| 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 | 43.6 | Very low | 41.2 | Very low | 237 Ų | 237 | 136.5 Ų | 136.5 | 100% | 1.167 | 80% | 0.798 | S | S | * | * | 0 | 96.2 | 0 | -57.1 | 175.2 | -174.2 | 0 | 0 | 105.2 | |||||
| 2 | A | 39.7 | Very low | 41 | Very low | 89 Ų | 89 | 142.8 Ų | 142.8 | 74% | 0.736 | 80% | 0.801 | S | S | * | * | 44.1 | 121.2 | 72.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 3 | L | 41.1 | Very low | 40.5 | Very low | 147 Ų | 147 | 145.4 Ų | 145.4 | 77% | 0.77 | 79% | 0.792 | S | S | * | * | -162.4 | 146.5 | 59.2 | -69.7 | 160.2 | 0 | 0 | 0 | 108.6 | |||||
| 4 | Q | 47.1 | Very low | 40 | Very low | 155 Ų | 155 | 144.1 Ų | 144.1 | 72% | 0.724 | 78% | 0.778 | S | S | * | * | 58.7 | 131.3 | 70.3 | -93.5 | 171.9 | -23 | 0 | 0 | 112.3 | |||||
| 5 | L | 43 | Very low | 39.3 | Very low | 128 Ų | 128 | 140.4 Ų | 140.4 | 67% | 0.67 | 77% | 0.767 | S | S | * | * | cis | -172.8 | 159.9 | 30.7 | -90.9 | 143.5 | 0 | 0 | 0 | 111.1 | ||||
| 6 | R | 42.1 | Very low | 38.9 | Very low | 215 Ų | 215 | 136.7 Ų | 136.7 | 81% | 0.811 | 76% | 0.761 | S | S | * | * | trans | 57.7 | 128 | 134.4 | -74.8 | 179.1 | 155.6 | -176.9 | -15.3 | 121.7 | ||||
| 7 | S | 41.1 | Very low | 38.7 | Very low | 120 Ų | 120 | 138.8 Ų | 138.8 | 84% | 0.839 | 76% | 0.764 | S | S | * | * | 88.3 | 136 | 60.2 | -59.6 | 0 | 0 | 0 | 0 | 114.2 | |||||
| 8 | G | 38.2 | Very low | 38.5 | Very low | 64 Ų | 64 | 141.9 Ų | 141.9 | 66% | 0.66 | 76% | 0.764 | S | S | * | * | trans | 113.8 | 133.7 | 163.5 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 9 | D | 39.6 | Very low | 38.4 | Very low | 161 Ų | 161 | 140.8 Ų | 140.8 | 86% | 0.861 | 77% | 0.767 | S | S | * | * | cis | -169.1 | 132.3 | 4 | -98 | -46.2 | 0 | 0 | 0 | 104.7 | ||||
| 10 | A | 36.4 | Very low | 38.2 | Very low | 90 Ų | 90 | 143.1 Ų | 143.1 | 74% | 0.744 | 76% | 0.764 | S | S | * | * | 97.1 | 152.6 | 87.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 11 | A | 41.2 | Very low | 37.9 | Very low | 96 Ų | 96 | 142.4 Ų | 142.4 | 79% | 0.793 | 76% | 0.76 | S | S | * | * | trans | 83.8 | 131.4 | 170.1 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 12 | Y | 38.7 | Very low | 37.5 | Very low | 212 Ų | 212 | 141.7 Ų | 141.7 | 83% | 0.831 | 75% | 0.746 | S | S | * | * | cis | -174.4 | 142 | -11.8 | -159.2 | -111.6 | 0 | 0 | 0 | 104.7 | ||||
| 13 | Y | 35.5 | Very low | 37.4 | Very low | 176 Ų | 176 | 143.1 Ų | 143.1 | 69% | 0.69 | 75% | 0.746 | S | S | * | * | trans | 21.1 | 141.9 | 141 | -117.5 | -144.5 | 0 | 0 | 0 | 119.6 | ||||
| 14 | Q | 32.2 | Very low | 37.3 | Very low | 128 Ų | 128 | 141.3 Ų | 141.3 | 60% | 0.598 | 75% | 0.746 | S | S | * | * | cis | -175.8 | 147.7 | 37.8 | 175.8 | 97.8 | 84.5 | 0 | 0 | 109 | ||||
| 15 | S | 30.9 | Very low | 37.5 | Very low | 88 Ų | 88 | 139.6 Ų | 139.6 | 62% | 0.615 | 75% | 0.748 | S | S | * | * | trans | -49.7 | 162.6 | 167.2 | 55.6 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 16 | A | 32 | Very low | 37.9 | Very low | 81 Ų | 81 | 139.2 Ų | 139.2 | 67% | 0.669 | 75% | 0.753 | S | S | * | * | trans | 98.3 | 142.4 | 131.1 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 17 | E | 35.5 | Very low | 37.8 | Very low | 172 Ų | 172 | 136.3 Ų | 136.3 | 80% | 0.804 | 76% | 0.759 | S | S | * | * | trans | 66.6 | 102.4 | 154.9 | -51.8 | -61.6 | 112.4 | 0 | 0 | 119.6 | ||||
| 18 | Y | 35.4 | Very low | 37.5 | Very low | 195 Ų | 195 | 133.9 Ų | 133.9 | 77% | 0.765 | 75% | 0.753 | S | S | * | * | -157.1 | 89.2 | 128.5 | -155.4 | -103.7 | 0 | 0 | 0 | 112.3 | R20 | Y18-R20 HydrophobicContact CE1-CB 3.81Š| |||
| 19 | C | 37 | Very low | 37.4 | Very low | 122 Ų | 122 | 142 Ų | 142 | 82% | 0.824 | 77% | 0.765 | S | S | * | * | trans | -84.1 | 122.4 | 151.9 | -83.2 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 20 | R | 33.3 | Very low | 37.1 | Very low | 185 Ų | 185 | 139.7 Ų | 139.7 | 70% | 0.698 | 76% | 0.761 | S | S | * | * | trans | -163.6 | 115.2 | 147.7 | -114.5 | -172.1 | 177.2 | 159.4 | 0.5 | 113.3 | Y18 | Y18-R20 HydrophobicContact CE1-CB 3.81Š| ||
| 21 | N | 32.8 | Very low | 37 | Very low | 129 Ų | 129 | 141.4 Ų | 141.4 | 69% | 0.69 | 76% | 0.758 | S | S | * | * | trans | 52 | 120.9 | 133.6 | -63.2 | -19.1 | 0 | 0 | 0 | 120.5 | ||||
| 22 | Y | 35 | Very low | 36.6 | Very low | 223 Ų | 223 | 142.4 Ų | 142.4 | 88% | 0.875 | 76% | 0.76 | S | S | * | * | -170.7 | 90.6 | 127.2 | -113.3 | -84.1 | 0 | 0 | 0 | 107.7 | |||||
| 23 | T | 36.8 | Very low | 36.6 | Very low | 118 Ų | 118 | 136.3 Ų | 136.3 | 72% | 0.724 | 75% | 0.748 | S | S | * | * | 66.9 | 98.3 | 95.8 | -51.1 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 24 | S | 40.1 | Very low | 36.8 | Very low | 110 Ų | 110 | 136 Ų | 136 | 77% | 0.769 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 146.3 | 161.6 | -56.8 | 0 | 0 | 0 | 0 | 111.1 | ||
| 25 | P | 50.3 | Low | 36.9 | Very low | 118 Ų | 118 | 141 Ų | 141 | 77% | 0.766 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -93.4 | 144.1 | 161.4 | 32.3 | -27.6 | 0 | 0 | 0 | 112.1 | ||
| 26 | P | 52 | Low | 37.1 | Very low | 121 Ų | 121 | 144.8 Ų | 144.8 | 79% | 0.786 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -103.6 | 140.8 | 168.1 | 36.6 | -26.7 | 0 | 0 | 0 | 111.4 | ||
| 27 | V | 40.3 | Very low | 37.3 | Very low | 153 Ų | 153 | 145.6 Ų | 145.6 | 93% | 0.927 | 79% | 0.786 | S | S | * | * | trans | -163.3 | 136.5 | 163.1 | -115.5 | 0 | 0 | 0 | 0 | 106 | ||||
| 28 | G | 34.6 | Very low | 37.3 | Very low | 70 Ų | 70 | 148.7 Ų | 148.7 | 72% | 0.722 | 79% | 0.791 | S | S | * | * | cis | 157 | 124.4 | 9 | 0 | 0 | 0 | 0 | 0 | 105 | ||||
| 29 | Y | 36.3 | Very low | 37.5 | Very low | 235 Ų | 235 | 147 Ų | 147 | 92% | 0.922 | 79% | 0.794 | S | S | * | * | trans | -80.4 | 125.2 | -179.5 | -174.3 | -92 | 0 | 0 | 0 | 109.4 | ||||
| 30 | S | 33 | Very low | 37.7 | Very low | 111 Ų | 111 | 146.7 Ų | 146.7 | 78% | 0.776 | 79% | 0.791 | S | S | * | * | trans | -156.6 | 112.6 | 160.9 | 60.1 | 0 | 0 | 0 | 0 | 112 | ||||
| 31 | D | 34.2 | Very low | 38 | Very low | 126 Ų | 126 | 141.5 Ų | 141.5 | 67% | 0.674 | 79% | 0.794 | S | S | * | * | trans | -30.2 | 137.6 | 149.7 | -177.7 | 29.1 | 0 | 0 | 0 | 115.1 | ||||
| 32 | S | 33.3 | Very low | 39 | Very low | 118 Ų | 118 | 141.3 Ų | 141.3 | 83% | 0.825 | 80% | 0.8 | S | S | * | * | trans | -177.3 | 115.2 | 136.7 | -84.5 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 33 | S | 37.1 | Very low | 39 | Very low | 84 Ų | 84 | 138.5 Ų | 138.5 | 59% | 0.587 | 80% | 0.8 | S | S | * | * | trans | -58.2 | 165.6 | 160.8 | -55.3 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 34 | H | 40.5 | Very low | 38.9 | Very low | 168 Ų | 168 | 137 Ų | 137 | 78% | 0.778 | 80% | 0.799 | S | S | * | * | trans | 82 | 101 | 165.1 | -51.4 | -77.8 | 0 | 0 | 0 | 117.8 | ||||
| 35 | Y | 33.8 | Very low | 38.7 | Very low | 234 Ų | 234 | 140.3 Ų | 140.3 | 92% | 0.918 | 81% | 0.805 | S | S | * | * | trans | -146.1 | 101.5 | 132.3 | -113 | -84.8 | 0 | 0 | 0 | 109.6 | ||||
| 36 | L | 35.9 | Very low | 38 | Very low | 168 Ų | 168 | 143 Ų | 143 | 88% | 0.88 | 81% | 0.812 | S | S | * | * | trans | -78 | 126 | 160.1 | -75.9 | 173 | 0 | 0 | 0 | 107.8 | ||||
| 37 | A | 35 | Very low | 37.3 | Very low | 97 Ų | 97 | 146.6 Ų | 146.6 | 80% | 0.802 | 82% | 0.815 | S | S | * | * | trans | -121.3 | 97.7 | 161.8 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 38 | R | 36.1 | Very low | 38 | Very low | 237 Ų | 237 | 144.5 Ų | 144.5 | 89% | 0.894 | 81% | 0.805 | S | S | * | * | trans | -72.2 | 127.8 | 168.1 | 166.9 | 172.6 | -85.2 | -173.9 | -7.7 | 108.5 | ||||
| 39 | L | 39.1 | Very low | 38.7 | Very low | 161 Ų | 161 | 147 Ų | 147 | 84% | 0.843 | 81% | 0.809 | S | S | * | * | trans | -129.6 | 150.3 | 160.1 | -73.8 | 179.4 | 0 | 0 | 0 | 110.6 | ||||
| 40 | P | 42.7 | Very low | 38.7 | Very low | 115 Ų | 115 | 143.5 Ų | 143.5 | 75% | 0.747 | 81% | 0.805 | S | S | * | * | trans | -96.4 | 143.6 | -155.5 | 5.4 | 16.5 | 0 | 0 | 0 | 112.1 | ||||
| 41 | G | 38.3 | Very low | 38.9 | Very low | 75 Ų | 75 | 143.3 Ų | 143.3 | 77% | 0.773 | 80% | 0.804 | S | S | * | * | trans | -77.9 | 166.9 | 165.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 42 | P | 55.2 | Low | 39 | Very low | 126 Ų | 126 | 144.3 Ų | 144.3 | 82% | 0.818 | 81% | 0.808 | S | S | * | * | trans | -123.6 | 129.3 | 147.4 | 31.5 | -19.2 | 0 | 0 | 0 | 112.1 | ||||
| 43 | D | 34.7 | Very low | 39.2 | Very low | 164 Ų | 164 | 146.9 Ų | 146.9 | 88% | 0.877 | 81% | 0.805 | S | S | * | * | trans | -52.1 | 146.1 | 156.4 | -83 | -84.3 | 0 | 0 | 0 | 112.3 | ||||
| 44 | A | 35.5 | Very low | 39.2 | Very low | 85 Ų | 85 | 147.1 Ų | 147.1 | 70% | 0.702 | 81% | 0.806 | S | S | * | * | -178 | 116.3 | 117.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | |||||
| 45 | M | 34.9 | Very low | 39 | Very low | 180 Ų | 180 | 147.5 Ų | 147.5 | 89% | 0.887 | 81% | 0.808 | S | S | * | * | trans | 56.2 | 120.7 | 131.7 | -55.5 | -143 | 122.5 | 0 | 0 | 119.4 | ||||
| 46 | L | 36.1 | Very low | 39.7 | Very low | 176 Ų | 176 | 141.4 Ų | 141.4 | 92% | 0.921 | 80% | 0.797 | S | S | * | * | -166 | 124.1 | 110.9 | -92.3 | 164.5 | 0 | 0 | 0 | 109.9 | |||||
| 47 | K | 36.9 | Very low | 39.6 | Very low | 195 Ų | 195 | 140.7 Ų | 140.7 | 85% | 0.848 | 79% | 0.789 | S | S | * | * | trans | -133.9 | 165.9 | 166.9 | -109.4 | 165.2 | 171.8 | 166.6 | 0 | 104.7 | ||||
| 48 | P | 55.6 | Low | 39.9 | Very low | 110 Ų | 110 | 142.9 Ų | 142.9 | 71% | 0.714 | 78% | 0.783 | S | S | * | * | cis | -129.2 | -152.3 | -31.7 | 36 | -13.4 | 0 | 0 | 0 | 108.6 | ||||
| 49 | P | 47.7 | Very low | 40.3 | Very low | 123 Ų | 123 | 136.6 Ų | 136.6 | 80% | 0.799 | 77% | 0.773 | S | S | * | * | -138.6 | 146.3 | 62.4 | 29.1 | -6.9 | 0 | 0 | 0 | 115.6 | |||||
| 50 | L | 37.6 | Very low | 40 | Very low | 161 Ų | 161 | 139.4 Ų | 139.4 | 84% | 0.843 | 78% | 0.779 | S | S | * | * | trans | -93.7 | 145.3 | 152.8 | -73.4 | 174.1 | 0 | 0 | 0 | 108.6 | ||||
| 51 | S | 36.6 | Very low | 40 | Very low | 107 Ų | 107 | 144.4 Ų | 144.4 | 75% | 0.748 | 78% | 0.783 | S | S | * | * | trans | 169 | 121.9 | 133.2 | -71 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 52 | L | 37 | Very low | 40.7 | Very low | 146 Ų | 146 | 146.1 Ų | 146.1 | 76% | 0.764 | 78% | 0.78 | S | S | * | * | 169.5 | 139.7 | 98.7 | -83.7 | 162.4 | 0 | 0 | 0 | 104.6 | |||||
| 53 | F | 38 | Very low | 40.4 | Very low | 173 Ų | 173 | 146.4 Ų | 146.4 | 76% | 0.759 | 78% | 0.782 | S | S | * | * | cis | -163 | 134.3 | 34.3 | -118.4 | -79.1 | 0 | 0 | 0 | 109.4 | ||||
| 54 | S | 35.6 | Very low | 40.8 | Very low | 88 Ų | 88 | 147.1 Ų | 147.1 | 62% | 0.615 | 78% | 0.779 | S | S | * | * | trans | 44.9 | 114.7 | 135.2 | 65.2 | 0 | 0 | 0 | 0 | 124.8 | ||||
| 55 | H | 37 | Very low | 41.3 | Very low | 177 Ų | 177 | 150.6 Ų | 150.6 | 82% | 0.819 | 79% | 0.785 | S | S | * | * | 18.8 | 163 | 119.2 | -75.3 | 94 | 0 | 0 | 0 | 121.7 | |||||
| 56 | P | 47.4 | Very low | 42.1 | Very low | 106 Ų | 106 | 147.5 Ų | 147.5 | 69% | 0.688 | 78% | 0.779 | S | S | * | * | cis | -141.3 | 164.5 | -4.9 | 19.8 | 7.5 | 0 | 0 | 0 | 118.3 | ||||
| 57 | Q | 35.6 | Very low | 42.6 | Very low | 152 Ų | 152 | 144.9 Ų | 144.9 | 71% | 0.71 | 77% | 0.772 | S | S | * | * | trans | 66.9 | 115.3 | 135.8 | -58.3 | -82.1 | 24.8 | 0 | 0 | 124.6 | ||||
| 58 | Q | 40.3 | Very low | 42.6 | Very low | 144 Ų | 144 | 140.1 Ų | 140.1 | 67% | 0.673 | 77% | 0.769 | S | S | * | * | trans | 75.8 | 174 | 130.8 | -55.2 | -72.4 | -0.4 | 0 | 0 | 120.2 | ||||
| 59 | P | 44.1 | Very low | 42 | Very low | 105 Ų | 105 | 144.3 Ų | 144.3 | 68% | 0.682 | 78% | 0.779 | S | S | * | * | -124.8 | 137.7 | -82.4 | 33.6 | -15.5 | 0 | 0 | 0 | 112.1 | R61 | P59-R61 PolarHBondContact O-N 3.13Š| |||
| 60 | F | 33.3 | Very low | 41.8 | Very low | 220 Ų | 220 | 142.8 Ų | 142.8 | 97% | 0.965 | 78% | 0.778 | S | S | * | * | trans | -90.8 | 105.9 | 178.7 | -82.9 | -81.5 | 0 | 0 | 0 | 113.1 | ||||
| 61 | R | 43.7 | Very low | 41.8 | Very low | 220 Ų | 220 | 142.9 Ų | 142.9 | 83% | 0.83 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -76.7 | 151.5 | 163.1 | -174.7 | 176.6 | -175 | 177.5 | 2.8 | 109.9 | P59 | P59-R61 PolarHBondContact O-N 3.13Š|
| 62 | P | 52.3 | Low | 42.6 | Very low | 111 Ų | 111 | 143.8 Ų | 143.8 | 72% | 0.721 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -78.9 | 149.4 | -178.8 | 16.1 | -4.9 | 0 | 0 | 0 | 111.8 | ||
| 63 | P | 48.9 | Very low | 43.6 | Very low | 131 Ų | 131 | 142.1 Ų | 142.1 | 85% | 0.851 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -80.1 | 140.5 | 177.6 | 31 | -30.2 | 0 | 0 | 0 | 112 | ||
| 64 | H | 42.8 | Very low | 44.5 | Very low | 179 Ų | 179 | 139.5 Ų | 139.5 | 83% | 0.829 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -82.3 | 151 | -177.7 | -147.8 | -98.5 | 0 | 0 | 0 | 111 | ||
| 65 | L | 45.9 | Very low | 45.5 | Very low | 158 Ų | 158 | 141.4 Ų | 141.4 | 83% | 0.827 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 153.4 | 168.6 | -69.2 | 162.4 | 0 | 0 | 0 | 112.3 | ||
| 66 | P | 52.6 | Low | 46.2 | Very low | 116 Ų | 116 | 140.1 Ų | 140.1 | 75% | 0.753 | 79% | 0.792 | S | S | * | * | trans | -124.5 | 169.1 | 144.7 | 36.3 | -22.9 | 0 | 0 | 0 | 113 | ||||
| 67 | P | 46.6 | Very low | 46.3 | Very low | 120 Ų | 120 | 139.4 Ų | 139.4 | 78% | 0.779 | 79% | 0.794 | S | S | * | * | trans | -108.6 | 159.8 | -141.6 | 39.3 | -33.4 | 0 | 0 | 0 | 116.8 | ||||
| 68 | A | 37.2 | Very low | 47 | Very low | 95 Ų | 95 | 138.3 Ų | 138.3 | 79% | 0.785 | 80% | 0.8 | S | S | * | * | trans | 36.6 | 114.5 | 144.1 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 69 | Q | 42.4 | Very low | 47.1 | Very low | 198 Ų | 198 | 135.8 Ų | 135.8 | 93% | 0.925 | 80% | 0.804 | S | S | * | * | trans | -131.7 | 119.9 | 131.8 | -68.8 | -168.2 | -3.1 | 0 | 0 | 109.5 | ||||
| 70 | A | 44.1 | Very low | 47.4 | Very low | 92 Ų | 92 | 136.2 Ų | 136.2 | 76% | 0.76 | 81% | 0.807 | S | S | * | * | trans | -73.5 | 141 | 169.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 71 | L | 35.8 | Very low | 47.6 | Very low | 162 Ų | 162 | 130.7 Ų | 130.7 | 85% | 0.848 | 80% | 0.796 | S | S | * | * | trans | -172.7 | 95.6 | 151.2 | -98.6 | 147.5 | 0 | 0 | 0 | 110.8 | ||||
| 72 | V | 53.6 | Low | 47.4 | Very low | 126 Ų | 126 | 130.2 Ų | 130.2 | 76% | 0.764 | 79% | 0.794 | S | S | * | * | trans | 41.3 | 127.7 | 134.8 | -171.9 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 73 | P | 58.4 | Low | 46.9 | Very low | 111 Ų | 111 | 133.4 Ų | 133.4 | 72% | 0.721 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -78.5 | 156 | 167.6 | 32.2 | -33.3 | 0 | 0 | 0 | 113.8 | ||
| 74 | P | 57.4 | Low | 47 | Very low | 119 Ų | 119 | 132.7 Ų | 132.7 | 77% | 0.773 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 158.8 | -170.3 | 29.7 | -35.6 | 0 | 0 | 0 | 114.7 | ||
| 75 | P | 56 | Low | 47.2 | Very low | 128 Ų | 128 | 132.1 Ų | 132.1 | 83% | 0.831 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -83.9 | 149 | -168.6 | 33.7 | -35 | 0 | 0 | 0 | 114.3 | ||
| 76 | V | 52.7 | Low | 47.7 | Very low | 150 Ų | 150 | 129.9 Ų | 129.9 | 91% | 0.909 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -87 | 135.9 | 165.8 | 179.7 | 0 | 0 | 0 | 0 | 108.8 | ||
| 77 | A | 49.6 | Very low | 48.1 | Very low | 90 Ų | 90 | 130.4 Ų | 130.4 | 74% | 0.744 | 79% | 0.792 | S | S | * | * | trans | -131.2 | 157.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 78 | P | 49.1 | Very low | 48.2 | Very low | 129 Ų | 129 | 127.3 Ų | 127.3 | 84% | 0.838 | 78% | 0.783 | S | S | * | * | trans | -104.4 | 171.6 | -143.8 | 38.8 | -33.4 | 0 | 0 | 0 | 116.4 | ||||
| 79 | A | 42.6 | Very low | 48.7 | Very low | 91 Ų | 91 | 129.3 Ų | 129.3 | 75% | 0.752 | 79% | 0.788 | S | S | * | * | trans | -64 | 176.1 | -177.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 80 | P | 50.1 | Low | 48.7 | Very low | 114 Ų | 114 | 127.6 Ų | 127.6 | 74% | 0.74 | 78% | 0.784 | S | S | * | * | -144.6 | 145.5 | 110.5 | 36.6 | -21.5 | 0 | 0 | 0 | 116.8 | |||||
| 81 | S | 38.4 | Very low | 48.5 | Very low | 104 Ų | 104 | 128.4 Ų | 128.4 | 73% | 0.727 | 78% | 0.784 | S | S | * | * | trans | 52.8 | 136.2 | 147.3 | 51.4 | 0 | 0 | 0 | 0 | 120 | ||||
| 82 | R | 38.1 | Very low | 48.9 | Very low | 210 Ų | 210 | 126.1 Ų | 126.1 | 79% | 0.792 | 78% | 0.782 | S | S | * | * | cis | -174.1 | 160.8 | 20.7 | -120.8 | 177.7 | -177.9 | 179.1 | 1.1 | 108 | ||||
| 83 | F | 42.2 | Very low | 49.2 | Very low | 179 Ų | 179 | 125.7 Ų | 125.7 | 79% | 0.785 | 78% | 0.781 | S | S | * | * | trans | 105.2 | 139.6 | 159.6 | -60.5 | -63.7 | 0 | 0 | 0 | 118.7 | ||||
| 84 | P | 50.5 | Low | 49 | Very low | 116 Ų | 116 | 126.4 Ų | 126.4 | 75% | 0.753 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -101.5 | 148.4 | -139.3 | 4.7 | 17.8 | 0 | 0 | 0 | 113.2 | ||
| 85 | L | 47.5 | Very low | 48.6 | Very low | 167 Ų | 167 | 124.8 Ų | 124.8 | 87% | 0.874 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 142.2 | 169.4 | -69.5 | 158.6 | 0 | 0 | 0 | 111.3 | ||
| 86 | P | 57.8 | Low | 48.5 | Very low | 110 Ų | 110 | 124.7 Ų | 124.7 | 71% | 0.714 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 148 | 162.9 | 30.4 | -31.8 | 0 | 0 | 0 | 110.6 | ||
| 87 | P | 59.4 | Low | 48.3 | Very low | 127 Ų | 127 | 125 Ų | 125 | 83% | 0.825 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 139.7 | -173.1 | 29.2 | -32.9 | 0 | 0 | 0 | 111.6 | ||
| 88 | G | 49.4 | Very low | 48.3 | Very low | 56 Ų | 56 | 126.6 Ų | 126.6 | 58% | 0.577 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -65 | 154.7 | 163.6 | 0 | 0 | 0 | 0 | 0 | 111 | L90 | G88-L90 PolarHBondContact O-N 3.05Š|
