| 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 | 38.2 | Very low | 42.8 | Very low | 252 Ų | 252 | 136.2 Ų | 136.2 | 100% | 1.241 | 83% | 0.832 | S | S | * | * | 0 | 105.8 | 0 | -57.9 | 179.7 | -179 | 0 | 0 | 104.9 | |||||
| 2 | G | 36.6 | Very low | 42.4 | Very low | 71 Ų | 71 | 134.7 Ų | 134.7 | 73% | 0.732 | 83% | 0.831 | S | S | * | * | 86 | 117.8 | 68.5 | 0 | 0 | 0 | 0 | 0 | 106.7 | |||||
| 3 | V | 40.5 | Very low | 41.8 | Very low | 138 Ų | 138 | 141.5 Ų | 141.5 | 84% | 0.836 | 83% | 0.832 | S | S | * | * | cis | -152.9 | 118.5 | 49.5 | 166.1 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 4 | V | 42.1 | Very low | 41.3 | Very low | 117 Ų | 117 | 149.1 Ų | 149.1 | 71% | 0.709 | 84% | 0.84 | S | S | * | * | 53 | 115 | 82.5 | -178.7 | 0 | 0 | 0 | 0 | 115.8 | |||||
| 5 | L | 42 | Very low | 41.4 | Very low | 172 Ų | 172 | 150.1 Ų | 150.1 | 90% | 0.901 | 84% | 0.835 | S | S | * | * | -166.9 | 154.1 | 129.9 | -102.4 | 169.9 | 0 | 0 | 0 | 111.1 | |||||
| 6 | S | 43.5 | Very low | 41.5 | Very low | 101 Ų | 101 | 148.3 Ų | 148.3 | 71% | 0.706 | 83% | 0.832 | S | S | * | * | trans | -105.1 | 168.9 | -155.7 | -61.6 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 7 | P | 46.7 | Very low | 41.2 | Very low | 128 Ų | 128 | 150.2 Ų | 150.2 | 83% | 0.831 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -90.3 | 160.1 | -168.1 | 36 | -35.4 | 0 | 0 | 0 | 114.8 | ||
| 8 | H | 42.3 | Very low | 41.3 | Very low | 189 Ų | 189 | 146.8 Ų | 146.8 | 88% | 0.875 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -101.5 | 150.3 | 173 | -103.7 | -80.7 | 0 | 0 | 0 | 112.9 | ||
| 9 | P | 48.3 | Very low | 41.6 | Very low | 117 Ų | 117 | 145.8 Ų | 145.8 | 76% | 0.76 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -96.5 | 165 | -170.4 | 38.3 | -35.8 | 0 | 0 | 0 | 114.6 | ||
| 10 | A | 44.4 | Very low | 41.4 | Very low | 100 Ų | 100 | 147.6 Ų | 147.6 | 83% | 0.826 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -93.2 | 151.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||
| 11 | P | 45.8 | Very low | 41.2 | Very low | 113 Ų | 113 | 145 Ų | 145 | 73% | 0.734 | 84% | 0.835 | S | S | * | * | trans | -112.7 | 121.6 | 168.2 | 34.5 | -24.3 | 0 | 0 | 0 | 114.8 | ||||
| 12 | S | 38.5 | Very low | 41.5 | Very low | 118 Ų | 118 | 139.3 Ų | 139.3 | 83% | 0.825 | 82% | 0.817 | S | S | * | * | trans | 38.8 | 139.1 | 139 | 45.1 | 0 | 0 | 0 | 0 | 124.5 | ||||
| 13 | R | 34.8 | Very low | 41.3 | Very low | 223 Ų | 223 | 139.6 Ų | 139.6 | 84% | 0.842 | 82% | 0.82 | S | S | * | * | trans | -51.4 | 154.4 | 164.9 | -73.4 | 177 | 164.5 | -160.9 | -2 | 113.9 | ||||
| 14 | R | 34.8 | Very low | 40.9 | Very low | 248 Ų | 248 | 139.7 Ų | 139.7 | 94% | 0.936 | 82% | 0.822 | S | S | * | * | trans | -109.6 | 138.4 | 156.2 | -71.8 | -176.1 | 174 | -170.2 | -2.4 | 110.6 | ||||
| 15 | E | 42.3 | Very low | 40.4 | Very low | 165 Ų | 165 | 145.6 Ų | 145.6 | 77% | 0.771 | 83% | 0.831 | S | S | * | * | trans | -124.3 | 161.7 | 161.8 | -97.4 | -173 | 102.1 | 0 | 0 | 109.4 | ||||
| 16 | P | 42.3 | Very low | 40.2 | Very low | 121 Ų | 121 | 143 Ų | 143 | 79% | 0.786 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -88.8 | 157.9 | -158.7 | 34.4 | -36.1 | 0 | 0 | 0 | 115.1 | ||
| 17 | L | 36.8 | Very low | 39.4 | Very low | 181 Ų | 181 | 141.6 Ų | 141.6 | 95% | 0.948 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -97.5 | 140.1 | 174.6 | -89.3 | 156.9 | 0 | 0 | 0 | 111.9 | ||
| 18 | A | 43.6 | Very low | 38.6 | Very low | 88 Ų | 88 | 148.3 Ų | 148.3 | 73% | 0.727 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -101.2 | 163.9 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||
| 19 | P | 46.1 | Very low | 38.1 | Very low | 128 Ų | 128 | 144.9 Ų | 144.9 | 83% | 0.831 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -90 | 160.1 | -158.6 | 35.1 | -36.3 | 0 | 0 | 0 | 115.5 | ||
| 20 | L | 37.8 | Very low | 37.5 | Very low | 181 Ų | 181 | 145 Ų | 145 | 95% | 0.948 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -101 | 144.6 | 173.4 | -76.9 | 164.3 | 0 | 0 | 0 | 112 | ||
| 21 | A | 37.9 | Very low | 36.9 | Very low | 94 Ų | 94 | 145.3 Ų | 145.3 | 78% | 0.777 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -88.8 | 161.9 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||
| 22 | P | 44 | Very low | 36.2 | Very low | 132 Ų | 132 | 146.5 Ų | 146.5 | 86% | 0.857 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -89.3 | 153.6 | -163.5 | 34.7 | -35.7 | 0 | 0 | 0 | 115.1 | ||
| 23 | G | 32.6 | Very low | 35.9 | Very low | 78 Ų | 78 | 146.8 Ų | 146.8 | 80% | 0.804 | 84% | 0.842 | S | S | * | * | trans | -113.3 | 144.6 | 176 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 24 | T | 32.1 | Very low | 35.6 | Very low | 140 Ų | 140 | 139.2 Ų | 139.2 | 86% | 0.859 | 83% | 0.833 | S | S | * | * | trans | -69.1 | 147.4 | -168.9 | -25.1 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 25 | R | 30.7 | Very low | 35.4 | Very low | 241 Ų | 241 | 133.2 Ų | 133.2 | 91% | 0.909 | 83% | 0.829 | S | S | * | * | trans | -145.1 | 161.4 | 152.8 | -87 | -154.7 | 177.3 | -138.7 | -2.1 | 111.9 | ||||
| 26 | P | 38.8 | Very low | 34.8 | Very low | 118 Ų | 118 | 130.8 Ų | 130.8 | 77% | 0.766 | 83% | 0.831 | S | S | * | * | trans | -111.2 | 151.4 | -145 | 39.2 | -33.9 | 0 | 0 | 0 | 117.1 | ||||
| 27 | G | 27.6 | Very low | 34.3 | Very low | 70 Ų | 70 | 136.7 Ų | 136.7 | 72% | 0.722 | 84% | 0.837 | S | S | * | * | 69.9 | 102.1 | 123.2 | 0 | 0 | 0 | 0 | 0 | 121.1 | |||||
| 28 | W | 29.5 | Very low | 33.9 | Very low | 270 Ų | 270 | 133.8 Ų | 133.8 | 100% | 1.023 | 83% | 0.832 | S | S | * | * | trans | -145.1 | 148.2 | 134.3 | -98.1 | -19 | 0 | 0 | 0 | 111.3 | ||||
| 29 | S | 31.4 | Very low | 33.4 | Very low | 116 Ų | 116 | 134.2 Ų | 134.2 | 81% | 0.811 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -90.9 | 154.1 | -167 | -55.5 | 0 | 0 | 0 | 0 | 113.5 | ||
| 30 | P | 36.5 | Very low | 32.7 | Very low | 120 Ų | 120 | 136.5 Ų | 136.5 | 78% | 0.779 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -81.7 | 141.2 | 173.9 | 33.5 | -33.5 | 0 | 0 | 0 | 111.8 | ||
| 31 | A | 31.1 | Very low | 32.4 | Very low | 106 Ų | 106 | 139.4 Ų | 139.4 | 88% | 0.876 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -84.6 | 122.1 | 169.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||
| 32 | V | 31.5 | Very low | 32.6 | Very low | 138 Ų | 138 | 140.1 Ų | 140.1 | 84% | 0.836 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -88.6 | 132.8 | 168.4 | 170.4 | 0 | 0 | 0 | 0 | 108.9 | ||
| 33 | S | 32.4 | Very low | 32 | Very low | 124 Ų | 124 | 138.2 Ų | 138.2 | 87% | 0.867 | 83% | 0.825 | S | S | * | * | trans | -129.7 | 132.8 | 148.7 | 61.9 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 34 | G | 28.5 | Very low | 31.9 | Very low | 64 Ų | 64 | 141.2 Ų | 141.2 | 66% | 0.66 | 83% | 0.828 | S | S | * | * | trans | -140.5 | 137.4 | -177 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 35 | S | 30.2 | Very low | 31.8 | Very low | 122 Ų | 122 | 139.5 Ų | 139.5 | 85% | 0.853 | 83% | 0.828 | S | S | * | * | trans | 174.6 | 137.3 | 166.2 | -81.2 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 36 | S | 29.7 | Very low | 31.8 | Very low | 115 Ų | 115 | 131.5 Ų | 131.5 | 80% | 0.804 | 82% | 0.82 | S | S | * | * | cis | -150.9 | 167.4 | 6 | -96.9 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 37 | R | 31.3 | Very low | 32.4 | Very low | 244 Ų | 244 | 132.1 Ų | 132.1 | 92% | 0.921 | 82% | 0.824 | S | S | * | * | trans | -59.2 | 147.8 | -178.8 | -56.4 | 159 | 172.1 | -137 | -3.1 | 113.9 | ||||
| 38 | S | 29.1 | Very low | 32.6 | Very low | 121 Ų | 121 | 132.4 Ų | 132.4 | 85% | 0.846 | 83% | 0.827 | S | S | * | * | -165.1 | 120.2 | 124.3 | 55.3 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 39 | A | 32.8 | Very low | 33.7 | Very low | 97 Ų | 97 | 125.7 Ų | 125.7 | 80% | 0.802 | 82% | 0.818 | S | S | * | * | trans | -109.9 | 125.1 | 171.4 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 40 | L | 30.6 | Very low | 33.7 | Very low | 176 Ų | 176 | 123.7 Ų | 123.7 | 92% | 0.921 | 82% | 0.816 | S | S | * | * | trans | -145.5 | 112.3 | 166 | -76.7 | -179.5 | 0 | 0 | 0 | 111.5 | ||||
| 41 | R | 32 | Very low | 34.5 | Very low | 241 Ų | 241 | 124.3 Ų | 124.3 | 91% | 0.909 | 82% | 0.82 | S | S | * | * | trans | -126.5 | 147.5 | 144.4 | -115 | -173.5 | 177.7 | -151.8 | -0.3 | 104.3 | ||||
| 42 | P | 42.5 | Very low | 34.6 | Very low | 110 Ų | 110 | 122.5 Ų | 122.5 | 71% | 0.714 | 81% | 0.812 | S | S | * | * | -154.3 | -166.1 | 74.6 | 35.8 | -12.5 | 0 | 0 | 0 | 115.7 | |||||
| 43 | S | 31.1 | Very low | 34.8 | Very low | 92 Ų | 92 | 123.1 Ų | 123.1 | 64% | 0.643 | 82% | 0.816 | S | S | * | * | trans | 66 | 109.6 | 151.2 | 38.1 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 44 | T | 30.6 | Very low | 34.7 | Very low | 141 Ų | 141 | 120 Ų | 120 | 87% | 0.865 | 80% | 0.803 | S | S | * | * | 83.8 | 112.4 | 65.8 | 56.8 | 0 | 0 | 0 | 0 | 116.2 | |||||
