CD2-CE1 4.29Å; L448-Y474 HydrophobicContact CG-CD1 4.43Å; L448-Y474 HydrophobicContact CG-CE1 3.99Å |
| 449 | V | 76.6 | Confident | 69.9 | Low | 57 Ų | 57 | 102 Ų | 102 | 35% | 0.345 | 58% | 0.579 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -112.3 | 132.7 | 175.7 | -168.2 | 0 | 0 | 0 | 0 | 108.2 | I447 C473 I475 | I447-V449 HydrophobicContact CG2-CG2 3.88Å; I447-V449 PolarHBondContact O-N 3.39Å; V449-C473 PolarHBondContact N-O 2.86Å; V449-C473 PolarHBondContact O-N 3.19Å; V449-I475 HydrophobicContact CB-CD1 4.42Å; V449-I475 HydrophobicContact CG2-CD1 4.06Å; V449-I475 HydrophobicContact CG2-CG1 4.4Å |
| 450 | K | 83.1 | Confident | 71.6 | Confident | 155 Ų | 155 | 103.6 Ų | 103.6 | 67% | 0.674 | 58% | 0.578 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -93.3 | 113.3 | 174.8 | -70.2 | -177.3 | -178.7 | -179.9 | 0 | 108.3 | V470 | K450-V470 HydrophobicContact CB-CG1 3.76Å; K450-V470 HydrophobicContact CD-CG1 4.15Å; K450-V470 HydrophobicContact CG-CG1 4.25Å |
| 451 | I | 79.4 | Confident | 73.8 | Confident | 87 Ų | 87 | 103.1 Ų | 103.1 | 45% | 0.446 | 58% | 0.582 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -88.6 | 117.5 | 173.8 | -59.3 | 176.5 | 0 | 0 | 0 | 106.6 | V470 Q471 C473 | I451-V470 WeakPolarHBondContact O-CA 3.41Å; I451-Q471 PolarHBondContact N-O 3.21Å; I451-Q471 PolarHBondContact O-N 3.46Å; I451-C473 HydrophobicContact CD1-CB 3.93Å; I451-C473 HydrophobicContact CG1-CB 4.31Å |
| 452 | C | 82.5 | Confident | 74.9 | Confident | 56 Ų | 56 | 104.9 Ų | 104.9 | 38% | 0.378 | 57% | 0.574 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -102.7 | 117.6 | 177.7 | 174.1 | 0 | 0 | 0 | 0 | 109.2 | E468 V470 | C452-E468 WeakPolarHBondContact SG-CG 3.34Å; C452-E468 PolarHBondContact SG-OE1 3.05Å; C452-V470 HydrophobicContact CB-CG2 3.99Å |
| 453 | T | 83.1 | Confident | 76.8 | Confident | 81 Ų | 81 | 105.6 Ų | 105.6 | 50% | 0.497 | 57% | 0.567 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -107 | 117.8 | 175.4 | -54.9 | 0 | 0 | 0 | 0 | 108.3 | H469 | T453-H469 PolarHBondContact N-O 3.38Å; T453-H469 PolarHBondContact O-N 3.03Å |
| 454 | I | 86.1 | Confident | 78.4 | Confident | 90 Ų | 90 | 104.8 Ų | 104.8 | 46% | 0.462 | 56% | 0.555 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -106.1 | 111.4 | 177.9 | -55.9 | 172 | 0 | 0 | 0 | 108.2 | K456 H467 E468 | I454-K456 HydrophobicContact CG2-CG 4.09Å; I454-H467 CarbonylContact C-O 3.58Å; I454-H467 WeakPolarHBondContact CA-O 3.47Å; I454-E468 HydrophobicContact CG1-CB 4.29Å; I454-E468 HydrophobicContact CG1-CG 3.98Å |
| 455 | T | 84.1 | Confident | 79.6 | Confident | 85 Ų | 85 | 104 Ų | 104 | 52% | 0.521 | 55% | 0.551 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -92.4 | 125.8 | 170.8 | 43.8 | 0 | 0 | 0 | 0 | 109.3 | S466 H467 | T455-S466 CarbonylContact O-C 3.56Å; T455-S466 WeakPolarHBondContact O-CA 3.31Å; T455-H467 PolarHBondContact N-O 3.41Å; T455-H467 PolarHBondContact O-N 2.93Å; T455-H467 PolarHBondContact OG1-O 3.24Å |
