| 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 | 32.1 | Very low | 38.6 | Very low | 238 Ų | 238 | 163.5 Ų | 163.5 | 100% | 1.172 | 86% | 0.858 | S | S | * | * | 0 | 167.6 | 0 | -64.1 | 80.6 | 95.3 | 0 | 0 | 110 | |||||
| 2 | R | 45.9 | Very low | 38.7 | Very low | 240 Ų | 240 | 159.2 Ų | 159.2 | 91% | 0.906 | 85% | 0.851 | S | S | * | * | trans | -85.3 | 175.6 | 161.9 | -96.4 | -172.4 | -177.6 | -169.9 | 3 | 109.7 | ||||
| 3 | P | 53.4 | Low | 39.4 | Very low | 120 Ų | 120 | 156.7 Ų | 156.7 | 78% | 0.779 | 85% | 0.849 | S | S | * | * | cis | -127.2 | 174.2 | 10.1 | 41.1 | -26 | 0 | 0 | 0 | 116 | ||||
| 4 | T | 42.8 | Very low | 39.2 | Very low | 137 Ų | 137 | 153.9 Ų | 153.9 | 84% | 0.84 | 84% | 0.84 | S | S | * | * | trans | -105.5 | 154.2 | 168 | 46.3 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 5 | K | 41.8 | Very low | 39.3 | Very low | 197 Ų | 197 | 156.8 Ų | 156.8 | 86% | 0.857 | 84% | 0.841 | S | S | * | * | trans | -144.4 | 140 | 164.7 | -104.5 | -175.2 | 176.4 | -178.6 | 0 | 109.2 | ||||
| 6 | G | 34.6 | Very low | 38.7 | Very low | 74 Ų | 74 | 151.8 Ų | 151.8 | 76% | 0.763 | 84% | 0.838 | S | S | * | * | trans | -157.7 | 139.9 | 173.1 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 7 | Y | 32.9 | Very low | 38.5 | Very low | 219 Ų | 219 | 155.4 Ų | 155.4 | 86% | 0.859 | 84% | 0.838 | S | S | * | * | trans | -103.6 | 149.7 | 178.1 | -71.7 | -83.2 | 0 | 0 | 0 | 110.4 | ||||
| 8 | T | 34.3 | Very low | 38.2 | Very low | 150 Ų | 150 | 154.9 Ų | 154.9 | 92% | 0.92 | 84% | 0.841 | S | S | * | * | trans | -132.4 | 155.8 | 172.4 | 49.7 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 9 | S | 35.3 | Very low | 37.9 | Very low | 102 Ų | 102 | 152.4 Ų | 152.4 | 71% | 0.713 | 84% | 0.836 | S | S | * | * | trans | -110.5 | 143.1 | -168.1 | 168.4 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 10 | T | 34.8 | Very low | 37.9 | Very low | 129 Ų | 129 | 151.3 Ų | 151.3 | 79% | 0.791 | 84% | 0.835 | S | S | * | * | trans | -141.9 | 129.3 | 149.4 | 41 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 11 | K | 36.5 | Very low | 37.6 | Very low | 193 Ų | 193 | 153.6 Ų | 153.6 | 84% | 0.839 | 84% | 0.836 | S | S | * | * | 81 | 114.9 | 52.6 | -73.8 | -171.6 | 174 | -176.6 | 0 | 113.8 | |||||
| 12 | S | 40.3 | Very low | 37.6 | Very low | 111 Ų | 111 | 146.7 Ų | 146.7 | 78% | 0.776 | 81% | 0.811 | S | S | * | * | trans | -106.7 | 156.9 | 170.6 | 48.4 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 13 | P | 47.8 | Very low | 37.9 | Very low | 127 Ų | 127 | 141.3 Ų | 141.3 | 83% | 0.825 | 81% | 0.807 | S | S | * | * | trans | -119.5 | 173.7 | 165.7 | 39 | -28 | 0 | 0 | 0 | 113.4 | ||||
| 14 | T | 36.8 | Very low | 36.9 | Very low | 118 Ų | 118 | 141.7 Ų | 141.7 | 72% | 0.724 | 80% | 0.803 | S | S | * | * | trans | -146.4 | 144.7 | -159.1 | -62.2 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 15 | K | 40.1 | Very low | 36.6 | Very low | 197 Ų | 197 | 146 Ų | 146 | 86% | 0.857 | 80% | 0.804 | S | S | * | * | trans | 69.9 | 142.8 | 162.4 | -83.6 | 170.7 | -179.4 | 179.4 | 0 | 120.4 | ||||
| 16 | G | 29.3 | Very low | 36.1 | Very low | 76 Ų | 76 | 148.4 Ų | 148.4 | 78% | 0.784 | 81% | 0.807 | S | S | * | * | trans | -174.8 | 131.3 | 160.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 17 | Y | 35.9 | Very low | 36 | Very low | 214 Ų | 214 | 149 Ų | 149 | 84% | 0.839 | 80% | 0.8 | S | S | * | * | trans | -127.1 | 145.1 | -175.9 | -94.2 | -91.2 | 0 | 0 | 0 | 111.1 | ||||
| 18 | T | 33.6 | Very low | 36 | Very low | 147 Ų | 147 | 145.1 Ų | 145.1 | 90% | 0.902 | 80% | 0.799 | S | S | * | * | trans | -149.6 | 167.6 | 151.1 | 42.2 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 19 | S | 32.5 | Very low | 35.8 | Very low | 106 Ų | 106 | 145.2 Ų | 145.2 | 74% | 0.741 | 79% | 0.794 | S | S | * | * | trans | -150.3 | 172.7 | -166.3 | -172.8 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 20 | T | 38.6 | Very low | 35.7 | Very low | 131 Ų | 131 | 145.7 Ų | 145.7 | 80% | 0.804 | 80% | 0.797 | S | S | * | * | trans | 72.8 | 146.2 | -178.5 | 77.2 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 21 | K | 30.9 | Very low | 36.4 | Very low | 200 Ų | 200 | 145.1 Ų | 145.1 | 87% | 0.87 | 80% | 0.796 | S | S | * | * | cis | -161.6 | 156.3 | 39.4 | -178.1 | 177.8 | -179 | 179.7 | 0 | 111.9 | ||||
| 22 | S | 31.8 | Very low | 36.1 | Very low | 93 Ų | 93 | 141.9 Ų | 141.9 | 65% | 0.65 | 80% | 0.798 | S | S | * | * | trans | -111.2 | 161.4 | 173.4 | -169.8 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 23 | P | 52.2 | Low | 36 | Very low | 126 Ų | 126 | 143.2 Ų | 143.2 | 82% | 0.818 | 80% | 0.801 | S | S | * | * | -148.7 | -175.3 | 110.6 | 40 | -22.7 | 0 | 0 | 0 | 116.5 | |||||
| 24 | D | 33.2 | Very low | 35.8 | Very low | 129 Ų | 129 | 143.2 Ų | 143.2 | 69% | 0.69 | 80% | 0.802 | S | S | * | * | trans | -83 | 151.9 | -156.9 | -85.3 | -90.3 | 0 | 0 | 0 | 121.4 | ||||
| 25 | R | 35.8 | Very low | 35.7 | Very low | 228 Ų | 228 | 149.3 Ų | 149.3 | 86% | 0.86 | 81% | 0.811 | S | S | * | * | trans | 22 | 136.5 | 134.4 | -55 | 170.5 | -177.9 | -109.6 | -0.6 | 121 | ||||
| 26 | R | 30.6 | Very low | 35.5 | Very low | 246 Ų | 246 | 145.2 Ų | 145.2 | 93% | 0.928 | 81% | 0.807 | S | S | * | * | -145 | 157.6 | 126.9 | -143 | 172 | -161.4 | -101.3 | 0.4 | 111.9 | |||||
| 27 | S | 32 | Very low | 35.7 | Very low | 88 Ų | 88 | 153.4 Ų | 153.4 | 62% | 0.615 | 82% | 0.815 | S | S | * | * | trans | -122.1 | 150.8 | -173.6 | 171.3 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 28 | T | 33.2 | Very low | 35.8 | Very low | 137 Ų | 137 | 154.1 Ų | 154.1 | 84% | 0.84 | 82% | 0.816 | S | S | * | * | trans | -147 | 145.1 | 155.5 | 43.5 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 29 | N | 31.4 | Very low | 36.3 | Very low | 151 Ų | 151 | 152.6 Ų | 152.6 | 81% | 0.807 | 81% | 0.809 | S | S | * | * | trans | -97.1 | 169.6 | -172.6 | -63.9 | -27.7 | 0 | 0 | 0 | 114 | ||||
| 30 | S | 33 | Very low | 36.9 | Very low | 112 Ų | 112 | 153.6 Ų | 153.6 | 78% | 0.783 | 81% | 0.812 | S | S | * | * | trans | -66.3 | -169.1 | 175.1 | -28.9 | 0 | 0 | 0 | 0 | 114 | ||||
| 31 | P | 49.8 | Very low | 36.7 | Very low | 117 Ų | 117 | 152 Ų | 152 | 76% | 0.76 | 81% | 0.813 | S | S | * | * | cis | -133.5 | 179.8 | -13.9 | 39.9 | -23.2 | 0 | 0 | 0 | 114.5 | ||||
| 32 | S | 30.1 | Very low | 37.3 | Very low | 126 Ų | 126 | 146.9 Ų | 146.9 | 88% | 0.881 | 81% | 0.808 | S | S | * | * | trans | -165.3 | 158.9 | 155.2 | -87.3 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 33 | T | 38.6 | Very low | 37.9 | Very low | 138 Ų | 138 | 147.8 Ų | 147.8 | 85% | 0.847 | 81% | 0.811 | S | S | * | * | trans | -100.4 | 165.9 | -165 | 40 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 34 | P | 43.5 | Very low | 37.1 | Very low | 128 Ų | 128 | 147.1 Ų | 147.1 | 83% | 0.831 | 81% | 0.81 | S | S | * | * | trans | -87.9 | 157 | -162.1 | 34.5 | -36.7 | 0 | 0 | 0 | 114.9 | ||||
| 35 | R | 33.6 | Very low | 37.5 | Very low | 245 Ų | 245 | 148.5 Ų | 148.5 | 93% | 0.925 | 82% | 0.817 | S | S | * | * | trans | -127.9 | 117.7 | 170.1 | -161.4 | 174.1 | -170.2 | -175.2 | 4 | 112.8 | ||||
| 36 | S | 35.1 | Very low | 37.5 | Very low | 111 Ų | 111 | 147.9 Ų | 147.9 | 78% | 0.776 | 82% | 0.815 | S | S | * | * | trans | -41 | 134.4 | 178.2 | 177 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 37 | R | 34 | Very low | 37.5 | Very low | 249 Ų | 249 | 141.2 Ų | 141.2 | 94% | 0.94 | 80% | 0.798 | S | S | * | * | trans | -137.5 | 127.2 | 150.1 | -94.4 | -173.5 | -175.4 | -145.5 | -1 | 112.4 | ||||
| 38 | R | 38.2 | Very low | 37.7 | Very low | 228 Ų | 228 | 146 Ų | 146 | 86% | 0.86 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 145.4 | 177.6 | -176.4 | -173.1 | -166.7 | 175.2 | 4.5 | 110.8 | ||
| 39 | P | 43.8 | Very low | 37.6 | Very low | 116 Ų | 116 | 142.7 Ų | 142.7 | 75% | 0.753 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -75 | 139.4 | 173.8 | 31 | -34.4 | 0 | 0 | 0 | 111.5 | ||
| 40 | P | 45.1 | Very low | 37.9 | Very low | 126 Ų | 126 | 142.9 Ų | 142.9 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -90.5 | 142.6 | 167.3 | 34.3 | -30.8 | 0 | 0 | 0 | 111.7 | ||
| 41 | A | 34.7 | Very low | 37.7 | Very low | 98 Ų | 98 | 142.4 Ų | 142.4 | 81% | 0.81 | 81% | 0.806 | S | S | * | * | trans | -88.6 | 175.5 | 167.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 42 | A | 43.4 | Very low | 37.2 | Very low | 93 Ų | 93 | 141.4 Ų | 141.4 | 77% | 0.769 | 80% | 0.802 | S | S | * | * | trans | -73.6 | 143.3 | -171.3 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 43 | P | 45.2 | Very low | 37.6 | Very low | 112 Ų | 112 | 142.6 Ų | 142.6 | 73% | 0.727 | 80% | 0.804 | S | S | * | * | trans | -81.4 | 133.6 | 149.8 | 33.7 | -29.1 | 0 | 0 | 0 | 109.1 | ||||
| 44 | S | 34.9 | Very low | 37.6 | Very low | 112 Ų | 112 | 141.3 Ų | 141.3 | 78% | 0.783 | 80% | 0.8 | S | S | * | * | 69.8 | 114.7 | 53.5 | 82.2 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 45 | N | 40.9 | Very low | 37.4 | Very low | 157 Ų | 157 | 141.3 Ų | 141.3 | 84% | 0.84 | 80% | 0.803 | S | S | * | * | trans | -81.6 | 172.5 | -178.1 | -162.3 | -9.4 | 0 | 0 | 0 | 111.8 | ||||
| 46 | R | 35.5 | Very low | 37.3 | Very low | 215 Ų | 215 | 133.3 Ų | 133.3 | 81% | 0.811 | 80% | 0.797 | S | S | * | * | trans | 84.2 | 144.1 | -178.8 | -62.9 | -176 | 176.3 | 167.1 | 0.7 | 115.8 | ||||
| 47 | D | 32.3 | Very low | 37.6 | Very low | 107 Ų | 107 | 133.7 Ų | 133.7 | 57% | 0.572 | 80% | 0.8 | S | S | * | * | cis | -159.9 | 172.2 | -6.1 | -101.5 | -27.4 | 0 | 0 | 0 | 110.7 | ||||
| 48 | H | 34.6 | Very low | 37.9 | Very low | 188 Ų | 188 | 129.2 Ų | 129.2 | 87% | 0.87 | 80% | 0.795 | S | S | * | * | trans | 77.1 | 148.5 | 166.9 | -36 | 96.1 | 0 | 0 | 0 | 118 | ||||
| 49 | G | 32.2 | Very low | 38.2 | Very low | 67 Ų | 67 | 123.6 Ų | 123.6 | 69% | 0.691 | 79% | 0.79 | S | S | * | * | cis | 165.5 | 162.1 | -9.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 50 | N | 36.9 | Very low | 37.8 | Very low | 156 Ų | 156 | 122.1 Ų | 122.1 | 83% | 0.834 | 80% | 0.796 | S | S | * | * | trans | 67 | 109.1 | 164.9 | -67.3 | -5.9 | 0 | 0 | 0 | 122.1 | ||||
| 51 | A | 29.4 | Very low | 37.9 | Very low | 101 Ų | 101 | 121.9 Ų | 121.9 | 84% | 0.835 | 80% | 0.797 | S | S | * | * | -156.3 | 104.7 | 108 | 0 | 0 | 0 | 0 | 0 | 108.1 | |||||
| 52 | S | 39.7 | Very low | 38 | Very low | 96 Ų | 96 | 122.3 Ų | 122.3 | 67% | 0.671 | 79% | 0.794 | S | S | * | * | 87 | 102 | 58.2 | -65.5 | 0 | 0 | 0 | 0 | 114.5 | |||||
| 53 | V | 39 | Very low | 37.9 | Very low | 152 Ų | 152 | 127.6 Ų | 127.6 | 92% | 0.921 | 80% | 0.799 | S | S | * | * | trans | -152.4 | 142.2 | 141.8 | -95.9 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 54 | S | 36.7 | Very low | 37.4 | Very low | 110 Ų | 110 | 126.2 Ų | 126.2 | 77% | 0.769 | 81% | 0.805 | S | S | * | * | trans | -52.8 | 143.2 | -179.1 | -51.7 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 55 | S | 39.7 | Very low | 37.8 | Very low | 128 Ų | 128 | 126.3 Ų | 126.3 | 90% | 0.895 | 81% | 0.806 | S | S | * | * | 72.5 | 123.5 | 53.9 | -50.1 | 0 | 0 | 0 | 0 | 115 | |||||
| 56 | G | 31.6 | Very low | 38 | Very low | 77 Ų | 77 | 126.3 Ų | 126.3 | 79% | 0.794 | 81% | 0.806 | S | S | * | * | trans | 168 | 124.6 | 172 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 57 | S | 42 | Very low | 38.1 | Very low | 119 Ų | 119 | 121.9 Ų | 121.9 | 83% | 0.832 | 81% | 0.807 | S | S | * | * | trans | -134.4 | 141.5 | -179.3 | -57.1 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 58 | N | 40.8 | Very low | 38.8 | Very low | 156 Ų | 156 | 122 Ų | 122 | 83% | 0.834 | 82% | 0.815 | S | S | * | * | trans | -173.5 | 121 | 159.3 | -98.9 | -16.5 | 0 | 0 | 0 | 106.9 | ||||
| 59 | S | 42.9 | Very low | 39.5 | Very low | 109 Ų | 109 | 119.2 Ų | 119.2 | 76% | 0.762 | 81% | 0.814 | S | S | * | * | 96 | 122.7 | 60.8 | 74.2 | 0 | 0 | 0 | 0 | 111.7 | |||||
| 60 | G | 35.4 | Very low | 40 | Very low | 86 Ų | 86 | 122.6 Ų | 122.6 | 89% | 0.887 | 82% | 0.822 | S | S | * | * | trans | 153.6 | 128 | 170.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 61 | S | 48.2 | Very low | 40.6 | Very low | 120 Ų | 120 | 125.5 Ų | 125.5 | 84% | 0.839 | 83% | 0.827 | S | S | * | * | trans | -143.8 | 134.9 | 178.1 | 170 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 62 | C | 37.4 | Very low | 41.2 | Very low | 108 Ų | 108 | 124 Ų | 124 | 73% | 0.73 | 82% | 0.821 | S | S | * | * | trans | -174 | 131.7 | 142.4 | 53.5 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 63 | K | 41.1 | Very low | 41.6 | Very low | 204 Ų | 204 | 129 Ų | 129 | 89% | 0.887 | 83% | 0.825 | S | S | * | * | trans | 61.3 | 119.6 | 134.8 | -61 | 169.2 | 72.2 | 177.4 | 0 | 121.6 | ||||
| 64 | G | 33.7 | Very low | 42.2 | Very low | 82 Ų | 82 | 130.9 Ų | 130.9 | 85% | 0.845 | 82% | 0.824 | S | S | * | * | trans | 97.6 | 145.1 | 147.7 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 65 | S | 44.6 | Very low | 42.6 | Very low | 115 Ų | 115 | 133 Ų | 133 | 80% | 0.804 | 82% | 0.82 | S | S | * | * | cis | -154.4 | 141.7 | -6.6 | -171.8 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 66 | D | 44.4 | Very low | 43.2 | Very low | 156 Ų | 156 | 138.7 Ų | 138.7 | 83% | 0.834 | 82% | 0.823 | S | S | * | * | trans | -69.1 | 140.6 | 161.5 | -58 | -79.5 | 0 | 0 | 0 | 110.4 | ||||
| 67 | C | 37.8 | Very low | 44.2 | Very low | 123 Ų | 123 | 140.9 Ų | 140.9 | 83% | 0.831 | 82% | 0.821 | S | S | * | * | trans | -171 | 106.5 | 153.5 | -120.9 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 68 | S | 46 | Very low | 44.2 | Very low | 108 Ų | 108 | 139.5 Ų | 139.5 | 76% | 0.755 | 81% | 0.812 | S | S | * | * | trans | 23 | 142.8 | 149 | -56.1 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 69 | P | 50.4 | Low | 44.6 | Very low | 130 Ų | 130 | 138.4 Ų | 138.4 | 84% | 0.844 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -81.2 | 122.6 | 179.9 | 32.8 | -34.6 | 0 | 0 | 0 | 114 | ||
| 70 | T | 41.9 | Very low | 45.1 | Very low | 139 Ų | 139 | 138.4 Ų | 138.4 | 85% | 0.853 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -86.9 | 119 | 171.8 | 47.2 | 0 | 0 | 0 | 0 | 112.3 | G72 | T70-G72 PolarHBondContact O-N 3.28Š|
| 71 | K | 50.5 | Low | 45.6 | Very low | 217 Ų | 217 | 139.7 Ų | 139.7 | 94% | 0.943 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -62 | 122.3 | 172.3 | -66.2 | 177 | 179.2 | 177.2 | 0 | 110.2 | ||
| 72 | G | 42.2 | Very low | 45.7 | Very low | 69 Ų | 69 | 141.1 Ų | 141.1 | 71% | 0.711 | 80% | 0.795 | S | S | * | * | trans | -146.3 | 90.5 | -171 | 0 | 0 | 0 | 0 | 0 | 115.5 | T70 | T70-G72 PolarHBondContact O-N 3.28Š| ||
| 73 | R | 48.3 | Very low | 46.4 | Very low | 200 Ų | 200 | 143.1 Ų | 143.1 | 76% | 0.755 | 79% | 0.793 | S | S | * | * | trans | 62.7 | 105.2 | 150.3 | -159.8 | -170 | -160.1 | -58.2 | 0.6 | 118.2 | ||||
| 74 | Q | 51.8 | Low | 46.8 | Very low | 192 Ų | 192 | 137 Ų | 137 | 90% | 0.897 | 79% | 0.789 | S | S | * | * | trans | -53.1 | 139.9 | 157.3 | -72.1 | 172.8 | -40.9 | 0 | 0 | 111.3 | ||||
| 75 | K | 44.4 | Very low | 47.7 | Very low | 156 Ų | 156 | 140.3 Ų | 140.3 | 68% | 0.678 | 79% | 0.785 | S | S | * | * | trans | -149 | 115.8 | 169.8 | -140.9 | 169.9 | -175.8 | -174.8 | 0 | 107.3 | T77 | K75-T77 PolarHBondContact O-N 3.05Š| ||
| 76 | Y | 50.9 | Low | 48.4 | Very low | 247 Ų | 247 | 144.9 Ų | 144.9 | 97% | 0.969 | 79% | 0.785 | S | S | * | * | trans | -63.7 | 101.9 | 169.4 | -101.8 | -104.3 | 0 | 0 | 0 | 107.8 | ||||
| 77 | T | 53.6 | Low | 49.1 | Very low | 122 Ų | 122 | 142.3 Ų | 142.3 | 75% | 0.748 | 78% | 0.776 | S | S | * | * | trans | -89.8 | 127.2 | 160.8 | 46.9 | 0 | 0 | 0 | 0 | 107.4 | K75 | K75-T77 PolarHBondContact O-N 3.05Š| ||
| 78 | S | 41.8 | Very low | 50 | Low | 91 Ų | 91 | 140.4 Ų | 140.4 | 64% | 0.636 | 76% | 0.763 | S | S | * | * | trans | -55.4 | 157.5 | -173.7 | 48.1 | 0 | 0 | 0 | 0 | 114.1 | T80 | S78-T80 PolarHBondContact O-N 3.46Š| ||
| 79 | C | 49.3 | Very low | 50.5 | Low | 133 Ų | 133 | 138.8 Ų | 138.8 | 90% | 0.899 | 75% | 0.75 | S | S | * | * | trans | -63.8 | 77.1 | 168.6 | -50.8 | 0 | 0 | 0 | 0 | 111.7 | D81 | C79-D81 VanDerWaalsContact C-N 3.33Š| ||
| 80 | T | 52.8 | Low | 50.9 | Low | 108 Ų | 108 | 139 Ų | 139 | 66% | 0.663 | 75% | 0.751 | S | S | * | * | trans | -103.9 | 56.8 | 161.2 | 58 | 0 | 0 | 0 | 0 | 108 | S78 N82 | S78-T80 PolarHBondContact O-N 3.46Å; T80-N82 PolarHBondContact O-N 3.08Å | ||
| 81 | D | 46.5 | Very low | 51.6 | Low | 114 Ų | 114 | 140.6 Ų | 140.6 | 61% | 0.61 | 75% | 0.749 | S | S | * | * | trans | -78.3 | 63.4 | -171 | -165.9 | 15.9 | 0 | 0 | 0 | 112.6 | C79 H83 | C79-D81 VanDerWaalsContact C-N 3.33Å; D81-H83 VanDerWaalsContact C-N 3.27Å; D81-H83 PolarHBondContact O-N 3.48Å; D81-H83 IonicContact OD1-CE1 2.72Å; D81-H83 PolarHBondContact OD1-CE1 3.4Å; D81-H83 IonicContact OD1-CG 2.74Å; D81-H83 IonicContact OD1-ND1 3.15Å; D81-H83 PolarHBondContact OD1-ND1 2.98Å | ||
| 82 | N | 51 | Low | 51.9 | Low | 150 Ų | 150 | 137.1 Ų | 137.1 | 80% | 0.802 | 74% | 0.736 | S | S | * | * | trans | -87.9 | 75.6 | 162 | -69.5 | -86.1 | 0 | 0 | 0 | 107.2 | T80 G84 | T80-N82 PolarHBondContact O-N 3.08Å; N82-G84 VanDerWaalsContact C-N 3.29Å; N82-G84 PolarHBondContact O-N 3.35Å | ||
| 83 | H | 50.8 | Low | 52.8 | Low | 149 Ų | 149 | 144.1 Ų | 144.1 | 69% | 0.69 | 74% | 0.743 | S | S | * | * | trans | -55.2 | 93.5 | 168.3 | -96.1 | 23.6 | 0 | 0 | 0 | 109.9 | D81 I85 | D81-H83 VanDerWaalsContact C-N 3.27Å; D81-H83 PolarHBondContact O-N 3.48Å; D81-H83 IonicContact OD1-CE1 2.72Å; D81-H83 PolarHBondContact OD1-CE1 3.4Å; D81-H83 IonicContact OD1-CG 2.74Å; D81-H83 IonicContact OD1-ND1 3.15Å; D81-H83 PolarHBondContact OD1-ND1 2.98Å; H83-I85 PolarHBondContact O-N 3.23Å | ||
| 84 | G | 49.7 | Very low | 53.9 | Low | 77 Ų | 77 | 138.6 Ų | 138.6 | 79% | 0.794 | 73% | 0.728 | S | S | * | * | 63 | -7.1 | 110.2 | 0 | 0 | 0 | 0 | 0 | 119.5 | N82 R86 | N82-G84 VanDerWaalsContact C-N 3.29Å; N82-G84 PolarHBondContact O-N 3.35Å; G84-R86 PolarHBondContact O-N 3.41Å | |||
| 85 | I | 53.5 | Low | 55.6 | Low | 150 Ų | 150 | 133 Ų | 133 | 77% | 0.769 | 71% | 0.707 | S | S | * | * | trans | -77 | 71.7 | 177.3 | -52.9 | 172.4 | 0 | 0 | 0 | 108.4 | H83 P87 | H83-I85 PolarHBondContact O-N 3.23Å; I85-P87 WeakPolarHBondContact O-CD 3.47Å | ||
| 86 | R | 58.1 | Low | 57.6 | Low | 211 Ų | 211 | 130.3 Ų | 130.3 | 80% | 0.796 | 71% | 0.705 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 121 | 150.6 | 177.4 | -175.1 | 179.6 | -166.4 | 0.7 | 105.9 | G84 | G84-R86 PolarHBondContact O-N 3.41Š|
| 87 | P | 59.3 | Low | 59.4 | Low | 102 Ų | 102 | 125 Ų | 125 | 66% | 0.662 | 69% | 0.693 | S | S | * | * | P | Polyproline II helix | trans | -53.6 | 132.7 | 174.9 | -26.1 | 35.1 | 0 | 0 | 0 | 109.3 | I85 | I85-P87 WeakPolarHBondContact O-CD 3.47Š|
| 88 | P | 57.3 | Low | 61.2 | Low | 83 Ų | 83 | 123.9 Ų | 123.9 | 54% | 0.539 | 68% | 0.679 | S | S | . | * | P | Polyproline II helix | trans | -55.8 | 142 | 175.9 | 22.4 | -31.7 | 0 | 0 | 0 | 109.2 | Q92 | P88-Q92 VanDerWaalsContact CB-OE1 3.23Š|
| 89 | P | 56.5 | Low | 63.5 | Low | 75 Ų | 75 | 125.5 Ų | 125.5 | 49% | 0.487 | 68% | 0.676 | S | S | . | * | P | Polyproline II helix | trans | -57.5 | 141.9 | -178.9 | 24.5 | -33.3 | 0 | 0 | 0 | 110.1 | E91 Q92 | P89-E91 PolarHBondContact O-N 3.29Å; P89-Q92 PolarHBondContact O-N 2.85Å |
| 90 | P | 58.4 | Low | 65.6 | Low | 135 Ų | 135 | 125.8 Ų | 125.8 | 88% | 0.877 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.6 | 9 | -160.7 | 28.1 | -37.3 | 0 | 0 | 0 | 115.9 | ||
| 91 | E | 56.1 | Low | 67.6 | Low | 172 Ų | 172 | 123.8 Ų | 123.8 | 80% | 0.804 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.1 | 1 | -179.7 | -59 | -173.7 | 145.7 | 0 | 0 | 113 | P89 Y93 | P89-E91 PolarHBondContact O-N 3.29Å; E91-Y93 PolarHBondContact O-N 2.89Å; E91-Y93 VanDerWaalsContact O-N 3.09Å |
| 92 | Q | 57.8 | Low | 69.9 | Low | 144 Ų | 144 | 121.8 Ų | 121.8 | 67% | 0.673 | 64% | 0.637 | S | S | * | * | S | Bend | trans | -70.2 | 107.6 | 168.3 | -74.1 | -165.4 | -43.2 | 0 | 0 | 110.1 | P88 P89 | P88-Q92 VanDerWaalsContact CB-OE1 3.23Å; P89-Q92 PolarHBondContact O-N 2.85Å |
| 93 | Y | 60.3 | Low | 72 | Confident | 216 Ų | 216 | 117.8 Ų | 117.8 | 85% | 0.847 | 62% | 0.62 | S | S | * | * | trans | -40.6 | 138.1 | 174.2 | -60.1 | -90.3 | 0 | 0 | 0 | 112.7 | E91 | E91-Y93 PolarHBondContact O-N 2.89Å; E91-Y93 VanDerWaalsContact O-N 3.09Å | ||
| 94 | L | 72.8 | Confident | 74.2 | Confident | 84 Ų | 84 | 114 Ų | 114 | 44% | 0.44 | 61% | 0.605 | S | S | . | * | S | Bend | trans | 3.6 | 116.4 | 162.6 | -65.6 | 161.5 | 0 | 0 | 0 | 114.3 | Q98 Q99 V102 | L94-Q98 HydrophobicContact CB-CB 3.87Å; L94-Q98 HydrophobicContact CD2-CB 3.86Å; L94-Q98 HydrophobicContact CG-CB 4.47Å; L94-Q99 HydrophobicContact CB-CB 4.34Å; L94-V102 HydrophobicContact CD1-CB 4.46Å; L94-V102 HydrophobicContact CD1-CG2 3.94Å |
| 95 | T | 85.6 | Confident | 76.5 | Confident | 75 Ų | 75 | 117.6 Ų | 117.6 | 46% | 0.46 | 59% | 0.594 | S | S | . | * | trans | -49.3 | 153.8 | -179.8 | 71.6 | 0 | 0 | 0 | 0 | 111.4 | L97 Q98 Q99 | T95-L97 CarbonylContact O-C 3.54Å; T95-L97 PolarHBondContact O-N 3.38Å; T95-Q98 CarbonylContact O-C 3.58Å; T95-Q98 WeakPolarHBondContact O-CA 3.25Å; T95-Q98 WeakPolarHBondContact O-CB 3.44Å; T95-Q98 PolarHBondContact O-N 3.08Å; T95-Q98 WeakPolarHBondContact OG1-CG 3.36Å; T95-Q98 PolarHBondContact OG1-N 3.5Å; T95-Q99 PolarHBondContact O-N 3.34Å | ||
| 96 | P | 86.9 | Confident | 78.6 | Confident | 98 Ų | 98 | 115.3 Ų | 115.3 | 64% | 0.636 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -54.3 | -21.1 | -176.3 | -30 | 36.7 | 0 | 0 | 0 | 115.3 | K100 | P96-K100 WeakPolarHBondContact O-CD 3.47Å; P96-K100 VanDerWaalsContact O-CG 3.22Å; P96-K100 WeakPolarHBondContact O-CG 3.42Å; P96-K100 PolarHBondContact O-N 3.27Å |