| 89 | P | 48.4 | Very low | 47.9 | Very low | 137 Ų | 137 | 126.9 Ų | 126.9 | 89% | 0.89 | 78% | 0.776 | S | S | * | * | trans | -70.5 | 106.2 | -179.8 | 28.1 | -31.4 | 0 | 0 | 0 | 109.5 | ||||
| 90 | L | 41.3 | Very low | 48.1 | Very low | 161 Ų | 161 | 128.3 Ų | 128.3 | 84% | 0.843 | 78% | 0.778 | S | S | * | * | trans | -69.7 | 133.2 | 162.9 | -74 | 168.2 | 0 | 0 | 0 | 109.2 | G88 | G88-L90 PolarHBondContact O-N 3.05Š| ||
| 91 | S | 40.7 | Very low | 47.9 | Very low | 110 Ų | 110 | 127.2 Ų | 127.2 | 77% | 0.769 | 77% | 0.773 | S | S | * | * | trans | 37.7 | 101.6 | 140.2 | -54.6 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 92 | S | 43.5 | Very low | 48.1 | Very low | 114 Ų | 114 | 131.6 Ų | 131.6 | 80% | 0.797 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 138 | 156.3 | -52.7 | 0 | 0 | 0 | 0 | 110.3 | ||
| 93 | P | 60.5 | Low | 48.2 | Very low | 116 Ų | 116 | 129.6 Ų | 129.6 | 75% | 0.753 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -69.9 | 148.7 | 174.1 | 28.3 | -33 | 0 | 0 | 0 | 111.2 | ||
| 94 | P | 52.9 | Low | 48.2 | Very low | 126 Ų | 126 | 127.2 Ų | 127.2 | 82% | 0.818 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 139 | 173.8 | 28 | -32.1 | 0 | 0 | 0 | 110.7 | ||
| 95 | A | 49.8 | Very low | 48.2 | Very low | 86 Ų | 86 | 127.6 Ų | 127.6 | 71% | 0.711 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 149.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||
| 96 | P | 54.6 | Low | 48.1 | Very low | 126 Ų | 126 | 130.7 Ų | 130.7 | 82% | 0.818 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 138.1 | 178.3 | 27.2 | -33.4 | 0 | 0 | 0 | 111.9 | ||
| 97 | D | 48.8 | Very low | 47.7 | Very low | 157 Ų | 157 | 130.4 Ų | 130.4 | 84% | 0.84 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 137.1 | 176.4 | -66.6 | -67.6 | 0 | 0 | 0 | 112.7 | ||
| 98 | P | 49.1 | Very low | 47.4 | Very low | 123 Ų | 123 | 130.7 Ų | 130.7 | 80% | 0.799 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -82.1 | 128.3 | 163.6 | 30 | -29 | 0 | 0 | 0 | 111.7 | ||
| 99 | D | 41 | Very low | 47.3 | Very low | 134 Ų | 134 | 131 Ų | 131 | 72% | 0.717 | 79% | 0.791 | S | S | * | * | trans | -30.3 | 132.7 | 172.3 | -174.3 | 37.6 | 0 | 0 | 0 | 117 | S101 | D99-S101 PolarHBondContact O-N 3.27Å; D99-S101 VanDerWaalsContact O-N 3.13Å | ||
| 100 | P | 45.9 | Very low | 47.3 | Very low | 121 Ų | 121 | 131.1 Ų | 131.1 | 79% | 0.786 | 79% | 0.792 | S | S | * | * | S | Bend | trans | -86.6 | 79.8 | 178.7 | 35.5 | -33.2 | 0 | 0 | 0 | 110.7 | ||
| 101 | S | 46.6 | Very low | 47.4 | Very low | 91 Ų | 91 | 127.6 Ų | 127.6 | 64% | 0.636 | 79% | 0.786 | S | S | * | * | trans | -160.3 | 82.2 | 165.8 | -81.2 | 0 | 0 | 0 | 0 | 110.1 | D99 | D99-S101 PolarHBondContact O-N 3.27Å; D99-S101 VanDerWaalsContact O-N 3.13Å | ||
| 102 | Q | 41.1 | Very low | 47.5 | Very low | 196 Ų | 196 | 128.3 Ų | 128.3 | 92% | 0.916 | 79% | 0.788 | S | S | * | * | trans | -163.5 | 100.9 | 144.2 | -75 | -140 | 80.6 | 0 | 0 | 110.1 | ||||
| 103 | I | 41.5 | Very low | 47.3 | Very low | 169 Ų | 169 | 129.9 Ų | 129.9 | 87% | 0.867 | 79% | 0.792 | S | S | * | * | trans | -74.7 | 118.2 | 173.7 | -64.9 | 155.7 | 0 | 0 | 0 | 108.3 | ||||
| 104 | T | 42.7 | Very low | 46 | Very low | 128 Ų | 128 | 129 Ų | 129 | 79% | 0.785 | 79% | 0.789 | S | S | * | * | trans | -138.5 | 119.7 | 157.5 | 35.8 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 105 | P | 49.9 | Very low | 45.3 | Very low | 124 Ų | 124 | 128.4 Ų | 128.4 | 81% | 0.805 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -80.2 | 134.1 | -177 | 27.3 | -29.5 | 0 | 0 | 0 | 112.8 | ||
| 106 | R | 45.2 | Very low | 44.8 | Very low | 232 Ų | 232 | 134.3 Ų | 134.3 | 88% | 0.875 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 155.4 | 163.7 | -120.9 | 178 | 78.9 | -177.2 | 4.7 | 110.2 | ||
| 107 | P | 49.1 | Very low | 44.7 | Very low | 105 Ų | 105 | 134.4 Ų | 134.4 | 68% | 0.682 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -77.9 | 152.2 | -178 | 32.5 | -29 | 0 | 0 | 0 | 111.6 | ||
| 108 | P | 54.2 | Low | 43.9 | Very low | 132 Ų | 132 | 133.2 Ų | 133.2 | 86% | 0.857 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 135.9 | -179 | 29.9 | -31.3 | 0 | 0 | 0 | 111.5 | ||
| 109 | G | 46 | Very low | 43.1 | Very low | 63 Ų | 63 | 130.9 Ų | 130.9 | 65% | 0.649 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -74 | 161.8 | 161.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||
| 110 | P | 48.9 | Very low | 43.4 | Very low | 139 Ų | 139 | 130.8 Ų | 130.8 | 90% | 0.903 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 133.4 | -174.7 | 29.9 | -31.7 | 0 | 0 | 0 | 111.6 | ||
| 111 | A | 42.8 | Very low | 42.9 | Very low | 87 Ų | 87 | 132.4 Ų | 132.4 | 72% | 0.719 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -86.2 | 155.9 | 169.1 | 0 | 0 | 0 | 0 | 0 | 111 | ||
| 112 | P | 43.5 | Very low | 43 | Very low | 125 Ų | 125 | 134 Ų | 134 | 81% | 0.812 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -78.2 | 141.3 | -179.3 | 32.3 | -33.2 | 0 | 0 | 0 | 111.4 | ||
| 113 | V | 38.1 | Very low | 42.4 | Very low | 147 Ų | 147 | 127.3 Ų | 127.3 | 89% | 0.891 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 123.5 | 173.4 | -74.3 | 0 | 0 | 0 | 0 | 110.3 | ||
| 114 | S | 34.3 | Very low | 42.1 | Very low | 97 Ų | 97 | 128.5 Ų | 128.5 | 68% | 0.678 | 80% | 0.796 | S | S | * | * | trans | -112 | 129.7 | 163 | -175.8 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 115 | S | 37.3 | Very low | 41.4 | Very low | 115 Ų | 115 | 126.6 Ų | 126.6 | 80% | 0.804 | 79% | 0.793 | S | S | * | * | trans | -146 | 105.2 | 168.8 | -62.3 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 116 | Y | 39.4 | Very low | 40.5 | Very low | 209 Ų | 209 | 125.1 Ų | 125.1 | 82% | 0.82 | 79% | 0.791 | S | S | * | * | trans | -105.5 | 158.5 | 153.5 | -64.7 | -76.4 | 0 | 0 | 0 | 107.7 | ||||
| 117 | P | 53.6 | Low | 40.2 | Very low | 128 Ų | 128 | 120.3 Ų | 120.3 | 83% | 0.831 | 79% | 0.79 | S | S | * | * | -134.4 | 157.6 | 99.5 | 28.2 | -12 | 0 | 0 | 0 | 115.6 | |||||
| 118 | C | 31.5 | Very low | 39.3 | Very low | 133 Ų | 133 | 119.9 Ų | 119.9 | 90% | 0.899 | 80% | 0.795 | S | S | * | * | trans | -22.5 | 139.9 | 166 | -66.2 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 119 | G | 32.7 | Very low | 38.2 | Very low | 73 Ų | 73 | 118.7 Ų | 118.7 | 75% | 0.753 | 79% | 0.79 | S | S | * | * | 114.1 | 158.7 | 55.4 | 0 | 0 | 0 | 0 | 0 | 108.4 | |||||
| 120 | P | 46.8 | Very low | 37.2 | Very low | 132 Ų | 132 | 124.3 Ų | 124.3 | 86% | 0.857 | 80% | 0.8 | S | S | * | * | cis | -135.5 | 166.3 | 15.1 | 34.3 | -12.1 | 0 | 0 | 0 | 118.3 | ||||
| 121 | L | 36.4 | Very low | 36.6 | Very low | 156 Ų | 156 | 126.5 Ų | 126.5 | 82% | 0.817 | 80% | 0.798 | S | S | * | * | trans | -51.3 | 178.1 | 160.6 | -80.2 | 164.7 | 0 | 0 | 0 | 114.5 | ||||
| 122 | P | 47.6 | Very low | 36.3 | Very low | 125 Ų | 125 | 127.2 Ų | 127.2 | 81% | 0.812 | 80% | 0.795 | S | S | * | * | cis | -142.6 | 174.5 | 26 | 37.5 | -14.6 | 0 | 0 | 0 | 115.9 | ||||
| 123 | G | 28.7 | Very low | 35.6 | Very low | 54 Ų | 54 | 129.8 Ų | 129.8 | 56% | 0.557 | 80% | 0.796 | S | S | * | * | cis | 167.6 | -180 | -0.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 124 | Q | 34.3 | Very low | 35.2 | Very low | 195 Ų | 195 | 129.8 Ų | 129.8 | 91% | 0.911 | 79% | 0.791 | S | S | * | * | trans | 68.2 | 136.9 | 150.2 | -55.1 | -167.4 | 98.7 | 0 | 0 | 117.6 | ||||
| 125 | A | 28.3 | Very low | 35.2 | Very low | 88 Ų | 88 | 132.9 Ų | 132.9 | 73% | 0.727 | 80% | 0.795 | S | S | * | * | cis | -166.6 | 146.1 | -7.4 | 0 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 126 | A | 30.7 | Very low | 34.9 | Very low | 92 Ų | 92 | 131.2 Ų | 131.2 | 76% | 0.76 | 80% | 0.796 | S | S | * | * | trans | -78.4 | 161.5 | 154.2 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 127 | P | 38.8 | Very low | 34.4 | Very low | 131 Ų | 131 | 127.9 Ų | 127.9 | 85% | 0.851 | 80% | 0.801 | S | S | * | * | -135 | 162.1 | 118.8 | 33.4 | -20.3 | 0 | 0 | 0 | 113.3 | |||||
| 128 | A | 31.6 | Very low | 33.5 | Very low | 96 Ų | 96 | 128.9 Ų | 128.9 | 79% | 0.793 | 80% | 0.799 | S | S | * | * | trans | -80.7 | 166.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 129 | S | 30.7 | Very low | 33.6 | Very low | 107 Ų | 107 | 130.3 Ų | 130.3 | 75% | 0.748 | 80% | 0.797 | S | S | * | * | trans | 106.5 | 132.4 | 145 | -127.9 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 130 | E | 25.6 | Very low | 33.4 | Very low | 182 Ų | 182 | 129.9 Ų | 129.9 | 85% | 0.85 | 79% | 0.793 | S | S | * | * | trans | 97.2 | 115.8 | 149.5 | -32.3 | -139.5 | 108.9 | 0 | 0 | 118.6 | ||||
| 131 | Q | 35.8 | Very low | 33.3 | Very low | 184 Ų | 184 | 131.7 Ų | 131.7 | 86% | 0.86 | 80% | 0.795 | S | S | * | * | trans | -61.9 | 153 | 161.9 | -111 | 172.3 | -95.9 | 0 | 0 | 110.1 | ||||
| 132 | P | 36.6 | Very low | 33 | Very low | 103 Ų | 103 | 132.5 Ų | 132.5 | 67% | 0.669 | 79% | 0.794 | S | S | * | * | -152.8 | 168.2 | 64 | 37.1 | -14.7 | 0 | 0 | 0 | 117.4 | |||||
| 133 | Q | 29.6 | Very low | 32.9 | Very low | 179 Ų | 179 | 136 Ų | 136 | 84% | 0.836 | 80% | 0.8 | S | S | * | * | trans | 35.5 | 125.4 | 141.9 | -63 | 170.1 | -34.7 | 0 | 0 | 120.7 | ||||
| 134 | D | 29.7 | Very low | 33.3 | Very low | 146 Ų | 146 | 141.9 Ų | 141.9 | 78% | 0.781 | 81% | 0.812 | S | S | * | * | 173.9 | 107.8 | 117.3 | -163.1 | -111.2 | 0 | 0 | 0 | 111 | |||||
| 135 | E | 34.5 | Very low | 33.4 | Very low | 163 Ų | 163 | 138.4 Ų | 138.4 | 76% | 0.762 | 80% | 0.8 | S | S | * | * | trans | 54.1 | 108.2 | 134.5 | -42.3 | -56.3 | 99.4 | 0 | 0 | 122.2 | ||||
| 136 | G | 30.6 | Very low | 34.3 | Very low | 80 Ų | 80 | 139.5 Ų | 139.5 | 83% | 0.825 | 79% | 0.794 | S | S | * | * | 109 | 94.5 | 116.1 | 0 | 0 | 0 | 0 | 0 | 119.3 | |||||
| 137 | C | 28.2 | Very low | 35.1 | Very low | 138 Ų | 138 | 140.2 Ų | 140.2 | 93% | 0.932 | 79% | 0.791 | S | S | * | * | -151.8 | 107.5 | 126.7 | -141.2 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 138 | L | 34.7 | Very low | 35.8 | Very low | 149 Ų | 149 | 140 Ų | 140 | 78% | 0.78 | 78% | 0.781 | S | S | * | * | trans | -91.3 | 164 | 173.1 | -167.3 | 143.2 | 0 | 0 | 0 | 108.9 | ||||
| 139 | L | 33.9 | Very low | 36.8 | Very low | 163 Ų | 163 | 137.4 Ų | 137.4 | 85% | 0.853 | 77% | 0.765 | S | S | * | * | trans | 104.4 | 108.5 | 175.2 | -54.4 | 172.2 | 0 | 0 | 0 | 110.3 | ||||
| 140 | G | 29.5 | Very low | 37.8 | Very low | 65 Ų | 65 | 136.1 Ų | 136.1 | 67% | 0.67 | 75% | 0.749 | S | S | * | * | cis | 120.3 | 98.6 | 30.4 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 141 | L | 43.5 | Very low | 39.3 | Very low | 170 Ų | 170 | 135.2 Ų | 135.2 | 89% | 0.89 | 75% | 0.745 | S | S | * | * | trans | -137.4 | 90.5 | 151.3 | -108.9 | 106.8 | 0 | 0 | 0 | 107.2 | ||||
| 142 | E | 31.3 | Very low | 40.2 | Very low | 172 Ų | 172 | 132.6 Ų | 132.6 | 80% | 0.804 | 73% | 0.733 | S | S | * | * | 59 | 92.2 | 103.1 | -33.4 | -147.1 | 126.6 | 0 | 0 | 111.9 | Q144 | E142-Q144 PolarHBondContact O-N 2.84Å; E142-Q144 VanDerWaalsContact O-N 3.13Å | |||
| 143 | E | 45.5 | Very low | 41.1 | Very low | 199 Ų | 199 | 129.7 Ų | 129.7 | 93% | 0.93 | 71% | 0.711 | S | S | * | * | trans | -48 | 104.6 | 155.7 | -171.2 | 175.6 | 95.3 | 0 | 0 | 109 | ||||
| 144 | Q | 35.6 | Very low | 42.5 | Very low | 177 Ų | 177 | 122.3 Ų | 122.3 | 83% | 0.827 | 68% | 0.679 | S | S | * | * | trans | -111.9 | 95.4 | 170.4 | -167.9 | 87.1 | 91.5 | 0 | 0 | 108.1 | E142 D146 | E142-Q144 PolarHBondContact O-N 2.84Å; E142-Q144 VanDerWaalsContact O-N 3.13Å; Q144-D146 PolarHBondContact O-N 3.25Å | ||
| 145 | D | 37.3 | Very low | 44.5 | Very low | 122 Ų | 122 | 120.7 Ų | 120.7 | 65% | 0.652 | 67% | 0.665 | S | S | * | * | trans | -27.9 | 110 | 156.3 | -162.3 | -113.3 | 0 | 0 | 0 | 113.8 | ||||
| 146 | D | 46.3 | Very low | 46.1 | Very low | 112 Ų | 112 | 117.7 Ų | 117.7 | 60% | 0.599 | 66% | 0.66 | S | S | * | * | 159.6 | 94.5 | 120.8 | -167.4 | -120.4 | 0 | 0 | 0 | 112.3 | Q144 L148 | Q144-D146 PolarHBondContact O-N 3.25Å; D146-L148 VanDerWaalsContact OD2-CB 3.24Å; D146-L148 WeakPolarHBondContact OD2-CB 3.14Å; D146-L148 WeakPolarHBondContact OD2-CG 3.26Å; D146-L148 PolarHBondContact OD2-N 2.74Å | |||
| 147 | P | 47.3 | Very low | 48.2 | Very low | 106 Ų | 106 | 117.8 Ų | 117.8 | 69% | 0.688 | 64% | 0.641 | S | S | * | * | trans | -122.5 | 52.1 | 139 | 30.1 | -17.8 | 0 | 0 | 0 | 110 | G149 | P147-G149 VanDerWaalsContact C-N 3.28Å; P147-G149 PolarHBondContact O-N 3.22Å | ||
| 148 | L | 54.2 | Low | 50.3 | Low | 126 Ų | 126 | 114.7 Ų | 114.7 | 66% | 0.66 | 61% | 0.61 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.1 | 73.1 | -177.2 | -60.9 | 178.1 | 0 | 0 | 0 | 112 | D146 | D146-L148 VanDerWaalsContact OD2-CB 3.24Å; D146-L148 WeakPolarHBondContact OD2-CB 3.14Å; D146-L148 WeakPolarHBondContact OD2-CG 3.26Å; D146-L148 PolarHBondContact OD2-N 2.74Å |
| 149 | G | 52.6 | Low | 52.7 | Low | 43 Ų | 43 | 107.6 Ų | 107.6 | 44% | 0.443 | 57% | 0.573 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -166.1 | -20.5 | 165.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | P147 | P147-G149 VanDerWaalsContact C-N 3.28Å; P147-G149 PolarHBondContact O-N 3.22Å |
| 150 | L | 52.2 | Low | 54.7 | Low | 79 Ų | 79 | 103 Ų | 103 | 41% | 0.414 | 55% | 0.546 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.5 | -37.2 | -179 | -172.3 | 56.9 | 0 | 0 | 0 | 112.5 | E152 L153 L185 | L150-E152 VanDerWaalsContact C-N 3.29Å; L150-E152 PolarHBondContact O-N 3.07Å; L150-L153 PolarHBondContact O-N 2.74Å; L150-L185 HydrophobicContact CD1-CD1 3.74Å |
| 151 | E | 56.5 | Low | 57.2 | Low | 164 Ų | 164 | 100.6 Ų | 100.6 | 77% | 0.766 | 52% | 0.518 | S | S | * | . | G | 310 helix | trans | -71 | -27.8 | 178 | -161.7 | 153.1 | 98.4 | 0 | 0 | 111.9 | L153 C154 | E151-L153 VanDerWaalsContact C-N 3.26Å; E151-L153 PolarHBondContact O-N 2.84Å; E151-C154 PolarHBondContact O-N 2.94Å |
| 152 | E | 55.4 | Low | 59 | Low | 129 Ų | 129 | 93.5 Ų | 93.5 | 60% | 0.603 | 48% | 0.482 | S | S | * | . | G | 310 helix | trans | -71.2 | -21.3 | 177.6 | -139.4 | -162.1 | 150.4 | 0 | 0 | 113.2 | L150 K160 | L150-E152 VanDerWaalsContact C-N 3.29Å; L150-E152 PolarHBondContact O-N 3.07Å; E152-K160 WeakPolarHBondContact O-CD 3.45Å; E152-K160 WeakPolarHBondContact O-CE 3.45Å; E152-K160 PolarHBondContact O-NZ 2.91Å |
| 153 | L | 55.7 | Low | 61.4 | Low | 42 Ų | 42 | 90.8 Ų | 90.8 | 22% | 0.22 | 47% | 0.473 | C | S | . | . | G | 310 helix | trans | -93.5 | -14.3 | 177.4 | -99.6 | 72 | 0 | 0 | 0 | 113.9 | L150 E151 K160 L161 F188 | L150-L153 PolarHBondContact O-N 2.74Å; E151-L153 VanDerWaalsContact C-N 3.26Å; E151-L153 PolarHBondContact O-N 2.84Å; L153-K160 HydrophobicContact CB-CB 4.2Å; L153-K160 HydrophobicContact CD1-CD 4.46Å; L153-K160 HydrophobicContact CG-CB 3.9Å; L153-K160 HydrophobicContact CG-CD 4.21Å; L153-K160 WeakPolarHBondContact O-CA 3.3Å; L153-K160 WeakPolarHBondContact O-CB 3.36Å; L153-K160 WeakPolarHBondContact O-CG 3.47Å; L153-K160 PolarHBondContact O-N 2.84Å; L153-L161 HydrophobicContact CB-CG 4.36Å; L153-L161 HydrophobicContact CD2-CD2 3.47Å; L153-L161 VanDerWaalsContact CD2-CD2 3.47Å; L153-L161 HydrophobicContact CD2-CG 3.76Å; L153-F188 HydrophobicContact CD2-CE1 4.29Å; L153-F188 HydrophobicContact CD2-CZ 4.2Å |
| 154 | C | 58.3 | Low | 63.2 | Low | 24 Ų | 24 | 84 Ų | 84 | 16% | 0.162 | 45% | 0.445 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.6 | 82 | -176.1 | -69.3 | 0 | 0 | 0 | 0 | 110.4 | E151 Y176 | E151-C154 PolarHBondContact O-N 2.94Å; C154-Y176 WeakPolarHBondContact CA-OH 3.35Å; C154-Y176 HydrophobicContact CB-CD1 4.04Å; C154-Y176 HydrophobicContact CB-CE1 3.4Å; C154-Y176 VanDerWaalsContact CB-CE1 3.4Å; C154-Y176 HydrophobicContact CB-CE2 4.38Å; C154-Y176 WeakPolarHBondContact SG-CE1 3.41Å |
| 155 | K | 72.4 | Confident | 65.5 | Low | 112 Ų | 112 | 80.8 Ų | 80.8 | 49% | 0.487 | 44% | 0.438 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.2 | 152.9 | 175.2 | -67.2 | 178.5 | 177.8 | -175.5 | 0 | 110 | L157 Y158 Y176 | K155-L157 PolarHBondContact O-N 2.7Å; K155-Y158 PolarHBondContact N-O 2.89Å; K155-Y158 PolarHBondContact O-N 3.02Å; K155-Y176 PolarHBondContact N-OH 3Å; K155-Y176 PolarHBondContact O-OH 3.32Å |
| 156 | P | 67.5 | Low | 67.7 | Low | 100 Ų | 100 | 75.5 Ų | 75.5 | 65% | 0.649 | 41% | 0.409 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.1 | -14.2 | -175.2 | 18.3 | -31.6 | 0 | 0 | 0 | 115.4 | A172 | P156-A172 WeakPolarHBondContact O-CB 3.46Š|
| 157 | L | 74 | Confident | 69.2 | Low | 82 Ų | 82 | 77.5 Ų | 77.5 | 43% | 0.429 | 42% | 0.42 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -131.6 | 7.1 | 175.1 | -63.7 | 172.4 | 0 | 0 | 0 | 113.2 | K155 T165 L166 | K155-L157 PolarHBondContact O-N 2.7Å; L157-T165 CarbonylContact O-C 3.57Å; L157-T165 WeakPolarHBondContact O-CA 3.25Å; L157-L166 WeakPolarHBondContact CB-O 3.35Å; L157-L166 VanDerWaalsContact CD2-O 3.25Å; L157-L166 WeakPolarHBondContact CD2-O 3.42Å; L157-L166 PolarHBondContact O-N 2.89Å |
| 158 | Y | 72.5 | Confident | 71.1 | Confident | 73 Ų | 73 | 75.3 Ų | 75.3 | 29% | 0.286 | 41% | 0.407 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -150.8 | 121.9 | -179.8 | -179.2 | -112.4 | 0 | 0 | 0 | 112.7 | K155 K160 V164 T165 Y176 | K155-Y158 PolarHBondContact N-O 2.89Å; K155-Y158 PolarHBondContact O-N 3.02Å; Y158-K160 HydrophobicContact CD1-CG 3.88Å; Y158-K160 HydrophobicContact CE1-CB 4.26Å; Y158-K160 HydrophobicContact CE1-CG 3.65Å; Y158-V164 VanDerWaalsContact CD2-O 3.3Å; Y158-V164 WeakPolarHBondContact CD2-O 3.25Å; Y158-T165 WeakPolarHBondContact CD2-OG1 3.47Å; Y158-Y176 VanDerWaalsContact C-OH 3.23Å; Y158-Y176 PolarHBondContact O-OH 2.95Å; Y158-Y176 VanDerWaalsContact O-OH 3.06Å |