| 45 | A | 30.3 | Very low | 34.8 | Very low | 104 Ų | 104 | 129.8 Ų | 129.8 | 86% | 0.86 | 82% | 0.821 | S | S | * | * | trans | -178.6 | 143.9 | 137.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 46 | G | 30 | Very low | 34.7 | Very low | 72 Ų | 72 | 127.8 Ų | 127.8 | 74% | 0.742 | 82% | 0.819 | S | S | * | * | trans | -98.4 | -144.8 | 165 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 47 | P | 51.6 | Low | 34.7 | Very low | 132 Ų | 132 | 125.6 Ų | 125.6 | 86% | 0.857 | 82% | 0.815 | S | S | * | * | cis | -143.1 | 159.2 | -4.5 | 40.9 | -22.8 | 0 | 0 | 0 | 117.7 | ||||
| 48 | G | 32 | Very low | 34.7 | Very low | 75 Ų | 75 | 121.2 Ų | 121.2 | 77% | 0.773 | 82% | 0.815 | S | S | * | * | trans | 58.2 | -174.1 | 146.8 | 0 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 49 | P | 52.3 | Low | 35 | Very low | 129 Ų | 129 | 120.4 Ų | 120.4 | 84% | 0.838 | 82% | 0.816 | S | S | * | * | cis | -141.6 | 144.2 | -20.7 | 38.2 | -20.3 | 0 | 0 | 0 | 117.4 | ||||
| 50 | G | 32.2 | Very low | 35 | Very low | 75 Ų | 75 | 120.9 Ų | 120.9 | 77% | 0.773 | 82% | 0.82 | S | S | * | * | trans | 53.4 | -170.7 | 145.8 | 0 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 51 | P | 52.6 | Low | 35.3 | Very low | 132 Ų | 132 | 118.4 Ų | 118.4 | 86% | 0.857 | 82% | 0.817 | S | S | * | * | cis | -139.6 | 167.8 | -16.9 | 41.3 | -24.8 | 0 | 0 | 0 | 117 | ||||
| 52 | G | 33.3 | Very low | 35.2 | Very low | 68 Ų | 68 | 110.4 Ų | 110.4 | 70% | 0.701 | 81% | 0.81 | S | S | * | * | trans | 75.4 | 162.9 | 157.5 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 53 | T | 36.1 | Very low | 34.6 | Very low | 152 Ų | 152 | 116.3 Ų | 116.3 | 93% | 0.933 | 82% | 0.818 | S | S | * | * | cis | -173.9 | 157.1 | -15.5 | 4.6 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 54 | G | 29.7 | Very low | 34.5 | Very low | 58 Ų | 58 | 123.3 Ų | 123.3 | 60% | 0.598 | 83% | 0.83 | S | S | * | * | cis | 166.6 | 157.3 | -5.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 55 | W | 31.9 | Very low | 34.6 | Very low | 270 Ų | 270 | 123.1 Ų | 123.1 | 100% | 1.023 | 83% | 0.829 | S | S | * | * | trans | 69.6 | 155.5 | 177.1 | -51 | -5.4 | 0 | 0 | 0 | 115.6 | ||||
| 56 | G | 27.4 | Very low | 34.9 | Very low | 80 Ų | 80 | 123.9 Ų | 123.9 | 83% | 0.825 | 82% | 0.824 | S | S | * | * | cis | -170.1 | 149 | -8.2 | 0 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 57 | G | 28.8 | Very low | 35 | Very low | 69 Ų | 69 | 124.8 Ų | 124.8 | 71% | 0.711 | 83% | 0.825 | S | S | * | * | 130.8 | 155.8 | 71.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | |||||
| 58 | T | 32.3 | Very low | 34.6 | Very low | 152 Ų | 152 | 124.1 Ų | 124.1 | 93% | 0.933 | 82% | 0.821 | S | S | * | * | trans | 64 | 128.7 | 166 | 44.3 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 59 | A | 35 | Very low | 34.5 | Very low | 104 Ų | 104 | 125.2 Ų | 125.2 | 86% | 0.86 | 82% | 0.823 | S | S | * | * | trans | -81.8 | 155.2 | 165.6 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 60 | A | 33 | Very low | 33.6 | Very low | 106 Ų | 106 | 125.8 Ų | 125.8 | 88% | 0.876 | 82% | 0.823 | S | S | * | * | trans | -143.3 | 122.5 | 164.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 61 | S | 36 | Very low | 33.6 | Very low | 124 Ų | 124 | 130.3 Ų | 130.3 | 87% | 0.867 | 82% | 0.824 | S | S | * | * | trans | -85.8 | 130.6 | 171.1 | 54.5 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 62 | G | 30.2 | Very low | 32.5 | Very low | 73 Ų | 73 | 129.3 Ų | 129.3 | 75% | 0.753 | 82% | 0.819 | S | S | * | * | trans | -149.4 | 96.5 | 164.1 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 63 | R | 29.9 | Very low | 32.3 | Very low | 234 Ų | 234 | 131 Ų | 131 | 88% | 0.883 | 83% | 0.826 | S | S | * | * | 67.6 | 111.6 | 66.6 | -151.9 | 178.9 | -147.4 | -86.8 | 2.8 | 111.9 | |||||
| 64 | W | 29.7 | Very low | 32.2 | Very low | 240 Ų | 240 | 127.9 Ų | 127.9 | 91% | 0.909 | 82% | 0.816 | S | S | * | * | trans | -65.5 | 148 | -178.2 | -69.6 | 63.6 | 0 | 0 | 0 | 112.4 | ||||
| 65 | V | 32.4 | Very low | 32.9 | Very low | 137 Ų | 137 | 131.7 Ų | 131.7 | 83% | 0.83 | 83% | 0.83 | S | S | * | * | trans | -131.2 | 113.6 | 169.6 | -179.8 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 66 | P | 36.7 | Very low | 32.8 | Very low | 119 Ų | 119 | 130.5 Ų | 130.5 | 77% | 0.773 | 83% | 0.825 | S | S | * | * | trans | -107.6 | 145.7 | 159.4 | 35.7 | -27.5 | 0 | 0 | 0 | 111 | ||||
| 67 | A | 32 | Very low | 33 | Very low | 91 Ų | 91 | 131.4 Ų | 131.4 | 75% | 0.752 | 83% | 0.825 | S | S | * | * | trans | -155.3 | 153 | 169.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 68 | P | 43.3 | Very low | 33.1 | Very low | 119 Ų | 119 | 132.5 Ų | 132.5 | 77% | 0.773 | 83% | 0.828 | S | S | * | * | cis | -123.1 | 159.7 | -39.9 | 36.5 | -25 | 0 | 0 | 0 | 111.8 | ||||
| 69 | A | 30.9 | Very low | 33.1 | Very low | 98 Ų | 98 | 130.7 Ų | 130.7 | 81% | 0.81 | 83% | 0.828 | S | S | * | * | trans | -81.6 | 148.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 70 | V | 32.7 | Very low | 32.8 | Very low | 140 Ų | 140 | 129.3 Ų | 129.3 | 85% | 0.848 | 82% | 0.824 | S | S | * | * | trans | -118.1 | 112.1 | 172.7 | -161.1 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 71 | H | 32.3 | Very low | 32.9 | Very low | 171 Ų | 171 | 132.9 Ų | 132.9 | 79% | 0.792 | 82% | 0.822 | S | S | * | * | trans | -118.6 | 154.8 | 163.5 | -93.3 | -82.9 | 0 | 0 | 0 | 105.6 | ||||
| 72 | C | 29.4 | Very low | 32.8 | Very low | 110 Ų | 110 | 134.3 Ų | 134.3 | 74% | 0.743 | 82% | 0.815 | S | S | * | * | cis | -163.7 | 158 | 18.7 | -131.2 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 73 | A | 28.2 | Very low | 33 | Very low | 103 Ų | 103 | 138.8 Ų | 138.8 | 85% | 0.851 | 82% | 0.816 | S | S | * | * | trans | -165.6 | 118.3 | 143.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 74 | A | 34.1 | Very low | 33.2 | Very low | 88 Ų | 88 | 135.9 Ų | 135.9 | 73% | 0.727 | 81% | 0.812 | S | S | * | * | trans | -97.6 | 172.4 | 161.2 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 75 | P | 44.1 | Very low | 33.3 | Very low | 137 Ų | 137 | 133.6 Ų | 133.6 | 89% | 0.89 | 81% | 0.811 | S | S | * | * | -131.9 | 167.8 | 113.7 | 36.7 | -29.6 | 0 | 0 | 0 | 113.5 | |||||
| 76 | R | 31 | Very low | 33.3 | Very low | 245 Ų | 245 | 130.2 Ų | 130.2 | 93% | 0.925 | 81% | 0.805 | S | S | * | * | trans | -140 | 120.2 | -169.4 | -174.9 | -172.1 | -177.8 | -159.4 | 0.7 | 110.4 | ||||
| 77 | A | 30.9 | Very low | 34.2 | Very low | 99 Ų | 99 | 130.6 Ų | 130.6 | 82% | 0.818 | 81% | 0.807 | S | S | * | * | trans | -172.1 | 154.4 | 158.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 78 | A | 31.6 | Very low | 35.2 | Very low | 93 Ų | 93 | 131 Ų | 131 | 77% | 0.769 | 80% | 0.802 | S | S | * | * | cis | 171.5 | 148.6 | -31.3 | 0 | 0 | 0 | 0 | 0 | 107 | ||||
| 79 | A | 31.7 | Very low | 34.7 | Very low | 113 Ų | 113 | 132.9 Ų | 132.9 | 93% | 0.934 | 81% | 0.805 | S | S | * | * | trans | 71 | 138.8 | 165.6 | 0 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 80 | G | 29.7 | Very low | 34.7 | Very low | 75 Ų | 75 | 133.9 Ų | 133.9 | 77% | 0.773 | 80% | 0.804 | S | S | * | * | trans | 145.4 | 84 | 168.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 81 | H | 33.9 | Very low | 34.7 | Very low | 182 Ų | 182 | 132.7 Ų | 132.7 | 84% | 0.843 | 80% | 0.802 | S | S | * | * | trans | -65.4 | 166.2 | 158.6 | -72.6 | -41.1 | 0 | 0 | 0 | 109.5 | ||||
| 82 | Q | 33.9 | Very low | 35.4 | Very low | 153 Ų | 153 | 130.2 Ų | 130.2 | 72% | 0.715 | 80% | 0.801 | S | S | * | * | cis | -171.7 | 154.5 | 42 | -158.7 | 145.8 | 16.3 | 0 | 0 | 114.8 | ||||
| 83 | Q | 34.1 | Very low | 35.5 | Very low | 168 Ų | 168 | 132.5 Ų | 132.5 | 79% | 0.785 | 81% | 0.806 | S | S | * | * | trans | 77.7 | 132.1 | 150.1 | -91.7 | 162.3 | 17.2 | 0 | 0 | 123.7 | ||||
| 84 | H | 34.2 | Very low | 35.6 | Very low | 172 Ų | 172 | 130.9 Ų | 130.9 | 80% | 0.796 | 80% | 0.8 | S | S | * | * | trans | -79.4 | 163.3 | 163.9 | -67.1 | -115.4 | 0 | 0 | 0 | 111.1 | ||||
| 85 | H | 33.4 | Very low | 35.5 | Very low | 192 Ų | 192 | 131.3 Ų | 131.3 | 89% | 0.889 | 80% | 0.803 | S | S | * | * | -164.2 | 161.1 | 113.6 | -97.8 | -67.6 | 0 | 0 | 0 | 111 | |||||
| 86 | G | 32.2 | Very low | 35.5 | Very low | 67 Ų | 67 | 130.5 Ų | 130.5 | 69% | 0.691 | 80% | 0.798 | S | S | * | * | trans | -100.4 | -153.7 | -163.2 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 87 | P | 54.3 | Low | 35.6 | Very low | 126 Ų | 126 | 131.1 Ų | 131.1 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | trans | -107.2 | -151.6 | -146.2 | 47.6 | -41.9 | 0 | 0 | 0 | 111.6 | ||||
| 88 | P | 54.3 | Low | 35.5 | Very low | 101 Ų | 101 | 136.2 Ų | 136.2 | 66% | 0.656 | 80% | 0.798 | S | S | * | * | cis | -140.3 | -176.8 | -9 | 39.3 | -19 | 0 | 0 | 0 | 117.4 | ||||