| 97 | L | 89.5 | Confident | 80.5 | Confident | 136 Ų | 136 | 110.3 Ų | 110.3 | 71% | 0.712 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -76.9 | -48.4 | 168.6 | -175.6 | 63.7 | 0 | 0 | 0 | 112.6 | T95 Q99 K100 E101 | T95-L97 CarbonylContact O-C 3.54Å; T95-L97 PolarHBondContact O-N 3.38Å; L97-Q99 VanDerWaalsContact C-N 3.35Å; L97-Q99 PolarHBondContact O-N 3.01Å; L97-K100 WeakPolarHBondContact O-CB 3.46Å; L97-K100 PolarHBondContact O-N 3.49Å; L97-E101 PolarHBondContact O-N 2.89Å |
| 98 | Q | 91.4 | Very high | 82.4 | Confident | 98 Ų | 98 | 113.2 Ų | 113.2 | 46% | 0.458 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -61.9 | -38.4 | 175 | -68.4 | 172.3 | -27.4 | 0 | 0 | 112.5 | L94 T95 E101 V102 | L94-Q98 HydrophobicContact CB-CB 3.87Å; L94-Q98 HydrophobicContact CD2-CB 3.86Å; L94-Q98 HydrophobicContact CG-CB 4.47Å; T95-Q98 CarbonylContact O-C 3.58Å; T95-Q98 WeakPolarHBondContact O-CA 3.25Å; T95-Q98 WeakPolarHBondContact O-CB 3.44Å; T95-Q98 PolarHBondContact O-N 3.08Å; T95-Q98 WeakPolarHBondContact OG1-CG 3.36Å; T95-Q98 PolarHBondContact OG1-N 3.5Å; Q98-E101 PolarHBondContact O-N 3.11Å; Q98-V102 WeakPolarHBondContact O-CG2 3.47Å; Q98-V102 PolarHBondContact O-N 3.26Å |
| 99 | Q | 90.8 | Very high | 84.3 | Confident | 125 Ų | 125 | 112.1 Ų | 112.1 | 58% | 0.584 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -65.3 | -41 | 175.9 | -168.1 | -175.4 | 19.5 | 0 | 0 | 111.3 | L94 T95 L97 C103 | L94-Q99 HydrophobicContact CB-CB 4.34Å; T95-Q99 PolarHBondContact O-N 3.34Å; L97-Q99 VanDerWaalsContact C-N 3.35Å; L97-Q99 PolarHBondContact O-N 3.01Å; Q99-C103 WeakPolarHBondContact O-CB 3.44Å; Q99-C103 PolarHBondContact O-N 3.04Å |
| 100 | K | 92.1 | Very high | 86.3 | Confident | 140 Ų | 140 | 113.6 Ų | 113.6 | 61% | 0.609 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -61.3 | -45.5 | 171.4 | -78.1 | 172.6 | -179.4 | -178.3 | 0 | 111.4 | P96 L97 V102 C103 I104 | P96-K100 WeakPolarHBondContact O-CD 3.47Å; P96-K100 VanDerWaalsContact O-CG 3.22Å; P96-K100 WeakPolarHBondContact O-CG 3.42Å; P96-K100 PolarHBondContact O-N 3.27Å; L97-K100 WeakPolarHBondContact O-CB 3.46Å; L97-K100 PolarHBondContact O-N 3.49Å; K100-V102 PolarHBondContact O-N 2.8Å; K100-C103 WeakPolarHBondContact O-CB 3.34Å; K100-C103 PolarHBondContact O-N 2.76Å; K100-I104 WeakPolarHBondContact O-CB 3.41Å; K100-I104 VanDerWaalsContact O-CG1 3.25Å; K100-I104 WeakPolarHBondContact O-CG1 3.36Å; K100-I104 PolarHBondContact O-N 3.38Å |
| 101 | E | 95.8 | Very high | 88.2 | Confident | 65 Ų | 65 | 112.1 Ų | 112.1 | 30% | 0.304 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -62.4 | -42.6 | 178.6 | 174.4 | 58.4 | -171 | 0 | 0 | 112.5 | L97 Q98 C103 I104 R105 | L97-E101 PolarHBondContact O-N 2.89Å; Q98-E101 PolarHBondContact O-N 3.11Å; E101-C103 PolarHBondContact O-N 2.96Å; E101-I104 PolarHBondContact O-N 2.84Å; E101-R105 WeakPolarHBondContact O-CG 3.33Å; E101-R105 PolarHBondContact O-N 2.86Å; E101-R105 IonicContact OE1-CZ 2.63Å; E101-R105 IonicContact OE1-NE 3.64Å; E101-R105 PolarHBondContact OE1-NE 3.21Å; E101-R105 IonicContact OE1-NH2 3.39Å; E101-R105 PolarHBondContact OE1-NH2 3.38Å |
| 102 | V | 95 | Very high | 90.3 | Very high | 72 Ų | 72 | 110.5 Ų | 110.5 | 44% | 0.436 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -64 | -40.1 | 173.4 | 170.6 | 0 | 0 | 0 | 0 | 111.5 | L94 Q98 K100 R105 H106 | L94-V102 HydrophobicContact CD1-CB 4.46Å; L94-V102 HydrophobicContact CD1-CG2 3.94Å; Q98-V102 WeakPolarHBondContact O-CG2 3.47Å; Q98-V102 PolarHBondContact O-N 3.26Å; K100-V102 PolarHBondContact O-N 2.8Å; V102-R105 PolarHBondContact O-N 3.48Å; V102-H106 PolarHBondContact O-N 2.91Å |
| 103 | C | 94.8 | Very high | 92.2 | Very high | 67 Ų | 67 | 109.5 Ų | 109.5 | 45% | 0.453 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.6 | -43.9 | 174.2 | -170.9 | 0 | 0 | 0 | 0 | 112 | Q99 K100 E101 R105 H106 L107 | Q99-C103 WeakPolarHBondContact O-CB 3.44Å; Q99-C103 PolarHBondContact O-N 3.04Å; K100-C103 WeakPolarHBondContact O-CB 3.34Å; K100-C103 PolarHBondContact O-N 2.76Å; E101-C103 PolarHBondContact O-N 2.96Å; C103-R105 PolarHBondContact O-N 3.43Å; C103-H106 PolarHBondContact O-N 3.49Å; C103-L107 WeakPolarHBondContact O-CB 3.27Å; C103-L107 WeakPolarHBondContact O-CG 3.32Å; C103-L107 PolarHBondContact O-N 3.49Å |
| 104 | I | 96.9 | Very high | 94 | Very high | 70 Ų | 70 | 102.5 Ų | 102.5 | 36% | 0.359 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.8 | -42.9 | 176.3 | -71.5 | 162.6 | 0 | 0 | 0 | 110.8 | K100 E101 L107 R108 | K100-I104 WeakPolarHBondContact O-CB 3.41Å; K100-I104 VanDerWaalsContact O-CG1 3.25Å; K100-I104 WeakPolarHBondContact O-CG1 3.36Å; K100-I104 PolarHBondContact O-N 3.38Å; E101-I104 PolarHBondContact O-N 2.84Å; I104-L107 PolarHBondContact O-N 3.02Å; I104-R108 HydrophobicContact CG2-CG 4.45Å; I104-R108 VanDerWaalsContact CG2-CZ 3.48Å; I104-R108 WeakPolarHBondContact O-CB 3.37Å; I104-R108 VanDerWaalsContact O-CG 3.27Å; I104-R108 WeakPolarHBondContact O-CG 3.45Å; I104-R108 PolarHBondContact O-N 3.37Å |
| 105 | R | 97.2 | Very high | 95.2 | Very high | 151 Ų | 151 | 102.1 Ų | 102.1 | 57% | 0.57 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -61.8 | -44 | 174.3 | -71 | 174.5 | -167.1 | -178.3 | 5.7 | 112.1 | E101 V102 C103 R108 A109 | E101-R105 WeakPolarHBondContact O-CG 3.33Å; E101-R105 PolarHBondContact O-N 2.86Å; E101-R105 IonicContact OE1-CZ 2.63Å; E101-R105 IonicContact OE1-NE 3.64Å; E101-R105 PolarHBondContact OE1-NE 3.21Å; E101-R105 IonicContact OE1-NH2 3.39Å; E101-R105 PolarHBondContact OE1-NH2 3.38Å; V102-R105 PolarHBondContact O-N 3.48Å; C103-R105 PolarHBondContact O-N 3.43Å; R105-R108 PolarHBondContact O-N 3.41Å; R105-A109 WeakPolarHBondContact O-CB 3.28Å; R105-A109 PolarHBondContact O-N 3.49Å |
| 106 | H | 97.8 | Very high | 95.8 | Very high | 103 Ų | 103 | 101.9 Ų | 101.9 | 48% | 0.477 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.2 | -42.8 | 176.8 | -176.5 | 62.7 | 0 | 0 | 0 | 112.5 | V102 C103 A109 K110 | V102-H106 PolarHBondContact O-N 2.91Å; C103-H106 PolarHBondContact O-N 3.49Å; H106-A109 PolarHBondContact O-N 3.23Å; H106-K110 WeakPolarHBondContact NE2-CE 3.48Å; H106-K110 PolarHBondContact O-N 2.71Å |
| 107 | L | 98.6 | Very high | 96.4 | Very high | 106 Ų | 106 | 100.6 Ų | 100.6 | 56% | 0.555 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -66.8 | -40.3 | 176.1 | -70.1 | 171.9 | 0 | 0 | 0 | 112 | C103 I104 K110 L111 | C103-L107 WeakPolarHBondContact O-CB 3.27Å; C103-L107 WeakPolarHBondContact O-CG 3.32Å; C103-L107 PolarHBondContact O-N 3.49Å; I104-L107 PolarHBondContact O-N 3.02Å; L107-K110 PolarHBondContact O-N 3.43Å; L107-L111 VanDerWaalsContact O-CB 3.28Å; L107-L111 WeakPolarHBondContact O-CB 3.39Å; L107-L111 PolarHBondContact O-N 2.83Å |
| 108 | R | 98.1 | Very high | 96.8 | Very high | 163 Ų | 163 | 99.2 Ų | 99.2 | 62% | 0.615 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -62.6 | -41.6 | 172.5 | -75.3 | 171.7 | 175.7 | 162.6 | -0.7 | 112 | I104 R105 L111 K112 | I104-R108 HydrophobicContact CG2-CG 4.45Å; I104-R108 VanDerWaalsContact CG2-CZ 3.48Å; I104-R108 WeakPolarHBondContact O-CB 3.37Å; I104-R108 VanDerWaalsContact O-CG 3.27Å; I104-R108 WeakPolarHBondContact O-CG 3.45Å; I104-R108 PolarHBondContact O-N 3.37Å; R105-R108 PolarHBondContact O-N 3.41Å; R108-L111 PolarHBondContact O-N 3.02Å; R108-K112 WeakPolarHBondContact O-CB 3.43Å; R108-K112 PolarHBondContact O-N 2.95Å |
| 109 | A | 98.3 | Very high | 97.2 | Very high | 59 Ų | 59 | 99.8 Ų | 99.8 | 49% | 0.488 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.5 | -48.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | R105 H106 L111 K112 E113 | R105-A109 WeakPolarHBondContact O-CB 3.28Å; R105-A109 PolarHBondContact O-N 3.49Å; H106-A109 PolarHBondContact O-N 3.23Å; A109-L111 PolarHBondContact O-N 3.25Å; A109-K112 PolarHBondContact O-N 2.9Å; A109-E113 WeakPolarHBondContact O-CB 3.45Å; A109-E113 PolarHBondContact O-N 2.85Å |
| 110 | K | 98.4 | Very high | 97.5 | Very high | 106 Ų | 106 | 98.8 Ų | 98.8 | 46% | 0.461 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.9 | -39.8 | 174.7 | -80.7 | -171.7 | 165.4 | -172.6 | 0 | 113.3 | H106 L107 E113 T114 | H106-K110 WeakPolarHBondContact NE2-CE 3.48Å; H106-K110 PolarHBondContact O-N 2.71Å; L107-K110 PolarHBondContact O-N 3.43Å; K110-E113 WeakPolarHBondContact O-CB 3.45Å; K110-E113 PolarHBondContact O-N 2.95Å; K110-T114 WeakPolarHBondContact O-CG2 3.5Å; K110-T114 PolarHBondContact O-N 3.04Å; K110-T114 PolarHBondContact O-OG1 3.29Å |
| 111 | L | 98.7 | Very high | 97.8 | Very high | 104 Ų | 104 | 98.6 Ų | 98.6 | 55% | 0.545 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -62.5 | -46 | 175.6 | -179.2 | 60.2 | 0 | 0 | 0 | 110.5 | L107 R108 A109 E113 T114 I115 | L107-L111 VanDerWaalsContact O-CB 3.28Å; L107-L111 WeakPolarHBondContact O-CB 3.39Å; L107-L111 PolarHBondContact O-N 2.83Å; R108-L111 PolarHBondContact O-N 3.02Å; A109-L111 PolarHBondContact O-N 3.25Å; L111-E113 PolarHBondContact O-N 3.26Å; L111-T114 WeakPolarHBondContact CA-OG1 3.14Å; L111-T114 PolarHBondContact O-N 2.92Å; L111-T114 PolarHBondContact O-OG1 3.45Å; L111-I115 HydrophobicContact CD1-CD1 4.11Å; L111-I115 HydrophobicContact CD1-CG1 4.4Å; L111-I115 HydrophobicContact CG-CD1 3.9Å; L111-I115 VanDerWaalsContact O-CG1 3.3Å; L111-I115 WeakPolarHBondContact O-CG1 3.44Å; L111-I115 PolarHBondContact O-N 3.02Å |
| 112 | K | 98.6 | Very high | 98 | Very high | 139 Ų | 139 | 99.9 Ų | 99.9 | 60% | 0.604 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -61.3 | -42.9 | 174.8 | -173.2 | 174.9 | -178.6 | 178.3 | 0 | 112.2 | R108 A109 I115 N116 | R108-K112 WeakPolarHBondContact O-CB 3.43Å; R108-K112 PolarHBondContact O-N 2.95Å; A109-K112 PolarHBondContact O-N 2.9Å; K112-I115 PolarHBondContact O-N 3.43Å; K112-N116 WeakPolarHBondContact O-CB 3.41Å; K112-N116 VanDerWaalsContact O-CG 3.26Å; K112-N116 PolarHBondContact O-N 2.87Å; K112-N116 PolarHBondContact O-OD1 3.07Å; K112-N116 VanDerWaalsContact O-OD1 3.13Å |
| 113 | E | 98.3 | Very high | 98.2 | Very high | 122 Ų | 122 | 100.7 Ų | 100.7 | 57% | 0.57 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -56.3 | -49.8 | 173.3 | -176.6 | 179.3 | -158.2 | 0 | 0 | 111 | A109 K110 L111 I115 N116 T117 | A109-E113 WeakPolarHBondContact O-CB 3.45Å; A109-E113 PolarHBondContact O-N 2.85Å; K110-E113 WeakPolarHBondContact O-CB 3.45Å; K110-E113 PolarHBondContact O-N 2.95Å; L111-E113 PolarHBondContact O-N 3.26Å; E113-I115 PolarHBondContact O-N 3.47Å; E113-N116 PolarHBondContact O-N 3.19Å; E113-T117 WeakPolarHBondContact O-CG2 3.07Å; E113-T117 PolarHBondContact O-N 3.06Å; E113-T117 PolarHBondContact O-OG1 3.09Å |
| 114 | T | 98.3 | Very high | 98.3 | Very high | 70 Ų | 70 | 101.3 Ų | 101.3 | 43% | 0.429 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63 | -40.6 | 177 | 55 | 0 | 0 | 0 | 0 | 113.1 | K110 L111 T117 L118 | K110-T114 WeakPolarHBondContact O-CG2 3.5Å; K110-T114 PolarHBondContact O-N 3.04Å; K110-T114 PolarHBondContact O-OG1 3.29Å; L111-T114 WeakPolarHBondContact CA-OG1 3.14Å; L111-T114 PolarHBondContact O-N 2.92Å; L111-T114 PolarHBondContact O-OG1 3.45Å; T114-T117 WeakPolarHBondContact CA-OG1 3.22Å; T114-T117 PolarHBondContact O-N 3.34Å; T114-T117 PolarHBondContact O-OG1 3.4Å; T114-L118 WeakPolarHBondContact O-CG 3.4Å; T114-L118 PolarHBondContact O-N 2.94Å |
| 115 | I | 98.6 | Very high | 98.4 | Very high | 75 Ų | 75 | 100.7 Ų | 100.7 | 39% | 0.385 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63 | -47.4 | 176.8 | -70.4 | 165.9 | 0 | 0 | 0 | 110.7 | L111 K112 E113 T117 L118 Q119 | L111-I115 HydrophobicContact CD1-CD1 4.11Å; L111-I115 HydrophobicContact CD1-CG1 4.4Å; L111-I115 HydrophobicContact CG-CD1 3.9Å; L111-I115 VanDerWaalsContact O-CG1 3.3Å; L111-I115 WeakPolarHBondContact O-CG1 3.44Å; L111-I115 PolarHBondContact O-N 3.02Å; K112-I115 PolarHBondContact O-N 3.43Å; E113-I115 PolarHBondContact O-N 3.47Å; I115-T117 PolarHBondContact O-N 3.36Å; I115-L118 PolarHBondContact O-N 3.04Å; I115-Q119 HydrophobicContact CG2-CG 4.48Å; I115-Q119 WeakPolarHBondContact O-CG 3.44Å; I115-Q119 PolarHBondContact O-N 3.02Å |
| 116 | N | 98.4 | Very high | 98.5 | Very high | 70 Ų | 70 | 97.3 Ų | 97.3 | 37% | 0.374 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -56.1 | -50.6 | 175.2 | -72.7 | 15.4 | 0 | 0 | 0 | 110.5 | K112 E113 L118 Q119 D120 | K112-N116 WeakPolarHBondContact O-CB 3.41Å; K112-N116 VanDerWaalsContact O-CG 3.26Å; K112-N116 PolarHBondContact O-N 2.87Å; K112-N116 PolarHBondContact O-OD1 3.07Å; K112-N116 VanDerWaalsContact O-OD1 3.13Å; E113-N116 PolarHBondContact O-N 3.19Å; N116-L118 VanDerWaalsContact C-N 3.26Å; N116-L118 PolarHBondContact O-N 2.88Å; N116-Q119 PolarHBondContact O-N 3.01Å; N116-Q119 VanDerWaalsContact O-N 3.1Å; N116-D120 VanDerWaalsContact O-CG 3.28Å; N116-D120 PolarHBondContact O-N 3.05Å |
| 117 | T | 98.6 | Very high | 98.5 | Very high | 72 Ų | 72 | 95.7 Ų | 95.7 | 44% | 0.442 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.2 | -30.3 | -179.9 | 59.4 | 0 | 0 | 0 | 0 | 113.2 | E113 T114 I115 R121 | E113-T117 WeakPolarHBondContact O-CG2 3.07Å; E113-T117 PolarHBondContact O-N 3.06Å; E113-T117 PolarHBondContact O-OG1 3.09Å; T114-T117 WeakPolarHBondContact CA-OG1 3.22Å; T114-T117 PolarHBondContact O-N 3.34Å; T114-T117 PolarHBondContact O-OG1 3.4Å; I115-T117 PolarHBondContact O-N 3.36Å; T117-R121 VanDerWaalsContact O-CG 3.3Å; T117-R121 WeakPolarHBondContact O-CG 3.33Å; T117-R121 PolarHBondContact O-N 2.83Å |
| 118 | L | 98.6 | Very high | 98.5 | Very high | 106 Ų | 106 | 95 Ų | 95 | 56% | 0.555 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -70.1 | -44.8 | 173 | -73.5 | 172.7 | 0 | 0 | 0 | 111.1 | T114 I115 N116 D120 R121 D122 | T114-L118 WeakPolarHBondContact O-CG 3.4Å; T114-L118 PolarHBondContact O-N 2.94Å; I115-L118 PolarHBondContact O-N 3.04Å; N116-L118 VanDerWaalsContact C-N 3.26Å; N116-L118 PolarHBondContact O-N 2.88Å; L118-D120 PolarHBondContact O-N 3.17Å; L118-R121 CarbonylContact O-C 3.46Å; L118-R121 WeakPolarHBondContact O-CA 3.36Å; L118-R121 PolarHBondContact O-N 3.03Å; L118-R121 VanDerWaalsContact O-N 3.08Å; L118-D122 PolarHBondContact O-N 3.33Å |
| 119 | Q | 98.6 | Very high | 98.5 | Very high | 110 Ų | 110 | 93.5 Ų | 93.5 | 51% | 0.514 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -62 | -40.2 | 176.2 | -70.5 | 175.6 | -29.5 | 0 | 0 | 112.5 | I115 N116 R121 D122 T123 | I115-Q119 HydrophobicContact CG2-CG 4.48Å; I115-Q119 WeakPolarHBondContact O-CG 3.44Å; I115-Q119 PolarHBondContact O-N 3.02Å; N116-Q119 PolarHBondContact O-N 3.01Å; N116-Q119 VanDerWaalsContact O-N 3.1Å; Q119-R121 VanDerWaalsContact C-N 3.28Å; Q119-R121 PolarHBondContact O-N 3.37Å; Q119-D122 PolarHBondContact O-N 3.47Å; Q119-T123 WeakPolarHBondContact O-CG2 3.18Å; Q119-T123 PolarHBondContact O-N 3.35Å; Q119-T123 PolarHBondContact O-OG1 3.35Å |
| 120 | D | 98.6 | Very high | 98.5 | Very high | 104 Ų | 104 | 94.4 Ų | 94.4 | 56% | 0.556 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -59.1 | -40.7 | 172.7 | -66.2 | -31.3 | 0 | 0 | 0 | 110.9 | N116 L118 T123 E124 | N116-D120 VanDerWaalsContact O-CG 3.28Å; N116-D120 PolarHBondContact O-N 3.05Å; L118-D120 PolarHBondContact O-N 3.17Å; D120-T123 PolarHBondContact O-OG1 3.41Å; D120-E124 WeakPolarHBondContact O-CB 3.28Å; D120-E124 PolarHBondContact O-N 2.94Å |
| 121 | R | 98.5 | Very high | 98.6 | Very high | 136 Ų | 136 | 95.1 Ų | 95.1 | 51% | 0.513 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -72.8 | -35.7 | 176.7 | -68.3 | -155 | 64.4 | 54.5 | 22.4 | 113.5 | T117 L118 Q119 E124 I125 | T117-R121 VanDerWaalsContact O-CG 3.3Å; T117-R121 WeakPolarHBondContact O-CG 3.33Å; T117-R121 PolarHBondContact O-N 2.83Å; L118-R121 CarbonylContact O-C 3.46Å; L118-R121 WeakPolarHBondContact O-CA 3.36Å; L118-R121 PolarHBondContact O-N 3.03Å; L118-R121 VanDerWaalsContact O-N 3.08Å; Q119-R121 VanDerWaalsContact C-N 3.28Å; Q119-R121 PolarHBondContact O-N 3.37Å; R121-E124 IonicContact CZ-OE2 3.99Å; R121-E124 IonicContact NH1-OE2 3.86Å; R121-E124 PolarHBondContact NH1-OE2 3.13Å; R121-E124 IonicContact NH2-OE2 3.72Å; R121-E124 PolarHBondContact NH2-OE2 3.35Å; R121-E124 PolarHBondContact O-N 2.91Å; R121-I125 WeakPolarHBondContact O-CB 3.39Å; R121-I125 WeakPolarHBondContact O-CD1 3.35Å; R121-I125 WeakPolarHBondContact O-CG1 3.37Å; R121-I125 PolarHBondContact O-N 3.31Å |
| 122 | D | 98.7 | Very high | 98.6 | Very high | 93 Ų | 93 | 95.8 Ų | 95.8 | 50% | 0.497 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -66.1 | -42.2 | 175.1 | -72.3 | -33.8 | 0 | 0 | 0 | 110.7 | L118 Q119 I125 D126 | L118-D122 PolarHBondContact O-N 3.33Å; Q119-D122 PolarHBondContact O-N 3.47Å; D122-I125 WeakPolarHBondContact O-CB 3.33Å; D122-I125 PolarHBondContact O-N 3.34Å; D122-D126 PolarHBondContact O-N 3.21Å |
| 123 | T | 98.5 | Very high | 98.5 | Very high | 88 Ų | 88 | 96 Ų | 96 | 54% | 0.54 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -66.3 | -39.2 | 172.7 | 61.1 | 0 | 0 | 0 | 0 | 112.5 | Q119 D120 I125 D126 T127 | Q119-T123 WeakPolarHBondContact O-CG2 3.18Å; Q119-T123 PolarHBondContact O-N 3.35Å; Q119-T123 PolarHBondContact O-OG1 3.35Å; D120-T123 PolarHBondContact O-OG1 3.41Å; T123-I125 VanDerWaalsContact C-N 3.34Å; T123-I125 PolarHBondContact O-N 3.08Å; T123-D126 PolarHBondContact O-N 2.8Å; T123-T127 WeakPolarHBondContact O-CG2 3.47Å; T123-T127 PolarHBondContact O-N 3.33Å |
| 124 | E | 98.7 | Very high | 98.5 | Very high | 81 Ų | 81 | 97.5 Ų | 97.5 | 38% | 0.379 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -55 | -50.4 | 170.8 | -178.2 | -175.8 | -141.7 | 0 | 0 | 110.6 | D120 R121 D126 T127 L128 | D120-E124 WeakPolarHBondContact O-CB 3.28Å; D120-E124 PolarHBondContact O-N 2.94Å; R121-E124 IonicContact CZ-OE2 3.99Å; R121-E124 IonicContact NH1-OE2 3.86Å; R121-E124 PolarHBondContact NH1-OE2 3.13Å; R121-E124 IonicContact NH2-OE2 3.72Å; R121-E124 PolarHBondContact NH2-OE2 3.35Å; R121-E124 PolarHBondContact O-N 2.91Å; E124-D126 VanDerWaalsContact C-N 3.32Å; E124-D126 PolarHBondContact O-N 3.19Å; E124-T127 PolarHBondContact O-N 3.49Å; E124-T127 PolarHBondContact O-OG1 3Å; E124-L128 HydrophobicContact CG-CD1 4.05Å; E124-L128 WeakPolarHBondContact O-CG 3.5Å; E124-L128 PolarHBondContact O-N 3.06Å |
| 125 | I | 98.6 | Very high | 98.5 | Very high | 57 Ų | 57 | 100.4 Ų | 100.4 | 29% | 0.292 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -57.7 | -43 | 178.3 | -73 | 163.6 | 0 | 0 | 0 | 111.2 | R121 D122 T123 L128 R129 | R121-I125 WeakPolarHBondContact O-CB 3.39Å; R121-I125 WeakPolarHBondContact O-CD1 3.35Å; R121-I125 WeakPolarHBondContact O-CG1 3.37Å; R121-I125 PolarHBondContact O-N 3.31Å; D122-I125 WeakPolarHBondContact O-CB 3.33Å; D122-I125 PolarHBondContact O-N 3.34Å; T123-I125 VanDerWaalsContact C-N 3.34Å; T123-I125 PolarHBondContact O-N 3.08Å; I125-L128 PolarHBondContact O-N 2.67Å; I125-R129 HydrophobicContact CG2-CG 4.47Å; I125-R129 VanDerWaalsContact CG2-CZ 3.43Å; I125-R129 WeakPolarHBondContact O-CG 3.5Å; I125-R129 PolarHBondContact O-N 3.39Å |
| 126 | D | 98.6 | Very high | 98.5 | Very high | 80 Ų | 80 | 102 Ų | 102 | 43% | 0.428 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -70.4 | -34.2 | 178 | -76.6 | -23.9 | 0 | 0 | 0 | 113 | D122 T123 E124 L128 R129 S130 | D122-D126 PolarHBondContact O-N 3.21Å; T123-D126 PolarHBondContact O-N 2.8Å; E124-D126 VanDerWaalsContact C-N 3.32Å; E124-D126 PolarHBondContact O-N 3.19Å; D126-L128 VanDerWaalsContact C-N 3.3Å; D126-L128 PolarHBondContact O-N 2.86Å; D126-R129 PolarHBondContact O-N 3.1Å; D126-R129 VanDerWaalsContact OD1-CD 3.23Å; D126-R129 WeakPolarHBondContact OD1-CD 3.44Å; D126-R129 IonicContact OD1-CZ 3.09Å; D126-R129 IonicContact OD1-NE 2.7Å; D126-R129 IonicContact OD1-NH1 2.75Å; D126-R129 PolarHBondContact OD1-NH1 2.94Å; D126-S130 WeakPolarHBondContact O-CB 3.39Å; D126-S130 PolarHBondContact O-N 3.38Å; D126-S130 PolarHBondContact O-OG 3.45Å; D126-S130 VanDerWaalsContact O-OG 3.06Å |
| 127 | T | 98.6 | Very high | 98.5 | Very high | 69 Ų | 69 | 104 Ų | 104 | 42% | 0.423 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -66.2 | -33.6 | 169.6 | 72.8 | 0 | 0 | 0 | 0 | 112.5 | T123 E124 K131 | T123-T127 WeakPolarHBondContact O-CG2 3.47Å; T123-T127 PolarHBondContact O-N 3.33Å; E124-T127 PolarHBondContact O-N 3.49Å; E124-T127 PolarHBondContact O-OG1 3Å; T127-K131 WeakPolarHBondContact O-CD 3.48Å; T127-K131 VanDerWaalsContact O-CG 3.27Å; T127-K131 WeakPolarHBondContact O-CG 3.23Å; T127-K131 PolarHBondContact O-N 2.65Å |
| 128 | L | 98.6 | Very high | 98.5 | Very high | 91 Ų | 91 | 104 Ų | 104 | 48% | 0.476 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -72.9 | -38.2 | 176.6 | -69.5 | 172.3 | 0 | 0 | 0 | 111.6 | E124 I125 D126 K131 L132 | E124-L128 HydrophobicContact CG-CD1 4.05Å; E124-L128 WeakPolarHBondContact O-CG 3.5Å; E124-L128 PolarHBondContact O-N 3.06Å; I125-L128 PolarHBondContact O-N 2.67Å; D126-L128 VanDerWaalsContact C-N 3.3Å; D126-L128 PolarHBondContact O-N 2.86Å; L128-K131 HydrophobicContact CD2-CD 4.39Å; L128-K131 PolarHBondContact O-N 2.84Å; L128-L132 WeakPolarHBondContact O-CB 3.41Å; L128-L132 PolarHBondContact O-N 3.28Å |
| 129 | R | 98.5 | Very high | 98.5 | Very high | 131 Ų | 131 | 105.9 Ų | 105.9 | 49% | 0.494 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -58.8 | -50.2 | 169.8 | -74.8 | 164.7 | 173.4 | 158.7 | 1.5 | 110.9 | I125 D126 K131 L132 Y133 | I125-R129 HydrophobicContact CG2-CG 4.47Å; I125-R129 VanDerWaalsContact CG2-CZ 3.43Å; I125-R129 WeakPolarHBondContact O-CG 3.5Å; I125-R129 PolarHBondContact O-N 3.39Å; D126-R129 PolarHBondContact O-N 3.1Å; D126-R129 VanDerWaalsContact OD1-CD 3.23Å; D126-R129 WeakPolarHBondContact OD1-CD 3.44Å; D126-R129 IonicContact OD1-CZ 3.09Å; D126-R129 IonicContact OD1-NE 2.7Å; D126-R129 IonicContact OD1-NH1 2.75Å; D126-R129 PolarHBondContact OD1-NH1 2.94Å; R129-K131 VanDerWaalsContact C-N 3.3Å; R129-K131 PolarHBondContact O-N 3.33Å; R129-L132 PolarHBondContact O-N 3.32Å; R129-L132 VanDerWaalsContact O-N 3.1Å; R129-Y133 HydrophobicContact CB-CD2 4.45Å; R129-Y133 HydrophobicContact CB-CE2 4.25Å; R129-Y133 WeakPolarHBondContact O-CD2 3.35Å; R129-Y133 PolarHBondContact O-N 2.69Å |