| 456 | K | 89.6 | Confident | 81.1 | Confident | 129 Ų | 129 | 102.9 Ų | 102.9 | 56% | 0.561 | 54% | 0.543 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -115.6 | 128 | 176.9 | -68.1 | -175.4 | 179.3 | 179.4 | 0 | 109.1 | I454 V463 S465 | I454-K456 HydrophobicContact CG2-CG 4.09Å; K456-V463 HydrophobicContact CB-CG1 3.93Å; K456-V463 HydrophobicContact CB-CG2 4.49Å; K456-V463 HydrophobicContact CD-CG1 4.12Å; K456-V463 HydrophobicContact CD-CG2 4.1Å; K456-V463 HydrophobicContact CG-CG1 4.1Å; K456-S465 WeakPolarHBondContact CA-O 3.47Å |
| 457 | E | 86.7 | Confident | 82.4 | Confident | 127 Ų | 127 | 100.1 Ų | 100.1 | 59% | 0.593 | 54% | 0.538 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -95 | 124.7 | 172.5 | -156.6 | 173.7 | -162.4 | 0 | 0 | 108.4 | V463 I464 S465 | E457-V463 CarbonylContact O-C 3.59Å; E457-V463 WeakPolarHBondContact O-CA 3.38Å; E457-I464 HydrophobicContact CB-CG1 4.29Å; E457-I464 HydrophobicContact CG-CD1 4.36Å; E457-I464 HydrophobicContact CG-CG1 4.49Å; E457-I464 VanDerWaalsContact O-CG1 3.22Å; E457-I464 WeakPolarHBondContact O-CG1 3.39Å; E457-I464 PolarHBondContact O-N 3.26Å; E457-S465 PolarHBondContact N-O 2.74Å; E457-S465 PolarHBondContact O-N 2.98Å |
| 458 | I | 87.8 | Confident | 83.6 | Confident | 104 Ų | 104 | 102.1 Ų | 102.1 | 53% | 0.533 | 55% | 0.546 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.4 | 125.8 | -172.1 | -52.1 | -178.4 | 0 | 0 | 0 | 108.5 | K462 V463 | I458-K462 WeakPolarHBondContact CA-O 3.49Å; I458-V463 HydrophobicContact CD1-CG2 4.16Å; I458-V463 HydrophobicContact CG1-CG2 3.95Å |
| 459 | K | 76.9 | Confident | 84.1 | Confident | 135 Ų | 135 | 103.2 Ų | 103.2 | 59% | 0.587 | 55% | 0.548 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -127.8 | 132.6 | 172.3 | -164 | 177.4 | 179.3 | 179.8 | 0 | 108.9 | G461 K462 I464 | K459-G461 PolarHBondContact O-N 3.02Å; K459-K462 PolarHBondContact N-O 2.94Å; K459-K462 PolarHBondContact O-N 3.46Å; K459-K462 VanDerWaalsContact O-O 3.12Å; K459-I464 HydrophobicContact CB-CD1 3.77Å; K459-I464 HydrophobicContact CB-CG1 4.31Å; K459-I464 HydrophobicContact CB-CG2 4.41Å |
| 460 | D | 81.8 | Confident | 84.7 | Confident | 158 Ų | 158 | 103.5 Ų | 103.5 | 85% | 0.845 | 55% | 0.55 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.5 | 37.3 | -178.1 | -51 | -41.1 | 0 | 0 | 0 | 113.8 | K462 | D460-K462 VanDerWaalsContact C-N 3.25Å; D460-K462 PolarHBondContact O-N 2.98Å |
| 461 | G | 83.6 | Confident | 84.7 | Confident | 77 Ų | 77 | 102 Ų | 102 | 79% | 0.794 | 55% | 0.545 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 76.1 | 3.6 | 179.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | K459 | K459-G461 PolarHBondContact O-N 3.02Š|