| 159 | C | 85.5 | Confident | 72.4 | Confident | 0 Ų | 0 | 72.5 Ų | 72.5 | 0% | 0 | 40% | 0.402 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.8 | 106.3 | 176.2 | 179.6 | 0 | 0 | 0 | 0 | 109.7 | L161 C162 N163 V164 H175 Y176 H181 | C159-L161 VanDerWaalsContact C-N 3.3Å; C159-L161 PolarHBondContact O-N 2.92Å; C159-C162 HydrophobicContact CB-CB 4.17Å; C159-C162 PolarHBondContact O-N 3.36Å; C159-C162 VanDerWaalsContact SG-CB 3.56Å; C159-C162 PolarHBondContact SG-N 3.14Å; C159-C162 VanDerWaalsContact SG-N 3.36Å; C159-C162 VanDerWaalsContact SG-SG 3.68Å; C159-N163 VanDerWaalsContact O-CA 3.28Å; C159-N163 WeakPolarHBondContact O-CA 3.34Å; C159-N163 PolarHBondContact O-N 3.37Å; C159-V164 PolarHBondContact N-O 2.78Å; C159-V164 PolarHBondContact O-N 3.07Å; C159-V164 VanDerWaalsContact O-N 3.17Å; C159-H175 WeakPolarHBondContact CB-NE2 3.44Å; C159-H175 PolarHBondContact SG-NE2 3.11Å; C159-Y176 WeakPolarHBondContact CA-OH 3.1Å; C159-Y176 HydrophobicContact CB-CE1 3.62Å; C159-Y176 PolarHBondContact N-OH 3.39Å; C159-H181 PolarHBondContact SG-CE1 2.9Å; C159-H181 PolarHBondContact SG-ND1 3.44Å |
| 160 | K | 75.8 | Confident | 73.8 | Confident | 67 Ų | 67 | 77.8 Ų | 77.8 | 29% | 0.291 | 42% | 0.416 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.1 | -30.9 | 176.8 | -58.1 | -166 | -175 | 158.6 | 0 | 112.1 | E152 L153 Y158 C162 N163 | E152-K160 WeakPolarHBondContact O-CD 3.45Å; E152-K160 WeakPolarHBondContact O-CE 3.45Å; E152-K160 PolarHBondContact O-NZ 2.91Å; L153-K160 HydrophobicContact CB-CB 4.2Å; L153-K160 HydrophobicContact CD1-CD 4.46Å; L153-K160 HydrophobicContact CG-CB 3.9Å; L153-K160 HydrophobicContact CG-CD 4.21Å; L153-K160 WeakPolarHBondContact O-CA 3.3Å; L153-K160 WeakPolarHBondContact O-CB 3.36Å; L153-K160 WeakPolarHBondContact O-CG 3.47Å; L153-K160 PolarHBondContact O-N 2.84Å; Y158-K160 HydrophobicContact CD1-CG 3.88Å; Y158-K160 HydrophobicContact CE1-CB 4.26Å; Y158-K160 HydrophobicContact CE1-CG 3.65Å; K160-C162 VanDerWaalsContact C-N 3.33Å; K160-C162 PolarHBondContact O-N 3.37Å; K160-N163 PolarHBondContact O-OD1 2.64Å; K160-N163 VanDerWaalsContact O-OD1 3.12Å |
| 161 | L | 82.6 | Confident | 75.3 | Confident | 13 Ų | 13 | 79 Ų | 79 | 7% | 0.068 | 42% | 0.419 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.3 | -36.7 | 176.6 | -71 | 169.3 | 0 | 0 | 0 | 112.4 | L153 C159 K184 L185 F188 | L153-L161 HydrophobicContact CB-CG 4.36Å; L153-L161 HydrophobicContact CD2-CD2 3.47Å; L153-L161 VanDerWaalsContact CD2-CD2 3.47Å; L153-L161 HydrophobicContact CD2-CG 3.76Å; C159-L161 VanDerWaalsContact C-N 3.3Å; C159-L161 PolarHBondContact O-N 2.92Å; L161-K184 VanDerWaalsContact O-CD 3.25Å; L161-K184 WeakPolarHBondContact O-CD 3.16Å; L161-K184 WeakPolarHBondContact O-CE 3.34Å; L161-K184 PolarHBondContact O-NZ 2.89Å; L161-L185 HydrophobicContact CD1-CD1 3.26Å; L161-L185 HydrophobicContact CD1-CG 4.5Å; L161-F188 HydrophobicContact CD2-CB 3.99Å; L161-F188 HydrophobicContact CD2-CD1 3.81Å; L161-F188 HydrophobicContact CD2-CD2 3.86Å; L161-F188 HydrophobicContact CD2-CE1 4.23Å; L161-F188 HydrophobicContact CD2-CE2 4.28Å; L161-F188 HydrophobicContact CD2-CG 3.6Å; L161-F188 HydrophobicContact CD2-CZ 4.45Å |
| 162 | C | 81.3 | Confident | 76.5 | Confident | 22 Ų | 22 | 71.3 Ų | 71.3 | 15% | 0.149 | 38% | 0.383 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -96.3 | -13.7 | -179.9 | -66 | 0 | 0 | 0 | 0 | 113 | C159 K160 V164 H175 H181 | C159-C162 HydrophobicContact CB-CB 4.17Å; C159-C162 PolarHBondContact O-N 3.36Å; C159-C162 VanDerWaalsContact SG-CB 3.56Å; C159-C162 PolarHBondContact SG-N 3.14Å; C159-C162 VanDerWaalsContact SG-N 3.36Å; C159-C162 VanDerWaalsContact SG-SG 3.68Å; K160-C162 VanDerWaalsContact C-N 3.33Å; K160-C162 PolarHBondContact O-N 3.37Å; C162-V164 VanDerWaalsContact C-N 3.27Å; C162-V164 HydrophobicContact CB-CB 4.38Å; C162-V164 HydrophobicContact CB-CG2 3.91Å; C162-V164 WeakPolarHBondContact O-CG2 3.5Å; C162-H175 WeakPolarHBondContact CB-NE2 3.35Å; C162-H175 PolarHBondContact SG-NE2 2.86Å; C162-H181 PolarHBondContact SG-ND1 3.3Å |
| 163 | N | 81.1 | Confident | 77.9 | Confident | 114 Ų | 114 | 70.8 Ų | 70.8 | 61% | 0.61 | 38% | 0.381 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53 | 43.2 | -168.3 | -59.4 | 69.6 | 0 | 0 | 0 | 111.8 | C159 K160 | C159-N163 VanDerWaalsContact O-CA 3.28Å; C159-N163 WeakPolarHBondContact O-CA 3.34Å; C159-N163 PolarHBondContact O-N 3.37Å; K160-N163 PolarHBondContact O-OD1 2.64Å; K160-N163 VanDerWaalsContact O-OD1 3.12Å |
| 164 | V | 82.7 | Confident | 79.4 | Confident | 57 Ų | 57 | 71.9 Ų | 71.9 | 35% | 0.345 | 40% | 0.396 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.5 | 126.4 | -178.2 | -177.5 | 0 | 0 | 0 | 0 | 110 | Y158 C159 C162 L166 | Y158-V164 VanDerWaalsContact CD2-O 3.3Å; Y158-V164 WeakPolarHBondContact CD2-O 3.25Å; C159-V164 PolarHBondContact N-O 2.78Å; C159-V164 PolarHBondContact O-N 3.07Å; C159-V164 VanDerWaalsContact O-N 3.17Å; C162-V164 VanDerWaalsContact C-N 3.27Å; C162-V164 HydrophobicContact CB-CB 4.38Å; C162-V164 HydrophobicContact CB-CG2 3.91Å; C162-V164 WeakPolarHBondContact O-CG2 3.5Å; V164-L166 HydrophobicContact CG1-CD2 3.56Å; V164-L166 HydrophobicContact CG1-CG 4.2Å |
| 165 | T | 84.5 | Confident | 80.9 | Confident | 109 Ų | 109 | 72.8 Ų | 72.8 | 67% | 0.669 | 40% | 0.398 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -88.1 | 128.2 | 168.8 | -46 | 0 | 0 | 0 | 0 | 109.1 | L157 Y158 | L157-T165 CarbonylContact O-C 3.57Å; L157-T165 WeakPolarHBondContact O-CA 3.25Å; Y158-T165 WeakPolarHBondContact CD2-OG1 3.47Å |
| 166 | L | 84.1 | Confident | 81.5 | Confident | 11 Ų | 11 | 70 Ų | 70 | 6% | 0.058 | 39% | 0.385 | C | S | . | . | trans | -112.5 | 132.6 | -174.9 | -57.9 | 171 | 0 | 0 | 0 | 107.4 | L157 V164 Q171 A172 H175 | L157-L166 WeakPolarHBondContact CB-O 3.35Å; L157-L166 VanDerWaalsContact CD2-O 3.25Å; L157-L166 WeakPolarHBondContact CD2-O 3.42Å; L157-L166 PolarHBondContact O-N 2.89Å; V164-L166 HydrophobicContact CG1-CD2 3.56Å; V164-L166 HydrophobicContact CG1-CG 4.2Å; L166-Q171 HydrophobicContact CD2-CG 4.15Å; L166-A172 HydrophobicContact CB-CB 4.23Å; L166-A172 VanDerWaalsContact CD1-CA 3.49Å; L166-A172 HydrophobicContact CD1-CB 3.97Å; L166-H175 HydrophobicContact CD1-CB 3.41Å; L166-H175 VanDerWaalsContact CD1-CB 3.41Å; L166-H175 HydrophobicContact CD2-CB 4.4Å | ||
| 167 | N | 78.3 | Confident | 82.4 | Confident | 155 Ų | 155 | 71.9 Ų | 71.9 | 83% | 0.829 | 39% | 0.385 | S | S | * | . | S | Bend | trans | -84.9 | -15.4 | -166.9 | -170.7 | -102.4 | 0 | 0 | 0 | 112.8 | ||
| 168 | S | 86 | Confident | 83.1 | Confident | 59 Ų | 59 | 69 Ų | 69 | 41% | 0.413 | 38% | 0.375 | S | S | . | . | S | Bend | trans | -140.9 | 147.9 | 179.4 | 172.7 | 0 | 0 | 0 | 0 | 111.6 | Q170 Q171 A172 | S168-Q170 PolarHBondContact O-N 3.43Å; S168-Q170 PolarHBondContact OG-N 3.44Å; S168-Q171 WeakPolarHBondContact O-CB 3.49Å; S168-Q171 PolarHBondContact O-N 3.09Å; S168-A172 PolarHBondContact O-N 3.5Å |
| 169 | A | 81.6 | Confident | 83.7 | Confident | 67 Ų | 67 | 74.5 Ų | 74.5 | 55% | 0.554 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -56.5 | -36.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q171 A172 Q173 | A169-Q171 VanDerWaalsContact C-N 3.34Å; A169-Q171 PolarHBondContact O-N 2.99Å; A169-A172 WeakPolarHBondContact O-CB 3.47Å; A169-A172 PolarHBondContact O-N 2.88Å; A169-Q173 PolarHBondContact O-N 3.26Å |
| 170 | Q | 82.8 | Confident | 83.7 | Confident | 155 Ų | 155 | 81.1 Ų | 81.1 | 72% | 0.724 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -69.6 | -34.1 | 178.6 | -159.2 | 172.9 | 27.1 | 0 | 0 | 111.9 | S168 A174 | S168-Q170 PolarHBondContact O-N 3.43Å; S168-Q170 PolarHBondContact OG-N 3.44Å; Q170-A174 WeakPolarHBondContact O-CB 3.02Å; Q170-A174 PolarHBondContact O-N 3.13Å |
| 171 | Q | 82.1 | Confident | 84.2 | Confident | 103 Ų | 103 | 78.5 Ų | 78.5 | 48% | 0.481 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -70.2 | -37.4 | 173.6 | -169.4 | -174.6 | 52 | 0 | 0 | 111.2 | L166 S168 A169 A174 H175 | L166-Q171 HydrophobicContact CD2-CG 4.15Å; S168-Q171 WeakPolarHBondContact O-CB 3.49Å; S168-Q171 PolarHBondContact O-N 3.09Å; A169-Q171 VanDerWaalsContact C-N 3.34Å; A169-Q171 PolarHBondContact O-N 2.99Å; Q171-A174 PolarHBondContact O-N 2.93Å; Q171-H175 WeakPolarHBondContact O-CB 3.26Å; Q171-H175 PolarHBondContact O-N 3.46Å |
| 172 | A | 82.4 | Confident | 84.3 | Confident | 3 Ų | 3 | 80.5 Ų | 80.5 | 3% | 0.025 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -62.4 | -47 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | P156 L166 S168 A169 A174 H175 Y176 | P156-A172 WeakPolarHBondContact O-CB 3.46Å; L166-A172 HydrophobicContact CB-CB 4.23Å; L166-A172 VanDerWaalsContact CD1-CA 3.49Å; L166-A172 HydrophobicContact CD1-CB 3.97Å; S168-A172 PolarHBondContact O-N 3.5Å; A169-A172 WeakPolarHBondContact O-CB 3.47Å; A169-A172 PolarHBondContact O-N 2.88Å; A172-A174 VanDerWaalsContact C-N 3.33Å; A172-A174 PolarHBondContact O-N 3.22Å; A172-H175 WeakPolarHBondContact O-CB 3.46Å; A172-H175 PolarHBondContact O-N 3.06Å; A172-H175 VanDerWaalsContact O-N 3.13Å; A172-Y176 HydrophobicContact CB-CD2 4.32Å; A172-Y176 HydrophobicContact CB-CE2 3.93Å; A172-Y176 WeakPolarHBondContact O-CD2 3.45Å; A172-Y176 PolarHBondContact O-N 3.05Å |
| 173 | Q | 84 | Confident | 84.5 | Confident | 118 Ų | 118 | 86.1 Ų | 86.1 | 55% | 0.551 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -60.8 | -42.7 | 177 | -140.2 | -167.3 | -36.3 | 0 | 0 | 111.8 | A169 H175 Q177 | A169-Q173 PolarHBondContact O-N 3.26Å; Q173-H175 VanDerWaalsContact C-N 3.33Å; Q173-H175 PolarHBondContact O-N 3.05Å; Q173-Q177 WeakPolarHBondContact O-CB 3.48Å; Q173-Q177 WeakPolarHBondContact O-CG 3.48Å; Q173-Q177 PolarHBondContact O-N 2.95Å; Q173-Q177 VanDerWaalsContact O-N 3.09Å; Q173-Q177 PolarHBondContact O-NE2 2.79Å |
| 174 | A | 88.2 | Confident | 84.6 | Confident | 66 Ų | 66 | 85.1 Ų | 85.1 | 55% | 0.545 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -66.2 | -34.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q170 Q171 A172 G178 | Q170-A174 WeakPolarHBondContact O-CB 3.02Å; Q170-A174 PolarHBondContact O-N 3.13Å; Q171-A174 PolarHBondContact O-N 2.93Å; A172-A174 VanDerWaalsContact C-N 3.33Å; A172-A174 PolarHBondContact O-N 3.22Å; A174-G178 PolarHBondContact O-N 3.39Å |
| 175 | H | 89.5 | Confident | 84.7 | Confident | 42 Ų | 42 | 84.4 Ų | 84.4 | 19% | 0.194 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -67.2 | -49.3 | 175 | 178.8 | 92.1 | 0 | 0 | 0 | 111.9 | C159 C162 L166 Q171 A172 Q173 Q177 G178 H181 | C159-H175 WeakPolarHBondContact CB-NE2 3.44Å; C159-H175 PolarHBondContact SG-NE2 3.11Å; C162-H175 WeakPolarHBondContact CB-NE2 3.35Å; C162-H175 PolarHBondContact SG-NE2 2.86Å; L166-H175 HydrophobicContact CD1-CB 3.41Å; L166-H175 VanDerWaalsContact CD1-CB 3.41Å; L166-H175 HydrophobicContact CD2-CB 4.4Å; Q171-H175 WeakPolarHBondContact O-CB 3.26Å; Q171-H175 PolarHBondContact O-N 3.46Å; A172-H175 WeakPolarHBondContact O-CB 3.46Å; A172-H175 PolarHBondContact O-N 3.06Å; A172-H175 VanDerWaalsContact O-N 3.13Å; Q173-H175 VanDerWaalsContact C-N 3.33Å; Q173-H175 PolarHBondContact O-N 3.05Å; H175-Q177 VanDerWaalsContact C-N 3.33Å; H175-Q177 PolarHBondContact O-N 3.2Å; H175-G178 PolarHBondContact O-N 2.84Å; H175-H181 AromaticContact CD2-ND1 3.9Å; H175-H181 AromaticContact NE2-ND1 3.58Å; H175-H181 WeakPolarHBondContact O-CB 3.29Å |
| 176 | Y | 85.1 | Confident | 84.7 | Confident | 53 Ų | 53 | 88.4 Ų | 88.4 | 21% | 0.208 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -65.6 | -35.2 | -178 | -66.2 | -48.3 | 0 | 0 | 0 | 112.8 | C154 K155 Y158 C159 A172 G178 H181 | C154-Y176 WeakPolarHBondContact CA-OH 3.35Å; C154-Y176 HydrophobicContact CB-CD1 4.04Å; C154-Y176 HydrophobicContact CB-CE1 3.4Å; C154-Y176 VanDerWaalsContact CB-CE1 3.4Å; C154-Y176 HydrophobicContact CB-CE2 4.38Å; C154-Y176 WeakPolarHBondContact SG-CE1 3.41Å; K155-Y176 PolarHBondContact N-OH 3Å; K155-Y176 PolarHBondContact O-OH 3.32Å; Y158-Y176 VanDerWaalsContact C-OH 3.23Å; Y158-Y176 PolarHBondContact O-OH 2.95Å; Y158-Y176 VanDerWaalsContact O-OH 3.06Å; C159-Y176 WeakPolarHBondContact CA-OH 3.1Å; C159-Y176 HydrophobicContact CB-CE1 3.62Å; C159-Y176 PolarHBondContact N-OH 3.39Å; A172-Y176 HydrophobicContact CB-CD2 4.32Å; A172-Y176 HydrophobicContact CB-CE2 3.93Å; A172-Y176 WeakPolarHBondContact O-CD2 3.45Å; A172-Y176 PolarHBondContact O-N 3.05Å; Y176-G178 PolarHBondContact O-N 3.28Å; Y176-H181 AromaticContact CD1-CE1 3.76Å; Y176-H181 AromaticContact CD1-NE2 3.75Å; Y176-H181 PolarHBondContact O-CD2 3.19Å; Y176-H181 VanDerWaalsContact O-CD2 3.3Å |
| 177 | Q | 86.2 | Confident | 84.7 | Confident | 141 Ų | 141 | 92.6 Ų | 92.6 | 66% | 0.659 | 47% | 0.471 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.7 | 0.8 | 174.1 | -64 | 170.4 | 97.7 | 0 | 0 | 113 | Q173 H175 | Q173-Q177 WeakPolarHBondContact O-CB 3.48Å; Q173-Q177 WeakPolarHBondContact O-CG 3.48Å; Q173-Q177 PolarHBondContact O-N 2.95Å; Q173-Q177 VanDerWaalsContact O-N 3.09Å; Q173-Q177 PolarHBondContact O-NE2 2.79Å; H175-Q177 VanDerWaalsContact C-N 3.33Å; H175-Q177 PolarHBondContact O-N 3.2Å |
| 178 | G | 88.3 | Confident | 84.8 | Confident | 21 Ų | 21 | 90 Ų | 90 | 22% | 0.216 | 45% | 0.453 | C | S | . | . | S | Bend | trans | -75 | 147.5 | -175.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | A174 H175 Y176 N180 H181 S182 | A174-G178 PolarHBondContact O-N 3.39Å; H175-G178 PolarHBondContact O-N 2.84Å; Y176-G178 PolarHBondContact O-N 3.28Å; G178-N180 PolarHBondContact O-N 3.36Å; G178-H181 PolarHBondContact O-N 3.25Å; G178-S182 PolarHBondContact O-N 3.25Å; G178-S182 PolarHBondContact O-OG 3.16Å |
| 179 | K | 85.6 | Confident | 84.4 | Confident | 188 Ų | 188 | 92.1 Ų | 92.1 | 82% | 0.817 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -61 | -24.9 | 175.3 | -64 | -179.2 | -177.5 | 178.7 | 0 | 113.6 | S182 K183 | K179-S182 VanDerWaalsContact C-OG 3.3Å; K179-S182 VanDerWaalsContact CA-OG 3.25Å; K179-S182 WeakPolarHBondContact CA-OG 3.43Å; K179-S182 PolarHBondContact O-OG 3.48Å; K179-S182 VanDerWaalsContact O-OG 3.11Å; K179-K183 WeakPolarHBondContact O-CB 3.49Å; K179-K183 PolarHBondContact O-N 2.82Å |
| 180 | N | 84.8 | Confident | 84.2 | Confident | 140 Ų | 140 | 93.1 Ų | 93.1 | 75% | 0.749 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -79 | -44.5 | 177.5 | -69.7 | -64.7 | 0 | 0 | 0 | 112.1 | G178 K183 K184 | G178-N180 PolarHBondContact O-N 3.36Å; N180-K183 PolarHBondContact O-N 3.42Å; N180-K184 PolarHBondContact O-N 2.83Å; N180-K184 VanDerWaalsContact O-N 3.08Å |
| 181 | H | 86.4 | Confident | 83.2 | Confident | 11 Ų | 11 | 88.9 Ų | 88.9 | 5% | 0.051 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -64.5 | -47.6 | 177.2 | 179.3 | 76.9 | 0 | 0 | 0 | 110.7 | C159 C162 H175 Y176 G178 K183 K184 L185 | C159-H181 PolarHBondContact SG-CE1 2.9Å; C159-H181 PolarHBondContact SG-ND1 3.44Å; C162-H181 PolarHBondContact SG-ND1 3.3Å; H175-H181 AromaticContact CD2-ND1 3.9Å; H175-H181 AromaticContact NE2-ND1 3.58Å; H175-H181 WeakPolarHBondContact O-CB 3.29Å; Y176-H181 AromaticContact CD1-CE1 3.76Å; Y176-H181 AromaticContact CD1-NE2 3.75Å; Y176-H181 PolarHBondContact O-CD2 3.19Å; Y176-H181 VanDerWaalsContact O-CD2 3.3Å; G178-H181 PolarHBondContact O-N 3.25Å; H181-K183 VanDerWaalsContact C-N 3.31Å; H181-K183 PolarHBondContact O-N 2.93Å; H181-K184 CarbonylContact O-C 3.52Å; H181-K184 PolarHBondContact O-N 3.49Å; H181-L185 WeakPolarHBondContact O-CB 3.42Å; H181-L185 PolarHBondContact O-N 2.94Å |
| 182 | S | 86 | Confident | 82.2 | Confident | 55 Ų | 55 | 86.1 Ų | 86.1 | 39% | 0.385 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -58.6 | -37 | 175.9 | 49.2 | 0 | 0 | 0 | 0 | 113.8 | G178 K179 R186 | G178-S182 PolarHBondContact O-N 3.25Å; G178-S182 PolarHBondContact O-OG 3.16Å; K179-S182 VanDerWaalsContact C-OG 3.3Å; K179-S182 VanDerWaalsContact CA-OG 3.25Å; K179-S182 WeakPolarHBondContact CA-OG 3.43Å; K179-S182 PolarHBondContact O-OG 3.48Å; K179-S182 VanDerWaalsContact O-OG 3.11Å; S182-R186 WeakPolarHBondContact O-CB 3.43Å; S182-R186 PolarHBondContact O-N 2.92Å |
| 183 | K | 85.9 | Confident | 80.7 | Confident | 140 Ų | 140 | 93.3 Ų | 93.3 | 61% | 0.609 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -65.9 | -42 | 172.9 | -173.8 | 176.8 | -178.5 | 178.9 | 0 | 111.9 | K179 N180 H181 R186 N187 | K179-K183 WeakPolarHBondContact O-CB 3.49Å; K179-K183 PolarHBondContact O-N 2.82Å; N180-K183 PolarHBondContact O-N 3.42Å; H181-K183 VanDerWaalsContact C-N 3.31Å; H181-K183 PolarHBondContact O-N 2.93Å; K183-R186 PolarHBondContact O-N 2.89Å; K183-N187 WeakPolarHBondContact O-CB 3.14Å; K183-N187 VanDerWaalsContact O-CG 3.23Å; K183-N187 PolarHBondContact O-N 2.93Å; K183-N187 VanDerWaalsContact O-N 3.08Å; K183-N187 PolarHBondContact O-OD1 3.08Å |
| 184 | K | 82.4 | Confident | 78.7 | Confident | 94 Ų | 94 | 95.8 Ų | 95.8 | 41% | 0.409 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -68.7 | -37.2 | 178.2 | -151.9 | 172.4 | -171.5 | -158.1 | 0 | 111.4 | L161 N180 H181 N187 F188 | L161-K184 VanDerWaalsContact O-CD 3.25Å; L161-K184 WeakPolarHBondContact O-CD 3.16Å; L161-K184 WeakPolarHBondContact O-CE 3.34Å; L161-K184 PolarHBondContact O-NZ 2.89Å; N180-K184 PolarHBondContact O-N 2.83Å; N180-K184 VanDerWaalsContact O-N 3.08Å; H181-K184 CarbonylContact O-C 3.52Å; H181-K184 PolarHBondContact O-N 3.49Å; K184-N187 PolarHBondContact O-N 3.3Å; K184-F188 WeakPolarHBondContact O-CB 3.5Å; K184-F188 PolarHBondContact O-N 2.9Å |