| 130 | S | 98.6 | Very high | 98.5 | Very high | 78 Ų | 78 | 104.2 Ų | 104.2 | 55% | 0.545 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.3 | -37.3 | 178.1 | -62.8 | 0 | 0 | 0 | 0 | 113.1 | D126 R134 | D126-S130 WeakPolarHBondContact O-CB 3.39Å; D126-S130 PolarHBondContact O-N 3.38Å; D126-S130 PolarHBondContact O-OG 3.45Å; D126-S130 VanDerWaalsContact O-OG 3.06Å; S130-R134 PolarHBondContact O-N 3.03Å |
| 131 | K | 98.7 | Very high | 98.5 | Very high | 122 Ų | 122 | 105.1 Ų | 105.1 | 53% | 0.53 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -66.9 | -43.2 | 172.4 | -73.1 | 162.5 | -175.9 | 163.6 | 0 | 112 | T127 L128 R129 R134 M135 | T127-K131 WeakPolarHBondContact O-CD 3.48Å; T127-K131 VanDerWaalsContact O-CG 3.27Å; T127-K131 WeakPolarHBondContact O-CG 3.23Å; T127-K131 PolarHBondContact O-N 2.65Å; L128-K131 HydrophobicContact CD2-CD 4.39Å; L128-K131 PolarHBondContact O-N 2.84Å; R129-K131 VanDerWaalsContact C-N 3.3Å; R129-K131 PolarHBondContact O-N 3.33Å; K131-R134 PolarHBondContact O-N 2.98Å; K131-M135 WeakPolarHBondContact O-CG 3.29Å; K131-M135 PolarHBondContact O-N 2.86Å |
| 132 | L | 98.8 | Very high | 98.4 | Very high | 117 Ų | 117 | 105.1 Ų | 105.1 | 61% | 0.613 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -65.9 | -41.6 | 179.9 | -178.6 | 62.9 | 0 | 0 | 0 | 112 | L128 R129 M135 Q136 | L128-L132 WeakPolarHBondContact O-CB 3.41Å; L128-L132 PolarHBondContact O-N 3.28Å; R129-L132 PolarHBondContact O-N 3.32Å; R129-L132 VanDerWaalsContact O-N 3.1Å; L132-M135 PolarHBondContact O-N 2.84Å; L132-Q136 WeakPolarHBondContact O-CB 3.39Å; L132-Q136 PolarHBondContact O-N 2.88Å |
| 133 | Y | 98.3 | Very high | 98.4 | Very high | 145 Ų | 145 | 103.1 Ų | 103.1 | 57% | 0.569 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -59.8 | -48.2 | 174.3 | -75.7 | -57.6 | 0 | 0 | 0 | 111.3 | R129 M135 Q136 E137 | R129-Y133 HydrophobicContact CB-CD2 4.45Å; R129-Y133 HydrophobicContact CB-CE2 4.25Å; R129-Y133 WeakPolarHBondContact O-CD2 3.35Å; R129-Y133 PolarHBondContact O-N 2.69Å; Y133-M135 PolarHBondContact O-N 3.06Å; Y133-Q136 CarbonylContact O-C 3.56Å; Y133-Q136 WeakPolarHBondContact O-CA 3.32Å; Y133-Q136 WeakPolarHBondContact O-CB 3.44Å; Y133-Q136 PolarHBondContact O-N 3.34Å; Y133-Q136 VanDerWaalsContact O-N 3.09Å; Y133-E137 WeakPolarHBondContact O-CG 3.13Å; Y133-E137 PolarHBondContact O-N 3.23Å |
| 134 | R | 98.3 | Very high | 98.4 | Very high | 152 Ų | 152 | 101.9 Ų | 101.9 | 57% | 0.574 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -59.2 | -46.8 | 174.9 | -78.2 | -164.7 | 59 | -123.1 | -29.4 | 113.1 | S130 K131 Q136 E137 D138 | S130-R134 PolarHBondContact O-N 3.03Å; K131-R134 PolarHBondContact O-N 2.98Å; R134-Q136 PolarHBondContact O-N 3.17Å; R134-E137 WeakPolarHBondContact O-CB 3.4Å; R134-E137 PolarHBondContact O-N 3.32Å; R134-E137 VanDerWaalsContact O-N 3.11Å; R134-D138 IonicContact NH2-OD1 3.18Å; R134-D138 IonicContact NH2-OD2 2.81Å; R134-D138 WeakPolarHBondContact O-CB 3.21Å; R134-D138 PolarHBondContact O-N 3.46Å; R134-D138 VanDerWaalsContact O-OD2 3.13Å |
| 135 | M | 97.9 | Very high | 98.4 | Very high | 131 Ų | 131 | 103.7 Ų | 103.7 | 65% | 0.645 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -64.1 | -25.8 | 176.4 | -70.9 | 179.2 | 67.6 | 0 | 0 | 113.2 | K131 L132 Y133 W139 | K131-M135 WeakPolarHBondContact O-CG 3.29Å; K131-M135 PolarHBondContact O-N 2.86Å; L132-M135 PolarHBondContact O-N 2.84Å; Y133-M135 PolarHBondContact O-N 3.06Å; M135-W139 VanDerWaalsContact O-CB 3.27Å; M135-W139 WeakPolarHBondContact O-CB 3.37Å; M135-W139 PolarHBondContact O-N 3.33Å |
| 136 | Q | 98.6 | Very high | 98.4 | Very high | 110 Ų | 110 | 107 Ų | 107 | 51% | 0.514 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -75.7 | -40.2 | 172.4 | -176 | -170.1 | -44.1 | 0 | 0 | 111.3 | L132 Y133 R134 W139 V140 | L132-Q136 WeakPolarHBondContact O-CB 3.39Å; L132-Q136 PolarHBondContact O-N 2.88Å; Y133-Q136 CarbonylContact O-C 3.56Å; Y133-Q136 WeakPolarHBondContact O-CA 3.32Å; Y133-Q136 WeakPolarHBondContact O-CB 3.44Å; Y133-Q136 PolarHBondContact O-N 3.34Å; Y133-Q136 VanDerWaalsContact O-N 3.09Å; R134-Q136 PolarHBondContact O-N 3.17Å; Q136-W139 PolarHBondContact O-N 2.98Å; Q136-V140 WeakPolarHBondContact O-CB 3.36Å; Q136-V140 VanDerWaalsContact O-CG2 3.28Å; Q136-V140 WeakPolarHBondContact O-CG2 3.47Å; Q136-V140 PolarHBondContact O-N 3.49Å |
| 137 | E | 98.1 | Very high | 98.4 | Very high | 111 Ų | 111 | 106.7 Ų | 106.7 | 52% | 0.519 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.3 | -53.7 | 173.4 | -69.1 | 162.8 | 163.4 | 0 | 0 | 110.3 | Y133 R134 W139 V140 E141 | Y133-E137 WeakPolarHBondContact O-CG 3.13Å; Y133-E137 PolarHBondContact O-N 3.23Å; R134-E137 WeakPolarHBondContact O-CB 3.4Å; R134-E137 PolarHBondContact O-N 3.32Å; R134-E137 VanDerWaalsContact O-N 3.11Å; E137-W139 VanDerWaalsContact C-N 3.28Å; E137-W139 PolarHBondContact O-N 3.06Å; E137-V140 PolarHBondContact O-N 3.02Å; E137-E141 PolarHBondContact O-N 3.4Å |
| 138 | D | 98.5 | Very high | 98.3 | Very high | 72 Ų | 72 | 108.3 Ų | 108.3 | 39% | 0.385 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -50.8 | -46.2 | 175.3 | -59.3 | -34.2 | 0 | 0 | 0 | 110.6 | R134 E141 E142 | R134-D138 IonicContact NH2-OD1 3.18Å; R134-D138 IonicContact NH2-OD2 2.81Å; R134-D138 WeakPolarHBondContact O-CB 3.21Å; R134-D138 PolarHBondContact O-N 3.46Å; R134-D138 VanDerWaalsContact O-OD2 3.13Å; D138-E141 PolarHBondContact O-N 2.93Å; D138-E142 PolarHBondContact O-N 3.14Å |
| 139 | W | 98.6 | Very high | 98.3 | Very high | 146 Ų | 146 | 107 Ų | 107 | 55% | 0.553 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -69.1 | -37.3 | 178.4 | 179.6 | 78.4 | 0 | 0 | 0 | 114 | M135 Q136 E137 E141 E142 E143 | M135-W139 VanDerWaalsContact O-CB 3.27Å; M135-W139 WeakPolarHBondContact O-CB 3.37Å; M135-W139 PolarHBondContact O-N 3.33Å; Q136-W139 PolarHBondContact O-N 2.98Å; E137-W139 VanDerWaalsContact C-N 3.28Å; E137-W139 PolarHBondContact O-N 3.06Å; W139-E141 VanDerWaalsContact C-N 3.35Å; W139-E142 PolarHBondContact O-N 3.05Å; W139-E143 HydrophobicContact CH2-CG 4.43Å; W139-E143 WeakPolarHBondContact O-CB 3.19Å; W139-E143 PolarHBondContact O-N 3.47Å |
| 140 | V | 98.6 | Very high | 98.3 | Very high | 75 Ų | 75 | 105.6 Ų | 105.6 | 46% | 0.455 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -67.3 | -37.9 | 176.2 | 166.3 | 0 | 0 | 0 | 0 | 110.7 | Q136 E137 E143 C144 | Q136-V140 WeakPolarHBondContact O-CB 3.36Å; Q136-V140 VanDerWaalsContact O-CG2 3.28Å; Q136-V140 WeakPolarHBondContact O-CG2 3.47Å; Q136-V140 PolarHBondContact O-N 3.49Å; E137-V140 PolarHBondContact O-N 3.02Å; V140-E143 PolarHBondContact O-N 3.27Å; V140-C144 WeakPolarHBondContact O-CB 3.37Å; V140-C144 PolarHBondContact O-N 3.06Å |
| 141 | E | 98.1 | Very high | 98.3 | Very high | 122 Ų | 122 | 107.2 Ų | 107.2 | 57% | 0.57 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -65.7 | -45.5 | 174.3 | -70.1 | -174.6 | -170.2 | 0 | 0 | 111.6 | E137 D138 W139 E143 C144 H145 | E137-E141 PolarHBondContact O-N 3.4Å; D138-E141 PolarHBondContact O-N 2.93Å; W139-E141 VanDerWaalsContact C-N 3.35Å; E141-E143 VanDerWaalsContact C-N 3.33Å; E141-E143 PolarHBondContact O-N 3.22Å; E141-C144 PolarHBondContact O-N 3.35Å; E141-H145 PolarHBondContact O-N 2.94Å; E141-H145 PolarHBondContact O-ND1 3.07Å |
| 142 | E | 97.6 | Very high | 98.3 | Very high | 136 Ų | 136 | 104 Ų | 104 | 64% | 0.636 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -59.6 | -40.4 | 174 | -75.3 | -174.2 | 177.9 | 0 | 0 | 112.8 | D138 W139 R146 | D138-E142 PolarHBondContact O-N 3.14Å; W139-E142 PolarHBondContact O-N 3.05Å; E142-R146 WeakPolarHBondContact O-CB 3.25Å; E142-R146 PolarHBondContact O-N 2.92Å; E142-R146 VanDerWaalsContact O-N 3.17Å |
| 143 | E | 97.4 | Very high | 98.2 | Very high | 52 Ų | 52 | 102.5 Ų | 102.5 | 24% | 0.243 | 50% | 0.501 | C | S | . | . | H | α-helix | trans | -65.3 | -42.2 | 175.3 | -174 | 64.8 | -136.8 | 0 | 0 | 111.5 | W139 V140 E141 R146 V147 | W139-E143 HydrophobicContact CH2-CG 4.43Å; W139-E143 WeakPolarHBondContact O-CB 3.19Å; W139-E143 PolarHBondContact O-N 3.47Å; V140-E143 PolarHBondContact O-N 3.27Å; E141-E143 VanDerWaalsContact C-N 3.33Å; E141-E143 PolarHBondContact O-N 3.22Å; E143-R146 PolarHBondContact O-N 3.36Å; E143-R146 IonicContact OE1-CZ 3.1Å; E143-R146 IonicContact OE1-NH1 2.74Å; E143-R146 IonicContact OE1-NH2 2.69Å; E143-R146 PolarHBondContact OE1-NH2 2.8Å; E143-R146 IonicContact OE2-CZ 3.19Å; E143-R146 IonicContact OE2-NH1 2.66Å; E143-R146 PolarHBondContact OE2-NH1 2.99Å; E143-R146 IonicContact OE2-NH2 3.35Å; E143-R146 PolarHBondContact OE2-NH2 2.91Å; E143-V147 WeakPolarHBondContact O-CG2 3.43Å; E143-V147 PolarHBondContact O-N 3.4Å |
| 144 | C | 98.3 | Very high | 98.2 | Very high | 62 Ų | 62 | 101.6 Ų | 101.6 | 42% | 0.419 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.5 | -54.2 | 178.4 | -157.3 | 0 | 0 | 0 | 0 | 111.4 | V140 E141 R146 V147 E148 | V140-C144 WeakPolarHBondContact O-CB 3.37Å; V140-C144 PolarHBondContact O-N 3.06Å; E141-C144 PolarHBondContact O-N 3.35Å; C144-R146 PolarHBondContact O-N 2.99Å; C144-V147 PolarHBondContact O-N 3.36Å; C144-E148 WeakPolarHBondContact O-CG 3.33Å; C144-E148 PolarHBondContact O-N 3.02Å; C144-E148 PolarHBondContact SG-OE1 3.32Å |
| 145 | H | 98.5 | Very high | 98.2 | Very high | 118 Ų | 118 | 99.9 Ų | 99.9 | 55% | 0.546 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -56.2 | -36.8 | 177.2 | -66.6 | 117 | 0 | 0 | 0 | 112.4 | E141 E148 A149 | E141-H145 PolarHBondContact O-N 2.94Å; E141-H145 PolarHBondContact O-ND1 3.07Å; H145-E148 IonicContact CD2-OE2 3.72Å; H145-A149 WeakPolarHBondContact O-CB 3.21Å; H145-A149 PolarHBondContact O-N 2.8Å |
| 146 | R | 98.5 | Very high | 98.3 | Very high | 126 Ų | 126 | 95.7 Ų | 95.7 | 48% | 0.475 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -68.7 | -39.3 | 177.3 | -164.9 | 177.6 | 77.6 | -116.8 | 4.4 | 112.4 | E142 E143 C144 Q150 | E142-R146 WeakPolarHBondContact O-CB 3.25Å; E142-R146 PolarHBondContact O-N 2.92Å; E142-R146 VanDerWaalsContact O-N 3.17Å; E143-R146 PolarHBondContact O-N 3.36Å; E143-R146 IonicContact OE1-CZ 3.1Å; E143-R146 IonicContact OE1-NH1 2.74Å; E143-R146 IonicContact OE1-NH2 2.69Å; E143-R146 PolarHBondContact OE1-NH2 2.8Å; E143-R146 IonicContact OE2-CZ 3.19Å; E143-R146 IonicContact OE2-NH1 2.66Å; E143-R146 PolarHBondContact OE2-NH1 2.99Å; E143-R146 IonicContact OE2-NH2 3.35Å; E143-R146 PolarHBondContact OE2-NH2 2.91Å; C144-R146 PolarHBondContact O-N 2.99Å; R146-Q150 WeakPolarHBondContact O-CG 3.36Å; R146-Q150 PolarHBondContact O-N 3.32Å; R146-Q150 VanDerWaalsContact O-N 3.17Å |
| 147 | V | 98.6 | Very high | 98.2 | Very high | 75 Ų | 75 | 97.8 Ų | 97.8 | 46% | 0.455 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -71 | -41 | 176.8 | 171.6 | 0 | 0 | 0 | 0 | 111.2 | E143 C144 Q150 L151 | E143-V147 WeakPolarHBondContact O-CG2 3.43Å; E143-V147 PolarHBondContact O-N 3.4Å; C144-V147 PolarHBondContact O-N 3.36Å; V147-Q150 PolarHBondContact O-N 3.48Å; V147-L151 PolarHBondContact O-N 3.49Å |
| 148 | E | 98.1 | Very high | 98.3 | Very high | 103 Ų | 103 | 98.1 Ų | 98.1 | 48% | 0.481 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -59.3 | -48.6 | 174.5 | -73 | 167.9 | -169.8 | 0 | 0 | 111.7 | C144 H145 Q150 L151 A152 | C144-E148 WeakPolarHBondContact O-CG 3.33Å; C144-E148 PolarHBondContact O-N 3.02Å; C144-E148 PolarHBondContact SG-OE1 3.32Å; H145-E148 IonicContact CD2-OE2 3.72Å; E148-Q150 VanDerWaalsContact C-N 3.28Å; E148-Q150 PolarHBondContact O-N 3.34Å; E148-L151 WeakPolarHBondContact O-CB 3.3Å; E148-L151 PolarHBondContact O-N 2.91Å; E148-A152 PolarHBondContact O-N 3.13Å |
| 149 | A | 98.1 | Very high | 98.2 | Very high | 62 Ų | 62 | 99.7 Ų | 99.7 | 51% | 0.512 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.4 | -36.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | H145 L153 | H145-A149 WeakPolarHBondContact O-CB 3.21Å; H145-A149 PolarHBondContact O-N 2.8Å; A149-L153 WeakPolarHBondContact O-CB 3.41Å; A149-L153 PolarHBondContact O-N 2.83Å; A149-L153 VanDerWaalsContact O-N 3.14Å |
| 150 | Q | 98.2 | Very high | 98.2 | Very high | 102 Ų | 102 | 98.1 Ų | 98.1 | 48% | 0.477 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -70.6 | -28.3 | 173.6 | -75.6 | -173.7 | 13 | 0 | 0 | 113.7 | R146 V147 E148 K154 | R146-Q150 WeakPolarHBondContact O-CG 3.36Å; R146-Q150 PolarHBondContact O-N 3.32Å; R146-Q150 VanDerWaalsContact O-N 3.17Å; V147-Q150 PolarHBondContact O-N 3.48Å; E148-Q150 VanDerWaalsContact C-N 3.28Å; E148-Q150 PolarHBondContact O-N 3.34Å; Q150-K154 WeakPolarHBondContact O-CD 3.29Å; Q150-K154 VanDerWaalsContact O-CG 3.29Å; Q150-K154 WeakPolarHBondContact O-CG 3.43Å; Q150-K154 PolarHBondContact O-N 3.47Å |
| 151 | L | 98.3 | Very high | 98.1 | Very high | 112 Ų | 112 | 101.1 Ų | 101.1 | 59% | 0.586 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -75 | -53.2 | 176.8 | -177.5 | 60.7 | 0 | 0 | 0 | 110.5 | V147 E148 L153 K154 E155 | V147-L151 PolarHBondContact O-N 3.49Å; E148-L151 WeakPolarHBondContact O-CB 3.3Å; E148-L151 PolarHBondContact O-N 2.91Å; L151-L153 PolarHBondContact O-N 3.44Å; L151-K154 WeakPolarHBondContact O-CA 3.18Å; L151-K154 WeakPolarHBondContact O-CB 3.4Å; L151-K154 PolarHBondContact O-N 3.19Å; L151-E155 PolarHBondContact O-N 3.04Å |
| 152 | A | 98.2 | Very high | 98.1 | Very high | 55 Ų | 55 | 101 Ų | 101 | 46% | 0.455 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -57 | -37.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | E148 K154 E155 A156 | E148-A152 PolarHBondContact O-N 3.13Å; A152-K154 VanDerWaalsContact C-N 3.34Å; A152-K154 PolarHBondContact O-N 3.28Å; A152-E155 PolarHBondContact O-N 3.35Å; A152-A156 WeakPolarHBondContact O-CB 3.17Å; A152-A156 PolarHBondContact O-N 3.22Å |
| 153 | L | 98.3 | Very high | 98.2 | Very high | 86 Ų | 86 | 100 Ų | 100 | 45% | 0.45 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -68.8 | -26.7 | 175.1 | 176 | 148.3 | 0 | 0 | 0 | 113.5 | A149 L151 R157 | A149-L153 WeakPolarHBondContact O-CB 3.41Å; A149-L153 PolarHBondContact O-N 2.83Å; A149-L153 VanDerWaalsContact O-N 3.14Å; L151-L153 PolarHBondContact O-N 3.44Å; L153-R157 WeakPolarHBondContact O-CB 3.38Å; L153-R157 VanDerWaalsContact O-CD 3.29Å; L153-R157 WeakPolarHBondContact O-CD 3.46Å; L153-R157 WeakPolarHBondContact O-CG 3.28Å; L153-R157 PolarHBondContact O-N 3.13Å |
| 154 | K | 98.4 | Very high | 98.2 | Very high | 125 Ų | 125 | 103.8 Ų | 103.8 | 54% | 0.543 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -77.5 | -42.5 | 171.5 | -73.1 | 165.6 | -173.9 | 166.8 | 0 | 111.1 | Q150 L151 A152 R157 Q158 | Q150-K154 WeakPolarHBondContact O-CD 3.29Å; Q150-K154 VanDerWaalsContact O-CG 3.29Å; Q150-K154 WeakPolarHBondContact O-CG 3.43Å; Q150-K154 PolarHBondContact O-N 3.47Å; L151-K154 WeakPolarHBondContact O-CA 3.18Å; L151-K154 WeakPolarHBondContact O-CB 3.4Å; L151-K154 PolarHBondContact O-N 3.19Å; A152-K154 VanDerWaalsContact C-N 3.34Å; A152-K154 PolarHBondContact O-N 3.28Å; K154-R157 WeakPolarHBondContact O-CB 3.48Å; K154-R157 PolarHBondContact O-N 2.81Å; K154-Q158 PolarHBondContact O-N 3.05Å |
| 155 | E | 98.2 | Very high | 98.1 | Very high | 117 Ų | 117 | 107.2 Ų | 107.2 | 55% | 0.547 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -60.4 | -53.4 | 177.7 | -173.5 | 164 | -142.8 | 0 | 0 | 111.2 | L151 A152 R157 Q158 E159 | L151-E155 PolarHBondContact O-N 3.04Å; A152-E155 PolarHBondContact O-N 3.35Å; E155-R157 VanDerWaalsContact C-N 3.25Å; E155-R157 PolarHBondContact O-N 3.42Å; E155-Q158 CarbonylContact O-C 3.6Å; E155-Q158 WeakPolarHBondContact O-CA 3.37Å; E155-Q158 WeakPolarHBondContact O-CB 3.49Å; E155-Q158 PolarHBondContact O-N 3.3Å; E155-E159 PolarHBondContact O-N 3.14Å |
| 156 | A | 98.1 | Very high | 98.1 | Very high | 43 Ų | 43 | 104 Ų | 104 | 36% | 0.355 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -58.1 | -34.6 | 175 | 0 | 0 | 0 | 0 | 0 | 113 | A152 I160 | A152-A156 WeakPolarHBondContact O-CB 3.17Å; A152-A156 PolarHBondContact O-N 3.22Å; A156-I160 WeakPolarHBondContact O-CB 3.36Å; A156-I160 WeakPolarHBondContact O-CD1 3.37Å; A156-I160 WeakPolarHBondContact O-CG1 3.49Å; A156-I160 PolarHBondContact O-N 3.16Å |
| 157 | R | 98.3 | Very high | 98 | Very high | 154 Ų | 154 | 101.9 Ų | 101.9 | 58% | 0.581 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -67.7 | -37.3 | 172.8 | -78.5 | 172.3 | 178.5 | -176.5 | -0.3 | 112.4 | L153 K154 E155 Q161 | L153-R157 WeakPolarHBondContact O-CB 3.38Å; L153-R157 VanDerWaalsContact O-CD 3.29Å; L153-R157 WeakPolarHBondContact O-CD 3.46Å; L153-R157 WeakPolarHBondContact O-CG 3.28Å; L153-R157 PolarHBondContact O-N 3.13Å; K154-R157 WeakPolarHBondContact O-CB 3.48Å; K154-R157 PolarHBondContact O-N 2.81Å; E155-R157 VanDerWaalsContact C-N 3.25Å; E155-R157 PolarHBondContact O-N 3.42Å; R157-Q161 VanDerWaalsContact O-CG 3.28Å; R157-Q161 WeakPolarHBondContact O-CG 3.41Å; R157-Q161 PolarHBondContact O-N 3.09Å |
| 158 | Q | 98.4 | Very high | 97.9 | Very high | 117 Ų | 117 | 100.8 Ų | 100.8 | 55% | 0.547 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -69.3 | -40.8 | 175.8 | -174.1 | 178.7 | -23.4 | 0 | 0 | 111.1 | K154 E155 Q161 Q162 | K154-Q158 PolarHBondContact O-N 3.05Å; E155-Q158 CarbonylContact O-C 3.6Å; E155-Q158 WeakPolarHBondContact O-CA 3.37Å; E155-Q158 WeakPolarHBondContact O-CB 3.49Å; E155-Q158 PolarHBondContact O-N 3.3Å; Q158-Q161 PolarHBondContact O-N 3.1Å; Q158-Q162 WeakPolarHBondContact O-CG 3.18Å; Q158-Q162 PolarHBondContact O-N 3.49Å |
| 159 | E | 97.6 | Very high | 97.7 | Very high | 106 Ų | 106 | 98.5 Ų | 98.5 | 50% | 0.495 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60.8 | -48.2 | 172.2 | -69.3 | -175.6 | 170.2 | 0 | 0 | 111.9 | E155 Q161 Q162 L163 | E155-E159 PolarHBondContact O-N 3.14Å; E159-Q161 PolarHBondContact O-N 3.11Å; E159-Q162 PolarHBondContact O-N 3.48Å; E159-Q162 VanDerWaalsContact O-N 3.09Å; E159-L163 WeakPolarHBondContact O-CB 3.29Å; E159-L163 WeakPolarHBondContact O-CG 3.35Å; E159-L163 PolarHBondContact O-N 3Å |
| 160 | I | 97.7 | Very high | 97.5 | Very high | 113 Ų | 113 | 99.7 Ų | 99.7 | 58% | 0.579 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -58.7 | -36.4 | 176.1 | -71.3 | 164.6 | 0 | 0 | 0 | 111.1 | A156 K164 | A156-I160 WeakPolarHBondContact O-CB 3.36Å; A156-I160 WeakPolarHBondContact O-CD1 3.37Å; A156-I160 WeakPolarHBondContact O-CG1 3.49Å; A156-I160 PolarHBondContact O-N 3.16Å; I160-K164 WeakPolarHBondContact O-CB 3.47Å; I160-K164 PolarHBondContact O-N 2.8Å |
| 161 | Q | 98.1 | Very high | 97.2 | Very high | 138 Ų | 138 | 101.4 Ų | 101.4 | 65% | 0.645 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -69.5 | -40.8 | 174.3 | -74.4 | 173.4 | 9.8 | 0 | 0 | 112.8 | R157 Q158 E159 K164 H165 | R157-Q161 VanDerWaalsContact O-CG 3.28Å; R157-Q161 WeakPolarHBondContact O-CG 3.41Å; R157-Q161 PolarHBondContact O-N 3.09Å; Q158-Q161 PolarHBondContact O-N 3.1Å; E159-Q161 PolarHBondContact O-N 3.11Å; Q161-K164 PolarHBondContact O-N 3.23Å; Q161-H165 WeakPolarHBondContact O-CB 3.36Å; Q161-H165 PolarHBondContact O-N 3.29Å |
| 162 | Q | 98 | Very high | 96.8 | Very high | 118 Ų | 118 | 99.7 Ų | 99.7 | 55% | 0.551 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -63.7 | -47.5 | 174.5 | -71.1 | 176 | 47.1 | 0 | 0 | 111.6 | Q158 E159 K164 H165 A166 | Q158-Q162 WeakPolarHBondContact O-CG 3.18Å; Q158-Q162 PolarHBondContact O-N 3.49Å; E159-Q162 PolarHBondContact O-N 3.48Å; E159-Q162 VanDerWaalsContact O-N 3.09Å; Q162-K164 PolarHBondContact O-N 3.1Å; Q162-H165 PolarHBondContact O-N 3.25Å; Q162-A166 WeakPolarHBondContact O-CB 3.41Å; Q162-A166 PolarHBondContact O-N 3.15Å |
| 163 | L | 98.3 | Very high | 96.3 | Very high | 115 Ų | 115 | 105.5 Ų | 105.5 | 60% | 0.602 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -60.9 | -43.2 | 176.1 | -70.9 | 170.1 | 0 | 0 | 0 | 111.3 | E159 A166 V167 | E159-L163 WeakPolarHBondContact O-CB 3.29Å; E159-L163 WeakPolarHBondContact O-CG 3.35Å; E159-L163 PolarHBondContact O-N 3Å; L163-A166 PolarHBondContact O-N 3.32Å; L163-V167 WeakPolarHBondContact O-CG2 3.41Å; L163-V167 PolarHBondContact O-N 3.19Å |
| 164 | K | 97.6 | Very high | 95.5 | Very high | 133 Ų | 133 | 107 Ų | 107 | 58% | 0.578 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -60.5 | -47.3 | 173.6 | -179.3 | 177.2 | 175.8 | -175.3 | 0 | 111.5 | I160 Q161 Q162 A166 V167 D168 | I160-K164 WeakPolarHBondContact O-CB 3.47Å; I160-K164 PolarHBondContact O-N 2.8Å; Q161-K164 PolarHBondContact O-N 3.23Å; Q162-K164 PolarHBondContact O-N 3.1Å; K164-A166 VanDerWaalsContact C-N 3.31Å; K164-A166 PolarHBondContact O-N 2.9Å; K164-V167 PolarHBondContact O-N 2.96Å; K164-D168 WeakPolarHBondContact CE-OD2 3.37Å; K164-D168 WeakPolarHBondContact CG-OD2 3.3Å; K164-D168 WeakPolarHBondContact O-CB 3.42Å; K164-D168 VanDerWaalsContact O-CG 3.29Å; K164-D168 PolarHBondContact O-N 2.97Å |
| 165 | H | 97.6 | Very high | 94.6 | Very high | 134 Ų | 134 | 104.3 Ų | 104.3 | 62% | 0.62 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -60.5 | -40.2 | 177.4 | 179.5 | -85.8 | 0 | 0 | 0 | 111.9 | Q161 Q162 T169 | Q161-H165 WeakPolarHBondContact O-CB 3.36Å; Q161-H165 PolarHBondContact O-N 3.29Å; Q162-H165 PolarHBondContact O-N 3.25Å; H165-T169 PolarHBondContact CE1-OG1 3.46Å; H165-T169 VanDerWaalsContact O-CB 3.3Å; H165-T169 WeakPolarHBondContact O-CB 3.36Å; H165-T169 PolarHBondContact O-N 3.46Å; H165-T169 PolarHBondContact O-OG1 2.9Å |
| 166 | A | 97.2 | Very high | 93.3 | Very high | 51 Ų | 51 | 104.4 Ų | 104.4 | 42% | 0.421 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.8 | -45.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112 | Q162 L163 K164 T169 V170 | Q162-A166 WeakPolarHBondContact O-CB 3.41Å; Q162-A166 PolarHBondContact O-N 3.15Å; L163-A166 PolarHBondContact O-N 3.32Å; K164-A166 VanDerWaalsContact C-N 3.31Å; K164-A166 PolarHBondContact O-N 2.9Å; A166-T169 PolarHBondContact O-N 2.72Å; A166-V170 WeakPolarHBondContact O-CG2 3.36Å; A166-V170 PolarHBondContact O-N 2.9Å |
