| 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 | 35.8 | Very low | 35.2 | Very low | 240 Ų | 240 | 138.5 Ų | 138.5 | 100% | 1.182 | 83% | 0.833 | S | S | * | * | 0 | 118.5 | 0 | -60.5 | -167.2 | 157.7 | 0 | 0 | 105.2 | |||||
| 2 | S | 38.6 | Very low | 34.6 | Very low | 109 Ų | 109 | 135.8 Ų | 135.8 | 76% | 0.762 | 83% | 0.825 | S | S | * | * | cis | -161.8 | 124.8 | 46.8 | -57.4 | 0 | 0 | 0 | 0 | 108 | ||||
| 3 | R | 34.3 | Very low | 34.3 | Very low | 254 Ų | 254 | 132.8 Ų | 132.8 | 96% | 0.958 | 82% | 0.824 | S | S | * | * | 55.4 | 114.3 | 102.3 | -72 | -170.3 | 177.5 | -163.4 | 0.3 | 115.6 | |||||
| 4 | G | 34 | Very low | 33.9 | Very low | 72 Ų | 72 | 136.3 Ų | 136.3 | 74% | 0.742 | 83% | 0.833 | S | S | * | * | trans | -82.3 | -166.1 | 167.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 5 | P | 48.5 | Very low | 33.7 | Very low | 126 Ų | 126 | 132.6 Ų | 132.6 | 82% | 0.818 | 83% | 0.833 | S | S | * | * | -140.1 | 143.3 | 128 | 24.3 | -3.3 | 0 | 0 | 0 | 113 | |||||
| 6 | S | 34.5 | Very low | 33.6 | Very low | 122 Ų | 122 | 130.5 Ų | 130.5 | 85% | 0.853 | 82% | 0.824 | S | S | * | * | 68.9 | 141.8 | 94.4 | -150.6 | 0 | 0 | 0 | 0 | 114.2 | |||||
| 7 | S | 31.8 | Very low | 33.3 | Very low | 107 Ų | 107 | 135.8 Ų | 135.8 | 75% | 0.748 | 83% | 0.825 | S | S | * | * | cis | 179.5 | 171.6 | -14.3 | 177.6 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 8 | A | 30.5 | Very low | 33.1 | Very low | 84 Ų | 84 | 138.4 Ų | 138.4 | 69% | 0.694 | 82% | 0.823 | S | S | * | * | trans | 84 | 145.6 | 158.6 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 9 | V | 30.4 | Very low | 33 | Very low | 142 Ų | 142 | 140.6 Ų | 140.6 | 86% | 0.861 | 83% | 0.83 | S | S | * | * | cis | -169.7 | 156.9 | -1.5 | 132.3 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 10 | L | 32.3 | Very low | 33.2 | Very low | 151 Ų | 151 | 139.9 Ų | 139.9 | 79% | 0.791 | 83% | 0.827 | S | S | * | * | trans | -67.7 | 171.9 | 174.8 | -72.5 | 156.6 | 0 | 0 | 0 | 114.6 | ||||
| 11 | P | 36.8 | Very low | 33.2 | Very low | 116 Ų | 116 | 139.3 Ų | 139.3 | 75% | 0.753 | 83% | 0.827 | S | S | * | * | -138.7 | 135.3 | 97.2 | 26.3 | -7.3 | 0 | 0 | 0 | 112.4 | |||||
| 12 | S | 28 | Very low | 33.1 | Very low | 106 Ų | 106 | 139.8 Ų | 139.8 | 74% | 0.741 | 82% | 0.815 | S | S | * | * | 66.5 | 105.1 | 75.5 | 79.7 | 0 | 0 | 0 | 0 | 117 | |||||
| 13 | A | 30.5 | Very low | 32.8 | Very low | 98 Ų | 98 | 140 Ų | 140 | 81% | 0.81 | 82% | 0.816 | S | S | * | * | trans | -154.9 | 99 | 146.5 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 14 | L | 29.2 | Very low | 32.8 | Very low | 181 Ų | 181 | 136.2 Ų | 136.2 | 95% | 0.948 | 81% | 0.814 | S | S | * | * | 53.2 | 93.8 | 89.7 | -97 | 149.7 | 0 | 0 | 0 | 114.8 | |||||
| 15 | G | 29.7 | Very low | 32.6 | Very low | 81 Ų | 81 | 137.7 Ų | 137.7 | 84% | 0.835 | 81% | 0.813 | S | S | * | * | trans | -156.5 | 94.7 | 162.8 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 16 | S | 32.3 | Very low | 31.7 | Very low | 99 Ų | 99 | 137.1 Ų | 137.1 | 69% | 0.692 | 81% | 0.811 | S | S | * | * | trans | -84.8 | 141.8 | -174.9 | 66.3 | 0 | 0 | 0 | 0 | 113 | ||||
| 17 | R | 29.2 | Very low | 31.5 | Very low | 220 Ų | 220 | 139.7 Ų | 139.7 | 83% | 0.83 | 82% | 0.815 | S | S | * | * | trans | 75.9 | 108.6 | 134.2 | -82.1 | 177 | 171.4 | -161 | -2.7 | 119.1 | ||||
| 18 | K | 30 | Very low | 31.6 | Very low | 184 Ų | 184 | 139.8 Ų | 139.8 | 80% | 0.8 | 82% | 0.815 | S | S | * | * | 174.4 | 124.7 | 86.6 | -98 | 159.9 | -170.7 | -175.7 | 0 | 111.3 | |||||
| 19 | L | 30.6 | Very low | 31.6 | Very low | 180 Ų | 180 | 143 Ų | 143 | 94% | 0.942 | 82% | 0.821 | S | S | * | * | trans | -71.9 | 130.4 | 162.4 | -77.6 | 148.5 | 0 | 0 | 0 | 108.9 | ||||
| 20 | T | 38.1 | Very low | 31.7 | Very low | 126 Ų | 126 | 144.8 Ų | 144.8 | 77% | 0.773 | 83% | 0.825 | S | S | * | * | trans | -130 | 148.4 | 165.5 | 45.2 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 21 | P | 31.6 | Very low | 31.5 | Very low | 127 Ų | 127 | 145.8 Ų | 145.8 | 83% | 0.825 | 83% | 0.831 | S | S | * | * | trans | -90.9 | 162.9 | -157.9 | 35.9 | -33.6 | 0 | 0 | 0 | 113.5 | S23 | P21-S23 PolarHBondContact O-N 2.91Š| ||
| 22 | R | 35.3 | Very low | 31.2 | Very low | 251 Ų | 251 | 143.3 Ų | 143.3 | 95% | 0.947 | 83% | 0.826 | S | S | * | * | trans | -47.8 | 125.4 | 171.5 | -64.8 | 172.2 | 170.7 | 154.3 | -3.7 | 112.5 | ||||
| 23 | S | 30.6 | Very low | 31.2 | Very low | 112 Ų | 112 | 142 Ų | 142 | 78% | 0.783 | 83% | 0.829 | S | S | * | * | trans | -158.6 | 114.8 | 152 | -179.5 | 0 | 0 | 0 | 0 | 108.4 | P21 | P21-S23 PolarHBondContact O-N 2.91Š| ||
| 24 | L | 34.5 | Very low | 31.2 | Very low | 175 Ų | 175 | 144.2 Ų | 144.2 | 92% | 0.916 | 83% | 0.832 | S | S | * | * | trans | -89.7 | 128.7 | 174.7 | -81.9 | 160.6 | 0 | 0 | 0 | 109.5 | ||||
| 25 | S | 30.2 | Very low | 31.3 | Very low | 103 Ų | 103 | 140.2 Ų | 140.2 | 72% | 0.72 | 83% | 0.825 | S | S | * | * | trans | 146.7 | 125.3 | 163 | 48.1 | 0 | 0 | 0 | 0 | 104.9 | ||||
| 26 | C | 29.7 | Very low | 31.4 | Very low | 115 Ų | 115 | 144.7 Ų | 144.7 | 78% | 0.777 | 83% | 0.829 | S | S | * | * | cis | -171 | 128.2 | 33.2 | 40.2 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 27 | L | 29.4 | Very low | 31.5 | Very low | 176 Ų | 176 | 147.9 Ų | 147.9 | 92% | 0.921 | 83% | 0.833 | S | S | * | * | trans | -144.4 | 114.4 | 166.4 | -75 | -179.4 | 0 | 0 | 0 | 110 | ||||
| 28 | S | 33.7 | Very low | 31.8 | Very low | 109 Ų | 109 | 142.8 Ų | 142.8 | 76% | 0.762 | 83% | 0.828 | S | S | * | * | trans | -162.5 | 129.8 | 158.5 | -35.4 | 0 | 0 | 0 | 0 | 103.4 | ||||
| 29 | D | 31.6 | Very low | 32.1 | Very low | 152 Ų | 152 | 145.3 Ų | 145.3 | 81% | 0.813 | 83% | 0.833 | S | S | * | * | cis | -157 | 148.9 | 4.6 | -80.8 | -52.7 | 0 | 0 | 0 | 106.5 | ||||
| 30 | L | 31.6 | Very low | 32.4 | Very low | 179 Ų | 179 | 142.7 Ų | 142.7 | 94% | 0.937 | 83% | 0.826 | S | S | * | * | trans | -135 | 101.9 | 163.6 | -78.7 | 177.4 | 0 | 0 | 0 | 108.5 | ||||
| 31 | D | 29.6 | Very low | 32 | Very low | 172 Ų | 172 | 143 Ų | 143 | 92% | 0.92 | 83% | 0.832 | S | S | * | * | trans | -177.3 | 143.4 | 142.2 | -140.7 | 10.9 | 0 | 0 | 0 | 106.2 | ||||
| 32 | G | 29.8 | Very low | 32.2 | Very low | 63 Ų | 63 | 148.3 Ų | 148.3 | 65% | 0.649 | 84% | 0.836 | S | S | * | * | cis | -174.9 | 160.1 | 6.1 | 0 | 0 | 0 | 0 | 0 | 106 | ||||
| 33 | G | 28.2 | Very low | 32.5 | Very low | 78 Ų | 78 | 141.4 Ų | 141.4 | 80% | 0.804 | 82% | 0.823 | S | S | * | * | trans | -72.7 | 158.2 | -151.4 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 34 | V | 31.1 | Very low | 33.2 | Very low | 146 Ų | 146 | 142.6 Ų | 142.6 | 89% | 0.885 | 83% | 0.828 | S | S | * | * | trans | -145.1 | 117.9 | 145.7 | -173.2 | 0 | 0 | 0 | 0 | 110 | ||||
| 35 | A | 30.1 | Very low | 33.2 | Very low | 96 Ų | 96 | 137.3 Ų | 137.3 | 79% | 0.793 | 82% | 0.817 | S | S | * | * | trans | 32.4 | 114.5 | 156 | 0 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 36 | L | 31.9 | Very low | 33.8 | Very low | 175 Ų | 175 | 138 Ų | 138 | 92% | 0.916 | 82% | 0.821 | S | S | * | * | trans | -86.7 | 120.2 | 158.8 | -93.8 | 148.2 | 0 | 0 | 0 | 109.9 | ||||
| 37 | E | 35.2 | Very low | 34.7 | Very low | 167 Ų | 167 | 139 Ų | 139 | 78% | 0.78 | 83% | 0.826 | S | S | * | * | trans | -108.3 | 132 | 159.6 | -97.4 | -70.1 | 137.6 | 0 | 0 | 108.7 | R39 | E37-R39 PolarHBondContact O-N 2.9Š| ||
| 38 | P | 34.8 | Very low | 35.1 | Very low | 112 Ų | 112 | 134 Ų | 134 | 73% | 0.727 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -82.8 | 116.2 | -173.7 | 25.9 | -20.2 | 0 | 0 | 0 | 111.4 | ||
| 39 | R | 36.1 | Very low | 35.7 | Very low | 238 Ų | 238 | 140.6 Ų | 140.6 | 90% | 0.898 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -84.3 | 133.7 | 172.6 | -74.9 | -174.9 | 166.6 | -175.5 | -3.1 | 111.3 | E37 | E37-R39 PolarHBondContact O-N 2.9Š|
| 40 | P | 36.5 | Very low | 36.3 | Very low | 124 Ų | 124 | 137.4 Ų | 137.4 | 81% | 0.805 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -71.7 | 142.9 | -174.6 | 25.3 | -31.3 | 0 | 0 | 0 | 113.3 | ||
| 41 | C | 30.8 | Very low | 37.3 | Very low | 133 Ų | 133 | 134.5 Ų | 134.5 | 90% | 0.899 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 129.7 | 175.1 | -57.5 | 0 | 0 | 0 | 0 | 111.5 | ||
| 42 | R | 35.3 | Very low | 38.6 | Very low | 239 Ų | 239 | 132 Ų | 132 | 90% | 0.902 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -92.2 | 135.8 | 172.2 | -161.3 | 179 | -150 | -170.6 | 6.2 | 110.1 | ||
| 43 | P | 41.1 | Very low | 39.6 | Very low | 105 Ų | 105 | 135 Ų | 135 | 68% | 0.682 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -73.8 | 164.6 | -179.8 | 30.4 | -34.5 | 0 | 0 | 0 | 112.7 | ||
| 44 | P | 45.6 | Very low | 40.8 | Very low | 137 Ų | 137 | 135.6 Ų | 135.6 | 89% | 0.89 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -79.2 | 131.1 | -172.7 | 32.3 | -31.8 | 0 | 0 | 0 | 111.1 | ||
| 45 | G | 34.4 | Very low | 41.6 | Very low | 65 Ų | 65 | 134.7 Ų | 134.7 | 67% | 0.67 | 81% | 0.808 | S | S | * | * | trans | -144.5 | 105.2 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 46 | S | 43.2 | Very low | 42.6 | Very low | 116 Ų | 116 | 134.5 Ų | 134.5 | 81% | 0.811 | 81% | 0.806 | S | S | * | * | trans | 63.7 | 144.1 | 152.6 | 57.5 | 0 | 0 | 0 | 0 | 121.8 | G48 | S46-G48 PolarHBondContact O-N 3.21Å; S46-G48 VanDerWaalsContact O-N 3.14Å | ||
| 47 | P | 49 | Very low | 43.3 | Very low | 137 Ų | 137 | 130.8 Ų | 130.8 | 89% | 0.89 | 79% | 0.793 | S | S | * | * | trans | -81.4 | 96.2 | -173.1 | 33.4 | -31.5 | 0 | 0 | 0 | 111.1 | ||||
| 48 | G | 37.2 | Very low | 44.3 | Very low | 72 Ų | 72 | 129.4 Ų | 129.4 | 74% | 0.742 | 80% | 0.802 | S | S | * | * | trans | -88.3 | 121 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112 | S46 | S46-G48 PolarHBondContact O-N 3.21Å; S46-G48 VanDerWaalsContact O-N 3.14Å | ||
| 49 | R | 46.4 | Very low | 44.7 | Very low | 246 Ų | 246 | 126.8 Ų | 126.8 | 93% | 0.928 | 80% | 0.795 | S | S | * | * | trans | -31.2 | 125.3 | 170 | -167.9 | 175.7 | -176.2 | -146.2 | 2.6 | 114 | ||||
| 50 | A | 44.7 | Very low | 45.1 | Very low | 86 Ų | 86 | 122.3 Ų | 122.3 | 71% | 0.711 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 139.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||
| 51 | P | 52.8 | Low | 45.4 | Very low | 117 Ų | 117 | 123.1 Ų | 123.1 | 76% | 0.76 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 151.2 | 172.1 | 27.4 | -31.6 | 0 | 0 | 0 | 110.9 | ||
| 52 | P | 56.7 | Low | 46.1 | Very low | 119 Ų | 119 | 121.5 Ų | 121.5 | 77% | 0.773 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 150.4 | 179.3 | 27.8 | -32.9 | 0 | 0 | 0 | 111.1 | ||
| 53 | P | 51.3 | Low | 46.7 | Very low | 128 Ų | 128 | 120.3 Ų | 120.3 | 83% | 0.831 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 139.9 | 179.8 | 26.9 | -32.9 | 0 | 0 | 0 | 111.2 | ||
| 54 | A | 51.9 | Low | 47 | Very low | 89 Ų | 89 | 123.4 Ų | 123.4 | 74% | 0.736 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 148.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 55 | P | 48.3 | Very low | 47.3 | Very low | 127 Ų | 127 | 127.7 Ų | 127.7 | 83% | 0.825 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 143.8 | 177.3 | 25.4 | -32.5 | 0 | 0 | 0 | 111.4 | ||
| 56 | A | 51.2 | Low | 47.7 | Very low | 92 Ų | 92 | 130.3 Ų | 130.3 | 76% | 0.76 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 141.1 | -176.1 | 0 | 0 | 0 | 0 | 0 | 112 | S58 | A56-S58 PolarHBondContact O-N 3.11Š|
| 57 | P | 47 | Very low | 48.1 | Very low | 98 Ų | 98 | 132.2 Ų | 132.2 | 64% | 0.636 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 131.1 | 168.1 | 27.4 | -30.9 | 0 | 0 | 0 | 109.7 | G59 | P57-G59 PolarHBondContact O-N 3.05Š|
| 58 | S | 55.9 | Low | 48 | Very low | 138 Ų | 138 | 132.8 Ų | 132.8 | 97% | 0.965 | 79% | 0.787 | S | S | * | * | S | Bend | trans | -71.5 | 72.8 | 171.2 | 51.7 | 0 | 0 | 0 | 0 | 110.5 | A56 | A56-S58 PolarHBondContact O-N 3.11Š|
| 59 | G | 43.4 | Very low | 48.5 | Very low | 56 Ų | 56 | 137.1 Ų | 137.1 | 58% | 0.577 | 79% | 0.792 | S | S | * | * | trans | -143.4 | 122.9 | 175 | 0 | 0 | 0 | 0 | 0 | 110.2 | P57 D61 | P57-G59 PolarHBondContact O-N 3.05Å; G59-D61 PolarHBondContact O-N 3.43Å | ||
| 60 | C | 44.9 | Very low | 48.6 | Very low | 144 Ų | 144 | 136.4 Ų | 136.4 | 97% | 0.973 | 79% | 0.789 | S | S | * | * | trans | -75.3 | 47.2 | -178.1 | -64.9 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 61 | D | 41.3 | Very low | 48.8 | Very low | 141 Ų | 141 | 144 Ų | 144 | 75% | 0.754 | 80% | 0.799 | S | S | * | * | trans | -107.5 | 108.5 | 176.2 | -148.7 | -4.4 | 0 | 0 | 0 | 109.9 | G59 R63 | G59-D61 PolarHBondContact O-N 3.43Å; D61-R63 PolarHBondContact O-N 2.74Å; D61-R63 VanDerWaalsContact O-N 3.1Å | ||
| 62 | P | 46.6 | Very low | 48.4 | Very low | 100 Ų | 100 | 142.4 Ų | 142.4 | 65% | 0.649 | 80% | 0.796 | S | S | * | * | trans | -68.1 | 113.8 | -175.7 | 25.7 | -30.6 | 0 | 0 | 0 | 109.9 | L64 | P62-L64 PolarHBondContact O-N 2.7Š| ||
| 63 | R | 48.5 | Very low | 47.9 | Very low | 214 Ų | 214 | 148.2 Ų | 148.2 | 81% | 0.808 | 80% | 0.802 | S | S | * | * | trans | -56.2 | 103.3 | 174.6 | -70.6 | -174 | 174.5 | 172.2 | -1.1 | 110.7 | D61 R65 | D61-R63 PolarHBondContact O-N 2.74Å; D61-R63 VanDerWaalsContact O-N 3.1Å; R63-R65 PolarHBondContact O-N 2.88Å; R63-R65 VanDerWaalsContact O-N 3.15Å | ||
| 64 | L | 46.4 | Very low | 47.6 | Very low | 169 Ų | 169 | 147.7 Ų | 147.7 | 89% | 0.885 | 80% | 0.802 | S | S | * | * | trans | -64.9 | 112.2 | 172.8 | -64.3 | 175.8 | 0 | 0 | 0 | 109.2 | P62 | P62-L64 PolarHBondContact O-N 2.7Š| ||
| 65 | R | 51.6 | Low | 47.5 | Very low | 227 Ų | 227 | 151.1 Ų | 151.1 | 86% | 0.857 | 81% | 0.807 | S | S | * | * | trans | -75.1 | 142.8 | 173.7 | -69.9 | -174.4 | 176.7 | -173.1 | -0.2 | 109.8 | R63 I67 | R63-R65 PolarHBondContact O-N 2.88Å; R63-R65 VanDerWaalsContact O-N 3.15Å; R65-I67 PolarHBondContact O-N 2.7Å | ||
| 66 | P | 44 | Very low | 47.4 | Very low | 120 Ų | 120 | 150.9 Ų | 150.9 | 78% | 0.779 | 81% | 0.805 | S | S | * | * | trans | -63.8 | 126.1 | 173.7 | -7.2 | 18.7 | 0 | 0 | 0 | 110.1 | I68 | P66-I68 PolarHBondContact O-N 3.05Å; P66-I68 VanDerWaalsContact O-N 3.08Å | ||
| 67 | I | 51.8 | Low | 47.1 | Very low | 156 Ų | 156 | 151.4 Ų | 151.4 | 80% | 0.8 | 80% | 0.804 | S | S | * | * | trans | -72 | 101.5 | 176.6 | -61.6 | 167.9 | 0 | 0 | 0 | 108 | R65 L69 | R65-I67 PolarHBondContact O-N 2.7Å; I67-L69 PolarHBondContact O-N 2.95Å; I67-L69 VanDerWaalsContact O-N 3.09Å | ||
| 68 | I | 46.5 | Very low | 47.1 | Very low | 150 Ų | 150 | 150 Ų | 150 | 77% | 0.769 | 80% | 0.796 | S | S | * | * | trans | -69.5 | 105 | 168.7 | -60.2 | 174.4 | 0 | 0 | 0 | 107.4 | P66 R70 | P66-I68 PolarHBondContact O-N 3.05Å; P66-I68 VanDerWaalsContact O-N 3.08Å; I68-R70 PolarHBondContact O-N 3.37Å | ||
| 69 | L | 48.1 | Very low | 46.7 | Very low | 162 Ų | 162 | 149.1 Ų | 149.1 | 85% | 0.848 | 79% | 0.787 | S | S | * | * | trans | -62.8 | 91.7 | 175.8 | -84.5 | 155.2 | 0 | 0 | 0 | 111 | I67 | I67-L69 PolarHBondContact O-N 2.95Å; I67-L69 VanDerWaalsContact O-N 3.09Å | ||
| 70 | R | 48.1 | Very low | 47 | Very low | 231 Ų | 231 | 154.8 Ų | 154.8 | 87% | 0.872 | 80% | 0.798 | S | S | * | * | trans | -78.8 | 116.4 | 156.3 | -74.2 | -172.8 | 175.1 | 178.5 | -0.6 | 107.8 | I68 A72 | I68-R70 PolarHBondContact O-N 3.37Å; R70-A72 PolarHBondContact O-N 3.07Å; R70-A72 VanDerWaalsContact O-N 3.09Å | ||
| 71 | R | 47.9 | Very low | 47.3 | Very low | 247 Ų | 247 | 155 Ų | 155 | 93% | 0.932 | 78% | 0.779 | S | S | * | * | trans | -59.3 | 113.6 | 170.4 | -81.1 | -175.2 | -174.4 | 175.1 | 2.5 | 109 | R73 | R71-R73 PolarHBondContact O-N 2.83Š| ||
| 72 | A | 44.6 | Very low | 47.5 | Very low | 82 Ų | 82 | 159.7 Ų | 159.7 | 68% | 0.678 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 127.7 | 171.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | R70 | R70-A72 PolarHBondContact O-N 3.07Å; R70-A72 VanDerWaalsContact O-N 3.09Å |
| 73 | R | 47.4 | Very low | 47.6 | Very low | 241 Ų | 241 | 163.6 Ų | 163.6 | 91% | 0.909 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 125.2 | 166.6 | -71.8 | -179.5 | 171.8 | -178.4 | -2.9 | 107.3 | R71 L75 | R71-R73 PolarHBondContact O-N 2.83Å; R73-L75 PolarHBondContact O-N 2.79Å |
| 74 | S | 43.7 | Very low | 47.6 | Very low | 118 Ų | 118 | 163.1 Ų | 163.1 | 83% | 0.825 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 129.6 | 179.7 | 49.7 | 0 | 0 | 0 | 0 | 111.2 | ||
| 75 | L | 50 | Low | 47.6 | Very low | 160 Ų | 160 | 158.9 Ų | 158.9 | 84% | 0.838 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -74.1 | 150 | 170.5 | -69.5 | 171.8 | 0 | 0 | 0 | 111 | R73 | R73-L75 PolarHBondContact O-N 2.79Š|
| 76 | P | 45.4 | Very low | 47.4 | Very low | 122 Ų | 122 | 153.6 Ų | 153.6 | 79% | 0.792 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 142.7 | 176.4 | 26.7 | -31.6 | 0 | 0 | 0 | 111.8 | S78 | P76-S78 PolarHBondContact O-N 3.16Š|
| 77 | S | 46.3 | Very low | 47.4 | Very low | 104 Ų | 104 | 150.9 Ų | 150.9 | 73% | 0.727 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 122.8 | -178.9 | 55.1 | 0 | 0 | 0 | 0 | 112 | ||
| 78 | S | 47.1 | Very low | 47.1 | Very low | 67 Ų | 67 | 147.9 Ų | 147.9 | 47% | 0.469 | 79% | 0.786 | S | S | . | * | P | Polyproline II helix | trans | -72.5 | 151.3 | 172.3 | 60.4 | 0 | 0 | 0 | 0 | 112.3 | P76 E80 R81 | P76-S78 PolarHBondContact O-N 3.16Å; S78-E80 VanDerWaalsContact C-N 3.29Å; S78-E80 PolarHBondContact O-N 3.36Å; S78-R81 WeakPolarHBondContact O-CB 3.36Å; S78-R81 PolarHBondContact O-N 3.26Å |
| 79 | P | 47.6 | Very low | 47.2 | Very low | 121 Ų | 121 | 147.2 Ų | 147.2 | 79% | 0.786 | 79% | 0.791 | S | S | * | * | G | 310 helix | trans | -69.6 | -18.3 | -172.9 | 26.4 | -33.6 | 0 | 0 | 0 | 114.6 | R81 R82 | P79-R81 PolarHBondContact O-N 3.38Å; P79-R82 PolarHBondContact O-N 3.1Å |
| 80 | E | 48.3 | Very low | 47.4 | Very low | 175 Ų | 175 | 142.6 Ų | 142.6 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | G | 310 helix | trans | -65.9 | -15 | 175 | -76.9 | 173.1 | 132.4 | 0 | 0 | 113.4 | S78 R82 | S78-E80 VanDerWaalsContact C-N 3.29Å; S78-E80 PolarHBondContact O-N 3.36Å; E80-R82 PolarHBondContact O-N 3.17Å |