| 89 | L | 31.8 | Very low | 35.3 | Very low | 158 Ų | 158 | 139.3 Ų | 139.3 | 83% | 0.827 | 79% | 0.794 | S | S | * | * | trans | 83 | 148.5 | 139.8 | -91.3 | 160.2 | 0 | 0 | 0 | 124.1 | ||||
| 90 | C | 30.1 | Very low | 35.1 | Very low | 118 Ų | 118 | 143.3 Ų | 143.3 | 80% | 0.797 | 79% | 0.791 | S | S | * | * | trans | 89.8 | 125.5 | 159.5 | -66.4 | 0 | 0 | 0 | 0 | 122 | ||||
| 91 | S | 33 | Very low | 35 | Very low | 115 Ų | 115 | 150 Ų | 150 | 80% | 0.804 | 79% | 0.793 | S | S | * | * | trans | -88.2 | -178.2 | 160.7 | -32.7 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 92 | P | 48.1 | Very low | 34.6 | Very low | 119 Ų | 119 | 151.8 Ų | 151.8 | 77% | 0.773 | 79% | 0.792 | S | S | * | * | cis | -123.8 | -153.3 | 31.3 | 37.4 | -14.9 | 0 | 0 | 0 | 111.5 | ||||
| 93 | D | 31.2 | Very low | 35 | Very low | 159 Ų | 159 | 150.1 Ų | 150.1 | 85% | 0.85 | 80% | 0.795 | S | S | * | * | cis | -159.2 | -179.4 | 3.2 | -155.2 | -7.3 | 0 | 0 | 0 | 111.4 | ||||
| 94 | G | 30 | Very low | 34.6 | Very low | 69 Ų | 69 | 145.8 Ų | 145.8 | 71% | 0.711 | 80% | 0.795 | S | S | * | * | trans | 109.4 | 108.3 | 146.7 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 95 | A | 32.5 | Very low | 34.6 | Very low | 97 Ų | 97 | 143.2 Ų | 143.2 | 80% | 0.802 | 80% | 0.796 | S | S | * | * | trans | -121.1 | -179 | 164.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 96 | P | 44.3 | Very low | 34.8 | Very low | 120 Ų | 120 | 140.1 Ų | 140.1 | 78% | 0.779 | 79% | 0.793 | S | S | * | * | cis | -123.2 | -178.3 | -32 | 33.7 | -17.1 | 0 | 0 | 0 | 111.7 | ||||
| 97 | R | 31.7 | Very low | 34.7 | Very low | 257 Ų | 257 | 141.2 Ų | 141.2 | 97% | 0.97 | 80% | 0.795 | S | S | * | * | trans | -128.2 | 145.3 | 159.5 | -75.4 | -166.7 | 176.1 | -146.1 | -0.2 | 112.3 | ||||
| 98 | R | 28.6 | Very low | 34.3 | Very low | 206 Ų | 206 | 141 Ų | 141 | 78% | 0.777 | 80% | 0.795 | S | S | * | * | trans | -140.1 | 156.7 | -171.2 | -163.4 | -177.5 | -167.7 | -143 | 7.2 | 109.9 | ||||
| 99 | F | 28.2 | Very low | 33 | Very low | 158 Ų | 158 | 141 Ų | 141 | 69% | 0.693 | 80% | 0.803 | S | S | * | * | trans | 74.3 | 151.9 | 176.6 | -61.7 | -72.1 | 0 | 0 | 0 | 115.7 | ||||
| 100 | K | 28.4 | Very low | 32.9 | Very low | 197 Ų | 197 | 137.6 Ų | 137.6 | 86% | 0.857 | 80% | 0.797 | S | S | * | * | cis | -146 | 176 | 10.5 | -136.3 | 158.7 | -170 | 180 | 0 | 112.2 | ||||
| 101 | R | 25.9 | Very low | 32.9 | Very low | 215 Ų | 215 | 141.6 Ų | 141.6 | 81% | 0.811 | 80% | 0.804 | S | S | * | * | trans | -99.7 | 164.7 | -171.3 | -79.4 | 179 | 162.5 | -168.4 | -5 | 114.3 | ||||
| 102 | R | 26.2 | Very low | 32.6 | Very low | 220 Ų | 220 | 142.8 Ų | 142.8 | 83% | 0.83 | 81% | 0.807 | S | S | * | * | trans | 76 | 166.6 | 144.8 | -91.4 | -175.1 | -179.6 | -158.5 | 0.2 | 117.9 | ||||
| 103 | P | 42.1 | Very low | 31.6 | Very low | 119 Ų | 119 | 140.8 Ų | 140.8 | 77% | 0.773 | 81% | 0.808 | S | S | * | * | cis | -139.3 | -179.4 | -24.9 | 36.6 | -18.9 | 0 | 0 | 0 | 114.9 | ||||
| 104 | G | 27 | Very low | 31.5 | Very low | 76 Ų | 76 | 141.9 Ų | 141.9 | 78% | 0.784 | 81% | 0.808 | S | S | * | * | trans | 112.7 | 122.5 | 135.3 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 105 | S | 32.8 | Very low | 31.3 | Very low | 119 Ų | 119 | 144.8 Ų | 144.8 | 83% | 0.832 | 81% | 0.812 | S | S | * | * | trans | -83.7 | 168.6 | 160.9 | -54.2 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 106 | P | 38.8 | Very low | 30.9 | Very low | 127 Ų | 127 | 145 Ų | 145 | 83% | 0.825 | 81% | 0.808 | S | S | * | * | -142.3 | 169.7 | 104 | 37.7 | -24.3 | 0 | 0 | 0 | 115 | |||||
| 107 | A | 30.3 | Very low | 30.1 | Very low | 89 Ų | 89 | 147.5 Ų | 147.5 | 74% | 0.736 | 81% | 0.814 | S | S | * | * | trans | -95.7 | 173.1 | 165.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 108 | P | 44.1 | Very low | 29.9 | Very low | 123 Ų | 123 | 146.2 Ų | 146.2 | 80% | 0.799 | 81% | 0.809 | S | S | * | * | -151.3 | 167.6 | 97 | 39.5 | -22.5 | 0 | 0 | 0 | 116.9 | |||||
| 109 | A | 28.9 | Very low | 29.8 | Very low | 100 Ų | 100 | 145.7 Ų | 145.7 | 83% | 0.826 | 82% | 0.815 | S | S | * | * | trans | 29.2 | 160.1 | 141 | 0 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 110 | A | 29.1 | Very low | 29.9 | Very low | 86 Ų | 86 | 144.9 Ų | 144.9 | 71% | 0.711 | 81% | 0.814 | S | S | * | * | cis | -178.7 | 150.6 | -25.2 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 111 | Q | 29.3 | Very low | 30.3 | Very low | 202 Ų | 202 | 141.5 Ų | 141.5 | 94% | 0.944 | 81% | 0.812 | S | S | * | * | trans | -164.2 | 164.8 | 156.6 | -118.6 | 164.9 | 102.2 | 0 | 0 | 113.2 | ||||
| 112 | T | 27.9 | Very low | 30.6 | Very low | 140 Ų | 140 | 139.5 Ų | 139.5 | 86% | 0.859 | 81% | 0.811 | S | S | * | * | trans | -110.6 | 159.4 | -152.1 | 41.5 | 0 | 0 | 0 | 0 | 115 | ||||
| 113 | G | 26.6 | Very low | 30.7 | Very low | 78 Ų | 78 | 132.7 Ų | 132.7 | 80% | 0.804 | 81% | 0.81 | S | S | * | * | trans | -173.7 | 129.8 | 166.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 114 | E | 28.2 | Very low | 30.3 | Very low | 181 Ų | 181 | 130.5 Ų | 130.5 | 85% | 0.846 | 81% | 0.808 | S | S | * | * | trans | -108.6 | -178.6 | -163.5 | -70.7 | -175.5 | 84.1 | 0 | 0 | 115.5 | ||||
| 115 | T | 25.7 | Very low | 31 | Very low | 131 Ų | 131 | 132.9 Ų | 132.9 | 80% | 0.804 | 81% | 0.81 | S | S | * | * | trans | 72.4 | 111.1 | 165.9 | 46.4 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 116 | S | 25.5 | Very low | 31.3 | Very low | 102 Ų | 102 | 133.4 Ų | 133.4 | 71% | 0.713 | 81% | 0.811 | S | S | * | * | 71.7 | 115.6 | 68.8 | -163.5 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 117 | L | 27.7 | Very low | 31.2 | Very low | 172 Ų | 172 | 132 Ų | 132 | 90% | 0.901 | 81% | 0.81 | S | S | * | * | -148.7 | 172.9 | 69.7 | -93.1 | 163.3 | 0 | 0 | 0 | 115.3 | |||||
| 118 | R | 26.6 | Very low | 31.5 | Very low | 230 Ų | 230 | 134.1 Ų | 134.1 | 87% | 0.868 | 81% | 0.813 | S | S | * | * | trans | -100.4 | 136.6 | -170.4 | 160.1 | -165.3 | -176.5 | -178.2 | 2.4 | 111.6 | ||||
| 119 | E | 26.4 | Very low | 31 | Very low | 194 Ų | 194 | 133.8 Ų | 133.8 | 91% | 0.907 | 81% | 0.811 | S | S | * | * | trans | -160.4 | 145.9 | 140.7 | -115.9 | 172.7 | 158.7 | 0 | 0 | 112.5 | ||||
| 120 | Q | 31.4 | Very low | 31.2 | Very low | 142 Ų | 142 | 137.3 Ų | 137.3 | 66% | 0.664 | 81% | 0.808 | S | S | * | * | trans | -105.5 | 162.5 | 165 | -79.7 | -157.8 | 41.3 | 0 | 0 | 108.4 | ||||
| 121 | P | 36 | Very low | 31.7 | Very low | 125 Ų | 125 | 139.2 Ų | 139.2 | 81% | 0.812 | 81% | 0.811 | S | S | * | * | -140.4 | 159.4 | 106.2 | 33.6 | -19.6 | 0 | 0 | 0 | 115.2 | |||||
| 122 | H | 31.9 | Very low | 32.1 | Very low | 174 Ų | 174 | 134.4 Ų | 134.4 | 81% | 0.806 | 79% | 0.794 | S | S | * | * | trans | -72.1 | 145.2 | 170 | -63.1 | -80.1 | 0 | 0 | 0 | 111.9 | ||||
| 123 | G | 27.8 | Very low | 32.5 | Very low | 77 Ų | 77 | 132.1 Ų | 132.1 | 79% | 0.794 | 78% | 0.782 | S | S | * | * | trans | -160.8 | 138.4 | 170.4 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 124 | G | 35.1 | Very low | 33.1 | Very low | 72 Ų | 72 | 134.5 Ų | 134.5 | 74% | 0.742 | 78% | 0.783 | S | S | * | * | trans | -75.3 | 178.4 | -173 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 125 | P | 42 | Very low | 33.6 | Very low | 127 Ų | 127 | 131.3 Ų | 131.3 | 83% | 0.825 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 151.6 | -177.4 | 29.4 | -35.4 | 0 | 0 | 0 | 112.5 | ||
| 126 | P | 39 | Very low | 34.1 | Very low | 130 Ų | 130 | 133.9 Ų | 133.9 | 84% | 0.844 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 141.1 | -175 | 28.3 | -34.9 | 0 | 0 | 0 | 112.5 | ||
| 127 | A | 35.3 | Very low | 34.5 | Very low | 97 Ų | 97 | 137.2 Ų | 137.2 | 80% | 0.802 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -72.8 | 145.8 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||
| 128 | V | 36.7 | Very low | 34.6 | Very low | 134 Ų | 134 | 132.5 Ų | 132.5 | 81% | 0.812 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 133.3 | 170.2 | -169.4 | 0 | 0 | 0 | 0 | 108.8 | F130 | V128-F130 PolarHBondContact O-N 2.95Å; V128-F130 VanDerWaalsContact O-N 3.1Å |
| 129 | P | 35 | Very low | 34.9 | Very low | 115 Ų | 115 | 132 Ų | 132 | 75% | 0.747 | 78% | 0.78 | S | S | * | * | trans | -68.4 | 110.3 | 177.8 | 26.8 | -33.4 | 0 | 0 | 0 | 110.8 | V131 | P129-V131 PolarHBondContact O-N 3.47Š| ||
| 130 | F | 32.8 | Very low | 35 | Very low | 175 Ų | 175 | 130.1 Ų | 130.1 | 77% | 0.768 | 78% | 0.776 | S | S | * | * | trans | -75.5 | 110.3 | 174.1 | -178 | -103.1 | 0 | 0 | 0 | 110.1 | V128 V132 | V128-F130 PolarHBondContact O-N 2.95Å; V128-F130 VanDerWaalsContact O-N 3.1Å; F130-V132 HydrophobicContact CD1-CG2 3.82Å; F130-V132 HydrophobicContact CE1-CB 4.47Å; F130-V132 HydrophobicContact CE1-CG2 3.86Å; F130-V132 PolarHBondContact O-N 3.34Å | ||