| 167 | V | 96.8 | Very high | 91.8 | Very high | 81 Ų | 81 | 105.5 Ų | 105.5 | 49% | 0.491 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.8 | -43.3 | 175.8 | 168.4 | 0 | 0 | 0 | 0 | 111.8 | L163 K164 T169 V170 R171 | L163-V167 WeakPolarHBondContact O-CG2 3.41Å; L163-V167 PolarHBondContact O-N 3.19Å; K164-V167 PolarHBondContact O-N 2.96Å; V167-T169 VanDerWaalsContact C-N 3.32Å; V167-T169 PolarHBondContact O-N 3.01Å; V167-V170 PolarHBondContact O-N 3.26Å; V167-R171 WeakPolarHBondContact O-CB 3.42Å; V167-R171 PolarHBondContact O-N 3.4Å |
| 168 | D | 96.1 | Very high | 90 | Very high | 52 Ų | 52 | 100 Ų | 100 | 28% | 0.278 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -66.9 | -34.7 | 177.6 | -69.9 | -18.5 | 0 | 0 | 0 | 110.9 | K164 R171 T172 | K164-D168 WeakPolarHBondContact CE-OD2 3.37Å; K164-D168 WeakPolarHBondContact CG-OD2 3.3Å; K164-D168 WeakPolarHBondContact O-CB 3.42Å; K164-D168 VanDerWaalsContact O-CG 3.29Å; K164-D168 PolarHBondContact O-N 2.97Å; D168-R171 PolarHBondContact O-N 3.32Å; D168-R171 IonicContact OD1-CZ 3.59Å; D168-R171 IonicContact OD1-NH1 2.65Å; D168-R171 PolarHBondContact OD1-NH1 3.25Å; D168-R171 IonicContact OD1-NH2 3.83Å; D168-T172 PolarHBondContact O-N 3.48Å; D168-T172 PolarHBondContact O-OG1 2.86Å |
| 169 | T | 95.1 | Very high | 88 | Confident | 55 Ų | 55 | 97.3 Ų | 97.3 | 34% | 0.337 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -67.1 | -43.7 | 172.1 | -58.7 | 0 | 0 | 0 | 0 | 112.1 | H165 A166 V167 R171 T172 R173 | H165-T169 PolarHBondContact CE1-OG1 3.46Å; H165-T169 VanDerWaalsContact O-CB 3.3Å; H165-T169 WeakPolarHBondContact O-CB 3.36Å; H165-T169 PolarHBondContact O-N 3.46Å; H165-T169 PolarHBondContact O-OG1 2.9Å; A166-T169 PolarHBondContact O-N 2.72Å; V167-T169 VanDerWaalsContact C-N 3.32Å; V167-T169 PolarHBondContact O-N 3.01Å; T169-R171 VanDerWaalsContact C-N 3.29Å; T169-R171 PolarHBondContact O-N 2.88Å; T169-T172 PolarHBondContact O-N 2.9Å; T169-T172 PolarHBondContact O-OG1 3.48Å; T169-R173 WeakPolarHBondContact O-CG 3.41Å; T169-R173 PolarHBondContact O-N 3.43Å |
| 170 | V | 93.8 | Very high | 85.9 | Confident | 86 Ų | 86 | 101 Ų | 101 | 52% | 0.521 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -64.4 | -38.1 | 174 | 171.9 | 0 | 0 | 0 | 0 | 110.2 | A166 V167 R173 L174 | A166-V170 WeakPolarHBondContact O-CG2 3.36Å; A166-V170 PolarHBondContact O-N 2.9Å; V167-V170 PolarHBondContact O-N 3.26Å; V170-R173 PolarHBondContact O-N 3.41Å; V170-L174 HydrophobicContact CG1-CD1 3.81Å; V170-L174 HydrophobicContact CG1-CG 4.3Å; V170-L174 WeakPolarHBondContact O-CB 3.36Å; V170-L174 VanDerWaalsContact O-CG 3.29Å; V170-L174 WeakPolarHBondContact O-CG 3.48Å; V170-L174 PolarHBondContact O-N 2.87Å |
| 171 | R | 92.1 | Very high | 83.8 | Confident | 139 Ų | 139 | 97.8 Ų | 97.8 | 53% | 0.525 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -63.4 | -44 | 175.4 | -170.4 | -176.4 | -60.8 | 118.1 | 8.6 | 112.1 | V167 D168 T169 L174 S175 | V167-R171 WeakPolarHBondContact O-CB 3.42Å; V167-R171 PolarHBondContact O-N 3.4Å; D168-R171 PolarHBondContact O-N 3.32Å; D168-R171 IonicContact OD1-CZ 3.59Å; D168-R171 IonicContact OD1-NH1 2.65Å; D168-R171 PolarHBondContact OD1-NH1 3.25Å; D168-R171 IonicContact OD1-NH2 3.83Å; T169-R171 VanDerWaalsContact C-N 3.29Å; T169-R171 PolarHBondContact O-N 2.88Å; R171-L174 PolarHBondContact O-N 3.23Å; R171-S175 WeakPolarHBondContact O-CB 3.44Å; R171-S175 PolarHBondContact O-N 2.92Å; R171-S175 PolarHBondContact O-OG 3.2Å |
| 172 | T | 89.5 | Confident | 81.9 | Confident | 75 Ų | 75 | 94 Ų | 94 | 46% | 0.46 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.3 | -44.7 | 176.8 | 51.9 | 0 | 0 | 0 | 0 | 111.2 | D168 T169 L174 S175 D176 | D168-T172 PolarHBondContact O-N 3.48Å; D168-T172 PolarHBondContact O-OG1 2.86Å; T169-T172 PolarHBondContact O-N 2.9Å; T169-T172 PolarHBondContact O-OG1 3.48Å; T172-L174 VanDerWaalsContact C-N 3.32Å; T172-L174 PolarHBondContact O-N 2.89Å; T172-S175 CarbonylContact O-C 3.56Å; T172-S175 PolarHBondContact O-N 3.32Å; T172-D176 VanDerWaalsContact O-CG 3.29Å; T172-D176 PolarHBondContact O-N 3.26Å |
| 173 | R | 87.9 | Confident | 80.4 | Confident | 177 Ų | 177 | 92.6 Ų | 92.6 | 67% | 0.668 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -57.8 | -40.8 | 174.2 | -66.2 | -58.9 | -174.2 | -162.3 | 1.8 | 113.2 | T169 V170 S175 A177 | T169-R173 WeakPolarHBondContact O-CG 3.41Å; T169-R173 PolarHBondContact O-N 3.43Å; V170-R173 PolarHBondContact O-N 3.41Å; R173-S175 VanDerWaalsContact C-N 3.34Å; R173-A177 WeakPolarHBondContact O-CB 3.24Å; R173-A177 PolarHBondContact O-N 2.93Å; R173-A177 VanDerWaalsContact O-N 3.1Å |
| 174 | L | 80.8 | Confident | 79 | Confident | 119 Ų | 119 | 91.8 Ų | 91.8 | 62% | 0.623 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -72.8 | -24.7 | 174.9 | -70.7 | 173.4 | 0 | 0 | 0 | 113.3 | V170 R171 T172 G178 | V170-L174 HydrophobicContact CG1-CD1 3.81Å; V170-L174 HydrophobicContact CG1-CG 4.3Å; V170-L174 WeakPolarHBondContact O-CB 3.36Å; V170-L174 VanDerWaalsContact O-CG 3.29Å; V170-L174 WeakPolarHBondContact O-CG 3.48Å; V170-L174 PolarHBondContact O-N 2.87Å; R171-L174 PolarHBondContact O-N 3.23Å; T172-L174 VanDerWaalsContact C-N 3.32Å; T172-L174 PolarHBondContact O-N 2.89Å; L174-G178 VanDerWaalsContact O-CA 3.28Å; L174-G178 WeakPolarHBondContact O-CA 3.45Å; L174-G178 PolarHBondContact O-N 3.44Å |
| 175 | S | 79.1 | Confident | 77.5 | Confident | 68 Ų | 68 | 86.6 Ų | 86.6 | 48% | 0.476 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -80.7 | -41.2 | 176.4 | -55.7 | 0 | 0 | 0 | 0 | 111.5 | R171 T172 R173 A177 G178 G179 | R171-S175 WeakPolarHBondContact O-CB 3.44Å; R171-S175 PolarHBondContact O-N 2.92Å; R171-S175 PolarHBondContact O-OG 3.2Å; T172-S175 CarbonylContact O-C 3.56Å; T172-S175 PolarHBondContact O-N 3.32Å; R173-S175 VanDerWaalsContact C-N 3.34Å; S175-A177 VanDerWaalsContact C-N 3.35Å; S175-G178 PolarHBondContact O-N 2.95Å; S175-G179 PolarHBondContact O-N 3.06Å |
| 176 | D | 72.3 | Confident | 76.5 | Confident | 119 Ų | 119 | 83.8 Ų | 83.8 | 64% | 0.636 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61.6 | -43.1 | 173.2 | -66.4 | -19.3 | 0 | 0 | 0 | 110.7 | T172 | T172-D176 VanDerWaalsContact O-CG 3.29Å; T172-D176 PolarHBondContact O-N 3.26Å |
| 177 | A | 66.6 | Low | 75.7 | Confident | 66 Ų | 66 | 87.3 Ų | 87.3 | 55% | 0.545 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -72.3 | -39.9 | 174 | 0 | 0 | 0 | 0 | 0 | 112.6 | R173 S175 | R173-A177 WeakPolarHBondContact O-CB 3.24Å; R173-A177 PolarHBondContact O-N 2.93Å; R173-A177 VanDerWaalsContact O-N 3.1Å; S175-A177 VanDerWaalsContact C-N 3.35Å |
| 178 | G | 60.3 | Low | 75.1 | Confident | 39 Ų | 39 | 89.4 Ų | 89.4 | 40% | 0.402 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -81.8 | -9.1 | -173.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | L174 S175 L180 | L174-G178 VanDerWaalsContact O-CA 3.28Å; L174-G178 WeakPolarHBondContact O-CA 3.45Å; L174-G178 PolarHBondContact O-N 3.44Å; S175-G178 PolarHBondContact O-N 2.95Å; G178-L180 PolarHBondContact O-N 3.09Å; G178-L180 VanDerWaalsContact O-N 3.09Å |
| 179 | G | 55.1 | Low | 74.5 | Confident | 60 Ų | 60 | 94.6 Ų | 94.6 | 62% | 0.619 | 53% | 0.534 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.3 | -24.5 | -173.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | S175 | S175-G179 PolarHBondContact O-N 3.06Š|
| 180 | L | 54 | Low | 74.1 | Confident | 182 Ų | 182 | 98.6 Ų | 98.6 | 95% | 0.953 | 55% | 0.547 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -139.4 | -3.7 | 172.8 | -75.3 | 174.3 | 0 | 0 | 0 | 114.2 | G178 | G178-L180 PolarHBondContact O-N 3.09Å; G178-L180 VanDerWaalsContact O-N 3.09Å |
| 181 | S | 54.1 | Low | 73.8 | Confident | 46 Ų | 46 | 100.9 Ų | 100.9 | 32% | 0.322 | 55% | 0.552 | S | S | . | * | trans | -152.5 | 92.6 | -173.3 | 167.1 | 0 | 0 | 0 | 0 | 111.9 | D183 V184 | S181-D183 PolarHBondContact O-N 3.28Å; S181-V184 PolarHBondContact OG-N 3.27Å | ||
| 182 | G | 58.2 | Low | 73.8 | Confident | 59 Ų | 59 | 97.6 Ų | 97.6 | 61% | 0.608 | 55% | 0.545 | S | S | * | . | S | Bend | trans | -68.3 | 87.7 | 152.7 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||
| 183 | D | 66.5 | Low | 74 | Confident | 89 Ų | 89 | 98.2 Ų | 98.2 | 48% | 0.476 | 55% | 0.545 | S | S | . | . | trans | 9.2 | 103.8 | -165.3 | -180 | 32.8 | 0 | 0 | 0 | 116.2 | S181 G185 V186 Q187 | S181-D183 PolarHBondContact O-N 3.28Å; D183-G185 CarbonylContact O-C 3.59Å; D183-G185 PolarHBondContact O-N 2.86Å; D183-G185 WeakPolarHBondContact OD1-CA 3.45Å; D183-G185 PolarHBondContact OD1-N 3.16Å; D183-G185 WeakPolarHBondContact OD2-CA 3.36Å; D183-V186 HydrophobicContact CB-CB 4.19Å; D183-V186 HydrophobicContact CB-CG2 4.41Å; D183-V186 PolarHBondContact O-N 2.82Å; D183-V186 WeakPolarHBondContact OD2-CG2 3.27Å; D183-V186 PolarHBondContact OD2-N 2.87Å; D183-Q187 PolarHBondContact O-N 2.95Å | ||
| 184 | V | 67.5 | Low | 74.1 | Confident | 98 Ų | 98 | 95 Ų | 95 | 59% | 0.594 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -51.6 | -28 | 172.6 | 176.2 | 0 | 0 | 0 | 0 | 112.3 | S181 K188 | S181-V184 PolarHBondContact OG-N 3.27Å; V184-K188 WeakPolarHBondContact O-CB 3.37Å; V184-K188 PolarHBondContact O-N 3.03Å |
| 185 | G | 67.6 | Low | 74.7 | Confident | 24 Ų | 24 | 92.4 Ų | 92.4 | 25% | 0.247 | 53% | 0.53 | C | S | . | . | H | α-helix | trans | -59.9 | -67 | 168.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | D183 Q187 K188 Y189 | D183-G185 CarbonylContact O-C 3.59Å; D183-G185 PolarHBondContact O-N 2.86Å; D183-G185 WeakPolarHBondContact OD1-CA 3.45Å; D183-G185 PolarHBondContact OD1-N 3.16Å; D183-G185 WeakPolarHBondContact OD2-CA 3.36Å; G185-Q187 VanDerWaalsContact C-N 3.33Å; G185-Q187 PolarHBondContact O-N 3.46Å; G185-K188 WeakPolarHBondContact O-CB 3.42Å; G185-K188 PolarHBondContact O-N 3.39Å; G185-K188 VanDerWaalsContact O-N 3.13Å; G185-Y189 WeakPolarHBondContact O-CD2 3.35Å; G185-Y189 PolarHBondContact O-N 3.14Å |
| 186 | V | 76.3 | Confident | 75.5 | Confident | 74 Ų | 74 | 95 Ų | 95 | 45% | 0.448 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -52.3 | -45.8 | 176.1 | 166.4 | 0 | 0 | 0 | 0 | 112.4 | D183 K188 Y189 F190 | D183-V186 HydrophobicContact CB-CB 4.19Å; D183-V186 HydrophobicContact CB-CG2 4.41Å; D183-V186 PolarHBondContact O-N 2.82Å; D183-V186 WeakPolarHBondContact OD2-CG2 3.27Å; D183-V186 PolarHBondContact OD2-N 2.87Å; V186-K188 VanDerWaalsContact C-N 3.32Å; V186-K188 PolarHBondContact O-N 2.91Å; V186-Y189 PolarHBondContact O-N 2.92Å; V186-Y189 VanDerWaalsContact O-N 3.17Å; V186-F190 HydrophobicContact CG1-CD2 3.95Å; V186-F190 HydrophobicContact CG1-CE2 3.94Å; V186-F190 WeakPolarHBondContact O-CD2 3.36Å; V186-F190 PolarHBondContact O-N 3.39Å |
| 187 | Q | 79.7 | Confident | 76.4 | Confident | 125 Ų | 125 | 92.9 Ų | 92.9 | 58% | 0.584 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -63.6 | -38.6 | 179.5 | -172.1 | 171.5 | 1.3 | 0 | 0 | 111.9 | D183 G185 F190 Q191 | D183-Q187 PolarHBondContact O-N 2.95Å; G185-Q187 VanDerWaalsContact C-N 3.33Å; G185-Q187 PolarHBondContact O-N 3.46Å; Q187-F190 PolarHBondContact O-N 3.25Å; Q187-Q191 PolarHBondContact O-N 2.94Å |
| 188 | K | 83.8 | Confident | 77.7 | Confident | 126 Ų | 126 | 95 Ų | 95 | 55% | 0.548 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.3 | -44.4 | 172.1 | 179.6 | -174.6 | 171.5 | -170.8 | 0 | 111.7 | V184 G185 V186 F190 Q191 D192 | V184-K188 WeakPolarHBondContact O-CB 3.37Å; V184-K188 PolarHBondContact O-N 3.03Å; G185-K188 WeakPolarHBondContact O-CB 3.42Å; G185-K188 PolarHBondContact O-N 3.39Å; G185-K188 VanDerWaalsContact O-N 3.13Å; V186-K188 VanDerWaalsContact C-N 3.32Å; V186-K188 PolarHBondContact O-N 2.91Å; K188-F190 VanDerWaalsContact C-N 3.32Å; K188-F190 PolarHBondContact O-N 3.17Å; K188-Q191 PolarHBondContact O-N 3.33Å; K188-D192 WeakPolarHBondContact CE-OD2 3.35Å; K188-D192 PolarHBondContact O-N 3.21Å |
| 189 | Y | 83.5 | Confident | 79.4 | Confident | 160 Ų | 160 | 99.7 Ų | 99.7 | 63% | 0.627 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -59.2 | -41.3 | 178.2 | -72.8 | -62.8 | 0 | 0 | 0 | 112.2 | G185 V186 Q191 D192 I193 | G185-Y189 WeakPolarHBondContact O-CD2 3.35Å; G185-Y189 PolarHBondContact O-N 3.14Å; V186-Y189 PolarHBondContact O-N 2.92Å; V186-Y189 VanDerWaalsContact O-N 3.17Å; Y189-Q191 VanDerWaalsContact C-N 3.32Å; Y189-Q191 PolarHBondContact O-N 2.92Å; Y189-D192 PolarHBondContact O-N 2.98Å; Y189-I193 WeakPolarHBondContact O-CB 3.24Å; Y189-I193 WeakPolarHBondContact O-CD1 3.43Å; Y189-I193 WeakPolarHBondContact O-CG1 3.32Å; Y189-I193 PolarHBondContact O-N 2.91Å |
| 190 | F | 86.6 | Confident | 81.3 | Confident | 139 Ų | 139 | 101.9 Ų | 101.9 | 61% | 0.61 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -59.9 | -40.1 | 172.3 | -89.3 | -77.1 | 0 | 0 | 0 | 112.8 | V186 Q187 K188 N194 | V186-F190 HydrophobicContact CG1-CD2 3.95Å; V186-F190 HydrophobicContact CG1-CE2 3.94Å; V186-F190 WeakPolarHBondContact O-CD2 3.36Å; V186-F190 PolarHBondContact O-N 3.39Å; Q187-F190 PolarHBondContact O-N 3.25Å; K188-F190 VanDerWaalsContact C-N 3.32Å; K188-F190 PolarHBondContact O-N 3.17Å; F190-N194 PolarHBondContact O-N 2.89Å |
| 191 | Q | 87.8 | Confident | 83.1 | Confident | 135 Ų | 135 | 98.5 Ų | 98.5 | 63% | 0.631 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -72.9 | -38.1 | -179.9 | -167 | 145.6 | 52.3 | 0 | 0 | 112.7 | Q187 K188 Y189 T195 | Q187-Q191 PolarHBondContact O-N 2.94Å; K188-Q191 PolarHBondContact O-N 3.33Å; Y189-Q191 VanDerWaalsContact C-N 3.32Å; Y189-Q191 PolarHBondContact O-N 2.92Å; Q191-T195 WeakPolarHBondContact O-CB 3.4Å; Q191-T195 PolarHBondContact O-N 3.32Å; Q191-T195 PolarHBondContact O-OG1 2.96Å |
| 192 | D | 92.5 | Very high | 85 | Confident | 69 Ų | 69 | 99.6 Ų | 99.6 | 37% | 0.369 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -65.4 | -41.8 | 172.7 | -78.2 | -28.3 | 0 | 0 | 0 | 111.2 | K188 Y189 T195 Q196 | K188-D192 WeakPolarHBondContact CE-OD2 3.35Å; K188-D192 PolarHBondContact O-N 3.21Å; Y189-D192 PolarHBondContact O-N 2.98Å; D192-T195 PolarHBondContact O-N 3.49Å; D192-Q196 WeakPolarHBondContact O-CG 3.35Å; D192-Q196 PolarHBondContact O-N 3.47Å |
| 193 | I | 93.1 | Very high | 86.7 | Confident | 89 Ų | 89 | 102.6 Ų | 102.6 | 46% | 0.456 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.1 | -49 | 176.5 | -71.7 | 164.7 | 0 | 0 | 0 | 111.4 | Y189 T195 Q196 N197 | Y189-I193 WeakPolarHBondContact O-CB 3.24Å; Y189-I193 WeakPolarHBondContact O-CD1 3.43Å; Y189-I193 WeakPolarHBondContact O-CG1 3.32Å; Y189-I193 PolarHBondContact O-N 2.91Å; I193-T195 VanDerWaalsContact C-N 3.26Å; I193-T195 PolarHBondContact O-N 3.1Å; I193-Q196 PolarHBondContact O-N 3.38Å; I193-N197 PolarHBondContact O-N 2.78Å |
| 194 | N | 90.6 | Very high | 88 | Confident | 109 Ų | 109 | 103.4 Ų | 103.4 | 58% | 0.583 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -60.6 | -37.4 | 175.3 | -88.9 | -12.5 | 0 | 0 | 0 | 112 | F190 Q196 N197 H198 | F190-N194 PolarHBondContact O-N 2.89Å; N194-Q196 VanDerWaalsContact C-N 3.29Å; N194-Q196 PolarHBondContact O-N 3.28Å; N194-N197 PolarHBondContact O-N 3.26Å; N194-H198 PolarHBondContact O-N 2.74Å |
| 195 | T | 94.1 | Very high | 89.1 | Confident | 65 Ų | 65 | 102.8 Ų | 102.8 | 40% | 0.399 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -66.9 | -29.2 | 175.7 | -57.8 | 0 | 0 | 0 | 0 | 112.5 | Q191 D192 I193 K199 | Q191-T195 WeakPolarHBondContact O-CB 3.4Å; Q191-T195 PolarHBondContact O-N 3.32Å; Q191-T195 PolarHBondContact O-OG1 2.96Å; D192-T195 PolarHBondContact O-N 3.49Å; I193-T195 VanDerWaalsContact C-N 3.26Å; I193-T195 PolarHBondContact O-N 3.1Å; T195-K199 WeakPolarHBondContact O-CD 3.28Å; T195-K199 VanDerWaalsContact O-CG 3.27Å; T195-K199 WeakPolarHBondContact O-CG 3.37Å |
| 196 | Q | 94.8 | Very high | 90.1 | Very high | 123 Ų | 123 | 106.3 Ų | 106.3 | 58% | 0.575 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -77.7 | -44.4 | 172.6 | -71.6 | -177.5 | 25.7 | 0 | 0 | 112.1 | D192 I193 N194 H198 K199 L200 | D192-Q196 WeakPolarHBondContact O-CG 3.35Å; D192-Q196 PolarHBondContact O-N 3.47Å; I193-Q196 PolarHBondContact O-N 3.38Å; N194-Q196 VanDerWaalsContact C-N 3.29Å; N194-Q196 PolarHBondContact O-N 3.28Å; Q196-H198 VanDerWaalsContact C-N 3.32Å; Q196-H198 PolarHBondContact O-N 2.97Å; Q196-K199 WeakPolarHBondContact O-CB 3.26Å; Q196-K199 PolarHBondContact O-N 3.03Å; Q196-L200 WeakPolarHBondContact O-CG 3.46Å; Q196-L200 PolarHBondContact O-N 3.33Å |
| 197 | N | 91.3 | Very high | 90.6 | Very high | 73 Ų | 73 | 108.2 Ų | 108.2 | 39% | 0.39 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -55.4 | -46.9 | 175.2 | -75.3 | -11.9 | 0 | 0 | 0 | 111.3 | I193 N194 K199 L200 E201 | I193-N197 PolarHBondContact O-N 2.78Å; N194-N197 PolarHBondContact O-N 3.26Å; N197-K199 VanDerWaalsContact C-N 3.26Å; N197-K199 PolarHBondContact O-N 2.69Å; N197-L200 CarbonylContact O-C 3.6Å; N197-L200 WeakPolarHBondContact O-CA 3.34Å; N197-L200 WeakPolarHBondContact O-CB 3.48Å; N197-L200 PolarHBondContact O-N 2.66Å; N197-E201 WeakPolarHBondContact O-CG 3.37Å; N197-E201 PolarHBondContact O-N 3.17Å |
| 198 | H | 95.1 | Very high | 90.9 | Very high | 112 Ų | 112 | 107.8 Ų | 107.8 | 52% | 0.519 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -66.9 | -25 | 179.4 | -164.2 | 54.4 | 0 | 0 | 0 | 114.1 | N194 Q196 E201 N202 | N194-H198 PolarHBondContact O-N 2.74Å; Q196-H198 VanDerWaalsContact C-N 3.32Å; Q196-H198 PolarHBondContact O-N 2.97Å; H198-E201 WeakPolarHBondContact CA-OE2 3.43Å; H198-E201 IonicContact CE1-OE2 3.78Å; H198-E201 IonicContact CG-OE2 3.72Å; H198-E201 IonicContact ND1-OE2 2.8Å; H198-E201 PolarHBondContact ND1-OE2 3.45Å; H198-N202 PolarHBondContact CE1-ND2 3.42Å; H198-N202 PolarHBondContact NE2-ND2 3.04Å; H198-N202 WeakPolarHBondContact O-CB 3.49Å; H198-N202 PolarHBondContact O-N 2.8Å; H198-N202 VanDerWaalsContact O-N 3.11Å; H198-N202 PolarHBondContact O-ND2 3.03Å |
| 199 | K | 95.8 | Very high | 91 | Very high | 137 Ų | 137 | 106.9 Ų | 106.9 | 60% | 0.596 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -74.1 | -36.6 | 170.1 | -71.6 | 167.9 | -174.3 | 173.5 | 0 | 111.9 | T195 Q196 N197 L203 | T195-K199 WeakPolarHBondContact O-CD 3.28Å; T195-K199 VanDerWaalsContact O-CG 3.27Å; T195-K199 WeakPolarHBondContact O-CG 3.37Å; Q196-K199 WeakPolarHBondContact O-CB 3.26Å; Q196-K199 PolarHBondContact O-N 3.03Å; N197-K199 VanDerWaalsContact C-N 3.26Å; N197-K199 PolarHBondContact O-N 2.69Å; K199-L203 VanDerWaalsContact O-CB 3.32Å; K199-L203 WeakPolarHBondContact O-CB 3.37Å; K199-L203 PolarHBondContact O-N 3.2Å |
| 200 | L | 94.8 | Very high | 90.9 | Very high | 105 Ų | 105 | 102.1 Ų | 102.1 | 55% | 0.55 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -68.6 | -42 | 174.6 | -67.5 | 170.5 | 0 | 0 | 0 | 111.4 | Q196 N197 L203 L204 | Q196-L200 WeakPolarHBondContact O-CG 3.46Å; Q196-L200 PolarHBondContact O-N 3.33Å; N197-L200 CarbonylContact O-C 3.6Å; N197-L200 WeakPolarHBondContact O-CA 3.34Å; N197-L200 WeakPolarHBondContact O-CB 3.48Å; N197-L200 PolarHBondContact O-N 2.66Å; L200-L203 PolarHBondContact O-N 3.41Å; L200-L204 VanDerWaalsContact O-CB 3.28Å; L200-L204 WeakPolarHBondContact O-CB 3.27Å; L200-L204 PolarHBondContact O-N 3.41Å |
| 201 | E | 92.7 | Very high | 90.2 | Very high | 112 Ų | 112 | 101.7 Ų | 101.7 | 52% | 0.523 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -56.3 | -49.8 | 171 | -71.2 | 165.1 | -175.6 | 0 | 0 | 111.3 | N197 H198 L203 L204 L205 | N197-E201 WeakPolarHBondContact O-CG 3.37Å; N197-E201 PolarHBondContact O-N 3.17Å; H198-E201 WeakPolarHBondContact CA-OE2 3.43Å; H198-E201 IonicContact CE1-OE2 3.78Å; H198-E201 IonicContact CG-OE2 3.72Å; H198-E201 IonicContact ND1-OE2 2.8Å; H198-E201 PolarHBondContact ND1-OE2 3.45Å; E201-L203 PolarHBondContact O-N 3.01Å; E201-L204 PolarHBondContact O-N 3.01Å; E201-L205 WeakPolarHBondContact O-CB 3.36Å; E201-L205 PolarHBondContact O-N 2.87Å |
| 202 | N | 92.9 | Very high | 89.4 | Confident | 69 Ų | 69 | 98 Ų | 98 | 37% | 0.369 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.2 | -42 | 175.7 | -90.6 | -90.2 | 0 | 0 | 0 | 112.3 | H198 L205 N206 | H198-N202 PolarHBondContact CE1-ND2 3.42Å; H198-N202 PolarHBondContact NE2-ND2 3.04Å; H198-N202 WeakPolarHBondContact O-CB 3.49Å; H198-N202 PolarHBondContact O-N 2.8Å; H198-N202 VanDerWaalsContact O-N 3.11Å; H198-N202 PolarHBondContact O-ND2 3.03Å; N202-L205 PolarHBondContact O-N 3.45Å; N202-N206 WeakPolarHBondContact O-CB 3.45Å; N202-N206 PolarHBondContact O-N 3.28Å; N202-N206 PolarHBondContact O-ND2 3.41Å |
| 203 | L | 94.5 | Very high | 87.9 | Confident | 121 Ų | 121 | 96.7 Ų | 96.7 | 63% | 0.634 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -64.4 | -41.9 | 178.8 | -176.7 | 64.4 | 0 | 0 | 0 | 111.4 | K199 L200 E201 N206 M207 | K199-L203 VanDerWaalsContact O-CB 3.32Å; K199-L203 WeakPolarHBondContact O-CB 3.37Å; K199-L203 PolarHBondContact O-N 3.2Å; L200-L203 PolarHBondContact O-N 3.41Å; E201-L203 PolarHBondContact O-N 3.01Å; L203-N206 PolarHBondContact O-N 2.82Å; L203-M207 WeakPolarHBondContact O-CB 3.43Å; L203-M207 PolarHBondContact O-N 2.85Å |
| 204 | L | 92.8 | Very high | 86.2 | Confident | 107 Ų | 107 | 98 Ų | 98 | 56% | 0.56 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -66.2 | -44.1 | 177.6 | -173.7 | 141.8 | 0 | 0 | 0 | 111.5 | L200 E201 N206 M207 E208 | L200-L204 VanDerWaalsContact O-CB 3.28Å; L200-L204 WeakPolarHBondContact O-CB 3.27Å; L200-L204 PolarHBondContact O-N 3.41Å; E201-L204 PolarHBondContact O-N 3.01Å; L204-N206 PolarHBondContact O-N 2.93Å; L204-M207 WeakPolarHBondContact O-CB 3.47Å; L204-M207 PolarHBondContact O-N 3.38Å; L204-E208 WeakPolarHBondContact O-CB 3.5Å; L204-E208 PolarHBondContact O-N 2.94Å |
| 205 | L | 90.5 | Very high | 84.4 | Confident | 85 Ų | 85 | 96 Ų | 96 | 45% | 0.445 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -60.9 | -43.3 | 174.2 | -179.9 | 64.9 | 0 | 0 | 0 | 112.1 | E201 N202 M207 E208 I209 | E201-L205 WeakPolarHBondContact O-CB 3.36Å; E201-L205 PolarHBondContact O-N 2.87Å; N202-L205 PolarHBondContact O-N 3.45Å; L205-M207 VanDerWaalsContact C-N 3.33Å; L205-M207 PolarHBondContact O-N 3.28Å; L205-E208 PolarHBondContact O-N 3.45Å; L205-I209 HydrophobicContact CD1-CD1 4.24Å; L205-I209 HydrophobicContact CG-CD1 4.05Å; L205-I209 WeakPolarHBondContact O-CD1 3.25Å; L205-I209 VanDerWaalsContact O-CG1 3.25Å; L205-I209 WeakPolarHBondContact O-CG1 3.24Å; L205-I209 PolarHBondContact O-N 3.17Å |