| 81 | R | 52.1 | Low | 47.6 | Very low | 148 Ų | 148 | 136.8 Ų | 136.8 | 56% | 0.558 | 78% | 0.784 | S | S | * | * | G | 310 helix | trans | -75.5 | -4.9 | -180 | -166.4 | 175.2 | -98.3 | -118.5 | 1.7 | 113.9 | S78 P79 L109 G110 | S78-R81 WeakPolarHBondContact O-CB 3.36Å; S78-R81 PolarHBondContact O-N 3.26Å; P79-R81 PolarHBondContact O-N 3.38Å; R81-L109 PolarHBondContact NH2-O 2.81Å; R81-G110 PolarHBondContact NH1-O 2.86Å |
| 82 | R | 46.3 | Very low | 47.8 | Very low | 239 Ų | 239 | 129.9 Ų | 129.9 | 90% | 0.902 | 78% | 0.78 | S | S | * | * | G | 310 helix | trans | -82.6 | -17.1 | -176.3 | -155.1 | 175.5 | -164.2 | -136.4 | 3.2 | 114.7 | P79 E80 | P79-R82 PolarHBondContact O-N 3.1Å; E80-R82 PolarHBondContact O-N 3.17Å |
| 83 | Q | 48.9 | Very low | 48.2 | Very low | 183 Ų | 183 | 131.1 Ų | 131.1 | 86% | 0.855 | 78% | 0.782 | S | S | * | * | S | Bend | trans | -100.2 | -6.3 | -164.9 | -81.4 | -178 | -1.3 | 0 | 0 | 117.2 | ||
| 84 | K | 47.6 | Very low | 48.6 | Very low | 203 Ų | 203 | 130.1 Ų | 130.1 | 88% | 0.883 | 78% | 0.779 | S | S | * | * | trans | -134.8 | 86.9 | 178.8 | -83.8 | -177.4 | 175.8 | 176.6 | 0 | 112.7 | ||||
| 85 | A | 45.6 | Very low | 48.9 | Very low | 80 Ų | 80 | 131.2 Ų | 131.2 | 66% | 0.661 | 78% | 0.783 | S | S | * | * | trans | -165.6 | 84 | 149.8 | 0 | 0 | 0 | 0 | 0 | 109.5 | G87 | A85-G87 PolarHBondContact O-N 3.34Š| ||
| 86 | A | 48 | Very low | 49.2 | Very low | 117 Ų | 117 | 127.6 Ų | 127.6 | 97% | 0.967 | 78% | 0.784 | S | S | * | * | trans | -73 | 81.9 | 157 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 87 | G | 44.7 | Very low | 49.5 | Very low | 62 Ų | 62 | 125.1 Ų | 125.1 | 64% | 0.639 | 77% | 0.769 | S | S | * | * | trans | -86.6 | 147.7 | 171.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | A85 | A85-G87 PolarHBondContact O-N 3.34Š| ||
| 88 | A | 45.3 | Very low | 50.1 | Low | 94 Ų | 94 | 125.9 Ų | 125.9 | 78% | 0.777 | 78% | 0.775 | S | S | * | * | trans | -47.4 | 147.6 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114 | G90 | A88-G90 PolarHBondContact O-N 2.84Š| ||
| 89 | P | 48.7 | Very low | 50.3 | Low | 135 Ų | 135 | 132.8 Ų | 132.8 | 88% | 0.877 | 79% | 0.79 | S | S | * | * | trans | -68.6 | 101.6 | 179.9 | 27.7 | -31.8 | 0 | 0 | 0 | 110 | ||||
| 90 | G | 52.3 | Low | 50.7 | Low | 66 Ų | 66 | 135.9 Ų | 135.9 | 68% | 0.68 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 149.6 | 165.1 | 0 | 0 | 0 | 0 | 0 | 110.7 | A88 A92 | A88-G90 PolarHBondContact O-N 2.84Å; G90-A92 PolarHBondContact O-N 3.26Å |
| 91 | A | 51.5 | Low | 51 | Low | 108 Ų | 108 | 135.2 Ų | 135.2 | 89% | 0.893 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -47.9 | 128 | -175 | 0 | 0 | 0 | 0 | 0 | 113.1 | C93 | A91-C93 PolarHBondContact O-N 2.96Š|
| 92 | A | 53.1 | Low | 51.4 | Low | 103 Ų | 103 | 137.1 Ų | 137.1 | 85% | 0.851 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 128.6 | 179 | 0 | 0 | 0 | 0 | 0 | 110.8 | G90 | G90-A92 PolarHBondContact O-N 3.26Š|
| 93 | C | 51.7 | Low | 52.2 | Low | 107 Ų | 107 | 131.7 Ų | 131.7 | 72% | 0.723 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -82.3 | 152.4 | 171.2 | -145.5 | 0 | 0 | 0 | 0 | 110 | A91 | A91-C93 PolarHBondContact O-N 2.96Š|
| 94 | R | 57.3 | Low | 53.1 | Low | 221 Ų | 221 | 129.9 Ų | 129.9 | 83% | 0.834 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 155.5 | -173.7 | -75 | -175.5 | 173.4 | -175.5 | -1.9 | 113.4 | G96 | R94-G96 PolarHBondContact O-N 2.89Š|
| 95 | P | 49.1 | Very low | 54.3 | Low | 140 Ų | 140 | 128 Ų | 128 | 91% | 0.909 | 77% | 0.773 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.2 | 125.4 | -178 | -14.3 | 28.2 | 0 | 0 | 0 | 110.9 | ||
| 96 | G | 56.1 | Low | 55.9 | Low | 84 Ų | 84 | 126.4 Ų | 126.4 | 87% | 0.866 | 76% | 0.76 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 115.8 | -0.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 116.3 | R94 S98 | R94-G96 PolarHBondContact O-N 2.89Å; G96-S98 PolarHBondContact O-N 2.99Å |
| 97 | C | 51.5 | Low | 57 | Low | 71 Ų | 71 | 123.8 Ų | 123.8 | 48% | 0.48 | 73% | 0.73 | S | S | . | * | trans | -86.2 | 109.1 | 178.3 | -157.4 | 0 | 0 | 0 | 0 | 112 | R99 | C97-R99 PolarHBondContact O-N 2.96Š| ||
| 98 | S | 58.6 | Low | 58.3 | Low | 120 Ų | 120 | 125.5 Ų | 125.5 | 84% | 0.839 | 74% | 0.738 | S | S | * | * | trans | -78.8 | 32.3 | 175.4 | 57.3 | 0 | 0 | 0 | 0 | 114 | G96 Q100 | G96-S98 PolarHBondContact O-N 2.99Å; S98-Q100 PolarHBondContact O-N 2.77Å | ||
| 99 | R | 52.5 | Low | 59.5 | Low | 212 Ų | 212 | 127.3 Ų | 127.3 | 80% | 0.8 | 73% | 0.734 | S | S | * | * | trans | -96.4 | 69.2 | 179.2 | -66.4 | -179.3 | 73.3 | -179.1 | 3.1 | 111 | C97 L101 | C97-R99 PolarHBondContact O-N 2.96Å; R99-L101 PolarHBondContact O-N 3.13Å | ||
| 100 | Q | 55.4 | Low | 60.4 | Low | 185 Ų | 185 | 122.1 Ų | 122.1 | 86% | 0.864 | 71% | 0.705 | S | S | * | * | trans | -75.8 | -3.4 | 168.2 | -69.7 | -167.2 | -1.7 | 0 | 0 | 113.4 | S98 R102 | S98-Q100 PolarHBondContact O-N 2.77Å; Q100-R102 PolarHBondContact O-N 3.37Å; Q100-R102 VanDerWaalsContact O-N 3.13Å | ||
| 101 | L | 55.8 | Low | 61.4 | Low | 162 Ų | 162 | 123.9 Ų | 123.9 | 85% | 0.848 | 70% | 0.698 | S | S | * | * | trans | -80.7 | 95.3 | 176.1 | -63.1 | 174 | 0 | 0 | 0 | 110 | R99 | R99-L101 PolarHBondContact O-N 3.13Š| ||
| 102 | R | 60 | Low | 62.4 | Low | 188 Ų | 188 | 125.4 Ų | 125.4 | 71% | 0.709 | 69% | 0.687 | S | S | * | * | trans | -90 | 113.5 | 169.6 | -70 | 177 | 66.6 | -178.3 | 4.6 | 109.1 | Q100 | Q100-R102 PolarHBondContact O-N 3.37Å; Q100-R102 VanDerWaalsContact O-N 3.13Å | ||
| 103 | V | 63.1 | Low | 63.1 | Low | 124 Ų | 124 | 126.2 Ų | 126.2 | 75% | 0.752 | 68% | 0.676 | S | S | * | * | trans | -78.8 | 124.7 | 168.4 | -177 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 104 | R | 67.8 | Low | 63.6 | Low | 146 Ų | 146 | 123.8 Ų | 123.8 | 55% | 0.551 | 66% | 0.664 | S | S | * | * | trans | -117.7 | 139.8 | 168.8 | -66.9 | -167.7 | -176.9 | -163.6 | 3.8 | 108.4 | ||||
| 105 | F | 71.4 | Confident | 64 | Low | 163 Ų | 163 | 122.1 Ų | 122.1 | 72% | 0.715 | 67% | 0.665 | S | S | * | * | trans | -89.3 | 124.9 | 172.7 | -64.6 | -88 | 0 | 0 | 0 | 108.3 | L113 | F105-L113 HydrophobicContact CB-CD1 4.01Š| ||
| 106 | A | 79.2 | Confident | 64.9 | Low | 47 Ų | 47 | 121.4 Ų | 121.4 | 39% | 0.388 | 66% | 0.658 | S | S | . | * | B | Isolated β-bridge | trans | -138.4 | 155.7 | -176.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | L111 | A106-L111 CarbonylContact C-O 3.36Å; A106-L111 WeakPolarHBondContact CA-O 3.27Å; A106-L111 WeakPolarHBondContact CB-O 3.33Å |
| 107 | D | 72.4 | Confident | 65.4 | Low | 61 Ų | 61 | 123 Ų | 123 | 33% | 0.326 | 64% | 0.641 | S | S | . | * | trans | -68.6 | 179.8 | 174.6 | 73 | 5.4 | 0 | 0 | 0 | 111.8 | L109 G110 L111 L113 | D107-L109 PolarHBondContact O-N 2.87Å; D107-L109 VanDerWaalsContact O-N 3.09Å; D107-L109 VanDerWaalsContact OD1-C 3.3Å; D107-L109 VanDerWaalsContact OD1-CA 3.31Å; D107-L109 WeakPolarHBondContact OD1-CA 3.32Å; D107-L109 WeakPolarHBondContact OD1-CB 3.47Å; D107-L109 PolarHBondContact OD1-N 2.87Å; D107-G110 WeakPolarHBondContact O-CA 3.31Å; D107-G110 PolarHBondContact O-N 3.29Å; D107-G110 PolarHBondContact OD1-N 2.88Å; D107-L111 PolarHBondContact N-O 2.88Å; D107-L111 PolarHBondContact OD1-N 2.64Å; D107-L113 HydrophobicContact CB-CD2 3.85Å | ||
| 108 | A | 71.9 | Confident | 66.3 | Low | 98 Ų | 98 | 124.8 Ų | 124.8 | 81% | 0.81 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.9 | -16.6 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||
| 109 | L | 70.1 | Confident | 67 | Low | 132 Ų | 132 | 125.5 Ų | 125.5 | 69% | 0.691 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.4 | 0.5 | 175.1 | -56.1 | 178.3 | 0 | 0 | 0 | 112 | R81 D107 L111 | R81-L109 PolarHBondContact NH2-O 2.81Å; D107-L109 PolarHBondContact O-N 2.87Å; D107-L109 VanDerWaalsContact O-N 3.09Å; D107-L109 VanDerWaalsContact OD1-C 3.3Å; D107-L109 VanDerWaalsContact OD1-CA 3.31Å; D107-L109 WeakPolarHBondContact OD1-CA 3.32Å; D107-L109 WeakPolarHBondContact OD1-CB 3.47Å; D107-L109 PolarHBondContact OD1-N 2.87Å; L109-L111 VanDerWaalsContact C-N 3.33Å; L109-L111 HydrophobicContact CB-CG 4.42Å |
| 110 | G | 67.8 | Low | 68.2 | Low | 26 Ų | 26 | 120.2 Ų | 120.2 | 27% | 0.268 | 63% | 0.626 | S | S | . | * | S | Bend | trans | 73.9 | 21.4 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | R81 D107 | R81-G110 PolarHBondContact NH1-O 2.86Å; D107-G110 WeakPolarHBondContact O-CA 3.31Å; D107-G110 PolarHBondContact O-N 3.29Å; D107-G110 PolarHBondContact OD1-N 2.88Å |
| 111 | L | 73.3 | Confident | 69 | Low | 104 Ų | 104 | 117.1 Ų | 117.1 | 55% | 0.545 | 63% | 0.632 | S | S | . | * | trans | -88.8 | 150.2 | 171.7 | -59.3 | 175.8 | 0 | 0 | 0 | 110.3 | A106 D107 L109 L113 | A106-L111 CarbonylContact C-O 3.36Å; A106-L111 WeakPolarHBondContact CA-O 3.27Å; A106-L111 WeakPolarHBondContact CB-O 3.33Å; D107-L111 PolarHBondContact N-O 2.88Å; D107-L111 PolarHBondContact OD1-N 2.64Å; L109-L111 VanDerWaalsContact C-N 3.33Å; L109-L111 HydrophobicContact CB-CG 4.42Å; L111-L113 PolarHBondContact O-N 2.87Å | ||
| 112 | E | 72.5 | Confident | 69.8 | Low | 139 Ų | 139 | 112.9 Ų | 112.9 | 65% | 0.65 | 63% | 0.628 | S | S | * | * | B | Isolated β-bridge | trans | -62 | 132.2 | -177.7 | -167.8 | 162.6 | -162.9 | 0 | 0 | 111.3 | A114 | E112-A114 PolarHBondContact O-N 2.91Å; E112-A114 VanDerWaalsContact O-N 3.13Å |
| 113 | L | 68.5 | Low | 70.7 | Confident | 120 Ų | 120 | 107.9 Ų | 107.9 | 63% | 0.628 | 62% | 0.615 | S | S | * | * | S | Bend | trans | -69 | -7.2 | -178.6 | -73.7 | 173.4 | 0 | 0 | 0 | 113.9 | F105 D107 L111 | F105-L113 HydrophobicContact CB-CD1 4.01Å; D107-L113 HydrophobicContact CB-CD2 3.85Å; L111-L113 PolarHBondContact O-N 2.87Å |
| 114 | A | 61.7 | Low | 71.2 | Confident | 57 Ų | 57 | 109.4 Ų | 109.4 | 47% | 0.471 | 62% | 0.619 | S | S | . | * | trans | -119.6 | 114.9 | -178.8 | 0 | 0 | 0 | 0 | 0 | 109.6 | E112 | E112-A114 PolarHBondContact O-N 2.91Å; E112-A114 VanDerWaalsContact O-N 3.13Å | ||
| 115 | Q | 65.2 | Low | 71.4 | Confident | 185 Ų | 185 | 107.2 Ų | 107.2 | 86% | 0.864 | 62% | 0.623 | S | S | * | * | trans | -93.9 | 101.2 | 163.8 | -172.6 | 177.1 | 16.6 | 0 | 0 | 107.7 | K117 | Q115-K117 PolarHBondContact O-N 2.92Š| ||
| 116 | V | 67.9 | Low | 71.6 | Confident | 125 Ų | 125 | 103.9 Ų | 103.9 | 76% | 0.758 | 62% | 0.62 | S | S | * | * | trans | -85 | 101.2 | 174.5 | -176.4 | 0 | 0 | 0 | 0 | 107.9 | V118 | V116-V118 HydrophobicContact CG1-CG2 4.12Š| ||
| 117 | K | 66 | Low | 71.5 | Confident | 118 Ų | 118 | 105 Ų | 105 | 51% | 0.513 | 62% | 0.622 | S | S | . | * | trans | -94.7 | 108.4 | 169.1 | -172.3 | 171.2 | 176.3 | -176 | 0 | 108 | Q115 F119 | Q115-K117 PolarHBondContact O-N 2.92Å; K117-F119 HydrophobicContact CB-CE2 4.08Å; K117-F119 HydrophobicContact CB-CZ 4.37Å; K117-F119 HydrophobicContact CD-CE1 3.9Å; K117-F119 HydrophobicContact CD-CE2 4.11Å; K117-F119 HydrophobicContact CD-CZ 3.54Å; K117-F119 HydrophobicContact CG-CD2 4.39Å; K117-F119 HydrophobicContact CG-CE1 4.27Å; K117-F119 HydrophobicContact CG-CE2 3.9Å; K117-F119 HydrophobicContact CG-CZ 3.85Å; K117-F119 WeakPolarHBondContact O-CD2 3.17Å | ||
| 118 | V | 70.6 | Confident | 72.1 | Confident | 109 Ų | 109 | 105.2 Ų | 105.2 | 66% | 0.661 | 63% | 0.627 | S | S | * | * | P | Polyproline II helix | trans | -82.2 | 123.1 | 173.2 | -175.8 | 0 | 0 | 0 | 0 | 107.2 | V116 | V116-V118 HydrophobicContact CG1-CG2 4.12Š|
| 119 | F | 73.1 | Confident | 72.4 | Confident | 134 Ų | 134 | 107.4 Ų | 107.4 | 59% | 0.588 | 62% | 0.624 | S | S | * | * | P | Polyproline II helix | trans | -100.1 | 129 | 175 | -63.9 | -93.7 | 0 | 0 | 0 | 108.4 | K117 | K117-F119 HydrophobicContact CB-CE2 4.08Å; K117-F119 HydrophobicContact CB-CZ 4.37Å; K117-F119 HydrophobicContact CD-CE1 3.9Å; K117-F119 HydrophobicContact CD-CE2 4.11Å; K117-F119 HydrophobicContact CD-CZ 3.54Å; K117-F119 HydrophobicContact CG-CD2 4.39Å; K117-F119 HydrophobicContact CG-CE1 4.27Å; K117-F119 HydrophobicContact CG-CE2 3.9Å; K117-F119 HydrophobicContact CG-CZ 3.85Å; K117-F119 WeakPolarHBondContact O-CD2 3.17Å |
| 120 | N | 79.2 | Confident | 72.8 | Confident | 101 Ų | 101 | 107.1 Ų | 107.1 | 54% | 0.54 | 62% | 0.619 | S | S | . | * | P | Polyproline II helix | trans | -91.9 | 153.1 | 170.9 | -55.3 | -75.8 | 0 | 0 | 0 | 109.8 | G122 D123 | N120-G122 PolarHBondContact O-N 2.81Å; N120-D123 VanDerWaalsContact CB-OD2 3.29Å; N120-D123 WeakPolarHBondContact CB-OD2 3.34Å; N120-D123 PolarHBondContact N-OD2 2.97Å; N120-D123 PolarHBondContact ND2-OD2 2.95Å; N120-D123 PolarHBondContact O-N 2.9Å |
| 121 | A | 71.8 | Confident | 73.3 | Confident | 121 Ų | 121 | 108.4 Ų | 108.4 | 100% | 1 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.7 | -13.3 | -178.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 122 | G | 72.8 | Confident | 73.6 | Confident | 73 Ų | 73 | 107.5 Ų | 107.5 | 75% | 0.753 | 62% | 0.617 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.2 | 5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | N120 | N120-G122 PolarHBondContact O-N 2.81Š|
| 123 | D | 79.5 | Confident | 73.8 | Confident | 82 Ų | 82 | 103.5 Ų | 103.5 | 44% | 0.439 | 61% | 0.605 | S | S | . | * | S | Bend | trans | -86 | 121.6 | 176.6 | -66.2 | -29.3 | 0 | 0 | 0 | 109.8 | N120 | N120-D123 VanDerWaalsContact CB-OD2 3.29Å; N120-D123 WeakPolarHBondContact CB-OD2 3.34Å; N120-D123 PolarHBondContact N-OD2 2.97Å; N120-D123 PolarHBondContact ND2-OD2 2.95Å; N120-D123 PolarHBondContact O-N 2.9Å |
| 124 | D | 71.8 | Confident | 74 | Confident | 156 Ų | 156 | 106.7 Ų | 106.7 | 83% | 0.834 | 61% | 0.608 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 127.9 | 174.1 | -76.7 | -26.9 | 0 | 0 | 0 | 110.6 | S126 | D124-S126 PolarHBondContact O-N 2.87Å; D124-S126 VanDerWaalsContact O-N 3.15Å |
| 125 | P | 73.5 | Confident | 74.5 | Confident | 100 Ų | 100 | 109 Ų | 109 | 65% | 0.649 | 61% | 0.612 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 117.4 | 179.9 | 26.3 | -32.6 | 0 | 0 | 0 | 110.3 | V127 | P125-V127 PolarHBondContact O-N 2.77Š|
| 126 | S | 74.9 | Confident | 74.6 | Confident | 93 Ų | 93 | 102.2 Ų | 102.2 | 65% | 0.65 | 59% | 0.588 | S | S | * | * | trans | -75.1 | 95.3 | 173.8 | 57.5 | 0 | 0 | 0 | 0 | 111.1 | D124 P128 | D124-S126 PolarHBondContact O-N 2.87Å; D124-S126 VanDerWaalsContact O-N 3.15Å; S126-P128 WeakPolarHBondContact O-CD 3.3Å | ||
| 127 | V | 78 | Confident | 74.7 | Confident | 70 Ų | 70 | 100.8 Ų | 100.8 | 42% | 0.424 | 58% | 0.575 | S | S | . | * | trans | -76.1 | 121.4 | 175.2 | -175.9 | 0 | 0 | 0 | 0 | 109.2 | P125 V131 L132 | P125-V127 PolarHBondContact O-N 2.77Å; V127-V131 HydrophobicContact CG1-CB 3.78Å; V127-V131 HydrophobicContact CG1-CG1 3.83Å; V127-L132 HydrophobicContact CB-CD2 4.18Å; V127-L132 HydrophobicContact CB-CG 4.29Å; V127-L132 HydrophobicContact CG1-CD2 3.81Å; V127-L132 HydrophobicContact CG1-CG 3.89Å | ||
| 128 | P | 83.9 | Confident | 74.5 | Confident | 67 Ų | 67 | 99.7 Ų | 99.7 | 44% | 0.435 | 58% | 0.575 | S | S | . | * | trans | -60.3 | 142.7 | 178.7 | -25.4 | 35.5 | 0 | 0 | 0 | 112.6 | S126 H130 V131 L132 | S126-P128 WeakPolarHBondContact O-CD 3.3Å; P128-H130 WeakPolarHBondContact CB-CE1 3.38Å; P128-H130 WeakPolarHBondContact CB-ND1 3.39Å; P128-H130 PolarHBondContact O-N 3.49Å; P128-H130 VanDerWaalsContact O-N 3.07Å; P128-V131 HydrophobicContact CB-CG2 4.32Å; P128-V131 HydrophobicContact CG-CG2 4.49Å; P128-V131 WeakPolarHBondContact O-CA 3.36Å; P128-V131 WeakPolarHBondContact O-CB 3.49Å; P128-V131 PolarHBondContact O-N 3.38Å; P128-L132 PolarHBondContact O-N 3Å | ||
| 129 | L | 78.1 | Confident | 73.9 | Confident | 143 Ų | 143 | 97 Ų | 97 | 75% | 0.749 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -56.5 | -29.6 | -177.2 | -67.1 | 174.6 | 0 | 0 | 0 | 114.2 | V131 L132 S133 | L129-V131 VanDerWaalsContact C-N 3.26Å; L129-V131 PolarHBondContact O-N 2.77Å; L129-L132 HydrophobicContact CD2-CD1 4.39Å; L129-L132 PolarHBondContact O-N 3.23Å; L129-S133 WeakPolarHBondContact O-CB 3.15Å; L129-S133 PolarHBondContact O-N 3.04Å; L129-S133 PolarHBondContact O-OG 2.82Å |
| 130 | H | 79.8 | Confident | 73.1 | Confident | 126 Ų | 126 | 95.6 Ų | 95.6 | 58% | 0.583 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -68.5 | -26.3 | 176.5 | 69.8 | -94.3 | 0 | 0 | 0 | 112.9 | P128 S133 R134 | P128-H130 WeakPolarHBondContact CB-CE1 3.38Å; P128-H130 WeakPolarHBondContact CB-ND1 3.39Å; P128-H130 PolarHBondContact O-N 3.49Å; P128-H130 VanDerWaalsContact O-N 3.07Å; H130-S133 VanDerWaalsContact CA-OG 3.22Å; H130-S133 WeakPolarHBondContact CA-OG 3.43Å; H130-S133 PolarHBondContact O-OG 2.9Å; H130-S133 VanDerWaalsContact O-OG 3.13Å; H130-R134 WeakPolarHBondContact O-CB 3.48Å; H130-R134 PolarHBondContact O-N 2.97Å |
| 131 | V | 77.4 | Confident | 71.9 | Confident | 54 Ų | 54 | 96.1 Ų | 96.1 | 33% | 0.327 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -77 | -46.9 | 174.5 | -178.2 | 0 | 0 | 0 | 0 | 109.3 | V127 P128 L129 S133 R134 L135 | V127-V131 HydrophobicContact CG1-CB 3.78Å; V127-V131 HydrophobicContact CG1-CG1 3.83Å; P128-V131 HydrophobicContact CB-CG2 4.32Å; P128-V131 HydrophobicContact CG-CG2 4.49Å; P128-V131 WeakPolarHBondContact O-CA 3.36Å; P128-V131 WeakPolarHBondContact O-CB 3.49Å; P128-V131 PolarHBondContact O-N 3.38Å; L129-V131 VanDerWaalsContact C-N 3.26Å; L129-V131 PolarHBondContact O-N 2.77Å; V131-S133 VanDerWaalsContact C-N 3.35Å; V131-S133 PolarHBondContact O-N 2.9Å; V131-R134 PolarHBondContact O-N 3.17Å; V131-L135 HydrophobicContact CG1-CD1 4.02Å; V131-L135 HydrophobicContact CG1-CG 4.49Å; V131-L135 WeakPolarHBondContact O-CG 3.3Å; V131-L135 PolarHBondContact O-N 2.85Å |
| 132 | L | 78.6 | Confident | 70.7 | Confident | 84 Ų | 84 | 94.2 Ų | 94.2 | 44% | 0.44 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -60.7 | -43.1 | 176.8 | -64.8 | 176.9 | 0 | 0 | 0 | 111.9 | V127 P128 L129 L135 A136 | V127-L132 HydrophobicContact CB-CD2 4.18Å; V127-L132 HydrophobicContact CB-CG 4.29Å; V127-L132 HydrophobicContact CG1-CD2 3.81Å; V127-L132 HydrophobicContact CG1-CG 3.89Å; P128-L132 PolarHBondContact O-N 3Å; L129-L132 HydrophobicContact CD2-CD1 4.39Å; L129-L132 PolarHBondContact O-N 3.23Å; L132-L135 PolarHBondContact O-N 3.26Å; L132-A136 WeakPolarHBondContact O-CB 3.42Å; L132-A136 PolarHBondContact O-N 3Å |