| 185 | L | 85.3 | Confident | 76.3 | Confident | 41 Ų | 41 | 98.2 Ų | 98.2 | 22% | 0.215 | 51% | 0.506 | C | S | . | . | H | α-helix | trans | -61 | -50.8 | 173.2 | -172 | 71 | 0 | 0 | 0 | 111.2 | L150 L161 H181 N187 F188 Y189 | L150-L185 HydrophobicContact CD1-CD1 3.74Å; L161-L185 HydrophobicContact CD1-CD1 3.26Å; L161-L185 HydrophobicContact CD1-CG 4.5Å; H181-L185 WeakPolarHBondContact O-CB 3.42Å; H181-L185 PolarHBondContact O-N 2.94Å; L185-N187 VanDerWaalsContact C-N 3.31Å; L185-N187 PolarHBondContact O-N 2.86Å; L185-F188 WeakPolarHBondContact O-CB 3.43Å; L185-F188 PolarHBondContact O-N 3.26Å; L185-F188 VanDerWaalsContact O-N 3.16Å; L185-Y189 HydrophobicContact CD1-CD2 4.16Å; L185-Y189 HydrophobicContact CD1-CE2 3.62Å; L185-Y189 HydrophobicContact CD2-CE2 4.4Å; L185-Y189 HydrophobicContact CG-CD2 3.97Å; L185-Y189 HydrophobicContact CG-CE2 3.75Å; L185-Y189 VanDerWaalsContact O-CD2 3.25Å; L185-Y189 WeakPolarHBondContact O-CD2 2.92Å; L185-Y189 PolarHBondContact O-N 3.48Å |
| 186 | R | 84.1 | Confident | 74.1 | Confident | 193 Ų | 193 | 101.8 Ų | 101.8 | 73% | 0.728 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -59.9 | -41.4 | 177.5 | -171.9 | -175.2 | -66.8 | 170.8 | -2.3 | 112.3 | S182 K183 A190 | S182-R186 WeakPolarHBondContact O-CB 3.43Å; S182-R186 PolarHBondContact O-N 2.92Å; K183-R186 PolarHBondContact O-N 2.89Å; R186-A190 WeakPolarHBondContact O-CB 3.25Å; R186-A190 PolarHBondContact O-N 2.95Å |
| 187 | N | 82.9 | Confident | 71.6 | Confident | 100 Ų | 100 | 104 Ų | 104 | 54% | 0.535 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -68.7 | -35.3 | 177.5 | -71.4 | 1.4 | 0 | 0 | 0 | 112.4 | K183 K184 L185 A190 G191 | K183-N187 WeakPolarHBondContact O-CB 3.14Å; K183-N187 VanDerWaalsContact O-CG 3.23Å; K183-N187 PolarHBondContact O-N 2.93Å; K183-N187 VanDerWaalsContact O-N 3.08Å; K183-N187 PolarHBondContact O-OD1 3.08Å; K184-N187 PolarHBondContact O-N 3.3Å; L185-N187 VanDerWaalsContact C-N 3.31Å; L185-N187 PolarHBondContact O-N 2.86Å; N187-A190 PolarHBondContact O-N 2.78Å; N187-G191 PolarHBondContact O-N 3.41Å; N187-G191 VanDerWaalsContact O-N 3.15Å |
| 188 | F | 81.1 | Confident | 69.3 | Low | 100 Ų | 100 | 104.9 Ų | 104.9 | 44% | 0.439 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -63.7 | -52.8 | 174.4 | -174 | -97.8 | 0 | 0 | 0 | 110 | L153 L161 K184 L185 A190 G191 S192 | L153-F188 HydrophobicContact CD2-CE1 4.29Å; L153-F188 HydrophobicContact CD2-CZ 4.2Å; L161-F188 HydrophobicContact CD2-CB 3.99Å; L161-F188 HydrophobicContact CD2-CD1 3.81Å; L161-F188 HydrophobicContact CD2-CD2 3.86Å; L161-F188 HydrophobicContact CD2-CE1 4.23Å; L161-F188 HydrophobicContact CD2-CE2 4.28Å; L161-F188 HydrophobicContact CD2-CG 3.6Å; L161-F188 HydrophobicContact CD2-CZ 4.45Å; K184-F188 WeakPolarHBondContact O-CB 3.5Å; K184-F188 PolarHBondContact O-N 2.9Å; L185-F188 WeakPolarHBondContact O-CB 3.43Å; L185-F188 PolarHBondContact O-N 3.26Å; L185-F188 VanDerWaalsContact O-N 3.16Å; F188-A190 VanDerWaalsContact C-N 3.27Å; F188-A190 PolarHBondContact O-N 3.03Å; F188-G191 CarbonylContact O-C 3.56Å; F188-G191 PolarHBondContact O-N 3.3Å; F188-S192 WeakPolarHBondContact CD1-OG 3.45Å; F188-S192 WeakPolarHBondContact CE1-OG 3.49Å; F188-S192 VanDerWaalsContact O-CB 3.24Å; F188-S192 WeakPolarHBondContact O-CB 3.42Å; F188-S192 PolarHBondContact O-N 3.31Å; F188-S192 PolarHBondContact O-OG 3.33Å |
| 189 | Y | 77 | Confident | 67.8 | Low | 103 Ų | 103 | 114.6 Ų | 114.6 | 40% | 0.404 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -58.9 | -34.5 | 175.7 | -79.4 | -72.2 | 0 | 0 | 0 | 113.8 | L185 G191 Q193 | L185-Y189 HydrophobicContact CD1-CD2 4.16Å; L185-Y189 HydrophobicContact CD1-CE2 3.62Å; L185-Y189 HydrophobicContact CD2-CE2 4.4Å; L185-Y189 HydrophobicContact CG-CD2 3.97Å; L185-Y189 HydrophobicContact CG-CE2 3.75Å; L185-Y189 VanDerWaalsContact O-CD2 3.25Å; L185-Y189 WeakPolarHBondContact O-CD2 2.92Å; L185-Y189 PolarHBondContact O-N 3.48Å; Y189-G191 VanDerWaalsContact C-N 3.26Å; Y189-G191 PolarHBondContact O-N 2.95Å; Y189-Q193 WeakPolarHBondContact O-CG 3.44Å |
| 190 | A | 77.8 | Confident | 65.7 | Low | 88 Ų | 88 | 113.4 Ų | 113.4 | 73% | 0.727 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -70.8 | -20 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | R186 N187 F188 | R186-A190 WeakPolarHBondContact O-CB 3.25Å; R186-A190 PolarHBondContact O-N 2.95Å; N187-A190 PolarHBondContact O-N 2.78Å; F188-A190 VanDerWaalsContact C-N 3.27Å; F188-A190 PolarHBondContact O-N 3.03Å |
| 191 | G | 62.6 | Low | 63.8 | Low | 67 Ų | 67 | 111.5 Ų | 111.5 | 69% | 0.691 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -109.6 | -19.6 | 179.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | N187 F188 Y189 | N187-G191 PolarHBondContact O-N 3.41Å; N187-G191 VanDerWaalsContact O-N 3.15Å; F188-G191 CarbonylContact O-C 3.56Å; F188-G191 PolarHBondContact O-N 3.3Å; Y189-G191 VanDerWaalsContact C-N 3.26Å; Y189-G191 PolarHBondContact O-N 2.95Å |
| 192 | S | 61.3 | Low | 61.5 | Low | 45 Ų | 45 | 120 Ų | 120 | 32% | 0.315 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -99.3 | -1.7 | -173.4 | 70 | 0 | 0 | 0 | 0 | 114.2 | F188 Q194 | F188-S192 WeakPolarHBondContact CD1-OG 3.45Å; F188-S192 WeakPolarHBondContact CE1-OG 3.49Å; F188-S192 VanDerWaalsContact O-CB 3.24Å; F188-S192 WeakPolarHBondContact O-CB 3.42Å; F188-S192 PolarHBondContact O-N 3.31Å; F188-S192 PolarHBondContact O-OG 3.33Å; S192-Q194 PolarHBondContact O-N 3.08Å |
| 193 | Q | 49.8 | Very low | 58.9 | Low | 153 Ų | 153 | 121.7 Ų | 121.7 | 72% | 0.715 | 65% | 0.653 | S | S | * | * | trans | -81.6 | 24.9 | 178 | -69.1 | -74.1 | 72.1 | 0 | 0 | 114.2 | Y189 | Y189-Q193 WeakPolarHBondContact O-CG 3.44Š| ||
| 194 | Q | 42.2 | Very low | 56.2 | Low | 171 Ų | 171 | 122.3 Ų | 122.3 | 80% | 0.799 | 66% | 0.662 | S | S | * | * | S | Bend | trans | -95.3 | 116.5 | 156.8 | -93.6 | -162.5 | -66.1 | 0 | 0 | 108.8 | S192 | S192-Q194 PolarHBondContact O-N 3.08Š|
| 195 | P | 39.1 | Very low | 53.8 | Low | 117 Ų | 117 | 126.7 Ų | 126.7 | 76% | 0.76 | 68% | 0.684 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 145.2 | 179.5 | -18.4 | 29.5 | 0 | 0 | 0 | 111.7 | ||
| 196 | P | 41.3 | Very low | 51.2 | Low | 116 Ų | 116 | 128.6 Ų | 128.6 | 75% | 0.753 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 137 | 175.1 | 29.9 | -32.3 | 0 | 0 | 0 | 109.9 | I198 | P196-I198 PolarHBondContact O-N 3.37Š|
| 197 | A | 33.6 | Very low | 48.7 | Very low | 99 Ų | 99 | 124.5 Ų | 124.5 | 82% | 0.818 | 72% | 0.721 | S | S | * | * | trans | -60.8 | 105.9 | -179.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | R199 | A197-R199 PolarHBondContact O-N 3.08Š| ||
| 198 | I | 38.1 | Very low | 46.1 | Very low | 160 Ų | 160 | 123.3 Ų | 123.3 | 82% | 0.821 | 73% | 0.732 | S | S | * | * | trans | -62.7 | 122 | 168.7 | -66.6 | 166.6 | 0 | 0 | 0 | 108 | P196 | P196-I198 PolarHBondContact O-N 3.37Š| ||
| 199 | R | 56.6 | Low | 44.8 | Very low | 226 Ų | 226 | 124.3 Ų | 124.3 | 85% | 0.853 | 75% | 0.748 | S | S | * | * | trans | -77.8 | 143.8 | 161.2 | -63 | -154.8 | 174.1 | 179 | 0.2 | 108.7 | A197 | A197-R199 PolarHBondContact O-N 3.08Š| ||
| 200 | I | 40.5 | Very low | 42.7 | Very low | 162 Ų | 162 | 126.7 Ų | 126.7 | 83% | 0.831 | 77% | 0.768 | S | S | * | * | trans | -179.2 | 155.2 | 140.4 | -89.5 | 150.4 | 0 | 0 | 0 | 111 | ||||
| 201 | P | 45.7 | Very low | 40.6 | Very low | 101 Ų | 101 | 127.1 Ų | 127.1 | 66% | 0.656 | 77% | 0.771 | S | S | * | * | trans | -97.1 | 171.6 | -156 | -7.7 | 30.1 | 0 | 0 | 0 | 119.1 | ||||
| 202 | E | 37.2 | Very low | 39.2 | Very low | 188 Ų | 188 | 127.7 Ų | 127.7 | 88% | 0.879 | 78% | 0.778 | S | S | * | * | trans | 81.1 | 136.1 | 145.2 | -82.2 | -178 | 112.8 | 0 | 0 | 124.4 | ||||
| 203 | A | 32.3 | Very low | 37.8 | Very low | 91 Ų | 91 | 131.9 Ų | 131.9 | 75% | 0.752 | 81% | 0.807 | S | S | * | * | trans | 82.7 | 115.7 | 139.1 | 0 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 204 | L | 29.4 | Very low | 36.8 | Very low | 154 Ų | 154 | 128.3 Ų | 128.3 | 81% | 0.806 | 81% | 0.811 | S | S | * | * | 139.7 | 116.7 | 109.2 | -164.6 | 70.8 | 0 | 0 | 0 | 114.4 | |||||
| 205 | E | 31.8 | Very low | 36.2 | Very low | 186 Ų | 186 | 125.1 Ų | 125.1 | 87% | 0.869 | 81% | 0.814 | S | S | * | * | trans | 7.1 | 149.8 | 151.2 | -59.3 | -163.2 | 97 | 0 | 0 | 123.9 | ||||
| 206 | G | 30.6 | Very low | 36 | Very low | 81 Ų | 81 | 123.9 Ų | 123.9 | 84% | 0.835 | 81% | 0.813 | S | S | * | * | trans | 167.3 | 109.1 | 151.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 207 | A | 31.1 | Very low | 35.8 | Very low | 107 Ų | 107 | 126.2 Ų | 126.2 | 88% | 0.884 | 82% | 0.82 | S | S | * | * | trans | -74.9 | 165.5 | -170.4 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 208 | G | 29.9 | Very low | 35.9 | Very low | 74 Ų | 74 | 126.6 Ų | 126.6 | 76% | 0.763 | 82% | 0.823 | S | S | * | * | trans | -73.5 | -140.7 | -179.7 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 209 | P | 52.9 | Low | 36 | Very low | 121 Ų | 121 | 126.8 Ų | 126.8 | 79% | 0.786 | 83% | 0.826 | S | S | * | * | cis | -135.4 | 178.1 | -5.1 | 39.1 | -19.8 | 0 | 0 | 0 | 115 | ||||
| 210 | N | 33.8 | Very low | 35.4 | Very low | 154 Ų | 154 | 119.4 Ų | 119.4 | 82% | 0.824 | 82% | 0.82 | S | S | * | * | 149.5 | 131.5 | 111.8 | -138.5 | -8.6 | 0 | 0 | 0 | 117.4 | |||||
| 211 | A | 33 | Very low | 35.1 | Very low | 96 Ų | 96 | 115.6 Ų | 115.6 | 79% | 0.793 | 82% | 0.82 | S | S | * | * | trans | 40 | 135.4 | 150.4 | 0 | 0 | 0 | 0 | 0 | 125.8 | ||||
| 212 | G | 32 | Very low | 35.2 | Very low | 80 Ų | 80 | 121.2 Ų | 121.2 | 83% | 0.825 | 83% | 0.829 | S | S | * | * | trans | 163.9 | 110 | 151.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 213 | S | 33.6 | Very low | 35.3 | Very low | 133 Ų | 133 | 120 Ų | 120 | 93% | 0.93 | 82% | 0.823 | S | S | * | * | trans | -79.3 | 159.9 | -168.5 | -40.2 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 214 | G | 28.3 | Very low | 36 | Very low | 77 Ų | 77 | 119.5 Ų | 119.5 | 79% | 0.794 | 82% | 0.819 | S | S | * | * | trans | 148.5 | 103.3 | 150.1 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 215 | A | 29.8 | Very low | 36.3 | Very low | 105 Ų | 105 | 119.1 Ų | 119.1 | 87% | 0.868 | 82% | 0.817 | S | S | * | * | trans | 37.6 | 118.2 | 143.4 | 0 | 0 | 0 | 0 | 0 | 124.9 | ||||
| 216 | A | 33.8 | Very low | 36.8 | Very low | 90 Ų | 90 | 119.2 Ų | 119.2 | 74% | 0.744 | 81% | 0.81 | S | S | * | * | trans | 26.5 | 131.6 | 134.9 | 0 | 0 | 0 | 0 | 0 | 125.2 | ||||
| 217 | D | 37.2 | Very low | 36.9 | Very low | 165 Ų | 165 | 125.3 Ų | 125.3 | 88% | 0.882 | 81% | 0.814 | S | S | * | * | trans | 69.5 | 108.9 | 144.8 | -62 | -46 | 0 | 0 | 0 | 121.8 | ||||
| 218 | A | 36.4 | Very low | 37.5 | Very low | 108 Ų | 108 | 124.2 Ų | 124.2 | 89% | 0.893 | 81% | 0.813 | S | S | * | * | trans | -157.7 | 144.9 | 149.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 219 | D | 40.3 | Very low | 37.5 | Very low | 164 Ų | 164 | 124.5 Ų | 124.5 | 88% | 0.877 | 81% | 0.808 | S | S | * | * | trans | -65.2 | 154.4 | 175.5 | 171.9 | -117.5 | 0 | 0 | 0 | 115.4 | ||||
| 220 | G | 44.3 | Very low | 37.1 | Very low | 70 Ų | 70 | 125 Ų | 125 | 72% | 0.722 | 81% | 0.811 | S | S | * | * | trans | 48.6 | 112 | 148.6 | 0 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 221 | G | 34.5 | Very low | 37.3 | Very low | 82 Ų | 82 | 128.1 Ų | 128.1 | 85% | 0.845 | 81% | 0.812 | S | S | * | * | trans | 175 | 137.4 | 161.8 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 222 | R | 47.1 | Very low | 38.1 | Very low | 220 Ų | 220 | 129.8 Ų | 129.8 | 83% | 0.83 | 81% | 0.811 | S | S | * | * | trans | -96.7 | 148.8 | -167.6 | -65.1 | 166.3 | 62.4 | 173.3 | -0.6 | 112.7 | ||||
| 223 | Q | 40.2 | Very low | 38.7 | Very low | 162 Ų | 162 | 130.9 Ų | 130.9 | 76% | 0.757 | 80% | 0.798 | S | S | * | * | trans | 87.1 | 113.9 | 147.4 | -71.6 | 173.3 | 97.4 | 0 | 0 | 122 | ||||
| 224 | A | 45.4 | Very low | 39.4 | Very low | 81 Ų | 81 | 131.7 Ų | 131.7 | 67% | 0.669 | 79% | 0.79 | S | S | * | * | trans | 70.8 | 110.7 | 130.6 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 225 | L | 35.9 | Very low | 40 | Very low | 146 Ų | 146 | 132.6 Ų | 132.6 | 76% | 0.764 | 79% | 0.791 | S | S | * | * | trans | -158.3 | 139.3 | 135.5 | -145.5 | 75.3 | 0 | 0 | 0 | 112.1 | ||||
| 226 | Y | 42.3 | Very low | 41 | Very low | 187 Ų | 187 | 131.4 Ų | 131.4 | 73% | 0.733 | 77% | 0.773 | S | S | * | * | trans | -85.8 | 130.5 | -171.3 | 7.2 | -93.9 | 0 | 0 | 0 | 111.1 | ||||
| 227 | K | 33.1 | Very low | 42.2 | Very low | 210 Ų | 210 | 135.4 Ų | 135.4 | 91% | 0.913 | 78% | 0.776 | S | S | * | * | trans | -161.9 | 132.9 | 151 | -132.3 | 166.9 | 178.6 | -171.2 | 0 | 111.7 | ||||
| 228 | G | 42.9 | Very low | 43.5 | Very low | 84 Ų | 84 | 130.1 Ų | 130.1 | 87% | 0.866 | 75% | 0.748 | S | S | * | * | trans | -60.2 | 131.9 | -171.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 229 | A | 30.7 | Very low | 45.3 | Very low | 80 Ų | 80 | 126.3 Ų | 126.3 | 66% | 0.661 | 71% | 0.713 | S | S | * | * | trans | -157 | 140 | 154.4 | 0 | 0 | 0 | 0 | 0 | 107.3 | R231 | A229-R231 PolarHBondContact O-N 3.17Š| ||
| 230 | P | 44.7 | Very low | 47.3 | Very low | 130 Ų | 130 | 123.5 Ų | 123.5 | 84% | 0.844 | 69% | 0.69 | S | S | * | * | trans | -73.6 | 100 | -178.7 | 31.3 | -30.2 | 0 | 0 | 0 | 107.7 | V232 | P230-V232 PolarHBondContact O-N 3.41Š| ||
| 231 | R | 38.1 | Very low | 49.4 | Very low | 221 Ų | 221 | 120.2 Ų | 120.2 | 83% | 0.834 | 66% | 0.656 | S | S | * | * | trans | -72 | 109.9 | 168.4 | -72.2 | -176.9 | 139.6 | 143.6 | -2.9 | 106.9 | A229 I233 | A229-R231 PolarHBondContact O-N 3.17Å; R231-I233 HydrophobicContact CB-CG1 4.39Å; R231-I233 WeakPolarHBondContact O-CG1 3.34Å; R231-I233 PolarHBondContact O-N 2.83Å | ||
| 232 | V | 49.2 | Very low | 51.8 | Low | 130 Ų | 130 | 124.6 Ų | 124.6 | 79% | 0.788 | 65% | 0.652 | S | S | * | * | trans | -59.3 | 97.8 | 154.7 | 176.3 | 0 | 0 | 0 | 0 | 105.1 | P230 L234 | P230-V232 PolarHBondContact O-N 3.41Å; V232-L234 PolarHBondContact O-N 3.46Å | ||
| 233 | I | 44.5 | Very low | 53.7 | Low | 104 Ų | 104 | 117.2 Ų | 117.2 | 53% | 0.533 | 63% | 0.629 | S | S | . | * | trans | -71.4 | 102.6 | 178.2 | -54.2 | 179.1 | 0 | 0 | 0 | 105.4 | R231 A235 D239 | R231-I233 HydrophobicContact CB-CG1 4.39Å; R231-I233 WeakPolarHBondContact O-CG1 3.34Å; R231-I233 PolarHBondContact O-N 2.83Å; I233-A235 PolarHBondContact O-N 3.39Å; I233-A235 VanDerWaalsContact O-N 3.13Å; I233-D239 VanDerWaalsContact CG2-OD2 3.26Å; I233-D239 WeakPolarHBondContact CG2-OD2 3.25Å | ||
| 234 | L | 48.1 | Very low | 55.8 | Low | 149 Ų | 149 | 111 Ų | 111 | 78% | 0.78 | 60% | 0.602 | S | S | * | * | trans | -53.4 | 119.5 | 161.7 | -88.1 | 74.6 | 0 | 0 | 0 | 106 | V232 T236 | V232-L234 PolarHBondContact O-N 3.46Å; L234-T236 PolarHBondContact O-N 3.37Å | ||
| 235 | A | 41.6 | Very low | 57.8 | Low | 97 Ų | 97 | 112.3 Ų | 112.3 | 80% | 0.802 | 60% | 0.599 | S | S | * | * | trans | -50.1 | 96.9 | -171.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | I233 | I233-A235 PolarHBondContact O-N 3.39Å; I233-A235 VanDerWaalsContact O-N 3.13Å | ||
| 236 | T | 51.8 | Low | 60 | Low | 80 Ų | 80 | 106.7 Ų | 106.7 | 49% | 0.491 | 57% | 0.573 | S | S | . | * | trans | -77.8 | 145.1 | 157.5 | 56.1 | 0 | 0 | 0 | 0 | 106.7 | L234 N238 D239 | L234-T236 PolarHBondContact O-N 3.37Å; T236-N238 PolarHBondContact O-N 3.42Å; T236-D239 PolarHBondContact O-N 3.48Å; T236-D239 VanDerWaalsContact O-N 3.14Å; T236-D239 PolarHBondContact OG1-OD2 3.28Å | ||
| 237 | E | 59.1 | Low | 62.2 | Low | 173 Ų | 173 | 102.4 Ų | 102.4 | 81% | 0.808 | 57% | 0.571 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.5 | -4.8 | -175.4 | 62.1 | -166.7 | 146.2 | 0 | 0 | 116 | Y258 | E237-Y258 PolarHBondContact O-OH 3.17Š|
| 238 | N | 62.8 | Low | 64.7 | Low | 54 Ų | 54 | 93.9 Ų | 93.9 | 29% | 0.289 | 53% | 0.533 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.2 | -11.8 | -177.9 | -57.5 | 78.1 | 0 | 0 | 0 | 113.9 | T236 L251 A254 | T236-N238 PolarHBondContact O-N 3.42Å; N238-L251 HydrophobicContact CB-CD1 3.64Å; N238-A254 WeakPolarHBondContact O-CB 3.33Å |
| 239 | D | 75.3 | Confident | 66.4 | Low | 29 Ų | 29 | 95 Ų | 95 | 16% | 0.155 | 53% | 0.528 | C | S | . | . | S | Bend | trans | -88.6 | -14.1 | -175.4 | -58.7 | -49.2 | 0 | 0 | 0 | 113.5 | I233 T236 S247 F248 | I233-D239 VanDerWaalsContact CG2-OD2 3.26Å; I233-D239 WeakPolarHBondContact CG2-OD2 3.25Å; T236-D239 PolarHBondContact O-N 3.48Å; T236-D239 VanDerWaalsContact O-N 3.14Å; T236-D239 PolarHBondContact OG1-OD2 3.28Å; D239-S247 WeakPolarHBondContact O-CA 3.25Å; D239-F248 PolarHBondContact O-N 3.47Å |
| 240 | Y | 82.9 | Confident | 68.9 | Low | 105 Ų | 105 | 93.4 Ų | 93.4 | 41% | 0.412 | 51% | 0.512 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.9 | 126.8 | -179.3 | -177.1 | -99.8 | 0 | 0 | 0 | 113.1 | K242 D245 A246 Y258 | Y240-K242 HydrophobicContact CD1-CG 3.83Å; Y240-K242 HydrophobicContact CE1-CB 4.25Å; Y240-K242 HydrophobicContact CE1-CG 3.77Å; Y240-D245 WeakPolarHBondContact OH-CA 3.28Å; Y240-D245 WeakPolarHBondContact OH-CB 3.37Å; Y240-D245 PolarHBondContact OH-OD1 3.2Å; Y240-A246 WeakPolarHBondContact CA-O 3.14Å; Y240-Y258 PolarHBondContact O-OH 3.46Å; Y240-Y258 VanDerWaalsContact O-OH 3.11Å |