| 131 | V | 39.8 | Very low | 35.1 | Very low | 126 Ų | 126 | 134 Ų | 134 | 76% | 0.764 | 79% | 0.785 | S | S | * | * | trans | -80.7 | 109 | 170.9 | 178.9 | 0 | 0 | 0 | 0 | 108.6 | P129 P133 | P129-V131 PolarHBondContact O-N 3.47Å; V131-P133 WeakPolarHBondContact O-CD 3.47Å | ||
| 132 | V | 35.7 | Very low | 34.9 | Very low | 100 Ų | 100 | 134 Ų | 134 | 61% | 0.606 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 123.9 | 171.6 | -171.5 | 0 | 0 | 0 | 0 | 108.5 | F130 | F130-V132 HydrophobicContact CD1-CG2 3.82Å; F130-V132 HydrophobicContact CE1-CB 4.47Å; F130-V132 HydrophobicContact CE1-CG2 3.86Å; F130-V132 PolarHBondContact O-N 3.34Å |
| 133 | P | 37.8 | Very low | 34.8 | Very low | 93 Ų | 93 | 131.2 Ų | 131.2 | 60% | 0.604 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 140.6 | 169.7 | -17.7 | 31.2 | 0 | 0 | 0 | 109.8 | V131 T135 | V131-P133 WeakPolarHBondContact O-CD 3.47Å; P133-T135 PolarHBondContact O-N 2.85Å |
| 134 | P | 39.8 | Very low | 35 | Very low | 127 Ų | 127 | 135.3 Ų | 135.3 | 83% | 0.825 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 127.6 | 179.9 | 23.9 | -32.9 | 0 | 0 | 0 | 110.6 | L136 | P134-L136 PolarHBondContact O-N 2.83Š|
| 135 | T | 38.4 | Very low | 34.9 | Very low | 115 Ų | 115 | 141.1 Ų | 141.1 | 71% | 0.706 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 127.4 | 177.6 | 42.7 | 0 | 0 | 0 | 0 | 111 | P133 Q137 | P133-T135 PolarHBondContact O-N 2.85Å; T135-Q137 VanDerWaalsContact C-N 3.34Å; T135-Q137 PolarHBondContact O-N 3.15Å |
| 136 | L | 35.4 | Very low | 34.6 | Very low | 185 Ų | 185 | 140.4 Ų | 140.4 | 97% | 0.969 | 79% | 0.788 | S | S | * | * | trans | -63.1 | 92.7 | 167.4 | -83 | 161.4 | 0 | 0 | 0 | 109.8 | P134 | P134-L136 PolarHBondContact O-N 2.83Š| ||
| 137 | Q | 34.2 | Very low | 34.5 | Very low | 171 Ų | 171 | 137.6 Ų | 137.6 | 80% | 0.799 | 78% | 0.783 | S | S | * | * | trans | -103.2 | 137.1 | 163.2 | -76.3 | -170.6 | -17.9 | 0 | 0 | 109.8 | T135 | T135-Q137 VanDerWaalsContact C-N 3.34Å; T135-Q137 PolarHBondContact O-N 3.15Å | ||
| 138 | G | 29.8 | Very low | 34.1 | Very low | 73 Ų | 73 | 142.4 Ų | 142.4 | 75% | 0.753 | 79% | 0.788 | S | S | * | * | trans | 54.4 | 110 | 144.8 | 0 | 0 | 0 | 0 | 0 | 118.1 | D140 | G138-D140 PolarHBondContact O-N 2.98Š| ||
| 139 | R | 32.1 | Very low | 33.7 | Very low | 220 Ų | 220 | 148.3 Ų | 148.3 | 83% | 0.83 | 80% | 0.796 | S | S | * | * | trans | -50.2 | 132.6 | 149.8 | -75 | 172.3 | 163.8 | 176.9 | -7.5 | 109.4 | ||||
| 140 | D | 29.5 | Very low | 33.5 | Very low | 154 Ų | 154 | 148 Ų | 148 | 82% | 0.824 | 80% | 0.804 | S | S | * | * | trans | -141 | 150.6 | 145.7 | -95.6 | -43.4 | 0 | 0 | 0 | 109.9 | G138 | G138-D140 PolarHBondContact O-N 2.98Š| ||
| 141 | W | 33.4 | Very low | 33.4 | Very low | 224 Ų | 224 | 147.4 Ų | 147.4 | 85% | 0.848 | 81% | 0.808 | S | S | * | * | trans | -87.4 | 148.5 | -157.8 | -66 | 80.9 | 0 | 0 | 0 | 113.9 | ||||
| 142 | V | 32.2 | Very low | 32.9 | Very low | 124 Ų | 124 | 145.3 Ų | 145.3 | 75% | 0.752 | 80% | 0.804 | S | S | * | * | trans | -104.3 | 129.6 | 167.4 | -178.5 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 143 | P | 29.4 | Very low | 32.6 | Very low | 117 Ų | 117 | 146.4 Ų | 146.4 | 76% | 0.76 | 81% | 0.813 | S | S | * | * | trans | -77.5 | 129.2 | 175.4 | -5.6 | 22.1 | 0 | 0 | 0 | 111 | ||||
| 144 | L | 31.8 | Very low | 32.2 | Very low | 163 Ų | 163 | 153.6 Ų | 153.6 | 85% | 0.853 | 83% | 0.829 | S | S | * | * | trans | -119.2 | 126.1 | 161.5 | -74.7 | 176.2 | 0 | 0 | 0 | 109.8 | S146 | L144-S146 PolarHBondContact O-N 2.87Š| ||
| 145 | H | 33.3 | Very low | 31.6 | Very low | 193 Ų | 193 | 155.1 Ų | 155.1 | 89% | 0.894 | 83% | 0.83 | S | S | * | * | S | Bend | trans | -74.9 | 100.2 | 174.7 | -84.3 | -91.1 | 0 | 0 | 0 | 111 | ||
| 146 | S | 34.9 | Very low | 31.4 | Very low | 112 Ų | 112 | 154.9 Ų | 154.9 | 78% | 0.783 | 83% | 0.831 | S | S | * | * | trans | -176.6 | 112.8 | 139.4 | 50.1 | 0 | 0 | 0 | 0 | 107 | L144 | L144-S146 PolarHBondContact O-N 2.87Š| ||
| 147 | G | 37.4 | Very low | 31.1 | Very low | 72 Ų | 72 | 152 Ų | 152 | 74% | 0.742 | 83% | 0.825 | S | S | * | * | trans | -87.6 | 124.8 | -176.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 148 | E | 27.3 | Very low | 31.1 | Very low | 197 Ų | 197 | 150 Ų | 150 | 92% | 0.921 | 83% | 0.826 | S | S | * | * | trans | -155.6 | 130.1 | 150.7 | -109.9 | 165.6 | 146.6 | 0 | 0 | 107.9 | ||||
| 149 | W | 27.2 | Very low | 31 | Very low | 258 Ų | 258 | 150.9 Ų | 150.9 | 98% | 0.977 | 83% | 0.826 | S | S | * | * | trans | -109.8 | 132.4 | -179.4 | -66.7 | 81 | 0 | 0 | 0 | 109 | ||||
| 150 | A | 32.3 | Very low | 31 | Very low | 109 Ų | 109 | 145.8 Ų | 145.8 | 90% | 0.901 | 82% | 0.824 | S | S | * | * | trans | -142.1 | 135.2 | 164.1 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 151 | D | 29.2 | Very low | 30.9 | Very low | 162 Ų | 162 | 147.8 Ų | 147.8 | 87% | 0.866 | 83% | 0.829 | S | S | * | * | trans | -104.7 | 145.5 | -171.7 | -163.5 | 1.8 | 0 | 0 | 0 | 110 | ||||
| 152 | A | 29.3 | Very low | 30.8 | Very low | 82 Ų | 82 | 143.9 Ų | 143.9 | 68% | 0.678 | 82% | 0.824 | S | S | * | * | trans | -153.4 | 140.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 153 | P | 30.1 | Very low | 30.8 | Very low | 123 Ų | 123 | 143.2 Ų | 143.2 | 80% | 0.799 | 82% | 0.815 | S | S | * | * | trans | -91.5 | 164.2 | -151.7 | -8 | 28.6 | 0 | 0 | 0 | 114.5 | ||||
| 154 | W | 29.9 | Very low | 31.5 | Very low | 244 Ų | 244 | 143.3 Ų | 143.3 | 92% | 0.924 | 82% | 0.816 | S | S | * | * | trans | -71.4 | 138.2 | 167.5 | -76.1 | 51.8 | 0 | 0 | 0 | 111.5 | ||||
| 155 | D | 26.8 | Very low | 31.3 | Very low | 160 Ų | 160 | 142.2 Ų | 142.2 | 86% | 0.856 | 81% | 0.806 | S | S | * | * | trans | -119.6 | 125.7 | 156.9 | -98.1 | -39.3 | 0 | 0 | 0 | 109.5 | ||||
| 156 | P | 34.5 | Very low | 31 | Very low | 110 Ų | 110 | 140.2 Ų | 140.2 | 71% | 0.714 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -86.9 | 132 | 179.2 | 32.9 | -32.3 | 0 | 0 | 0 | 112.1 | ||
| 157 | C | 29.7 | Very low | 30.9 | Very low | 125 Ų | 125 | 140.7 Ų | 140.7 | 85% | 0.845 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -63 | 132.7 | 170.8 | -64.6 | 0 | 0 | 0 | 0 | 111 | ||
| 158 | P | 33.1 | Very low | 30.6 | Very low | 129 Ų | 129 | 142.7 Ų | 142.7 | 84% | 0.838 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 151.1 | 178.4 | 31.2 | -34.7 | 0 | 0 | 0 | 112.2 | ||
| 159 | A | 28.8 | Very low | 30.8 | Very low | 91 Ų | 91 | 136.9 Ų | 136.9 | 75% | 0.752 | 81% | 0.807 | S | S | * | * | trans | -107.9 | 171.6 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 160 | S | 31.2 | Very low | 30.9 | Very low | 112 Ų | 112 | 128.1 Ų | 128.1 | 78% | 0.783 | 80% | 0.797 | S | S | * | * | trans | 95.8 | 145.5 | -175.3 | -44.4 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 161 | E | 27.1 | Very low | 31.1 | Very low | 197 Ų | 197 | 132 Ų | 132 | 92% | 0.921 | 80% | 0.801 | S | S | * | * | cis | -124.5 | -179.9 | 27 | -66.7 | -180 | 107.5 | 0 | 0 | 115.9 | ||||
| 162 | L | 31.1 | Very low | 31.4 | Very low | 142 Ų | 142 | 127.8 Ų | 127.8 | 74% | 0.743 | 80% | 0.796 | S | S | * | * | trans | -131.1 | 149.2 | -156.3 | -85.6 | 167.8 | 0 | 0 | 0 | 113.3 | ||||
| 163 | L | 33.5 | Very low | 31.9 | Very low | 110 Ų | 110 | 130.8 Ų | 130.8 | 58% | 0.576 | 80% | 0.801 | S | S | * | * | trans | 76.7 | 159.7 | 140.7 | -73 | 168.6 | 0 | 0 | 0 | 118.3 | H165 | L163-H165 VanDerWaalsContact CD1-CE1 3.47Å; L163-H165 WeakPolarHBondContact CD1-CE1 3.47Å; L163-H165 VanDerWaalsContact CD2-CE1 3.47Å; L163-H165 WeakPolarHBondContact CD2-CE1 3.25Å | ||
| 164 | P | 42.6 | Very low | 32.4 | Very low | 119 Ų | 119 | 129.1 Ų | 129.1 | 77% | 0.773 | 80% | 0.797 | S | S | * | * | cis | -134.3 | 152.6 | 31.1 | 39.3 | -19.5 | 0 | 0 | 0 | 122.1 | ||||
| 165 | H | 29.3 | Very low | 33.1 | Very low | 140 Ų | 140 | 122.1 Ų | 122.1 | 65% | 0.648 | 78% | 0.784 | S | S | * | * | trans | -13.6 | 149.4 | 159.2 | -39.6 | -78.9 | 0 | 0 | 0 | 123.2 | L163 | L163-H165 VanDerWaalsContact CD1-CE1 3.47Å; L163-H165 WeakPolarHBondContact CD1-CE1 3.47Å; L163-H165 VanDerWaalsContact CD2-CE1 3.47Å; L163-H165 WeakPolarHBondContact CD2-CE1 3.25Å | ||
| 166 | T | 26.5 | Very low | 34.1 | Very low | 151 Ų | 151 | 122 Ų | 122 | 93% | 0.926 | 78% | 0.78 | S | S | * | * | -133.9 | 167.3 | 118 | 53.6 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 167 | S | 31.8 | Very low | 34.8 | Very low | 122 Ų | 122 | 123.5 Ų | 123.5 | 85% | 0.853 | 79% | 0.787 | S | S | * | * | trans | -121.6 | 162.5 | -154.8 | 176.9 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 168 | S | 32.3 | Very low | 36.1 | Very low | 113 Ų | 113 | 120.6 Ų | 120.6 | 79% | 0.79 | 78% | 0.778 | S | S | * | * | trans | 110.6 | 109.5 | 167.3 | -165.5 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 169 | G | 30.9 | Very low | 37.3 | Very low | 76 Ų | 76 | 117.8 Ų | 117.8 | 78% | 0.784 | 77% | 0.766 | S | S | * | * | cis | 106.2 | 118.2 | 35.6 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 170 | G | 29.7 | Very low | 38.7 | Very low | 74 Ų | 74 | 119.7 Ų | 119.7 | 76% | 0.763 | 76% | 0.762 | S | S | * | * | cis | -176.7 | -170.5 | -4.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 171 | L | 35.3 | Very low | 40.4 | Very low | 190 Ų | 190 | 118 Ų | 118 | 100% | 0.995 | 74% | 0.744 | S | S | * | * | trans | 65.2 | 106 | 168.1 | -155.6 | 75.7 | 0 | 0 | 0 | 118.1 | ||||