| 133 | S | 76.8 | Confident | 69.4 | Low | 56 Ų | 56 | 95.8 Ų | 95.8 | 39% | 0.392 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -65.6 | -38.7 | 175.6 | 49.7 | 0 | 0 | 0 | 0 | 112.8 | L129 H130 V131 A136 I137 | L129-S133 WeakPolarHBondContact O-CB 3.15Å; L129-S133 PolarHBondContact O-N 3.04Å; L129-S133 PolarHBondContact O-OG 2.82Å; H130-S133 VanDerWaalsContact CA-OG 3.22Å; H130-S133 WeakPolarHBondContact CA-OG 3.43Å; H130-S133 PolarHBondContact O-OG 2.9Å; H130-S133 VanDerWaalsContact O-OG 3.13Å; V131-S133 VanDerWaalsContact C-N 3.35Å; V131-S133 PolarHBondContact O-N 2.9Å; S133-A136 PolarHBondContact O-N 2.8Å; S133-I137 WeakPolarHBondContact O-CB 3.32Å; S133-I137 WeakPolarHBondContact O-CD1 2.99Å; S133-I137 WeakPolarHBondContact O-CG1 3.43Å; S133-I137 PolarHBondContact O-N 3.26Å |
| 134 | R | 72.4 | Confident | 67.9 | Low | 186 Ų | 186 | 96.2 Ų | 96.2 | 70% | 0.702 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -65.3 | -40.6 | 172.9 | -88.9 | -164.4 | 161 | -178.8 | -4.2 | 112.9 | H130 V131 N138 | H130-R134 WeakPolarHBondContact O-CB 3.48Å; H130-R134 PolarHBondContact O-N 2.97Å; V131-R134 PolarHBondContact O-N 3.17Å; R134-N138 WeakPolarHBondContact O-CB 3.46Å; R134-N138 PolarHBondContact O-N 3.36Å; R134-N138 PolarHBondContact O-ND2 2.85Å |
| 135 | L | 72.4 | Confident | 66.9 | Low | 106 Ų | 106 | 91.2 Ų | 91.2 | 56% | 0.555 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -63.8 | -43.3 | 175.3 | -71.3 | 168.8 | 0 | 0 | 0 | 111 | V131 L132 N138 S139 | V131-L135 HydrophobicContact CG1-CD1 4.02Å; V131-L135 HydrophobicContact CG1-CG 4.49Å; V131-L135 WeakPolarHBondContact O-CG 3.3Å; V131-L135 PolarHBondContact O-N 2.85Å; L132-L135 PolarHBondContact O-N 3.26Å; L135-N138 PolarHBondContact O-N 2.89Å; L135-S139 WeakPolarHBondContact O-CB 3.38Å; L135-S139 PolarHBondContact O-N 2.87Å; L135-S139 PolarHBondContact O-OG 3.4Å |
| 136 | A | 68.8 | Low | 65.9 | Low | 43 Ų | 43 | 94.5 Ų | 94.5 | 36% | 0.355 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -63.4 | -44.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | L132 S133 N138 S139 D140 | L132-A136 WeakPolarHBondContact O-CB 3.42Å; L132-A136 PolarHBondContact O-N 3Å; S133-A136 PolarHBondContact O-N 2.8Å; A136-N138 VanDerWaalsContact C-N 3.32Å; A136-N138 PolarHBondContact O-N 3.22Å; A136-S139 VanDerWaalsContact CA-OG 3.28Å; A136-S139 WeakPolarHBondContact CA-OG 3.44Å; A136-S139 PolarHBondContact O-N 2.88Å; A136-S139 PolarHBondContact O-OG 3.42Å; A136-D140 WeakPolarHBondContact O-CB 3.25Å; A136-D140 PolarHBondContact O-N 2.88Å |
| 137 | I | 69.8 | Low | 64.8 | Low | 95 Ų | 95 | 95.3 Ų | 95.3 | 49% | 0.487 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -62.5 | -42 | 175.9 | -69.2 | 161.7 | 0 | 0 | 0 | 110.6 | S133 D140 L141 | S133-I137 WeakPolarHBondContact O-CB 3.32Å; S133-I137 WeakPolarHBondContact O-CD1 2.99Å; S133-I137 WeakPolarHBondContact O-CG1 3.43Å; S133-I137 PolarHBondContact O-N 3.26Å; I137-D140 PolarHBondContact O-N 3.28Å; I137-L141 HydrophobicContact CG2-CD1 3.99Å; I137-L141 VanDerWaalsContact O-CD1 3.23Å; I137-L141 WeakPolarHBondContact O-CD1 3.06Å; I137-L141 PolarHBondContact O-N 2.87Å |
| 138 | N | 60.8 | Low | 63.5 | Low | 94 Ų | 94 | 96 Ų | 96 | 50% | 0.503 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -68.9 | -36.9 | 177.7 | -70.3 | -10 | 0 | 0 | 0 | 111.7 | R134 L135 A136 L141 C142 | R134-N138 WeakPolarHBondContact O-CB 3.46Å; R134-N138 PolarHBondContact O-N 3.36Å; R134-N138 PolarHBondContact O-ND2 2.85Å; L135-N138 PolarHBondContact O-N 2.89Å; A136-N138 VanDerWaalsContact C-N 3.32Å; A136-N138 PolarHBondContact O-N 3.22Å; N138-L141 PolarHBondContact O-N 3.08Å; N138-C142 WeakPolarHBondContact O-CB 3.25Å; N138-C142 PolarHBondContact O-N 2.85Å; N138-C142 PolarHBondContact O-SG 2.61Å |
| 139 | S | 59.4 | Low | 62.1 | Low | 52 Ų | 52 | 98.7 Ų | 98.7 | 36% | 0.364 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -67.1 | -39.7 | 174.3 | 60.9 | 0 | 0 | 0 | 0 | 111.5 | L135 A136 C142 C143 | L135-S139 WeakPolarHBondContact O-CB 3.38Å; L135-S139 PolarHBondContact O-N 2.87Å; L135-S139 PolarHBondContact O-OG 3.4Å; A136-S139 VanDerWaalsContact CA-OG 3.28Å; A136-S139 WeakPolarHBondContact CA-OG 3.44Å; A136-S139 PolarHBondContact O-N 2.88Å; A136-S139 PolarHBondContact O-OG 3.42Å; S139-C142 CarbonylContact O-C 3.58Å; S139-C142 PolarHBondContact O-N 3.23Å; S139-C143 VanDerWaalsContact O-CB 3.24Å; S139-C143 WeakPolarHBondContact O-CB 3.08Å; S139-C143 PolarHBondContact O-N 3.33Å; S139-C143 PolarHBondContact O-SG 2.69Å |
| 140 | D | 55.4 | Low | 61.4 | Low | 105 Ų | 105 | 96.5 Ų | 96.5 | 56% | 0.561 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -68.9 | -35.1 | 177.7 | -68.3 | -16.7 | 0 | 0 | 0 | 111.9 | A136 I137 C143 S144 | A136-D140 WeakPolarHBondContact O-CB 3.25Å; A136-D140 PolarHBondContact O-N 2.88Å; I137-D140 PolarHBondContact O-N 3.28Å; D140-C143 PolarHBondContact O-N 2.93Å; D140-S144 VanDerWaalsContact O-CB 3.23Å; D140-S144 WeakPolarHBondContact O-CB 3.47Å; D140-S144 PolarHBondContact O-N 2.8Å; D140-S144 PolarHBondContact O-OG 2.72Å |
| 141 | L | 53.4 | Low | 61 | Low | 113 Ų | 113 | 94 Ų | 94 | 59% | 0.592 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -65.4 | -38.7 | 169.7 | -98.7 | 83.5 | 0 | 0 | 0 | 112 | I137 N138 S144 S145 | I137-L141 HydrophobicContact CG2-CD1 3.99Å; I137-L141 VanDerWaalsContact O-CD1 3.23Å; I137-L141 WeakPolarHBondContact O-CD1 3.06Å; I137-L141 PolarHBondContact O-N 2.87Å; N138-L141 PolarHBondContact O-N 3.08Å; L141-S144 PolarHBondContact O-OG 2.79Å; L141-S145 PolarHBondContact O-OG 2.76Å |
| 142 | C | 48 | Very low | 61.1 | Low | 81 Ų | 81 | 96 Ų | 96 | 55% | 0.547 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -72.5 | -31.5 | 176.8 | -67.5 | 0 | 0 | 0 | 0 | 113 | N138 S139 S145 | N138-C142 WeakPolarHBondContact O-CB 3.25Å; N138-C142 PolarHBondContact O-N 2.85Å; N138-C142 PolarHBondContact O-SG 2.61Å; S139-C142 CarbonylContact O-C 3.58Å; S139-C142 PolarHBondContact O-N 3.23Å; C142-S145 PolarHBondContact O-OG 3.48Å |
| 143 | C | 44.2 | Very low | 61.4 | Low | 105 Ų | 105 | 97.3 Ų | 97.3 | 71% | 0.709 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -88.3 | -17.9 | -178.4 | -68.5 | 0 | 0 | 0 | 0 | 113.9 | S139 D140 | S139-C143 VanDerWaalsContact O-CB 3.24Å; S139-C143 WeakPolarHBondContact O-CB 3.08Å; S139-C143 PolarHBondContact O-N 3.33Å; S139-C143 PolarHBondContact O-SG 2.69Å; D140-C143 PolarHBondContact O-N 2.93Å |
| 144 | S | 48.8 | Very low | 61.9 | Low | 92 Ų | 92 | 96.7 Ų | 96.7 | 64% | 0.643 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -83.9 | -21.7 | 175.9 | 52.8 | 0 | 0 | 0 | 0 | 113.3 | D140 L141 Q146 | D140-S144 VanDerWaalsContact O-CB 3.23Å; D140-S144 WeakPolarHBondContact O-CB 3.47Å; D140-S144 PolarHBondContact O-N 2.8Å; D140-S144 PolarHBondContact O-OG 2.72Å; L141-S144 PolarHBondContact O-OG 2.79Å; S144-Q146 PolarHBondContact O-N 2.94Å |
| 145 | S | 50.7 | Low | 62.7 | Low | 50 Ų | 50 | 88.6 Ų | 88.6 | 35% | 0.35 | 49% | 0.492 | S | S | . | . | S | Bend | trans | -71.3 | 93.8 | 162.7 | 30.6 | 0 | 0 | 0 | 0 | 109.5 | L141 C142 D147 L148 | L141-S145 PolarHBondContact O-OG 2.76Å; C142-S145 PolarHBondContact O-OG 3.48Å; S145-D147 PolarHBondContact O-N 2.7Å; S145-D147 VanDerWaalsContact O-N 3.09Å; S145-L148 WeakPolarHBondContact OG-CD1 3.49Å |
| 146 | Q | 52.3 | Low | 63.7 | Low | 169 Ų | 169 | 85.6 Ų | 85.6 | 79% | 0.79 | 48% | 0.478 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -49.4 | 117.9 | 157.3 | -87.7 | 166.8 | 8.3 | 0 | 0 | 107.6 | S144 | S144-Q146 PolarHBondContact O-N 2.94Š|
| 147 | D | 51.8 | Low | 64.9 | Low | 111 Ų | 111 | 85.7 Ų | 85.7 | 59% | 0.594 | 48% | 0.476 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 70.8 | 70.6 | 172.9 | -48.6 | -29.7 | 0 | 0 | 0 | 115.3 | S145 E149 R288 | S145-D147 PolarHBondContact O-N 2.7Å; S145-D147 VanDerWaalsContact O-N 3.09Å; D147-E149 PolarHBondContact O-N 3.4Å; D147-R288 IonicContact OD1-NH2 2.81Å; D147-R288 PolarHBondContact OD1-NH2 3.46Å; D147-R288 VanDerWaalsContact OD1-NH2 3.16Å |
| 148 | L | 51.1 | Low | 66 | Low | 83 Ų | 83 | 84 Ų | 84 | 44% | 0.435 | 47% | 0.467 | S | S | . | . | trans | -68.6 | 68.6 | 145.8 | -96.9 | 114.9 | 0 | 0 | 0 | 108.9 | S145 F150 | S145-L148 WeakPolarHBondContact OG-CD1 3.49Å; L148-F150 VanDerWaalsContact C-N 3.3Å; L148-F150 HydrophobicContact CB-CD2 4.33Å; L148-F150 HydrophobicContact CB-CE2 3.88Å; L148-F150 HydrophobicContact CB-CZ 4.3Å; L148-F150 HydrophobicContact CD2-CD1 4.44Å; L148-F150 HydrophobicContact CD2-CD2 4.48Å; L148-F150 HydrophobicContact CD2-CE1 3.59Å; L148-F150 HydrophobicContact CD2-CE2 3.64Å; L148-F150 HydrophobicContact CD2-CZ 3.14Å; L148-F150 HydrophobicContact CG-CE2 4.4Å; L148-F150 HydrophobicContact CG-CZ 4.31Å; L148-F150 WeakPolarHBondContact O-CD2 3.35Å; L148-F150 PolarHBondContact O-N 2.96Å | ||
| 149 | E | 54.5 | Low | 67.4 | Low | 124 Ų | 124 | 80.6 Ų | 80.6 | 58% | 0.579 | 45% | 0.448 | S | S | * | . | trans | -70.6 | 93 | 163.1 | -167.6 | 179 | -167.1 | 0 | 0 | 106.5 | D147 T151 A283 | D147-E149 PolarHBondContact O-N 3.4Å; E149-T151 HydrophobicContact CG-CG2 4.26Å; E149-T151 PolarHBondContact O-N 2.83Å; E149-T151 VanDerWaalsContact O-N 3.09Å; E149-A283 HydrophobicContact CG-CB 3.83Å; E149-A283 WeakPolarHBondContact OE1-CB 3.31Å | ||
| 150 | F | 63 | Low | 68.9 | Low | 98 Ų | 98 | 83 Ų | 83 | 43% | 0.43 | 46% | 0.463 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -70 | 108.4 | 170.8 | -66.2 | -85.1 | 0 | 0 | 0 | 107.1 | L148 L284 M286 | L148-F150 VanDerWaalsContact C-N 3.3Å; L148-F150 HydrophobicContact CB-CD2 4.33Å; L148-F150 HydrophobicContact CB-CE2 3.88Å; L148-F150 HydrophobicContact CB-CZ 4.3Å; L148-F150 HydrophobicContact CD2-CD1 4.44Å; L148-F150 HydrophobicContact CD2-CD2 4.48Å; L148-F150 HydrophobicContact CD2-CE1 3.59Å; L148-F150 HydrophobicContact CD2-CE2 3.64Å; L148-F150 HydrophobicContact CD2-CZ 3.14Å; L148-F150 HydrophobicContact CG-CE2 4.4Å; L148-F150 HydrophobicContact CG-CZ 4.31Å; L148-F150 WeakPolarHBondContact O-CD2 3.35Å; L148-F150 PolarHBondContact O-N 2.96Å; F150-L284 HydrophobicContact CB-CB 4.34Å; F150-L284 WeakPolarHBondContact O-CB 3.34Å; F150-L284 PolarHBondContact O-N 2.88Å; F150-M286 HydrophobicContact CD2-CG 4.31Å; F150-M286 HydrophobicContact CE2-CE 4.45Å; F150-M286 HydrophobicContact CE2-CG 4.23Å |
| 151 | T | 71.1 | Confident | 70.6 | Confident | 73 Ų | 73 | 80.8 Ų | 80.8 | 45% | 0.448 | 45% | 0.454 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.9 | 116.1 | 175.1 | 44.8 | 0 | 0 | 0 | 0 | 109 | E149 N281 | E149-T151 HydrophobicContact CG-CG2 4.26Å; E149-T151 PolarHBondContact O-N 2.83Å; E149-T151 VanDerWaalsContact O-N 3.09Å; T151-N281 HydrophobicContact CG2-CB 4.38Å |
| 152 | L | 79.6 | Confident | 72.4 | Confident | 96 Ų | 96 | 75.7 Ų | 75.7 | 50% | 0.503 | 43% | 0.427 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.9 | 129.9 | 168.8 | -68.3 | -169.6 | 0 | 0 | 0 | 109.6 | H282 L284 | L152-H282 PolarHBondContact N-O 3.48Å; L152-H282 PolarHBondContact O-N 3.42Å; L152-L284 HydrophobicContact CD1-CD1 3.37Å; L152-L284 HydrophobicContact CD1-CG 4.06Å; L152-L284 HydrophobicContact CG-CD1 3.65Å; L152-L284 HydrophobicContact CG-CG 4.04Å |
| 153 | Q | 84.5 | Confident | 74.4 | Confident | 112 Ų | 112 | 74 Ų | 74 | 52% | 0.523 | 41% | 0.414 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.9 | 121.3 | 168.9 | -73.4 | 173.7 | -5.9 | 0 | 0 | 108.8 | L247 R280 N281 | Q153-L247 PolarHBondContact OE1-O 3.14Å; Q153-R280 WeakPolarHBondContact CA-O 3.37Å; Q153-N281 WeakPolarHBondContact CG-OD1 3.34Å |
| 154 | C | 87.2 | Confident | 76.7 | Confident | 43 Ų | 43 | 75.6 Ų | 75.6 | 29% | 0.291 | 41% | 0.412 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -137 | 151.4 | 176.9 | 68.7 | 0 | 0 | 0 | 0 | 111.5 | C279 R280 | C154-C279 WeakPolarHBondContact O-CA 3.19Å; C154-R280 PolarHBondContact N-O 2.79Å; C154-R280 PolarHBondContact O-N 2.78Å |
| 155 | L | 90.8 | Very high | 78.6 | Confident | 15 Ų | 15 | 72.6 Ų | 72.6 | 8% | 0.079 | 39% | 0.392 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.7 | 125.4 | 172.1 | -73.5 | 174.1 | 0 | 0 | 0 | 109.8 | C184 I189 V242 L247 V253 L277 C279 | L155-C184 HydrophobicContact CB-CB 4.09Å; L155-C184 WeakPolarHBondContact O-CB 3.3Å; L155-C184 PolarHBondContact O-SG 3.4Å; L155-I189 HydrophobicContact CD1-CD1 3.81Å; L155-I189 HydrophobicContact CD1-CG1 3.86Å; L155-V242 HydrophobicContact CD1-CB 4.43Å; L155-V242 HydrophobicContact CD1-CG1 4.27Å; L155-V242 HydrophobicContact CD1-CG2 4.05Å; L155-L247 HydrophobicContact CD1-CD2 3.67Å; L155-L247 HydrophobicContact CD2-CD2 3.68Å; L155-L247 HydrophobicContact CG-CD2 3.56Å; L155-V253 HydrophobicContact CD1-CG2 4.11Å; L155-V253 HydrophobicContact CD2-CG2 4.1Å; L155-L277 HydrophobicContact CB-CB 4.41Å; L155-L277 HydrophobicContact CD2-CB 4.31Å; L155-C279 HydrophobicContact CD2-CB 4.11Å |
| 156 | V | 91.9 | Very high | 80.5 | Confident | 43 Ų | 43 | 75.6 Ų | 75.6 | 26% | 0.261 | 42% | 0.42 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.6 | 131.1 | 179.1 | -176.3 | 0 | 0 | 0 | 0 | 109.2 | D158 L277 T278 R280 | V156-D158 PolarHBondContact O-N 2.88Å; V156-L277 WeakPolarHBondContact O-CA 3.29Å; V156-T278 PolarHBondContact N-O 3.09Å; V156-T278 PolarHBondContact O-N 2.88Å; V156-R280 HydrophobicContact CB-CG 4.46Å; V156-R280 HydrophobicContact CG2-CB 4.17Å; V156-R280 HydrophobicContact CG2-CG 4.36Å |
| 157 | P | 93.8 | Very high | 82.4 | Confident | 46 Ų | 46 | 70.6 Ų | 70.6 | 30% | 0.299 | 40% | 0.398 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -60.1 | 133 | 173.8 | -22.1 | 32.1 | 0 | 0 | 0 | 112 | F159 V182 L277 | P157-F159 HydrophobicContact CB-CD1 4.2Å; P157-F159 HydrophobicContact CB-CE1 3.97Å; P157-F159 HydrophobicContact CB-CE2 4.29Å; P157-F159 HydrophobicContact CB-CG 4.47Å; P157-F159 HydrophobicContact CB-CZ 4.02Å; P157-F159 PolarHBondContact O-N 2.93Å; P157-V182 HydrophobicContact CB-CG1 4.28Å; P157-V182 HydrophobicContact CG-CG1 3.68Å; P157-L277 HydrophobicContact CB-CD2 4.03Å; P157-L277 HydrophobicContact CG-CD2 3.69Å |
| 158 | D | 92.8 | Very high | 84.4 | Confident | 58 Ų | 58 | 65.9 Ų | 65.9 | 31% | 0.31 | 37% | 0.373 | S | S | . | . | S | Bend | trans | -88.3 | 16.7 | 174.4 | -60.6 | -52.9 | 0 | 0 | 0 | 112.1 | V156 S276 T278 R280 | V156-D158 PolarHBondContact O-N 2.88Å; D158-S276 PolarHBondContact N-O 2.9Å; D158-T278 PolarHBondContact OD1-OG1 2.89Å; D158-T278 WeakPolarHBondContact OD2-CB 3.49Å; D158-T278 PolarHBondContact OD2-N 2.95Å; D158-T278 PolarHBondContact OD2-OG1 2.84Å; D158-R280 IonicContact OD1-CZ 3.53Å; D158-R280 IonicContact OD1-NE 3.49Å; D158-R280 IonicContact OD1-NH2 2.73Å; D158-R280 PolarHBondContact OD1-NH2 3.41Å |
| 159 | F | 91.8 | Very high | 86.3 | Confident | 24 Ų | 24 | 63.9 Ų | 63.9 | 11% | 0.105 | 37% | 0.372 | C | S | . | . | S | Bend | trans | -138.7 | 149.4 | -177.7 | 54.7 | -88.6 | 0 | 0 | 0 | 110.4 | P157 P162 L179 V182 F255 Y275 S276 | P157-F159 HydrophobicContact CB-CD1 4.2Å; P157-F159 HydrophobicContact CB-CE1 3.97Å; P157-F159 HydrophobicContact CB-CE2 4.29Å; P157-F159 HydrophobicContact CB-CG 4.47Å; P157-F159 HydrophobicContact CB-CZ 4.02Å; P157-F159 PolarHBondContact O-N 2.93Å; F159-P162 HydrophobicContact CD2-CG 4.04Å; F159-P162 HydrophobicContact CE2-CG 3.84Å; F159-L179 HydrophobicContact CE2-CD2 4.03Å; F159-L179 HydrophobicContact CZ-CD2 4.07Å; F159-V182 HydrophobicContact CE2-CG1 4.06Å; F159-V182 HydrophobicContact CZ-CG1 3.76Å; F159-F255 HydrophobicContact CZ-CZ 4.25Å; F159-Y275 AromaticContact CD1-CD1 3.94Å; F159-Y275 HydrophobicContact CD1-CD1 3.94Å; F159-Y275 AromaticContact CD2-CD1 3.83Å; F159-Y275 HydrophobicContact CD2-CD1 3.83Å; F159-Y275 HydrophobicContact CD2-CE1 4.07Å; F159-Y275 AromaticContact CE1-CD1 3.66Å; F159-Y275 HydrophobicContact CE1-CD1 3.66Å; F159-Y275 HydrophobicContact CE1-CG 4.23Å; F159-Y275 AromaticContact CE2-CD1 3.55Å; F159-Y275 HydrophobicContact CE2-CD1 3.55Å; F159-Y275 AromaticContact CE2-CE1 3.95Å; F159-Y275 HydrophobicContact CE2-CE1 3.95Å; F159-Y275 HydrophobicContact CG-CD1 4.02Å; F159-Y275 AromaticContact CZ-CD1 3.45Å; F159-Y275 HydrophobicContact CZ-CD1 3.45Å; F159-Y275 VanDerWaalsContact CZ-CD1 3.45Å; F159-Y275 HydrophobicContact CZ-CE1 4.29Å; F159-Y275 HydrophobicContact CZ-CG 4.16Å; F159-S276 WeakPolarHBondContact CD1-O 3.4Å; F159-S276 VanDerWaalsContact CE1-O 3.25Å; F159-S276 WeakPolarHBondContact CE1-O 3.39Å |
| 160 | P | 90.9 | Very high | 88.2 | Confident | 103 Ų | 103 | 65.2 Ų | 65.2 | 67% | 0.669 | 38% | 0.378 | S | S | * | . | trans | -65 | 155.9 | 174.5 | 29.2 | -35.4 | 0 | 0 | 0 | 110.7 | P162 | P160-P162 VanDerWaalsContact O-CD 3.31Å; P160-P162 WeakPolarHBondContact O-CD 3.21Å; P160-P162 VanDerWaalsContact O-N 3.09Å | ||
| 161 | P | 91.2 | Very high | 89.7 | Confident | 57 Ų | 57 | 61.1 Ų | 61.1 | 37% | 0.37 | 36% | 0.36 | S | S | . | . | trans | -50.8 | 118 | 177.2 | -26 | 34.9 | 0 | 0 | 0 | 111.2 | V163 E164 | P161-V163 VanDerWaalsContact C-N 3.29Å; P161-V163 PolarHBondContact O-N 2.86Å; P161-E164 HydrophobicContact CB-CB 4.28Å; P161-E164 HydrophobicContact CB-CG 4.08Å; P161-E164 PolarHBondContact O-N 3.3Å | ||
| 162 | P | 90.9 | Very high | 90.9 | Very high | 6 Ų | 6 | 57.6 Ų | 57.6 | 4% | 0.039 | 34% | 0.338 | C | S | . | . | G | 310 helix | trans | -59.2 | -37 | -171.3 | -30.5 | 37 | 0 | 0 | 0 | 114.4 | F159 P160 E164 A165 F168 L179 Y275 | F159-P162 HydrophobicContact CD2-CG 4.04Å; F159-P162 HydrophobicContact CE2-CG 3.84Å; P160-P162 VanDerWaalsContact O-CD 3.31Å; P160-P162 WeakPolarHBondContact O-CD 3.21Å; P160-P162 VanDerWaalsContact O-N 3.09Å; P162-E164 PolarHBondContact O-N 3.17Å; P162-A165 VanDerWaalsContact O-CB 3.28Å; P162-A165 WeakPolarHBondContact O-CB 3.43Å; P162-A165 PolarHBondContact O-N 3.33Å; P162-A165 VanDerWaalsContact O-N 3.17Å; P162-F168 VanDerWaalsContact O-CD2 3.25Å; P162-F168 WeakPolarHBondContact O-CD2 3.38Å; P162-L179 WeakPolarHBondContact CB-O 3.29Å; P162-L179 HydrophobicContact CG-CB 4.42Å; P162-L179 HydrophobicContact CG-CD2 4.04Å; P162-L179 HydrophobicContact CG-CG 4.22Å; P162-Y275 HydrophobicContact CG-CE1 4Å |
| 163 | V | 90.2 | Very high | 91.6 | Very high | 45 Ų | 45 | 58.6 Ų | 58.6 | 27% | 0.273 | 34% | 0.34 | S | S | . | . | G | 310 helix | trans | -65.6 | -22.1 | 178.4 | 67.8 | 0 | 0 | 0 | 0 | 113.6 | P161 E180 | P161-V163 VanDerWaalsContact C-N 3.29Å; P161-V163 PolarHBondContact O-N 2.86Å; V163-E180 HydrophobicContact CB-CG 4.03Å; V163-E180 WeakPolarHBondContact CB-O 3.28Å; V163-E180 HydrophobicContact CG2-CG 4.09Å; V163-E180 PolarHBondContact N-O 2.95Å |