| 206 | N | 89.8 | Confident | 82.4 | Confident | 97 Ų | 97 | 99.3 Ų | 99.3 | 52% | 0.519 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.7 | -36.1 | 175.9 | -80 | -74.2 | 0 | 0 | 0 | 112.1 | N202 L203 L204 A210 | N202-N206 WeakPolarHBondContact O-CB 3.45Å; N202-N206 PolarHBondContact O-N 3.28Å; N202-N206 PolarHBondContact O-ND2 3.41Å; L203-N206 PolarHBondContact O-N 2.82Å; L204-N206 PolarHBondContact O-N 2.93Å; N206-A210 WeakPolarHBondContact O-CB 3.5Å; N206-A210 PolarHBondContact O-N 3.48Å |
| 207 | M | 85.9 | Confident | 80.3 | Confident | 115 Ų | 115 | 102.8 Ų | 102.8 | 57% | 0.567 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -67.6 | -42.3 | 174.4 | -175.5 | 178.2 | 69.6 | 0 | 0 | 111.9 | L203 L204 L205 A210 Q211 | L203-M207 WeakPolarHBondContact O-CB 3.43Å; L203-M207 PolarHBondContact O-N 2.85Å; L204-M207 WeakPolarHBondContact O-CB 3.47Å; L204-M207 PolarHBondContact O-N 3.38Å; L205-M207 VanDerWaalsContact C-N 3.33Å; L205-M207 PolarHBondContact O-N 3.28Å; M207-A210 PolarHBondContact O-N 3.15Å; M207-Q211 WeakPolarHBondContact O-CB 3.25Å; M207-Q211 PolarHBondContact O-N 3.2Å |
| 208 | E | 87 | Confident | 78.5 | Confident | 115 Ų | 115 | 106.2 Ų | 106.2 | 54% | 0.537 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -60.9 | -45.7 | 175.6 | -177.4 | 175.9 | -160.8 | 0 | 0 | 111.5 | L204 L205 A210 Q211 A212 | L204-E208 WeakPolarHBondContact O-CB 3.5Å; L204-E208 PolarHBondContact O-N 2.94Å; L205-E208 PolarHBondContact O-N 3.45Å; E208-A210 PolarHBondContact O-N 2.91Å; E208-Q211 PolarHBondContact O-N 3.24Å; E208-A212 WeakPolarHBondContact O-CB 3.31Å; E208-A212 PolarHBondContact O-N 3.47Å |
| 209 | I | 84.3 | Confident | 76.2 | Confident | 107 Ų | 107 | 105.1 Ų | 105.1 | 55% | 0.549 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -61.1 | -43.2 | 175 | -68.7 | 164.7 | 0 | 0 | 0 | 111.1 | L205 A212 G213 | L205-I209 HydrophobicContact CD1-CD1 4.24Å; L205-I209 HydrophobicContact CG-CD1 4.05Å; L205-I209 WeakPolarHBondContact O-CD1 3.25Å; L205-I209 VanDerWaalsContact O-CG1 3.25Å; L205-I209 WeakPolarHBondContact O-CG1 3.24Å; L205-I209 PolarHBondContact O-N 3.17Å; I209-A212 PolarHBondContact O-N 3.07Å; I209-G213 PolarHBondContact O-N 2.95Å; I209-G213 VanDerWaalsContact O-N 3.08Å |
| 210 | A | 81.7 | Confident | 73.9 | Confident | 61 Ų | 61 | 104.7 Ų | 104.7 | 50% | 0.504 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -64.9 | -38.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | N206 M207 E208 G213 L214 | N206-A210 WeakPolarHBondContact O-CB 3.5Å; N206-A210 PolarHBondContact O-N 3.48Å; M207-A210 PolarHBondContact O-N 3.15Å; E208-A210 PolarHBondContact O-N 2.91Å; A210-G213 PolarHBondContact O-N 3Å; A210-L214 PolarHBondContact O-N 3.33Å |
| 211 | Q | 72.5 | Confident | 71.3 | Confident | 129 Ų | 129 | 107.7 Ų | 107.7 | 60% | 0.603 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -70.3 | -39.8 | 177.8 | -169 | 171.6 | 9.2 | 0 | 0 | 112 | M207 E208 G213 L214 A215 | M207-Q211 WeakPolarHBondContact O-CB 3.25Å; M207-Q211 PolarHBondContact O-N 3.2Å; E208-Q211 PolarHBondContact O-N 3.24Å; Q211-G213 VanDerWaalsContact C-N 3.28Å; Q211-G213 PolarHBondContact O-N 3.04Å; Q211-L214 PolarHBondContact O-N 3.25Å; Q211-L214 VanDerWaalsContact O-N 3.08Å; Q211-A215 PolarHBondContact O-N 3.07Å |
| 212 | A | 70.4 | Confident | 69.1 | Low | 57 Ų | 57 | 106.3 Ų | 106.3 | 47% | 0.471 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -60.7 | -37 | 171.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | E208 I209 L214 A215 N216 | E208-A212 WeakPolarHBondContact O-CB 3.31Å; E208-A212 PolarHBondContact O-N 3.47Å; I209-A212 PolarHBondContact O-N 3.07Å; A212-L214 PolarHBondContact O-N 2.95Å; A212-A215 PolarHBondContact O-N 3.01Å; A212-N216 PolarHBondContact O-N 2.76Å |
| 213 | G | 62.4 | Low | 66.5 | Low | 43 Ų | 43 | 109.8 Ų | 109.8 | 44% | 0.443 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -66 | -16.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | I209 A210 Q211 R217 | I209-G213 PolarHBondContact O-N 2.95Å; I209-G213 VanDerWaalsContact O-N 3.08Å; A210-G213 PolarHBondContact O-N 3Å; Q211-G213 VanDerWaalsContact C-N 3.28Å; Q211-G213 PolarHBondContact O-N 3.04Å; G213-R217 PolarHBondContact O-NE 3.3Å |
| 214 | L | 56.6 | Low | 63.7 | Low | 117 Ų | 117 | 113.1 Ų | 113.1 | 61% | 0.613 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -97.2 | -40.9 | 172.2 | -73.5 | 167.3 | 0 | 0 | 0 | 112 | A210 Q211 A212 N216 R217 | A210-L214 PolarHBondContact O-N 3.33Å; Q211-L214 PolarHBondContact O-N 3.25Å; Q211-L214 VanDerWaalsContact O-N 3.08Å; A212-L214 PolarHBondContact O-N 2.95Å; L214-N216 PolarHBondContact O-N 3.29Å; L214-R217 PolarHBondContact O-N 3.41Å |
| 215 | A | 52.9 | Low | 61.8 | Low | 67 Ų | 67 | 112.7 Ų | 112.7 | 55% | 0.554 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -55.6 | -40 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q211 A212 R217 N218 | Q211-A215 PolarHBondContact O-N 3.07Å; A212-A215 PolarHBondContact O-N 3.01Å; A215-R217 PolarHBondContact O-N 2.8Å; A215-N218 PolarHBondContact O-N 2.92Å |
| 216 | N | 51.6 | Low | 59.2 | Low | 133 Ų | 133 | 115 Ų | 115 | 71% | 0.711 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74 | 16.5 | 178 | -160.3 | 25.1 | 0 | 0 | 0 | 114.8 | A212 L214 | A212-N216 PolarHBondContact O-N 2.76Å; L214-N216 PolarHBondContact O-N 3.29Å |
| 217 | R | 52 | Low | 56.8 | Low | 197 Ų | 197 | 117.8 Ų | 117.8 | 74% | 0.743 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.6 | -15.1 | 173.2 | -62.4 | -176.9 | -175 | -105.2 | 0.8 | 113.9 | G213 L214 A215 | G213-R217 PolarHBondContact O-NE 3.3Å; L214-R217 PolarHBondContact O-N 3.41Å; A215-R217 PolarHBondContact O-N 2.8Å |
| 218 | N | 53.4 | Low | 54.7 | Low | 145 Ų | 145 | 118.1 Ų | 118.1 | 78% | 0.775 | 68% | 0.675 | S | S | * | * | S | Bend | trans | -108.1 | 16.5 | -169.1 | -80.9 | 51.5 | 0 | 0 | 0 | 114.1 | A215 | A215-N218 PolarHBondContact O-N 2.92Š|
| 219 | C | 46.6 | Very low | 52.4 | Low | 88 Ų | 88 | 117 Ų | 117 | 60% | 0.595 | 69% | 0.685 | S | S | * | * | S | Bend | trans | -118 | 17.2 | -179 | 56.3 | 0 | 0 | 0 | 0 | 114.2 | ||
| 220 | N | 47.7 | Very low | 50.1 | Low | 129 Ų | 129 | 118.8 Ų | 118.8 | 69% | 0.69 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -133.6 | 74.7 | 171.6 | -65.2 | -71.6 | 0 | 0 | 0 | 110.2 | ||
| 221 | D | 38.7 | Very low | 48.2 | Very low | 167 Ų | 167 | 119.4 Ų | 119.4 | 89% | 0.893 | 71% | 0.709 | S | S | * | * | S | Bend | trans | 171.9 | 154.5 | 134.9 | -94.8 | -34.9 | 0 | 0 | 0 | 113.4 | ||
| 222 | A | 47.6 | Very low | 47 | Very low | 84 Ų | 84 | 118.3 Ų | 118.3 | 69% | 0.694 | 71% | 0.711 | S | S | * | * | trans | 65.4 | 75.8 | 157.7 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 223 | D | 38.7 | Very low | 45.7 | Very low | 142 Ų | 142 | 124.4 Ų | 124.4 | 76% | 0.759 | 73% | 0.729 | S | S | * | * | 46.3 | 130.9 | 115.2 | -67.9 | -55.5 | 0 | 0 | 0 | 124.8 | |||||
| 224 | F | 34.8 | Very low | 44.5 | Very low | 191 Ų | 191 | 129.8 Ų | 129.8 | 84% | 0.838 | 75% | 0.748 | S | S | * | * | trans | 80.7 | 155.4 | 141.2 | -89.2 | -113.8 | 0 | 0 | 0 | 120.4 | ||||
| 225 | P | 52.1 | Low | 44.1 | Very low | 98 Ų | 98 | 130.1 Ų | 130.1 | 64% | 0.636 | 76% | 0.76 | S | S | * | * | trans | -127.5 | 170.4 | -134 | 44.6 | -34.1 | 0 | 0 | 0 | 116.7 | ||||
| 226 | C | 36.3 | Very low | 43.6 | Very low | 133 Ų | 133 | 130.5 Ų | 130.5 | 90% | 0.899 | 77% | 0.771 | S | S | * | * | trans | -103.9 | 122.6 | 162.9 | -74.6 | 0 | 0 | 0 | 0 | 112 | ||||
| 227 | L | 40.6 | Very low | 42.5 | Very low | 156 Ų | 156 | 134 Ų | 134 | 82% | 0.817 | 78% | 0.78 | S | S | * | * | trans | -102.8 | 172.8 | 159 | -71.5 | 171.6 | 0 | 0 | 0 | 109.2 | ||||
| 228 | S | 40.9 | Very low | 42.2 | Very low | 122 Ų | 122 | 129.7 Ų | 129.7 | 85% | 0.853 | 78% | 0.775 | S | S | * | * | trans | 74.8 | 139.7 | 177.1 | -64.4 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 229 | A | 37.8 | Very low | 41.4 | Very low | 90 Ų | 90 | 128 Ų | 128 | 74% | 0.744 | 77% | 0.774 | S | S | * | * | cis | -153 | 157.4 | -8.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 230 | D | 37.2 | Very low | 41 | Very low | 145 Ų | 145 | 129.7 Ų | 129.7 | 78% | 0.775 | 79% | 0.785 | S | S | * | * | trans | 3.3 | 138.2 | 147.5 | -163.5 | 5.1 | 0 | 0 | 0 | 119.3 | T232 | D230-T232 PolarHBondContact OD1-OG1 3.26Š| ||
| 231 | G | 41.8 | Very low | 40.3 | Very low | 75 Ų | 75 | 126.9 Ų | 126.9 | 77% | 0.773 | 79% | 0.786 | S | S | * | * | trans | -170.3 | 53.2 | -173 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q233 | G231-Q233 PolarHBondContact O-N 3.32Š| ||
| 232 | T | 46.6 | Very low | 40.5 | Very low | 105 Ų | 105 | 128 Ų | 128 | 64% | 0.644 | 79% | 0.786 | S | S | * | * | trans | -51 | 121.7 | -175.4 | -54.2 | 0 | 0 | 0 | 0 | 114.4 | D230 | D230-T232 PolarHBondContact OD1-OG1 3.26Š| ||
| 233 | Q | 43.9 | Very low | 40.2 | Very low | 186 Ų | 186 | 131.2 Ų | 131.2 | 87% | 0.869 | 79% | 0.792 | S | S | * | * | -174.6 | 143.8 | 123.1 | -101.2 | 151.2 | 114.5 | 0 | 0 | 115.3 | G231 | G231-Q233 PolarHBondContact O-N 3.32Š| |||
| 234 | D | 37.3 | Very low | 40.5 | Very low | 156 Ų | 156 | 129.9 Ų | 129.9 | 83% | 0.834 | 79% | 0.794 | S | S | * | * | trans | 47.6 | 89.6 | 152.4 | -159 | 19.4 | 0 | 0 | 0 | 120.5 | ||||
| 235 | S | 47.3 | Very low | 41.3 | Very low | 124 Ų | 124 | 126.7 Ų | 126.7 | 87% | 0.867 | 79% | 0.79 | S | S | * | * | -158.3 | 130.6 | 128.9 | 50 | 0 | 0 | 0 | 0 | 110.7 | |||||
| 236 | G | 42.8 | Very low | 41.3 | Very low | 75 Ų | 75 | 125.8 Ų | 125.8 | 77% | 0.773 | 78% | 0.783 | S | S | * | * | trans | 159.6 | 84.1 | 171.5 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 237 | F | 29.2 | Very low | 42.7 | Very low | 207 Ų | 207 | 122.7 Ų | 122.7 | 91% | 0.908 | 76% | 0.763 | S | S | * | * | -156.2 | 154.2 | 119.6 | -163.8 | -106.5 | 0 | 0 | 0 | 111.4 | |||||
| 238 | V | 45.6 | Very low | 43.5 | Very low | 106 Ų | 106 | 125.3 Ų | 125.3 | 64% | 0.642 | 76% | 0.762 | S | S | * | * | trans | -109.6 | 151.2 | -160.6 | 168 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 239 | C | 35.8 | Very low | 44.4 | Very low | 110 Ų | 110 | 122.5 Ų | 122.5 | 74% | 0.743 | 75% | 0.747 | S | S | * | * | trans | 88.8 | 139.6 | 153.5 | -97.6 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 240 | C | 39.1 | Very low | 45.3 | Very low | 122 Ų | 122 | 122.3 Ų | 122.3 | 82% | 0.824 | 73% | 0.733 | S | S | * | * | trans | 69.5 | 100.3 | 144.2 | -64 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 241 | G | 33 | Very low | 46.6 | Very low | 70 Ų | 70 | 120.6 Ų | 120.6 | 72% | 0.722 | 72% | 0.723 | S | S | * | * | trans | -159.2 | 72.9 | 162.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | N243 | G241-N243 PolarHBondContact O-N 3.31Š| ||
| 242 | E | 42.9 | Very low | 47.7 | Very low | 190 Ų | 190 | 122.3 Ų | 122.3 | 89% | 0.888 | 71% | 0.714 | S | S | * | * | trans | -64.9 | 106 | -178.7 | -71.3 | 170.3 | 103.6 | 0 | 0 | 111.4 | ||||
| 243 | N | 41.4 | Very low | 48.7 | Very low | 152 Ų | 152 | 123.6 Ų | 123.6 | 81% | 0.813 | 72% | 0.716 | S | S | * | * | trans | -141.3 | 63.5 | 163.8 | -85.2 | -61.1 | 0 | 0 | 0 | 108.3 | G241 V245 | G241-N243 PolarHBondContact O-N 3.31Å; N243-V245 PolarHBondContact O-N 3.28Å | ||
| 244 | S | 44.1 | Very low | 49.9 | Very low | 115 Ų | 115 | 121.1 Ų | 121.1 | 80% | 0.804 | 71% | 0.705 | S | S | * | * | trans | -69.5 | 96.3 | 171.1 | -163.7 | 0 | 0 | 0 | 0 | 108.3 | P246 | S244-P246 WeakPolarHBondContact O-CD 3.37Š| ||
| 245 | V | 51.6 | Low | 51.2 | Low | 124 Ų | 124 | 116.3 Ų | 116.3 | 75% | 0.752 | 69% | 0.687 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 120.8 | 167.8 | -176.5 | 0 | 0 | 0 | 0 | 106.3 | N243 S247 | N243-V245 PolarHBondContact O-N 3.28Å; V245-S247 PolarHBondContact O-N 2.89Å |
| 246 | P | 52.2 | Low | 52.2 | Low | 78 Ų | 78 | 113 Ų | 113 | 51% | 0.506 | 67% | 0.667 | S | S | . | * | P | Polyproline II helix | trans | -53.2 | 131.5 | -173.9 | -28.2 | 35.2 | 0 | 0 | 0 | 110.7 | S244 D250 L251 | S244-P246 WeakPolarHBondContact O-CD 3.37Å; P246-D250 HydrophobicContact CB-CB 4.36Å; P246-L251 HydrophobicContact CB-CD1 4.07Å |
| 247 | S | 65.5 | Low | 53.6 | Low | 68 Ų | 68 | 116.9 Ų | 116.9 | 48% | 0.476 | 66% | 0.66 | S | S | . | * | P | Polyproline II helix | trans | -62.5 | 153.3 | -179.3 | -174.9 | 0 | 0 | 0 | 0 | 109 | V245 A249 D250 L251 | V245-S247 PolarHBondContact O-N 2.89Å; S247-A249 PolarHBondContact O-N 3.44Å; S247-D250 WeakPolarHBondContact CA-OD2 3.5Å; S247-D250 VanDerWaalsContact CB-OD2 3.23Å; S247-D250 WeakPolarHBondContact CB-OD2 3.42Å; S247-D250 PolarHBondContact N-OD2 3.31Å; S247-D250 PolarHBondContact O-N 2.88Å; S247-L251 PolarHBondContact O-N 3.37Å |
| 248 | R | 57 | Low | 55.2 | Low | 212 Ų | 212 | 111.5 Ų | 111.5 | 80% | 0.8 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -58.1 | -19.8 | 174 | -179.6 | 171.7 | 166.7 | 171 | -4.2 | 112.2 | L252 | R248-L252 HydrophobicContact CG-CD1 4.4Å; R248-L252 WeakPolarHBondContact O-CD1 3.15Å; R248-L252 VanDerWaalsContact O-CG 3.25Å; R248-L252 WeakPolarHBondContact O-CG 3.49Å |
| 249 | A | 59.8 | Low | 56.1 | Low | 63 Ų | 63 | 110.1 Ų | 110.1 | 52% | 0.521 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -69.7 | -45.2 | 169.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | S247 L252 L253 | S247-A249 PolarHBondContact O-N 3.44Å; A249-L252 PolarHBondContact O-N 2.9Å; A249-L252 VanDerWaalsContact O-N 3.15Å; A249-L253 PolarHBondContact O-N 3.26Å |
| 250 | D | 57.4 | Low | 57.4 | Low | 85 Ų | 85 | 111.9 Ų | 111.9 | 46% | 0.455 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -65.9 | -45.9 | -174.8 | -50.5 | -41.5 | 0 | 0 | 0 | 111 | P246 S247 L252 L253 E254 | P246-D250 HydrophobicContact CB-CB 4.36Å; S247-D250 WeakPolarHBondContact CA-OD2 3.5Å; S247-D250 VanDerWaalsContact CB-OD2 3.23Å; S247-D250 WeakPolarHBondContact CB-OD2 3.42Å; S247-D250 PolarHBondContact N-OD2 3.31Å; S247-D250 PolarHBondContact O-N 2.88Å; D250-L252 PolarHBondContact O-N 3.5Å; D250-L253 PolarHBondContact O-N 3.09Å; D250-L253 VanDerWaalsContact O-N 3.1Å; D250-E254 PolarHBondContact O-N 2.9Å |
| 251 | L | 64.4 | Low | 58.5 | Low | 109 Ų | 109 | 111.1 Ų | 111.1 | 57% | 0.571 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -59.1 | -30.7 | 173.6 | -93.1 | 130.2 | 0 | 0 | 0 | 113.5 | P246 S247 A255 | P246-L251 HydrophobicContact CB-CD1 4.07Å; S247-L251 PolarHBondContact O-N 3.37Å; L251-A255 WeakPolarHBondContact O-CB 3.29Å; L251-A255 PolarHBondContact O-N 2.94Å |
| 252 | L | 64.3 | Low | 59.6 | Low | 112 Ų | 112 | 111.4 Ų | 111.4 | 59% | 0.586 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -80.1 | -32.7 | 176.1 | -73.2 | 172.2 | 0 | 0 | 0 | 112 | R248 A249 D250 A256 | R248-L252 HydrophobicContact CG-CD1 4.4Å; R248-L252 WeakPolarHBondContact O-CD1 3.15Å; R248-L252 VanDerWaalsContact O-CG 3.25Å; R248-L252 WeakPolarHBondContact O-CG 3.49Å; A249-L252 PolarHBondContact O-N 2.9Å; A249-L252 VanDerWaalsContact O-N 3.15Å; D250-L252 PolarHBondContact O-N 3.5Å; L252-A256 WeakPolarHBondContact O-CB 3.47Å; L252-A256 PolarHBondContact O-N 3.42Å |
| 253 | L | 68.4 | Low | 60.5 | Low | 131 Ų | 131 | 105 Ų | 105 | 69% | 0.686 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -70.5 | -42.9 | 176.9 | -159.1 | 71.1 | 0 | 0 | 0 | 111.3 | A249 D250 A256 Y257 | A249-L253 PolarHBondContact O-N 3.26Å; D250-L253 PolarHBondContact O-N 3.09Å; D250-L253 VanDerWaalsContact O-N 3.1Å; L253-A256 PolarHBondContact O-N 3.1Å; L253-Y257 PolarHBondContact O-N 2.87Å |
| 254 | E | 68.9 | Low | 61.7 | Low | 134 Ų | 134 | 100.4 Ų | 100.4 | 63% | 0.626 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -70.4 | -36.9 | 176.7 | -165 | 166.9 | -171.6 | 0 | 0 | 111.9 | D250 A256 Y257 L258 | D250-E254 PolarHBondContact O-N 2.9Å; E254-A256 VanDerWaalsContact C-N 3.34Å; E254-A256 PolarHBondContact O-N 2.8Å; E254-Y257 PolarHBondContact O-N 3.46Å; E254-L258 WeakPolarHBondContact O-CG 3.21Å; E254-L258 PolarHBondContact O-N 3.24Å |
| 255 | A | 64.6 | Low | 62.4 | Low | 56 Ų | 56 | 99.8 Ų | 99.8 | 46% | 0.463 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -64.5 | -35.4 | 171 | 0 | 0 | 0 | 0 | 0 | 113.1 | L251 S259 | L251-A255 WeakPolarHBondContact O-CB 3.29Å; L251-A255 PolarHBondContact O-N 2.94Å; A255-S259 PolarHBondContact O-N 2.99Å |
| 256 | A | 68.1 | Low | 62.4 | Low | 55 Ų | 55 | 99 Ų | 99 | 46% | 0.455 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -67.3 | -43 | 174 | 0 | 0 | 0 | 0 | 0 | 111.7 | L252 L253 E254 L258 S259 E260 | L252-A256 WeakPolarHBondContact O-CB 3.47Å; L252-A256 PolarHBondContact O-N 3.42Å; L253-A256 PolarHBondContact O-N 3.1Å; E254-A256 VanDerWaalsContact C-N 3.34Å; E254-A256 PolarHBondContact O-N 2.8Å; A256-L258 PolarHBondContact O-N 3.11Å; A256-S259 WeakPolarHBondContact O-CB 3.16Å; A256-S259 PolarHBondContact O-N 2.86Å; A256-S259 VanDerWaalsContact O-N 3.11Å; A256-E260 PolarHBondContact O-N 3.49Å |
| 257 | Y | 71.6 | Confident | 63.1 | Low | 156 Ų | 156 | 99.2 Ų | 99.2 | 61% | 0.612 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -60.4 | -45.3 | 177.5 | -172.1 | -92.3 | 0 | 0 | 0 | 112.3 | L253 E254 S259 E260 E261 | L253-Y257 PolarHBondContact O-N 2.87Å; E254-Y257 PolarHBondContact O-N 3.46Å; Y257-S259 PolarHBondContact O-N 3.18Å; Y257-E260 PolarHBondContact O-N 3.06Å; Y257-E261 PolarHBondContact O-N 3.12Å; Y257-E261 VanDerWaalsContact O-N 3.14Å |
| 258 | L | 63.6 | Low | 63.2 | Low | 93 Ų | 93 | 102.3 Ų | 102.3 | 49% | 0.487 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -65.6 | -24.3 | 175.8 | -67.6 | 169.5 | 0 | 0 | 0 | 113.1 | E254 A256 T262 | E254-L258 WeakPolarHBondContact O-CG 3.21Å; E254-L258 PolarHBondContact O-N 3.24Å; A256-L258 PolarHBondContact O-N 3.11Å; L258-T262 WeakPolarHBondContact O-CB 3.38Å; L258-T262 WeakPolarHBondContact O-CG2 3.49Å; L258-T262 PolarHBondContact O-N 3.39Å; L258-T262 VanDerWaalsContact O-N 3.1Å; L258-T262 PolarHBondContact O-OG1 2.75Å |
| 259 | S | 64.8 | Low | 63.5 | Low | 77 Ų | 77 | 95.7 Ų | 95.7 | 54% | 0.538 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -69.2 | -42.2 | 173.3 | -164.6 | 0 | 0 | 0 | 0 | 111.9 | A255 A256 Y257 T262 A263 | A255-S259 PolarHBondContact O-N 2.99Å; A256-S259 WeakPolarHBondContact O-CB 3.16Å; A256-S259 PolarHBondContact O-N 2.86Å; A256-S259 VanDerWaalsContact O-N 3.11Å; Y257-S259 PolarHBondContact O-N 3.18Å; S259-T262 PolarHBondContact O-OG1 2.7Å; S259-T262 VanDerWaalsContact O-OG1 3.14Å; S259-A263 WeakPolarHBondContact O-CB 3.44Å; S259-A263 PolarHBondContact O-N 2.86Å |
| 260 | E | 62.8 | Low | 63.5 | Low | 148 Ų | 148 | 99.6 Ų | 99.6 | 69% | 0.692 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -68.2 | -41 | 175.3 | -69.7 | -165.6 | 119.7 | 0 | 0 | 112.1 | A256 Y257 T262 A263 S264 | A256-E260 PolarHBondContact O-N 3.49Å; Y257-E260 PolarHBondContact O-N 3.06Å; E260-T262 PolarHBondContact O-N 2.89Å; E260-A263 PolarHBondContact O-N 3.19Å; E260-S264 WeakPolarHBondContact O-CB 3.41Å; E260-S264 PolarHBondContact O-N 3.39Å |
| 261 | E | 62.2 | Low | 63.4 | Low | 106 Ų | 106 | 101.3 Ų | 101.3 | 50% | 0.495 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -64.9 | -38.9 | 178.8 | -170.2 | 164 | -157.9 | 0 | 0 | 112.1 | Y257 S264 L265 | Y257-E261 PolarHBondContact O-N 3.12Å; Y257-E261 VanDerWaalsContact O-N 3.14Å; E261-S264 PolarHBondContact O-N 2.96Å; E261-L265 PolarHBondContact O-N 3.43Å |
| 262 | T | 56.9 | Low | 63 | Low | 75 Ų | 75 | 98.5 Ų | 98.5 | 46% | 0.46 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -72.3 | -31.9 | 175 | 51.5 | 0 | 0 | 0 | 0 | 113.2 | L258 S259 E260 L265 N266 | L258-T262 WeakPolarHBondContact O-CB 3.38Å; L258-T262 WeakPolarHBondContact O-CG2 3.49Å; L258-T262 PolarHBondContact O-N 3.39Å; L258-T262 VanDerWaalsContact O-N 3.1Å; L258-T262 PolarHBondContact O-OG1 2.75Å; S259-T262 PolarHBondContact O-OG1 2.7Å; S259-T262 VanDerWaalsContact O-OG1 3.14Å; E260-T262 PolarHBondContact O-N 2.89Å; T262-L265 PolarHBondContact O-N 2.83Å; T262-N266 PolarHBondContact O-N 3.38Å; T262-N266 VanDerWaalsContact O-N 3.09Å; T262-N266 PolarHBondContact O-ND2 3.24Å |
| 263 | A | 61.8 | Low | 62.6 | Low | 55 Ų | 55 | 98.4 Ų | 98.4 | 46% | 0.455 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -66.5 | -39.5 | 170.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | S259 E260 N266 T267 | S259-A263 WeakPolarHBondContact O-CB 3.44Å; S259-A263 PolarHBondContact O-N 2.86Å; E260-A263 PolarHBondContact O-N 3.19Å; A263-N266 PolarHBondContact O-N 3.45Å; A263-T267 PolarHBondContact O-N 3.06Å; A263-T267 VanDerWaalsContact O-N 3.16Å; A263-T267 PolarHBondContact O-OG1 2.96Å; A263-T267 VanDerWaalsContact O-OG1 3.06Å |
| 264 | S | 64.9 | Low | 61.9 | Low | 57 Ų | 57 | 97.2 Ų | 97.2 | 40% | 0.399 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -64.2 | -37.8 | 175.2 | -171.3 | 0 | 0 | 0 | 0 | 112.5 | E260 E261 T267 K268 | E260-S264 WeakPolarHBondContact O-CB 3.41Å; E260-S264 PolarHBondContact O-N 3.39Å; E261-S264 PolarHBondContact O-N 2.96Å; S264-T267 PolarHBondContact O-OG1 3.13Å; S264-T267 VanDerWaalsContact O-OG1 3.05Å; S264-K268 PolarHBondContact O-N 3.19Å |
| 265 | L | 58.8 | Low | 61 | Low | 101 Ų | 101 | 97.4 Ų | 97.4 | 53% | 0.529 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -67.5 | -46.3 | 173.2 | -85.4 | 163.6 | 0 | 0 | 0 | 112.8 | E261 T262 T267 K268 V269 | E261-L265 PolarHBondContact O-N 3.43Å; T262-L265 PolarHBondContact O-N 2.83Å; L265-T267 VanDerWaalsContact C-N 3.31Å; L265-T267 PolarHBondContact O-N 2.86Å; L265-K268 PolarHBondContact O-N 3.14Å; L265-V269 WeakPolarHBondContact O-CG2 3.2Å; L265-V269 PolarHBondContact O-N 3.28Å |