| 462 | K | 77.6 | Confident | 84.8 | Confident | 165 Ų | 165 | 101.3 Ų | 101.3 | 72% | 0.717 | 55% | 0.546 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -115.7 | 132.4 | 177.1 | -154.8 | 172.5 | -176.3 | 179.7 | 0 | 111 | I458 K459 D460 I464 | I458-K462 WeakPolarHBondContact CA-O 3.49Å; K459-K462 PolarHBondContact N-O 2.94Å; K459-K462 PolarHBondContact O-N 3.46Å; K459-K462 VanDerWaalsContact O-O 3.12Å; D460-K462 VanDerWaalsContact C-N 3.25Å; D460-K462 PolarHBondContact O-N 2.98Å; K462-I464 PolarHBondContact O-N 2.98Å |
| 463 | V | 87.9 | Confident | 84.6 | Confident | 69 Ų | 69 | 101.3 Ų | 101.3 | 42% | 0.418 | 55% | 0.546 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -68.6 | 114.4 | 176.4 | -179 | 0 | 0 | 0 | 0 | 108 | K456 E457 I458 S465 | K456-V463 HydrophobicContact CB-CG1 3.93Å; K456-V463 HydrophobicContact CB-CG2 4.49Å; K456-V463 HydrophobicContact CD-CG1 4.12Å; K456-V463 HydrophobicContact CD-CG2 4.1Å; K456-V463 HydrophobicContact CG-CG1 4.1Å; E457-V463 CarbonylContact O-C 3.59Å; E457-V463 WeakPolarHBondContact O-CA 3.38Å; I458-V463 HydrophobicContact CD1-CG2 4.16Å; I458-V463 HydrophobicContact CG1-CG2 3.95Å; V463-S465 WeakPolarHBondContact CG1-O 3.18Å |
| 464 | I | 88.1 | Confident | 84.3 | Confident | 105 Ų | 105 | 104.1 Ų | 104.1 | 54% | 0.538 | 55% | 0.549 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.3 | -23.7 | -178.2 | 47.4 | 164.9 | 0 | 0 | 0 | 112.3 | E457 K459 K462 | E457-I464 HydrophobicContact CB-CG1 4.29Å; E457-I464 HydrophobicContact CG-CD1 4.36Å; E457-I464 HydrophobicContact CG-CG1 4.49Å; E457-I464 VanDerWaalsContact O-CG1 3.22Å; E457-I464 WeakPolarHBondContact O-CG1 3.39Å; E457-I464 PolarHBondContact O-N 3.26Å; K459-I464 HydrophobicContact CB-CD1 3.77Å; K459-I464 HydrophobicContact CB-CG1 4.31Å; K459-I464 HydrophobicContact CB-CG2 4.41Å; K462-I464 PolarHBondContact O-N 2.98Å |
| 465 | S | 81.7 | Confident | 83.8 | Confident | 63 Ų | 63 | 104.2 Ų | 104.2 | 44% | 0.441 | 55% | 0.549 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -151.8 | 144.1 | 176 | -177.4 | 0 | 0 | 0 | 0 | 110.5 | K456 E457 V463 | K456-S465 WeakPolarHBondContact CA-O 3.47Å; E457-S465 PolarHBondContact N-O 2.74Å; E457-S465 PolarHBondContact O-N 2.98Å; V463-S465 WeakPolarHBondContact CG1-O 3.18Å |
| 466 | S | 86.3 | Confident | 82.6 | Confident | 79 Ų | 79 | 103.4 Ų | 103.4 | 55% | 0.552 | 54% | 0.544 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -134.6 | 125.6 | 172.1 | 69.2 | 0 | 0 | 0 | 0 | 110.6 | T455 | T455-S466 CarbonylContact O-C 3.56Å; T455-S466 WeakPolarHBondContact O-CA 3.31Å |
| 467 | H | 87.6 | Confident | 81.2 | Confident | 118 Ų | 118 | 105.6 Ų | 105.6 | 55% | 0.546 | 55% | 0.549 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.6 | 129.9 | 175.8 | -171.7 | 65.8 | 0 | 0 | 0 | 110 | I454 T455 | I454-H467 CarbonylContact C-O 3.58Å; I454-H467 WeakPolarHBondContact CA-O 3.47Å; T455-H467 PolarHBondContact N-O 3.41Å; T455-H467 PolarHBondContact O-N 2.93Å; T455-H467 PolarHBondContact OG1-O 3.24Å |