| 164 | E | 91.1 | Very high | 92.1 | Very high | 140 Ų | 140 | 61.4 Ų | 61.4 | 65% | 0.654 | 35% | 0.346 | S | S | * | . | G | 310 helix | trans | -89 | -7.6 | 178.4 | -65.1 | 173.8 | -162.6 | 0 | 0 | 112.2 | P161 P162 | P161-E164 HydrophobicContact CB-CB 4.28Å; P161-E164 HydrophobicContact CB-CG 4.08Å; P161-E164 PolarHBondContact O-N 3.3Å; P162-E164 PolarHBondContact O-N 3.17Å |
| 165 | A | 90.1 | Very high | 92.4 | Very high | 28 Ų | 28 | 60.5 Ų | 60.5 | 23% | 0.231 | 34% | 0.338 | C | S | . | . | S | Bend | trans | -69 | 133.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | P162 D167 F168 | P162-A165 VanDerWaalsContact O-CB 3.28Å; P162-A165 WeakPolarHBondContact O-CB 3.43Å; P162-A165 PolarHBondContact O-N 3.33Å; P162-A165 VanDerWaalsContact O-N 3.17Å; A165-D167 WeakPolarHBondContact CB-OD1 3.3Å; A165-D167 PolarHBondContact O-N 3.07Å; A165-F168 VanDerWaalsContact O-CB 3.25Å; A165-F168 WeakPolarHBondContact O-CB 3.4Å; A165-F168 PolarHBondContact O-N 3.35Å; A165-F168 VanDerWaalsContact O-N 3.09Å |
| 166 | A | 90.1 | Very high | 92.7 | Very high | 113 Ų | 113 | 61.2 Ų | 61.2 | 93% | 0.934 | 34% | 0.342 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.4 | -28.1 | -176.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||
| 167 | D | 91.8 | Very high | 93 | Very high | 64 Ų | 64 | 59.2 Ų | 59.2 | 34% | 0.342 | 33% | 0.329 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.1 | 4.2 | -179.2 | 68.2 | -39.6 | 0 | 0 | 0 | 113.5 | A165 G169 E170 R171 | A165-D167 WeakPolarHBondContact CB-OD1 3.3Å; A165-D167 PolarHBondContact O-N 3.07Å; D167-G169 VanDerWaalsContact C-N 3.32Å; D167-G169 PolarHBondContact O-N 3.09Å; D167-E170 PolarHBondContact O-N 3.18Å; D167-R171 WeakPolarHBondContact O-CB 3.05Å; D167-R171 PolarHBondContact O-N 2.68Å; D167-R171 WeakPolarHBondContact OD2-CD 3.34Å |
| 168 | F | 93.3 | Very high | 93.1 | Very high | 13 Ų | 13 | 57 Ų | 57 | 6% | 0.057 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -55.2 | -45.4 | -175.4 | 177.2 | -96.2 | 0 | 0 | 0 | 112.8 | P162 A165 L172 C178 L179 E180 R194 | P162-F168 VanDerWaalsContact O-CD2 3.25Å; P162-F168 WeakPolarHBondContact O-CD2 3.38Å; A165-F168 VanDerWaalsContact O-CB 3.25Å; A165-F168 WeakPolarHBondContact O-CB 3.4Å; A165-F168 PolarHBondContact O-N 3.35Å; A165-F168 VanDerWaalsContact O-N 3.09Å; F168-L172 HydrophobicContact CE1-CD2 4.33Å; F168-L172 WeakPolarHBondContact O-CB 3.36Å; F168-L172 PolarHBondContact O-N 3.07Å; F168-C178 HydrophobicContact CD2-CB 4.17Å; F168-C178 HydrophobicContact CE2-CB 3.51Å; F168-C178 HydrophobicContact CZ-CB 3.98Å; F168-L179 WeakPolarHBondContact CE2-O 3.25Å; F168-E180 HydrophobicContact CZ-CB 4.39Å; F168-R194 HydrophobicContact CZ-CB 4.13Å |
| 169 | G | 92.8 | Very high | 93.4 | Very high | 40 Ų | 40 | 54.2 Ų | 54.2 | 41% | 0.412 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -65.5 | -45.3 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | D167 L172 Q173 | D167-G169 VanDerWaalsContact C-N 3.32Å; D167-G169 PolarHBondContact O-N 3.09Å; G169-L172 PolarHBondContact O-N 2.89Å; G169-Q173 WeakPolarHBondContact O-CG 3.1Å; G169-Q173 PolarHBondContact O-N 2.99Å |
| 170 | E | 93.8 | Very high | 93.5 | Very high | 153 Ų | 153 | 54.4 Ų | 54.4 | 72% | 0.715 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -63.4 | -43.3 | 178 | -64.7 | -173.1 | 172.7 | 0 | 0 | 111.6 | D167 Q173 R174 | D167-E170 PolarHBondContact O-N 3.18Å; E170-Q173 PolarHBondContact O-N 2.77Å; E170-R174 VanDerWaalsContact O-CB 3.31Å; E170-R174 WeakPolarHBondContact O-CB 3.25Å; E170-R174 PolarHBondContact O-N 2.94Å |
| 171 | R | 94.4 | Very high | 93.8 | Very high | 11 Ų | 11 | 55.5 Ų | 55.5 | 4% | 0.042 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -59.3 | -50 | 172.6 | -83 | 177.1 | 52.2 | -160.5 | -2.2 | 110.7 | D167 Q173 R174 Q175 D268 Y275 | D167-R171 WeakPolarHBondContact O-CB 3.05Å; D167-R171 PolarHBondContact O-N 2.68Å; D167-R171 WeakPolarHBondContact OD2-CD 3.34Å; R171-Q173 VanDerWaalsContact C-N 3.26Å; R171-Q173 PolarHBondContact O-N 3.25Å; R171-R174 PolarHBondContact O-N 2.88Å; R171-Q175 WeakPolarHBondContact O-CG 3.37Å; R171-Q175 PolarHBondContact O-N 3.01Å; R171-D268 IonicContact NH2-OD1 3.33Å; R171-D268 PolarHBondContact NH2-OD1 2.76Å; R171-D268 IonicContact NH2-OD2 3.98Å; R171-Y275 PolarHBondContact NH2-OH 3.04Å |
| 172 | L | 95.4 | Very high | 94 | Very high | 0 Ų | 0 | 53.7 Ų | 53.7 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -56.8 | -42.9 | -178.9 | 178.4 | 60.5 | 0 | 0 | 0 | 111.6 | F168 G169 L176 C178 R194 C196 E233 | F168-L172 HydrophobicContact CE1-CD2 4.33Å; F168-L172 WeakPolarHBondContact O-CB 3.36Å; F168-L172 PolarHBondContact O-N 3.07Å; G169-L172 PolarHBondContact O-N 2.89Å; L172-L176 WeakPolarHBondContact O-CA 3.39Å; L172-L176 PolarHBondContact O-N 2.77Å; L172-C178 WeakPolarHBondContact CA-SG 3.28Å; L172-C178 HydrophobicContact CB-CB 4.4Å; L172-C178 HydrophobicContact CD1-CB 4.19Å; L172-C178 PolarHBondContact N-SG 2.92Å; L172-C178 VanDerWaalsContact N-SG 3.36Å; L172-R194 HydrophobicContact CD1-CB 4.41Å; L172-R194 HydrophobicContact CD1-CG 4.47Å; L172-R194 WeakPolarHBondContact CD1-O 3.46Å; L172-R194 HydrophobicContact CD2-CB 4.3Å; L172-R194 VanDerWaalsContact CD2-CD 3.45Å; L172-R194 HydrophobicContact CD2-CG 3.75Å; L172-C196 PolarHBondContact O-SG 3.21Å; L172-C196 VanDerWaalsContact O-SG 3.42Å; L172-E233 HydrophobicContact CD2-CG 4.17Å; L172-E233 WeakPolarHBondContact CD2-OE1 3.44Å |
| 173 | Q | 94.8 | Very high | 94.1 | Very high | 116 Ų | 116 | 56.7 Ų | 56.7 | 54% | 0.542 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -69.1 | -33.5 | 176.7 | -63.9 | -58.8 | -44.5 | 0 | 0 | 112.8 | G169 E170 R171 | G169-Q173 WeakPolarHBondContact O-CG 3.1Å; G169-Q173 PolarHBondContact O-N 2.99Å; E170-Q173 PolarHBondContact O-N 2.77Å; R171-Q173 VanDerWaalsContact C-N 3.26Å; R171-Q173 PolarHBondContact O-N 3.25Å |
| 174 | R | 94.4 | Very high | 94.1 | Very high | 172 Ų | 172 | 56.9 Ų | 56.9 | 65% | 0.649 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -74.1 | -45.1 | -179.4 | -176 | 174.6 | 70.6 | -166.8 | 2.9 | 113.6 | E170 R171 D271 | E170-R174 VanDerWaalsContact O-CB 3.31Å; E170-R174 WeakPolarHBondContact O-CB 3.25Å; E170-R174 PolarHBondContact O-N 2.94Å; R171-R174 PolarHBondContact O-N 2.88Å; R174-D271 IonicContact NH2-OD1 3.74Å; R174-D271 PolarHBondContact NH2-OD1 3.09Å |
| 175 | Q | 95 | Very high | 93.8 | Very high | 24 Ų | 24 | 53.2 Ų | 53.2 | 11% | 0.112 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -105.8 | -2.8 | -176 | 47.3 | 176.3 | 43.4 | 0 | 0 | 113.6 | R171 V177 C178 Y266 D268 | R171-Q175 WeakPolarHBondContact O-CG 3.37Å; R171-Q175 PolarHBondContact O-N 3.01Å; Q175-V177 VanDerWaalsContact CG-O 3.32Å; Q175-V177 WeakPolarHBondContact CG-O 3.44Å; Q175-V177 PolarHBondContact NE2-O 3.39Å; Q175-V177 PolarHBondContact O-N 2.77Å; Q175-C178 PolarHBondContact NE2-SG 3.37Å; Q175-Y266 VanDerWaalsContact O-CB 3.32Å; Q175-Y266 WeakPolarHBondContact O-CB 3.22Å; Q175-D268 PolarHBondContact NE2-OD1 3.42Å |
| 176 | L | 96.9 | Very high | 93.2 | Very high | 30 Ų | 30 | 58.8 Ų | 58.8 | 16% | 0.157 | 32% | 0.317 | C | S | . | . | S | Bend | trans | 63.3 | -3.7 | 179 | -51 | 179.3 | 0 | 0 | 0 | 116.1 | L172 V195 C196 V198 Y259 Y266 | L172-L176 WeakPolarHBondContact O-CA 3.39Å; L172-L176 PolarHBondContact O-N 2.77Å; L176-V195 CarbonylContact O-C 3.57Å; L176-V195 VanDerWaalsContact O-CA 3.25Å; L176-V195 WeakPolarHBondContact O-CA 3Å; L176-C196 HydrophobicContact CB-CB 4.23Å; L176-C196 HydrophobicContact CD2-CB 3.85Å; L176-C196 PolarHBondContact O-N 2.87Å; L176-V198 HydrophobicContact CD1-CG2 4.18Å; L176-Y259 HydrophobicContact CB-CD1 4.18Å; L176-Y259 HydrophobicContact CB-CE1 4.13Å; L176-Y259 WeakPolarHBondContact O-CD1 3.15Å; L176-Y266 HydrophobicContact CB-CG 4.37Å; L176-Y266 HydrophobicContact CD1-CD1 3.97Å; L176-Y266 HydrophobicContact CD1-CD2 4.09Å; L176-Y266 HydrophobicContact CD1-CE1 3.55Å; L176-Y266 HydrophobicContact CD1-CE2 3.69Å; L176-Y266 HydrophobicContact CD1-CG 4.22Å; L176-Y266 HydrophobicContact CG-CD1 4.37Å; L176-Y266 HydrophobicContact CG-CE1 4.33Å |
| 177 | V | 97.4 | Very high | 92.7 | Very high | 0 Ų | 0 | 60 Ų | 60 | 0% | 0 | 31% | 0.307 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -143.4 | 135.4 | 177.6 | 53.9 | 0 | 0 | 0 | 0 | 109.3 | Q175 V193 R194 V195 V257 Y259 D268 | Q175-V177 VanDerWaalsContact CG-O 3.32Å; Q175-V177 WeakPolarHBondContact CG-O 3.44Å; Q175-V177 PolarHBondContact NE2-O 3.39Å; Q175-V177 PolarHBondContact O-N 2.77Å; V177-V193 HydrophobicContact CG2-CG1 3.59Å; V177-R194 WeakPolarHBondContact CA-O 3.37Å; V177-V195 HydrophobicContact CB-CG1 4.07Å; V177-V195 HydrophobicContact CG2-CG1 3.89Å; V177-V257 HydrophobicContact CG2-CB 4.23Å; V177-V257 HydrophobicContact CG2-CG1 3.71Å; V177-Y259 HydrophobicContact CB-CD1 4.1Å; V177-Y259 HydrophobicContact CB-CG 4.28Å; V177-D268 HydrophobicContact CG1-CB 4.17Å; V177-D268 HydrophobicContact CG2-CB 4.46Å |
| 178 | C | 97 | Very high | 92.7 | Very high | 0 Ų | 0 | 57.2 Ų | 57.2 | 0% | 0 | 29% | 0.294 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -140.7 | 138.6 | 170.1 | -78 | 0 | 0 | 0 | 0 | 110.3 | F168 L172 Q175 E180 R194 D268 | F168-C178 HydrophobicContact CD2-CB 4.17Å; F168-C178 HydrophobicContact CE2-CB 3.51Å; F168-C178 HydrophobicContact CZ-CB 3.98Å; L172-C178 WeakPolarHBondContact CA-SG 3.28Å; L172-C178 HydrophobicContact CB-CB 4.4Å; L172-C178 HydrophobicContact CD1-CB 4.19Å; L172-C178 PolarHBondContact N-SG 2.92Å; L172-C178 VanDerWaalsContact N-SG 3.36Å; Q175-C178 PolarHBondContact NE2-SG 3.37Å; C178-E180 PolarHBondContact O-N 3.38Å; C178-R194 PolarHBondContact N-O 3.3Å; C178-R194 PolarHBondContact O-N 3.22Å; C178-D268 VanDerWaalsContact CA-OD2 3.25Å; C178-D268 WeakPolarHBondContact CA-OD2 3.5Å |
| 179 | L | 97.3 | Very high | 92.7 | Very high | 0 Ų | 0 | 56.7 Ų | 56.7 | 0% | 0 | 29% | 0.291 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -61.4 | 129.1 | 162.3 | -176.6 | 69.6 | 0 | 0 | 0 | 108.5 | F159 P162 F168 V193 F238 F255 V257 D268 Y275 | F159-L179 HydrophobicContact CE2-CD2 4.03Å; F159-L179 HydrophobicContact CZ-CD2 4.07Å; P162-L179 WeakPolarHBondContact CB-O 3.29Å; P162-L179 HydrophobicContact CG-CB 4.42Å; P162-L179 HydrophobicContact CG-CD2 4.04Å; P162-L179 HydrophobicContact CG-CG 4.22Å; F168-L179 WeakPolarHBondContact CE2-O 3.25Å; L179-V193 HydrophobicContact CD1-CG2 4.23Å; L179-F238 HydrophobicContact CD1-CE1 3.6Å; L179-F238 HydrophobicContact CD1-CZ 3.82Å; L179-F255 HydrophobicContact CD1-CE2 4.15Å; L179-F255 HydrophobicContact CD2-CE2 3.76Å; L179-F255 HydrophobicContact CD2-CZ 3.76Å; L179-V257 HydrophobicContact CB-CG2 4.33Å; L179-V257 HydrophobicContact CD1-CG2 4.41Å; L179-D268 PolarHBondContact N-OD2 3.3Å; L179-Y275 HydrophobicContact CB-CD2 4.48Å; L179-Y275 HydrophobicContact CB-CE1 4.15Å; L179-Y275 HydrophobicContact CB-CE2 3.77Å; L179-Y275 HydrophobicContact CD2-CD1 3.56Å; L179-Y275 HydrophobicContact CD2-CD2 4.03Å; L179-Y275 HydrophobicContact CD2-CE1 3.55Å; L179-Y275 HydrophobicContact CD2-CE2 4.04Å; L179-Y275 HydrophobicContact CD2-CG 3.78Å; L179-Y275 HydrophobicContact CG-CE1 4.46Å |
| 180 | E | 95.6 | Very high | 92.9 | Very high | 27 Ų | 27 | 56.8 Ų | 56.8 | 13% | 0.126 | 29% | 0.285 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.3 | -50.9 | 179.7 | 176.3 | -174.9 | -140 | 0 | 0 | 110.8 | V163 F168 C178 T192 R194 | V163-E180 HydrophobicContact CB-CG 4.03Å; V163-E180 WeakPolarHBondContact CB-O 3.28Å; V163-E180 HydrophobicContact CG2-CG 4.09Å; V163-E180 PolarHBondContact N-O 2.95Å; F168-E180 HydrophobicContact CZ-CB 4.39Å; C178-E180 PolarHBondContact O-N 3.38Å; E180-T192 WeakPolarHBondContact CB-O 3.4Å; E180-T192 PolarHBondContact N-O 2.8Å; E180-T192 VanDerWaalsContact OE2-CB 3.23Å; E180-T192 WeakPolarHBondContact OE2-CB 3.46Å; E180-T192 PolarHBondContact OE2-OG1 3.01Å; E180-R194 IonicContact OE1-CZ 3.95Å; E180-R194 IonicContact OE1-NE 3.41Å; E180-R194 PolarHBondContact OE1-NE 2.73Å; E180-R194 IonicContact OE1-NH2 3.26Å; E180-R194 PolarHBondContact OE1-NH2 3.49Å |
| 181 | R | 95.3 | Very high | 93.1 | Very high | 126 Ų | 126 | 49.9 Ų | 49.9 | 48% | 0.475 | 26% | 0.255 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.5 | 148.3 | -179.5 | -170.5 | 177.5 | -62.6 | -84.3 | -3.2 | 110.9 | G191 T192 | R181-G191 CarbonylContact O-C 3.58Å; R181-G191 WeakPolarHBondContact O-CA 3.36Å; R181-T192 PolarHBondContact N-O 2.87Å; R181-T192 PolarHBondContact O-N 2.85Å |
| 182 | V | 95.9 | Very high | 93.2 | Very high | 20 Ų | 20 | 49.8 Ų | 49.8 | 12% | 0.121 | 26% | 0.256 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.5 | 141.7 | 167.9 | 70.8 | 0 | 0 | 0 | 0 | 109.5 | P157 F159 I189 S190 F255 | P157-V182 HydrophobicContact CB-CG1 4.28Å; P157-V182 HydrophobicContact CG-CG1 3.68Å; F159-V182 HydrophobicContact CE2-CG1 4.06Å; F159-V182 HydrophobicContact CZ-CG1 3.76Å; V182-I189 HydrophobicContact CG2-CG2 3.61Å; V182-S190 CarbonylContact C-O 3.58Å; V182-S190 WeakPolarHBondContact CA-O 3.25Å; V182-S190 WeakPolarHBondContact CG2-O 3.31Å; V182-F255 HydrophobicContact CG2-CZ 4.21Å |
| 183 | T | 93.3 | Very high | 93.3 | Very high | 69 Ų | 69 | 49.8 Ų | 49.8 | 42% | 0.423 | 26% | 0.256 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.9 | 133.5 | 176.7 | 43.1 | 0 | 0 | 0 | 0 | 109 | S190 | T183-S190 PolarHBondContact N-O 2.83Å; T183-S190 PolarHBondContact O-N 3.46Å; T183-S190 VanDerWaalsContact O-O 3.07Å; T183-S190 PolarHBondContact O-OG 2.7Å; T183-S190 PolarHBondContact OG1-O 3.03Å; T183-S190 PolarHBondContact OG1-OG 3.26Å |
| 184 | C | 90.6 | Very high | 93.5 | Very high | 48 Ų | 48 | 46.6 Ų | 46.6 | 32% | 0.324 | 24% | 0.239 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -110.8 | 131.8 | 178.5 | -58.6 | 0 | 0 | 0 | 0 | 109.1 | L155 L277 | L155-C184 HydrophobicContact CB-CB 4.09Å; L155-C184 WeakPolarHBondContact O-CB 3.3Å; L155-C184 PolarHBondContact O-SG 3.4Å; C184-L277 VanDerWaalsContact SG-CD2 3.58Å |
| 185 | S | 85.1 | Confident | 93.6 | Very high | 64 Ų | 64 | 38.4 Ų | 38.4 | 45% | 0.448 | 21% | 0.208 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -132.7 | 176.2 | 172.4 | 71.2 | 0 | 0 | 0 | 0 | 110.4 | L187 G188 | S185-L187 PolarHBondContact O-N 2.88Å; S185-L187 PolarHBondContact OG-N 2.81Å; S185-G188 PolarHBondContact N-O 3.34Å; S185-G188 PolarHBondContact O-N 2.81Å; S185-G188 VanDerWaalsContact O-N 3.09Å |
| 186 | D | 77.9 | Confident | 93.7 | Very high | 144 Ų | 144 | 37.7 Ų | 37.7 | 77% | 0.77 | 21% | 0.206 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -55.1 | -30 | 170 | 60.5 | -28.6 | 0 | 0 | 0 | 113.4 | G188 | D186-G188 VanDerWaalsContact C-N 3.35Š|
| 187 | L | 79.1 | Confident | 93.7 | Very high | 139 Ų | 139 | 39.7 Ų | 39.7 | 73% | 0.728 | 22% | 0.217 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -80.9 | -10.5 | 177.8 | -58.3 | 178 | 0 | 0 | 0 | 114 | S185 | S185-L187 PolarHBondContact O-N 2.88Å; S185-L187 PolarHBondContact OG-N 2.81Å |
| 188 | G | 90.3 | Very high | 93.5 | Very high | 6 Ų | 6 | 43.7 Ų | 43.7 | 6% | 0.062 | 24% | 0.241 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | 129.1 | -153.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | S185 D186 | S185-G188 PolarHBondContact N-O 3.34Å; S185-G188 PolarHBondContact O-N 2.81Å; S185-G188 VanDerWaalsContact O-N 3.09Å; D186-G188 VanDerWaalsContact C-N 3.35Å |
| 189 | I | 95.1 | Very high | 93.4 | Very high | 2 Ų | 2 | 45.2 Ų | 45.2 | 1% | 0.01 | 25% | 0.253 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104 | 133.7 | -177.5 | -62.2 | 157 | 0 | 0 | 0 | 108.8 | L155 V182 F238 G239 F240 V242 V253 L277 | L155-I189 HydrophobicContact CD1-CD1 3.81Å; L155-I189 HydrophobicContact CD1-CG1 3.86Å; V182-I189 HydrophobicContact CG2-CG2 3.61Å; I189-F238 HydrophobicContact CG2-CE2 4.33Å; I189-G239 CarbonylContact O-C 3.52Å; I189-G239 WeakPolarHBondContact O-CA 3.44Å; I189-F240 HydrophobicContact CB-CD2 4.44Å; I189-F240 HydrophobicContact CB-CE1 4.2Å; I189-F240 HydrophobicContact CB-CE2 3.96Å; I189-F240 HydrophobicContact CB-CZ 3.82Å; I189-F240 HydrophobicContact CD1-CD2 4.46Å; I189-F240 HydrophobicContact CD1-CE2 3.47Å; I189-F240 VanDerWaalsContact CD1-CE2 3.47Å; I189-F240 HydrophobicContact CD1-CZ 3.65Å; I189-F240 HydrophobicContact CG1-CE2 4.27Å; I189-F240 HydrophobicContact CG1-CZ 4.37Å; I189-F240 HydrophobicContact CG2-CE1 4.14Å; I189-F240 HydrophobicContact CG2-CZ 3.95Å; I189-F240 PolarHBondContact N-O 3.43Å; I189-F240 PolarHBondContact O-N 3.5Å; I189-V242 HydrophobicContact CB-CG2 4.5Å; I189-V242 HydrophobicContact CD1-CG2 3.54Å; I189-V242 HydrophobicContact CG1-CG2 3.73Å; I189-V253 HydrophobicContact CD1-CB 4.2Å; I189-V253 HydrophobicContact CD1-CG1 3.86Å; I189-V253 HydrophobicContact CD1-CG2 4.28Å; I189-L277 HydrophobicContact CD1-CD1 3.35Å; I189-L277 HydrophobicContact CG1-CD1 3.82Å; I189-L277 HydrophobicContact CG2-CD1 4.03Å |
| 190 | S | 96.5 | Very high | 93.3 | Very high | 41 Ų | 41 | 54.5 Ų | 54.5 | 29% | 0.287 | 29% | 0.294 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.7 | 161.7 | 173.5 | 52.3 | 0 | 0 | 0 | 0 | 110.4 | V182 T183 F238 | V182-S190 CarbonylContact C-O 3.58Å; V182-S190 WeakPolarHBondContact CA-O 3.25Å; V182-S190 WeakPolarHBondContact CG2-O 3.31Å; T183-S190 PolarHBondContact N-O 2.83Å; T183-S190 PolarHBondContact O-N 3.46Å; T183-S190 VanDerWaalsContact O-O 3.07Å; T183-S190 PolarHBondContact O-OG 2.7Å; T183-S190 PolarHBondContact OG1-O 3.03Å; T183-S190 PolarHBondContact OG1-OG 3.26Å; S190-F238 VanDerWaalsContact CA-O 3.3Å; S190-F238 WeakPolarHBondContact CA-O 3.41Å |
| 191 | G | 96.8 | Very high | 93.4 | Very high | 8 Ų | 8 | 61 Ų | 61 | 8% | 0.082 | 32% | 0.324 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -174.6 | 175.5 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | R181 T237 F238 | R181-G191 CarbonylContact O-C 3.58Å; R181-G191 WeakPolarHBondContact O-CA 3.36Å; G191-T237 WeakPolarHBondContact O-CA 3.14Å; G191-F238 PolarHBondContact N-O 2.97Å; G191-F238 WeakPolarHBondContact O-CD1 3.41Å; G191-F238 PolarHBondContact O-N 3.43Å |