| 241 | C | 86.8 | Confident | 70.7 | Confident | 1 Ų | 1 | 91.5 Ų | 91.5 | 1% | 0.007 | 49% | 0.494 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.8 | 106 | 173.5 | -176.6 | 0 | 0 | 0 | 0 | 111.1 | L243 C244 D245 A246 F248 H257 Y258 H263 | C241-L243 VanDerWaalsContact C-N 3.27Å; C241-L243 PolarHBondContact O-N 2.64Å; C241-C244 HydrophobicContact CB-CB 4.18Å; C241-C244 CarbonylContact O-C 3.44Å; C241-C244 PolarHBondContact O-N 3.43Å; C241-C244 PolarHBondContact SG-N 3.36Å; C241-C244 VanDerWaalsContact SG-N 3.42Å; C241-D245 VanDerWaalsContact O-CA 3.27Å; C241-D245 WeakPolarHBondContact O-CA 3.3Å; C241-D245 PolarHBondContact O-N 3.36Å; C241-A246 PolarHBondContact N-O 2.85Å; C241-A246 PolarHBondContact O-N 3.01Å; C241-F248 HydrophobicContact CB-CE2 3.94Å; C241-F248 HydrophobicContact CB-CZ 4.12Å; C241-H257 PolarHBondContact SG-NE2 3.33Å; C241-H257 VanDerWaalsContact SG-NE2 3.43Å; C241-Y258 WeakPolarHBondContact CA-OH 3.24Å; C241-Y258 HydrophobicContact CB-CE1 4.12Å; C241-H263 PolarHBondContact SG-CE1 3.3Å; C241-H263 PolarHBondContact SG-ND1 3.03Å |
| 242 | K | 85.2 | Confident | 72.8 | Confident | 174 Ų | 174 | 84.2 Ų | 84.2 | 76% | 0.757 | 48% | 0.481 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.2 | -29.7 | 176.2 | -61.3 | -179.7 | -179.2 | -179.8 | 0 | 113.7 | Y240 C244 | Y240-K242 HydrophobicContact CD1-CG 3.83Å; Y240-K242 HydrophobicContact CE1-CB 4.25Å; Y240-K242 HydrophobicContact CE1-CG 3.77Å; K242-C244 VanDerWaalsContact C-N 3.31Å |
| 243 | L | 86.7 | Confident | 74.6 | Confident | 64 Ų | 64 | 81.4 Ų | 81.4 | 34% | 0.335 | 46% | 0.464 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.2 | -34.7 | 177.7 | -66.6 | 176.6 | 0 | 0 | 0 | 110.7 | C241 K266 L267 A270 | C241-L243 VanDerWaalsContact C-N 3.27Å; C241-L243 PolarHBondContact O-N 2.64Å; L243-K266 WeakPolarHBondContact O-CD 3.4Å; L243-K266 WeakPolarHBondContact O-CE 3.47Å; L243-K266 PolarHBondContact O-NZ 2.98Å; L243-L267 HydrophobicContact CD1-CB 4.34Å; L243-L267 HydrophobicContact CD1-CD1 3.4Å; L243-L267 HydrophobicContact CD1-CG 4.46Å; L243-A270 HydrophobicContact CD2-CB 4.12Å |
| 244 | C | 85.3 | Confident | 76.5 | Confident | 31 Ų | 31 | 76.4 Ų | 76.4 | 21% | 0.209 | 44% | 0.439 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -106.2 | -4.1 | -175.2 | -68.9 | 0 | 0 | 0 | 0 | 114.3 | C241 K242 A246 H257 | C241-C244 HydrophobicContact CB-CB 4.18Å; C241-C244 CarbonylContact O-C 3.44Å; C241-C244 PolarHBondContact O-N 3.43Å; C241-C244 PolarHBondContact SG-N 3.36Å; C241-C244 VanDerWaalsContact SG-N 3.42Å; K242-C244 VanDerWaalsContact C-N 3.31Å; C244-A246 HydrophobicContact CB-CB 4.26Å; C244-A246 PolarHBondContact O-N 3.21Å; C244-H257 VanDerWaalsContact CB-CE1 3.5Å; C244-H257 WeakPolarHBondContact CB-CE1 3.47Å; C244-H257 WeakPolarHBondContact CB-NE2 3.49Å; C244-H257 PolarHBondContact SG-NE2 3.49Å |
| 245 | D | 86.1 | Confident | 78.3 | Confident | 110 Ų | 110 | 74 Ų | 74 | 59% | 0.588 | 42% | 0.423 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 44.7 | 47.2 | -169.3 | -59.8 | -48.4 | 0 | 0 | 0 | 113 | Y240 C241 | Y240-D245 WeakPolarHBondContact OH-CA 3.28Å; Y240-D245 WeakPolarHBondContact OH-CB 3.37Å; Y240-D245 PolarHBondContact OH-OD1 3.2Å; C241-D245 VanDerWaalsContact O-CA 3.27Å; C241-D245 WeakPolarHBondContact O-CA 3.3Å; C241-D245 PolarHBondContact O-N 3.36Å |
| 246 | A | 83.9 | Confident | 80.5 | Confident | 27 Ų | 27 | 72.5 Ų | 72.5 | 22% | 0.223 | 41% | 0.411 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.7 | 127.1 | -176 | 0 | 0 | 0 | 0 | 0 | 110.4 | Y240 C241 C244 F248 | Y240-A246 WeakPolarHBondContact CA-O 3.14Å; C241-A246 PolarHBondContact N-O 2.85Å; C241-A246 PolarHBondContact O-N 3.01Å; C244-A246 HydrophobicContact CB-CB 4.26Å; C244-A246 PolarHBondContact O-N 3.21Å; A246-F248 HydrophobicContact CB-CE1 4.06Å; A246-F248 HydrophobicContact CB-CZ 3.8Å |
| 247 | S | 87 | Confident | 82.5 | Confident | 98 Ų | 98 | 70.7 Ų | 70.7 | 69% | 0.685 | 40% | 0.397 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -95.5 | 147.4 | 169.2 | 54.3 | 0 | 0 | 0 | 0 | 110.8 | D239 | D239-S247 WeakPolarHBondContact O-CA 3.25Å |
| 248 | F | 85.3 | Confident | 83.9 | Confident | 30 Ų | 30 | 65.9 Ų | 65.9 | 13% | 0.132 | 37% | 0.372 | C | S | . | . | trans | -117.8 | 140.7 | -178.3 | -52.1 | -66.9 | 0 | 0 | 0 | 111.2 | D239 C241 A246 S250 V253 A254 H257 Y258 | D239-F248 PolarHBondContact O-N 3.47Å; C241-F248 HydrophobicContact CB-CE2 3.94Å; C241-F248 HydrophobicContact CB-CZ 4.12Å; A246-F248 HydrophobicContact CB-CE1 4.06Å; A246-F248 HydrophobicContact CB-CZ 3.8Å; F248-S250 VanDerWaalsContact C-N 3.28Å; F248-V253 HydrophobicContact CB-CG1 4.39Å; F248-V253 HydrophobicContact CD1-CG1 3.85Å; F248-V253 HydrophobicContact CG-CG1 4.47Å; F248-A254 HydrophobicContact CB-CB 3.9Å; F248-A254 HydrophobicContact CD2-CB 3.42Å; F248-A254 VanDerWaalsContact CD2-CB 3.42Å; F248-A254 HydrophobicContact CE2-CB 4.2Å; F248-A254 HydrophobicContact CG-CB 3.76Å; F248-H257 HydrophobicContact CD1-CB 4.33Å; F248-H257 HydrophobicContact CE1-CB 3.49Å; F248-H257 VanDerWaalsContact CE1-CB 3.49Å; F248-H257 AromaticContact CE1-CG 3.51Å; F248-H257 AromaticContact CE1-ND1 3.6Å; F248-H257 HydrophobicContact CE2-CB 4.16Å; F248-H257 AromaticContact CE2-CD2 3.97Å; F248-H257 HydrophobicContact CZ-CB 3.42Å; F248-H257 VanDerWaalsContact CZ-CB 3.42Å; F248-H257 AromaticContact CZ-CD2 3.34Å; F248-H257 WeakPolarHBondContact CZ-CD2 3.47Å; F248-H257 AromaticContact CZ-CE1 3.79Å; F248-H257 AromaticContact CZ-CG 3.1Å; F248-H257 AromaticContact CZ-ND1 3.42Å; F248-H257 WeakPolarHBondContact CZ-ND1 3.44Å; F248-H257 AromaticContact CZ-NE2 3.79Å; F248-Y258 HydrophobicContact CE2-CE2 4.49Å | ||
| 249 | S | 80.6 | Confident | 85.1 | Confident | 109 Ų | 109 | 70.8 Ų | 70.8 | 76% | 0.762 | 39% | 0.393 | S | S | * | . | S | Bend | trans | -79.9 | -9.3 | 177.7 | 53.3 | 0 | 0 | 0 | 0 | 113.6 | ||
| 250 | S | 83.1 | Confident | 85.8 | Confident | 46 Ų | 46 | 70.4 Ų | 70.4 | 32% | 0.322 | 40% | 0.396 | S | S | . | . | S | Bend | trans | -159.8 | 154.9 | 175.4 | 64.8 | 0 | 0 | 0 | 0 | 112.4 | F248 A252 V253 A254 | F248-S250 VanDerWaalsContact C-N 3.28Å; S250-A252 VanDerWaalsContact C-N 3.29Å; S250-A252 PolarHBondContact O-N 2.83Å; S250-V253 PolarHBondContact O-N 3.06Å; S250-V253 VanDerWaalsContact O-N 3.13Å; S250-V253 VanDerWaalsContact OG-CG2 3.27Å; S250-V253 WeakPolarHBondContact OG-CG2 3.45Å; S250-A254 PolarHBondContact O-N 3.42Å |
| 251 | L | 81.6 | Confident | 86.2 | Confident | 89 Ų | 89 | 74.6 Ų | 74.6 | 47% | 0.466 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -58.1 | -37.5 | 178.2 | -177.1 | 63.7 | 0 | 0 | 0 | 113 | N238 V253 A254 Q255 | N238-L251 HydrophobicContact CB-CD1 3.64Å; L251-V253 VanDerWaalsContact C-N 3.32Å; L251-V253 PolarHBondContact O-N 2.58Å; L251-A254 WeakPolarHBondContact O-CB 3.25Å; L251-A254 PolarHBondContact O-N 3.49Å; L251-Q255 HydrophobicContact CD1-CG 4.48Å; L251-Q255 HydrophobicContact CG-CG 4.5Å; L251-Q255 WeakPolarHBondContact O-CB 3.4Å; L251-Q255 WeakPolarHBondContact O-CG 3.29Å; L251-Q255 PolarHBondContact O-N 2.86Å |
| 252 | A | 83.2 | Confident | 86.2 | Confident | 68 Ų | 68 | 81.1 Ų | 81.1 | 56% | 0.562 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -63.6 | -39 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | S250 Q255 A256 | S250-A252 VanDerWaalsContact C-N 3.29Å; S250-A252 PolarHBondContact O-N 2.83Å; A252-Q255 PolarHBondContact O-N 2.96Å; A252-A256 WeakPolarHBondContact O-CB 3.46Å; A252-A256 PolarHBondContact O-N 3.16Å |
| 253 | V | 85.5 | Confident | 86.5 | Confident | 71 Ų | 71 | 73.5 Ų | 73.5 | 43% | 0.43 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -70.5 | -40.9 | 177 | 176.7 | 0 | 0 | 0 | 0 | 110.7 | F248 S250 L251 A256 H257 | F248-V253 HydrophobicContact CB-CG1 4.39Å; F248-V253 HydrophobicContact CD1-CG1 3.85Å; F248-V253 HydrophobicContact CG-CG1 4.47Å; S250-V253 PolarHBondContact O-N 3.06Å; S250-V253 VanDerWaalsContact O-N 3.13Å; S250-V253 VanDerWaalsContact OG-CG2 3.27Å; S250-V253 WeakPolarHBondContact OG-CG2 3.45Å; L251-V253 VanDerWaalsContact C-N 3.32Å; L251-V253 PolarHBondContact O-N 2.58Å; V253-A256 PolarHBondContact O-N 3.37Å; V253-H257 PolarHBondContact O-N 3.48Å |
| 254 | A | 84.7 | Confident | 86.6 | Confident | 0 Ų | 0 | 72.4 Ų | 72.4 | 0% | 0 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -59.4 | -46.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | N238 F248 S250 L251 A256 H257 Y258 | N238-A254 WeakPolarHBondContact O-CB 3.33Å; F248-A254 HydrophobicContact CB-CB 3.9Å; F248-A254 HydrophobicContact CD2-CB 3.42Å; F248-A254 VanDerWaalsContact CD2-CB 3.42Å; F248-A254 HydrophobicContact CE2-CB 4.2Å; F248-A254 HydrophobicContact CG-CB 3.76Å; S250-A254 PolarHBondContact O-N 3.42Å; L251-A254 WeakPolarHBondContact O-CB 3.25Å; L251-A254 PolarHBondContact O-N 3.49Å; A254-A256 VanDerWaalsContact C-N 3.33Å; A254-A256 PolarHBondContact O-N 2.97Å; A254-H257 WeakPolarHBondContact O-CA 3.06Å; A254-H257 WeakPolarHBondContact O-CB 3.49Å; A254-H257 PolarHBondContact O-N 3.33Å; A254-H257 VanDerWaalsContact O-N 3.09Å; A254-Y258 HydrophobicContact CB-CE2 4.39Å; A254-Y258 WeakPolarHBondContact O-CD2 3.16Å; A254-Y258 PolarHBondContact O-N 2.93Å |
| 255 | Q | 85.2 | Confident | 86.9 | Confident | 98 Ų | 98 | 77.9 Ų | 77.9 | 46% | 0.458 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -60.5 | -42.1 | 177.5 | -76.8 | -178.5 | -12.2 | 0 | 0 | 112 | L251 A252 H257 Y258 Q259 | L251-Q255 HydrophobicContact CD1-CG 4.48Å; L251-Q255 HydrophobicContact CG-CG 4.5Å; L251-Q255 WeakPolarHBondContact O-CB 3.4Å; L251-Q255 WeakPolarHBondContact O-CG 3.29Å; L251-Q255 PolarHBondContact O-N 2.86Å; A252-Q255 PolarHBondContact O-N 2.96Å; Q255-H257 VanDerWaalsContact C-N 3.29Å; Q255-H257 PolarHBondContact O-N 3.36Å; Q255-Y258 PolarHBondContact O-N 2.76Å; Q255-Q259 WeakPolarHBondContact O-CB 3.38Å; Q255-Q259 WeakPolarHBondContact O-CG 3.35Å; Q255-Q259 PolarHBondContact O-N 3.5Å; Q255-Q259 VanDerWaalsContact O-N 3.13Å; Q255-Q259 PolarHBondContact O-NE2 3.23Å |
| 256 | A | 89.6 | Confident | 87 | Confident | 65 Ų | 65 | 77 Ų | 77 | 54% | 0.537 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -64.4 | -34.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | A252 V253 A254 G260 | A252-A256 WeakPolarHBondContact O-CB 3.46Å; A252-A256 PolarHBondContact O-N 3.16Å; V253-A256 PolarHBondContact O-N 3.37Å; A254-A256 VanDerWaalsContact C-N 3.33Å; A254-A256 PolarHBondContact O-N 2.97Å; A256-G260 PolarHBondContact O-N 3.33Å; A256-G260 VanDerWaalsContact O-N 3.17Å |
| 257 | H | 92 | Very high | 87.3 | Confident | 42 Ų | 42 | 78.8 Ų | 78.8 | 19% | 0.194 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -64.9 | -51.8 | 174.1 | 175.3 | 94.6 | 0 | 0 | 0 | 112.1 | C241 C244 F248 V253 A254 Q255 Q259 G260 H263 | C241-H257 PolarHBondContact SG-NE2 3.33Å; C241-H257 VanDerWaalsContact SG-NE2 3.43Å; C244-H257 VanDerWaalsContact CB-CE1 3.5Å; C244-H257 WeakPolarHBondContact CB-CE1 3.47Å; C244-H257 WeakPolarHBondContact CB-NE2 3.49Å; C244-H257 PolarHBondContact SG-NE2 3.49Å; F248-H257 HydrophobicContact CD1-CB 4.33Å; F248-H257 HydrophobicContact CE1-CB 3.49Å; F248-H257 VanDerWaalsContact CE1-CB 3.49Å; F248-H257 AromaticContact CE1-CG 3.51Å; F248-H257 AromaticContact CE1-ND1 3.6Å; F248-H257 HydrophobicContact CE2-CB 4.16Å; F248-H257 AromaticContact CE2-CD2 3.97Å; F248-H257 HydrophobicContact CZ-CB 3.42Å; F248-H257 VanDerWaalsContact CZ-CB 3.42Å; F248-H257 AromaticContact CZ-CD2 3.34Å; F248-H257 WeakPolarHBondContact CZ-CD2 3.47Å; F248-H257 AromaticContact CZ-CE1 3.79Å; F248-H257 AromaticContact CZ-CG 3.1Å; F248-H257 AromaticContact CZ-ND1 3.42Å; F248-H257 WeakPolarHBondContact CZ-ND1 3.44Å; F248-H257 AromaticContact CZ-NE2 3.79Å; V253-H257 PolarHBondContact O-N 3.48Å; A254-H257 WeakPolarHBondContact O-CA 3.06Å; A254-H257 WeakPolarHBondContact O-CB 3.49Å; A254-H257 PolarHBondContact O-N 3.33Å; A254-H257 VanDerWaalsContact O-N 3.09Å; Q255-H257 VanDerWaalsContact C-N 3.29Å; Q255-H257 PolarHBondContact O-N 3.36Å; H257-Q259 VanDerWaalsContact C-N 3.27Å; H257-Q259 PolarHBondContact O-N 3Å; H257-G260 WeakPolarHBondContact O-CA 3.48Å; H257-G260 PolarHBondContact O-N 3.15Å; H257-H263 AromaticContact CD2-ND1 3.75Å; H257-H263 AromaticContact NE2-CG 3.9Å; H257-H263 AromaticContact NE2-ND1 3.31Å; H257-H263 PolarHBondContact NE2-ND1 2.79Å; H257-H263 WeakPolarHBondContact O-CB 3.15Å |
| 258 | Y | 89.1 | Confident | 87.4 | Confident | 72 Ų | 72 | 83 Ų | 83 | 28% | 0.282 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -62.8 | -32.8 | -177.8 | -75.1 | -65.7 | 0 | 0 | 0 | 112.8 | E237 Y240 C241 F248 A254 Q255 G260 H263 | E237-Y258 PolarHBondContact O-OH 3.17Å; Y240-Y258 PolarHBondContact O-OH 3.46Å; Y240-Y258 VanDerWaalsContact O-OH 3.11Å; C241-Y258 WeakPolarHBondContact CA-OH 3.24Å; C241-Y258 HydrophobicContact CB-CE1 4.12Å; F248-Y258 HydrophobicContact CE2-CE2 4.49Å; A254-Y258 HydrophobicContact CB-CE2 4.39Å; A254-Y258 WeakPolarHBondContact O-CD2 3.16Å; A254-Y258 PolarHBondContact O-N 2.93Å; Q255-Y258 PolarHBondContact O-N 2.76Å; Y258-G260 VanDerWaalsContact C-N 3.29Å; Y258-H263 AromaticContact CD1-CE1 3.68Å; Y258-H263 AromaticContact CD1-NE2 3.58Å; Y258-H263 AromaticContact CE1-CE1 3.85Å; Y258-H263 PolarHBondContact O-CD2 3.45Å |
| 259 | Q | 88.5 | Confident | 87.5 | Confident | 157 Ų | 157 | 86.5 Ų | 86.5 | 73% | 0.734 | 46% | 0.455 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.4 | -1.4 | 175 | -66.3 | 167.7 | 87.1 | 0 | 0 | 113.2 | Q255 H257 | Q255-Q259 WeakPolarHBondContact O-CB 3.38Å; Q255-Q259 WeakPolarHBondContact O-CG 3.35Å; Q255-Q259 PolarHBondContact O-N 3.5Å; Q255-Q259 VanDerWaalsContact O-N 3.13Å; Q255-Q259 PolarHBondContact O-NE2 3.23Å; H257-Q259 VanDerWaalsContact C-N 3.27Å; H257-Q259 PolarHBondContact O-N 3Å |
| 260 | G | 90.3 | Very high | 87.9 | Confident | 22 Ų | 22 | 82.6 Ų | 82.6 | 23% | 0.227 | 43% | 0.43 | C | S | . | . | S | Bend | trans | -77.7 | 148.9 | -174.9 | 0 | 0 | 0 | 0 | 0 | 114 | A256 H257 Y258 N262 H263 A264 | A256-G260 PolarHBondContact O-N 3.33Å; A256-G260 VanDerWaalsContact O-N 3.17Å; H257-G260 WeakPolarHBondContact O-CA 3.48Å; H257-G260 PolarHBondContact O-N 3.15Å; Y258-G260 VanDerWaalsContact C-N 3.29Å; G260-N262 PolarHBondContact O-N 3.42Å; G260-H263 PolarHBondContact O-N 2.78Å; G260-A264 PolarHBondContact O-N 3.47Å |
| 261 | K | 89.9 | Confident | 88.1 | Confident | 193 Ų | 193 | 84.6 Ų | 84.6 | 84% | 0.839 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -60.3 | -27 | 177.6 | -61.9 | 179.3 | -177.6 | 177.6 | 0 | 113.4 | K265 | K261-K265 PolarHBondContact O-N 2.89Å |
| 262 | N | 88.6 | Confident | 88.3 | Confident | 137 Ų | 137 | 83.5 Ų | 83.5 | 73% | 0.733 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -73.3 | -46.3 | 177.5 | -70.1 | -59.5 | 0 | 0 | 0 | 112 | G260 K265 K266 | G260-N262 PolarHBondContact O-N 3.42Å; N262-K265 PolarHBondContact O-N 3.24Å; N262-K266 PolarHBondContact O-N 3.35Å; N262-K266 VanDerWaalsContact O-N 3.15Å |
| 263 | H | 89.6 | Confident | 88.3 | Confident | 15 Ų | 15 | 86.6 Ų | 86.6 | 7% | 0.069 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -62.8 | -46 | 176 | -176 | 78 | 0 | 0 | 0 | 110.5 | C241 H257 Y258 G260 K265 K266 L267 | C241-H263 PolarHBondContact SG-CE1 3.3Å; C241-H263 PolarHBondContact SG-ND1 3.03Å; H257-H263 AromaticContact CD2-ND1 3.75Å; H257-H263 AromaticContact NE2-CG 3.9Å; H257-H263 AromaticContact NE2-ND1 3.31Å; H257-H263 PolarHBondContact NE2-ND1 2.79Å; H257-H263 WeakPolarHBondContact O-CB 3.15Å; Y258-H263 AromaticContact CD1-CE1 3.68Å; Y258-H263 AromaticContact CD1-NE2 3.58Å; Y258-H263 AromaticContact CE1-CE1 3.85Å; Y258-H263 PolarHBondContact O-CD2 3.45Å; G260-H263 PolarHBondContact O-N 2.78Å; H263-K265 VanDerWaalsContact C-N 3.26Å; H263-K265 PolarHBondContact O-N 3.36Å; H263-K266 PolarHBondContact O-N 3.46Å; H263-K266 VanDerWaalsContact O-N 3.07Å; H263-L267 WeakPolarHBondContact O-CB 3.37Å; H263-L267 PolarHBondContact O-N 3.13Å |
| 264 | A | 89.8 | Confident | 87.9 | Confident | 40 Ų | 40 | 88.8 Ų | 88.8 | 33% | 0.331 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -57.3 | -35.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | G260 R268 | G260-A264 PolarHBondContact O-N 3.47Å; A264-R268 WeakPolarHBondContact O-CG 3.23Å; A264-R268 PolarHBondContact O-N 3.05Å |
| 265 | K | 92.3 | Very high | 87.3 | Confident | 147 Ų | 147 | 95 Ų | 95 | 64% | 0.639 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -70.7 | -41.9 | 176.1 | -173.1 | -178.9 | 177.5 | -173.3 | 0 | 111.8 | K261 N262 H263 L269 | K261-K265 PolarHBondContact O-N 2.89Å; N262-K265 PolarHBondContact O-N 3.24Å; H263-K265 VanDerWaalsContact C-N 3.26Å; H263-K265 PolarHBondContact O-N 3.36Å; K265-L269 WeakPolarHBondContact O-CG 3.41Å; K265-L269 PolarHBondContact O-N 3.17Å |
| 266 | K | 87.6 | Confident | 86.4 | Confident | 91 Ų | 91 | 94.4 Ų | 94.4 | 40% | 0.396 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -69.8 | -37.1 | -179.7 | -155.2 | 169.5 | -177.8 | -163.1 | 0 | 111.1 | L243 N262 H263 L269 A270 | L243-K266 WeakPolarHBondContact O-CD 3.4Å; L243-K266 WeakPolarHBondContact O-CE 3.47Å; L243-K266 PolarHBondContact O-NZ 2.98Å; N262-K266 PolarHBondContact O-N 3.35Å; N262-K266 VanDerWaalsContact O-N 3.15Å; H263-K266 PolarHBondContact O-N 3.46Å; H263-K266 VanDerWaalsContact O-N 3.07Å; K266-L269 PolarHBondContact O-N 3.31Å; K266-A270 WeakPolarHBondContact O-CB 3.5Å; K266-A270 PolarHBondContact O-N 2.89Å |
| 267 | L | 89.9 | Confident | 85.2 | Confident | 64 Ų | 64 | 95.4 Ų | 95.4 | 34% | 0.335 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -58 | -52.3 | 173.5 | -175.8 | 65.5 | 0 | 0 | 0 | 111.8 | L243 H263 L269 A270 E271 | L243-L267 HydrophobicContact CD1-CB 4.34Å; L243-L267 HydrophobicContact CD1-CD1 3.4Å; L243-L267 HydrophobicContact CD1-CG 4.46Å; H263-L267 WeakPolarHBondContact O-CB 3.37Å; H263-L267 PolarHBondContact O-N 3.13Å; L267-L269 VanDerWaalsContact C-N 3.27Å; L267-L269 PolarHBondContact O-N 3.47Å; L267-A270 PolarHBondContact O-N 3.35Å; L267-A270 VanDerWaalsContact O-N 3.14Å; L267-E271 HydrophobicContact CD1-CG 4.42Å; L267-E271 HydrophobicContact CG-CG 4.44Å; L267-E271 WeakPolarHBondContact O-CG 3.47Å; L267-E271 PolarHBondContact O-N 3.2Å |