| 266 | N | 52.9 | Low | 60.2 | Low | 108 Ų | 108 | 101.1 Ų | 101.1 | 58% | 0.578 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -62.7 | -35 | -179.2 | -82.6 | -74 | 0 | 0 | 0 | 113.1 | T262 A263 R270 | T262-N266 PolarHBondContact O-N 3.38Å; T262-N266 VanDerWaalsContact O-N 3.09Å; T262-N266 PolarHBondContact O-ND2 3.24Å; A263-N266 PolarHBondContact O-N 3.45Å; N266-R270 PolarHBondContact O-N 3.26Å |
| 267 | T | 65.6 | Low | 59.3 | Low | 83 Ų | 83 | 106 Ų | 106 | 51% | 0.509 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -70.7 | -38.4 | 175.8 | 47 | 0 | 0 | 0 | 0 | 112.5 | A263 S264 L265 R270 Q271 | A263-T267 PolarHBondContact O-N 3.06Å; A263-T267 VanDerWaalsContact O-N 3.16Å; A263-T267 PolarHBondContact O-OG1 2.96Å; A263-T267 VanDerWaalsContact O-OG1 3.06Å; S264-T267 PolarHBondContact O-OG1 3.13Å; S264-T267 VanDerWaalsContact O-OG1 3.05Å; L265-T267 VanDerWaalsContact C-N 3.31Å; L265-T267 PolarHBondContact O-N 2.86Å; T267-R270 PolarHBondContact O-N 3.34Å; T267-Q271 PolarHBondContact O-N 3.45Å; T267-Q271 VanDerWaalsContact O-N 3.17Å |
| 268 | K | 67.9 | Low | 58.1 | Low | 133 Ų | 133 | 103 Ų | 103 | 58% | 0.578 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -64.6 | -39.4 | 172.3 | -80.5 | 173.9 | 176.3 | 167 | 0 | 113.6 | S264 L265 Q271 S272 | S264-K268 PolarHBondContact O-N 3.19Å; L265-K268 PolarHBondContact O-N 3.14Å; K268-Q271 PolarHBondContact O-N 3.26Å; K268-S272 PolarHBondContact O-N 3.36Å |
| 269 | V | 63.9 | Low | 57.3 | Low | 73 Ų | 73 | 103.3 Ų | 103.3 | 44% | 0.442 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -58.6 | -50.4 | 175.8 | 170.7 | 0 | 0 | 0 | 0 | 110.1 | L265 Q271 S272 E273 | L265-V269 WeakPolarHBondContact O-CG2 3.2Å; L265-V269 PolarHBondContact O-N 3.28Å; V269-Q271 VanDerWaalsContact C-N 3.34Å; V269-Q271 PolarHBondContact O-N 3.08Å; V269-S272 PolarHBondContact O-N 2.87Å; V269-S272 PolarHBondContact O-OG 2.93Å; V269-E273 PolarHBondContact O-N 2.96Å; V269-E273 VanDerWaalsContact O-N 3.13Å |
| 270 | R | 59.6 | Low | 56.2 | Low | 145 Ų | 145 | 108 Ų | 108 | 55% | 0.547 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -57.5 | -42.1 | 177.6 | -71.7 | -174.9 | 58.7 | 73.9 | 21.2 | 113.5 | N266 T267 S272 E273 E274 | N266-R270 PolarHBondContact O-N 3.26Å; T267-R270 PolarHBondContact O-N 3.34Å; R270-S272 VanDerWaalsContact C-N 3.33Å; R270-S272 PolarHBondContact O-N 2.88Å; R270-E273 PolarHBondContact O-N 3.26Å; R270-E274 IonicContact NH2-OE1 3.1Å; R270-E274 PolarHBondContact NH2-OE1 2.68Å; R270-E274 PolarHBondContact O-N 2.87Å; R270-E274 VanDerWaalsContact O-N 3.13Å |
| 271 | Q | 55.5 | Low | 55 | Low | 121 Ų | 121 | 105.7 Ų | 105.7 | 57% | 0.565 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -63.2 | -39.7 | 176.1 | -73.5 | 177.7 | -27.3 | 0 | 0 | 111.7 | T267 K268 V269 E273 E274 E275 | T267-Q271 PolarHBondContact O-N 3.45Å; T267-Q271 VanDerWaalsContact O-N 3.17Å; K268-Q271 PolarHBondContact O-N 3.26Å; V269-Q271 VanDerWaalsContact C-N 3.34Å; V269-Q271 PolarHBondContact O-N 3.08Å; Q271-E273 VanDerWaalsContact C-N 3.26Å; Q271-E273 PolarHBondContact O-N 2.92Å; Q271-E274 PolarHBondContact O-N 3.21Å; Q271-E275 WeakPolarHBondContact O-CG 3.49Å; Q271-E275 PolarHBondContact O-N 3.08Å |
| 272 | S | 55.1 | Low | 53.9 | Low | 49 Ų | 49 | 105.5 Ų | 105.5 | 34% | 0.343 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -68.5 | -20.7 | 176.6 | 75.7 | 0 | 0 | 0 | 0 | 114.3 | K268 V269 R270 Q276 | K268-S272 PolarHBondContact O-N 3.36Å; V269-S272 PolarHBondContact O-N 2.87Å; V269-S272 PolarHBondContact O-OG 2.93Å; R270-S272 VanDerWaalsContact C-N 3.33Å; R270-S272 PolarHBondContact O-N 2.88Å; S272-Q276 WeakPolarHBondContact O-CG 3.44Å; S272-Q276 PolarHBondContact O-N 3.23Å; S272-Q276 PolarHBondContact O-NE2 3.48Å |
| 273 | E | 56.2 | Low | 53.2 | Low | 111 Ų | 111 | 107.6 Ų | 107.6 | 52% | 0.519 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -78.7 | -43 | 172.1 | -65.9 | 174.2 | 140.7 | 0 | 0 | 111 | V269 R270 Q271 Q276 Q277 | V269-E273 PolarHBondContact O-N 2.96Å; V269-E273 VanDerWaalsContact O-N 3.13Å; R270-E273 PolarHBondContact O-N 3.26Å; Q271-E273 VanDerWaalsContact C-N 3.26Å; Q271-E273 PolarHBondContact O-N 2.92Å; E273-Q276 PolarHBondContact O-N 3.4Å; E273-Q277 PolarHBondContact O-N 2.96Å; E273-Q277 VanDerWaalsContact O-N 3.08Å |
| 274 | E | 53.8 | Low | 52.2 | Low | 106 Ų | 106 | 114.4 Ų | 114.4 | 50% | 0.495 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -67.4 | -34.2 | 177.9 | -69 | 171.3 | -167.8 | 0 | 0 | 112.1 | R270 Q271 T278 | R270-E274 IonicContact NH2-OE1 3.1Å; R270-E274 PolarHBondContact NH2-OE1 2.68Å; R270-E274 PolarHBondContact O-N 2.87Å; R270-E274 VanDerWaalsContact O-N 3.13Å; Q271-E274 PolarHBondContact O-N 3.21Å; E274-T278 PolarHBondContact O-N 3.29Å; E274-T278 PolarHBondContact O-OG1 3.4Å |
| 275 | E | 50.5 | Low | 50.7 | Low | 137 Ų | 137 | 115.4 Ų | 115.4 | 64% | 0.64 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -70.2 | -38.7 | 172 | -72.7 | -174.2 | 153.8 | 0 | 0 | 112.9 | Q271 Q277 T278 V279 | Q271-E275 WeakPolarHBondContact O-CG 3.49Å; Q271-E275 PolarHBondContact O-N 3.08Å; E275-Q277 VanDerWaalsContact C-N 3.33Å; E275-Q277 PolarHBondContact O-N 3.45Å; E275-T278 WeakPolarHBondContact CA-OG1 3.23Å; E275-T278 PolarHBondContact O-N 2.93Å; E275-T278 PolarHBondContact O-OG1 2.92Å; E275-T278 VanDerWaalsContact O-OG1 3.06Å; E275-V279 WeakPolarHBondContact O-CG2 3.34Å; E275-V279 PolarHBondContact O-N 3.25Å |
| 276 | Q | 48.5 | Very low | 49.4 | Very low | 134 Ų | 134 | 116.7 Ų | 116.7 | 63% | 0.626 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -66.7 | -34.9 | 175.7 | -80.9 | 173.9 | 86.8 | 0 | 0 | 112.4 | S272 E273 T278 | S272-Q276 WeakPolarHBondContact O-CG 3.44Å; S272-Q276 PolarHBondContact O-N 3.23Å; S272-Q276 PolarHBondContact O-NE2 3.48Å; E273-Q276 PolarHBondContact O-N 3.4Å; Q276-T278 VanDerWaalsContact C-N 3.32Å; Q276-T278 PolarHBondContact O-N 2.97Å |
| 277 | Q | 48.5 | Very low | 48.4 | Very low | 158 Ų | 158 | 120.1 Ų | 120.1 | 74% | 0.738 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -72.3 | -23.6 | 178.2 | -166.6 | 164.7 | 53.2 | 0 | 0 | 113.3 | E273 E275 | E273-Q277 PolarHBondContact O-N 2.96Å; E273-Q277 VanDerWaalsContact O-N 3.08Å; E275-Q277 VanDerWaalsContact C-N 3.33Å; E275-Q277 PolarHBondContact O-N 3.45Å |
| 278 | T | 46.1 | Very low | 46.8 | Very low | 92 Ų | 92 | 122.8 Ų | 122.8 | 56% | 0.564 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -88.6 | -25.5 | 176.9 | 43.1 | 0 | 0 | 0 | 0 | 114 | E274 E275 Q276 S281 | E274-T278 PolarHBondContact O-N 3.29Å; E274-T278 PolarHBondContact O-OG1 3.4Å; E275-T278 WeakPolarHBondContact CA-OG1 3.23Å; E275-T278 PolarHBondContact O-N 2.93Å; E275-T278 PolarHBondContact O-OG1 2.92Å; E275-T278 VanDerWaalsContact O-OG1 3.06Å; Q276-T278 VanDerWaalsContact C-N 3.32Å; Q276-T278 PolarHBondContact O-N 2.97Å; T278-S281 PolarHBondContact O-OG 2.94Å |
| 279 | V | 45.9 | Very low | 45.1 | Very low | 101 Ų | 101 | 123.6 Ų | 123.6 | 61% | 0.612 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -72.5 | -33.3 | 174.6 | 173.8 | 0 | 0 | 0 | 0 | 112.4 | E275 S281 S282 | E275-V279 WeakPolarHBondContact O-CG2 3.34Å; E275-V279 PolarHBondContact O-N 3.25Å; V279-S281 VanDerWaalsContact C-N 3.31Å; V279-S281 PolarHBondContact O-N 2.94Å; V279-S282 PolarHBondContact O-N 3.29Å |
| 280 | Q | 41.7 | Very low | 43.5 | Very low | 176 Ų | 176 | 128.4 Ų | 128.4 | 82% | 0.822 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.4 | -22.1 | -179.8 | -79.7 | -167 | -9.1 | 0 | 0 | 114.9 | ||
| 281 | S | 38.6 | Very low | 42.1 | Very low | 99 Ų | 99 | 130.8 Ų | 130.8 | 69% | 0.692 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.2 | -3.1 | -178.6 | 59.5 | 0 | 0 | 0 | 0 | 114.6 | T278 V279 | T278-S281 PolarHBondContact O-OG 2.94Å; V279-S281 VanDerWaalsContact C-N 3.31Å; V279-S281 PolarHBondContact O-N 2.94Å |
| 282 | S | 38.7 | Very low | 41 | Very low | 102 Ų | 102 | 133.1 Ų | 133.1 | 71% | 0.713 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -106.9 | 6.4 | -166.9 | -152 | 0 | 0 | 0 | 0 | 114.7 | V279 | V279-S282 PolarHBondContact O-N 3.29Š|
| 283 | V | 43.3 | Very low | 39.7 | Very low | 119 Ų | 119 | 136.8 Ų | 136.8 | 72% | 0.721 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -110.9 | -16.5 | -167.2 | -177.1 | 0 | 0 | 0 | 0 | 114.5 | ||
| 284 | E | 40.3 | Very low | 38.5 | Very low | 197 Ų | 197 | 139.4 Ų | 139.4 | 92% | 0.921 | 75% | 0.746 | S | S | * | * | S | Bend | trans | -113.2 | 107.2 | 173 | -78.4 | -170.8 | 131 | 0 | 0 | 111.1 | ||
| 285 | G | 32.2 | Very low | 37.5 | Very low | 79 Ų | 79 | 141.6 Ų | 141.6 | 81% | 0.814 | 76% | 0.756 | S | S | * | * | trans | 157.3 | 33.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 286 | T | 33.3 | Very low | 36.7 | Very low | 127 Ų | 127 | 147.2 Ų | 147.2 | 78% | 0.779 | 77% | 0.771 | S | S | * | * | trans | -110.5 | 141.8 | 172.6 | -40.6 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 287 | E | 30.9 | Very low | 36 | Very low | 180 Ų | 180 | 150.1 Ų | 150.1 | 84% | 0.841 | 78% | 0.782 | S | S | * | * | trans | 71.3 | 140.6 | -176.2 | -47 | 175.9 | -141.5 | 0 | 0 | 112.3 | ||||
| 288 | V | 31.7 | Very low | 35.2 | Very low | 140 Ų | 140 | 148.5 Ų | 148.5 | 85% | 0.848 | 78% | 0.783 | S | S | * | * | cis | -132.8 | 172.8 | 23.9 | 175.5 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 289 | L | 32.5 | Very low | 34.6 | Very low | 150 Ų | 150 | 150.2 Ų | 150.2 | 79% | 0.785 | 80% | 0.797 | S | S | * | * | trans | -85 | 157 | -168.4 | -64.7 | 160.3 | 0 | 0 | 0 | 116.7 | ||||
| 290 | H | 30.8 | Very low | 34.1 | Very low | 174 Ų | 174 | 152.5 Ų | 152.5 | 81% | 0.806 | 81% | 0.806 | S | S | * | * | trans | 40.8 | 124.2 | 143.5 | -83.1 | -114.4 | 0 | 0 | 0 | 121.9 | ||||
| 291 | E | 30.4 | Very low | 33.9 | Very low | 194 Ų | 194 | 151.9 Ų | 151.9 | 91% | 0.907 | 81% | 0.807 | S | S | * | * | -151.1 | -179.3 | 119 | -133.8 | 170.7 | -155.1 | 0 | 0 | 111.4 | |||||
| 292 | E | 31 | Very low | 33.5 | Very low | 171 Ų | 171 | 151.8 Ų | 151.8 | 80% | 0.799 | 81% | 0.812 | S | S | * | * | trans | -92.7 | 140.3 | -151 | -74.1 | -162.2 | 112.3 | 0 | 0 | 119.1 | ||||
| 293 | V | 28.5 | Very low | 33.4 | Very low | 125 Ų | 125 | 151.2 Ų | 151.2 | 76% | 0.758 | 82% | 0.823 | S | S | * | * | 33.4 | 100.9 | 120.5 | -166.2 | 0 | 0 | 0 | 0 | 120 | |||||
| 294 | E | 30.8 | Very low | 33 | Very low | 167 Ų | 167 | 156.5 Ų | 156.5 | 78% | 0.78 | 83% | 0.829 | S | S | * | * | trans | -176.5 | 148.3 | 135.4 | -104.2 | -154.9 | 118.3 | 0 | 0 | 108.3 | ||||
| 295 | Q | 33 | Very low | 32.8 | Very low | 151 Ų | 151 | 155.7 Ų | 155.7 | 71% | 0.706 | 83% | 0.828 | S | S | * | * | cis | -134.1 | 134.3 | -1.7 | -94 | 157.1 | 14.6 | 0 | 0 | 110.4 | K297 | Q295-K297 PolarHBondContact O-N 2.84Š| ||
| 296 | R | 33.7 | Very low | 32.9 | Very low | 256 Ų | 256 | 161.6 Ų | 161.6 | 97% | 0.966 | 83% | 0.834 | S | S | * | * | trans | -84.3 | 91.2 | 160.6 | -101.8 | -171.9 | 168.7 | -154.8 | -0.4 | 109.7 | ||||
| 297 | K | 34.4 | Very low | 32.8 | Very low | 194 Ų | 194 | 158.6 Ų | 158.6 | 84% | 0.843 | 83% | 0.829 | S | S | * | * | trans | -162.5 | 154.1 | 160.4 | -115.8 | 167.2 | -174.1 | 177.1 | 0 | 112.7 | Q295 | Q295-K297 PolarHBondContact O-N 2.84Š| ||
| 298 | V | 31.9 | Very low | 33 | Very low | 125 Ų | 125 | 159 Ų | 159 | 76% | 0.758 | 83% | 0.831 | S | S | * | * | trans | 82.6 | 72.4 | -174.3 | -164.9 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 299 | C | 33.1 | Very low | 33.2 | Very low | 128 Ų | 128 | 160 Ų | 160 | 87% | 0.865 | 83% | 0.831 | S | S | * | * | trans | -105.4 | -3.5 | 155.8 | -64.8 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 300 | D | 35.3 | Very low | 33.1 | Very low | 148 Ų | 148 | 160.7 Ų | 160.7 | 79% | 0.791 | 84% | 0.835 | S | S | * | * | S | Bend | trans | -114.2 | 50.6 | -167.3 | -60.3 | -69.5 | 0 | 0 | 0 | 113.9 | ||
| 301 | L | 36.7 | Very low | 32.9 | Very low | 164 Ų | 164 | 162.5 Ų | 162.5 | 86% | 0.859 | 84% | 0.841 | S | S | * | * | S | Bend | trans | -159.6 | 61.8 | 161.6 | -140 | 73.9 | 0 | 0 | 0 | 115.8 | ||
| 302 | A | 31.8 | Very low | 32.9 | Very low | 97 Ų | 97 | 157.2 Ų | 157.2 | 80% | 0.802 | 83% | 0.83 | S | S | * | * | trans | -141.3 | -5.8 | 167 | 0 | 0 | 0 | 0 | 0 | 115.1 | R304 | A302-R304 VanDerWaalsContact C-N 3.26Å; A302-R304 PolarHBondContact O-N 3.06Å | ||
| 303 | G | 36.8 | Very low | 32.9 | Very low | 90 Ų | 90 | 152.7 Ų | 152.7 | 93% | 0.928 | 83% | 0.83 | S | S | * | * | trans | -77.8 | 59.3 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 304 | R | 34.5 | Very low | 32.9 | Very low | 229 Ų | 229 | 152.9 Ų | 152.9 | 86% | 0.864 | 84% | 0.835 | S | S | * | * | trans | -155.6 | 147.7 | 172.3 | -147.6 | 172.7 | -177.8 | 171.7 | 0.1 | 111.8 | A302 | A302-R304 VanDerWaalsContact C-N 3.26Å; A302-R304 PolarHBondContact O-N 3.06Å | ||
| 305 | M | 36.3 | Very low | 33.1 | Very low | 181 Ų | 181 | 151.6 Ų | 151.6 | 89% | 0.892 | 84% | 0.843 | S | S | * | * | trans | 70.1 | 49.4 | 174.9 | -53.8 | -177.4 | 67.1 | 0 | 0 | 116.5 | ||||
| 306 | Q | 34.3 | Very low | 33 | Very low | 202 Ų | 202 | 147.8 Ų | 147.8 | 94% | 0.944 | 84% | 0.844 | S | S | * | * | -80.2 | 132 | 128.6 | -79.2 | -176.1 | -18.3 | 0 | 0 | 107.4 | |||||
| 307 | G | 31.2 | Very low | 33 | Very low | 65 Ų | 65 | 144 Ų | 144 | 67% | 0.67 | 84% | 0.837 | S | S | * | * | trans | -163 | 107.8 | -179.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 308 | E | 33.9 | Very low | 32.9 | Very low | 189 Ų | 189 | 141.9 Ų | 141.9 | 88% | 0.883 | 84% | 0.836 | S | S | * | * | trans | 64.8 | 146.9 | 154.1 | -54.5 | -177.1 | 139.1 | 0 | 0 | 116.7 | ||||
| 309 | L | 35.9 | Very low | 32.9 | Very low | 161 Ų | 161 | 145.7 Ų | 145.7 | 84% | 0.843 | 84% | 0.842 | S | S | * | * | cis | -124.9 | 138.7 | 18.1 | -71.3 | 154.4 | 0 | 0 | 0 | 112 | ||||
| 310 | N | 30.9 | Very low | 32.9 | Very low | 163 Ų | 163 | 147.8 Ų | 147.8 | 87% | 0.872 | 84% | 0.839 | S | S | * | * | trans | -89.1 | 144.1 | 158.4 | -72.2 | -38.9 | 0 | 0 | 0 | 108.8 | ||||
| 311 | F | 26.1 | Very low | 32.6 | Very low | 212 Ų | 212 | 148.7 Ų | 148.7 | 93% | 0.93 | 84% | 0.844 | S | S | * | * | trans | -122.3 | 110.5 | 159.1 | -154.8 | -89.9 | 0 | 0 | 0 | 108.5 | ||||
| 312 | A | 32 | Very low | 32.3 | Very low | 83 Ų | 83 | 146.9 Ų | 146.9 | 69% | 0.686 | 84% | 0.835 | S | S | * | * | trans | -82.8 | 140.4 | -177.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 313 | G | 30 | Very low | 32.4 | Very low | 76 Ų | 76 | 149.8 Ų | 149.8 | 78% | 0.784 | 83% | 0.832 | S | S | * | * | trans | -86.4 | 136.3 | 163.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 314 | C | 29 | Very low | 32 | Very low | 130 Ų | 130 | 155 Ų | 155 | 88% | 0.878 | 82% | 0.823 | S | S | * | * | trans | -140 | 121.1 | 167 | -91.2 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 315 | C | 34.8 | Very low | 31.9 | Very low | 139 Ų | 139 | 148.9 Ų | 148.9 | 94% | 0.939 | 81% | 0.812 | S | S | * | * | trans | -92.5 | 146.2 | 149.7 | -61 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 316 | G | 31.6 | Very low | 31.7 | Very low | 71 Ų | 71 | 148.2 Ų | 148.2 | 73% | 0.732 | 81% | 0.806 | S | S | * | * | trans | -174.9 | 130 | 177.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 317 | E | 32.3 | Very low | 31.5 | Very low | 176 Ų | 176 | 145.4 Ų | 145.4 | 82% | 0.822 | 80% | 0.798 | S | S | * | * | trans | -78.5 | 164.7 | -163.1 | -66.3 | 117.4 | 117.9 | 0 | 0 | 117.2 | ||||
| 318 | D | 32.6 | Very low | 31.7 | Very low | 151 Ų | 151 | 152.4 Ų | 152.4 | 81% | 0.807 | 81% | 0.81 | S | S | * | * | trans | 55 | 124.7 | 143.7 | -63.2 | -11.3 | 0 | 0 | 0 | 122.7 | ||||
| 319 | K | 33 | Very low | 31.6 | Very low | 204 Ų | 204 | 151.5 Ų | 151.5 | 89% | 0.887 | 81% | 0.806 | S | S | * | * | -153.9 | 158.6 | 119.1 | -117.3 | 170.7 | -173.8 | 177.3 | 0 | 114.3 | |||||
| 320 | Q | 31.5 | Very low | 31.4 | Very low | 172 Ų | 172 | 151.9 Ų | 151.9 | 80% | 0.804 | 80% | 0.803 | S | S | * | * | trans | -75.4 | 159.4 | -179.9 | -59.4 | 159.5 | -78.5 | 0 | 0 | 112.2 | ||||
| 321 | D | 29.3 | Very low | 31.4 | Very low | 168 Ų | 168 | 152.4 Ų | 152.4 | 90% | 0.898 | 80% | 0.8 | S | S | * | * | -160.5 | 177.7 | 120 | -100.1 | -24.3 | 0 | 0 | 0 | 111.5 | |||||
| 322 | D | 30.7 | Very low | 31.6 | Very low | 125 Ų | 125 | 147.2 Ų | 147.2 | 67% | 0.668 | 80% | 0.797 | S | S | * | * | trans | -101.1 | 164.6 | -134.6 | -153 | -19.1 | 0 | 0 | 0 | 117.8 | ||||
| 323 | Q | 33.9 | Very low | 31.4 | Very low | 158 Ų | 158 | 146.3 Ų | 146.3 | 74% | 0.738 | 80% | 0.796 | S | S | * | * | trans | 58.8 | 137 | 154.6 | -93.9 | 147.7 | 72.9 | 0 | 0 | 120.7 | ||||
| 324 | R | 28.2 | Very low | 31.4 | Very low | 199 Ų | 199 | 151.4 Ų | 151.4 | 75% | 0.751 | 80% | 0.803 | S | S | * | * | -167.9 | 133.4 | 61.7 | -176.2 | -176.7 | -178.1 | -74.6 | 1.7 | 115.3 | |||||
| 325 | V | 32.4 | Very low | 31.5 | Very low | 102 Ų | 102 | 148.1 Ų | 148.1 | 62% | 0.618 | 79% | 0.791 | S | S | * | * | trans | -18 | 130.8 | 158.4 | -153.1 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 326 | E | 31.3 | Very low | 31.2 | Very low | 167 Ų | 167 | 150.4 Ų | 150.4 | 78% | 0.78 | 79% | 0.787 | S | S | * | * | -174.3 | 153 | 108.7 | -100.1 | 176.2 | -157.7 | 0 | 0 | 114.9 | |||||
| 327 | D | 30.7 | Very low | 31.1 | Very low | 142 Ų | 142 | 157.1 Ų | 157.1 | 76% | 0.759 | 79% | 0.791 | S | S | * | * | trans | -88.3 | 158.2 | -168.8 | -56.2 | -88 | 0 | 0 | 0 | 115.5 | ||||
| 328 | K | 34.6 | Very low | 31.2 | Very low | 213 Ų | 213 | 153 Ų | 153 | 93% | 0.926 | 78% | 0.781 | S | S | * | * | -161.9 | 154.1 | 118 | -112.4 | 166.9 | -175 | 175.7 | 0 | 115.3 | |||||
| 329 | Q | 32.3 | Very low | 31 | Very low | 170 Ų | 170 | 150.7 Ų | 150.7 | 79% | 0.794 | 77% | 0.773 | S | S | * | * | trans | -102.2 | 173.7 | -172.1 | -59.6 | 165.5 | -61.4 | 0 | 0 | 113.2 | ||||
| 330 | Q | 31.7 | Very low | 31.1 | Very low | 169 Ų | 169 | 149.1 Ų | 149.1 | 79% | 0.79 | 77% | 0.769 | S | S | * | * | trans | 104.6 | 111.9 | 156.5 | -63.1 | 176.6 | -46.8 | 0 | 0 | 114.6 | ||||
| 331 | E | 31.3 | Very low | 31 | Very low | 173 Ų | 173 | 148.5 Ų | 148.5 | 81% | 0.808 | 77% | 0.766 | S | S | * | * | cis | 97.5 | 121 | 49.8 | -92.7 | -162.8 | 120.5 | 0 | 0 | 113.1 | ||||
| 332 | A | 29.4 | Very low | 30.9 | Very low | 104 Ų | 104 | 146.6 Ų | 146.6 | 86% | 0.86 | 76% | 0.76 | S | S | * | * | trans | 59.8 | 145.3 | 151.6 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 333 | G | 28.6 | Very low | 30.7 | Very low | 64 Ų | 64 | 145.6 Ų | 145.6 | 66% | 0.66 | 76% | 0.763 | S | S | * | * | cis | 149.9 | 142.1 | -11.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 334 | I | 31.2 | Very low | 31.4 | Very low | 183 Ų | 183 | 143.8 Ų | 143.8 | 94% | 0.938 | 77% | 0.765 | S | S | * | * | trans | 67.4 | 141.4 | 168.7 | -48.4 | 173.4 | 0 | 0 | 0 | 114.2 | ||||
| 335 | G | 29.1 | Very low | 31.5 | Very low | 60 Ų | 60 | 140 Ų | 140 | 62% | 0.619 | 76% | 0.764 | S | S | * | * | cis | 168.1 | 176.9 | -5.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 336 | E | 29.1 | Very low | 31.4 | Very low | 187 Ų | 187 | 143.1 Ų | 143.1 | 87% | 0.874 | 78% | 0.775 | S | S | * | * | trans | 63.1 | 174.2 | 167.6 | -54 | -163.1 | 112.8 | 0 | 0 | 118.5 | ||||
| 337 | R | 29.5 | Very low | 31.3 | Very low | 213 Ų | 213 | 140.9 Ų | 140.9 | 80% | 0.804 | 77% | 0.773 | S | S | * | * | -165.1 | 150.6 | -56.3 | 176.1 | 176.4 | 171.6 | 178 | 0.6 | 110.3 | |||||
| 338 | S | 34.4 | Very low | 32.3 | Very low | 89 Ų | 89 | 139.4 Ų | 139.4 | 62% | 0.622 | 77% | 0.771 | S | S | * | * | trans | 71.1 | 162.1 | 163 | -81.3 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 339 | T | 29.1 | Very low | 31.9 | Very low | 103 Ų | 103 | 136.2 Ų | 136.2 | 63% | 0.632 | 76% | 0.76 | S | S | * | * | cis | -154.6 | 152.2 | 2.2 | -2.9 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 340 | E | 34.1 | Very low | 31.8 | Very low | 171 Ų | 171 | 136.8 Ų | 136.8 | 80% | 0.799 | 76% | 0.756 | S | S | * | * | trans | 57.9 | 164 | 141.8 | -77.1 | 158.6 | 166.6 | 0 | 0 | 121.3 | ||||
| 341 | E | 29.9 | Very low | 31.6 | Very low | 159 Ų | 159 | 134.7 Ų | 134.7 | 74% | 0.743 | 76% | 0.755 | S | S | * | * | cis | -153.6 | -176.8 | 4.8 | -141.3 | -146.9 | 123.9 | 0 | 0 | 114.2 | ||||
| 342 | T | 26.8 | Very low | 31.5 | Very low | 127 Ų | 127 | 137.1 Ų | 137.1 | 78% | 0.779 | 76% | 0.757 | S | S | * | * | trans | 97.3 | 131.9 | 159.6 | 71.8 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 343 | S | 27.7 | Very low | 31.6 | Very low | 104 Ų | 104 | 140.2 Ų | 140.2 | 73% | 0.727 | 76% | 0.758 | S | S | * | * | trans | -157.8 | 162.4 | 168.7 | -171.5 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 344 | P | 48.4 | Very low | 31.9 | Very low | 120 Ų | 120 | 142.4 Ų | 142.4 | 78% | 0.779 | 76% | 0.763 | S | S | * | * | -152 | 136 | 104.4 | 35.8 | -17.2 | 0 | 0 | 0 | 117.7 | |||||
| 345 | V | 29.3 | Very low | 32.2 | Very low | 121 Ų | 121 | 139.7 Ų | 139.7 | 73% | 0.733 | 76% | 0.757 | S | S | * | * | 28 | 126.8 | 127.6 | -175.3 | 0 | 0 | 0 | 0 | 120.7 | |||||
| 346 | I | 31.9 | Very low | 32.1 | Very low | 166 Ų | 166 | 140.8 Ų | 140.8 | 85% | 0.851 | 77% | 0.768 | S | S | * | * | -160.1 | 147.4 | 128.5 | -98.1 | 153.3 | 0 | 0 | 0 | 109 | |||||
| 347 | T | 29.2 | Very low | 32.2 | Very low | 121 Ų | 121 | 136 Ų | 136 | 74% | 0.742 | 76% | 0.761 | S | S | * | * | trans | -150.5 | 168.5 | -177.3 | 44.7 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 348 | P | 50.8 | Low | 32.4 | Very low | 110 Ų | 110 | 135.4 Ų | 135.4 | 71% | 0.714 | 77% | 0.767 | S | S | * | * | cis | -117 | -136.3 | 6.9 | 26 | 0.2 | 0 | 0 | 0 | 111 | ||||
| 349 | E | 25.9 | Very low | 32.2 | Very low | 146 Ų | 146 | 140 Ų | 140 | 68% | 0.682 | 78% | 0.779 | S | S | * | * | cis | -163 | 178.7 | 7.1 | -154.2 | 170.3 | -101.3 | 0 | 0 | 113.2 | ||||
| 350 | Y | 29.6 | Very low | 32.4 | Very low | 183 Ų | 183 | 140.5 Ų | 140.5 | 72% | 0.718 | 78% | 0.784 | S | S | * | * | trans | 54 | 105.6 | 164.2 | 43.6 | -109.4 | 0 | 0 | 0 | 123 | ||||