| 192 | T | 97.7 | Very high | 93.4 | Very high | 9 Ų | 9 | 56.6 Ų | 56.6 | 6% | 0.055 | 31% | 0.309 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.9 | 143.8 | 173 | 57.1 | 0 | 0 | 0 | 0 | 110.8 | E180 R181 R224 V235 F236 T237 | E180-T192 WeakPolarHBondContact CB-O 3.4Å; E180-T192 PolarHBondContact N-O 2.8Å; E180-T192 VanDerWaalsContact OE2-CB 3.23Å; E180-T192 WeakPolarHBondContact OE2-CB 3.46Å; E180-T192 PolarHBondContact OE2-OG1 3.01Å; R181-T192 PolarHBondContact N-O 2.87Å; R181-T192 PolarHBondContact O-N 2.85Å; T192-R224 VanDerWaalsContact CG2-CZ 3.45Å; T192-R224 VanDerWaalsContact CG2-NH2 3.25Å; T192-V235 HydrophobicContact CG2-CG1 4.2Å; T192-F236 CarbonylContact C-O 3.56Å; T192-F236 VanDerWaalsContact CA-O 3.26Å; T192-F236 WeakPolarHBondContact CA-O 3.49Å; T192-T237 HydrophobicContact CG2-CG2 3.94Å |
| 193 | V | 98 | Very high | 93.5 | Very high | 0 Ų | 0 | 61.5 Ų | 61.5 | 0% | 0 | 33% | 0.33 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.3 | 135.5 | 177.5 | 175.1 | 0 | 0 | 0 | 0 | 107.1 | V177 L179 V195 V204 V235 F236 F238 V257 | V177-V193 HydrophobicContact CG2-CG1 3.59Å; L179-V193 HydrophobicContact CD1-CG2 4.23Å; V193-V195 HydrophobicContact CG1-CG1 3.99Å; V193-V204 HydrophobicContact CB-CG1 4.36Å; V193-V204 HydrophobicContact CG1-CG1 4.04Å; V193-V235 CarbonylContact O-C 3.57Å; V193-V235 WeakPolarHBondContact O-CA 3.08Å; V193-F236 HydrophobicContact CB-CB 4.44Å; V193-F236 PolarHBondContact N-O 3.1Å; V193-F236 PolarHBondContact O-N 3.49Å; V193-F238 HydrophobicContact CG2-CD1 3.74Å; V193-F238 HydrophobicContact CG2-CE1 3.75Å; V193-V257 HydrophobicContact CB-CG1 4.35Å; V193-V257 HydrophobicContact CG1-CG1 3.68Å; V193-V257 HydrophobicContact CG2-CG1 3.74Å; V193-V257 HydrophobicContact CG2-CG2 4.07Å |
| 194 | R | 97.4 | Very high | 93.8 | Very high | 49 Ų | 49 | 58.3 Ų | 58.3 | 19% | 0.185 | 31% | 0.311 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.3 | 135.1 | 172.4 | -162.3 | 175.9 | -76 | -162.9 | 5.6 | 109.6 | F168 L172 V177 C178 E180 A227 E233 D234 | F168-R194 HydrophobicContact CZ-CB 4.13Å; L172-R194 HydrophobicContact CD1-CB 4.41Å; L172-R194 HydrophobicContact CD1-CG 4.47Å; L172-R194 WeakPolarHBondContact CD1-O 3.46Å; L172-R194 HydrophobicContact CD2-CB 4.3Å; L172-R194 VanDerWaalsContact CD2-CD 3.45Å; L172-R194 HydrophobicContact CD2-CG 3.75Å; V177-R194 WeakPolarHBondContact CA-O 3.37Å; C178-R194 PolarHBondContact N-O 3.3Å; C178-R194 PolarHBondContact O-N 3.22Å; E180-R194 IonicContact OE1-CZ 3.95Å; E180-R194 IonicContact OE1-NE 3.41Å; E180-R194 PolarHBondContact OE1-NE 2.73Å; E180-R194 IonicContact OE1-NH2 3.26Å; E180-R194 PolarHBondContact OE1-NH2 3.49Å; R194-A227 HydrophobicContact CG-CB 4.42Å; R194-E233 VanDerWaalsContact CD-OE2 3.31Å; R194-E233 WeakPolarHBondContact CD-OE2 3.42Å; R194-E233 HydrophobicContact CG-CB 4.26Å; R194-E233 IonicContact NH1-OE2 3.16Å; R194-E233 PolarHBondContact NH1-OE2 3.18Å; R194-D234 WeakPolarHBondContact CA-O 3.21Å |
| 195 | V | 97.8 | Very high | 94.1 | Very high | 0 Ų | 0 | 56.2 Ų | 56.2 | 0% | 0 | 30% | 0.297 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.9 | 147.2 | 178.2 | -58.8 | 0 | 0 | 0 | 0 | 111.3 | L176 V177 V193 K202 V204 E233 D234 F236 Y259 | L176-V195 CarbonylContact O-C 3.57Å; L176-V195 VanDerWaalsContact O-CA 3.25Å; L176-V195 WeakPolarHBondContact O-CA 3Å; V177-V195 HydrophobicContact CB-CG1 4.07Å; V177-V195 HydrophobicContact CG2-CG1 3.89Å; V193-V195 HydrophobicContact CG1-CG1 3.99Å; V195-K202 HydrophobicContact CG2-CD 4.04Å; V195-V204 HydrophobicContact CG1-CG2 3.85Å; V195-E233 CarbonylContact O-C 3.55Å; V195-E233 VanDerWaalsContact O-CA 3.28Å; V195-E233 WeakPolarHBondContact O-CA 3.17Å; V195-D234 HydrophobicContact CG2-CB 3.86Å; V195-D234 PolarHBondContact N-O 3.21Å; V195-D234 PolarHBondContact O-N 2.75Å; V195-F236 HydrophobicContact CG2-CD2 3.75Å; V195-F236 HydrophobicContact CG2-CE2 3.53Å; V195-Y259 HydrophobicContact CB-CD1 4.13Å; V195-Y259 HydrophobicContact CB-CD2 4.49Å; V195-Y259 HydrophobicContact CB-CE1 3.89Å; V195-Y259 HydrophobicContact CB-CE2 4.3Å; V195-Y259 HydrophobicContact CB-CG 4.4Å; V195-Y259 HydrophobicContact CG1-CD1 4.12Å; V195-Y259 HydrophobicContact CG1-CD2 4.17Å; V195-Y259 HydrophobicContact CG1-CE1 4.37Å; V195-Y259 HydrophobicContact CG1-CE2 4.45Å; V195-Y259 HydrophobicContact CG1-CG 3.99Å; V195-Y259 HydrophobicContact CG2-CE2 4.34Å |
| 196 | C | 97.1 | Very high | 94.7 | Very high | 10 Ų | 10 | 53.2 Ų | 53.2 | 7% | 0.068 | 28% | 0.276 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.6 | 133.4 | 171.8 | -64.6 | 0 | 0 | 0 | 0 | 110.4 | L172 L176 V198 Y259 | L172-C196 PolarHBondContact O-SG 3.21Å; L172-C196 VanDerWaalsContact O-SG 3.42Å; L176-C196 HydrophobicContact CB-CB 4.23Å; L176-C196 HydrophobicContact CD2-CB 3.85Å; L176-C196 PolarHBondContact O-N 2.87Å; C196-V198 VanDerWaalsContact C-N 3.34Å; C196-V198 HydrophobicContact CB-CG2 4.28Å; C196-V198 PolarHBondContact O-N 3.23Å; C196-Y259 PolarHBondContact O-OH 2.99Å |
| 197 | N | 95.4 | Very high | 95.7 | Very high | 72 Ų | 72 | 50.4 Ų | 50.4 | 39% | 0.385 | 26% | 0.255 | S | S | . | . | trans | -80.1 | 78.4 | -179.1 | -173.6 | 8.7 | 0 | 0 | 0 | 111.4 | K202 G231 K232 | N197-K202 WeakPolarHBondContact OD1-CE 3.44Å; N197-K202 PolarHBondContact OD1-NZ 3.2Å; N197-G231 PolarHBondContact ND2-O 3.21Å; N197-K232 VanDerWaalsContact CB-O 3.29Å; N197-K232 WeakPolarHBondContact CB-O 3.22Å; N197-K232 PolarHBondContact N-O 3.46Å | ||
| 198 | V | 94.8 | Very high | 96.5 | Very high | 83 Ų | 83 | 45 Ų | 45 | 50% | 0.503 | 23% | 0.225 | S | C | . | . | S | Bend | trans | -85.1 | -39.2 | -179.3 | -177.5 | 0 | 0 | 0 | 0 | 112.4 | L176 C196 V261 | L176-V198 HydrophobicContact CD1-CG2 4.18Å; C196-V198 VanDerWaalsContact C-N 3.34Å; C196-V198 HydrophobicContact CB-CG2 4.28Å; C196-V198 PolarHBondContact O-N 3.23Å; V198-V261 HydrophobicContact CB-CG1 4.38Å; V198-V261 HydrophobicContact CB-CG2 4.15Å |
| 199 | A | 95.1 | Very high | 96.7 | Very high | 32 Ų | 32 | 44.8 Ų | 44.8 | 26% | 0.264 | 22% | 0.222 | S | C | . | . | trans | -147.8 | 163.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | K202 V261 A262 | A199-K202 WeakPolarHBondContact O-CE 3.47Å; A199-K202 WeakPolarHBondContact O-CG 3.42Å; A199-K202 PolarHBondContact O-NZ 3.42Å; A199-V261 HydrophobicContact CB-CG2 3.63Å; A199-A262 HydrophobicContact CB-CB 4.37Å | ||
| 200 | F | 94.4 | Very high | 96.6 | Very high | 195 Ų | 195 | 47 Ų | 47 | 86% | 0.855 | 23% | 0.232 | S | C | * | . | S | Bend | trans | -64 | -48.1 | -178.8 | -179.2 | -102.3 | 0 | 0 | 0 | 112.5 | K202 | F200-K202 PolarHBondContact O-N 3.16Š|
| 201 | E | 96.9 | Very high | 96.3 | Very high | 163 Ų | 163 | 46.1 Ų | 46.1 | 76% | 0.762 | 23% | 0.225 | S | C | * | . | trans | -76.9 | 108.7 | 179.4 | -66.9 | -175.4 | -176.6 | 0 | 0 | 111 | ||||
| 202 | K | 96.8 | Very high | 95.9 | Very high | 34 Ų | 34 | 47.9 Ų | 47.9 | 15% | 0.148 | 24% | 0.244 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -124.9 | 132.9 | -178.4 | -62.7 | -173.1 | -171.4 | 80.5 | 0 | 109.6 | V195 N197 A199 F200 D234 F236 Y259 V261 | V195-K202 HydrophobicContact CG2-CD 4.04Å; N197-K202 WeakPolarHBondContact OD1-CE 3.44Å; N197-K202 PolarHBondContact OD1-NZ 3.2Å; A199-K202 WeakPolarHBondContact O-CE 3.47Å; A199-K202 WeakPolarHBondContact O-CG 3.42Å; A199-K202 PolarHBondContact O-NZ 3.42Å; F200-K202 PolarHBondContact O-N 3.16Å; K202-D234 WeakPolarHBondContact CE-OD2 3.36Å; K202-D234 IonicContact NZ-OD2 2.68Å; K202-D234 PolarHBondContact NZ-OD2 2.95Å; K202-F236 HydrophobicContact CB-CZ 3.83Å; K202-F236 HydrophobicContact CD-CE2 4.06Å; K202-F236 HydrophobicContact CD-CZ 4.08Å; K202-Y259 HydrophobicContact CB-CE2 3.86Å; K202-Y259 HydrophobicContact CD-CE2 4Å; K202-Y259 WeakPolarHBondContact CD-OH 3.43Å; K202-Y259 WeakPolarHBondContact CE-OH 3.4Å; K202-Y259 HydrophobicContact CG-CE2 3.86Å; K202-V261 HydrophobicContact CG-CG2 4.36Å |
| 203 | Q | 97.8 | Very high | 95.7 | Very high | 123 Ų | 123 | 51.7 Ų | 51.7 | 58% | 0.575 | 26% | 0.257 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -119.5 | 112.8 | 169.7 | -59.7 | 176.7 | 6 | 0 | 0 | 108.8 | R260 | Q203-R260 HydrophobicContact CB-CB 4.23Å; Q203-R260 PolarHBondContact N-O 3.2Å; Q203-R260 PolarHBondContact O-N 3.23Å |
| 204 | V | 98.3 | Very high | 95.4 | Very high | 3 Ų | 3 | 61.8 Ų | 61.8 | 2% | 0.018 | 30% | 0.295 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.8 | 130.6 | 176 | -177.9 | 0 | 0 | 0 | 0 | 108.2 | V193 V195 A221 F236 V257 R258 Y259 | V193-V204 HydrophobicContact CB-CG1 4.36Å; V193-V204 HydrophobicContact CG1-CG1 4.04Å; V195-V204 HydrophobicContact CG1-CG2 3.85Å; V204-A221 HydrophobicContact CB-CB 3.94Å; V204-A221 HydrophobicContact CG1-CB 3.74Å; V204-A221 PolarHBondContact O-N 3.09Å; V204-F236 HydrophobicContact CB-CB 4.32Å; V204-F236 HydrophobicContact CB-CD1 3.89Å; V204-F236 HydrophobicContact CB-CE1 4.38Å; V204-F236 HydrophobicContact CB-CG 4.02Å; V204-F236 HydrophobicContact CG1-CB 4.28Å; V204-F236 HydrophobicContact CG1-CG 4.46Å; V204-F236 HydrophobicContact CG2-CB 4.45Å; V204-F236 HydrophobicContact CG2-CD1 3.86Å; V204-F236 HydrophobicContact CG2-CD2 3.87Å; V204-F236 HydrophobicContact CG2-CE1 4.02Å; V204-F236 HydrophobicContact CG2-CE2 4.04Å; V204-F236 HydrophobicContact CG2-CG 3.79Å; V204-F236 HydrophobicContact CG2-CZ 4.13Å; V204-V257 HydrophobicContact CG1-CG1 4.07Å; V204-R258 WeakPolarHBondContact CA-O 3.46Å; V204-Y259 HydrophobicContact CG2-CD2 3.77Å; V204-Y259 HydrophobicContact CG2-CE2 4.35Å |
| 205 | A | 98.2 | Very high | 95.2 | Very high | 4 Ų | 4 | 61.8 Ų | 61.8 | 3% | 0.033 | 30% | 0.303 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.4 | 148.1 | 177.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | A219 R258 | A205-A219 CarbonylContact C-O 3.5Å; A205-A219 VanDerWaalsContact CA-O 3.3Å; A205-A219 WeakPolarHBondContact CA-O 3.49Å; A205-R258 PolarHBondContact N-O 3.15Å; A205-R258 PolarHBondContact O-N 3.28Å |
| 206 | V | 98.1 | Very high | 95.1 | Very high | 0 Ų | 0 | 64.4 Ų | 64.4 | 0% | 0 | 32% | 0.319 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.4 | 121.9 | 172.4 | 178.5 | 0 | 0 | 0 | 0 | 108.2 | E218 A219 F238 F240 F255 V257 | V206-E218 CarbonylContact O-C 3.45Å; V206-E218 WeakPolarHBondContact O-CA 3.4Å; V206-A219 PolarHBondContact N-O 3.46Å; V206-A219 PolarHBondContact O-N 3.05Å; V206-F238 HydrophobicContact CB-CD2 4.21Å; V206-F238 HydrophobicContact CB-CG 4.36Å; V206-F238 HydrophobicContact CG1-CD2 4.47Å; V206-F238 HydrophobicContact CG1-CE2 4.38Å; V206-F238 HydrophobicContact CG2-CB 3.93Å; V206-F238 HydrophobicContact CG2-CD1 3.61Å; V206-F238 HydrophobicContact CG2-CD2 3.68Å; V206-F238 HydrophobicContact CG2-CE1 3.96Å; V206-F238 HydrophobicContact CG2-CE2 4.03Å; V206-F238 HydrophobicContact CG2-CG 3.44Å; V206-F238 VanDerWaalsContact CG2-CG 3.44Å; V206-F238 HydrophobicContact CG2-CZ 4.15Å; V206-F240 HydrophobicContact CG1-CE1 3.97Å; V206-F255 HydrophobicContact CG1-CB 3.85Å; V206-F255 HydrophobicContact CG1-CD2 3.66Å; V206-F255 HydrophobicContact CG1-CG 4.1Å; V206-V257 HydrophobicContact CG2-CG1 4.5Å; V206-V257 HydrophobicContact CG2-CG2 4.35Å |
| 207 | R | 97.4 | Very high | 95.1 | Very high | 86 Ų | 86 | 67.7 Ų | 67.7 | 33% | 0.325 | 33% | 0.333 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.7 | 125.6 | 172.8 | -167.9 | 179.6 | -179.4 | 178.8 | 0.5 | 108.4 | W213 T216 H217 E218 F255 A256 W267 | R207-W213 HydrophobicContact CG-CZ3 4.1Å; R207-T216 PolarHBondContact NE-OG1 3.35Å; R207-T216 PolarHBondContact NH2-OG1 2.89Å; R207-H217 CarbonylContact C-O 3.59Å; R207-H217 WeakPolarHBondContact CA-O 3.04Å; R207-E218 HydrophobicContact CB-CG 4.24Å; R207-E218 HydrophobicContact CG-CG 4.06Å; R207-F255 CarbonylContact O-C 3.6Å; R207-F255 WeakPolarHBondContact O-CA 3.24Å; R207-F255 WeakPolarHBondContact O-CB 3.48Å; R207-A256 PolarHBondContact N-O 3.32Å; R207-A256 PolarHBondContact O-N 2.95Å; R207-W267 HydrophobicContact CB-CH2 4.16Å; R207-W267 HydrophobicContact CB-CZ3 4Å |
| 208 | Y | 96.1 | Very high | 95.2 | Very high | 26 Ų | 26 | 68.7 Ų | 68.7 | 10% | 0.102 | 34% | 0.336 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.5 | 161.4 | -174.1 | 64.7 | -83.8 | 0 | 0 | 0 | 112.5 | F210 H217 A219 F240 H254 | Y208-F210 AromaticContact CD2-CE2 3.94Å; Y208-F210 HydrophobicContact CD2-CE2 3.94Å; Y208-F210 AromaticContact CD2-CZ 3.83Å; Y208-F210 HydrophobicContact CD2-CZ 3.83Å; Y208-F210 AromaticContact CE2-CE2 3.63Å; Y208-F210 HydrophobicContact CE2-CE2 3.63Å; Y208-F210 AromaticContact CE2-CZ 3.66Å; Y208-F210 HydrophobicContact CE2-CZ 3.66Å; Y208-H217 HydrophobicContact CD1-CB 4.19Å; Y208-H217 HydrophobicContact CD2-CB 4.03Å; Y208-H217 HydrophobicContact CE1-CB 3.68Å; Y208-H217 HydrophobicContact CE2-CB 3.51Å; Y208-H217 HydrophobicContact CG-CB 4.34Å; Y208-H217 PolarHBondContact N-O 2.74Å; Y208-H217 PolarHBondContact O-N 3.31Å; Y208-A219 HydrophobicContact CD1-CB 4.49Å; Y208-A219 HydrophobicContact CE1-CB 3.9Å; Y208-F240 AromaticContact CD1-CD1 4Å; Y208-F240 HydrophobicContact CD1-CD1 4Å; Y208-F240 HydrophobicContact CD1-CD2 4.1Å; Y208-F240 HydrophobicContact CD1-CE1 4.14Å; Y208-F240 HydrophobicContact CD1-CE2 4.21Å; Y208-F240 AromaticContact CD1-CG 3.98Å; Y208-F240 HydrophobicContact CD1-CG 3.98Å; Y208-F240 HydrophobicContact CD1-CZ 4.25Å; Y208-F240 AromaticContact CD2-CD2 3.67Å; Y208-F240 HydrophobicContact CD2-CD2 3.67Å; Y208-F240 AromaticContact CD2-CE2 3.59Å; Y208-F240 HydrophobicContact CD2-CE2 3.59Å; Y208-F240 HydrophobicContact CD2-CG 4.36Å; Y208-F240 HydrophobicContact CD2-CZ 4.25Å; Y208-F240 HydrophobicContact CE1-CB 3.87Å; Y208-F240 HydrophobicContact CE1-CD1 4.13Å; Y208-F240 HydrophobicContact CE1-CD2 4.05Å; Y208-F240 AromaticContact CE1-CG 3.77Å; Y208-F240 HydrophobicContact CE1-CG 3.77Å; Y208-F240 HydrophobicContact CE2-CB 4.44Å; Y208-F240 AromaticContact CE2-CD2 3.59Å; Y208-F240 HydrophobicContact CE2-CD2 3.59Å; Y208-F240 HydrophobicContact CE2-CE2 4.02Å; Y208-F240 HydrophobicContact CE2-CG 4.15Å; Y208-F240 HydrophobicContact CG-CD1 4.42Å; Y208-F240 AromaticContact CG-CD2 3.93Å; Y208-F240 HydrophobicContact CG-CD2 3.93Å; Y208-F240 HydrophobicContact CG-CE1 4.24Å; Y208-F240 AromaticContact CG-CE2 3.7Å; Y208-F240 HydrophobicContact CG-CE2 3.7Å; Y208-F240 HydrophobicContact CG-CG 4.28Å; Y208-F240 AromaticContact CG-CZ 3.88Å; Y208-F240 HydrophobicContact CG-CZ 3.88Å; Y208-F240 AromaticContact CZ-CD2 3.79Å; Y208-F240 AromaticContact CZ-CG 3.86Å; Y208-H254 CarbonylContact C-O 3.53Å; Y208-H254 WeakPolarHBondContact CA-O 3.44Å |
| 209 | T | 95.1 | Very high | 95.3 | Very high | 0 Ų | 0 | 65.3 Ų | 65.3 | 0% | 0 | 32% | 0.316 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -148.9 | 146.3 | -178.5 | -177.6 | 0 | 0 | 0 | 0 | 111.3 | S211 W213 S215 H254 | T209-S211 PolarHBondContact OG1-N 3.02Å; T209-S211 VanDerWaalsContact OG1-N 3.13Å; T209-S211 PolarHBondContact OG1-OG 2.96Å; T209-W213 HydrophobicContact CG2-CD2 3.62Å; T209-W213 HydrophobicContact CG2-CE3 3.83Å; T209-W213 HydrophobicContact CG2-CG 3.97Å; T209-W213 HydrophobicContact CG2-CH2 4.49Å; T209-W213 HydrophobicContact CG2-CZ2 4.34Å; T209-W213 HydrophobicContact CG2-CZ3 4.26Å; T209-W213 PolarHBondContact OG1-N 3.5Å; T209-W213 VanDerWaalsContact OG1-N 3.11Å; T209-S215 WeakPolarHBondContact CB-O 3.38Å; T209-S215 PolarHBondContact OG1-O 3.47Å; T209-H254 HydrophobicContact CG2-CB 3.75Å; T209-H254 PolarHBondContact N-O 2.89Å; T209-H254 PolarHBondContact O-N 3.31Å; T209-H254 VanDerWaalsContact O-N 3.08Å |
| 210 | F | 92.4 | Very high | 95.4 | Very high | 49 Ų | 49 | 69.1 Ų | 69.1 | 22% | 0.215 | 34% | 0.336 | C | S | . | . | S | Bend | trans | -105.7 | -1.5 | 171.8 | -53.6 | -70.3 | 0 | 0 | 0 | 112.3 | Y208 V242 L246 V253 | Y208-F210 AromaticContact CD2-CE2 3.94Å; Y208-F210 HydrophobicContact CD2-CE2 3.94Å; Y208-F210 AromaticContact CD2-CZ 3.83Å; Y208-F210 HydrophobicContact CD2-CZ 3.83Å; Y208-F210 AromaticContact CE2-CE2 3.63Å; Y208-F210 HydrophobicContact CE2-CE2 3.63Å; Y208-F210 AromaticContact CE2-CZ 3.66Å; Y208-F210 HydrophobicContact CE2-CZ 3.66Å; F210-V242 HydrophobicContact CE1-CB 4.42Å; F210-V242 HydrophobicContact CE1-CG1 3.78Å; F210-V242 HydrophobicContact CE1-CG2 4.13Å; F210-V242 HydrophobicContact CZ-CG1 4.43Å; F210-V242 HydrophobicContact CZ-CG2 4.46Å; F210-L246 HydrophobicContact CB-CD1 4.23Å; F210-L246 HydrophobicContact CD1-CD1 4.4Å; F210-L246 HydrophobicContact CD2-CD1 3.85Å; F210-L246 HydrophobicContact CE2-CD1 4.31Å; F210-L246 HydrophobicContact CG-CD1 3.9Å; F210-V253 HydrophobicContact CD1-CB 4.49Å; F210-V253 HydrophobicContact CD1-CG1 4.1Å; F210-V253 HydrophobicContact CD1-CG2 3.83Å; F210-V253 HydrophobicContact CE1-CG1 3.91Å; F210-V253 HydrophobicContact CE1-CG2 3.91Å |
| 211 | S | 90.6 | Very high | 95.6 | Very high | 22 Ų | 22 | 60.1 Ų | 60.1 | 15% | 0.154 | 30% | 0.298 | C | S | . | . | S | Bend | trans | -128.6 | 22.6 | -165.6 | 64.6 | 0 | 0 | 0 | 0 | 113.1 | T209 R214 S215 | T209-S211 PolarHBondContact OG1-N 3.02Å; T209-S211 VanDerWaalsContact OG1-N 3.13Å; T209-S211 PolarHBondContact OG1-OG 2.96Å; S211-R214 PolarHBondContact O-NH1 3.36Å; S211-S215 PolarHBondContact OG-N 2.78Å; S211-S215 PolarHBondContact OG-OG 3.44Å |
| 212 | G | 88.6 | Confident | 95.7 | Very high | 46 Ų | 46 | 61.4 Ų | 61.4 | 47% | 0.474 | 30% | 0.296 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 60.4 | 48.7 | -177 | 0 | 0 | 0 | 0 | 0 | 112.2 | R214 | G212-R214 VanDerWaalsContact C-N 3.26Å; G212-R214 PolarHBondContact O-N 3.29Å |
| 213 | W | 92.6 | Very high | 95.7 | Very high | 88 Ų | 88 | 67.1 Ų | 67.1 | 33% | 0.333 | 32% | 0.316 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 69.6 | 5.3 | 176.6 | -58.9 | 111.1 | 0 | 0 | 0 | 116.7 | R207 T209 T216 H254 A256 D274 | R207-W213 HydrophobicContact CG-CZ3 4.1Å; T209-W213 HydrophobicContact CG2-CD2 3.62Å; T209-W213 HydrophobicContact CG2-CE3 3.83Å; T209-W213 HydrophobicContact CG2-CG 3.97Å; T209-W213 HydrophobicContact CG2-CH2 4.49Å; T209-W213 HydrophobicContact CG2-CZ2 4.34Å; T209-W213 HydrophobicContact CG2-CZ3 4.26Å; T209-W213 PolarHBondContact OG1-N 3.5Å; T209-W213 VanDerWaalsContact OG1-N 3.11Å; W213-T216 HydrophobicContact CE3-CG2 3.68Å; W213-T216 HydrophobicContact CZ3-CG2 4.18Å; W213-H254 HydrophobicContact CZ2-CB 4.2Å; W213-A256 HydrophobicContact CH2-CB 4.45Å; W213-D274 HydrophobicContact CZ2-CB 4.46Å; W213-D274 WeakPolarHBondContact CZ2-OD2 3.26Å; W213-D274 PolarHBondContact NE1-OD2 2.84Å |
| 214 | R | 92.1 | Very high | 95.7 | Very high | 212 Ų | 212 | 68.7 Ų | 68.7 | 80% | 0.8 | 32% | 0.317 | S | S | * | . | S | Bend | trans | -67.7 | -41.2 | 171.3 | -63.7 | -170.7 | -56.1 | -86.4 | 1.4 | 112.5 | S211 G212 | S211-R214 PolarHBondContact O-NH1 3.36Å; G212-R214 VanDerWaalsContact C-N 3.26Å; G212-R214 PolarHBondContact O-N 3.29Å |