| 468 | E | 91.6 | Very high | 79.6 | Confident | 119 Ų | 119 | 105 Ų | 105 | 56% | 0.556 | 56% | 0.556 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -110.8 | 119.3 | -178.9 | -178.1 | 173.1 | 173.6 | 0 | 0 | 109.2 | C452 I454 V470 | C452-E468 WeakPolarHBondContact SG-CG 3.34Å; C452-E468 PolarHBondContact SG-OE1 3.05Å; I454-E468 HydrophobicContact CG1-CB 4.29Å; I454-E468 HydrophobicContact CG1-CG 3.98Å; E468-V470 HydrophobicContact CG-CG2 4.11Å |
| 469 | H | 85.1 | Confident | 77.9 | Confident | 108 Ų | 108 | 104.5 Ų | 104.5 | 50% | 0.5 | 57% | 0.568 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -116.5 | 120 | 175 | -170.4 | 70.5 | 0 | 0 | 0 | 110.1 | T453 | T453-H469 PolarHBondContact N-O 3.38Å; T453-H469 PolarHBondContact O-N 3.03Å |
| 470 | V | 87.7 | Confident | 76.4 | Confident | 63 Ų | 63 | 107.8 Ų | 107.8 | 38% | 0.382 | 58% | 0.582 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -109.9 | 113.1 | -178.2 | -174.5 | 0 | 0 | 0 | 0 | 109.5 | K450 I451 C452 E468 | K450-V470 HydrophobicContact CB-CG1 3.76Å; K450-V470 HydrophobicContact CD-CG1 4.15Å; K450-V470 HydrophobicContact CG-CG1 4.25Å; I451-V470 WeakPolarHBondContact O-CA 3.41Å; C452-V470 HydrophobicContact CB-CG2 3.99Å; E468-V470 HydrophobicContact CG-CG2 4.11Å |
| 471 | Q | 84.8 | Confident | 74.6 | Confident | 124 Ų | 124 | 110.1 Ų | 110.1 | 58% | 0.579 | 60% | 0.601 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -107.8 | 128 | 177.7 | -168 | 174.9 | -13.5 | 0 | 0 | 110.8 | I451 C473 | I451-Q471 PolarHBondContact N-O 3.21Å; I451-Q471 PolarHBondContact O-N 3.46Å; Q471-C473 PolarHBondContact O-N 3.49Å |
| 472 | P | 80.4 | Confident | 74.1 | Confident | 73 Ų | 73 | 111.8 Ų | 111.8 | 47% | 0.474 | 59% | 0.592 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -72.3 | 126.6 | 172.3 | 27.2 | -30.2 | 0 | 0 | 0 | 110.2 | L448 | L448-P472 HydrophobicContact CD1-CB 3.61Å |
| 473 | C | 78.4 | Confident | 73.9 | Confident | 56 Ų | 56 | 108.9 Ų | 108.9 | 38% | 0.378 | 59% | 0.585 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -125.5 | 132.6 | 176.6 | -151.8 | 0 | 0 | 0 | 0 | 109.7 | V449 I451 Q471 | V449-C473 PolarHBondContact N-O 2.86Å; V449-C473 PolarHBondContact O-N 3.19Å; I451-C473 HydrophobicContact CD1-CB 3.93Å; I451-C473 HydrophobicContact CG1-CB 4.31Å; Q471-C473 PolarHBondContact O-N 3.49Å |
| 474 | Y | 77.8 | Confident | 73.2 | Confident | 140 Ų | 140 | 111.2 Ų | 111.2 | 55% | 0.549 | 59% | 0.594 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -100 | 114.7 | -179.9 | -64.2 | -84.8 | 0 | 0 | 0 | 109.3 | R446 L448 | R446-Y474 HydrophobicContact CB-CD1 4.46Å; L448-Y474 HydrophobicContact CB-CD1 3.92Å; L448-Y474 HydrophobicContact CB-CE1 3.73Å; L448-Y474 HydrophobicContact CD1-CD1 3.83Å; L448-Y474 HydrophobicContact CD1-CD2 4.39Å; L448-Y474 HydrophobicContact CD1-CE1 3.45Å; L448-Y474 VanDerWaalsContact CD1-CE1 3.45Å; L448-Y474 HydrophobicContact CD1-CE2 4.05Å; L448-Y474 HydrophobicContact CD1-CG 4.29Å; L448-Y474 HydrophobicContact CD2-CE1 4.29Å; L448-Y474 HydrophobicContact CG-CD1 4.43Å; L448-Y474 HydrophobicContact CG-CE1 3.99Å |