| 172 | G | 35.7 | Very low | 42 | Very low | 73 Ų | 73 | 112.8 Ų | 112.8 | 75% | 0.753 | 73% | 0.728 | S | S | * | * | trans | 151.4 | 44.5 | 168.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | A174 | G172-A174 PolarHBondContact O-N 2.67Š| ||
| 173 | D | 40.2 | Very low | 43.4 | Very low | 146 Ų | 146 | 111.4 Ų | 111.4 | 78% | 0.781 | 72% | 0.718 | S | S | * | * | trans | -71.1 | 92.3 | 172.2 | -177.2 | 18.5 | 0 | 0 | 0 | 110.5 | C175 | D173-C175 PolarHBondContact OD1-N 3.06Å; D173-C175 PolarHBondContact OD1-SG 3.09Å | ||
| 174 | A | 41.4 | Very low | 44.4 | Very low | 87 Ų | 87 | 112.9 Ų | 112.9 | 72% | 0.719 | 73% | 0.725 | S | S | * | * | trans | -102.9 | 96.2 | 157.2 | 0 | 0 | 0 | 0 | 0 | 107.3 | G172 M176 | G172-A174 PolarHBondContact O-N 2.67Å; A174-M176 PolarHBondContact O-N 3.1Å | ||
| 175 | C | 43.3 | Very low | 44.9 | Very low | 97 Ų | 97 | 115.5 Ų | 115.5 | 66% | 0.655 | 72% | 0.721 | S | S | * | * | trans | -47.1 | 100.7 | 175.1 | -73.7 | 0 | 0 | 0 | 0 | 111.5 | D173 V177 | D173-C175 PolarHBondContact OD1-N 3.06Å; D173-C175 PolarHBondContact OD1-SG 3.09Å; C175-V177 HydrophobicContact CB-CG2 4.33Å; C175-V177 PolarHBondContact O-N 3.19Å | ||
| 176 | M | 48 | Very low | 45.5 | Very low | 157 Ų | 157 | 114.5 Ų | 114.5 | 77% | 0.773 | 72% | 0.715 | S | S | * | * | trans | -77.4 | 63.3 | 176 | -164.6 | -172 | -57.7 | 0 | 0 | 110.4 | A174 G178 A179 | A174-M176 PolarHBondContact O-N 3.1Å; M176-G178 PolarHBondContact O-N 3.37Å; M176-G178 VanDerWaalsContact O-N 3.15Å; M176-A179 HydrophobicContact CG-CB 4.46Å; M176-A179 HydrophobicContact SD-CB 4Å | ||
| 177 | V | 49 | Very low | 46.4 | Very low | 142 Ų | 142 | 116.2 Ų | 116.2 | 86% | 0.861 | 71% | 0.71 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.9 | 112.3 | 168.2 | 179 | 0 | 0 | 0 | 0 | 107.3 | C175 | C175-V177 HydrophobicContact CB-CG2 4.33Å; C175-V177 PolarHBondContact O-N 3.19Å |
| 178 | G | 57.7 | Low | 47.1 | Very low | 64 Ų | 64 | 116.1 Ų | 116.1 | 66% | 0.66 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 108 | 25.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 116.1 | M176 I180 | M176-G178 PolarHBondContact O-N 3.37Å; M176-G178 VanDerWaalsContact O-N 3.15Å; G178-I180 VanDerWaalsContact C-N 3.3Å; G178-I180 PolarHBondContact O-N 3.37Å |
| 179 | A | 57.3 | Low | 47.7 | Very low | 71 Ų | 71 | 118.8 Ų | 118.8 | 59% | 0.587 | 71% | 0.706 | S | S | * | * | trans | -60.8 | 95.3 | 157.2 | 0 | 0 | 0 | 0 | 0 | 109.3 | M176 N181 | M176-A179 HydrophobicContact CG-CB 4.46Å; M176-A179 HydrophobicContact SD-CB 4Å; A179-N181 PolarHBondContact O-N 2.88Å | ||
| 180 | I | 57.9 | Low | 48.5 | Very low | 130 Ų | 130 | 120.3 Ų | 120.3 | 67% | 0.667 | 70% | 0.696 | S | S | * | * | trans | -59.6 | 107.7 | 173.5 | -65.1 | 164.2 | 0 | 0 | 0 | 107.1 | G178 P182 Y185 | G178-I180 VanDerWaalsContact C-N 3.3Å; G178-I180 PolarHBondContact O-N 3.37Å; I180-P182 WeakPolarHBondContact O-CD 3.13Å; I180-Y185 HydrophobicContact CG2-CD2 3.77Å; I180-Y185 HydrophobicContact CG2-CE2 3.69Å | ||
| 181 | N | 66.8 | Low | 49.4 | Very low | 76 Ų | 76 | 123.6 Ų | 123.6 | 41% | 0.406 | 69% | 0.69 | S | S | . | * | trans | -67.4 | 112.2 | 176.1 | -178.9 | 0.1 | 0 | 0 | 0 | 108.7 | A179 E183 L184 | A179-N181 PolarHBondContact O-N 2.88Å; N181-E183 PolarHBondContact O-N 3.32Å; N181-E183 VanDerWaalsContact OD1-CB 3.29Å; N181-E183 WeakPolarHBondContact OD1-CB 3.39Å; N181-E183 WeakPolarHBondContact OD1-CG 3.29Å; N181-E183 PolarHBondContact OD1-N 3.07Å; N181-L184 HydrophobicContact CB-CD1 4.07Å; N181-L184 HydrophobicContact CB-CG 4.15Å; N181-L184 PolarHBondContact O-N 3.24Å; N181-L184 VanDerWaalsContact O-N 3.09Å | ||
| 182 | P | 62.6 | Low | 50.3 | Low | 88 Ų | 88 | 116.2 Ų | 116.2 | 57% | 0.571 | 65% | 0.654 | S | S | * | * | G | 310 helix | trans | -63.4 | -27 | -177.4 | -20.2 | 34.5 | 0 | 0 | 0 | 111.9 | I180 L184 Y185 K186 | I180-P182 WeakPolarHBondContact O-CD 3.13Å; P182-L184 PolarHBondContact O-N 2.99Å; P182-Y185 CarbonylContact O-C 3.48Å; P182-Y185 PolarHBondContact O-N 3.38Å; P182-Y185 VanDerWaalsContact O-N 3.07Å; P182-K186 PolarHBondContact O-N 2.68Å |
| 183 | E | 59.2 | Low | 51.4 | Low | 113 Ų | 113 | 115.9 Ų | 115.9 | 53% | 0.528 | 63% | 0.633 | S | S | . | * | G | 310 helix | trans | -63.3 | -27.8 | 177.2 | -54.4 | -61.6 | 138.2 | 0 | 0 | 112.7 | N181 Y185 K186 | N181-E183 PolarHBondContact O-N 3.32Å; N181-E183 VanDerWaalsContact OD1-CB 3.29Å; N181-E183 WeakPolarHBondContact OD1-CB 3.39Å; N181-E183 WeakPolarHBondContact OD1-CG 3.29Å; N181-E183 PolarHBondContact OD1-N 3.07Å; E183-Y185 VanDerWaalsContact C-N 3.31Å; E183-K186 VanDerWaalsContact OE1-CE 3.25Å; E183-K186 WeakPolarHBondContact OE1-CE 3.47Å; E183-K186 IonicContact OE1-NZ 3.9Å; E183-K186 PolarHBondContact OE1-NZ 2.95Å; E183-K186 WeakPolarHBondContact OE2-CD 3.26Å; E183-K186 VanDerWaalsContact OE2-CE 3.26Å; E183-K186 WeakPolarHBondContact OE2-CE 3.37Å; E183-K186 IonicContact OE2-NZ 3.34Å; E183-K186 PolarHBondContact OE2-NZ 3.34Å |
| 184 | L | 54.4 | Low | 52.5 | Low | 141 Ų | 141 | 113.7 Ų | 113.7 | 74% | 0.738 | 63% | 0.625 | S | S | * | * | G | 310 helix | trans | -78.5 | -16 | 175.7 | -67.6 | 176.2 | 0 | 0 | 0 | 113.1 | N181 P182 | N181-L184 HydrophobicContact CB-CD1 4.07Å; N181-L184 HydrophobicContact CB-CG 4.15Å; N181-L184 PolarHBondContact O-N 3.24Å; N181-L184 VanDerWaalsContact O-N 3.09Å; P182-L184 PolarHBondContact O-N 2.99Å |
| 185 | Y | 54.2 | Low | 54 | Low | 174 Ų | 174 | 114.8 Ų | 114.8 | 68% | 0.682 | 62% | 0.619 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107 | -0.8 | 174.4 | -71.2 | -88.9 | 0 | 0 | 0 | 112.9 | I180 P182 E183 F187 | I180-Y185 HydrophobicContact CG2-CD2 3.77Å; I180-Y185 HydrophobicContact CG2-CE2 3.69Å; P182-Y185 CarbonylContact O-C 3.48Å; P182-Y185 PolarHBondContact O-N 3.38Å; P182-Y185 VanDerWaalsContact O-N 3.07Å; E183-Y185 VanDerWaalsContact C-N 3.31Å; Y185-F187 PolarHBondContact O-N 3.03Å |
| 186 | K | 40.6 | Very low | 55.5 | Low | 119 Ų | 119 | 112.5 Ų | 112.5 | 52% | 0.517 | 60% | 0.598 | S | S | . | * | S | Bend | trans | -66.5 | 103.4 | 156.7 | -69.3 | -175 | -169.4 | 169.1 | 0 | 106.8 | P182 E183 | P182-K186 PolarHBondContact O-N 2.68Å; E183-K186 VanDerWaalsContact OE1-CE 3.25Å; E183-K186 WeakPolarHBondContact OE1-CE 3.47Å; E183-K186 IonicContact OE1-NZ 3.9Å; E183-K186 PolarHBondContact OE1-NZ 2.95Å; E183-K186 WeakPolarHBondContact OE2-CD 3.26Å; E183-K186 VanDerWaalsContact OE2-CE 3.26Å; E183-K186 WeakPolarHBondContact OE2-CE 3.37Å; E183-K186 IonicContact OE2-NZ 3.34Å; E183-K186 PolarHBondContact OE2-NZ 3.34Å |
| 187 | F | 45.4 | Very low | 56.8 | Low | 187 Ų | 187 | 108.5 Ų | 108.5 | 82% | 0.82 | 58% | 0.583 | S | S | * | * | trans | -45.4 | 127.1 | 155 | -65.4 | -88.5 | 0 | 0 | 0 | 106.7 | Y185 E189 | Y185-F187 PolarHBondContact O-N 3.03Å; F187-E189 PolarHBondContact O-N 3.19Å | ||
| 188 | P | 46.9 | Very low | 57.9 | Low | 121 Ų | 121 | 110 Ų | 110 | 79% | 0.786 | 59% | 0.587 | S | S | * | * | trans | -54 | 120.9 | 177 | 22.6 | -32.3 | 0 | 0 | 0 | 106.6 | D190 | P188-D190 PolarHBondContact O-N 2.92Š| ||
| 189 | E | 44.7 | Very low | 58.8 | Low | 168 Ų | 168 | 110.5 Ų | 110.5 | 79% | 0.785 | 59% | 0.592 | S | S | * | * | trans | -51.5 | 114.5 | -178.4 | -68.6 | 177 | 151.9 | 0 | 0 | 107 | F187 K191 | F187-E189 PolarHBondContact O-N 3.19Å; E189-K191 WeakPolarHBondContact O-CG 3.4Å; E189-K191 PolarHBondContact O-N 2.76Å | ||
| 190 | D | 48.3 | Very low | 60.1 | Low | 108 Ų | 108 | 108 Ų | 108 | 58% | 0.578 | 57% | 0.57 | S | S | * | * | trans | -71 | 89.7 | -175.7 | -177.2 | 0.2 | 0 | 0 | 0 | 107.6 | P188 S192 E193 | P188-D190 PolarHBondContact O-N 2.92Å; D190-S192 PolarHBondContact O-N 2.83Å; D190-S192 WeakPolarHBondContact OD1-CB 3.03Å; D190-S192 PolarHBondContact OD1-N 3.01Å; D190-S192 PolarHBondContact OD1-OG 3.33Å; D190-S192 PolarHBondContact OD2-OG 3.31Å; D190-S192 VanDerWaalsContact OD2-OG 3.08Å; D190-E193 PolarHBondContact O-N 2.91Å | ||
| 191 | K | 48.4 | Very low | 61.7 | Low | 143 Ų | 143 | 104.2 Ų | 104.2 | 62% | 0.622 | 55% | 0.551 | S | S | * | * | G | 310 helix | trans | -58.2 | -13.6 | -176.5 | -62.2 | -171.4 | -179.7 | -178.3 | 0 | 112.3 | E189 E193 T194 D195 | E189-K191 WeakPolarHBondContact O-CG 3.4Å; E189-K191 PolarHBondContact O-N 2.76Å; K191-E193 PolarHBondContact O-N 2.89Å; K191-T194 WeakPolarHBondContact CA-OG1 3.47Å; K191-T194 CarbonylContact O-C 3.24Å; K191-T194 PolarHBondContact O-N 3.35Å; K191-T194 PolarHBondContact O-OG1 3.19Å; K191-D195 PolarHBondContact O-N 2.95Å |