| 215 | S | 93.9 | Very high | 95.5 | Very high | 50 Ų | 50 | 69 Ų | 69 | 35% | 0.35 | 32% | 0.321 | S | S | . | . | S | Bend | trans | -116.8 | 139.1 | 169.7 | 65.3 | 0 | 0 | 0 | 0 | 109.2 | T209 S211 | T209-S215 WeakPolarHBondContact CB-O 3.38Å; T209-S215 PolarHBondContact OG1-O 3.47Å; S211-S215 PolarHBondContact OG-N 2.78Å; S211-S215 PolarHBondContact OG-OG 3.44Å |
| 216 | T | 95.8 | Very high | 95.4 | Very high | 54 Ų | 54 | 72.5 Ų | 72.5 | 33% | 0.331 | 34% | 0.343 | S | S | . | . | trans | -128.8 | 142.3 | 179.2 | 66.5 | 0 | 0 | 0 | 0 | 111 | R207 W213 | R207-T216 PolarHBondContact NE-OG1 3.35Å; R207-T216 PolarHBondContact NH2-OG1 2.89Å; W213-T216 HydrophobicContact CE3-CG2 3.68Å; W213-T216 HydrophobicContact CZ3-CG2 4.18Å | ||
| 217 | H | 95.9 | Very high | 95.1 | Very high | 79 Ų | 79 | 74.1 Ų | 74.1 | 37% | 0.366 | 36% | 0.357 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.5 | 156.5 | 177.8 | -54.6 | -83.7 | 0 | 0 | 0 | 108.7 | R207 Y208 | R207-H217 CarbonylContact C-O 3.59Å; R207-H217 WeakPolarHBondContact CA-O 3.04Å; Y208-H217 HydrophobicContact CD1-CB 4.19Å; Y208-H217 HydrophobicContact CD2-CB 4.03Å; Y208-H217 HydrophobicContact CE1-CB 3.68Å; Y208-H217 HydrophobicContact CE2-CB 3.51Å; Y208-H217 HydrophobicContact CG-CB 4.34Å; Y208-H217 PolarHBondContact N-O 2.74Å; Y208-H217 PolarHBondContact O-N 3.31Å |
| 218 | E | 97.3 | Very high | 94.7 | Very high | 94 Ų | 94 | 71.6 Ų | 71.6 | 44% | 0.439 | 36% | 0.357 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.3 | 139.8 | 176.2 | -72 | -168.4 | 174.9 | 0 | 0 | 110.3 | V206 R207 R258 | V206-E218 CarbonylContact O-C 3.45Å; V206-E218 WeakPolarHBondContact O-CA 3.4Å; R207-E218 HydrophobicContact CB-CG 4.24Å; R207-E218 HydrophobicContact CG-CG 4.06Å; E218-R258 IonicContact OE1-CZ 2.69Å; E218-R258 IonicContact OE1-NH1 2.7Å; E218-R258 PolarHBondContact OE1-NH1 2.84Å; E218-R258 IonicContact OE1-NH2 3.67Å; E218-R258 IonicContact OE2-CZ 2.88Å; E218-R258 IonicContact OE2-NH1 3Å; E218-R258 PolarHBondContact OE2-NH1 3.09Å; E218-R258 IonicContact OE2-NH2 3.66Å; E218-R258 PolarHBondContact OE2-NH2 2.83Å |
| 219 | A | 97.7 | Very high | 94 | Very high | 12 Ų | 12 | 77.3 Ų | 77.3 | 10% | 0.099 | 40% | 0.397 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122 | 123.8 | 171.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | A205 V206 Y208 F240 | A205-A219 CarbonylContact C-O 3.5Å; A205-A219 VanDerWaalsContact CA-O 3.3Å; A205-A219 WeakPolarHBondContact CA-O 3.49Å; V206-A219 PolarHBondContact N-O 3.46Å; V206-A219 PolarHBondContact O-N 3.05Å; Y208-A219 HydrophobicContact CD1-CB 4.49Å; Y208-A219 HydrophobicContact CE1-CB 3.9Å; A219-F240 HydrophobicContact CB-CB 3.93Å; A219-F240 HydrophobicContact CB-CD1 4.13Å; A219-F240 HydrophobicContact CB-CG 4.44Å |
| 220 | V | 98.1 | Very high | 93.5 | Very high | 111 Ų | 111 | 84 Ų | 84 | 67% | 0.673 | 43% | 0.429 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -74.1 | 132.6 | 178.1 | 179 | 0 | 0 | 0 | 0 | 109.6 | ||
| 221 | A | 98.2 | Very high | 93.2 | Very high | 7 Ų | 7 | 82.8 Ų | 82.8 | 6% | 0.058 | 43% | 0.431 | C | S | . | . | P | Polyproline II helix | trans | -88.9 | 144.4 | 172.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | V204 F236 T237 F238 | V204-A221 HydrophobicContact CB-CB 3.94Å; V204-A221 HydrophobicContact CG1-CB 3.74Å; V204-A221 PolarHBondContact O-N 3.09Å; A221-F236 HydrophobicContact CB-CB 3.95Å; A221-F236 HydrophobicContact CB-CD1 4.43Å; A221-T237 CarbonylContact C-O 3.51Å; A221-T237 WeakPolarHBondContact CA-O 3.3Å; A221-T237 WeakPolarHBondContact CB-O 3.29Å; A221-F238 HydrophobicContact CB-CB 3.91Å |
| 222 | R | 98.1 | Very high | 93.4 | Very high | 190 Ų | 190 | 88.3 Ų | 88.3 | 72% | 0.717 | 45% | 0.452 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -103.9 | 140.4 | 179.7 | -66.6 | -173.7 | 170.1 | 87.6 | -0.3 | 110.1 | R224 F236 T237 | R222-R224 PolarHBondContact O-N 3.14Å; R222-F236 CarbonylContact O-C 3.55Å; R222-F236 WeakPolarHBondContact O-CA 3.41Å; R222-T237 PolarHBondContact N-O 2.92Å; R222-T237 PolarHBondContact O-N 3.06Å; R222-T237 PolarHBondContact O-OG1 2.95Å |
| 223 | W | 97.7 | Very high | 93.8 | Very high | 153 Ų | 153 | 88.1 Ų | 88.1 | 58% | 0.58 | 44% | 0.438 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -64.7 | 130.1 | 175.1 | 179.3 | 78.7 | 0 | 0 | 0 | 110.1 | G225 D234 F236 | W223-G225 VanDerWaalsContact CZ2-CA 3.49Å; W223-D234 PolarHBondContact NE1-OD1 3.09Å; W223-F236 HydrophobicContact CB-CD1 4.12Å; W223-F236 HydrophobicContact CB-CE1 3.69Å; W223-F236 HydrophobicContact CB-CZ 3.94Å; W223-F236 AromaticContact CD1-CE2 3.85Å; W223-F236 AromaticContact CD1-CZ 3.82Å; W223-F236 HydrophobicContact CG-CE1 4.49Å; W223-F236 HydrophobicContact CG-CZ 4.28Å |
| 224 | R | 96.8 | Very high | 94 | Very high | 157 Ų | 157 | 84.4 Ų | 84.4 | 59% | 0.592 | 43% | 0.425 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -97.8 | -42.5 | 176.3 | 178.7 | -169.3 | -77.1 | -169.7 | -4.3 | 111 | T192 R222 V235 T237 | T192-R224 VanDerWaalsContact CG2-CZ 3.45Å; T192-R224 VanDerWaalsContact CG2-NH2 3.25Å; R222-R224 PolarHBondContact O-N 3.14Å; R224-V235 HydrophobicContact CB-CB 4.48Å; R224-V235 HydrophobicContact CB-CG1 4.41Å; R224-V235 WeakPolarHBondContact CB-O 3.46Å; R224-V235 PolarHBondContact N-O 3.48Å; R224-T237 HydrophobicContact CB-CG2 4.21Å; R224-T237 VanDerWaalsContact CZ-CG2 3.46Å |
| 225 | G | 95.8 | Very high | 94.2 | Very high | 10 Ų | 10 | 74.9 Ų | 74.9 | 10% | 0.103 | 39% | 0.391 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 159 | 174.5 | -171.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | W223 V235 | W223-G225 VanDerWaalsContact CZ2-CA 3.49Å; G225-V235 PolarHBondContact N-O 3.19Å; G225-V235 PolarHBondContact O-N 2.8Å |
| 226 | P | 96.1 | Very high | 94.5 | Very high | 76 Ų | 76 | 73 Ų | 73 | 49% | 0.494 | 38% | 0.376 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.5 | 146.3 | 171.6 | 30.3 | -34.4 | 0 | 0 | 0 | 110.9 | G228 E233 | P226-G228 VanDerWaalsContact C-N 3.29Å; P226-G228 PolarHBondContact O-N 3.16Å; P226-E233 WeakPolarHBondContact CA-O 3.31Å |
| 227 | A | 91.4 | Very high | 94.6 | Very high | 35 Ų | 35 | 72.4 Ų | 72.4 | 29% | 0.289 | 37% | 0.373 | S | S | . | . | S | Bend | trans | -73.6 | -20.7 | 179 | 0 | 0 | 0 | 0 | 0 | 113.3 | R194 E233 V235 | R194-A227 HydrophobicContact CG-CB 4.42Å; A227-E233 HydrophobicContact CB-CB 3.84Å; A227-E233 PolarHBondContact N-O 2.95Å; A227-V235 HydrophobicContact CB-CG2 3.64Å |
| 228 | G | 87.6 | Confident | 94.7 | Very high | 32 Ų | 32 | 69.1 Ų | 69.1 | 33% | 0.33 | 36% | 0.357 | S | S | . | . | S | Bend | trans | -161.2 | 175.4 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | P226 E230 G231 | P226-G228 VanDerWaalsContact C-N 3.29Å; P226-G228 PolarHBondContact O-N 3.16Å; G228-E230 PolarHBondContact O-N 3.47Å; G228-G231 PolarHBondContact O-N 2.89Å |
| 229 | P | 82.1 | Confident | 94.6 | Very high | 146 Ų | 146 | 66.9 Ų | 66.9 | 95% | 0.948 | 36% | 0.359 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.9 | -23.9 | -173.1 | 26.8 | -34.8 | 0 | 0 | 0 | 113.6 | G231 | P229-G231 VanDerWaalsContact C-N 3.3Å; P229-G231 PolarHBondContact O-N 2.9Å |
| 230 | E | 84.8 | Confident | 94.6 | Very high | 140 Ų | 140 | 66.6 Ų | 66.6 | 65% | 0.654 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.5 | -13.5 | 179.8 | -59.9 | -165.3 | 155.9 | 0 | 0 | 113.8 | G228 K232 | G228-E230 PolarHBondContact O-N 3.47Å; E230-K232 HydrophobicContact CB-CD 4.37Å; E230-K232 HydrophobicContact CB-CG 4.2Å; E230-K232 PolarHBondContact O-N 3.09Å; E230-K232 WeakPolarHBondContact OE2-CD 3.23Å; E230-K232 WeakPolarHBondContact OE2-CE 3.45Å; E230-K232 IonicContact OE2-NZ 2.7Å; E230-K232 PolarHBondContact OE2-NZ 3Å |
| 231 | G | 87.1 | Confident | 94.3 | Very high | 25 Ų | 25 | 65.6 Ų | 65.6 | 26% | 0.258 | 35% | 0.351 | S | S | . | . | trans | 63.7 | 13.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 115.7 | N197 G228 P229 E233 | N197-G231 PolarHBondContact ND2-O 3.21Å; G228-G231 PolarHBondContact O-N 2.89Å; P229-G231 VanDerWaalsContact C-N 3.3Å; P229-G231 PolarHBondContact O-N 2.9Å; G231-E233 PolarHBondContact O-N 3.22Å | ||
| 232 | K | 93.4 | Very high | 93.9 | Very high | 137 Ų | 137 | 65.6 Ų | 65.6 | 60% | 0.596 | 35% | 0.351 | S | S | * | . | S | Bend | trans | -68.8 | -22.3 | 177 | -69.1 | 177.5 | 179.2 | 160.6 | 0 | 113.3 | N197 E230 | N197-K232 VanDerWaalsContact CB-O 3.29Å; N197-K232 WeakPolarHBondContact CB-O 3.22Å; N197-K232 PolarHBondContact N-O 3.46Å; E230-K232 HydrophobicContact CB-CD 4.37Å; E230-K232 HydrophobicContact CB-CG 4.2Å; E230-K232 PolarHBondContact O-N 3.09Å; E230-K232 WeakPolarHBondContact OE2-CD 3.23Å; E230-K232 WeakPolarHBondContact OE2-CE 3.45Å; E230-K232 IonicContact OE2-NZ 2.7Å; E230-K232 PolarHBondContact OE2-NZ 3Å |
| 233 | E | 96.4 | Very high | 93.2 | Very high | 42 Ų | 42 | 58.4 Ų | 58.4 | 20% | 0.196 | 33% | 0.329 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.5 | 141.1 | -174 | -65.2 | 169.9 | 178.9 | 0 | 0 | 109.4 | L172 R194 V195 P226 A227 G231 | L172-E233 HydrophobicContact CD2-CG 4.17Å; L172-E233 WeakPolarHBondContact CD2-OE1 3.44Å; R194-E233 VanDerWaalsContact CD-OE2 3.31Å; R194-E233 WeakPolarHBondContact CD-OE2 3.42Å; R194-E233 HydrophobicContact CG-CB 4.26Å; R194-E233 IonicContact NH1-OE2 3.16Å; R194-E233 PolarHBondContact NH1-OE2 3.18Å; V195-E233 CarbonylContact O-C 3.55Å; V195-E233 VanDerWaalsContact O-CA 3.28Å; V195-E233 WeakPolarHBondContact O-CA 3.17Å; P226-E233 WeakPolarHBondContact CA-O 3.31Å; A227-E233 HydrophobicContact CB-CB 3.84Å; A227-E233 PolarHBondContact N-O 2.95Å; G231-E233 PolarHBondContact O-N 3.22Å |
| 234 | D | 97 | Very high | 92.3 | Very high | 11 Ų | 11 | 56.1 Ų | 56.1 | 6% | 0.059 | 33% | 0.333 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112 | 147.2 | 175.4 | -77 | -47.8 | 0 | 0 | 0 | 110.6 | R194 V195 K202 W223 F236 | R194-D234 WeakPolarHBondContact CA-O 3.21Å; V195-D234 HydrophobicContact CG2-CB 3.86Å; V195-D234 PolarHBondContact N-O 3.21Å; V195-D234 PolarHBondContact O-N 2.75Å; K202-D234 WeakPolarHBondContact CE-OD2 3.36Å; K202-D234 IonicContact NZ-OD2 2.68Å; K202-D234 PolarHBondContact NZ-OD2 2.95Å; W223-D234 PolarHBondContact NE1-OD1 3.09Å; D234-F236 HydrophobicContact CB-CD2 4.29Å; D234-F236 HydrophobicContact CB-CE2 3.77Å |
| 235 | V | 97.9 | Very high | 91.3 | Very high | 12 Ų | 12 | 55.9 Ų | 55.9 | 7% | 0.073 | 34% | 0.337 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.9 | 129.5 | 173.6 | -175.9 | 0 | 0 | 0 | 0 | 109.4 | T192 V193 R224 G225 A227 | T192-V235 HydrophobicContact CG2-CG1 4.2Å; V193-V235 CarbonylContact O-C 3.57Å; V193-V235 WeakPolarHBondContact O-CA 3.08Å; R224-V235 HydrophobicContact CB-CB 4.48Å; R224-V235 HydrophobicContact CB-CG1 4.41Å; R224-V235 WeakPolarHBondContact CB-O 3.46Å; R224-V235 PolarHBondContact N-O 3.48Å; G225-V235 PolarHBondContact N-O 3.19Å; G225-V235 PolarHBondContact O-N 2.8Å; A227-V235 HydrophobicContact CB-CG2 3.64Å |
| 236 | F | 98.4 | Very high | 90.2 | Very high | 11 Ų | 11 | 58.3 Ų | 58.3 | 5% | 0.048 | 35% | 0.347 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.4 | 145.4 | 173.9 | -75.1 | -104.9 | 0 | 0 | 0 | 110.1 | T192 V193 V195 K202 V204 A221 R222 W223 D234 | T192-F236 CarbonylContact C-O 3.56Å; T192-F236 VanDerWaalsContact CA-O 3.26Å; T192-F236 WeakPolarHBondContact CA-O 3.49Å; V193-F236 HydrophobicContact CB-CB 4.44Å; V193-F236 PolarHBondContact N-O 3.1Å; V193-F236 PolarHBondContact O-N 3.49Å; V195-F236 HydrophobicContact CG2-CD2 3.75Å; V195-F236 HydrophobicContact CG2-CE2 3.53Å; K202-F236 HydrophobicContact CB-CZ 3.83Å; K202-F236 HydrophobicContact CD-CE2 4.06Å; K202-F236 HydrophobicContact CD-CZ 4.08Å; V204-F236 HydrophobicContact CB-CB 4.32Å; V204-F236 HydrophobicContact CB-CD1 3.89Å; V204-F236 HydrophobicContact CB-CE1 4.38Å; V204-F236 HydrophobicContact CB-CG 4.02Å; V204-F236 HydrophobicContact CG1-CB 4.28Å; V204-F236 HydrophobicContact CG1-CG 4.46Å; V204-F236 HydrophobicContact CG2-CB 4.45Å; V204-F236 HydrophobicContact CG2-CD1 3.86Å; V204-F236 HydrophobicContact CG2-CD2 3.87Å; V204-F236 HydrophobicContact CG2-CE1 4.02Å; V204-F236 HydrophobicContact CG2-CE2 4.04Å; V204-F236 HydrophobicContact CG2-CG 3.79Å; V204-F236 HydrophobicContact CG2-CZ 4.13Å; A221-F236 HydrophobicContact CB-CB 3.95Å; A221-F236 HydrophobicContact CB-CD1 4.43Å; R222-F236 CarbonylContact O-C 3.55Å; R222-F236 WeakPolarHBondContact O-CA 3.41Å; W223-F236 HydrophobicContact CB-CD1 4.12Å; W223-F236 HydrophobicContact CB-CE1 3.69Å; W223-F236 HydrophobicContact CB-CZ 3.94Å; W223-F236 AromaticContact CD1-CE2 3.85Å; W223-F236 AromaticContact CD1-CZ 3.82Å; W223-F236 HydrophobicContact CG-CE1 4.49Å; W223-F236 HydrophobicContact CG-CZ 4.28Å; D234-F236 HydrophobicContact CB-CD2 4.29Å; D234-F236 HydrophobicContact CB-CE2 3.77Å |
| 237 | T | 98.2 | Very high | 89.1 | Confident | 41 Ų | 41 | 56.4 Ų | 56.4 | 25% | 0.252 | 33% | 0.332 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.9 | 136.7 | 174.5 | 47.4 | 0 | 0 | 0 | 0 | 111 | G191 T192 A221 R222 R224 | G191-T237 WeakPolarHBondContact O-CA 3.14Å; T192-T237 HydrophobicContact CG2-CG2 3.94Å; A221-T237 CarbonylContact C-O 3.51Å; A221-T237 WeakPolarHBondContact CA-O 3.3Å; A221-T237 WeakPolarHBondContact CB-O 3.29Å; R222-T237 PolarHBondContact N-O 2.92Å; R222-T237 PolarHBondContact O-N 3.06Å; R222-T237 PolarHBondContact O-OG1 2.95Å; R224-T237 HydrophobicContact CB-CG2 4.21Å; R224-T237 VanDerWaalsContact CZ-CG2 3.46Å |
| 238 | F | 97.8 | Very high | 88.7 | Confident | 10 Ų | 10 | 61.4 Ų | 61.4 | 4% | 0.044 | 35% | 0.35 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.6 | 160.6 | 171.6 | 69.2 | -88 | 0 | 0 | 0 | 110.6 | L179 I189 S190 G191 V193 V206 A221 F240 F255 | L179-F238 HydrophobicContact CD1-CE1 3.6Å; L179-F238 HydrophobicContact CD1-CZ 3.82Å; I189-F238 HydrophobicContact CG2-CE2 4.33Å; S190-F238 VanDerWaalsContact CA-O 3.3Å; S190-F238 WeakPolarHBondContact CA-O 3.41Å; G191-F238 PolarHBondContact N-O 2.97Å; G191-F238 WeakPolarHBondContact O-CD1 3.41Å; G191-F238 PolarHBondContact O-N 3.43Å; V193-F238 HydrophobicContact CG2-CD1 3.74Å; V193-F238 HydrophobicContact CG2-CE1 3.75Å; V206-F238 HydrophobicContact CB-CD2 4.21Å; V206-F238 HydrophobicContact CB-CG 4.36Å; V206-F238 HydrophobicContact CG1-CD2 4.47Å; V206-F238 HydrophobicContact CG1-CE2 4.38Å; V206-F238 HydrophobicContact CG2-CB 3.93Å; V206-F238 HydrophobicContact CG2-CD1 3.61Å; V206-F238 HydrophobicContact CG2-CD2 3.68Å; V206-F238 HydrophobicContact CG2-CE1 3.96Å; V206-F238 HydrophobicContact CG2-CE2 4.03Å; V206-F238 HydrophobicContact CG2-CG 3.44Å; V206-F238 VanDerWaalsContact CG2-CG 3.44Å; V206-F238 HydrophobicContact CG2-CZ 4.15Å; A221-F238 HydrophobicContact CB-CB 3.91Å; F238-F240 HydrophobicContact CD2-CD1 4.03Å; F238-F240 AromaticContact CD2-CE1 4Å; F238-F240 HydrophobicContact CD2-CE1 4Å; F238-F240 HydrophobicContact CE2-CD1 4.3Å; F238-F240 AromaticContact CE2-CE1 3.81Å; F238-F240 HydrophobicContact CE2-CE1 3.81Å; F238-F255 HydrophobicContact CZ-CE2 4.27Å |
| 239 | G | 96.9 | Very high | 88.6 | Confident | 46 Ų | 46 | 64.6 Ų | 64.6 | 47% | 0.474 | 36% | 0.359 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -158.1 | 142.7 | 168.6 | 0 | 0 | 0 | 0 | 0 | 110 | I189 | I189-G239 CarbonylContact O-C 3.52Å; I189-G239 WeakPolarHBondContact O-CA 3.44Å |
| 240 | F | 95.8 | Very high | 88.7 | Confident | 7 Ų | 7 | 59.7 Ų | 59.7 | 3% | 0.031 | 34% | 0.335 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.8 | 141.3 | 172 | 55.5 | -90.7 | 0 | 0 | 0 | 110.7 | I189 V206 Y208 A219 F238 V242 V253 | I189-F240 HydrophobicContact CB-CD2 4.44Å; I189-F240 HydrophobicContact CB-CE1 4.2Å; I189-F240 HydrophobicContact CB-CE2 3.96Å; I189-F240 HydrophobicContact CB-CZ 3.82Å; I189-F240 HydrophobicContact CD1-CD2 4.46Å; I189-F240 HydrophobicContact CD1-CE2 3.47Å; I189-F240 VanDerWaalsContact CD1-CE2 3.47Å; I189-F240 HydrophobicContact CD1-CZ 3.65Å; I189-F240 HydrophobicContact CG1-CE2 4.27Å; I189-F240 HydrophobicContact CG1-CZ 4.37Å; I189-F240 HydrophobicContact CG2-CE1 4.14Å; I189-F240 HydrophobicContact CG2-CZ 3.95Å; I189-F240 PolarHBondContact N-O 3.43Å; I189-F240 PolarHBondContact O-N 3.5Å; V206-F240 HydrophobicContact CG1-CE1 3.97Å; Y208-F240 AromaticContact CD1-CD1 4Å; Y208-F240 HydrophobicContact CD1-CD1 4Å; Y208-F240 HydrophobicContact CD1-CD2 4.1Å; Y208-F240 HydrophobicContact CD1-CE1 4.14Å; Y208-F240 HydrophobicContact CD1-CE2 4.21Å; Y208-F240 AromaticContact CD1-CG 3.98Å; Y208-F240 HydrophobicContact CD1-CG 3.98Å; Y208-F240 HydrophobicContact CD1-CZ 4.25Å; Y208-F240 AromaticContact CD2-CD2 3.67Å; Y208-F240 HydrophobicContact CD2-CD2 3.67Å; Y208-F240 AromaticContact CD2-CE2 3.59Å; Y208-F240 HydrophobicContact CD2-CE2 3.59Å; Y208-F240 HydrophobicContact CD2-CG 4.36Å; Y208-F240 HydrophobicContact CD2-CZ 4.25Å; Y208-F240 HydrophobicContact CE1-CB 3.87Å; Y208-F240 HydrophobicContact CE1-CD1 4.13Å; Y208-F240 HydrophobicContact CE1-CD2 4.05Å; Y208-F240 AromaticContact CE1-CG 3.77Å; Y208-F240 HydrophobicContact CE1-CG 3.77Å; Y208-F240 HydrophobicContact CE2-CB 4.44Å; Y208-F240 AromaticContact CE2-CD2 3.59Å; Y208-F240 HydrophobicContact CE2-CD2 3.59Å; Y208-F240 HydrophobicContact CE2-CE2 4.02Å; Y208-F240 HydrophobicContact CE2-CG 4.15Å; Y208-F240 HydrophobicContact CG-CD1 4.42Å; Y208-F240 AromaticContact CG-CD2 3.93Å; Y208-F240 HydrophobicContact CG-CD2 3.93Å; Y208-F240 HydrophobicContact CG-CE1 4.24Å; Y208-F240 AromaticContact CG-CE2 3.7Å; Y208-F240 HydrophobicContact CG-CE2 3.7Å; Y208-F240 HydrophobicContact CG-CG 4.28Å; Y208-F240 AromaticContact CG-CZ 3.88Å; Y208-F240 HydrophobicContact CG-CZ 3.88Å; Y208-F240 AromaticContact CZ-CD2 3.79Å; Y208-F240 AromaticContact CZ-CG 3.86Å; A219-F240 HydrophobicContact CB-CB 3.93Å; A219-F240 HydrophobicContact CB-CD1 4.13Å; A219-F240 HydrophobicContact CB-CG 4.44Å; F238-F240 HydrophobicContact CD2-CD1 4.03Å; F238-F240 AromaticContact CD2-CE1 4Å; F238-F240 HydrophobicContact CD2-CE1 4Å; F238-F240 HydrophobicContact CE2-CD1 4.3Å; F238-F240 AromaticContact CE2-CE1 3.81Å; F238-F240 HydrophobicContact CE2-CE1 3.81Å; F240-V242 HydrophobicContact CD2-CG2 4.46Å; F240-V242 HydrophobicContact CE2-CG2 4.39Å; F240-V253 HydrophobicContact CE2-CG1 4.3Å |