| 475 | I | 73.9 | Confident | 72.3 | Confident | 92 Ų | 92 | 111.5 Ų | 111.5 | 47% | 0.472 | 60% | 0.598 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -103.7 | 127.3 | 178.7 | -53.4 | 177.8 | 0 | 0 | 0 | 108.2 | I447 V449 R477 | I447-I475 PolarHBondContact N-O 2.91Å; I447-I475 PolarHBondContact O-N 2.89Å; V449-I475 HydrophobicContact CB-CD1 4.42Å; V449-I475 HydrophobicContact CG2-CD1 4.06Å; V449-I475 HydrophobicContact CG2-CG1 4.4Å; I475-R477 PolarHBondContact O-N 3.17Å |
| 476 | T | 60 | Low | 71.7 | Confident | 68 Ų | 68 | 114.6 Ų | 114.6 | 42% | 0.417 | 61% | 0.608 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -80.2 | 118.2 | 177 | -43.3 | 0 | 0 | 0 | 0 | 108.4 | P444 P478 | P444-T476 HydrophobicContact CB-CG2 3.51Å; P444-T476 HydrophobicContact CG-CG2 3.39Å; T476-P478 WeakPolarHBondContact O-CD 3.43Å |
| 477 | R | 60.1 | Low | 70.7 | Confident | 174 Ų | 174 | 116.9 Ų | 116.9 | 66% | 0.657 | 61% | 0.611 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 123.2 | 179.2 | -152.4 | -175.1 | -161.9 | 167.8 | 1.9 | 108.7 | I447 I475 A479 | I447-R477 HydrophobicContact CD1-CB 4.15Å; I447-R477 HydrophobicContact CD1-CG 4.02Å; I475-R477 PolarHBondContact O-N 3.17Å; R477-A479 PolarHBondContact O-N 3.06Å |
| 478 | P | 53.1 | Low | 69.5 | Low | 114 Ų | 114 | 116.9 Ų | 116.9 | 74% | 0.74 | 62% | 0.616 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 135 | 169.5 | 25.2 | -29.9 | 0 | 0 | 0 | 108.4 | T476 K480 | T476-P478 WeakPolarHBondContact O-CD 3.43Å; P478-K480 PolarHBondContact O-N 2.9Å; P478-K480 VanDerWaalsContact O-N 3.16Å |
| 479 | A | 51.5 | Low | 67.8 | Low | 94 Ų | 94 | 116.7 Ų | 116.7 | 78% | 0.777 | 62% | 0.621 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 120.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 108.5 | R477 V481 | R477-A479 PolarHBondContact O-N 3.06Å; A479-V481 PolarHBondContact O-N 2.83Å |
| 480 | K | 46.6 | Very low | 66.4 | Low | 204 Ų | 204 | 117.4 Ų | 117.4 | 89% | 0.887 | 63% | 0.631 | S | S | * | * | trans | -66.6 | 113.8 | 175.7 | -133.5 | -179.6 | -177.1 | -171.9 | 0 | 106.9 | P478 | P478-K480 PolarHBondContact O-N 2.9Å; P478-K480 VanDerWaalsContact O-N 3.16Å | ||
| 481 | V | 42.6 | Very low | 64.5 | Low | 207 Ų | 207 | 122.4 Ų | 122.4 | 100% | 1.255 | 65% | 0.653 | S | S | * | * | trans | -98.7 | 0 | 163.4 | -179.6 | 0 | 0 | 0 | 0 | 107.3 | A479 | A479-V481 PolarHBondContact O-N 2.83Š|
Retrieved 481 of 481 residues in 170.2 ms
(Link to these results)