| 351 | T | 28.7 | Very low | 32.2 | Very low | 124 Ų | 124 | 140.9 Ų | 140.9 | 76% | 0.761 | 79% | 0.785 | S | S | * | * | 87.5 | 101.7 | 120.7 | -56.5 | 0 | 0 | 0 | 0 | 120.9 | |||||
| 352 | R | 29.5 | Very low | 32.2 | Very low | 225 Ų | 225 | 139.7 Ų | 139.7 | 85% | 0.849 | 79% | 0.79 | S | S | * | * | trans | 60.7 | 115.7 | 136.7 | -173.3 | -162.4 | -72.2 | -164.6 | -2.1 | 119.2 | ||||
| 353 | L | 31.9 | Very low | 32.6 | Very low | 169 Ų | 169 | 138.9 Ų | 138.9 | 89% | 0.885 | 79% | 0.789 | S | S | * | * | -165.6 | 168.5 | 119.3 | -103 | 167.3 | 0 | 0 | 0 | 110.7 | |||||
| 354 | S | 33.2 | Very low | 33.2 | Very low | 109 Ų | 109 | 142.2 Ų | 142.2 | 76% | 0.762 | 79% | 0.793 | S | S | * | * | trans | -134.4 | 136.2 | -169.8 | -179.3 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 355 | P | 38.3 | Very low | 32.7 | Very low | 127 Ų | 127 | 142 Ų | 142 | 83% | 0.825 | 79% | 0.792 | S | S | * | * | trans | -109.1 | 137 | 167.9 | 36.5 | -26.4 | 0 | 0 | 0 | 112.4 | ||||
| 356 | G | 26.8 | Very low | 33 | Very low | 82 Ų | 82 | 142.3 Ų | 142.3 | 85% | 0.845 | 80% | 0.796 | S | S | * | * | trans | -111.5 | -170.6 | -175.3 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 357 | A | 32 | Very low | 33.1 | Very low | 88 Ų | 88 | 146.1 Ų | 146.1 | 73% | 0.727 | 80% | 0.8 | S | S | * | * | trans | -149.9 | 113.1 | 167.5 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 358 | Q | 32.1 | Very low | 33.1 | Very low | 199 Ų | 199 | 152 Ų | 152 | 93% | 0.93 | 81% | 0.808 | S | S | * | * | 89.5 | 115.6 | 90.1 | -81 | -173.2 | 54.9 | 0 | 0 | 113.9 | |||||
| 359 | E | 30.8 | Very low | 32.1 | Very low | 186 Ų | 186 | 152.1 Ų | 152.1 | 87% | 0.869 | 81% | 0.812 | S | S | * | * | trans | -121.7 | 161.5 | 164 | -110.4 | -160.1 | 104.6 | 0 | 0 | 109.5 | ||||
| 360 | P | 34.6 | Very low | 32.4 | Very low | 114 Ų | 114 | 151.7 Ų | 151.7 | 74% | 0.74 | 82% | 0.819 | S | S | * | * | trans | -80.5 | 163.9 | -163.8 | 32.3 | -36.1 | 0 | 0 | 0 | 114.9 | ||||
| 361 | Q | 28.7 | Very low | 32.4 | Very low | 178 Ų | 178 | 147.3 Ų | 147.3 | 83% | 0.832 | 82% | 0.815 | S | S | * | * | trans | -89 | 147.5 | -174.1 | -57.1 | -176.1 | 6.2 | 0 | 0 | 112.9 | ||||
| 362 | T | 30.9 | Very low | 32.7 | Very low | 135 Ų | 135 | 152.9 Ų | 152.9 | 83% | 0.828 | 82% | 0.822 | S | S | * | * | trans | -113.7 | 126 | 158.9 | 84.2 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 363 | S | 34.4 | Very low | 33.1 | Very low | 110 Ų | 110 | 150.3 Ų | 150.3 | 77% | 0.769 | 82% | 0.82 | S | S | * | * | trans | -96.9 | 112.4 | -172.4 | -55.2 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 364 | Q | 40.7 | Very low | 33.3 | Very low | 174 Ų | 174 | 150.7 Ų | 150.7 | 81% | 0.813 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -85.4 | 147.1 | 162.7 | -65.9 | -171 | 13.4 | 0 | 0 | 110.6 | ||
| 365 | P | 37 | Very low | 33.1 | Very low | 115 Ų | 115 | 153 Ų | 153 | 75% | 0.747 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 145 | 178.1 | 28.7 | -34.5 | 0 | 0 | 0 | 111.8 | R367 | P365-R367 PolarHBondContact O-N 2.84Š|
| 366 | P | 36.2 | Very low | 32.8 | Very low | 127 Ų | 127 | 151.6 Ų | 151.6 | 83% | 0.825 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 133.3 | -175.1 | -20.9 | 33.1 | 0 | 0 | 0 | 113.5 | R368 | P366-R368 PolarHBondContact O-N 3.36Š|
| 367 | R | 32.8 | Very low | 33.1 | Very low | 247 Ų | 247 | 151.4 Ų | 151.4 | 93% | 0.932 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 119.6 | 164.4 | -65.5 | -174 | -179.8 | -151.9 | 0 | 109 | P365 S369 | P365-R367 PolarHBondContact O-N 2.84Å; R367-S369 PolarHBondContact O-N 3.42Å; R367-S369 VanDerWaalsContact O-N 3.16Å |
| 368 | R | 29.6 | Very low | 32.9 | Very low | 243 Ų | 243 | 154 Ų | 154 | 92% | 0.917 | 82% | 0.823 | S | S | * | * | trans | -68.5 | 108.8 | 166.6 | -84.3 | -174.4 | 171 | 178.3 | -3.1 | 109.5 | P366 | P366-R368 PolarHBondContact O-N 3.36Š| ||
| 369 | S | 29.7 | Very low | 33 | Very low | 114 Ų | 114 | 150.5 Ų | 150.5 | 80% | 0.797 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 138.8 | 151.2 | 40.5 | 0 | 0 | 0 | 0 | 108.9 | R367 | R367-S369 PolarHBondContact O-N 3.42Å; R367-S369 VanDerWaalsContact O-N 3.16Å |
| 370 | V | 33.2 | Very low | 32.9 | Very low | 136 Ų | 136 | 147.9 Ų | 147.9 | 82% | 0.824 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -97.4 | 132.1 | 163.6 | -179.6 | 0 | 0 | 0 | 0 | 106.5 | ||
| 371 | S | 30.2 | Very low | 32.9 | Very low | 92 Ų | 92 | 148.1 Ų | 148.1 | 64% | 0.643 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 143.6 | -179.2 | 40.4 | 0 | 0 | 0 | 0 | 111.5 | ||
| 372 | R | 33.7 | Very low | 33.1 | Very low | 240 Ų | 240 | 147.7 Ų | 147.7 | 91% | 0.906 | 81% | 0.809 | S | S | * | * | trans | -86.1 | 110.2 | 168 | 168.5 | -174.3 | 168.9 | 173.4 | -2.4 | 107.8 | ||||
| 373 | E | 38.2 | Very low | 33.3 | Very low | 172 Ų | 172 | 147.3 Ų | 147.3 | 80% | 0.804 | 81% | 0.806 | S | S | * | * | trans | -122.7 | 160.4 | 161.9 | -86.4 | 162.5 | 129.1 | 0 | 0 | 109.7 | ||||
| 374 | E | 35.8 | Very low | 33.2 | Very low | 176 Ų | 176 | 150.5 Ų | 150.5 | 82% | 0.822 | 81% | 0.809 | S | S | * | * | trans | -100.7 | 160.2 | -151.5 | -157.1 | 179.5 | 113.2 | 0 | 0 | 112.8 | ||||
| 375 | I | 29.7 | Very low | 33.3 | Very low | 157 Ų | 157 | 149 Ų | 149 | 81% | 0.805 | 81% | 0.806 | S | S | * | * | 176.6 | 129.8 | 122.7 | -89.4 | 154.2 | 0 | 0 | 0 | 110.8 | |||||
| 376 | A | 31.2 | Very low | 33.5 | Very low | 98 Ų | 98 | 152.4 Ų | 152.4 | 81% | 0.81 | 81% | 0.812 | S | S | * | * | trans | 43.5 | 129.3 | 157.2 | 0 | 0 | 0 | 0 | 0 | 122 | ||||
| 377 | G | 33.9 | Very low | 33.6 | Very low | 78 Ų | 78 | 153.6 Ų | 153.6 | 80% | 0.804 | 81% | 0.812 | S | S | * | * | 122.2 | 45.4 | 122.2 | 0 | 0 | 0 | 0 | 0 | 120.4 | |||||
| 378 | V | 28.1 | Very low | 33.9 | Very low | 142 Ų | 142 | 149 Ų | 149 | 86% | 0.861 | 81% | 0.806 | S | S | * | * | trans | -131.3 | 114.3 | 155.6 | -177.6 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 379 | T | 32.6 | Very low | 34.5 | Very low | 127 Ų | 127 | 144 Ų | 144 | 78% | 0.779 | 80% | 0.797 | S | S | * | * | trans | -77.2 | 124 | 172 | 44.4 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 380 | V | 30.6 | Very low | 35.2 | Very low | 130 Ų | 130 | 146.2 Ų | 146.2 | 79% | 0.788 | 80% | 0.795 | S | S | * | * | trans | -76.2 | 129 | 162.9 | 178.2 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 381 | V | 33.7 | Very low | 35.4 | Very low | 120 Ų | 120 | 145 Ų | 145 | 73% | 0.727 | 78% | 0.784 | S | S | * | * | trans | -122.1 | 118.6 | 163.3 | 177.1 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 382 | E | 33.6 | Very low | 36 | Very low | 168 Ų | 168 | 147.6 Ų | 147.6 | 79% | 0.785 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -71.7 | 134.4 | 170.9 | -64.5 | 173.8 | 122.5 | 0 | 0 | 108.5 | H384 | E382-H384 PolarHBondContact O-N 3.17Š|
| 383 | V | 35.3 | Very low | 35.9 | Very low | 128 Ų | 128 | 141.4 Ų | 141.4 | 78% | 0.776 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -82 | 118.1 | 171.5 | -176.5 | 0 | 0 | 0 | 0 | 107.6 | ||
| 384 | H | 31.8 | Very low | 35.8 | Very low | 177 Ų | 177 | 139.1 Ų | 139.1 | 82% | 0.819 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -91.3 | 136.5 | 157.8 | -104.6 | 60.6 | 0 | 0 | 0 | 108 | E382 | E382-H384 PolarHBondContact O-N 3.17Š|
| 385 | D | 42.8 | Very low | 35.8 | Very low | 143 Ų | 143 | 137.3 Ų | 137.3 | 77% | 0.765 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -87.1 | 132.5 | 166.9 | -56.1 | -69.3 | 0 | 0 | 0 | 109.1 | ||
| 386 | E | 40 | Very low | 36.1 | Very low | 185 Ų | 185 | 137.8 Ų | 137.8 | 86% | 0.864 | 76% | 0.756 | S | S | * | * | trans | -174.8 | 109.9 | 145.3 | -106.8 | 169 | -150.5 | 0 | 0 | 111.1 | ||||
| 387 | D | 39.3 | Very low | 36.1 | Very low | 153 Ų | 153 | 141.4 Ų | 141.4 | 82% | 0.818 | 76% | 0.756 | S | S | * | * | trans | 38.7 | 135.8 | 143.2 | -54.5 | -20.7 | 0 | 0 | 0 | 125.8 | ||||
| 388 | D | 39.6 | Very low | 36.1 | Very low | 151 Ų | 151 | 141.6 Ų | 141.6 | 81% | 0.807 | 75% | 0.751 | S | S | * | * | trans | 94.3 | 147 | 134.9 | -101 | -21.7 | 0 | 0 | 0 | 126.6 | ||||
| 389 | D | 41.1 | Very low | 36.2 | Very low | 136 Ų | 136 | 142.1 Ų | 142.1 | 73% | 0.727 | 75% | 0.754 | S | S | * | * | trans | 68.9 | 114 | 156.9 | -80.6 | -31.4 | 0 | 0 | 0 | 125.5 | ||||
| 390 | E | 44.7 | Very low | 36.2 | Very low | 162 Ų | 162 | 139.5 Ų | 139.5 | 76% | 0.757 | 75% | 0.752 | S | S | * | * | 65.9 | 114.4 | 125.7 | -74 | -79.5 | 106.4 | 0 | 0 | 124.4 | |||||
| 391 | D | 37.5 | Very low | 36.2 | Very low | 111 Ų | 111 | 140.2 Ų | 140.2 | 59% | 0.594 | 76% | 0.757 | S | S | * | * | 99.4 | 149 | 119.3 | -151.4 | 25 | 0 | 0 | 0 | 123.2 | |||||
| 392 | K | 42.1 | Very low | 36.3 | Very low | 145 Ų | 145 | 139 Ų | 139 | 63% | 0.63 | 76% | 0.759 | S | S | * | * | trans | 62 | 89.5 | 162.3 | -63.3 | -80 | 153.1 | -3.9 | 0 | 123.3 | ||||
| 393 | T | 33.3 | Very low | 36.2 | Very low | 111 Ų | 111 | 137.6 Ų | 137.6 | 68% | 0.681 | 76% | 0.762 | S | S | * | * | 53.9 | 152.5 | 109.7 | 59.9 | 0 | 0 | 0 | 0 | 124.4 | |||||
| 394 | N | 35.3 | Very low | 36.5 | Very low | 124 Ų | 124 | 135.7 Ų | 135.7 | 66% | 0.663 | 76% | 0.76 | S | S | * | * | trans | 79.2 | 151.9 | 155.4 | -76.1 | 31 | 0 | 0 | 0 | 118.7 | ||||
| 395 | E | 36.7 | Very low | 36.7 | Very low | 138 Ų | 138 | 136.2 Ų | 136.2 | 65% | 0.645 | 76% | 0.762 | S | S | * | * | cis | -170.1 | 144.6 | -26.5 | -116.9 | 169.5 | -145.6 | 0 | 0 | 108.4 | ||||
| 396 | Q | 35.2 | Very low | 36.7 | Very low | 166 Ų | 166 | 137.3 Ų | 137.3 | 78% | 0.776 | 77% | 0.768 | S | S | * | * | trans | 59.4 | 171.2 | 155.3 | -78.4 | 171.8 | 7.4 | 0 | 0 | 118.1 | ||||
| 397 | E | 30.5 | Very low | 36.6 | Very low | 174 Ų | 174 | 136 Ų | 136 | 81% | 0.813 | 76% | 0.762 | S | S | * | * | cis | -149.1 | 177.2 | -31.2 | 177.7 | 160.2 | 152.1 | 0 | 0 | 108.4 | ||||
| 398 | A | 34.1 | Very low | 36.7 | Very low | 83 Ų | 83 | 134.8 Ų | 134.8 | 69% | 0.686 | 76% | 0.756 | S | S | * | * | trans | -81.2 | 153.2 | -166.3 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 399 | T | 30.1 | Very low | 36.5 | Very low | 153 Ų | 153 | 132.2 Ų | 132.2 | 94% | 0.939 | 75% | 0.75 | S | S | * | * | trans | 178.4 | 154.6 | 134.1 | 28 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 400 | G | 32.3 | Very low | 36.4 | Very low | 71 Ų | 71 | 128.3 Ų | 128.3 | 73% | 0.732 | 74% | 0.741 | S | S | * | * | cis | 149.9 | 49.7 | -3.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 401 | V | 31.9 | Very low | 36 | Very low | 146 Ų | 146 | 128.2 Ų | 128.2 | 89% | 0.885 | 74% | 0.738 | S | S | * | * | trans | -133.8 | 137.9 | 177.2 | -177.6 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 402 | A | 34.3 | Very low | 36 | Very low | 95 Ų | 95 | 129.8 Ų | 129.8 | 79% | 0.785 | 75% | 0.745 | S | S | * | * | trans | -121 | 135.1 | 176 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 403 | V | 32.7 | Very low | 36.1 | Very low | 137 Ų | 137 | 130.8 Ų | 130.8 | 83% | 0.83 | 75% | 0.752 | S | S | * | * | trans | -135.1 | 137.5 | 157 | -178.7 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 404 | A | 41.3 | Very low | 36.2 | Very low | 89 Ų | 89 | 133 Ų | 133 | 74% | 0.736 | 75% | 0.752 | S | S | * | * | trans | -108.1 | 133 | -177.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 405 | E | 36.7 | Very low | 37.1 | Very low | 188 Ų | 188 | 131.5 Ų | 131.5 | 88% | 0.879 | 75% | 0.751 | S | S | * | * | trans | -134.8 | 138.9 | 160.6 | -70.3 | -75.8 | 131 | 0 | 0 | 106 | ||||
| 406 | D | 42.7 | Very low | 37.9 | Very low | 165 Ų | 165 | 134.4 Ų | 134.4 | 88% | 0.882 | 76% | 0.758 | S | S | * | * | trans | -81.9 | 130.3 | -173.6 | -86.4 | -62.4 | 0 | 0 | 0 | 113 | ||||
| 407 | E | 36.8 | Very low | 38.7 | Very low | 157 Ų | 157 | 135.6 Ų | 135.6 | 73% | 0.734 | 76% | 0.755 | S | S | * | * | trans | -151.5 | 86.9 | 161.2 | -94.1 | -64.7 | 139.2 | 0 | 0 | 110.1 | S409 | E407-S409 PolarHBondContact O-N 3.33Å; E407-S409 WeakPolarHBondContact OE2-CB 3.3Å; E407-S409 PolarHBondContact OE2-OG 3.37Å | ||
| 408 | D | 42.5 | Very low | 39.7 | Very low | 129 Ų | 129 | 129.9 Ų | 129.9 | 69% | 0.69 | 73% | 0.734 | S | S | * | * | trans | -74.2 | 63.2 | 164.8 | -175.7 | 30.6 | 0 | 0 | 0 | 109.5 | G410 K411 | D408-G410 VanDerWaalsContact C-N 3.34Å; D408-G410 PolarHBondContact O-N 3.39Å; D408-K411 IonicContact OD1-NZ 3.85Å; D408-K411 PolarHBondContact OD1-NZ 2.85Å; D408-K411 IonicContact OD2-NZ 2.68Å; D408-K411 PolarHBondContact OD2-NZ 2.9Å; D408-K411 VanDerWaalsContact OD2-NZ 3.1Å | ||
| 409 | S | 35.8 | Very low | 40.9 | Very low | 97 Ų | 97 | 137.9 Ų | 137.9 | 68% | 0.678 | 75% | 0.747 | S | S | * | * | trans | -76 | 83.2 | -168.7 | -138 | 0 | 0 | 0 | 0 | 111.6 | E407 | E407-S409 PolarHBondContact O-N 3.33Å; E407-S409 WeakPolarHBondContact OE2-CB 3.3Å; E407-S409 PolarHBondContact OE2-OG 3.37Å | ||
| 410 | G | 38.8 | Very low | 42.4 | Very low | 53 Ų | 53 | 136.4 Ų | 136.4 | 55% | 0.546 | 73% | 0.729 | S | S | . | * | trans | 74.9 | 79.5 | 155.6 | 0 | 0 | 0 | 0 | 0 | 115.9 | D408 I412 | D408-G410 VanDerWaalsContact C-N 3.34Å; D408-G410 PolarHBondContact O-N 3.39Å; G410-I412 VanDerWaalsContact C-N 3.26Å; G410-I412 WeakPolarHBondContact O-CG1 3.49Å; G410-I412 PolarHBondContact O-N 3.39Å | ||
| 411 | K | 36.7 | Very low | 43.8 | Very low | 161 Ų | 161 | 139.5 Ų | 139.5 | 70% | 0.7 | 72% | 0.723 | S | S | * | * | trans | -60.6 | 94.1 | 147.9 | -65.6 | 175.8 | -168.9 | 72.5 | 0 | 108 | D408 Q413 | D408-K411 IonicContact OD1-NZ 3.85Å; D408-K411 PolarHBondContact OD1-NZ 2.85Å; D408-K411 IonicContact OD2-NZ 2.68Å; D408-K411 PolarHBondContact OD2-NZ 2.9Å; D408-K411 VanDerWaalsContact OD2-NZ 3.1Å; K411-Q413 VanDerWaalsContact C-N 3.31Å; K411-Q413 PolarHBondContact O-N 3.49Å | ||
| 412 | I | 37.3 | Very low | 45.4 | Very low | 143 Ų | 143 | 138.8 Ų | 138.8 | 73% | 0.733 | 71% | 0.713 | S | S | * | * | trans | -64.9 | 90.2 | -177.2 | -55.9 | 178.6 | 0 | 0 | 0 | 109.4 | G410 K414 | G410-I412 VanDerWaalsContact C-N 3.26Å; G410-I412 WeakPolarHBondContact O-CG1 3.49Å; G410-I412 PolarHBondContact O-N 3.39Å; I412-K414 HydrophobicContact CG2-CG 4.42Å; I412-K414 PolarHBondContact O-N 2.88Å; I412-K414 VanDerWaalsContact O-N 3.08Å | ||
| 413 | Q | 42.7 | Very low | 47 | Very low | 167 Ų | 167 | 139.2 Ų | 139.2 | 78% | 0.78 | 70% | 0.701 | S | S | * | * | trans | -59.7 | 111.6 | 159.3 | -74.8 | -171.8 | -30.8 | 0 | 0 | 107.1 | K411 S415 | K411-Q413 VanDerWaalsContact C-N 3.31Å; K411-Q413 PolarHBondContact O-N 3.49Å; Q413-S415 PolarHBondContact O-N 3.48Å; Q413-S415 PolarHBondContact O-OG 2.85Å | ||
| 414 | K | 36.8 | Very low | 48.7 | Very low | 158 Ų | 158 | 134.4 Ų | 134.4 | 69% | 0.687 | 67% | 0.671 | S | S | * | * | trans | -72.4 | 76.1 | 176.2 | -69.8 | 177.5 | 178 | 175.3 | 0 | 109.1 | I412 Y416 | I412-K414 HydrophobicContact CG2-CG 4.42Å; I412-K414 PolarHBondContact O-N 2.88Å; I412-K414 VanDerWaalsContact O-N 3.08Å; K414-Y416 HydrophobicContact CB-CD2 4.33Å; K414-Y416 HydrophobicContact CB-CE2 3.77Å; K414-Y416 WeakPolarHBondContact O-CD2 3.41Å; K414-Y416 PolarHBondContact O-N 3.35Å; K414-Y416 VanDerWaalsContact O-N 3.12Å | ||
| 415 | S | 52.6 | Low | 50.1 | Low | 92 Ų | 92 | 134.2 Ų | 134.2 | 64% | 0.643 | 66% | 0.657 | S | S | * | * | trans | -76.5 | 91.9 | 178.6 | -62.8 | 0 | 0 | 0 | 0 | 109.4 | Q413 W417 | Q413-S415 PolarHBondContact O-N 3.48Å; Q413-S415 PolarHBondContact O-OG 2.85Å; S415-W417 PolarHBondContact O-N 3.36Å | ||
| 416 | Y | 54.4 | Low | 51.7 | Low | 199 Ų | 199 | 130.2 Ų | 130.2 | 78% | 0.78 | 64% | 0.641 | S | S | * | * | trans | -70.1 | 16 | 179.9 | -74.7 | -83.7 | 0 | 0 | 0 | 114.8 | K414 | K414-Y416 HydrophobicContact CB-CD2 4.33Å; K414-Y416 HydrophobicContact CB-CE2 3.77Å; K414-Y416 WeakPolarHBondContact O-CD2 3.41Å; K414-Y416 PolarHBondContact O-N 3.35Å; K414-Y416 VanDerWaalsContact O-N 3.12Å | ||
| 417 | W | 51.8 | Low | 53.1 | Low | 190 Ų | 190 | 125.2 Ų | 125.2 | 72% | 0.72 | 62% | 0.623 | S | S | * | * | S | Bend | trans | -138.5 | 158.5 | -175.3 | -74.2 | 89.9 | 0 | 0 | 0 | 111.2 | S415 D424 | S415-W417 PolarHBondContact O-N 3.36Å; W417-D424 HydrophobicContact CE3-CB 4.09Å; W417-D424 HydrophobicContact CZ3-CB 4.22Å |
| 418 | S | 52.2 | Low | 54.8 | Low | 54 Ų | 54 | 121.6 Ų | 121.6 | 38% | 0.378 | 61% | 0.611 | S | S | . | * | trans | -71.1 | 158.3 | -170.8 | 83.2 | 0 | 0 | 0 | 0 | 112.2 | H420 D424 | S418-H420 PolarHBondContact O-N 2.95Å; S418-H420 PolarHBondContact OG-N 3.46Å; S418-H420 PolarHBondContact OG-O 2.97Å; S418-D424 PolarHBondContact OG-OD1 2.85Å | ||
| 419 | R | 59.5 | Low | 56.1 | Low | 251 Ų | 251 | 117.2 Ų | 117.2 | 95% | 0.947 | 59% | 0.593 | S | S | * | * | S | Bend | trans | -67.8 | 3.2 | 169.8 | -85.4 | -176.4 | 168.4 | 175.8 | -3.6 | 113.6 | ||
| 420 | H | 60.5 | Low | 58 | Low | 122 Ų | 122 | 117.8 Ų | 117.8 | 57% | 0.565 | 59% | 0.588 | S | S | * | * | trans | -126.7 | 82.6 | -168.5 | -60.1 | 109.7 | 0 | 0 | 0 | 111.9 | S418 L422 I423 | S418-H420 PolarHBondContact O-N 2.95Å; S418-H420 PolarHBondContact OG-N 3.46Å; S418-H420 PolarHBondContact OG-O 2.97Å; H420-L422 PolarHBondContact O-N 3.44Å; H420-I423 HydrophobicContact CB-CD1 3.95Å; H420-I423 HydrophobicContact CB-CG1 4.18Å; H420-I423 PolarHBondContact O-N 3.46Å | ||
| 421 | F | 62.7 | Low | 59.4 | Low | 136 Ų | 136 | 119.5 Ų | 119.5 | 60% | 0.596 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -41.3 | -33.6 | 175.7 | 171.1 | -101 | 0 | 0 | 0 | 115.2 | I423 L425 | F421-I423 PolarHBondContact O-N 3.36Å; F421-L425 HydrophobicContact CE1-CD2 3.96Å; F421-L425 HydrophobicContact CZ-CD2 4.24Å; F421-L425 WeakPolarHBondContact O-CB 3.36Å; F421-L425 PolarHBondContact O-N 3.1Å |
| 422 | L | 63.9 | Low | 60.9 | Low | 132 Ų | 132 | 114.9 Ų | 114.9 | 69% | 0.691 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -65.3 | -33.8 | 177.8 | -67.2 | 173.3 | 0 | 0 | 0 | 113.6 | H420 L426 | H420-L422 PolarHBondContact O-N 3.44Å; L422-L426 WeakPolarHBondContact O-CB 3.47Å; L422-L426 PolarHBondContact O-N 3.26Å |
| 423 | I | 68.4 | Low | 62.7 | Low | 104 Ų | 104 | 112.6 Ų | 112.6 | 53% | 0.533 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -73.1 | -45.5 | 179.1 | -64.2 | 176.9 | 0 | 0 | 0 | 109.5 | H420 F421 L425 L426 A427 | H420-I423 HydrophobicContact CB-CD1 3.95Å; H420-I423 HydrophobicContact CB-CG1 4.18Å; H420-I423 PolarHBondContact O-N 3.46Å; F421-I423 PolarHBondContact O-N 3.36Å; I423-L425 VanDerWaalsContact C-N 3.34Å; I423-L425 PolarHBondContact O-N 2.95Å; I423-L426 PolarHBondContact O-N 2.89Å; I423-A427 WeakPolarHBondContact O-CB 3.44Å; I423-A427 PolarHBondContact O-N 3.39Å |
| 424 | D | 68.8 | Low | 63.9 | Low | 36 Ų | 36 | 108.6 Ų | 108.6 | 19% | 0.193 | 56% | 0.555 | C | S | . | * | H | α-helix | trans | -64.3 | -40.5 | 178.2 | -52.2 | -5.7 | 0 | 0 | 0 | 110.7 | W417 S418 V428 | W417-D424 HydrophobicContact CE3-CB 4.09Å; W417-D424 HydrophobicContact CZ3-CB 4.22Å; S418-D424 PolarHBondContact OG-OD1 2.85Å; D424-V428 WeakPolarHBondContact O-CG2 3.46Å; D424-V428 PolarHBondContact O-N 3.18Å |
| 425 | L | 71.3 | Confident | 65.3 | Low | 85 Ų | 85 | 105 Ų | 105 | 45% | 0.445 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -64.8 | -41.7 | 172.6 | -179.7 | 62.6 | 0 | 0 | 0 | 112.1 | F421 I423 V428 A429 | F421-L425 HydrophobicContact CE1-CD2 3.96Å; F421-L425 HydrophobicContact CZ-CD2 4.24Å; F421-L425 WeakPolarHBondContact O-CB 3.36Å; F421-L425 PolarHBondContact O-N 3.1Å; I423-L425 VanDerWaalsContact C-N 3.34Å; I423-L425 PolarHBondContact O-N 2.95Å; L425-V428 PolarHBondContact O-N 3.25Å; L425-A429 VanDerWaalsContact O-CB 3.25Å; L425-A429 WeakPolarHBondContact O-CB 3.42Å; L425-A429 PolarHBondContact O-N 3.19Å |
| 426 | L | 69.3 | Low | 66.2 | Low | 103 Ų | 103 | 103.4 Ų | 103.4 | 54% | 0.539 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -66.5 | -40 | 178.4 | -172.8 | 69.9 | 0 | 0 | 0 | 111.6 | L422 I423 V428 A429 I430 | L422-L426 WeakPolarHBondContact O-CB 3.47Å; L422-L426 PolarHBondContact O-N 3.26Å; I423-L426 PolarHBondContact O-N 2.89Å; L426-V428 VanDerWaalsContact C-N 3.29Å; L426-V428 PolarHBondContact O-N 3.37Å; L426-A429 PolarHBondContact O-N 3.05Å; L426-A429 VanDerWaalsContact O-N 3.12Å; L426-I430 HydrophobicContact CD1-CD1 4.35Å; L426-I430 HydrophobicContact CD1-CG1 4.23Å; L426-I430 HydrophobicContact CD2-CD1 4.32Å; L426-I430 HydrophobicContact CG-CD1 3.82Å; L426-I430 HydrophobicContact CG-CG1 4.17Å; L426-I430 VanDerWaalsContact O-CG1 3.31Å; L426-I430 WeakPolarHBondContact O-CG1 3.47Å; L426-I430 PolarHBondContact O-N 3.12Å |
| 427 | A | 71.6 | Confident | 67 | Low | 61 Ų | 61 | 96.2 Ų | 96.2 | 50% | 0.504 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.5 | -37.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | I423 P431 | I423-A427 WeakPolarHBondContact O-CB 3.44Å; I423-A427 PolarHBondContact O-N 3.39Å; A427-P431 VanDerWaalsContact O-CD 3.25Å; A427-P431 WeakPolarHBondContact O-CD 3.39Å |
| 428 | V | 73.4 | Confident | 68 | Low | 81 Ų | 81 | 96.9 Ų | 96.9 | 49% | 0.491 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -77.9 | -30.6 | 173.3 | 176.6 | 0 | 0 | 0 | 0 | 112.2 | D424 L425 L426 V432 | D424-V428 WeakPolarHBondContact O-CG2 3.46Å; D424-V428 PolarHBondContact O-N 3.18Å; L425-V428 PolarHBondContact O-N 3.25Å; L426-V428 VanDerWaalsContact C-N 3.29Å; L426-V428 PolarHBondContact O-N 3.37Å; V428-V432 WeakPolarHBondContact O-CG2 3.48Å |
| 429 | A | 69.5 | Low | 68.8 | Low | 37 Ų | 37 | 99.3 Ų | 99.3 | 31% | 0.306 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -77.2 | -38.8 | -178.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | L425 L426 V432 V433 | L425-A429 VanDerWaalsContact O-CB 3.25Å; L425-A429 WeakPolarHBondContact O-CB 3.42Å; L425-A429 PolarHBondContact O-N 3.19Å; L426-A429 PolarHBondContact O-N 3.05Å; L426-A429 VanDerWaalsContact O-N 3.12Å; A429-V432 WeakPolarHBondContact O-CA 3.45Å; A429-V432 WeakPolarHBondContact O-CB 3.1Å; A429-V432 PolarHBondContact O-N 2.97Å; A429-V433 PolarHBondContact O-N 3.37Å |