| 241 | P | 92.8 | Very high | 88.9 | Confident | 90 Ų | 90 | 54.6 Ų | 54.6 | 58% | 0.584 | 32% | 0.315 | S | S | * | . | trans | -69.5 | 145.4 | -179.8 | 30.1 | -34.6 | 0 | 0 | 0 | 110.2 | ||||
| 242 | V | 88.8 | Confident | 89.1 | Confident | 7 Ų | 7 | 60.5 Ų | 60.5 | 4% | 0.042 | 33% | 0.33 | C | S | . | . | trans | -114.4 | 111.6 | 168.4 | -174.1 | 0 | 0 | 0 | 0 | 107.7 | L155 I189 F210 F240 L247 | L155-V242 HydrophobicContact CD1-CB 4.43Å; L155-V242 HydrophobicContact CD1-CG1 4.27Å; L155-V242 HydrophobicContact CD1-CG2 4.05Å; I189-V242 HydrophobicContact CB-CG2 4.5Å; I189-V242 HydrophobicContact CD1-CG2 3.54Å; I189-V242 HydrophobicContact CG1-CG2 3.73Å; F210-V242 HydrophobicContact CE1-CB 4.42Å; F210-V242 HydrophobicContact CE1-CG1 3.78Å; F210-V242 HydrophobicContact CE1-CG2 4.13Å; F210-V242 HydrophobicContact CZ-CG1 4.43Å; F210-V242 HydrophobicContact CZ-CG2 4.46Å; F240-V242 HydrophobicContact CD2-CG2 4.46Å; F240-V242 HydrophobicContact CE2-CG2 4.39Å; V242-L247 HydrophobicContact CB-CD2 4.43Å; V242-L247 HydrophobicContact CG1-CD1 4.23Å; V242-L247 HydrophobicContact CG1-CD2 3.44Å; V242-L247 VanDerWaalsContact CG1-CD2 3.44Å; V242-L247 HydrophobicContact CG1-CG 3.79Å | ||
| 243 | P | 84.3 | Confident | 89.1 | Confident | 39 Ų | 39 | 54.1 Ų | 54.1 | 25% | 0.253 | 30% | 0.302 | S | S | . | . | trans | -59.1 | 133.4 | 179.4 | -22.8 | 31.2 | 0 | 0 | 0 | 111.4 | F245 L246 | P243-F245 HydrophobicContact CB-CD1 3.7Å; P243-F245 HydrophobicContact CB-CE1 3.27Å; P243-F245 HydrophobicContact CB-CE2 4.26Å; P243-F245 HydrophobicContact CB-CG 4.35Å; P243-F245 HydrophobicContact CB-CZ 3.58Å; P243-F245 HydrophobicContact CG-CE1 4.19Å; P243-F245 HydrophobicContact CG-CZ 4.12Å; P243-F245 PolarHBondContact O-N 3.27Å; P243-F245 VanDerWaalsContact O-N 3.16Å; P243-L246 HydrophobicContact CB-CD1 4.22Å; P243-L246 HydrophobicContact CB-CG 4.23Å; P243-L246 HydrophobicContact CG-CD1 3.9Å; P243-L246 HydrophobicContact CG-CG 4.45Å; P243-L246 WeakPolarHBondContact O-CB 3.03Å; P243-L246 PolarHBondContact O-N 2.81Å | ||
| 244 | P | 79.4 | Confident | 89 | Confident | 105 Ų | 105 | 54 Ų | 54 | 68% | 0.682 | 30% | 0.301 | S | S | * | . | G | 310 helix | trans | -58.2 | -32.8 | -177.2 | -27.7 | 34.7 | 0 | 0 | 0 | 114 | L246 L247 | P244-L246 PolarHBondContact O-N 3.43Å; P244-L247 WeakPolarHBondContact O-CB 3.17Å; P244-L247 PolarHBondContact O-N 3.32Å |
| 245 | F | 76.3 | Confident | 89 | Confident | 152 Ų | 152 | 53.4 Ų | 53.4 | 67% | 0.667 | 30% | 0.298 | S | S | * | . | G | 310 helix | trans | -69 | -11.9 | 177 | 66.2 | -97.5 | 0 | 0 | 0 | 113.7 | P243 | P243-F245 HydrophobicContact CB-CD1 3.7Å; P243-F245 HydrophobicContact CB-CE1 3.27Å; P243-F245 HydrophobicContact CB-CE2 4.26Å; P243-F245 HydrophobicContact CB-CG 4.35Å; P243-F245 HydrophobicContact CB-CZ 3.58Å; P243-F245 HydrophobicContact CG-CE1 4.19Å; P243-F245 HydrophobicContact CG-CZ 4.12Å; P243-F245 PolarHBondContact O-N 3.27Å; P243-F245 VanDerWaalsContact O-N 3.16Å |
| 246 | L | 71.5 | Confident | 89 | Confident | 60 Ų | 60 | 53 Ų | 53 | 31% | 0.314 | 30% | 0.296 | S | S | . | . | G | 310 helix | trans | -97.3 | 5.5 | 173.5 | -61.7 | -179.7 | 0 | 0 | 0 | 112.5 | F210 P243 P244 S251 | F210-L246 HydrophobicContact CB-CD1 4.23Å; F210-L246 HydrophobicContact CD1-CD1 4.4Å; F210-L246 HydrophobicContact CD2-CD1 3.85Å; F210-L246 HydrophobicContact CE2-CD1 4.31Å; F210-L246 HydrophobicContact CG-CD1 3.9Å; P243-L246 HydrophobicContact CB-CD1 4.22Å; P243-L246 HydrophobicContact CB-CG 4.23Å; P243-L246 HydrophobicContact CG-CD1 3.9Å; P243-L246 HydrophobicContact CG-CG 4.45Å; P243-L246 WeakPolarHBondContact O-CB 3.03Å; P243-L246 PolarHBondContact O-N 2.81Å; P244-L246 PolarHBondContact O-N 3.43Å; L246-S251 WeakPolarHBondContact O-CB 3.47Å |
| 247 | L | 73.4 | Confident | 88.9 | Confident | 36 Ų | 36 | 52.5 Ų | 52.5 | 19% | 0.188 | 29% | 0.294 | C | S | . | . | trans | -105 | 37.3 | -179.3 | -65.1 | 177.8 | 0 | 0 | 0 | 112.3 | Q153 L155 V242 P244 C279 | Q153-L247 PolarHBondContact OE1-O 3.14Å; L155-L247 HydrophobicContact CD1-CD2 3.67Å; L155-L247 HydrophobicContact CD2-CD2 3.68Å; L155-L247 HydrophobicContact CG-CD2 3.56Å; V242-L247 HydrophobicContact CB-CD2 4.43Å; V242-L247 HydrophobicContact CG1-CD1 4.23Å; V242-L247 HydrophobicContact CG1-CD2 3.44Å; V242-L247 VanDerWaalsContact CG1-CD2 3.44Å; V242-L247 HydrophobicContact CG1-CG 3.79Å; P244-L247 WeakPolarHBondContact O-CB 3.17Å; P244-L247 PolarHBondContact O-N 3.32Å; L247-C279 PolarHBondContact O-SG 3.42Å | ||
| 248 | E | 82.4 | Confident | 88.9 | Confident | 141 Ų | 141 | 51.9 Ų | 51.9 | 66% | 0.659 | 29% | 0.287 | S | S | * | . | trans | -61.3 | 148.3 | 170.4 | -64.7 | -179.3 | 176.3 | 0 | 0 | 110.2 | G250 S251 C279 | E248-G250 PolarHBondContact O-N 2.89Å; E248-S251 PolarHBondContact N-OG 3.25Å; E248-S251 WeakPolarHBondContact O-CB 3.38Å; E248-S251 PolarHBondContact O-N 3.44Å; E248-S251 PolarHBondContact O-OG 3.38Å; E248-C279 WeakPolarHBondContact O-CB 3.02Å | ||
| 249 | L | 85.3 | Confident | 88.9 | Confident | 98 Ų | 98 | 51.4 Ų | 51.4 | 51% | 0.513 | 29% | 0.285 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55 | 127.9 | -179 | -168.9 | 66.8 | 0 | 0 | 0 | 110.8 | S251 N281 | L249-S251 VanDerWaalsContact C-N 3.31Å; L249-N281 HydrophobicContact CD1-CB 4.27Å; L249-N281 VanDerWaalsContact CD1-OD1 3.29Å; L249-N281 WeakPolarHBondContact CD1-OD1 3.41Å |
| 250 | G | 84.5 | Confident | 89 | Confident | 44 Ų | 44 | 54 Ų | 54 | 45% | 0.454 | 28% | 0.28 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 84.1 | -5.1 | -176.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | E248 C279 | E248-G250 PolarHBondContact O-N 2.89Å; G250-C279 PolarHBondContact N-O 3.2Å |
| 251 | S | 88.8 | Confident | 89.1 | Confident | 33 Ų | 33 | 53.9 Ų | 53.9 | 23% | 0.231 | 28% | 0.28 | C | S | . | . | trans | -59 | 145.3 | 170.9 | -62.9 | 0 | 0 | 0 | 0 | 111 | L246 E248 L249 T278 C279 | L246-S251 WeakPolarHBondContact O-CB 3.47Å; E248-S251 PolarHBondContact N-OG 3.25Å; E248-S251 WeakPolarHBondContact O-CB 3.38Å; E248-S251 PolarHBondContact O-N 3.44Å; E248-S251 PolarHBondContact O-OG 3.38Å; L249-S251 VanDerWaalsContact C-N 3.31Å; S251-T278 WeakPolarHBondContact O-CA 3.43Å; S251-C279 PolarHBondContact O-N 3.11Å | ||
| 252 | R | 91.4 | Very high | 89.2 | Confident | 149 Ų | 149 | 53.5 Ų | 53.5 | 56% | 0.562 | 29% | 0.285 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -122.8 | 135.2 | -177.2 | -59.9 | -172.1 | -178 | -169.1 | -2 | 111.6 | L277 | R252-L277 CarbonylContact C-O 3.46Å; R252-L277 VanDerWaalsContact CA-O 3.3Å; R252-L277 WeakPolarHBondContact CA-O 3.23Å |
| 253 | V | 93.6 | Very high | 89.5 | Confident | 2 Ų | 2 | 57.6 Ų | 57.6 | 1% | 0.012 | 33% | 0.328 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107 | 126.8 | 168.7 | -170.8 | 0 | 0 | 0 | 0 | 107.7 | L155 I189 F210 F240 S276 L277 | L155-V253 HydrophobicContact CD1-CG2 4.11Å; L155-V253 HydrophobicContact CD2-CG2 4.1Å; I189-V253 HydrophobicContact CD1-CB 4.2Å; I189-V253 HydrophobicContact CD1-CG1 3.86Å; I189-V253 HydrophobicContact CD1-CG2 4.28Å; F210-V253 HydrophobicContact CD1-CB 4.49Å; F210-V253 HydrophobicContact CD1-CG1 4.1Å; F210-V253 HydrophobicContact CD1-CG2 3.83Å; F210-V253 HydrophobicContact CE1-CG1 3.91Å; F210-V253 HydrophobicContact CE1-CG2 3.91Å; F240-V253 HydrophobicContact CE2-CG1 4.3Å; V253-S276 WeakPolarHBondContact O-CA 3.38Å; V253-L277 HydrophobicContact CB-CB 4.31Å; V253-L277 PolarHBondContact N-O 3.45Å; V253-L277 PolarHBondContact O-N 3.47Å |
| 254 | H | 95.1 | Very high | 90.1 | Very high | 39 Ų | 39 | 57.4 Ų | 57.4 | 18% | 0.181 | 33% | 0.33 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.1 | 141.3 | 173.1 | -61.9 | -85.4 | 0 | 0 | 0 | 109.7 | Y208 T209 W213 Y275 | Y208-H254 CarbonylContact C-O 3.53Å; Y208-H254 WeakPolarHBondContact CA-O 3.44Å; T209-H254 HydrophobicContact CG2-CB 3.75Å; T209-H254 PolarHBondContact N-O 2.89Å; T209-H254 PolarHBondContact O-N 3.31Å; T209-H254 VanDerWaalsContact O-N 3.08Å; W213-H254 HydrophobicContact CZ2-CB 4.2Å; H254-Y275 CarbonylContact C-O 3.43Å; H254-Y275 VanDerWaalsContact CA-O 3.3Å; H254-Y275 WeakPolarHBondContact CA-O 3.23Å |
| 255 | F | 96.7 | Very high | 90.9 | Very high | 0 Ų | 0 | 56.3 Ų | 56.3 | 0% | 0 | 32% | 0.316 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -149.1 | 158.2 | 173.5 | 69.8 | -84.4 | 0 | 0 | 0 | 112.8 | F159 L179 V182 V206 R207 F238 Y275 L277 | F159-F255 HydrophobicContact CZ-CZ 4.25Å; L179-F255 HydrophobicContact CD1-CE2 4.15Å; L179-F255 HydrophobicContact CD2-CE2 3.76Å; L179-F255 HydrophobicContact CD2-CZ 3.76Å; V182-F255 HydrophobicContact CG2-CZ 4.21Å; V206-F255 HydrophobicContact CG1-CB 3.85Å; V206-F255 HydrophobicContact CG1-CD2 3.66Å; V206-F255 HydrophobicContact CG1-CG 4.1Å; R207-F255 CarbonylContact O-C 3.6Å; R207-F255 WeakPolarHBondContact O-CA 3.24Å; R207-F255 WeakPolarHBondContact O-CB 3.48Å; F238-F255 HydrophobicContact CZ-CE2 4.27Å; F255-Y275 HydrophobicContact CD2-CD2 4.39Å; F255-Y275 HydrophobicContact CD2-CG 4.49Å; F255-Y275 VanDerWaalsContact CE1-CB 3.42Å; F255-Y275 HydrophobicContact CE1-CG 4.49Å; F255-Y275 HydrophobicContact CE2-CD2 4.05Å; F255-Y275 AromaticContact CE2-CG 3.94Å; F255-Y275 HydrophobicContact CE2-CG 3.94Å; F255-Y275 AromaticContact CZ-CG 3.95Å; F255-Y275 HydrophobicContact CZ-CG 3.95Å; F255-Y275 PolarHBondContact N-O 3.14Å; F255-Y275 WeakPolarHBondContact O-CB 3.34Å; F255-Y275 PolarHBondContact O-N 3Å; F255-L277 HydrophobicContact CD1-CD1 4.13Å; F255-L277 HydrophobicContact CE1-CD1 3.62Å; F255-L277 HydrophobicContact CE1-CG 4.18Å |
| 256 | A | 97.1 | Very high | 91.9 | Very high | 4 Ų | 4 | 52.7 Ų | 52.7 | 3% | 0.033 | 30% | 0.298 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -139 | 152.5 | 173.3 | 0 | 0 | 0 | 0 | 0 | 109.3 | R207 W213 W267 N269 | R207-A256 PolarHBondContact N-O 3.32Å; R207-A256 PolarHBondContact O-N 2.95Å; W213-A256 HydrophobicContact CH2-CB 4.45Å; A256-W267 HydrophobicContact CB-CE3 4.12Å; A256-W267 HydrophobicContact CB-CZ3 4.27Å; A256-N269 HydrophobicContact CB-CB 4.13Å |
| 257 | V | 97.8 | Very high | 93.1 | Very high | 0 Ų | 0 | 53.8 Ų | 53.8 | 0% | 0 | 30% | 0.298 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.9 | 131.6 | -178.4 | -169.4 | 0 | 0 | 0 | 0 | 109.6 | V177 L179 V193 V204 V206 W267 D268 | V177-V257 HydrophobicContact CG2-CB 4.23Å; V177-V257 HydrophobicContact CG2-CG1 3.71Å; L179-V257 HydrophobicContact CB-CG2 4.33Å; L179-V257 HydrophobicContact CD1-CG2 4.41Å; V193-V257 HydrophobicContact CB-CG1 4.35Å; V193-V257 HydrophobicContact CG1-CG1 3.68Å; V193-V257 HydrophobicContact CG2-CG1 3.74Å; V193-V257 HydrophobicContact CG2-CG2 4.07Å; V204-V257 HydrophobicContact CG1-CG1 4.07Å; V206-V257 HydrophobicContact CG2-CG1 4.5Å; V206-V257 HydrophobicContact CG2-CG2 4.35Å; V257-W267 CarbonylContact O-C 3.51Å; V257-W267 WeakPolarHBondContact O-CA 3.33Å; V257-D268 HydrophobicContact CB-CB 4.25Å; V257-D268 PolarHBondContact N-O 3.13Å; V257-D268 PolarHBondContact O-N 3.09Å |
| 258 | R | 97.8 | Very high | 94.2 | Very high | 27 Ų | 27 | 52 Ų | 52 | 10% | 0.102 | 29% | 0.289 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.6 | 133 | 174.9 | -173.3 | -177 | 71.3 | -162.2 | -10.6 | 109.9 | V204 A205 E218 R260 E265 Y266 W267 | V204-R258 WeakPolarHBondContact CA-O 3.46Å; A205-R258 PolarHBondContact N-O 3.15Å; A205-R258 PolarHBondContact O-N 3.28Å; E218-R258 IonicContact OE1-CZ 2.69Å; E218-R258 IonicContact OE1-NH1 2.7Å; E218-R258 PolarHBondContact OE1-NH1 2.84Å; E218-R258 IonicContact OE1-NH2 3.67Å; E218-R258 IonicContact OE2-CZ 2.88Å; E218-R258 IonicContact OE2-NH1 3Å; E218-R258 PolarHBondContact OE2-NH1 3.09Å; E218-R258 IonicContact OE2-NH2 3.66Å; E218-R258 PolarHBondContact OE2-NH2 2.83Å; R258-R260 HydrophobicContact CG-CG 4.44Å; R258-E265 WeakPolarHBondContact CD-OE2 3.49Å; R258-E265 HydrophobicContact CG-CG 3.82Å; R258-Y266 WeakPolarHBondContact CA-O 3.36Å; R258-W267 HydrophobicContact CB-CD2 4.2Å; R258-W267 HydrophobicContact CB-CE3 3.97Å; R258-W267 HydrophobicContact CB-CH2 3.72Å; R258-W267 HydrophobicContact CB-CZ2 3.94Å; R258-W267 HydrophobicContact CB-CZ3 3.73Å; R258-W267 HydrophobicContact CG-CD2 4.28Å; R258-W267 HydrophobicContact CG-CH2 3.98Å; R258-W267 HydrophobicContact CG-CZ2 3.68Å; R258-W267 HydrophobicContact CG-CZ3 4.39Å |
| 259 | Y | 98.3 | Very high | 94.8 | Very high | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 27% | 0.272 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125 | 119.4 | 172.5 | 174.3 | -144.5 | 0 | 0 | 0 | 110.2 | L176 V177 V195 C196 K202 V204 V261 E265 Y266 | L176-Y259 HydrophobicContact CB-CD1 4.18Å; L176-Y259 HydrophobicContact CB-CE1 4.13Å; L176-Y259 WeakPolarHBondContact O-CD1 3.15Å; V177-Y259 HydrophobicContact CB-CD1 4.1Å; V177-Y259 HydrophobicContact CB-CG 4.28Å; V195-Y259 HydrophobicContact CB-CD1 4.13Å; V195-Y259 HydrophobicContact CB-CD2 4.49Å; V195-Y259 HydrophobicContact CB-CE1 3.89Å; V195-Y259 HydrophobicContact CB-CE2 4.3Å; V195-Y259 HydrophobicContact CB-CG 4.4Å; V195-Y259 HydrophobicContact CG1-CD1 4.12Å; V195-Y259 HydrophobicContact CG1-CD2 4.17Å; V195-Y259 HydrophobicContact CG1-CE1 4.37Å; V195-Y259 HydrophobicContact CG1-CE2 4.45Å; V195-Y259 HydrophobicContact CG1-CG 3.99Å; V195-Y259 HydrophobicContact CG2-CE2 4.34Å; C196-Y259 PolarHBondContact O-OH 2.99Å; K202-Y259 HydrophobicContact CB-CE2 3.86Å; K202-Y259 HydrophobicContact CD-CE2 4Å; K202-Y259 WeakPolarHBondContact CD-OH 3.43Å; K202-Y259 WeakPolarHBondContact CE-OH 3.4Å; K202-Y259 HydrophobicContact CG-CE2 3.86Å; V204-Y259 HydrophobicContact CG2-CD2 3.77Å; V204-Y259 HydrophobicContact CG2-CE2 4.35Å; Y259-V261 HydrophobicContact CD1-CG1 4.25Å; Y259-V261 HydrophobicContact CD2-CB 4.44Å; Y259-V261 HydrophobicContact CE1-CB 4.22Å; Y259-V261 HydrophobicContact CE1-CG1 3.61Å; Y259-V261 HydrophobicContact CE2-CB 3.64Å; Y259-V261 HydrophobicContact CE2-CG1 3.95Å; Y259-V261 HydrophobicContact CE2-CG2 4.41Å; Y259-V261 VanDerWaalsContact CZ-CG1 3.44Å; Y259-E265 CarbonylContact O-C 3.56Å; Y259-E265 WeakPolarHBondContact O-CA 3.28Å; Y259-Y266 HydrophobicContact CD1-CD2 4.18Å; Y259-Y266 PolarHBondContact N-O 2.93Å; Y259-Y266 PolarHBondContact O-N 3.34Å |
| 260 | R | 98.1 | Very high | 95 | Very high | 101 Ų | 101 | 44 Ų | 44 | 38% | 0.381 | 25% | 0.251 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.5 | 128.4 | 172.2 | -63.8 | 175.4 | 174.6 | 177.1 | -4.5 | 110 | Q203 R258 A264 E265 | Q203-R260 HydrophobicContact CB-CB 4.23Å; Q203-R260 PolarHBondContact N-O 3.2Å; Q203-R260 PolarHBondContact O-N 3.23Å; R258-R260 HydrophobicContact CG-CG 4.44Å; R260-A264 VanDerWaalsContact CA-O 3.27Å; R260-A264 WeakPolarHBondContact CA-O 3.33Å; R260-E265 HydrophobicContact CG-CB 4.15Å; R260-E265 HydrophobicContact CG-CG 3.98Å; R260-E265 IonicContact CZ-OE2 3.15Å; R260-E265 IonicContact NE-OE2 3.29Å; R260-E265 PolarHBondContact NE-OE2 3.28Å; R260-E265 IonicContact NH2-OE2 2.74Å; R260-E265 PolarHBondContact NH2-OE2 2.9Å |
| 261 | V | 97.5 | Very high | 95.1 | Very high | 4 Ų | 4 | 44.8 Ų | 44.8 | 2% | 0.024 | 25% | 0.245 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -153.3 | 139.1 | 179 | 62.4 | 0 | 0 | 0 | 0 | 109.6 | V198 A199 K202 Y259 G263 A264 Y266 | V198-V261 HydrophobicContact CB-CG1 4.38Å; V198-V261 HydrophobicContact CB-CG2 4.15Å; A199-V261 HydrophobicContact CB-CG2 3.63Å; K202-V261 HydrophobicContact CG-CG2 4.36Å; Y259-V261 HydrophobicContact CD1-CG1 4.25Å; Y259-V261 HydrophobicContact CD2-CB 4.44Å; Y259-V261 HydrophobicContact CE1-CB 4.22Å; Y259-V261 HydrophobicContact CE1-CG1 3.61Å; Y259-V261 HydrophobicContact CE2-CB 3.64Å; Y259-V261 HydrophobicContact CE2-CG1 3.95Å; Y259-V261 HydrophobicContact CE2-CG2 4.41Å; Y259-V261 VanDerWaalsContact CZ-CG1 3.44Å; V261-G263 PolarHBondContact O-N 3.43Å; V261-G263 VanDerWaalsContact O-N 3.07Å; V261-A264 PolarHBondContact N-O 2.86Å; V261-A264 PolarHBondContact O-N 2.79Å; V261-Y266 HydrophobicContact CG1-CD2 4.17Å; V261-Y266 HydrophobicContact CG1-CE2 3.78Å |
| 262 | A | 95.4 | Very high | 94.9 | Very high | 83 Ų | 83 | 53.7 Ų | 53.7 | 69% | 0.686 | 27% | 0.273 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.2 | 35.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | A199 A264 | A199-A262 HydrophobicContact CB-CB 4.37Å; A262-A264 VanDerWaalsContact C-N 3.28Å; A262-A264 PolarHBondContact O-N 2.85Å |
| 263 | G | 94.6 | Very high | 94.6 | Very high | 92 Ų | 92 | 54.2 Ų | 54.2 | 95% | 0.948 | 28% | 0.275 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 79.5 | -1.8 | -179.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | V261 | V261-G263 PolarHBondContact O-N 3.43Å; V261-G263 VanDerWaalsContact O-N 3.07Å |
| 264 | A | 96.4 | Very high | 94.4 | Very high | 35 Ų | 35 | 55.6 Ų | 55.6 | 29% | 0.289 | 28% | 0.283 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.4 | 156.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | R260 V261 A262 Y266 | R260-A264 VanDerWaalsContact CA-O 3.27Å; R260-A264 WeakPolarHBondContact CA-O 3.33Å; V261-A264 PolarHBondContact N-O 2.86Å; V261-A264 PolarHBondContact O-N 2.79Å; A262-A264 VanDerWaalsContact C-N 3.28Å; A262-A264 PolarHBondContact O-N 2.85Å; A264-Y266 HydrophobicContact CB-CE2 3.63Å |
| 265 | E | 97.4 | Very high | 94.4 | Very high | 82 Ų | 82 | 53.8 Ų | 53.8 | 38% | 0.383 | 27% | 0.274 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.5 | 130.6 | 178.4 | -175.3 | 176.6 | 101.5 | 0 | 0 | 110.2 | R258 Y259 R260 W267 | R258-E265 WeakPolarHBondContact CD-OE2 3.49Å; R258-E265 HydrophobicContact CG-CG 3.82Å; Y259-E265 CarbonylContact O-C 3.56Å; Y259-E265 WeakPolarHBondContact O-CA 3.28Å; R260-E265 HydrophobicContact CG-CB 4.15Å; R260-E265 HydrophobicContact CG-CG 3.98Å; R260-E265 IonicContact CZ-OE2 3.15Å; R260-E265 IonicContact NE-OE2 3.29Å; R260-E265 PolarHBondContact NE-OE2 3.28Å; R260-E265 IonicContact NH2-OE2 2.74Å; R260-E265 PolarHBondContact NH2-OE2 2.9Å; E265-W267 PolarHBondContact OE1-NE1 3.08Å |