| 268 | R | 90 | Very high | 83.7 | Confident | 188 Ų | 188 | 99.9 Ų | 99.9 | 71% | 0.709 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -60.1 | -34 | 179.4 | -73.2 | 179.1 | -176.1 | 163.7 | 2.1 | 114.1 | A264 A272 | A264-R268 WeakPolarHBondContact O-CG 3.23Å; A264-R268 PolarHBondContact O-N 3.05Å; R268-A272 PolarHBondContact O-N 2.9Å; R268-A272 VanDerWaalsContact O-N 3.12Å |
| 269 | L | 87.3 | Confident | 82.2 | Confident | 103 Ų | 103 | 104.6 Ų | 104.6 | 54% | 0.539 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -72.2 | -43.6 | 177.1 | -70.7 | 171.9 | 0 | 0 | 0 | 111.1 | K265 K266 L267 E271 A272 Q273 | K265-L269 WeakPolarHBondContact O-CG 3.41Å; K265-L269 PolarHBondContact O-N 3.17Å; K266-L269 PolarHBondContact O-N 3.31Å; L267-L269 VanDerWaalsContact C-N 3.27Å; L267-L269 PolarHBondContact O-N 3.47Å; L269-E271 VanDerWaalsContact C-N 3.3Å; L269-E271 PolarHBondContact O-N 2.77Å; L269-A272 PolarHBondContact O-N 2.93Å; L269-Q273 WeakPolarHBondContact O-CG 3.49Å; L269-Q273 PolarHBondContact O-N 3.36Å; L269-Q273 VanDerWaalsContact O-N 3.08Å |
| 270 | A | 87.7 | Confident | 80.4 | Confident | 27 Ų | 27 | 106 Ų | 106 | 22% | 0.223 | 55% | 0.548 | C | S | . | . | H | α-helix | trans | -62.4 | -38.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | L243 K266 L267 A272 Q273 Q274 | L243-A270 HydrophobicContact CD2-CB 4.12Å; K266-A270 WeakPolarHBondContact O-CB 3.5Å; K266-A270 PolarHBondContact O-N 2.89Å; L267-A270 PolarHBondContact O-N 3.35Å; L267-A270 VanDerWaalsContact O-N 3.14Å; A270-A272 PolarHBondContact O-N 3.42Å; A270-Q273 PolarHBondContact O-N 3.32Å; A270-Q274 PolarHBondContact O-N 3.34Å |
| 271 | E | 88.6 | Confident | 78.5 | Confident | 88 Ų | 88 | 107.9 Ų | 107.9 | 41% | 0.411 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -64.9 | -37.3 | 175.8 | -71.6 | 175.6 | 132.3 | 0 | 0 | 113 | L267 L269 Q273 Q274 N275 | L267-E271 HydrophobicContact CD1-CG 4.42Å; L267-E271 HydrophobicContact CG-CG 4.44Å; L267-E271 WeakPolarHBondContact O-CG 3.47Å; L267-E271 PolarHBondContact O-N 3.2Å; L269-E271 VanDerWaalsContact C-N 3.3Å; L269-E271 PolarHBondContact O-N 2.77Å; E271-Q273 VanDerWaalsContact C-N 3.32Å; E271-Q274 VanDerWaalsContact O-CG 3.3Å; E271-Q274 WeakPolarHBondContact O-CG 3.49Å; E271-N275 WeakPolarHBondContact O-CB 3.47Å; E271-N275 PolarHBondContact O-N 2.73Å |
| 272 | A | 85.8 | Confident | 76.4 | Confident | 65 Ų | 65 | 104.4 Ų | 104.4 | 54% | 0.537 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -68.2 | -34.2 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112 | R268 L269 A270 | R268-A272 PolarHBondContact O-N 2.9Å; R268-A272 VanDerWaalsContact O-N 3.12Å; L269-A272 PolarHBondContact O-N 2.93Å; A270-A272 PolarHBondContact O-N 3.42Å |
| 273 | Q | 83.1 | Confident | 74.4 | Confident | 134 Ų | 134 | 104.7 Ų | 104.7 | 63% | 0.626 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -75.3 | -43.4 | 178.4 | -71 | 178.5 | -46.1 | 0 | 0 | 112.2 | L269 A270 E271 N275 S276 S277 | L269-Q273 WeakPolarHBondContact O-CG 3.49Å; L269-Q273 PolarHBondContact O-N 3.36Å; L269-Q273 VanDerWaalsContact O-N 3.08Å; A270-Q273 PolarHBondContact O-N 3.32Å; E271-Q273 VanDerWaalsContact C-N 3.32Å; Q273-N275 VanDerWaalsContact C-N 3.25Å; Q273-N275 PolarHBondContact O-N 3.12Å; Q273-S276 PolarHBondContact O-N 2.73Å; Q273-S276 PolarHBondContact O-OG 3.37Å; Q273-S277 PolarHBondContact O-N 2.92Å |
| 274 | Q | 75.8 | Confident | 72.4 | Confident | 116 Ų | 116 | 111.9 Ų | 111.9 | 54% | 0.542 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -64.2 | -31.8 | 177.3 | 74.1 | -172.1 | -1.4 | 0 | 0 | 112.3 | A270 E271 S276 S277 N278 | A270-Q274 PolarHBondContact O-N 3.34Å; E271-Q274 VanDerWaalsContact O-CG 3.3Å; E271-Q274 WeakPolarHBondContact O-CG 3.49Å; Q274-S276 PolarHBondContact O-N 2.95Å; Q274-S277 WeakPolarHBondContact CA-OG 3.33Å; Q274-S277 PolarHBondContact O-N 3.48Å; Q274-S277 PolarHBondContact O-OG 2.95Å; Q274-N278 PolarHBondContact O-N 3.41Å |
| 275 | N | 72.9 | Confident | 70 | Confident | 130 Ų | 130 | 113.6 Ų | 113.6 | 70% | 0.695 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -68.2 | -24.3 | 175.9 | -169.7 | 62.3 | 0 | 0 | 0 | 112.3 | E271 Q273 | E271-N275 WeakPolarHBondContact O-CB 3.47Å; E271-N275 PolarHBondContact O-N 2.73Å; Q273-N275 VanDerWaalsContact C-N 3.25Å; Q273-N275 PolarHBondContact O-N 3.12Å |
| 276 | S | 65.1 | Low | 67.7 | Low | 87 Ų | 87 | 111.4 Ų | 111.4 | 61% | 0.608 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -82.5 | -28.3 | 174.3 | 69.1 | 0 | 0 | 0 | 0 | 113.4 | Q273 Q274 | Q273-S276 PolarHBondContact O-N 2.73Å; Q273-S276 PolarHBondContact O-OG 3.37Å; Q274-S276 PolarHBondContact O-N 2.95Å |
| 277 | S | 66 | Low | 65.8 | Low | 85 Ų | 85 | 112.9 Ų | 112.9 | 59% | 0.594 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -83.3 | -20.6 | 179 | 57.5 | 0 | 0 | 0 | 0 | 114 | Q273 Q274 M279 | Q273-S277 PolarHBondContact O-N 2.92Å; Q274-S277 WeakPolarHBondContact CA-OG 3.33Å; Q274-S277 PolarHBondContact O-N 3.48Å; Q274-S277 PolarHBondContact O-OG 2.95Å; S277-M279 VanDerWaalsContact C-N 3.29Å; S277-M279 PolarHBondContact O-N 3.5Å |
| 278 | N | 60.6 | Low | 64 | Low | 137 Ų | 137 | 121.8 Ų | 121.8 | 73% | 0.733 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83 | 2.2 | -177.6 | -156.8 | 15 | 0 | 0 | 0 | 114.4 | Q274 | Q274-N278 PolarHBondContact O-N 3.41Š|
| 279 | M | 56.4 | Low | 61.6 | Low | 170 Ų | 170 | 122.6 Ų | 122.6 | 84% | 0.837 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.3 | -9.1 | 179.5 | -160.9 | 168.4 | 139.9 | 0 | 0 | 113.5 | S277 | S277-M279 VanDerWaalsContact C-N 3.29Å; S277-M279 PolarHBondContact O-N 3.5Å |
| 280 | E | 51.3 | Low | 59.7 | Low | 188 Ų | 188 | 125.6 Ų | 125.6 | 88% | 0.879 | 71% | 0.706 | S | S | * | * | S | Bend | trans | -102.8 | 25.5 | 178.3 | -78.6 | -77.5 | 105.6 | 0 | 0 | 112.5 | ||
| 281 | G | 50.4 | Low | 57.3 | Low | 60 Ų | 60 | 135.8 Ų | 135.8 | 62% | 0.619 | 74% | 0.739 | S | S | * | * | S | Bend | trans | -129.8 | 6.4 | -171.9 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||
| 282 | S | 45.8 | Very low | 55.6 | Low | 121 Ų | 121 | 139.6 Ų | 139.6 | 85% | 0.846 | 75% | 0.754 | S | S | * | * | trans | -142.3 | 96.8 | 178.8 | -75.4 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 283 | N | 46.8 | Very low | 53.4 | Low | 143 Ų | 143 | 142.9 Ų | 142.9 | 77% | 0.765 | 76% | 0.762 | S | S | * | * | trans | -104.6 | 148.8 | 156.7 | -170.6 | 20.3 | 0 | 0 | 0 | 109.5 | ||||
| 284 | E | 47.6 | Very low | 51.7 | Low | 166 Ų | 166 | 140.2 Ų | 140.2 | 78% | 0.776 | 77% | 0.771 | S | S | * | * | trans | 108.4 | 92.2 | 169.6 | -54.4 | -58.9 | 111 | 0 | 0 | 115.7 | ||||
| 285 | G | 39.7 | Very low | 49.9 | Very low | 76 Ų | 76 | 142.4 Ų | 142.4 | 78% | 0.784 | 79% | 0.786 | S | S | * | * | trans | 156.5 | 51.9 | 158.4 | 0 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 286 | A | 43.5 | Very low | 48.3 | Very low | 101 Ų | 101 | 142.5 Ų | 142.5 | 84% | 0.835 | 78% | 0.783 | S | S | * | * | trans | 67.4 | 171.3 | 149.2 | 0 | 0 | 0 | 0 | 0 | 121 | ||||
| 287 | P | 47.6 | Very low | 46.8 | Very low | 121 Ų | 121 | 146.4 Ų | 146.4 | 79% | 0.786 | 79% | 0.785 | S | S | * | * | -113 | 164.1 | -80.3 | 35 | -21.9 | 0 | 0 | 0 | 113.7 | K289 | P287-K289 PolarHBondContact O-N 3.37Š| |||
| 288 | R | 51.8 | Low | 45.8 | Very low | 251 Ų | 251 | 153.2 Ų | 153.2 | 95% | 0.947 | 80% | 0.798 | S | S | * | * | trans | -51.4 | 129.9 | 174.3 | -67.6 | -173.5 | 172.5 | 167.1 | -0.8 | 112.5 | ||||
| 289 | K | 39.8 | Very low | 45.2 | Very low | 206 Ų | 206 | 152.1 Ų | 152.1 | 90% | 0.896 | 79% | 0.791 | S | S | * | * | trans | -107.6 | 114.5 | 148.6 | -83.7 | -176.1 | 176.6 | 174.2 | 0 | 109.3 | P287 R291 | P287-K289 PolarHBondContact O-N 3.37Å; K289-R291 PolarHBondContact O-N 2.91Å | ||
| 290 | N | 46.7 | Very low | 44.4 | Very low | 165 Ų | 165 | 149.4 Ų | 149.4 | 88% | 0.882 | 78% | 0.784 | S | S | * | * | trans | -65 | 116.3 | 164 | -155.9 | 9.1 | 0 | 0 | 0 | 107.3 | ||||
| 291 | R | 37.8 | Very low | 43.9 | Very low | 242 Ų | 242 | 147.9 Ų | 147.9 | 91% | 0.913 | 78% | 0.775 | S | S | * | * | trans | -133.5 | 114.2 | 162.2 | -147.6 | 173.5 | -172.6 | 168.1 | 1.3 | 109.4 | K289 | K289-R291 PolarHBondContact O-N 2.91Š| ||
| 292 | K | 52.1 | Low | 43.3 | Very low | 168 Ų | 168 | 152 Ų | 152 | 73% | 0.73 | 78% | 0.783 | S | S | * | * | trans | -65.2 | 166.5 | 179.6 | -165.9 | 177.2 | 155.1 | 165.6 | 0 | 111.1 | ||||
| 293 | D | 40.9 | Very low | 43.2 | Very low | 133 Ų | 133 | 156.4 Ų | 156.4 | 71% | 0.711 | 78% | 0.781 | S | S | * | * | trans | 94.2 | 99.7 | 158.4 | -52 | -61.8 | 0 | 0 | 0 | 116.5 | ||||
| 294 | G | 46.7 | Very low | 43.1 | Very low | 79 Ų | 79 | 159.8 Ų | 159.8 | 81% | 0.814 | 78% | 0.783 | S | S | * | * | trans | 49.3 | 101.8 | 134.5 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 295 | N | 38.7 | Very low | 42.3 | Very low | 161 Ų | 161 | 157.8 Ų | 157.8 | 86% | 0.861 | 79% | 0.787 | S | S | * | * | trans | -117.1 | 95.4 | 150.8 | -145.5 | 18.3 | 0 | 0 | 0 | 108.2 | Y297 | N295-Y297 PolarHBondContact O-N 3.48Š| ||
| 296 | E | 38.4 | Very low | 43 | Very low | 133 Ų | 133 | 159 Ų | 159 | 62% | 0.621 | 78% | 0.781 | S | S | * | * | trans | -48.3 | 137.1 | 164.8 | -93.8 | -147.9 | 120.1 | 0 | 0 | 109.3 | R298 | E296-R298 PolarHBondContact O-N 3.24Š| ||
| 297 | Y | 34.4 | Very low | 42.8 | Very low | 169 Ų | 169 | 163.2 Ų | 163.2 | 66% | 0.663 | 78% | 0.783 | S | S | * | * | trans | -38.5 | 101 | 156.6 | 63.2 | -73.9 | 0 | 0 | 0 | 109.7 | N295 L299 | N295-Y297 PolarHBondContact O-N 3.48Å; Y297-L299 HydrophobicContact CD2-CB 4.01Å; Y297-L299 HydrophobicContact CE2-CB 4.42Å; Y297-L299 PolarHBondContact O-N 3.06Å | ||
| 298 | R | 44.3 | Very low | 42.5 | Very low | 227 Ų | 227 | 165.3 Ų | 165.3 | 86% | 0.857 | 79% | 0.787 | S | S | * | * | trans | -74.6 | 81.7 | 159.4 | -69.9 | -170.2 | 86.1 | 103.7 | -3.6 | 106.5 | E296 V300 | E296-R298 PolarHBondContact O-N 3.24Å; R298-V300 VanDerWaalsContact C-N 3.25Å; R298-V300 PolarHBondContact O-N 3.17Å | ||
| 299 | L | 49.5 | Very low | 42.2 | Very low | 114 Ų | 114 | 159.3 Ų | 159.3 | 60% | 0.597 | 78% | 0.781 | S | S | * | * | trans | -57.1 | 97.2 | 157.8 | 178.5 | 71.8 | 0 | 0 | 0 | 106.2 | Y297 K301 | Y297-L299 HydrophobicContact CD2-CB 4.01Å; Y297-L299 HydrophobicContact CE2-CB 4.42Å; Y297-L299 PolarHBondContact O-N 3.06Å; L299-K301 HydrophobicContact CD2-CD 4.44Å; L299-K301 HydrophobicContact CD2-CG 3.9Å; L299-K301 HydrophobicContact CG-CG 3.99Å; L299-K301 PolarHBondContact O-N 2.92Å | ||
| 300 | V | 39.5 | Very low | 42.4 | Very low | 114 Ų | 114 | 154.1 Ų | 154.1 | 69% | 0.691 | 78% | 0.777 | S | S | * | * | trans | -66.2 | 94.6 | 168.9 | -174.9 | 0 | 0 | 0 | 0 | 106.3 | R298 N302 | R298-V300 VanDerWaalsContact C-N 3.25Å; R298-V300 PolarHBondContact O-N 3.17Å; V300-N302 VanDerWaalsContact C-N 3.34Å; V300-N302 VanDerWaalsContact CG1-OD1 3.26Å; V300-N302 WeakPolarHBondContact CG1-OD1 3.24Å; V300-N302 PolarHBondContact O-N 3.27Å; V300-N302 VanDerWaalsContact O-N 3.08Å | ||
| 301 | K | 40.1 | Very low | 42.5 | Very low | 155 Ų | 155 | 151 Ų | 151 | 67% | 0.674 | 77% | 0.773 | S | S | * | * | trans | -72.2 | 91.1 | 168.6 | -64.3 | 171.3 | -175.5 | 173.7 | 0 | 106.8 | L299 R303 | L299-K301 HydrophobicContact CD2-CD 4.44Å; L299-K301 HydrophobicContact CD2-CG 3.9Å; L299-K301 HydrophobicContact CG-CG 3.99Å; L299-K301 PolarHBondContact O-N 2.92Å; K301-R303 PolarHBondContact O-N 2.78Å | ||
| 302 | N | 38.4 | Very low | 43.4 | Very low | 147 Ų | 147 | 147.5 Ų | 147.5 | 79% | 0.786 | 77% | 0.769 | S | S | * | * | trans | -64.3 | 100.1 | 166.2 | -80.9 | 44.3 | 0 | 0 | 0 | 108.9 | V300 | V300-N302 VanDerWaalsContact C-N 3.34Å; V300-N302 VanDerWaalsContact CG1-OD1 3.26Å; V300-N302 WeakPolarHBondContact CG1-OD1 3.24Å; V300-N302 PolarHBondContact O-N 3.27Å; V300-N302 VanDerWaalsContact O-N 3.08Å | ||
| 303 | R | 42.4 | Very low | 43.2 | Very low | 213 Ų | 213 | 145.6 Ų | 145.6 | 80% | 0.804 | 77% | 0.774 | S | S | * | * | trans | -85.7 | 112.3 | 168.7 | -75.8 | -169.7 | -170.9 | -151.3 | 3.5 | 110.1 | K301 | K301-R303 PolarHBondContact O-N 2.78Š| ||
| 304 | R | 45.3 | Very low | 43.5 | Very low | 215 Ų | 215 | 141.9 Ų | 141.9 | 81% | 0.811 | 77% | 0.767 | S | S | * | * | trans | 62 | 120.7 | 143.3 | -60.9 | -178 | -169.3 | -134 | 0 | 119.2 | ||||
| 305 | S | 31.6 | Very low | 44 | Very low | 124 Ų | 124 | 144.8 Ų | 144.8 | 87% | 0.867 | 77% | 0.771 | S | S | * | * | -142.3 | 131.5 | 109.9 | -76.7 | 0 | 0 | 0 | 0 | 109.9 | |||||
| 306 | P | 53.1 | Low | 44.6 | Very low | 101 Ų | 101 | 148 Ų | 148 | 66% | 0.656 | 77% | 0.773 | S | S | * | * | trans | -105.2 | 113 | -174 | 34.7 | -23.1 | 0 | 0 | 0 | 111.4 | ||||
| 307 | Q | 39.4 | Very low | 44.8 | Very low | 189 Ų | 189 | 151.3 Ų | 151.3 | 88% | 0.883 | 78% | 0.781 | S | S | * | * | trans | -156.9 | 94.1 | 159.7 | -71.8 | -60.2 | -23.9 | 0 | 0 | 108.7 | ||||
| 308 | L | 42 | Very low | 45.2 | Very low | 166 Ų | 166 | 150.2 Ų | 150.2 | 87% | 0.869 | 79% | 0.787 | S | S | * | * | trans | -133 | 135.6 | 151.4 | -82.9 | -178.6 | 0 | 0 | 0 | 108.3 | ||||
| 309 | P | 45.4 | Very low | 45.4 | Very low | 124 Ų | 124 | 143.7 Ų | 143.7 | 81% | 0.805 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 147.3 | -173.6 | -13.1 | 28.6 | 0 | 0 | 0 | 111.9 | A311 | P309-A311 PolarHBondContact O-N 2.92Š|
| 310 | A | 44.1 | Very low | 45.4 | Very low | 98 Ų | 98 | 148.3 Ų | 148.3 | 81% | 0.81 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 118.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||
| 311 | A | 47.5 | Very low | 45.9 | Very low | 98 Ų | 98 | 148.7 Ų | 148.7 | 81% | 0.81 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -84.4 | 120.1 | 162.8 | 0 | 0 | 0 | 0 | 0 | 108.4 | P309 | P309-A311 PolarHBondContact O-N 2.92Š|
| 312 | M | 58.3 | Low | 46.5 | Very low | 170 Ų | 170 | 152.5 Ų | 152.5 | 84% | 0.837 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 141.5 | -178.4 | -65.2 | -72.2 | -75.9 | 0 | 0 | 112.5 | G314 | M312-G314 PolarHBondContact O-N 3.07Š|
| 313 | P | 47.3 | Very low | 47.4 | Very low | 128 Ų | 128 | 153.3 Ų | 153.3 | 83% | 0.831 | 80% | 0.798 | S | S | * | * | trans | -81.2 | 102.8 | 172.3 | 30.7 | -28.4 | 0 | 0 | 0 | 110.1 | ||||
| 314 | G | 47.8 | Very low | 47.9 | Very low | 54 Ų | 54 | 153.9 Ų | 153.9 | 56% | 0.557 | 80% | 0.8 | S | S | * | * | trans | -77.6 | 148 | 166.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | M312 Y316 | M312-G314 PolarHBondContact O-N 3.07Å; G314-Y316 VanDerWaalsContact C-N 3.27Å; G314-Y316 PolarHBondContact O-N 2.94Å | ||
| 315 | P | 56.6 | Low | 48.4 | Very low | 140 Ų | 140 | 146.8 Ų | 146.8 | 91% | 0.909 | 78% | 0.777 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.2 | 17.7 | -162.9 | 32.7 | -35.5 | 0 | 0 | 0 | 115.8 | ||
| 316 | Y | 51.9 | Low | 49.8 | Very low | 230 Ų | 230 | 143.3 Ų | 143.3 | 90% | 0.902 | 75% | 0.752 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -153.9 | 60.6 | 175.9 | -147.4 | -94.7 | 0 | 0 | 0 | 113.2 | G314 | G314-Y316 VanDerWaalsContact C-N 3.27Å; G314-Y316 PolarHBondContact O-N 2.94Å |
| 317 | Y | 41.6 | Very low | 50.1 | Low | 201 Ų | 201 | 148.4 Ų | 148.4 | 79% | 0.788 | 76% | 0.758 | S | S | * | * | trans | -145.7 | 106.5 | 156.6 | -160.6 | -103.4 | 0 | 0 | 0 | 109.2 | P319 | Y317-P319 HydrophobicContact CD1-CB 4.3Å; Y317-P319 HydrophobicContact CD1-CG 4.43Å; Y317-P319 HydrophobicContact CE1-CB 4.04Å; Y317-P319 WeakPolarHBondContact O-CD 3.36Å | ||
| 318 | N | 43.5 | Very low | 51.1 | Low | 146 Ų | 146 | 145.6 Ų | 145.6 | 78% | 0.781 | 75% | 0.749 | S | S | * | * | trans | -99.9 | 94.4 | 175.9 | -151.5 | -19.3 | 0 | 0 | 0 | 106.6 | R320 | N318-R320 PolarHBondContact O-N 3.05Š| ||
| 319 | P | 48.9 | Very low | 52.2 | Low | 91 Ų | 91 | 138.6 Ų | 138.6 | 59% | 0.591 | 71% | 0.712 | S | S | * | * | trans | -74 | 82.6 | 172.3 | 31.1 | -31.2 | 0 | 0 | 0 | 107 | Y317 | Y317-P319 HydrophobicContact CD1-CB 4.3Å; Y317-P319 HydrophobicContact CD1-CG 4.43Å; Y317-P319 HydrophobicContact CE1-CB 4.04Å; Y317-P319 WeakPolarHBondContact O-CD 3.36Å | ||
| 320 | R | 49.6 | Very low | 52.9 | Low | 211 Ų | 211 | 135.2 Ų | 135.2 | 80% | 0.796 | 70% | 0.695 | S | S | * | * | trans | -51.8 | 130.5 | 158.1 | -83.1 | -174.6 | -179.8 | -120.2 | 1.8 | 106.1 | N318 R322 | N318-R320 PolarHBondContact O-N 3.05Å; R320-R322 PolarHBondContact O-N 3.24Å | ||
| 321 | P | 47.9 | Very low | 54 | Low | 121 Ų | 121 | 139 Ų | 139 | 79% | 0.786 | 70% | 0.698 | S | S | * | * | trans | -67.1 | 92.1 | 173.3 | 27.8 | -30.4 | 0 | 0 | 0 | 106.1 | Q323 | P321-Q323 PolarHBondContact O-N 3.21Š| ||
| 322 | R | 53.3 | Low | 55.3 | Low | 236 Ų | 236 | 135.7 Ų | 135.7 | 89% | 0.891 | 67% | 0.669 | S | S | * | * | trans | -61.3 | 99.9 | 155.9 | -78.3 | -162.4 | -163.6 | -108.7 | 5.6 | 103.4 | R320 R324 | R320-R322 PolarHBondContact O-N 3.24Å; R322-R324 PolarHBondContact O-N 3.17Å | ||
| 323 | Q | 57.1 | Low | 56.3 | Low | 164 Ų | 164 | 129.7 Ų | 129.7 | 77% | 0.766 | 64% | 0.642 | S | S | * | * | trans | -40.3 | 114.4 | 160.8 | -89.5 | -177.4 | -29.8 | 0 | 0 | 105.3 | P321 I325 | P321-Q323 PolarHBondContact O-N 3.21Å; Q323-I325 PolarHBondContact O-N 3.15Å | ||
| 324 | R | 52.8 | Low | 57.7 | Low | 225 Ų | 225 | 125.6 Ų | 125.6 | 85% | 0.849 | 61% | 0.614 | S | S | * | * | trans | -63.7 | 96.8 | -175.8 | -170.7 | -171.4 | -142.7 | -139.6 | 8.7 | 105.2 | R322 P326 | R322-R324 PolarHBondContact O-N 3.17Å; R324-P326 WeakPolarHBondContact O-CD 3.39Å; R324-P326 VanDerWaalsContact O-N 3.08Å | ||