| 192 | S | 54.2 | Low | 62.9 | Low | 35 Ų | 35 | 100.6 Ų | 100.6 | 25% | 0.245 | 53% | 0.532 | C | S | . | . | G | 310 helix | trans | -57.6 | -28.3 | 169.7 | 77.6 | 0 | 0 | 0 | 0 | 113.1 | D190 T194 R203 | D190-S192 PolarHBondContact O-N 2.83Å; D190-S192 WeakPolarHBondContact OD1-CB 3.03Å; D190-S192 PolarHBondContact OD1-N 3.01Å; D190-S192 PolarHBondContact OD1-OG 3.33Å; D190-S192 PolarHBondContact OD2-OG 3.31Å; D190-S192 VanDerWaalsContact OD2-OG 3.08Å; S192-T194 VanDerWaalsContact C-N 3.3Å; S192-T194 PolarHBondContact O-N 2.91Å; S192-R203 PolarHBondContact O-NH1 2.66Å |
| 193 | E | 59.8 | Low | 64.5 | Low | 66 Ų | 66 | 96.7 Ų | 96.7 | 31% | 0.308 | 51% | 0.505 | S | S | . | . | G | 310 helix | trans | -66.4 | -31.8 | 172.4 | -73.1 | -133.1 | 154.7 | 0 | 0 | 112.6 | D190 K191 F196 R203 W205 K223 | D190-E193 PolarHBondContact O-N 2.91Å; K191-E193 PolarHBondContact O-N 2.89Å; E193-F196 WeakPolarHBondContact O-CE2 3.21Å; E193-F196 WeakPolarHBondContact O-CZ 3.47Å; E193-R203 PolarHBondContact O-NH1 2.79Å; E193-W205 HydrophobicContact CB-CZ2 4.46Å; E193-W205 HydrophobicContact CG-CZ2 4.36Å; E193-W205 PolarHBondContact OE1-NE1 3.42Å; E193-K223 IonicContact OE1-NZ 2.73Å; E193-K223 IonicContact OE2-NZ 2.67Å; E193-K223 PolarHBondContact OE2-NZ 2.88Å |
| 194 | T | 63.1 | Low | 66.2 | Low | 100 Ų | 100 | 91.3 Ų | 91.3 | 61% | 0.613 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.4 | -17.4 | -175 | 43.5 | 0 | 0 | 0 | 0 | 115.1 | K191 S192 F196 | K191-T194 WeakPolarHBondContact CA-OG1 3.47Å; K191-T194 CarbonylContact O-C 3.24Å; K191-T194 PolarHBondContact O-N 3.35Å; K191-T194 PolarHBondContact O-OG1 3.19Å; S192-T194 VanDerWaalsContact C-N 3.3Å; S192-T194 PolarHBondContact O-N 2.91Å; T194-F196 WeakPolarHBondContact O-CD2 3.45Å; T194-F196 WeakPolarHBondContact O-CE2 3.09Å; T194-F196 PolarHBondContact O-N 2.93Å |
| 195 | D | 71.8 | Confident | 68.3 | Low | 111 Ų | 111 | 84.8 Ų | 84.8 | 59% | 0.594 | 45% | 0.446 | S | S | * | . | trans | -80.9 | 107.6 | 174.5 | -73.6 | -27.3 | 0 | 0 | 0 | 110.1 | K191 R203 | K191-D195 PolarHBondContact O-N 2.95Å; D195-R203 PolarHBondContact O-NH1 2.71Å; D195-R203 PolarHBondContact O-NH2 2.77Å | ||
| 196 | F | 75.9 | Confident | 70.3 | Confident | 48 Ų | 48 | 76.5 Ų | 76.5 | 21% | 0.211 | 41% | 0.414 | C | S | . | . | trans | -106.3 | 122.7 | 174.2 | -63.3 | -94.4 | 0 | 0 | 0 | 109.1 | E193 T194 C200 R203 Q225 H226 | E193-F196 WeakPolarHBondContact O-CE2 3.21Å; E193-F196 WeakPolarHBondContact O-CZ 3.47Å; T194-F196 WeakPolarHBondContact O-CD2 3.45Å; T194-F196 WeakPolarHBondContact O-CE2 3.09Å; T194-F196 PolarHBondContact O-N 2.93Å; F196-C200 HydrophobicContact CB-CB 4.39Å; F196-R203 HydrophobicContact CD1-CB 4.48Å; F196-R203 HydrophobicContact CE1-CB 3.81Å; F196-Q225 HydrophobicContact CE1-CB 4.48Å; F196-Q225 HydrophobicContact CZ-CB 4.24Å; F196-H226 HydrophobicContact CD1-CB 4.14Å; F196-H226 AromaticContact CD1-ND1 3.55Å; F196-H226 AromaticContact CD2-CE1 3.47Å; F196-H226 VanDerWaalsContact CD2-CE1 3.47Å; F196-H226 WeakPolarHBondContact CD2-CE1 3.43Å; F196-H226 AromaticContact CD2-ND1 3.12Å; F196-H226 WeakPolarHBondContact CD2-ND1 3.39Å; F196-H226 HydrophobicContact CE1-CB 4.01Å; F196-H226 AromaticContact CE1-CG 3.93Å; F196-H226 AromaticContact CE1-ND1 3.49Å; F196-H226 WeakPolarHBondContact CE1-ND1 3.41Å; F196-H226 AromaticContact CE2-CE1 3.21Å; F196-H226 WeakPolarHBondContact CE2-CE1 3.11Å; F196-H226 AromaticContact CE2-ND1 3.09Å; F196-H226 WeakPolarHBondContact CE2-ND1 3.49Å; F196-H226 AromaticContact CG-ND1 3.38Å; F196-H226 WeakPolarHBondContact CG-ND1 3.15Å; F196-H226 HydrophobicContact CZ-CB 4.49Å; F196-H226 AromaticContact CZ-CE1 3.7Å; F196-H226 AromaticContact CZ-CG 3.93Å; F196-H226 AromaticContact CZ-ND1 3.28Å; F196-H226 VanDerWaalsContact CZ-ND1 3.28Å; F196-H226 WeakPolarHBondContact CZ-ND1 3.4Å | ||
| 197 | P | 75.1 | Confident | 72.9 | Confident | 73 Ų | 73 | 71 Ų | 71 | 47% | 0.474 | 39% | 0.39 | S | S | . | . | trans | -67.8 | 154.4 | 179.1 | 27.5 | -33.8 | 0 | 0 | 0 | 111.7 | G199 C200 | P197-G199 PolarHBondContact O-N 3.46Å; P197-C200 HydrophobicContact CG-CB 4.15Å; P197-C200 WeakPolarHBondContact O-CB 3.28Å; P197-C200 PolarHBondContact O-N 3.24Å | ||
| 198 | D | 71.7 | Confident | 75.3 | Confident | 173 Ų | 173 | 62.2 Ų | 62.2 | 93% | 0.925 | 35% | 0.351 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.2 | 132.6 | 175.8 | -71.3 | -45.7 | 0 | 0 | 0 | 111.4 | C200 | D198-C200 VanDerWaalsContact C-N 3.31Å; D198-C200 PolarHBondContact O-N 2.96Å |
| 199 | G | 76.3 | Confident | 77.5 | Confident | 75 Ų | 75 | 59 Ų | 59 | 77% | 0.773 | 33% | 0.326 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 75.8 | 10 | -175.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | P197 L201 | P197-G199 PolarHBondContact O-N 3.46Å; G199-L201 PolarHBondContact O-N 2.9Å |
| 200 | C | 84.9 | Confident | 79.8 | Confident | 20 Ų | 20 | 52 Ų | 52 | 14% | 0.135 | 29% | 0.293 | C | S | . | . | trans | -56.7 | 127.9 | 173 | -174.2 | 0 | 0 | 0 | 0 | 111.6 | F196 P197 D198 G202 Q228 | F196-C200 HydrophobicContact CB-CB 4.39Å; P197-C200 HydrophobicContact CG-CB 4.15Å; P197-C200 WeakPolarHBondContact O-CB 3.28Å; P197-C200 PolarHBondContact O-N 3.24Å; D198-C200 VanDerWaalsContact C-N 3.31Å; D198-C200 PolarHBondContact O-N 2.96Å; C200-G202 PolarHBondContact O-N 2.93Å; C200-G202 PolarHBondContact SG-N 3.46Å; C200-G202 VanDerWaalsContact SG-N 3.36Å; C200-G202 PolarHBondContact SG-O 2.97Å; C200-G202 VanDerWaalsContact SG-O 3.38Å; C200-Q228 VanDerWaalsContact O-CG 3.3Å; C200-Q228 WeakPolarHBondContact O-CG 3.48Å | ||
| 201 | L | 90.9 | Very high | 81.9 | Confident | 49 Ų | 49 | 50.7 Ų | 50.7 | 26% | 0.257 | 28% | 0.283 | S | S | . | . | trans | -80.4 | 2.1 | 176.8 | -57.7 | 172.9 | 0 | 0 | 0 | 112.9 | G199 Q228 L321 A323 | G199-L201 PolarHBondContact O-N 2.9Å; L201-Q228 PolarHBondContact O-N 2.71Å; L201-L321 HydrophobicContact CB-CB 3.86Å; L201-A323 HydrophobicContact CD1-CB 3.93Å; L201-A323 VanDerWaalsContact CD1-N 3.32Å | ||
| 202 | G | 93 | Very high | 83.9 | Confident | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 28% | 0.282 | C | S | . | . | trans | 115 | 173.8 | -173.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | C200 Q225 H226 L321 | C200-G202 PolarHBondContact O-N 2.93Å; C200-G202 PolarHBondContact SG-N 3.46Å; C200-G202 VanDerWaalsContact SG-N 3.36Å; C200-G202 PolarHBondContact SG-O 2.97Å; C200-G202 VanDerWaalsContact SG-O 3.38Å; G202-Q225 CarbonylContact C-O 3.32Å; G202-Q225 WeakPolarHBondContact CA-O 3.47Å; G202-H226 WeakPolarHBondContact CA-O 3.43Å; G202-H226 PolarHBondContact N-O 3.12Å; G202-L321 VanDerWaalsContact C-CD1 3.45Å; G202-L321 VanDerWaalsContact O-CD1 3.24Å; G202-L321 WeakPolarHBondContact O-CD1 3.49Å; G202-L321 PolarHBondContact O-N 3.41Å | ||
| 203 | R | 94.8 | Very high | 85.7 | Confident | 6 Ų | 6 | 58.1 Ų | 58.1 | 2% | 0.023 | 32% | 0.316 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.2 | 143.7 | 179.5 | -175.6 | 173.7 | -70.1 | 160.2 | -7.4 | 110.7 | S192 E193 D195 F196 W205 A224 Q225 W318 D320 | S192-R203 PolarHBondContact O-NH1 2.66Å; E193-R203 PolarHBondContact O-NH1 2.79Å; D195-R203 PolarHBondContact O-NH1 2.71Å; D195-R203 PolarHBondContact O-NH2 2.77Å; F196-R203 HydrophobicContact CD1-CB 4.48Å; F196-R203 HydrophobicContact CE1-CB 3.81Å; R203-W205 HydrophobicContact CB-CE3 4.37Å; R203-W205 HydrophobicContact CB-CH2 3.78Å; R203-W205 HydrophobicContact CB-CZ3 3.56Å; R203-W205 HydrophobicContact CG-CD2 4.46Å; R203-W205 HydrophobicContact CG-CE3 4Å; R203-W205 HydrophobicContact CG-CH2 3.56Å; R203-W205 HydrophobicContact CG-CZ2 4.06Å; R203-W205 HydrophobicContact CG-CZ3 3.52Å; R203-W205 WeakPolarHBondContact O-CZ3 3.38Å; R203-A224 CarbonylContact O-C 3.46Å; R203-A224 WeakPolarHBondContact O-CA 3.41Å; R203-A224 WeakPolarHBondContact O-CB 3.17Å; R203-Q225 PolarHBondContact N-O 2.81Å; R203-Q225 PolarHBondContact O-N 3.25Å; R203-W318 HydrophobicContact CG-CB 4.28Å; R203-W318 HydrophobicContact CG-CE3 4.32Å; R203-D320 IonicContact CZ-OD1 2.68Å; R203-D320 IonicContact NE-OD1 3.87Å; R203-D320 PolarHBondContact NE-OD1 3.08Å; R203-D320 IonicContact NH2-OD1 2.77Å; R203-D320 PolarHBondContact NH2-OD1 3.43Å; R203-D320 VanDerWaalsContact NH2-OD1 3.12Å; R203-D320 IonicContact NH2-OD2 3.8Å |
| 204 | L | 96.7 | Very high | 87.3 | Confident | 0 Ų | 0 | 56.8 Ų | 56.8 | 0% | 0 | 32% | 0.316 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.4 | 130.8 | -179.1 | -172.8 | 68.9 | 0 | 0 | 0 | 110.5 | F206 L221 A224 F283 V300 W318 R319 L321 | L204-F206 HydrophobicContact CD2-CD1 4.42Å; L204-F206 HydrophobicContact CG-CD1 4.41Å; L204-L221 HydrophobicContact CD1-CD1 3.91Å; L204-A224 HydrophobicContact CD1-CB 3.87Å; L204-F283 HydrophobicContact CD2-CB 3.55Å; L204-F283 HydrophobicContact CD2-CD1 3.75Å; L204-F283 HydrophobicContact CD2-CD2 4.06Å; L204-F283 HydrophobicContact CD2-CE1 4.43Å; L204-F283 HydrophobicContact CD2-CG 3.53Å; L204-V300 HydrophobicContact CB-CG2 4.2Å; L204-V300 HydrophobicContact CD2-CG2 4.2Å; L204-W318 CarbonylContact O-C 3.6Å; L204-W318 VanDerWaalsContact O-CA 3.27Å; L204-W318 WeakPolarHBondContact O-CA 3.02Å; L204-R319 PolarHBondContact N-O 3.17Å; L204-R319 PolarHBondContact O-N 3.05Å; L204-L321 HydrophobicContact CB-CD1 4.11Å |