| 266 | Y | 97.4 | Very high | 94.3 | Very high | 76 Ų | 76 | 54.8 Ų | 54.8 | 30% | 0.298 | 28% | 0.282 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.2 | 146.8 | -179.5 | -54.5 | -85.5 | 0 | 0 | 0 | 109.5 | Q175 L176 R258 Y259 V261 A264 | Q175-Y266 VanDerWaalsContact O-CB 3.32Å; Q175-Y266 WeakPolarHBondContact O-CB 3.22Å; L176-Y266 HydrophobicContact CB-CG 4.37Å; L176-Y266 HydrophobicContact CD1-CD1 3.97Å; L176-Y266 HydrophobicContact CD1-CD2 4.09Å; L176-Y266 HydrophobicContact CD1-CE1 3.55Å; L176-Y266 HydrophobicContact CD1-CE2 3.69Å; L176-Y266 HydrophobicContact CD1-CG 4.22Å; L176-Y266 HydrophobicContact CG-CD1 4.37Å; L176-Y266 HydrophobicContact CG-CE1 4.33Å; R258-Y266 WeakPolarHBondContact CA-O 3.36Å; Y259-Y266 HydrophobicContact CD1-CD2 4.18Å; Y259-Y266 PolarHBondContact N-O 2.93Å; Y259-Y266 PolarHBondContact O-N 3.34Å; V261-Y266 HydrophobicContact CG1-CD2 4.17Å; V261-Y266 HydrophobicContact CG1-CE2 3.78Å; A264-Y266 HydrophobicContact CB-CE2 3.63Å |
| 267 | W | 96.7 | Very high | 94.2 | Very high | 83 Ų | 83 | 54.6 Ų | 54.6 | 31% | 0.314 | 28% | 0.28 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129 | 136.9 | -176.8 | -72.8 | 88.3 | 0 | 0 | 0 | 111.1 | R207 A256 V257 R258 E265 | R207-W267 HydrophobicContact CB-CH2 4.16Å; R207-W267 HydrophobicContact CB-CZ3 4Å; A256-W267 HydrophobicContact CB-CE3 4.12Å; A256-W267 HydrophobicContact CB-CZ3 4.27Å; V257-W267 CarbonylContact O-C 3.51Å; V257-W267 WeakPolarHBondContact O-CA 3.33Å; R258-W267 HydrophobicContact CB-CD2 4.2Å; R258-W267 HydrophobicContact CB-CE3 3.97Å; R258-W267 HydrophobicContact CB-CH2 3.72Å; R258-W267 HydrophobicContact CB-CZ2 3.94Å; R258-W267 HydrophobicContact CB-CZ3 3.73Å; R258-W267 HydrophobicContact CG-CD2 4.28Å; R258-W267 HydrophobicContact CG-CH2 3.98Å; R258-W267 HydrophobicContact CG-CZ2 3.68Å; R258-W267 HydrophobicContact CG-CZ3 4.39Å; E265-W267 PolarHBondContact OE1-NE1 3.08Å |
| 268 | D | 96.5 | Very high | 94 | Very high | 0 Ų | 0 | 55.3 Ų | 55.3 | 0% | 0 | 28% | 0.284 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.3 | 102.8 | 163.4 | -176.9 | 25 | 0 | 0 | 0 | 108.9 | R171 Q175 V177 C178 L179 V257 N270 Y275 | R171-D268 IonicContact NH2-OD1 3.33Å; R171-D268 PolarHBondContact NH2-OD1 2.76Å; R171-D268 IonicContact NH2-OD2 3.98Å; Q175-D268 PolarHBondContact NE2-OD1 3.42Å; V177-D268 HydrophobicContact CG1-CB 4.17Å; V177-D268 HydrophobicContact CG2-CB 4.46Å; C178-D268 VanDerWaalsContact CA-OD2 3.25Å; C178-D268 WeakPolarHBondContact CA-OD2 3.5Å; L179-D268 PolarHBondContact N-OD2 3.3Å; V257-D268 HydrophobicContact CB-CB 4.25Å; V257-D268 PolarHBondContact N-O 3.13Å; V257-D268 PolarHBondContact O-N 3.09Å; D268-N270 PolarHBondContact OD1-N 3.42Å; D268-Y275 WeakPolarHBondContact OD2-CE2 3.38Å; D268-Y275 PolarHBondContact OD2-OH 3.45Å |
| 269 | N | 93.8 | Very high | 93.6 | Very high | 55 Ų | 55 | 54.1 Ų | 54.1 | 29% | 0.294 | 28% | 0.28 | S | S | . | . | trans | -115 | 27.9 | 177.8 | 68.4 | -5.8 | 0 | 0 | 0 | 111.4 | A256 D271 R272 R273 D274 | A256-N269 HydrophobicContact CB-CB 4.13Å; N269-D271 PolarHBondContact O-N 2.87Å; N269-R272 PolarHBondContact O-N 3.07Å; N269-R272 PolarHBondContact OD1-N 3.02Å; N269-R272 VanDerWaalsContact OD1-N 3.1Å; N269-R273 PolarHBondContact O-N 3.45Å; N269-D274 VanDerWaalsContact O-CA 3.3Å; N269-D274 WeakPolarHBondContact O-CA 3.29Å; N269-D274 PolarHBondContact O-N 2.9Å | ||
| 270 | N | 90.1 | Very high | 93.3 | Very high | 16 Ų | 16 | 59.6 Ų | 59.6 | 9% | 0.086 | 30% | 0.301 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 53.3 | 49.3 | 178.3 | -173.5 | 24.2 | 0 | 0 | 0 | 112.6 | D268 R272 R273 D274 Y275 | D268-N270 PolarHBondContact OD1-N 3.42Å; N270-R272 PolarHBondContact O-N 3.15Å; N270-R273 WeakPolarHBondContact O-CB 3.35Å; N270-R273 PolarHBondContact O-N 3.13Å; N270-R273 VanDerWaalsContact O-N 3.16Å; N270-R273 PolarHBondContact O-NH2 2.87Å; N270-R273 PolarHBondContact OD1-NH2 2.85Å; N270-D274 PolarHBondContact ND2-O 2.91Å; N270-Y275 HydrophobicContact CB-CD1 4.16Å; N270-Y275 HydrophobicContact CB-CD2 4.23Å; N270-Y275 HydrophobicContact CB-CE1 3.96Å; N270-Y275 HydrophobicContact CB-CE2 4Å; N270-Y275 HydrophobicContact CB-CG 4.32Å |
| 271 | D | 86.1 | Confident | 92.7 | Very high | 60 Ų | 60 | 58.4 Ų | 58.4 | 32% | 0.321 | 30% | 0.302 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 51.6 | 50.1 | -176.1 | -59 | -58.1 | 0 | 0 | 0 | 113.3 | R174 N269 R273 | R174-D271 IonicContact NH2-OD1 3.74Å; R174-D271 PolarHBondContact NH2-OD1 3.09Å; N269-D271 PolarHBondContact O-N 2.87Å; D271-R273 VanDerWaalsContact C-N 3.27Å; D271-R273 PolarHBondContact O-N 3.32Å; D271-R273 IonicContact OD2-NH2 3.54Å |
| 272 | R | 85.4 | Confident | 91.9 | Very high | 219 Ų | 219 | 63.2 Ų | 63.2 | 83% | 0.826 | 32% | 0.324 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 70.8 | 7.5 | -179.6 | -46 | -179.4 | 179.6 | -157.5 | -0.9 | 116.2 | N269 N270 | N269-R272 PolarHBondContact O-N 3.07Å; N269-R272 PolarHBondContact OD1-N 3.02Å; N269-R272 VanDerWaalsContact OD1-N 3.1Å; N270-R272 PolarHBondContact O-N 3.15Å |
| 273 | R | 85.2 | Confident | 91.1 | Very high | 160 Ų | 160 | 61.3 Ų | 61.3 | 60% | 0.604 | 31% | 0.308 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.1 | -12.7 | 174.8 | -64.4 | -177.5 | -65 | -103.8 | -7.8 | 113.5 | N269 N270 D271 | N269-R273 PolarHBondContact O-N 3.45Å; N270-R273 WeakPolarHBondContact O-CB 3.35Å; N270-R273 PolarHBondContact O-N 3.13Å; N270-R273 VanDerWaalsContact O-N 3.16Å; N270-R273 PolarHBondContact O-NH2 2.87Å; N270-R273 PolarHBondContact OD1-NH2 2.85Å; D271-R273 VanDerWaalsContact C-N 3.27Å; D271-R273 PolarHBondContact O-N 3.32Å; D271-R273 IonicContact OD2-NH2 3.54Å |
| 274 | D | 90.2 | Very high | 90 | Very high | 31 Ų | 31 | 60.4 Ų | 60.4 | 17% | 0.166 | 28% | 0.281 | C | S | . | . | trans | 56.2 | 166 | -164.8 | -60.3 | -36.1 | 0 | 0 | 0 | 112.7 | W213 N269 N270 | W213-D274 HydrophobicContact CZ2-CB 4.46Å; W213-D274 WeakPolarHBondContact CZ2-OD2 3.26Å; W213-D274 PolarHBondContact NE1-OD2 2.84Å; N269-D274 VanDerWaalsContact O-CA 3.3Å; N269-D274 WeakPolarHBondContact O-CA 3.29Å; N269-D274 PolarHBondContact O-N 2.9Å; N270-D274 PolarHBondContact ND2-O 2.91Å | ||
| 275 | Y | 95.1 | Very high | 88.3 | Confident | 1 Ų | 1 | 65.5 Ų | 65.5 | 0% | 0.004 | 30% | 0.299 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.5 | 122.5 | 167.5 | -68.4 | -75 | 0 | 0 | 0 | 108.7 | F159 P162 R171 L179 H254 F255 D268 N270 | F159-Y275 AromaticContact CD1-CD1 3.94Å; F159-Y275 HydrophobicContact CD1-CD1 3.94Å; F159-Y275 AromaticContact CD2-CD1 3.83Å; F159-Y275 HydrophobicContact CD2-CD1 3.83Å; F159-Y275 HydrophobicContact CD2-CE1 4.07Å; F159-Y275 AromaticContact CE1-CD1 3.66Å; F159-Y275 HydrophobicContact CE1-CD1 3.66Å; F159-Y275 HydrophobicContact CE1-CG 4.23Å; F159-Y275 AromaticContact CE2-CD1 3.55Å; F159-Y275 HydrophobicContact CE2-CD1 3.55Å; F159-Y275 AromaticContact CE2-CE1 3.95Å; F159-Y275 HydrophobicContact CE2-CE1 3.95Å; F159-Y275 HydrophobicContact CG-CD1 4.02Å; F159-Y275 AromaticContact CZ-CD1 3.45Å; F159-Y275 HydrophobicContact CZ-CD1 3.45Å; F159-Y275 VanDerWaalsContact CZ-CD1 3.45Å; F159-Y275 HydrophobicContact CZ-CE1 4.29Å; F159-Y275 HydrophobicContact CZ-CG 4.16Å; P162-Y275 HydrophobicContact CG-CE1 4Å; R171-Y275 PolarHBondContact NH2-OH 3.04Å; L179-Y275 HydrophobicContact CB-CD2 4.48Å; L179-Y275 HydrophobicContact CB-CE1 4.15Å; L179-Y275 HydrophobicContact CB-CE2 3.77Å; L179-Y275 HydrophobicContact CD2-CD1 3.56Å; L179-Y275 HydrophobicContact CD2-CD2 4.03Å; L179-Y275 HydrophobicContact CD2-CE1 3.55Å; L179-Y275 HydrophobicContact CD2-CE2 4.04Å; L179-Y275 HydrophobicContact CD2-CG 3.78Å; L179-Y275 HydrophobicContact CG-CE1 4.46Å; H254-Y275 CarbonylContact C-O 3.43Å; H254-Y275 VanDerWaalsContact CA-O 3.3Å; H254-Y275 WeakPolarHBondContact CA-O 3.23Å; F255-Y275 HydrophobicContact CD2-CD2 4.39Å; F255-Y275 HydrophobicContact CD2-CG 4.49Å; F255-Y275 VanDerWaalsContact CE1-CB 3.42Å; F255-Y275 HydrophobicContact CE1-CG 4.49Å; F255-Y275 HydrophobicContact CE2-CD2 4.05Å; F255-Y275 AromaticContact CE2-CG 3.94Å; F255-Y275 HydrophobicContact CE2-CG 3.94Å; F255-Y275 AromaticContact CZ-CG 3.95Å; F255-Y275 HydrophobicContact CZ-CG 3.95Å; F255-Y275 PolarHBondContact N-O 3.14Å; F255-Y275 WeakPolarHBondContact O-CB 3.34Å; F255-Y275 PolarHBondContact O-N 3Å; D268-Y275 WeakPolarHBondContact OD2-CE2 3.38Å; D268-Y275 PolarHBondContact OD2-OH 3.45Å; N270-Y275 HydrophobicContact CB-CD1 4.16Å; N270-Y275 HydrophobicContact CB-CD2 4.23Å; N270-Y275 HydrophobicContact CB-CE1 3.96Å; N270-Y275 HydrophobicContact CB-CE2 4Å; N270-Y275 HydrophobicContact CB-CG 4.32Å |
| 276 | S | 94.6 | Very high | 86.5 | Confident | 22 Ų | 22 | 67.8 Ų | 67.8 | 15% | 0.154 | 31% | 0.311 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118 | 138.1 | -178.4 | 41.1 | 0 | 0 | 0 | 0 | 111.7 | D158 F159 V253 | D158-S276 PolarHBondContact N-O 2.9Å; F159-S276 WeakPolarHBondContact CD1-O 3.4Å; F159-S276 VanDerWaalsContact CE1-O 3.25Å; F159-S276 WeakPolarHBondContact CE1-O 3.39Å; V253-S276 WeakPolarHBondContact O-CA 3.38Å |
| 277 | L | 93.9 | Very high | 84.6 | Confident | 0 Ų | 0 | 68.1 Ų | 68.1 | 0% | 0 | 32% | 0.322 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.7 | 126.4 | 174.9 | -67.3 | 153.8 | 0 | 0 | 0 | 107.5 | L155 V156 P157 C184 I189 R252 V253 F255 | L155-L277 HydrophobicContact CB-CB 4.41Å; L155-L277 HydrophobicContact CD2-CB 4.31Å; V156-L277 WeakPolarHBondContact O-CA 3.29Å; P157-L277 HydrophobicContact CB-CD2 4.03Å; P157-L277 HydrophobicContact CG-CD2 3.69Å; C184-L277 VanDerWaalsContact SG-CD2 3.58Å; I189-L277 HydrophobicContact CD1-CD1 3.35Å; I189-L277 HydrophobicContact CG1-CD1 3.82Å; I189-L277 HydrophobicContact CG2-CD1 4.03Å; R252-L277 CarbonylContact C-O 3.46Å; R252-L277 VanDerWaalsContact CA-O 3.3Å; R252-L277 WeakPolarHBondContact CA-O 3.23Å; V253-L277 HydrophobicContact CB-CB 4.31Å; V253-L277 PolarHBondContact N-O 3.45Å; V253-L277 PolarHBondContact O-N 3.47Å; F255-L277 HydrophobicContact CD1-CD1 4.13Å; F255-L277 HydrophobicContact CE1-CD1 3.62Å; F255-L277 HydrophobicContact CE1-CG 4.18Å |
| 278 | T | 93 | Very high | 82.6 | Confident | 15 Ų | 15 | 72.4 Ų | 72.4 | 9% | 0.092 | 34% | 0.339 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.9 | 134.8 | 178.4 | -65.2 | 0 | 0 | 0 | 0 | 110.1 | V156 D158 S251 R280 | V156-T278 PolarHBondContact N-O 3.09Å; V156-T278 PolarHBondContact O-N 2.88Å; D158-T278 PolarHBondContact OD1-OG1 2.89Å; D158-T278 WeakPolarHBondContact OD2-CB 3.49Å; D158-T278 PolarHBondContact OD2-N 2.95Å; D158-T278 PolarHBondContact OD2-OG1 2.84Å; S251-T278 WeakPolarHBondContact O-CA 3.43Å; T278-R280 HydrophobicContact CG2-CG 4.23Å; T278-R280 PolarHBondContact O-N 2.97Å |
| 279 | C | 91.1 | Very high | 80.6 | Confident | 2 Ų | 2 | 76 Ų | 76 | 1% | 0.014 | 38% | 0.375 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -70.7 | 120.4 | 171.8 | -173.5 | 0 | 0 | 0 | 0 | 109.7 | C154 L155 L247 E248 G250 S251 | C154-C279 WeakPolarHBondContact O-CA 3.19Å; L155-C279 HydrophobicContact CD2-CB 4.11Å; L247-C279 PolarHBondContact O-SG 3.42Å; E248-C279 WeakPolarHBondContact O-CB 3.02Å; G250-C279 PolarHBondContact N-O 3.2Å; S251-C279 PolarHBondContact O-N 3.11Å |
| 280 | R | 90.1 | Very high | 78.4 | Confident | 114 Ų | 114 | 79.3 Ų | 79.3 | 43% | 0.43 | 39% | 0.389 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.8 | 152.6 | -178.7 | -59.8 | -176.7 | -174.1 | -177.4 | 1.5 | 110 | Q153 C154 V156 D158 T278 | Q153-R280 WeakPolarHBondContact CA-O 3.37Å; C154-R280 PolarHBondContact N-O 2.79Å; C154-R280 PolarHBondContact O-N 2.78Å; V156-R280 HydrophobicContact CB-CG 4.46Å; V156-R280 HydrophobicContact CG2-CB 4.17Å; V156-R280 HydrophobicContact CG2-CG 4.36Å; D158-R280 IonicContact OD1-CZ 3.53Å; D158-R280 IonicContact OD1-NE 3.49Å; D158-R280 IonicContact OD1-NH2 2.73Å; D158-R280 PolarHBondContact OD1-NH2 3.41Å; T278-R280 HydrophobicContact CG2-CG 4.23Å; T278-R280 PolarHBondContact O-N 2.97Å |
| 281 | N | 86.7 | Confident | 76.4 | Confident | 77 Ų | 77 | 84 Ų | 84 | 41% | 0.412 | 42% | 0.422 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.4 | 128.1 | 167.9 | -75 | -17.6 | 0 | 0 | 0 | 108.7 | T151 Q153 L249 | T151-N281 HydrophobicContact CG2-CB 4.38Å; Q153-N281 WeakPolarHBondContact CG-OD1 3.34Å; L249-N281 HydrophobicContact CD1-CB 4.27Å; L249-N281 VanDerWaalsContact CD1-OD1 3.29Å; L249-N281 WeakPolarHBondContact CD1-OD1 3.41Å |
| 282 | H | 80.4 | Confident | 74.7 | Confident | 104 Ų | 104 | 89.4 Ų | 89.4 | 48% | 0.481 | 45% | 0.445 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.4 | 113.5 | 170 | -162.1 | -57.3 | 0 | 0 | 0 | 108 | L152 L284 | L152-H282 PolarHBondContact N-O 3.48Å; L152-H282 PolarHBondContact O-N 3.42Å; H282-L284 PolarHBondContact O-N 3.42Å |
| 283 | A | 77.9 | Confident | 72.9 | Confident | 43 Ų | 43 | 87.3 Ų | 87.3 | 36% | 0.355 | 45% | 0.445 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -65.9 | 121.6 | 172.4 | 0 | 0 | 0 | 0 | 0 | 109 | E149 | E149-A283 HydrophobicContact CG-CB 3.83Å; E149-A283 WeakPolarHBondContact OE1-CB 3.31Å |
| 284 | L | 71.9 | Confident | 71.1 | Confident | 74 Ų | 74 | 83.8 Ų | 83.8 | 39% | 0.387 | 45% | 0.445 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -95 | 110.7 | 164.9 | -65 | -172 | 0 | 0 | 0 | 107.8 | F150 L152 H282 M286 | F150-L284 HydrophobicContact CB-CB 4.34Å; F150-L284 WeakPolarHBondContact O-CB 3.34Å; F150-L284 PolarHBondContact O-N 2.88Å; L152-L284 HydrophobicContact CD1-CD1 3.37Å; L152-L284 HydrophobicContact CD1-CG 4.06Å; L152-L284 HydrophobicContact CG-CD1 3.65Å; L152-L284 HydrophobicContact CG-CG 4.04Å; H282-L284 PolarHBondContact O-N 3.42Å; L284-M286 PolarHBondContact O-N 3.13Å |
| 285 | H | 61.4 | Low | 69.2 | Low | 142 Ų | 142 | 92 Ų | 92 | 66% | 0.657 | 47% | 0.473 | S | S | * | . | trans | -85.1 | 110 | 171.3 | -165.5 | -72 | 0 | 0 | 0 | 108.2 | P287 | H285-P287 WeakPolarHBondContact O-CD 3.39Š| ||
| 286 | M | 58.7 | Low | 67.2 | Low | 130 Ų | 130 | 98.1 Ų | 98.1 | 64% | 0.64 | 51% | 0.505 | S | S | * | . | trans | -62.3 | 123 | 166.8 | -81.2 | -78 | -177.7 | 0 | 0 | 108 | F150 L284 R288 | F150-M286 HydrophobicContact CD2-CG 4.31Å; F150-M286 HydrophobicContact CE2-CE 4.45Å; F150-M286 HydrophobicContact CE2-CG 4.23Å; L284-M286 PolarHBondContact O-N 3.13Å; M286-R288 PolarHBondContact O-N 3.31Å | ||
| 287 | P | 58.3 | Low | 64.5 | Low | 82 Ų | 82 | 104.6 Ų | 104.6 | 53% | 0.532 | 53% | 0.532 | S | S | . | . | trans | -57.8 | 112.8 | 174.9 | 20 | -27.7 | 0 | 0 | 0 | 108.5 | H285 G289 | H285-P287 WeakPolarHBondContact O-CD 3.39Å; P287-G289 PolarHBondContact O-N 3.06Å | ||
| 288 | R | 54.4 | Low | 62.1 | Low | 174 Ų | 174 | 113.5 Ų | 113.5 | 66% | 0.657 | 57% | 0.571 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.2 | 112.3 | 177.8 | -73.7 | -176 | 174.2 | -163.9 | 7.3 | 107.4 | D147 M286 | D147-R288 IonicContact OD1-NH2 2.81Å; D147-R288 PolarHBondContact OD1-NH2 3.46Å; D147-R288 VanDerWaalsContact OD1-NH2 3.16Å; M286-R288 PolarHBondContact O-N 3.31Å |
| 289 | G | 54.6 | Low | 59.5 | Low | 74 Ų | 74 | 123.9 Ų | 123.9 | 76% | 0.763 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 108.5 | -3.9 | 167.9 | 0 | 0 | 0 | 0 | 0 | 117.5 | P287 | P287-G289 PolarHBondContact O-N 3.06Š|
| 290 | E | 48 | Very low | 58 | Low | 126 Ų | 126 | 130 Ų | 130 | 59% | 0.589 | 65% | 0.654 | S | S | * | * | trans | -105.7 | 9.7 | 177.2 | -66.1 | -177.2 | 177.5 | 0 | 0 | 113.5 | E292 E293 S294 | E290-E292 PolarHBondContact O-N 2.96Å; E290-E293 PolarHBondContact O-N 3.34Å; E290-S294 PolarHBondContact O-N 3.01Å | ||
| 291 | C | 47.1 | Very low | 56.3 | Low | 114 Ų | 114 | 130.8 Ų | 130.8 | 77% | 0.77 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.4 | -16.9 | 178.2 | -162.5 | 0 | 0 | 0 | 0 | 112.9 | ||
| 292 | E | 51.8 | Low | 54.6 | Low | 174 Ų | 174 | 133.8 Ų | 133.8 | 81% | 0.813 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.4 | -24.5 | 177 | -67.6 | -167.2 | 155.5 | 0 | 0 | 112.9 | E290 | E290-E292 PolarHBondContact O-N 2.96Š|
| 293 | E | 46.2 | Very low | 53.1 | Low | 175 Ų | 175 | 135.5 Ų | 135.5 | 82% | 0.818 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.7 | -18.6 | -176.2 | -67.6 | -177.9 | 166 | 0 | 0 | 114 | E290 W295 | E290-E293 PolarHBondContact O-N 3.34Å; E293-W295 PolarHBondContact O-N 3.29Å; E293-W295 VanDerWaalsContact O-N 3.14Å |
| 294 | S | 47.8 | Very low | 51.5 | Low | 86 Ų | 86 | 141.3 Ų | 141.3 | 60% | 0.601 | 71% | 0.713 | S | S | * | * | trans | -88.6 | 68.8 | 177.5 | -79.9 | 0 | 0 | 0 | 0 | 112.8 | E290 I296 | E290-S294 PolarHBondContact O-N 3.01Å; S294-I296 PolarHBondContact O-N 3.32Å | ||
| 295 | W | 49.5 | Very low | 50.1 | Low | 203 Ų | 203 | 145.8 Ų | 145.8 | 77% | 0.769 | 74% | 0.735 | S | S | * | * | trans | -76.8 | 101.2 | 157.7 | -67.4 | 90.9 | 0 | 0 | 0 | 108.2 | E293 H297 | E293-W295 PolarHBondContact O-N 3.29Å; E293-W295 VanDerWaalsContact O-N 3.14Å; W295-H297 VanDerWaalsContact C-N 3.29Å; W295-H297 PolarHBondContact O-CD2 3.29Å; W295-H297 PolarHBondContact O-N 3.29Å | ||
| 296 | I | 54.6 | Low | 49.3 | Very low | 130 Ų | 130 | 146.1 Ų | 146.1 | 67% | 0.667 | 74% | 0.74 | S | S | * | * | trans | -66.1 | 96.1 | 165.9 | -57.7 | 174.2 | 0 | 0 | 0 | 106.9 | S294 F298 | S294-I296 PolarHBondContact O-N 3.32Å; I296-F298 HydrophobicContact CB-CE2 4.37Å; I296-F298 HydrophobicContact CG2-CD1 4.5Å; I296-F298 HydrophobicContact CG2-CD2 4.17Å; I296-F298 HydrophobicContact CG2-CE1 4.14Å; I296-F298 HydrophobicContact CG2-CE2 3.79Å; I296-F298 HydrophobicContact CG2-CZ 3.77Å; I296-F298 PolarHBondContact O-N 3.19Å | ||
| 297 | H | 38.1 | Very low | 48.6 | Very low | 157 Ų | 157 | 147.3 Ų | 147.3 | 73% | 0.727 | 75% | 0.748 | S | S | * | * | trans | -72.6 | 104.1 | 166.4 | -74.9 | -86.1 | 0 | 0 | 0 | 108 | W295 I299 | W295-H297 VanDerWaalsContact C-N 3.29Å; W295-H297 PolarHBondContact O-CD2 3.29Å; W295-H297 PolarHBondContact O-N 3.29Å; H297-I299 PolarHBondContact O-N 3.42Å; H297-I299 VanDerWaalsContact O-N 3.11Å | ||
| 298 | F | 41.8 | Very low | 47.8 | Very low | 188 Ų | 188 | 152.8 Ų | 152.8 | 83% | 0.825 | 77% | 0.766 | S | S | * | * | trans | -70.9 | 101.6 | 159.9 | -63.5 | -82.2 | 0 | 0 | 0 | 106.9 | I296 | I296-F298 HydrophobicContact CB-CE2 4.37Å; I296-F298 HydrophobicContact CG2-CD1 4.5Å; I296-F298 HydrophobicContact CG2-CD2 4.17Å; I296-F298 HydrophobicContact CG2-CE1 4.14Å; I296-F298 HydrophobicContact CG2-CE2 3.79Å; I296-F298 HydrophobicContact CG2-CZ 3.77Å; I296-F298 PolarHBondContact O-N 3.19Å | ||
| 299 | I | 39.9 | Very low | 47.2 | Very low | 232 Ų | 232 | 150.8 Ų | 150.8 | 100% | 1.19 | 78% | 0.776 | S | S | * | * | trans | -73.2 | 0 | 173.5 | -27 | 175.8 | 0 | 0 | 0 | 109.5 | H297 | H297-I299 PolarHBondContact O-N 3.42Å; H297-I299 VanDerWaalsContact O-N 3.11Å |
Retrieved 299 of 299 residues in 679.5 ms
(Link to these results)