| 325 | I | 55.8 | Low | 58.8 | Low | 66 Ų | 66 | 130.1 Ų | 130.1 | 34% | 0.338 | 63% | 0.634 | S | S | . | * | trans | -48.5 | 122.3 | 175.1 | -60.3 | 172.1 | 0 | 0 | 0 | 104.8 | Q323 R327 L329 V333 | Q323-I325 PolarHBondContact O-N 3.15Å; I325-R327 PolarHBondContact O-N 3.07Å; I325-L329 HydrophobicContact CG2-CB 3.5Å; I325-L329 VanDerWaalsContact CG2-CB 3.5Å; I325-V333 HydrophobicContact CD1-CG2 4.21Å; I325-V333 HydrophobicContact CG2-CG2 4.38Å | ||
| 326 | P | 61 | Low | 59.6 | Low | 51 Ų | 51 | 127.6 Ų | 127.6 | 33% | 0.331 | 62% | 0.62 | S | S | . | * | trans | -47.5 | 138.9 | 179.3 | -29.1 | 35.2 | 0 | 0 | 0 | 109.5 | R324 D328 L329 A330 | R324-P326 WeakPolarHBondContact O-CD 3.39Å; R324-P326 VanDerWaalsContact O-N 3.08Å; P326-D328 PolarHBondContact O-N 3.35Å; P326-L329 PolarHBondContact O-N 3.29Å; P326-A330 PolarHBondContact O-N 3.21Å | ||
| 327 | R | 60.6 | Low | 60.8 | Low | 207 Ų | 207 | 118.9 Ų | 118.9 | 78% | 0.781 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -53 | -27.9 | -172.6 | -175.7 | 176.5 | -87.5 | 176.7 | -8 | 112 | I325 | I325-R327 PolarHBondContact O-N 3.07Å |
| 328 | D | 60.4 | Low | 62.6 | Low | 131 Ų | 131 | 114 Ų | 114 | 70% | 0.701 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -76.4 | -23.7 | 179.7 | -48.5 | -42.8 | 0 | 0 | 0 | 113.6 | P326 | P326-D328 PolarHBondContact O-N 3.35Å |
| 329 | L | 65 | Low | 64.8 | Low | 18 Ų | 18 | 107.8 Ų | 107.8 | 9% | 0.094 | 55% | 0.55 | C | S | . | . | H | α-helix | trans | -89.3 | -24.8 | 174.4 | -92.7 | 68.3 | 0 | 0 | 0 | 112.4 | I325 P326 M331 C332 V333 F339 E351 R355 L358 | I325-L329 HydrophobicContact CG2-CB 3.5Å; I325-L329 VanDerWaalsContact CG2-CB 3.5Å; P326-L329 PolarHBondContact O-N 3.29Å; L329-M331 PolarHBondContact O-N 3.29Å; L329-C332 WeakPolarHBondContact O-CB 3.35Å; L329-C332 PolarHBondContact O-N 3.23Å; L329-V333 WeakPolarHBondContact O-CG2 3.27Å; L329-F339 HydrophobicContact CD2-CE1 4.21Å; L329-E351 HydrophobicContact CD2-CG 3.73Å; L329-E351 VanDerWaalsContact CD2-OE1 3.3Å; L329-E351 WeakPolarHBondContact CD2-OE1 3.42Å; L329-R355 HydrophobicContact CD2-CG 3.95Å; L329-L358 HydrophobicContact CD1-CD1 4.36Å |
| 330 | A | 61 | Low | 66.6 | Low | 54 Ų | 54 | 108.1 Ų | 108.1 | 45% | 0.446 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -62.3 | -26.6 | -177 | 0 | 0 | 0 | 0 | 0 | 113.5 | P326 C332 | P326-A330 PolarHBondContact O-N 3.21Å; A330-C332 PolarHBondContact O-N 3.12Å |
| 331 | M | 66.4 | Low | 68.5 | Low | 176 Ų | 176 | 98.4 Ų | 98.4 | 87% | 0.867 | 50% | 0.504 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.3 | -16.4 | 175 | -66.6 | -176.6 | 64.1 | 0 | 0 | 113.2 | L329 | L329-M331 PolarHBondContact O-N 3.29Š|
| 332 | C | 73.6 | Confident | 70.3 | Confident | 30 Ų | 30 | 96.8 Ų | 96.8 | 20% | 0.203 | 50% | 0.496 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -105.8 | 1.6 | -176.6 | -48.7 | 0 | 0 | 0 | 0 | 112.3 | L329 A330 F339 Y340 F354 | L329-C332 WeakPolarHBondContact O-CB 3.35Å; L329-C332 PolarHBondContact O-N 3.23Å; A330-C332 PolarHBondContact O-N 3.12Å; C332-F339 CarbonylContact O-C 3.49Å; C332-F339 WeakPolarHBondContact O-CA 3.38Å; C332-Y340 WeakPolarHBondContact CB-O 3.35Å; C332-Y340 PolarHBondContact O-N 3.2Å; C332-F354 HydrophobicContact CB-CD1 4.49Å; C332-F354 HydrophobicContact CB-CE1 3.37Å; C332-F354 HydrophobicContact CB-CZ 3.48Å; C332-F354 VanDerWaalsContact CB-CZ 3.48Å |
| 333 | V | 80.9 | Confident | 71.9 | Confident | 44 Ų | 44 | 89.1 Ų | 89.1 | 27% | 0.267 | 47% | 0.471 | S | S | . | . | B | Isolated β-bridge | trans | -94.2 | 119.6 | -179.8 | -178.4 | 0 | 0 | 0 | 0 | 109.3 | I325 L329 F339 | I325-V333 HydrophobicContact CD1-CG2 4.21Å; I325-V333 HydrophobicContact CG2-CG2 4.38Å; L329-V333 WeakPolarHBondContact O-CG2 3.27Å; V333-F339 HydrophobicContact CG2-CD1 3.75Å; V333-F339 HydrophobicContact CG2-CE1 3.5Å; V333-F339 HydrophobicContact CG2-CZ 4.27Å |
| 334 | T | 76.6 | Confident | 73.3 | Confident | 42 Ų | 42 | 82.2 Ų | 82.2 | 26% | 0.258 | 44% | 0.44 | S | S | . | . | trans | -73.9 | 159.3 | 173.5 | 54.2 | 0 | 0 | 0 | 0 | 111.3 | S336 G337 Q338 | T334-S336 PolarHBondContact O-N 3.08Å; T334-S336 PolarHBondContact OG1-OG 3.39Å; T334-G337 PolarHBondContact O-N 3.23Å; T334-Q338 PolarHBondContact N-O 2.88Å; T334-Q338 PolarHBondContact OG1-N 3.17Å; T334-Q338 PolarHBondContact OG1-O 2.93Å | ||
| 335 | P | 69.9 | Low | 75 | Confident | 148 Ų | 148 | 77.1 Ų | 77.1 | 96% | 0.961 | 43% | 0.43 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.5 | -22.3 | 177.1 | -24 | 33.3 | 0 | 0 | 0 | 114.2 | G337 | P335-G337 VanDerWaalsContact C-N 3.27Š|
| 336 | S | 73.1 | Confident | 76.5 | Confident | 88 Ų | 88 | 76.6 Ų | 76.6 | 62% | 0.615 | 43% | 0.431 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.1 | -7.2 | 173.8 | 54.6 | 0 | 0 | 0 | 0 | 113.8 | T334 | T334-S336 PolarHBondContact O-N 3.08Å; T334-S336 PolarHBondContact OG1-OG 3.39Å |
| 337 | G | 76.8 | Confident | 77.8 | Confident | 46 Ų | 46 | 77.1 Ų | 77.1 | 47% | 0.474 | 45% | 0.447 | S | S | . | . | S | Bend | trans | 85.8 | 5.6 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | T334 P335 | T334-G337 PolarHBondContact O-N 3.23Å; P335-G337 VanDerWaalsContact C-N 3.27Å |
| 338 | Q | 80.3 | Confident | 79 | Confident | 99 Ų | 99 | 68.1 Ų | 68.1 | 46% | 0.463 | 42% | 0.417 | S | S | . | . | trans | -86.6 | 143.8 | 175.2 | -66.4 | 177.5 | -25 | 0 | 0 | 110.8 | T334 | T334-Q338 PolarHBondContact N-O 2.88Å; T334-Q338 PolarHBondContact OG1-N 3.17Å; T334-Q338 PolarHBondContact OG1-O 2.93Å | ||
| 339 | F | 88.8 | Confident | 80.1 | Confident | 15 Ų | 15 | 69.6 Ų | 69.6 | 7% | 0.066 | 42% | 0.419 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.4 | 134.3 | 176.1 | -62.7 | -90 | 0 | 0 | 0 | 110.1 | L329 C332 V333 G347 A348 E351 F354 | L329-F339 HydrophobicContact CD2-CE1 4.21Å; C332-F339 CarbonylContact O-C 3.49Å; C332-F339 WeakPolarHBondContact O-CA 3.38Å; V333-F339 HydrophobicContact CG2-CD1 3.75Å; V333-F339 HydrophobicContact CG2-CE1 3.5Å; V333-F339 HydrophobicContact CG2-CZ 4.27Å; F339-G347 CarbonylContact O-C 3.47Å; F339-G347 VanDerWaalsContact O-CA 3.26Å; F339-G347 WeakPolarHBondContact O-CA 3.38Å; F339-A348 HydrophobicContact CB-CB 4.49Å; F339-A348 PolarHBondContact N-O 3.49Å; F339-A348 PolarHBondContact O-N 3.33Å; F339-E351 HydrophobicContact CD2-CB 4.46Å; F339-E351 HydrophobicContact CE1-CB 4.34Å; F339-E351 HydrophobicContact CE1-CG 4.05Å; F339-E351 HydrophobicContact CE2-CB 3.55Å; F339-E351 HydrophobicContact CE2-CG 4.17Å; F339-E351 HydrophobicContact CZ-CB 3.48Å; F339-E351 VanDerWaalsContact CZ-CB 3.48Å; F339-E351 HydrophobicContact CZ-CG 3.6Å; F339-F354 HydrophobicContact CB-CB 3.63Å; F339-F354 HydrophobicContact CB-CD1 3.73Å; F339-F354 HydrophobicContact CB-CD2 3.52Å; F339-F354 HydrophobicContact CB-CE1 4.24Å; F339-F354 HydrophobicContact CB-CE2 4.06Å; F339-F354 HydrophobicContact CB-CG 3.33Å; F339-F354 HydrophobicContact CB-CZ 4.4Å; F339-F354 HydrophobicContact CD1-CB 4.33Å; F339-F354 AromaticContact CD1-CD1 3.75Å; F339-F354 HydrophobicContact CD1-CD1 3.75Å; F339-F354 HydrophobicContact CD1-CE1 4.32Å; F339-F354 HydrophobicContact CD1-CG 4.14Å; F339-F354 HydrophobicContact CD2-CB 4.38Å; F339-F354 HydrophobicContact CG-CB 3.87Å; F339-F354 HydrophobicContact CG-CD1 4Å; F339-F354 AromaticContact CG-CG 3.89Å; F339-F354 HydrophobicContact CG-CG 3.89Å |
| 340 | Y | 88.5 | Confident | 81.1 | Confident | 99 Ų | 99 | 74.1 Ų | 74.1 | 39% | 0.388 | 44% | 0.44 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.5 | 131.3 | -178.5 | 175 | -104.2 | 0 | 0 | 0 | 111.2 | C332 N345 C346 | C332-Y340 WeakPolarHBondContact CB-O 3.35Å; C332-Y340 PolarHBondContact O-N 3.2Å; Y340-N345 PolarHBondContact OH-OD1 2.98Å; Y340-C346 WeakPolarHBondContact CA-O 3.09Å |
| 341 | C | 88.8 | Confident | 82.3 | Confident | 6 Ų | 6 | 73.7 Ų | 73.7 | 4% | 0.041 | 43% | 0.428 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.5 | 108.7 | 175.5 | 176 | 0 | 0 | 0 | 0 | 109.3 | M343 C344 N345 C346 F354 H357 H363 | C341-M343 VanDerWaalsContact C-N 3.28Å; C341-M343 PolarHBondContact O-N 3.41Å; C341-C344 HydrophobicContact CB-CB 4.44Å; C341-C344 PolarHBondContact O-N 2.82Å; C341-C344 PolarHBondContact SG-N 3.13Å; C341-N345 VanDerWaalsContact O-CA 3.29Å; C341-N345 WeakPolarHBondContact O-CA 3.5Å; C341-N345 PolarHBondContact O-N 3.36Å; C341-C346 PolarHBondContact N-O 3.05Å; C341-C346 PolarHBondContact O-N 3.29Å; C341-F354 HydrophobicContact CB-CE2 3.65Å; C341-F354 HydrophobicContact CB-CZ 3.94Å; C341-H357 WeakPolarHBondContact CB-NE2 3.36Å; C341-H357 PolarHBondContact SG-NE2 3.39Å; C341-H363 PolarHBondContact SG-CE1 2.93Å; C341-H363 PolarHBondContact SG-ND1 3.32Å |
| 342 | S | 86 | Confident | 83.3 | Confident | 87 Ų | 87 | 69.5 Ų | 69.5 | 61% | 0.608 | 41% | 0.413 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.7 | -26.8 | 177.4 | 56.1 | 0 | 0 | 0 | 0 | 113.5 | C344 N345 | S342-C344 VanDerWaalsContact C-N 3.32Å; S342-N345 PolarHBondContact O-OD1 2.87Å |
| 343 | M | 86.1 | Confident | 84.1 | Confident | 76 Ų | 76 | 72 Ų | 72 | 37% | 0.374 | 42% | 0.424 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.7 | -24.6 | -179.4 | -57.1 | -168.4 | 74.6 | 0 | 0 | 112.6 | C341 V367 L370 | C341-M343 VanDerWaalsContact C-N 3.28Å; C341-M343 PolarHBondContact O-N 3.41Å; M343-V367 HydrophobicContact CE-CB 4.45Å; M343-V367 HydrophobicContact CE-CG2 3.96Å; M343-V367 HydrophobicContact SD-CG2 3.75Å; M343-L370 HydrophobicContact CE-CB 3.99Å; M343-L370 HydrophobicContact CE-CD1 3.27Å; M343-L370 HydrophobicContact CE-CG 4.25Å |
| 344 | C | 87.7 | Confident | 84.5 | Confident | 18 Ų | 18 | 70 Ų | 70 | 12% | 0.122 | 41% | 0.412 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -113.3 | -7.1 | 179.6 | -63.5 | 0 | 0 | 0 | 0 | 113.1 | C341 S342 C346 H357 H363 | C341-C344 HydrophobicContact CB-CB 4.44Å; C341-C344 PolarHBondContact O-N 2.82Å; C341-C344 PolarHBondContact SG-N 3.13Å; S342-C344 VanDerWaalsContact C-N 3.32Å; C344-C346 HydrophobicContact CB-CB 4.35Å; C344-C346 PolarHBondContact O-N 2.88Å; C344-C346 PolarHBondContact O-SG 3.4Å; C344-H357 VanDerWaalsContact CB-CE1 3.43Å; C344-H357 WeakPolarHBondContact CB-CE1 3.34Å; C344-H357 VanDerWaalsContact SG-CE1 3.56Å; C344-H363 PolarHBondContact SG-ND1 3.44Å |
| 345 | N | 88.6 | Confident | 85 | Confident | 119 Ų | 119 | 73.1 Ų | 73.1 | 64% | 0.636 | 42% | 0.419 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.5 | 40.5 | -169.4 | -69.1 | -19.5 | 0 | 0 | 0 | 112.8 | Y340 C341 S342 | Y340-N345 PolarHBondContact OH-OD1 2.98Å; C341-N345 VanDerWaalsContact O-CA 3.29Å; C341-N345 WeakPolarHBondContact O-CA 3.5Å; C341-N345 PolarHBondContact O-N 3.36Å; S342-N345 PolarHBondContact O-OD1 2.87Å |
| 346 | C | 86.1 | Confident | 86.1 | Confident | 54 Ų | 54 | 72.4 Ų | 72.4 | 37% | 0.365 | 40% | 0.403 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.4 | 131.6 | -179.2 | -57.9 | 0 | 0 | 0 | 0 | 110.5 | Y340 C341 C344 | Y340-C346 WeakPolarHBondContact CA-O 3.09Å; C341-C346 PolarHBondContact N-O 3.05Å; C341-C346 PolarHBondContact O-N 3.29Å; C344-C346 HydrophobicContact CB-CB 4.35Å; C344-C346 PolarHBondContact O-N 2.88Å; C344-C346 PolarHBondContact O-SG 3.4Å |
| 347 | G | 88.3 | Confident | 87 | Confident | 63 Ų | 63 | 70 Ų | 70 | 65% | 0.649 | 38% | 0.382 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -98.1 | 147.6 | 168.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | F339 | F339-G347 CarbonylContact O-C 3.47Å; F339-G347 VanDerWaalsContact O-CA 3.26Å; F339-G347 WeakPolarHBondContact O-CA 3.38Å |
| 348 | A | 87 | Confident | 87.6 | Confident | 18 Ų | 18 | 69.8 Ų | 69.8 | 15% | 0.149 | 37% | 0.37 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135 | 137.2 | 170.4 | 0 | 0 | 0 | 0 | 0 | 109.3 | F339 D353 F354 | F339-A348 HydrophobicContact CB-CB 4.49Å; F339-A348 PolarHBondContact N-O 3.49Å; F339-A348 PolarHBondContact O-N 3.33Å; A348-D353 HydrophobicContact CB-CB 4.37Å; A348-F354 HydrophobicContact CB-CB 3.86Å; A348-F354 HydrophobicContact CB-CD2 4.01Å; A348-F354 HydrophobicContact CB-CG 4.43Å |
| 349 | E | 83.6 | Confident | 88.1 | Confident | 161 Ų | 161 | 70.8 Ų | 70.8 | 75% | 0.752 | 37% | 0.374 | S | S | * | . | S | Bend | trans | -81.3 | -28.8 | -179 | -60.3 | -174.3 | 161.3 | 0 | 0 | 111.7 | ||
| 350 | Q | 85.6 | Confident | 88.3 | Confident | 113 Ų | 113 | 71.7 Ų | 71.7 | 53% | 0.528 | 38% | 0.383 | S | S | . | . | S | Bend | trans | -108.7 | 143.7 | -179.4 | -58 | -174.5 | 99 | 0 | 0 | 111.9 | T352 D353 F354 | Q350-T352 VanDerWaalsContact C-N 3.27Å; Q350-T352 PolarHBondContact O-N 2.93Å; Q350-D353 HydrophobicContact CB-CB 4.45Å; Q350-D353 PolarHBondContact NE2-OD2 2.94Å; Q350-D353 PolarHBondContact O-N 3.5Å; Q350-F354 PolarHBondContact O-N 2.87Å; Q350-F354 VanDerWaalsContact O-N 3.14Å |
| 351 | E | 86 | Confident | 88.6 | Confident | 45 Ų | 45 | 76.1 Ų | 76.1 | 21% | 0.21 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -61.4 | -37.2 | 177.2 | -172.6 | 175.6 | 171.9 | 0 | 0 | 112 | L329 F339 F354 R355 | L329-E351 HydrophobicContact CD2-CG 3.73Å; L329-E351 VanDerWaalsContact CD2-OE1 3.3Å; L329-E351 WeakPolarHBondContact CD2-OE1 3.42Å; F339-E351 HydrophobicContact CD2-CB 4.46Å; F339-E351 HydrophobicContact CE1-CB 4.34Å; F339-E351 HydrophobicContact CE1-CG 4.05Å; F339-E351 HydrophobicContact CE2-CB 3.55Å; F339-E351 HydrophobicContact CE2-CG 4.17Å; F339-E351 HydrophobicContact CZ-CB 3.48Å; F339-E351 VanDerWaalsContact CZ-CB 3.48Å; F339-E351 HydrophobicContact CZ-CG 3.6Å; E351-F354 PolarHBondContact O-N 3.43Å; E351-R355 HydrophobicContact CG-CG 4.42Å; E351-R355 WeakPolarHBondContact O-CB 3.5Å; E351-R355 VanDerWaalsContact O-CG 3.25Å; E351-R355 WeakPolarHBondContact O-CG 3.5Å; E351-R355 PolarHBondContact O-N 2.9Å; E351-R355 IonicContact OE1-CZ 3.22Å; E351-R355 IonicContact OE1-NE 3.07Å; E351-R355 PolarHBondContact OE1-NE 3.32Å; E351-R355 IonicContact OE1-NH2 2.64Å; E351-R355 PolarHBondContact OE1-NH2 3.09Å |
| 352 | T | 88.2 | Confident | 88.7 | Confident | 88 Ų | 88 | 83.1 Ų | 83.1 | 54% | 0.54 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -63.3 | -45.4 | 180 | 49.2 | 0 | 0 | 0 | 0 | 111.8 | Q350 F354 R355 Q356 | Q350-T352 VanDerWaalsContact C-N 3.27Å; Q350-T352 PolarHBondContact O-N 2.93Å; T352-F354 VanDerWaalsContact C-N 3.31Å; T352-F354 PolarHBondContact O-N 3.31Å; T352-R355 PolarHBondContact O-N 3.13Å; T352-Q356 WeakPolarHBondContact O-CB 3.34Å; T352-Q356 PolarHBondContact O-N 3.45Å |
| 353 | D | 88.6 | Confident | 89 | Confident | 83 Ų | 83 | 80 Ų | 80 | 44% | 0.444 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -69.1 | -36.3 | -178.4 | -57.9 | -18.8 | 0 | 0 | 0 | 110.3 | A348 Q350 Q356 H357 | A348-D353 HydrophobicContact CB-CB 4.37Å; Q350-D353 HydrophobicContact CB-CB 4.45Å; Q350-D353 PolarHBondContact NE2-OD2 2.94Å; Q350-D353 PolarHBondContact O-N 3.5Å; D353-Q356 PolarHBondContact O-N 3.32Å; D353-H357 PolarHBondContact O-N 3.46Å |
| 354 | F | 90.1 | Very high | 89.4 | Confident | 1 Ų | 1 | 82 Ų | 82 | 0% | 0.004 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -67.6 | -41.7 | 174 | -166 | -112 | 0 | 0 | 0 | 113 | C332 F339 C341 A348 Q350 E351 T352 Q356 H357 L358 | C332-F354 HydrophobicContact CB-CD1 4.49Å; C332-F354 HydrophobicContact CB-CE1 3.37Å; C332-F354 HydrophobicContact CB-CZ 3.48Å; C332-F354 VanDerWaalsContact CB-CZ 3.48Å; F339-F354 HydrophobicContact CB-CB 3.63Å; F339-F354 HydrophobicContact CB-CD1 3.73Å; F339-F354 HydrophobicContact CB-CD2 3.52Å; F339-F354 HydrophobicContact CB-CE1 4.24Å; F339-F354 HydrophobicContact CB-CE2 4.06Å; F339-F354 HydrophobicContact CB-CG 3.33Å; F339-F354 HydrophobicContact CB-CZ 4.4Å; F339-F354 HydrophobicContact CD1-CB 4.33Å; F339-F354 AromaticContact CD1-CD1 3.75Å; F339-F354 HydrophobicContact CD1-CD1 3.75Å; F339-F354 HydrophobicContact CD1-CE1 4.32Å; F339-F354 HydrophobicContact CD1-CG 4.14Å; F339-F354 HydrophobicContact CD2-CB 4.38Å; F339-F354 HydrophobicContact CG-CB 3.87Å; F339-F354 HydrophobicContact CG-CD1 4Å; F339-F354 AromaticContact CG-CG 3.89Å; F339-F354 HydrophobicContact CG-CG 3.89Å; C341-F354 HydrophobicContact CB-CE2 3.65Å; C341-F354 HydrophobicContact CB-CZ 3.94Å; A348-F354 HydrophobicContact CB-CB 3.86Å; A348-F354 HydrophobicContact CB-CD2 4.01Å; A348-F354 HydrophobicContact CB-CG 4.43Å; Q350-F354 PolarHBondContact O-N 2.87Å; Q350-F354 VanDerWaalsContact O-N 3.14Å; E351-F354 PolarHBondContact O-N 3.43Å; T352-F354 VanDerWaalsContact C-N 3.31Å; T352-F354 PolarHBondContact O-N 3.31Å; F354-Q356 VanDerWaalsContact C-N 3.32Å; F354-Q356 PolarHBondContact O-N 3.41Å; F354-H357 WeakPolarHBondContact O-CB 3.02Å; F354-H357 PolarHBondContact O-N 3.48Å; F354-H357 VanDerWaalsContact O-N 3.16Å; F354-L358 HydrophobicContact CD1-CD1 3.94Å; F354-L358 HydrophobicContact CD1-CG 4.19Å; F354-L358 HydrophobicContact CE1-CD1 3.66Å; F354-L358 HydrophobicContact CE1-CD2 4.09Å; F354-L358 HydrophobicContact CE1-CG 3.92Å; F354-L358 HydrophobicContact CZ-CD1 4.45Å; F354-L358 HydrophobicContact CZ-CD2 4.06Å; F354-L358 HydrophobicContact CZ-CG 4.29Å; F354-L358 WeakPolarHBondContact O-CG 3.16Å; F354-L358 PolarHBondContact O-N 2.65Å |