| 430 | I | 75.8 | Confident | 69.1 | Low | 109 Ų | 109 | 92.2 Ų | 92.2 | 56% | 0.559 | 51% | 0.513 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.8 | -47.4 | -175.7 | -76.5 | 164.2 | 0 | 0 | 0 | 112.6 | L426 V432 P434 | L426-I430 HydrophobicContact CD1-CD1 4.35Å; L426-I430 HydrophobicContact CD1-CG1 4.23Å; L426-I430 HydrophobicContact CD2-CD1 4.32Å; L426-I430 HydrophobicContact CG-CD1 3.82Å; L426-I430 HydrophobicContact CG-CG1 4.17Å; L426-I430 VanDerWaalsContact O-CG1 3.31Å; L426-I430 WeakPolarHBondContact O-CG1 3.47Å; L426-I430 PolarHBondContact O-N 3.12Å; I430-V432 PolarHBondContact O-N 3.37Å; I430-P434 VanDerWaalsContact O-CD 3.26Å; I430-P434 WeakPolarHBondContact O-CD 3.49Å |
| 431 | P | 67.4 | Low | 69.4 | Low | 89 Ų | 89 | 96.7 Ų | 96.7 | 58% | 0.578 | 53% | 0.525 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.6 | -18.6 | 175.7 | -20.7 | 34.1 | 0 | 0 | 0 | 114.5 | A427 | A427-P431 VanDerWaalsContact O-CD 3.25Å; A427-P431 WeakPolarHBondContact O-CD 3.39Å |
| 432 | V | 69.5 | Low | 69.2 | Low | 63 Ų | 63 | 92.3 Ų | 92.3 | 38% | 0.382 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -92.7 | -27.6 | -174.9 | 178.2 | 0 | 0 | 0 | 0 | 112.1 | V428 A429 I430 T435 V436 | V428-V432 WeakPolarHBondContact O-CG2 3.48Å; A429-V432 WeakPolarHBondContact O-CA 3.45Å; A429-V432 WeakPolarHBondContact O-CB 3.1Å; A429-V432 PolarHBondContact O-N 2.97Å; I430-V432 PolarHBondContact O-N 3.37Å; V432-T435 PolarHBondContact O-N 2.78Å; V432-T435 PolarHBondContact O-OG1 3.23Å; V432-V436 HydrophobicContact CG1-CG2 3.8Å; V432-V436 WeakPolarHBondContact O-CG2 3.3Å; V432-V436 PolarHBondContact O-N 2.89Å |
| 433 | V | 75.3 | Confident | 68.6 | Low | 96 Ų | 96 | 91.9 Ų | 91.9 | 58% | 0.582 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -55.6 | -46 | 177.8 | 175.3 | 0 | 0 | 0 | 0 | 112.8 | A429 T435 V436 A437 | A429-V433 PolarHBondContact O-N 3.37Å; V433-T435 PolarHBondContact O-N 2.93Å; V433-V436 PolarHBondContact O-N 3.26Å; V433-A437 VanDerWaalsContact O-CB 3.24Å; V433-A437 WeakPolarHBondContact O-CB 3.43Å; V433-A437 PolarHBondContact O-N 3.35Å |
| 434 | P | 68 | Low | 68.1 | Low | 83 Ų | 83 | 93.9 Ų | 93.9 | 54% | 0.539 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -62.4 | -42.1 | 179.2 | -23.9 | 34.8 | 0 | 0 | 0 | 113.5 | I430 A437 W438 | I430-P434 VanDerWaalsContact O-CD 3.26Å; I430-P434 WeakPolarHBondContact O-CD 3.49Å; P434-A437 PolarHBondContact O-N 2.85Å; P434-W438 WeakPolarHBondContact O-CB 3.36Å; P434-W438 PolarHBondContact O-N 3.49Å |
| 435 | T | 66.3 | Low | 67.2 | Low | 83 Ų | 83 | 103.7 Ų | 103.7 | 51% | 0.509 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -71.3 | -33.5 | -179 | 53.9 | 0 | 0 | 0 | 0 | 112.4 | V432 V433 L439 | V432-T435 PolarHBondContact O-N 2.78Å; V432-T435 PolarHBondContact O-OG1 3.23Å; V433-T435 PolarHBondContact O-N 2.93Å; T435-L439 VanDerWaalsContact O-CB 3.3Å; T435-L439 WeakPolarHBondContact O-CB 3.35Å; T435-L439 PolarHBondContact O-N 3.27Å; T435-L439 VanDerWaalsContact O-N 3.1Å |
| 436 | V | 70.3 | Confident | 66.4 | Low | 57 Ų | 57 | 103.4 Ų | 103.4 | 35% | 0.345 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -71.9 | -43.1 | 171.8 | 175 | 0 | 0 | 0 | 0 | 111.4 | V432 V433 W438 L439 C440 | V432-V436 HydrophobicContact CG1-CG2 3.8Å; V432-V436 WeakPolarHBondContact O-CG2 3.3Å; V432-V436 PolarHBondContact O-N 2.89Å; V433-V436 PolarHBondContact O-N 3.26Å; V436-W438 VanDerWaalsContact C-N 3.3Å; V436-W438 PolarHBondContact O-N 2.97Å; V436-L439 PolarHBondContact O-N 3.46Å; V436-C440 WeakPolarHBondContact O-CB 3.5Å; V436-C440 PolarHBondContact O-N 2.86Å; V436-C440 PolarHBondContact O-SG 3.49Å; V436-C440 VanDerWaalsContact O-SG 3.32Å |
| 437 | A | 72.4 | Confident | 65.3 | Low | 48 Ų | 48 | 101.9 Ų | 101.9 | 40% | 0.397 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -63.2 | -35 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | V433 P434 R441 | V433-A437 VanDerWaalsContact O-CB 3.24Å; V433-A437 WeakPolarHBondContact O-CB 3.43Å; V433-A437 PolarHBondContact O-N 3.35Å; P434-A437 PolarHBondContact O-N 2.85Å; A437-R441 PolarHBondContact O-N 2.87Å |
| 438 | W | 72.6 | Confident | 63.8 | Low | 205 Ų | 205 | 107.8 Ų | 107.8 | 78% | 0.777 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -68.5 | -48.7 | 172.1 | -175.5 | 85.6 | 0 | 0 | 0 | 111.8 | P434 V436 C440 R441 G442 | P434-W438 WeakPolarHBondContact O-CB 3.36Å; P434-W438 PolarHBondContact O-N 3.49Å; V436-W438 VanDerWaalsContact C-N 3.3Å; V436-W438 PolarHBondContact O-N 2.97Å; W438-C440 VanDerWaalsContact C-N 3.25Å; W438-C440 PolarHBondContact O-N 3.48Å; W438-R441 PolarHBondContact O-N 3.3Å; W438-G442 PolarHBondContact O-N 3.13Å; W438-G442 VanDerWaalsContact O-N 3.16Å |
| 439 | L | 68.8 | Low | 62.7 | Low | 104 Ų | 104 | 108 Ų | 108 | 55% | 0.545 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -59.8 | -34.2 | 178.1 | -173.6 | 65.6 | 0 | 0 | 0 | 112.6 | T435 V436 R441 | T435-L439 VanDerWaalsContact O-CB 3.3Å; T435-L439 WeakPolarHBondContact O-CB 3.35Å; T435-L439 PolarHBondContact O-N 3.27Å; T435-L439 VanDerWaalsContact O-N 3.1Å; V436-L439 PolarHBondContact O-N 3.46Å; L439-R441 VanDerWaalsContact C-N 3.3Å; L439-R441 PolarHBondContact O-N 2.9Å |
| 440 | C | 65.7 | Low | 61.4 | Low | 102 Ų | 102 | 115.4 Ų | 115.4 | 69% | 0.689 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.1 | 0.3 | 176 | -66.4 | 0 | 0 | 0 | 0 | 114.6 | V436 W438 | V436-C440 WeakPolarHBondContact O-CB 3.5Å; V436-C440 PolarHBondContact O-N 2.86Å; V436-C440 PolarHBondContact O-SG 3.49Å; V436-C440 VanDerWaalsContact O-SG 3.32Å; W438-C440 VanDerWaalsContact C-N 3.25Å; W438-C440 PolarHBondContact O-N 3.48Å |
| 441 | R | 66.4 | Low | 60.6 | Low | 217 Ų | 217 | 117.6 Ų | 117.6 | 82% | 0.819 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -119.7 | -12.1 | 177.6 | -90.7 | -170.4 | 157.1 | 94.3 | -0.6 | 115.1 | A437 W438 L439 P443 | A437-R441 PolarHBondContact O-N 2.87Å; W438-R441 PolarHBondContact O-N 3.3Å; L439-R441 VanDerWaalsContact C-N 3.3Å; L439-R441 PolarHBondContact O-N 2.9Å; R441-P443 WeakPolarHBondContact O-CD 3.27Å |
| 442 | G | 59.1 | Low | 59.9 | Low | 43 Ų | 43 | 119.8 Ų | 119.8 | 44% | 0.443 | 66% | 0.656 | S | S | . | * | S | Bend | trans | -75.5 | 125.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | W438 V444 | W438-G442 PolarHBondContact O-N 3.13Å; W438-G442 VanDerWaalsContact O-N 3.16Å; G442-V444 PolarHBondContact O-N 3.18Å |
| 443 | P | 51.3 | Low | 59.4 | Low | 124 Ų | 124 | 124.8 Ų | 124.8 | 81% | 0.805 | 67% | 0.673 | S | S | * | * | trans | -60.1 | 132.1 | 168.2 | -22.4 | 34.2 | 0 | 0 | 0 | 110.8 | R441 R445 | R441-P443 WeakPolarHBondContact O-CD 3.27Å; P443-R445 PolarHBondContact O-N 3.46Å | ||
| 444 | V | 58.3 | Low | 58.8 | Low | 146 Ų | 146 | 122.5 Ų | 122.5 | 89% | 0.885 | 67% | 0.669 | S | S | * | * | trans | -72.9 | 87.8 | -173.3 | -175.6 | 0 | 0 | 0 | 0 | 111.1 | G442 G446 | G442-V444 PolarHBondContact O-N 3.18Å; V444-G446 PolarHBondContact O-N 3.17Å | ||
| 445 | R | 48.5 | Very low | 58.6 | Low | 241 Ų | 241 | 120.6 Ų | 120.6 | 91% | 0.909 | 66% | 0.657 | S | S | * | * | trans | -82.2 | 104.6 | 158.3 | -86.6 | -171.8 | 155.9 | 131.4 | -1.5 | 108.7 | P443 G447 | P443-R445 PolarHBondContact O-N 3.46Å; R445-G447 PolarHBondContact O-N 2.8Å | ||
| 446 | G | 55.1 | Low | 58.5 | Low | 79 Ų | 79 | 121.3 Ų | 121.3 | 81% | 0.814 | 66% | 0.657 | S | S | * | * | trans | -66.5 | 123.6 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111 | V444 | V444-G446 PolarHBondContact O-N 3.17Š| ||
| 447 | G | 45.7 | Very low | 58.4 | Low | 71 Ų | 71 | 123.2 Ų | 123.2 | 73% | 0.732 | 67% | 0.665 | S | S | * | * | trans | 179.7 | 82.9 | -177.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | R445 | R445-G447 PolarHBondContact O-N 2.8Š| ||
| 448 | Q | 41.4 | Very low | 58.2 | Low | 186 Ų | 186 | 127.3 Ų | 127.3 | 87% | 0.869 | 67% | 0.67 | S | S | * | * | trans | 64.5 | 143.7 | 179.2 | -70.9 | -74.4 | -35.4 | 0 | 0 | 116.7 | ||||
| 449 | P | 49.5 | Very low | 58.3 | Low | 85 Ų | 85 | 119 Ų | 119 | 55% | 0.552 | 65% | 0.649 | S | S | * | * | trans | -95.1 | 105.5 | -173.1 | 35.1 | -31.3 | 0 | 0 | 0 | 112.9 | Y451 | P449-Y451 HydrophobicContact CB-CD2 3.83Å; P449-Y451 HydrophobicContact CB-CE2 3.84Å; P449-Y451 PolarHBondContact O-N 3.08Å | ||
| 450 | M | 42.4 | Very low | 58.1 | Low | 192 Ų | 192 | 118.1 Ų | 118.1 | 95% | 0.946 | 65% | 0.65 | S | S | * | * | trans | -78.5 | 66.2 | 173.7 | -150.7 | -171.7 | 92.7 | 0 | 0 | 112.8 | ||||
| 451 | Y | 59.7 | Low | 58.2 | Low | 155 Ų | 155 | 115.9 Ų | 115.9 | 61% | 0.608 | 64% | 0.635 | S | S | * | * | trans | -86.3 | 144.5 | 157 | -58.4 | -54.1 | 0 | 0 | 0 | 107.3 | P449 | P449-Y451 HydrophobicContact CB-CD2 3.83Å; P449-Y451 HydrophobicContact CB-CE2 3.84Å; P449-Y451 PolarHBondContact O-N 3.08Å | ||
| 452 | H | 52.7 | Low | 58.2 | Low | 135 Ų | 135 | 109.8 Ų | 109.8 | 63% | 0.625 | 62% | 0.622 | S | S | * | * | S | Bend | -139.7 | -20.2 | 60.4 | -82.8 | -83.6 | 0 | 0 | 0 | 117.4 | G454 S455 L456 | H452-G454 PolarHBondContact O-N 3.16Å; H452-S455 WeakPolarHBondContact CA-OG 3.37Å; H452-S455 PolarHBondContact O-N 3.25Å; H452-S455 PolarHBondContact O-OG 3.39Å; H452-L456 HydrophobicContact CB-CD1 3.91Å; H452-L456 HydrophobicContact CB-CG 4.47Å; H452-L456 WeakPolarHBondContact O-CB 3.28Å; H452-L456 WeakPolarHBondContact O-CG 3.49Å; H452-L456 PolarHBondContact O-N 3.42Å | |
| 453 | F | 57.8 | Low | 58.6 | Low | 169 Ų | 169 | 112.1 Ų | 112.1 | 74% | 0.741 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -61.7 | -49.7 | -169.4 | -121.3 | -86.3 | 0 | 0 | 0 | 113.2 | S455 L456 L457 | F453-S455 VanDerWaalsContact C-N 3.33Å; F453-S455 PolarHBondContact O-N 3.38Å; F453-L456 PolarHBondContact O-N 2.87Å; F453-L457 HydrophobicContact CD1-CD1 3.92Å; F453-L457 HydrophobicContact CE1-CD1 4.23Å; F453-L457 PolarHBondContact O-N 3.49Å |
| 454 | G | 62.6 | Low | 59.4 | Low | 48 Ų | 48 | 108.6 Ų | 108.6 | 50% | 0.495 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -65.3 | -31.7 | 178.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | H452 R458 | H452-G454 PolarHBondContact O-N 3.16Å; G454-R458 WeakPolarHBondContact O-CD 3.25Å; G454-R458 VanDerWaalsContact O-CG 3.24Å; G454-R458 WeakPolarHBondContact O-CG 3.41Å; G454-R458 PolarHBondContact O-N 2.89Å |
| 455 | S | 63.9 | Low | 59.7 | Low | 42 Ų | 42 | 106.1 Ų | 106.1 | 29% | 0.294 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -76.2 | -36.7 | 174.1 | 41.7 | 0 | 0 | 0 | 0 | 112.8 | H452 F453 R458 G459 | H452-S455 WeakPolarHBondContact CA-OG 3.37Å; H452-S455 PolarHBondContact O-N 3.25Å; H452-S455 PolarHBondContact O-OG 3.39Å; F453-S455 VanDerWaalsContact C-N 3.33Å; F453-S455 PolarHBondContact O-N 3.38Å; S455-R458 PolarHBondContact O-N 2.98Å; S455-G459 PolarHBondContact O-N 2.88Å |
| 456 | L | 63.7 | Low | 60.4 | Low | 98 Ų | 98 | 99.5 Ų | 99.5 | 51% | 0.513 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -67.3 | -41.4 | 174.9 | -81.5 | 165.3 | 0 | 0 | 0 | 111.1 | H452 F453 G459 C460 | H452-L456 HydrophobicContact CB-CD1 3.91Å; H452-L456 HydrophobicContact CB-CG 4.47Å; H452-L456 WeakPolarHBondContact O-CB 3.28Å; H452-L456 WeakPolarHBondContact O-CG 3.49Å; H452-L456 PolarHBondContact O-N 3.42Å; F453-L456 PolarHBondContact O-N 2.87Å; L456-G459 PolarHBondContact O-N 2.97Å; L456-C460 WeakPolarHBondContact O-CB 3.46Å; L456-C460 PolarHBondContact O-N 3.2Å; L456-C460 PolarHBondContact O-SG 2.77Å |
| 457 | L | 68.6 | Low | 60.5 | Low | 97 Ų | 97 | 99.1 Ų | 99.1 | 51% | 0.508 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -60.9 | -46.8 | 172.3 | -97.8 | 66.3 | 0 | 0 | 0 | 111.6 | F453 G459 C460 C461 | F453-L457 HydrophobicContact CD1-CD1 3.92Å; F453-L457 HydrophobicContact CE1-CD1 4.23Å; F453-L457 PolarHBondContact O-N 3.49Å; L457-G459 VanDerWaalsContact C-N 3.28Å; L457-G459 PolarHBondContact O-N 3.47Å; L457-C460 PolarHBondContact O-N 3.5Å; L457-C461 WeakPolarHBondContact O-CB 3.36Å; L457-C461 PolarHBondContact O-N 2.84Å; L457-C461 PolarHBondContact O-SG 3.29Å |
| 458 | R | 69 | Low | 61.1 | Low | 135 Ų | 135 | 101.8 Ų | 101.8 | 51% | 0.509 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -57.9 | -39.3 | 175.5 | -73.7 | 169.7 | -177 | 174.7 | 2.1 | 112.2 | G454 S455 T462 | G454-R458 WeakPolarHBondContact O-CD 3.25Å; G454-R458 VanDerWaalsContact O-CG 3.24Å; G454-R458 WeakPolarHBondContact O-CG 3.41Å; G454-R458 PolarHBondContact O-N 2.89Å; S455-R458 PolarHBondContact O-N 2.98Å; R458-T462 WeakPolarHBondContact O-CB 3.4Å; R458-T462 WeakPolarHBondContact O-CG2 3.49Å; R458-T462 PolarHBondContact O-N 3.4Å; R458-T462 PolarHBondContact O-OG1 3.49Å |
| 459 | G | 74.1 | Confident | 61.8 | Low | 31 Ų | 31 | 103.6 Ų | 103.6 | 32% | 0.32 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -65.9 | -55.4 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | S455 L456 L457 C461 T462 V463 | S455-G459 PolarHBondContact O-N 2.88Å; L456-G459 PolarHBondContact O-N 2.97Å; L457-G459 VanDerWaalsContact C-N 3.28Å; L457-G459 PolarHBondContact O-N 3.47Å; G459-C461 PolarHBondContact O-N 2.82Å; G459-T462 PolarHBondContact O-N 2.82Å; G459-T462 PolarHBondContact O-OG1 2.92Å; G459-V463 WeakPolarHBondContact O-CB 3.47Å; G459-V463 WeakPolarHBondContact O-CG2 3.44Å; G459-V463 PolarHBondContact O-N 3.32Å |
| 460 | C | 65.6 | Low | 62.2 | Low | 84 Ų | 84 | 108.7 Ų | 108.7 | 57% | 0.568 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -60.6 | -42.8 | -178.3 | -73.2 | 0 | 0 | 0 | 0 | 112.7 | L456 L457 V463 A464 | L456-C460 WeakPolarHBondContact O-CB 3.46Å; L456-C460 PolarHBondContact O-N 3.2Å; L456-C460 PolarHBondContact O-SG 2.77Å; L457-C460 PolarHBondContact O-N 3.5Å; C460-V463 PolarHBondContact O-N 2.8Å; C460-A464 VanDerWaalsContact O-CB 3.24Å; C460-A464 WeakPolarHBondContact O-CB 3.34Å; C460-A464 PolarHBondContact O-N 3.09Å |
| 461 | C | 66.4 | Low | 62.5 | Low | 55 Ų | 55 | 102.7 Ų | 102.7 | 37% | 0.372 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -65.1 | -41.8 | 178 | -66.4 | 0 | 0 | 0 | 0 | 112.2 | L457 G459 L465 | L457-C461 WeakPolarHBondContact O-CB 3.36Å; L457-C461 PolarHBondContact O-N 2.84Å; L457-C461 PolarHBondContact O-SG 3.29Å; G459-C461 PolarHBondContact O-N 2.82Å; C461-L465 WeakPolarHBondContact O-CB 3.43Å; C461-L465 VanDerWaalsContact O-CG 3.29Å; C461-L465 WeakPolarHBondContact O-CG 3.36Å; C461-L465 PolarHBondContact O-N 2.94Å |
| 462 | T | 66.9 | Low | 62.3 | Low | 90 Ų | 90 | 98.9 Ų | 98.9 | 55% | 0.552 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -70.7 | -37.6 | 178.1 | 50.6 | 0 | 0 | 0 | 0 | 112.4 | R458 G459 H466 | R458-T462 WeakPolarHBondContact O-CB 3.4Å; R458-T462 WeakPolarHBondContact O-CG2 3.49Å; R458-T462 PolarHBondContact O-N 3.4Å; R458-T462 PolarHBondContact O-OG1 3.49Å; G459-T462 PolarHBondContact O-N 2.82Å; G459-T462 PolarHBondContact O-OG1 2.92Å; T462-H466 WeakPolarHBondContact O-CB 3.22Å; T462-H466 PolarHBondContact O-N 3.3Å |
| 463 | V | 68.4 | Low | 62.1 | Low | 91 Ų | 91 | 94.7 Ų | 94.7 | 55% | 0.552 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -66.6 | -42.8 | 173.8 | 171.3 | 0 | 0 | 0 | 0 | 111.5 | G459 C460 H466 S467 | G459-V463 WeakPolarHBondContact O-CB 3.47Å; G459-V463 WeakPolarHBondContact O-CG2 3.44Å; G459-V463 PolarHBondContact O-N 3.32Å; C460-V463 PolarHBondContact O-N 2.8Å; V463-H466 PolarHBondContact O-N 2.72Å; V463-S467 WeakPolarHBondContact O-CB 3.46Å; V463-S467 PolarHBondContact O-N 2.86Å; V463-S467 PolarHBondContact O-OG 3.23Å |
| 464 | A | 68.3 | Low | 61.7 | Low | 50 Ų | 50 | 94.1 Ų | 94.1 | 41% | 0.413 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -60.5 | -46.5 | 176 | 0 | 0 | 0 | 0 | 0 | 111.8 | C460 H466 S467 L468 | C460-A464 VanDerWaalsContact O-CB 3.24Å; C460-A464 WeakPolarHBondContact O-CB 3.34Å; C460-A464 PolarHBondContact O-N 3.09Å; A464-H466 VanDerWaalsContact C-N 3.35Å; A464-H466 PolarHBondContact O-N 2.74Å; A464-S467 PolarHBondContact O-N 2.84Å; A464-L468 WeakPolarHBondContact O-CG 3.39Å; A464-L468 PolarHBondContact O-N 2.77Å |
| 465 | L | 64.8 | Low | 60.9 | Low | 95 Ų | 95 | 102.2 Ų | 102.2 | 50% | 0.497 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -62 | -38.8 | 175.3 | -72.4 | 168.4 | 0 | 0 | 0 | 112.5 | C461 R469 | C461-L465 WeakPolarHBondContact O-CB 3.43Å; C461-L465 VanDerWaalsContact O-CG 3.29Å; C461-L465 WeakPolarHBondContact O-CG 3.36Å; C461-L465 PolarHBondContact O-N 2.94Å; L465-R469 WeakPolarHBondContact O-CB 3.38Å; L465-R469 PolarHBondContact O-N 2.92Å; L465-R469 VanDerWaalsContact O-N 3.08Å |
| 466 | H | 61.8 | Low | 59.9 | Low | 101 Ų | 101 | 108.1 Ų | 108.1 | 47% | 0.468 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -68.1 | -38.8 | 175.2 | 178.2 | -98.9 | 0 | 0 | 0 | 112.5 | T462 V463 A464 R469 R470 | T462-H466 WeakPolarHBondContact O-CB 3.22Å; T462-H466 PolarHBondContact O-N 3.3Å; V463-H466 PolarHBondContact O-N 2.72Å; A464-H466 VanDerWaalsContact C-N 3.35Å; A464-H466 PolarHBondContact O-N 2.74Å; H466-R469 PolarHBondContact O-N 3.1Å; H466-R470 PolarHBondContact CE1-NE 2.71Å; H466-R470 PolarHBondContact NE2-NE 3.49Å; H466-R470 VanDerWaalsContact NE2-NE 3.13Å; H466-R470 PolarHBondContact O-N 2.81Å; H466-R470 VanDerWaalsContact O-N 3.14Å |
| 467 | S | 57.7 | Low | 58.7 | Low | 71 Ų | 71 | 113.2 Ų | 113.2 | 50% | 0.497 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -63.7 | -45.5 | 175 | -68.9 | 0 | 0 | 0 | 0 | 111.9 | V463 A464 R469 R470 G471 | V463-S467 WeakPolarHBondContact O-CB 3.46Å; V463-S467 PolarHBondContact O-N 2.86Å; V463-S467 PolarHBondContact O-OG 3.23Å; A464-S467 PolarHBondContact O-N 2.84Å; S467-R469 VanDerWaalsContact C-N 3.28Å; S467-R469 PolarHBondContact O-N 2.84Å; S467-R470 PolarHBondContact O-N 2.95Å; S467-R470 VanDerWaalsContact O-N 3.17Å; S467-G471 PolarHBondContact O-N 3.18Å |
| 468 | L | 57.7 | Low | 58.1 | Low | 127 Ų | 127 | 114.2 Ų | 114.2 | 67% | 0.665 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -57.6 | -41.8 | 173.1 | -70.8 | 167.3 | 0 | 0 | 0 | 111.5 | A464 R470 G471 G472 | A464-L468 WeakPolarHBondContact O-CG 3.39Å; A464-L468 PolarHBondContact O-N 2.77Å; L468-R470 VanDerWaalsContact C-N 3.29Å; L468-R470 PolarHBondContact O-N 2.8Å; L468-G471 PolarHBondContact O-N 2.63Å; L468-G472 PolarHBondContact O-N 3.42Å |
| 469 | R | 57.4 | Low | 56.9 | Low | 225 Ų | 225 | 113 Ų | 113 | 85% | 0.849 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -68.7 | -20.4 | 179.5 | -156.9 | 174.2 | -165.2 | 173 | 6.2 | 114.4 | L465 H466 S467 | L465-R469 WeakPolarHBondContact O-CB 3.38Å; L465-R469 PolarHBondContact O-N 2.92Å; L465-R469 VanDerWaalsContact O-N 3.08Å; H466-R469 PolarHBondContact O-N 3.1Å; S467-R469 VanDerWaalsContact C-N 3.28Å; S467-R469 PolarHBondContact O-N 2.84Å |
| 470 | R | 56.7 | Low | 55.4 | Low | 191 Ų | 191 | 118.7 Ų | 118.7 | 72% | 0.721 | 69% | 0.693 | S | S | * | * | H | α-helix | trans | -96.8 | -29.1 | 171.2 | -68.8 | -165.1 | -176.7 | -147.6 | 1.6 | 113.5 | H466 S467 L468 G473 | H466-R470 PolarHBondContact CE1-NE 2.71Å; H466-R470 PolarHBondContact NE2-NE 3.49Å; H466-R470 VanDerWaalsContact NE2-NE 3.13Å; H466-R470 PolarHBondContact O-N 2.81Å; H466-R470 VanDerWaalsContact O-N 3.14Å; S467-R470 PolarHBondContact O-N 2.95Å; S467-R470 VanDerWaalsContact O-N 3.17Å; L468-R470 VanDerWaalsContact C-N 3.29Å; L468-R470 PolarHBondContact O-N 2.8Å; R470-G473 PolarHBondContact O-N 2.78Å |
| 471 | G | 49.9 | Very low | 54.9 | Low | 67 Ų | 67 | 120.5 Ų | 120.5 | 69% | 0.691 | 70% | 0.699 | S | S | * | * | H | α-helix | trans | -69.9 | -27.7 | -178 | 0 | 0 | 0 | 0 | 0 | 114.7 | S467 L468 G473 | S467-G471 PolarHBondContact O-N 3.18Å; L468-G471 PolarHBondContact O-N 2.63Å; G471-G473 VanDerWaalsContact C-N 3.27Å; G471-G473 PolarHBondContact O-N 3.31Å |
| 472 | G | 53.7 | Low | 54.3 | Low | 74 Ų | 74 | 123.9 Ų | 123.9 | 76% | 0.763 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.2 | -3.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | L468 L474 | L468-G472 PolarHBondContact O-N 3.42Å; G472-L474 PolarHBondContact O-N 3.33Å |
| 473 | G | 49.3 | Very low | 53.6 | Low | 48 Ų | 48 | 125.8 Ų | 125.8 | 50% | 0.495 | 73% | 0.725 | S | S | . | * | trans | -85.8 | 100.9 | -176.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | R470 G471 R475 | R470-G473 PolarHBondContact O-N 2.78Å; G471-G473 VanDerWaalsContact C-N 3.27Å; G471-G473 PolarHBondContact O-N 3.31Å; G473-R475 PolarHBondContact O-N 2.81Å | ||
| 474 | L | 49 | Very low | 52.7 | Low | 156 Ų | 156 | 127.8 Ų | 127.8 | 82% | 0.817 | 74% | 0.735 | S | S | * | * | trans | -55.3 | 99 | 174.2 | 179.7 | 65.2 | 0 | 0 | 0 | 111.4 | G472 H476 | G472-L474 PolarHBondContact O-N 3.33Å; L474-H476 PolarHBondContact O-N 2.76Å | ||
| 475 | R | 45.2 | Very low | 51.7 | Low | 218 Ų | 218 | 132.7 Ų | 132.7 | 82% | 0.823 | 76% | 0.755 | S | S | * | * | trans | -83.1 | 88.4 | 173.7 | -75.8 | -71.9 | 177.8 | -144.9 | -2.1 | 109.8 | G473 Y477 | G473-R475 PolarHBondContact O-N 2.81Å; R475-Y477 PolarHBondContact O-N 2.98Å | ||
| 476 | H | 44.6 | Very low | 50.9 | Low | 167 Ų | 167 | 135.2 Ų | 135.2 | 77% | 0.773 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 118.5 | 161.9 | -116.6 | -81 | 0 | 0 | 0 | 109.2 | L474 | L474-H476 PolarHBondContact O-N 2.76Š|
| 477 | Y | 38.5 | Very low | 50.1 | Low | 205 Ų | 205 | 137.6 Ų | 137.6 | 80% | 0.804 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -83.8 | 129 | 158.4 | -82.9 | -93.8 | 0 | 0 | 0 | 107.7 | R475 | R475-Y477 PolarHBondContact O-N 2.98Š|
| 478 | P | 54.9 | Low | 49.5 | Very low | 117 Ų | 117 | 142.8 Ų | 142.8 | 76% | 0.76 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 138.8 | 161.9 | 31.1 | -31.8 | 0 | 0 | 0 | 108.7 | ||
| 479 | A | 44 | Very low | 48.8 | Very low | 110 Ų | 110 | 144.1 Ų | 144.1 | 91% | 0.909 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 145.6 | 169.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||
| 480 | G | 42.7 | Very low | 48 | Very low | 151 Ų | 151 | 136.7 Ų | 136.7 | 100% | 1.557 | 83% | 0.828 | S | S | * | * | trans | -166.9 | 0 | 176.6 | 0 | 0 | 0 | 0 | 0 | 110.1 |
Retrieved 480 of 480 residues in 138.9 ms
(Link to these results)