| 205 | W | 96.9 | Very high | 88.8 | Confident | 5 Ų | 5 | 55 Ų | 55 | 2% | 0.019 | 30% | 0.301 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108 | 130.4 | 172.8 | -71.6 | -112.7 | 0 | 0 | 0 | 109.9 | E193 R203 I222 K223 Q225 I317 W318 | E193-W205 HydrophobicContact CB-CZ2 4.46Å; E193-W205 HydrophobicContact CG-CZ2 4.36Å; E193-W205 PolarHBondContact OE1-NE1 3.42Å; R203-W205 HydrophobicContact CB-CE3 4.37Å; R203-W205 HydrophobicContact CB-CH2 3.78Å; R203-W205 HydrophobicContact CB-CZ3 3.56Å; R203-W205 HydrophobicContact CG-CD2 4.46Å; R203-W205 HydrophobicContact CG-CE3 4Å; R203-W205 HydrophobicContact CG-CH2 3.56Å; R203-W205 HydrophobicContact CG-CZ2 4.06Å; R203-W205 HydrophobicContact CG-CZ3 3.52Å; R203-W205 WeakPolarHBondContact O-CZ3 3.38Å; W205-I222 HydrophobicContact CB-CB 4.22Å; W205-I222 PolarHBondContact O-N 2.76Å; W205-K223 HydrophobicContact CB-CG 3.72Å; W205-K223 HydrophobicContact CD2-CD 4.14Å; W205-K223 HydrophobicContact CD2-CG 3.78Å; W205-K223 HydrophobicContact CE3-CD 4.28Å; W205-K223 HydrophobicContact CE3-CG 3.75Å; W205-K223 HydrophobicContact CG-CD 4.31Å; W205-K223 VanDerWaalsContact CG-CE 3.5Å; W205-K223 HydrophobicContact CG-CG 3.78Å; W205-K223 PolarHBondContact N-O 3.44Å; W205-K223 PolarHBondContact O-N 3.06Å; W205-Q225 HydrophobicContact CH2-CB 3.96Å; W205-Q225 HydrophobicContact CH2-CG 3.95Å; W205-Q225 HydrophobicContact CZ3-CB 3.7Å; W205-Q225 HydrophobicContact CZ3-CG 3.73Å; W205-I317 WeakPolarHBondContact CA-O 3.12Å; W205-W318 HydrophobicContact CD2-CB 4.02Å; W205-W318 HydrophobicContact CG-CB 3.98Å |
| 206 | F | 97.4 | Very high | 89.9 | Confident | 0 Ų | 0 | 54.8 Ų | 54.8 | 0% | 0 | 29% | 0.292 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -145.3 | 162.3 | 176.6 | 59.3 | -84.7 | 0 | 0 | 0 | 109.9 | L204 V208 G220 F283 V300 F302 I317 R319 | L204-F206 HydrophobicContact CD2-CD1 4.42Å; L204-F206 HydrophobicContact CG-CD1 4.41Å; F206-V208 HydrophobicContact CD2-CG1 3.98Å; F206-V208 HydrophobicContact CE2-CG1 4Å; F206-G220 CarbonylContact C-O 3.56Å; F206-G220 WeakPolarHBondContact CA-O 3.34Å; F206-G220 WeakPolarHBondContact CB-O 3.32Å; F206-F283 HydrophobicContact CB-CE1 4.08Å; F206-F283 HydrophobicContact CB-CE2 4.42Å; F206-F283 HydrophobicContact CB-CZ 3.66Å; F206-F283 HydrophobicContact CD1-CD2 4.44Å; F206-F283 AromaticContact CD1-CE2 3.76Å; F206-F283 HydrophobicContact CD1-CE2 3.76Å; F206-F283 AromaticContact CD1-CZ 3.87Å; F206-F283 HydrophobicContact CD1-CZ 3.87Å; F206-F283 AromaticContact CD2-CE2 3.75Å; F206-F283 HydrophobicContact CD2-CE2 3.75Å; F206-F283 AromaticContact CD2-CZ 3.56Å; F206-F283 HydrophobicContact CD2-CZ 3.56Å; F206-F283 HydrophobicContact CE1-CD2 4.46Å; F206-F283 AromaticContact CE1-CE2 3.88Å; F206-F283 HydrophobicContact CE1-CE2 3.88Å; F206-F283 HydrophobicContact CE1-CZ 4.43Å; F206-F283 AromaticContact CE2-CE2 3.86Å; F206-F283 HydrophobicContact CE2-CE2 3.86Å; F206-F283 HydrophobicContact CE2-CZ 4.15Å; F206-F283 HydrophobicContact CG-CE1 4.24Å; F206-F283 AromaticContact CG-CE2 3.7Å; F206-F283 HydrophobicContact CG-CE2 3.7Å; F206-F283 AromaticContact CG-CZ 3.4Å; F206-F283 HydrophobicContact CG-CZ 3.4Å; F206-F283 VanDerWaalsContact CG-CZ 3.4Å; F206-F283 AromaticContact CZ-CE2 3.93Å; F206-F283 HydrophobicContact CZ-CE2 3.93Å; F206-V300 HydrophobicContact CE1-CG1 4.16Å; F206-F302 HydrophobicContact CE2-CB 4.32Å; F206-F302 HydrophobicContact CE2-CD1 4.06Å; F206-F302 HydrophobicContact CE2-CD2 4.31Å; F206-F302 AromaticContact CE2-CG 3.95Å; F206-F302 HydrophobicContact CE2-CG 3.95Å; F206-F302 HydrophobicContact CZ-CB 3.97Å; F206-F302 HydrophobicContact CZ-CD1 4.39Å; F206-F302 AromaticContact CZ-CD2 3.89Å; F206-F302 HydrophobicContact CZ-CD2 3.89Å; F206-F302 AromaticContact CZ-CG 3.8Å; F206-F302 HydrophobicContact CZ-CG 3.8Å; F206-I317 HydrophobicContact CE1-CG2 4.45Å; F206-I317 HydrophobicContact CE2-CB 4.13Å; F206-I317 HydrophobicContact CE2-CD1 4.48Å; F206-I317 HydrophobicContact CE2-CG2 4.4Å; F206-I317 HydrophobicContact CZ-CB 4.13Å; F206-I317 HydrophobicContact CZ-CG2 3.96Å; F206-I317 PolarHBondContact N-O 3.19Å; F206-I317 PolarHBondContact O-N 3.48Å; F206-R319 HydrophobicContact CE1-CB 4.39Å; F206-R319 HydrophobicContact CE1-CG 4.14Å; F206-R319 HydrophobicContact CZ-CG 4.35Å |
| 207 | S | 95.6 | Very high | 90.8 | Very high | 3 Ų | 3 | 52.5 Ų | 52.5 | 2% | 0.021 | 28% | 0.282 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117 | 144.6 | 170.6 | 62.2 | 0 | 0 | 0 | 0 | 111.2 | V219 G220 R314 R315 | S207-V219 WeakPolarHBondContact O-CA 3.23Å; S207-G220 PolarHBondContact N-O 3.17Å; S207-G220 PolarHBondContact O-N 2.74Å; S207-G220 WeakPolarHBondContact OG-CA 3.27Å; S207-G220 PolarHBondContact OG-N 3.24Å; S207-R314 PolarHBondContact OG-NE 3.09Å; S207-R314 PolarHBondContact OG-NH2 3.1Å; S207-R314 VanDerWaalsContact OG-NH2 3.17Å; S207-R315 CarbonylContact C-O 3.52Å; S207-R315 WeakPolarHBondContact CA-O 3.48Å; S207-R315 WeakPolarHBondContact CB-O 3.43Å |
| 208 | V | 95.1 | Very high | 91.8 | Very high | 2 Ų | 2 | 50.7 Ų | 50.7 | 1% | 0.012 | 27% | 0.268 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122 | 144.1 | 172.4 | -65.4 | 0 | 0 | 0 | 0 | 110.5 | F206 L281 F302 L304 L309 R315 I317 | F206-V208 HydrophobicContact CD2-CG1 3.98Å; F206-V208 HydrophobicContact CE2-CG1 4Å; V208-L281 HydrophobicContact CG1-CD2 3.87Å; V208-F302 HydrophobicContact CG1-CD1 4.46Å; V208-F302 HydrophobicContact CG1-CE1 4.35Å; V208-F302 HydrophobicContact CG2-CE1 4.15Å; V208-L304 HydrophobicContact CG1-CD2 4.31Å; V208-L309 HydrophobicContact CG2-CD2 4.42Å; V208-R315 PolarHBondContact N-O 2.88Å; V208-R315 PolarHBondContact O-N 2.99Å; V208-I317 HydrophobicContact CG2-CD1 3.78Å |
| 209 | E | 93.3 | Very high | 93 | Very high | 53 Ų | 53 | 42.4 Ų | 42.4 | 25% | 0.248 | 22% | 0.224 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -156.5 | 140.8 | 179.5 | -178.3 | 164.8 | -135.8 | 0 | 0 | 107.7 | L218 R314 | E209-L218 HydrophobicContact CB-CB 4.21Å; E209-L218 HydrophobicContact CG-CD1 4.33Å; E209-L218 PolarHBondContact N-O 3.04Å; E209-L218 VanDerWaalsContact N-O 3.12Å; E209-L218 PolarHBondContact O-N 2.87Å; E209-R314 HydrophobicContact CB-CB 4.47Å; E209-R314 PolarHBondContact OE1-N 3.05Å; E209-R314 WeakPolarHBondContact OE2-CB 3.42Å |
| 210 | Y | 93.3 | Very high | 94 | Very high | 23 Ų | 23 | 38.9 Ų | 38.9 | 9% | 0.09 | 19% | 0.187 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -127.6 | 108.7 | -176.5 | -178.3 | -105.5 | 0 | 0 | 0 | 110.9 | Q212 E215 R216 L217 V271 S273 I276 L309 | Y210-Q212 HydrophobicContact CD1-CB 4.28Å; Y210-Q212 HydrophobicContact CE1-CB 3.9Å; Y210-Q212 HydrophobicContact CE1-CG 4.33Å; Y210-Q212 PolarHBondContact O-N 2.77Å; Y210-E215 WeakPolarHBondContact OH-CA 3.26Å; Y210-R216 CarbonylContact C-O 3.49Å; Y210-R216 WeakPolarHBondContact CA-O 3.46Å; Y210-R216 VanDerWaalsContact CD2-O 3.29Å; Y210-R216 WeakPolarHBondContact CD2-O 3.48Å; Y210-L217 HydrophobicContact CD2-CB 4.14Å; Y210-L217 HydrophobicContact CD2-CD1 4.49Å; Y210-V271 HydrophobicContact CE2-CG1 4.1Å; Y210-V271 PolarHBondContact OH-O 3.02Å; Y210-V271 VanDerWaalsContact OH-O 3.05Å; Y210-S273 WeakPolarHBondContact OH-CA 3.35Å; Y210-S273 PolarHBondContact OH-N 3.01Å; Y210-I276 HydrophobicContact CD2-CD1 4.29Å; Y210-I276 HydrophobicContact CD2-CG1 3.89Å; Y210-I276 HydrophobicContact CE1-CG2 4.22Å; Y210-I276 HydrophobicContact CE2-CB 4.27Å; Y210-I276 HydrophobicContact CE2-CD1 4.42Å; Y210-I276 HydrophobicContact CE2-CG1 4.02Å; Y210-I276 HydrophobicContact CG-CG1 4.31Å; Y210-L309 HydrophobicContact CG-CD1 4.41Å |
| 211 | E | 92.2 | Very high | 94.6 | Very high | 79 Ų | 79 | 38 Ų | 38 | 37% | 0.369 | 18% | 0.181 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -78.2 | 96 | 173.8 | -63.7 | 177.2 | 158.2 | 0 | 0 | 108.5 | E213 A214 E215 R216 L218 | E211-E213 VanDerWaalsContact C-N 3.32Å; E211-E213 PolarHBondContact O-N 3.17Å; E211-A214 HydrophobicContact CB-CB 4.05Å; E211-A214 PolarHBondContact O-N 3.35Å; E211-E215 PolarHBondContact O-N 3.48Å; E211-R216 HydrophobicContact CB-CB 4.41Å; E211-R216 PolarHBondContact N-O 2.98Å; E211-R216 PolarHBondContact O-N 2.91Å; E211-R216 VanDerWaalsContact O-N 3.11Å; E211-L218 HydrophobicContact CG-CD1 4.15Å; E211-L218 HydrophobicContact CG-CG 4.38Å |
| 212 | Q | 90.3 | Very high | 95 | Very high | 130 Ų | 130 | 37.1 Ų | 37.1 | 61% | 0.607 | 18% | 0.176 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -61.6 | -39.6 | -177.5 | 179 | 170.9 | -27.4 | 0 | 0 | 112.5 | Y210 E215 | Y210-Q212 HydrophobicContact CD1-CB 4.28Å; Y210-Q212 HydrophobicContact CE1-CB 3.9Å; Y210-Q212 HydrophobicContact CE1-CG 4.33Å; Y210-Q212 PolarHBondContact O-N 2.77Å; Q212-E215 PolarHBondContact O-N 2.84Å |