| 355 | R | 87.8 | Confident | 89.7 | Confident | 108 Ų | 108 | 83.6 Ų | 83.6 | 41% | 0.408 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -60.9 | -44.3 | 174 | -74.6 | 173.1 | 177.9 | -151.4 | 4.6 | 111 | L329 E351 T352 H357 L358 E359 | L329-R355 HydrophobicContact CD2-CG 3.95Å; E351-R355 HydrophobicContact CG-CG 4.42Å; E351-R355 WeakPolarHBondContact O-CB 3.5Å; E351-R355 VanDerWaalsContact O-CG 3.25Å; E351-R355 WeakPolarHBondContact O-CG 3.5Å; E351-R355 PolarHBondContact O-N 2.9Å; E351-R355 IonicContact OE1-CZ 3.22Å; E351-R355 IonicContact OE1-NE 3.07Å; E351-R355 PolarHBondContact OE1-NE 3.32Å; E351-R355 IonicContact OE1-NH2 2.64Å; E351-R355 PolarHBondContact OE1-NH2 3.09Å; T352-R355 PolarHBondContact O-N 3.13Å; R355-H357 VanDerWaalsContact C-N 3.27Å; R355-H357 PolarHBondContact O-N 3Å; R355-L358 PolarHBondContact O-N 3.29Å; R355-E359 WeakPolarHBondContact O-CB 3.5Å; R355-E359 WeakPolarHBondContact O-CG 3.45Å; R355-E359 PolarHBondContact O-N 3.47Å |
| 356 | Q | 92.3 | Very high | 89.8 | Confident | 133 Ų | 133 | 82.3 Ų | 82.3 | 62% | 0.621 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -59.7 | -39.2 | 174.8 | -166.9 | 75.8 | 84.5 | 0 | 0 | 111.5 | T352 D353 F354 E359 S360 | T352-Q356 WeakPolarHBondContact O-CB 3.34Å; T352-Q356 PolarHBondContact O-N 3.45Å; D353-Q356 PolarHBondContact O-N 3.32Å; F354-Q356 VanDerWaalsContact C-N 3.32Å; F354-Q356 PolarHBondContact O-N 3.41Å; Q356-E359 PolarHBondContact O-N 2.85Å; Q356-S360 PolarHBondContact O-N 2.88Å |
| 357 | H | 92.5 | Very high | 90.1 | Very high | 37 Ų | 37 | 81.5 Ų | 81.5 | 17% | 0.171 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -62.3 | -49 | 173.6 | 168.9 | 80.3 | 0 | 0 | 0 | 112.5 | C341 C344 D353 F354 R355 E359 S360 H363 | C341-H357 WeakPolarHBondContact CB-NE2 3.36Å; C341-H357 PolarHBondContact SG-NE2 3.39Å; C344-H357 VanDerWaalsContact CB-CE1 3.43Å; C344-H357 WeakPolarHBondContact CB-CE1 3.34Å; C344-H357 VanDerWaalsContact SG-CE1 3.56Å; D353-H357 PolarHBondContact O-N 3.46Å; F354-H357 WeakPolarHBondContact O-CB 3.02Å; F354-H357 PolarHBondContact O-N 3.48Å; F354-H357 VanDerWaalsContact O-N 3.16Å; R355-H357 VanDerWaalsContact C-N 3.27Å; R355-H357 PolarHBondContact O-N 3Å; H357-E359 PolarHBondContact O-N 3.35Å; H357-S360 WeakPolarHBondContact O-CB 2.82Å; H357-S360 PolarHBondContact O-N 2.84Å; H357-S360 PolarHBondContact O-OG 3.14Å; H357-H363 AromaticContact CD2-ND1 3.99Å; H357-H363 AromaticContact NE2-ND1 3.36Å; H357-H363 PolarHBondContact NE2-ND1 3.5Å; H357-H363 WeakPolarHBondContact O-CB 3.45Å |
| 358 | L | 89.9 | Confident | 90.2 | Very high | 42 Ų | 42 | 81.9 Ų | 81.9 | 22% | 0.22 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -61.4 | -33.4 | 178.4 | -66.9 | 178.9 | 0 | 0 | 0 | 112.1 | L329 F354 R355 S360 H363 | L329-L358 HydrophobicContact CD1-CD1 4.36Å; F354-L358 HydrophobicContact CD1-CD1 3.94Å; F354-L358 HydrophobicContact CD1-CG 4.19Å; F354-L358 HydrophobicContact CE1-CD1 3.66Å; F354-L358 HydrophobicContact CE1-CD2 4.09Å; F354-L358 HydrophobicContact CE1-CG 3.92Å; F354-L358 HydrophobicContact CZ-CD1 4.45Å; F354-L358 HydrophobicContact CZ-CD2 4.06Å; F354-L358 HydrophobicContact CZ-CG 4.29Å; F354-L358 WeakPolarHBondContact O-CG 3.16Å; F354-L358 PolarHBondContact O-N 2.65Å; R355-L358 PolarHBondContact O-N 3.29Å; L358-S360 VanDerWaalsContact C-N 3.32Å; L358-H363 PolarHBondContact O-CD2 3.3Å; L358-H363 VanDerWaalsContact O-CD2 3.24Å |
| 359 | E | 89.9 | Confident | 90.5 | Very high | 121 Ų | 121 | 87.4 Ų | 87.4 | 57% | 0.565 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -82.8 | -10.4 | 177.4 | -69.3 | 176.3 | -178 | 0 | 0 | 113.6 | R355 Q356 H357 K364 | R355-E359 WeakPolarHBondContact O-CB 3.5Å; R355-E359 WeakPolarHBondContact O-CG 3.45Å; R355-E359 PolarHBondContact O-N 3.47Å; Q356-E359 PolarHBondContact O-N 2.85Å; H357-E359 PolarHBondContact O-N 3.35Å; E359-K364 VanDerWaalsContact O-CE 3.29Å; E359-K364 WeakPolarHBondContact O-CE 3.3Å; E359-K364 PolarHBondContact O-NZ 3.1Å |
| 360 | S | 93.1 | Very high | 90.8 | Very high | 34 Ų | 34 | 83 Ų | 83 | 24% | 0.238 | 41% | 0.412 | C | S | . | . | S | Bend | trans | -64 | 149.8 | -177.3 | 77.6 | 0 | 0 | 0 | 0 | 112.2 | Q356 H357 L358 Q362 H363 K364 | Q356-S360 PolarHBondContact O-N 2.88Å; H357-S360 WeakPolarHBondContact O-CB 2.82Å; H357-S360 PolarHBondContact O-N 2.84Å; H357-S360 PolarHBondContact O-OG 3.14Å; L358-S360 VanDerWaalsContact C-N 3.32Å; S360-Q362 PolarHBondContact O-N 3.2Å; S360-H363 PolarHBondContact O-N 2.65Å; S360-H363 WeakPolarHBondContact OG-CB 3.32Å; S360-H363 PolarHBondContact OG-N 3.24Å; S360-K364 WeakPolarHBondContact O-CG 3.36Å; S360-K364 PolarHBondContact O-N 3.32Å |
| 361 | K | 93.9 | Very high | 90.9 | Very high | 191 Ų | 191 | 86 Ų | 86 | 83% | 0.83 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -59.5 | -36.1 | 176.4 | -66.6 | -176.3 | 179.7 | -179.1 | 0 | 111.9 | A365 | K361-A365 VanDerWaalsContact O-CB 3.23Å; K361-A365 WeakPolarHBondContact O-CB 3.33Å; K361-A365 PolarHBondContact O-N 3.16Å |
| 362 | Q | 92.6 | Very high | 91.3 | Very high | 154 Ų | 154 | 90.9 Ų | 90.9 | 72% | 0.72 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -67.5 | -45.7 | -179.6 | -64.3 | -176.6 | 23.5 | 0 | 0 | 111.8 | S360 A365 K366 | S360-Q362 PolarHBondContact O-N 3.2Å; Q362-A365 PolarHBondContact O-N 3.08Å; Q362-K366 PolarHBondContact O-N 3.48Å |
| 363 | H | 92.4 | Very high | 91.4 | Very high | 20 Ų | 20 | 94.5 Ų | 94.5 | 9% | 0.093 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -62.8 | -49.3 | 176.8 | -177.8 | 83.1 | 0 | 0 | 0 | 110.7 | C341 C344 H357 L358 S360 A365 K366 V367 | C341-H363 PolarHBondContact SG-CE1 2.93Å; C341-H363 PolarHBondContact SG-ND1 3.32Å; C344-H363 PolarHBondContact SG-ND1 3.44Å; H357-H363 AromaticContact CD2-ND1 3.99Å; H357-H363 AromaticContact NE2-ND1 3.36Å; H357-H363 PolarHBondContact NE2-ND1 3.5Å; H357-H363 WeakPolarHBondContact O-CB 3.45Å; L358-H363 PolarHBondContact O-CD2 3.3Å; L358-H363 VanDerWaalsContact O-CD2 3.24Å; S360-H363 PolarHBondContact O-N 2.65Å; S360-H363 WeakPolarHBondContact OG-CB 3.32Å; S360-H363 PolarHBondContact OG-N 3.24Å; H363-A365 VanDerWaalsContact C-N 3.32Å; H363-A365 PolarHBondContact O-N 2.98Å; H363-K366 PolarHBondContact O-N 2.86Å; H363-V367 WeakPolarHBondContact NE2-CG2 3.46Å; H363-V367 VanDerWaalsContact O-CG2 3.25Å; H363-V367 WeakPolarHBondContact O-CG2 3.35Å; H363-V367 PolarHBondContact O-N 3.04Å |
| 364 | K | 92.6 | Very high | 91.6 | Very high | 118 Ų | 118 | 95.2 Ų | 95.2 | 51% | 0.513 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -58.5 | -42.1 | 178.6 | -73 | 172 | 175 | 162.1 | 0 | 112.6 | E359 S360 V367 S368 | E359-K364 VanDerWaalsContact O-CE 3.29Å; E359-K364 WeakPolarHBondContact O-CE 3.3Å; E359-K364 PolarHBondContact O-NZ 3.1Å; S360-K364 WeakPolarHBondContact O-CG 3.36Å; S360-K364 PolarHBondContact O-N 3.32Å; K364-V367 PolarHBondContact O-N 2.95Å; K364-S368 PolarHBondContact O-N 3.11Å; K364-S368 PolarHBondContact O-OG 3.45Å; K364-S368 VanDerWaalsContact O-OG 3.07Å |
| 365 | A | 94.7 | Very high | 91.7 | Very high | 52 Ų | 52 | 100.2 Ų | 100.2 | 43% | 0.43 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -62 | -48.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112 | K361 Q362 H363 V367 S368 E369 | K361-A365 VanDerWaalsContact O-CB 3.23Å; K361-A365 WeakPolarHBondContact O-CB 3.33Å; K361-A365 PolarHBondContact O-N 3.16Å; Q362-A365 PolarHBondContact O-N 3.08Å; H363-A365 VanDerWaalsContact C-N 3.32Å; H363-A365 PolarHBondContact O-N 2.98Å; A365-V367 VanDerWaalsContact C-N 3.32Å; A365-V367 PolarHBondContact O-N 2.84Å; A365-S368 WeakPolarHBondContact CA-OG 3.42Å; A365-S368 PolarHBondContact O-N 3.42Å; A365-S368 PolarHBondContact O-OG 3.37Å; A365-E369 WeakPolarHBondContact O-CB 3.43Å; A365-E369 PolarHBondContact O-N 3.26Å |
| 366 | K | 91.8 | Very high | 91.9 | Very high | 92 Ų | 92 | 97.3 Ų | 97.3 | 40% | 0.4 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -61.5 | -39.4 | 176.3 | -78 | -175.3 | 175.9 | -177.4 | 0 | 112.5 | Q362 H363 E369 L370 | Q362-K366 PolarHBondContact O-N 3.48Å; H363-K366 PolarHBondContact O-N 2.86Å; K366-E369 PolarHBondContact O-N 3.31Å; K366-L370 WeakPolarHBondContact O-CB 3.33Å; K366-L370 WeakPolarHBondContact O-CG 3.27Å; K366-L370 PolarHBondContact O-N 3.33Å |
| 367 | V | 91.7 | Very high | 91.8 | Very high | 37 Ų | 37 | 95.9 Ų | 95.9 | 22% | 0.224 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -65.4 | -44.6 | 176.9 | 172.8 | 0 | 0 | 0 | 0 | 111 | M343 H363 K364 A365 L370 R371 | M343-V367 HydrophobicContact CE-CB 4.45Å; M343-V367 HydrophobicContact CE-CG2 3.96Å; M343-V367 HydrophobicContact SD-CG2 3.75Å; H363-V367 WeakPolarHBondContact NE2-CG2 3.46Å; H363-V367 VanDerWaalsContact O-CG2 3.25Å; H363-V367 WeakPolarHBondContact O-CG2 3.35Å; H363-V367 PolarHBondContact O-N 3.04Å; K364-V367 PolarHBondContact O-N 2.95Å; A365-V367 VanDerWaalsContact C-N 3.32Å; A365-V367 PolarHBondContact O-N 2.84Å; V367-L370 PolarHBondContact O-N 3.29Å; V367-R371 WeakPolarHBondContact O-CB 3.33Å; V367-R371 PolarHBondContact O-N 3.42Å |
| 368 | S | 91.1 | Very high | 91.6 | Very high | 71 Ų | 71 | 99.5 Ų | 99.5 | 50% | 0.497 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -65.3 | -39.8 | 177 | 52 | 0 | 0 | 0 | 0 | 112.3 | K364 A365 R371 Y372 | K364-S368 PolarHBondContact O-N 3.11Å; K364-S368 PolarHBondContact O-OG 3.45Å; K364-S368 VanDerWaalsContact O-OG 3.07Å; A365-S368 WeakPolarHBondContact CA-OG 3.42Å; A365-S368 PolarHBondContact O-N 3.42Å; A365-S368 PolarHBondContact O-OG 3.37Å; S368-R371 PolarHBondContact O-N 2.77Å; S368-Y372 WeakPolarHBondContact O-CB 3.46Å; S368-Y372 PolarHBondContact O-N 3.35Å |
| 369 | E | 92.9 | Very high | 91.6 | Very high | 135 Ų | 135 | 102.8 Ų | 102.8 | 63% | 0.631 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -64.5 | -45 | 177.4 | -175.4 | -178.3 | 166.9 | 0 | 0 | 111.3 | A365 K366 R371 Y372 R373 | A365-E369 WeakPolarHBondContact O-CB 3.43Å; A365-E369 PolarHBondContact O-N 3.26Å; K366-E369 PolarHBondContact O-N 3.31Å; E369-R371 VanDerWaalsContact C-N 3.35Å; E369-R371 PolarHBondContact O-N 3.19Å; E369-Y372 PolarHBondContact O-N 3Å; E369-R373 WeakPolarHBondContact O-CB 3.5Å; E369-R373 PolarHBondContact O-N 3.25Å |
| 370 | L | 89.4 | Confident | 91.3 | Very high | 69 Ų | 69 | 100 Ų | 100 | 36% | 0.361 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -65.5 | -37.6 | 176.4 | -81.3 | 163 | 0 | 0 | 0 | 112.5 | M343 K366 V367 H374 | M343-L370 HydrophobicContact CE-CB 3.99Å; M343-L370 HydrophobicContact CE-CD1 3.27Å; M343-L370 HydrophobicContact CE-CG 4.25Å; K366-L370 WeakPolarHBondContact O-CB 3.33Å; K366-L370 WeakPolarHBondContact O-CG 3.27Å; K366-L370 PolarHBondContact O-N 3.33Å; V367-L370 PolarHBondContact O-N 3.29Å; L370-H374 WeakPolarHBondContact O-CB 2.97Å; L370-H374 PolarHBondContact O-N 3.2Å |
| 371 | R | 88.6 | Confident | 90.2 | Very high | 176 Ų | 176 | 106.8 Ų | 106.8 | 66% | 0.664 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.9 | -47.7 | 173.1 | -174.8 | -174.4 | -65.2 | 176.1 | -0.8 | 110.8 | V367 S368 E369 H374 E375 | V367-R371 WeakPolarHBondContact O-CB 3.33Å; V367-R371 PolarHBondContact O-N 3.42Å; S368-R371 PolarHBondContact O-N 2.77Å; E369-R371 VanDerWaalsContact C-N 3.35Å; E369-R371 PolarHBondContact O-N 3.19Å; R371-H374 PolarHBondContact O-N 3.31Å; R371-E375 WeakPolarHBondContact O-CB 3.34Å; R371-E375 PolarHBondContact O-N 3.36Å |
| 372 | Y | 92.9 | Very high | 88.9 | Confident | 146 Ų | 146 | 105.6 Ų | 105.6 | 57% | 0.573 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -60.2 | -46.9 | 178 | 178 | -102.1 | 0 | 0 | 0 | 111.3 | S368 E369 H374 E375 M376 | S368-Y372 WeakPolarHBondContact O-CB 3.46Å; S368-Y372 PolarHBondContact O-N 3.35Å; E369-Y372 PolarHBondContact O-N 3Å; Y372-H374 VanDerWaalsContact C-N 3.33Å; Y372-H374 PolarHBondContact O-N 3.37Å; Y372-E375 PolarHBondContact O-N 3.01Å; Y372-M376 HydrophobicContact CD1-CG 4.15Å; Y372-M376 HydrophobicContact CD2-CE 4.25Å; Y372-M376 HydrophobicContact CD2-CG 4.37Å; Y372-M376 HydrophobicContact CE1-CG 3.71Å; Y372-M376 HydrophobicContact CE1-SD 4.48Å; Y372-M376 HydrophobicContact CE2-CE 3.74Å; Y372-M376 HydrophobicContact CE2-CG 3.95Å; Y372-M376 HydrophobicContact CE2-SD 3.95Å; Y372-M376 HydrophobicContact CG-CG 4.46Å; Y372-M376 WeakPolarHBondContact O-CG 3.26Å; Y372-M376 PolarHBondContact O-N 3.03Å |
| 373 | R | 91.4 | Very high | 88.7 | Confident | 164 Ų | 164 | 103.2 Ų | 103.2 | 62% | 0.619 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -59.3 | -44.5 | 177.7 | -164 | -176.9 | 76.2 | 128.2 | 7.8 | 111.8 | E369 E375 M376 E377 | E369-R373 WeakPolarHBondContact O-CB 3.5Å; E369-R373 PolarHBondContact O-N 3.25Å; R373-E375 VanDerWaalsContact C-N 3.35Å; R373-M376 PolarHBondContact O-N 3.05Å; R373-E377 WeakPolarHBondContact O-CB 3.47Å; R373-E377 PolarHBondContact O-N 3.33Å |
| 374 | H | 91.2 | Very high | 88.5 | Confident | 99 Ų | 99 | 107.6 Ų | 107.6 | 46% | 0.458 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -67.4 | -35.7 | 177.6 | -174.7 | 57.9 | 0 | 0 | 0 | 112.5 | L370 R371 Y372 E377 N378 | L370-H374 WeakPolarHBondContact O-CB 2.97Å; L370-H374 PolarHBondContact O-N 3.2Å; R371-H374 PolarHBondContact O-N 3.31Å; Y372-H374 VanDerWaalsContact C-N 3.33Å; Y372-H374 PolarHBondContact O-N 3.37Å; H374-E377 IonicContact ND1-OE2 3.75Å; H374-E377 PolarHBondContact O-N 3.38Å; H374-N378 PolarHBondContact CD2-ND2 3.41Å; H374-N378 PolarHBondContact NE2-ND2 3.35Å; H374-N378 WeakPolarHBondContact O-CB 3.45Å; H374-N378 PolarHBondContact O-N 3.44Å; H374-N378 PolarHBondContact O-ND2 2.73Å |
| 375 | E | 93.1 | Very high | 88.3 | Confident | 106 Ų | 106 | 107 Ų | 107 | 50% | 0.495 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -66.6 | -42 | 174.8 | -171.7 | 171.6 | -176.8 | 0 | 0 | 111.6 | R371 Y372 R373 N378 L379 | R371-E375 WeakPolarHBondContact O-CB 3.34Å; R371-E375 PolarHBondContact O-N 3.36Å; Y372-E375 PolarHBondContact O-N 3.01Å; R373-E375 VanDerWaalsContact C-N 3.35Å; E375-N378 PolarHBondContact O-N 2.77Å; E375-L379 WeakPolarHBondContact O-CG 3.42Å; E375-L379 PolarHBondContact O-N 3Å; E375-L379 VanDerWaalsContact O-N 3.1Å |
| 376 | M | 91 | Very high | 87.9 | Confident | 47 Ų | 47 | 110.2 Ų | 110.2 | 23% | 0.232 | 55% | 0.548 | C | S | . | . | H | α-helix | trans | -64.9 | -41.9 | 174.2 | -66.6 | -58.4 | 101.8 | 0 | 0 | 111.9 | Y372 R373 N378 L379 G380 Y381 | Y372-M376 HydrophobicContact CD1-CG 4.15Å; Y372-M376 HydrophobicContact CD2-CE 4.25Å; Y372-M376 HydrophobicContact CD2-CG 4.37Å; Y372-M376 HydrophobicContact CE1-CG 3.71Å; Y372-M376 HydrophobicContact CE1-SD 4.48Å; Y372-M376 HydrophobicContact CE2-CE 3.74Å; Y372-M376 HydrophobicContact CE2-CG 3.95Å; Y372-M376 HydrophobicContact CE2-SD 3.95Å; Y372-M376 HydrophobicContact CG-CG 4.46Å; Y372-M376 WeakPolarHBondContact O-CG 3.26Å; Y372-M376 PolarHBondContact O-N 3.03Å; R373-M376 PolarHBondContact O-N 3.05Å; M376-N378 PolarHBondContact O-N 3.14Å; M376-L379 HydrophobicContact CE-CD1 3.89Å; M376-L379 CarbonylContact O-C 3.58Å; M376-L379 PolarHBondContact O-N 3.18Å; M376-L379 VanDerWaalsContact O-N 3.16Å; M376-G380 PolarHBondContact O-N 2.92Å; M376-Y381 CarbonylContact C-O 3.56Å; M376-Y381 PolarHBondContact O-N 3.13Å |
| 377 | E | 92 | Very high | 87.7 | Confident | 102 Ų | 102 | 111.4 Ų | 111.4 | 48% | 0.477 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -60.8 | -43.4 | 174.7 | -176 | -179.7 | -160 | 0 | 0 | 111.5 | R373 H374 L379 G380 | R373-E377 WeakPolarHBondContact O-CB 3.47Å; R373-E377 PolarHBondContact O-N 3.33Å; H374-E377 IonicContact ND1-OE2 3.75Å; H374-E377 PolarHBondContact O-N 3.38Å; E377-L379 PolarHBondContact O-N 3.5Å; E377-G380 PolarHBondContact O-N 3.04Å |
| 378 | N | 86.5 | Confident | 87.4 | Confident | 113 Ų | 113 | 116.3 Ų | 116.3 | 60% | 0.604 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -66.2 | -25.2 | 176.8 | -74.3 | -24.5 | 0 | 0 | 0 | 113.3 | H374 E375 M376 G380 | H374-N378 PolarHBondContact CD2-ND2 3.41Å; H374-N378 PolarHBondContact NE2-ND2 3.35Å; H374-N378 WeakPolarHBondContact O-CB 3.45Å; H374-N378 PolarHBondContact O-N 3.44Å; H374-N378 PolarHBondContact O-ND2 2.73Å; E375-N378 PolarHBondContact O-N 2.77Å; M376-N378 PolarHBondContact O-N 3.14Å; N378-G380 VanDerWaalsContact C-N 3.25Å |
| 379 | L | 91.1 | Very high | 87.2 | Confident | 111 Ų | 111 | 119.6 Ų | 119.6 | 58% | 0.581 | 59% | 0.586 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.6 | 2.1 | 173.3 | -68.3 | 170.6 | 0 | 0 | 0 | 112.8 | E375 M376 E377 Y381 | E375-L379 WeakPolarHBondContact O-CG 3.42Å; E375-L379 PolarHBondContact O-N 3Å; E375-L379 VanDerWaalsContact O-N 3.1Å; M376-L379 HydrophobicContact CE-CD1 3.89Å; M376-L379 CarbonylContact O-C 3.58Å; M376-L379 PolarHBondContact O-N 3.18Å; M376-L379 VanDerWaalsContact O-N 3.16Å; E377-L379 PolarHBondContact O-N 3.5Å; L379-Y381 VanDerWaalsContact C-N 3.31Å; L379-Y381 HydrophobicContact CB-CD2 3.85Å; L379-Y381 HydrophobicContact CB-CE2 4.28Å |
| 380 | G | 83.8 | Confident | 86.7 | Confident | 63 Ų | 63 | 118.4 Ų | 118.4 | 65% | 0.649 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 79.7 | 11.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | M376 E377 N378 S382 | M376-G380 PolarHBondContact O-N 2.92Å; E377-G380 PolarHBondContact O-N 3.04Å; N378-G380 VanDerWaalsContact C-N 3.25Å; G380-S382 PolarHBondContact O-N 2.78Å |
| 381 | Y | 69.6 | Low | 86.5 | Confident | 177 Ų | 177 | 122.5 Ų | 122.5 | 69% | 0.694 | 60% | 0.601 | S | S | * | * | trans | -91.6 | 93.3 | 170.6 | -65.7 | -84.7 | 0 | 0 | 0 | 107.7 | M376 L379 | M376-Y381 CarbonylContact C-O 3.56Å; M376-Y381 PolarHBondContact O-N 3.13Å; L379-Y381 VanDerWaalsContact C-N 3.31Å; L379-Y381 HydrophobicContact CB-CD2 3.85Å; L379-Y381 HydrophobicContact CB-CE2 4.28Å | ||
| 382 | S | 67.1 | Low | 86.3 | Confident | 166 Ų | 166 | 117.6 Ų | 117.6 | 100% | 1.161 | 60% | 0.595 | S | S | * | * | trans | -105.9 | 0 | 173.5 | -64.5 | 0 | 0 | 0 | 0 | 111.6 | G380 | G380-S382 PolarHBondContact O-N 2.78Š|
Retrieved 382 of 382 residues in 182.3 ms
(Link to these results)