| 213 | E | 91.2 | Very high | 95.2 | Very high | 205 Ų | 205 | 38.7 Ų | 38.7 | 96% | 0.958 | 18% | 0.183 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -66.2 | -37.3 | -178.4 | -58.3 | -177.8 | 159.2 | 0 | 0 | 112.7 | E211 | E211-E213 VanDerWaalsContact C-N 3.32Å; E211-E213 PolarHBondContact O-N 3.17Å |
| 214 | A | 93.6 | Very high | 95.2 | Very high | 37 Ų | 37 | 38.4 Ų | 38.4 | 31% | 0.306 | 18% | 0.182 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -88.7 | -5.6 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | E211 R216 Q270 | E211-A214 HydrophobicContact CB-CB 4.05Å; E211-A214 PolarHBondContact O-N 3.35Å; A214-R216 VanDerWaalsContact C-N 3.35Å; A214-R216 HydrophobicContact CB-CB 4.37Å; A214-R216 HydrophobicContact CB-CG 4.25Å; A214-R216 PolarHBondContact O-N 3.25Å; A214-Q270 PolarHBondContact O-NE2 3.41Å |
| 215 | E | 94.1 | Very high | 95.1 | Very high | 64 Ų | 64 | 40.7 Ų | 40.7 | 30% | 0.299 | 19% | 0.193 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 48.8 | 48.8 | -168.3 | -63.3 | -153.5 | 122.4 | 0 | 0 | 113.5 | Y210 E211 Q212 Q270 V271 S272 S273 | Y210-E215 WeakPolarHBondContact OH-CA 3.26Å; E211-E215 PolarHBondContact O-N 3.48Å; Q212-E215 PolarHBondContact O-N 2.84Å; E215-Q270 PolarHBondContact O-NE2 3.02Å; E215-V271 CarbonylContact C-O 3.53Å; E215-V271 PolarHBondContact O-N 2.78Å; E215-V271 VanDerWaalsContact O-O 3.07Å; E215-S272 VanDerWaalsContact CD-CA 3.47Å; E215-S272 WeakPolarHBondContact OE1-CA 3.47Å; E215-S272 VanDerWaalsContact OE1-CB 3.24Å; E215-S272 WeakPolarHBondContact OE1-CB 3.2Å; E215-S272 PolarHBondContact OE1-OG 3.39Å; E215-S272 WeakPolarHBondContact OE2-CB 3.49Å; E215-S273 PolarHBondContact OE1-N 2.84Å; E215-S273 PolarHBondContact OE1-OG 3.47Å; E215-S273 VanDerWaalsContact OE1-OG 3.1Å |
| 216 | R | 94.8 | Very high | 94.8 | Very high | 106 Ų | 106 | 44.5 Ų | 44.5 | 40% | 0.4 | 21% | 0.21 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -127.1 | 130.4 | -174.6 | -76 | 170.4 | -172.1 | 169.3 | 7.3 | 112.8 | Y210 E211 A214 I268 F269 | Y210-R216 CarbonylContact C-O 3.49Å; Y210-R216 WeakPolarHBondContact CA-O 3.46Å; Y210-R216 VanDerWaalsContact CD2-O 3.29Å; Y210-R216 WeakPolarHBondContact CD2-O 3.48Å; E211-R216 HydrophobicContact CB-CB 4.41Å; E211-R216 PolarHBondContact N-O 2.98Å; E211-R216 PolarHBondContact O-N 2.91Å; E211-R216 VanDerWaalsContact O-N 3.11Å; A214-R216 VanDerWaalsContact C-N 3.35Å; A214-R216 HydrophobicContact CB-CB 4.37Å; A214-R216 HydrophobicContact CB-CG 4.25Å; A214-R216 PolarHBondContact O-N 3.25Å; R216-I268 HydrophobicContact CB-CG2 4.05Å; R216-I268 HydrophobicContact CG-CG2 3.91Å; R216-F269 WeakPolarHBondContact CA-O 3.49Å |
| 217 | L | 95.1 | Very high | 94.6 | Very high | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 21% | 0.212 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -92.6 | 115.1 | 166.1 | 178.4 | 76.3 | 0 | 0 | 0 | 109 | Y210 V219 L242 I268 F269 V271 I276 L304 L309 | Y210-L217 HydrophobicContact CD2-CB 4.14Å; Y210-L217 HydrophobicContact CD2-CD1 4.49Å; L217-V219 HydrophobicContact CD2-CG2 3.89Å; L217-V219 HydrophobicContact CG-CG2 3.93Å; L217-L242 HydrophobicContact CD2-CD1 3.96Å; L217-I268 WeakPolarHBondContact O-CA 3.39Å; L217-F269 HydrophobicContact CB-CB 4.36Å; L217-F269 HydrophobicContact CD2-CD2 4.29Å; L217-F269 PolarHBondContact N-O 2.78Å; L217-F269 PolarHBondContact O-N 2.86Å; L217-V271 HydrophobicContact CB-CG1 3.85Å; L217-I276 HydrophobicContact CB-CD1 4.35Å; L217-I276 HydrophobicContact CD1-CD1 4.35Å; L217-I276 HydrophobicContact CD2-CD1 4.35Å; L217-L304 HydrophobicContact CD1-CD1 4.23Å; L217-L304 HydrophobicContact CD1-CD2 4.26Å; L217-L304 HydrophobicContact CD2-CD1 3.53Å; L217-L309 HydrophobicContact CD1-CD2 4.36Å |
| 218 | L | 95.8 | Very high | 94.2 | Very high | 34 Ų | 34 | 50.3 Ų | 50.3 | 18% | 0.178 | 24% | 0.237 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -87.1 | 130.4 | 169.8 | -51.8 | 179.7 | 0 | 0 | 0 | 109.2 | E209 E211 I268 | E209-L218 HydrophobicContact CB-CB 4.21Å; E209-L218 HydrophobicContact CG-CD1 4.33Å; E209-L218 PolarHBondContact N-O 3.04Å; E209-L218 VanDerWaalsContact N-O 3.12Å; E209-L218 PolarHBondContact O-N 2.87Å; E211-L218 HydrophobicContact CG-CD1 4.15Å; E211-L218 HydrophobicContact CG-CG 4.38Å; L218-I268 HydrophobicContact CD2-CB 4.49Å; L218-I268 HydrophobicContact CD2-CD1 3.92Å; L218-I268 HydrophobicContact CD2-CG1 3.76Å; L218-I268 HydrophobicContact CD2-CG2 4.21Å |
| 219 | V | 97.4 | Very high | 93.5 | Very high | 0 Ų | 0 | 51.5 Ų | 51.5 | 0% | 0 | 25% | 0.247 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -126.6 | 116 | 176.7 | -175.9 | 0 | 0 | 0 | 0 | 109.3 | S207 L217 L240 F267 F269 L281 F283 | S207-V219 WeakPolarHBondContact O-CA 3.23Å; L217-V219 HydrophobicContact CD2-CG2 3.89Å; L217-V219 HydrophobicContact CG-CG2 3.93Å; V219-L240 HydrophobicContact CB-CD2 4.34Å; V219-L240 HydrophobicContact CG1-CD2 3.75Å; V219-F267 HydrophobicContact CB-CB 4.4Å; V219-F267 PolarHBondContact N-O 3.25Å; V219-F267 PolarHBondContact O-N 3.37Å; V219-F269 HydrophobicContact CG2-CD2 4.13Å; V219-F269 HydrophobicContact CG2-CE2 4.2Å; V219-L281 HydrophobicContact CG1-CD2 3.87Å; V219-L281 HydrophobicContact CG2-CD1 4.1Å; V219-L281 HydrophobicContact CG2-CD2 3.76Å; V219-F283 HydrophobicContact CG1-CE1 4.03Å; V219-F283 HydrophobicContact CG1-CZ 3.82Å |
| 220 | G | 97.6 | Very high | 92.7 | Very high | 1 Ų | 1 | 53.4 Ų | 53.4 | 1% | 0.01 | 27% | 0.265 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.5 | 116 | 172.6 | 0 | 0 | 0 | 0 | 0 | 110.2 | F206 S207 | F206-G220 CarbonylContact C-O 3.56Å; F206-G220 WeakPolarHBondContact CA-O 3.34Å; F206-G220 WeakPolarHBondContact CB-O 3.32Å; S207-G220 PolarHBondContact N-O 3.17Å; S207-G220 PolarHBondContact O-N 2.74Å; S207-G220 WeakPolarHBondContact OG-CA 3.27Å; S207-G220 PolarHBondContact OG-N 3.24Å |
| 221 | L | 98.3 | Very high | 91.7 | Very high | 1 Ų | 1 | 55.3 Ų | 55.3 | 1% | 0.005 | 28% | 0.281 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.9 | 109.4 | 170.9 | -177.4 | 70.5 | 0 | 0 | 0 | 108.4 | L204 V238 F263 D264 E265 F267 F283 | L204-L221 HydrophobicContact CD1-CD1 3.91Å; L221-V238 HydrophobicContact CD1-CB 4.39Å; L221-V238 HydrophobicContact CD1-CG1 4.17Å; L221-V238 HydrophobicContact CD1-CG2 4.28Å; L221-V238 HydrophobicContact CD2-CB 3.83Å; L221-V238 HydrophobicContact CD2-CG1 4.38Å; L221-V238 HydrophobicContact CD2-CG2 3.97Å; L221-F263 HydrophobicContact CB-CB 4.38Å; L221-F263 HydrophobicContact CD1-CD2 4.44Å; L221-F263 HydrophobicContact CD2-CB 3.76Å; L221-F263 HydrophobicContact CD2-CD1 3.79Å; L221-F263 HydrophobicContact CD2-CD2 3.94Å; L221-F263 HydrophobicContact CD2-CE1 4.4Å; L221-F263 HydrophobicContact CD2-CE2 4.5Å; L221-F263 HydrophobicContact CD2-CG 3.55Å; L221-F263 HydrophobicContact CG-CB 3.74Å; L221-F263 HydrophobicContact CG-CD2 3.91Å; L221-F263 HydrophobicContact CG-CG 3.82Å; L221-F263 WeakPolarHBondContact O-CB 3.41Å; L221-D264 WeakPolarHBondContact O-CA 3.44Å; L221-D264 PolarHBondContact O-N 3Å; L221-E265 PolarHBondContact N-O 3.34Å; L221-E265 PolarHBondContact O-N 3.31Å; L221-F267 HydrophobicContact CB-CD2 4.26Å; L221-F267 HydrophobicContact CB-CE2 3.78Å; L221-F267 HydrophobicContact CD2-CE2 4.09Å; L221-F283 HydrophobicContact CD1-CD1 4.18Å; L221-F283 HydrophobicContact CD1-CE1 4.14Å |
| 222 | I | 97.8 | Very high | 90.7 | Very high | 31 Ų | 31 | 61.2 Ų | 61.2 | 16% | 0.159 | 31% | 0.309 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.2 | -79.2 | -169.5 | -55.2 | 166.6 | 0 | 0 | 0 | 109.7 | W205 F263 D264 V316 | W205-I222 HydrophobicContact CB-CB 4.22Å; W205-I222 PolarHBondContact O-N 2.76Å; I222-F263 WeakPolarHBondContact O-CA 3.39Å; I222-F263 WeakPolarHBondContact O-CB 3.44Å; I222-F263 PolarHBondContact O-N 2.8Å; I222-D264 PolarHBondContact O-N 3.36Å; I222-D264 VanDerWaalsContact O-N 3.17Å; I222-V316 HydrophobicContact CD1-CG1 3.81Å; I222-V316 HydrophobicContact CD1-CG2 4.08Å |
| 223 | K | 97 | Very high | 90.2 | Very high | 33 Ų | 33 | 57.6 Ų | 57.6 | 14% | 0.143 | 30% | 0.296 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.6 | 159.2 | -174.9 | 64.8 | 177.2 | -175.9 | 178.6 | 0 | 111.2 | E193 W205 P261 | E193-K223 IonicContact OE1-NZ 2.73Å; E193-K223 IonicContact OE2-NZ 2.67Å; E193-K223 PolarHBondContact OE2-NZ 2.88Å; W205-K223 HydrophobicContact CB-CG 3.72Å; W205-K223 HydrophobicContact CD2-CD 4.14Å; W205-K223 HydrophobicContact CD2-CG 3.78Å; W205-K223 HydrophobicContact CE3-CD 4.28Å; W205-K223 HydrophobicContact CE3-CG 3.75Å; W205-K223 HydrophobicContact CG-CD 4.31Å; W205-K223 VanDerWaalsContact CG-CE 3.5Å; W205-K223 HydrophobicContact CG-CG 3.78Å; W205-K223 PolarHBondContact N-O 3.44Å; W205-K223 PolarHBondContact O-N 3.06Å; K223-P261 CarbonylContact C-O 3.32Å; K223-P261 VanDerWaalsContact CA-O 3.32Å; K223-P261 WeakPolarHBondContact CA-O 3.25Å |
| 224 | A | 96.4 | Very high | 90 | Very high | 0 Ų | 0 | 48.1 Ų | 48.1 | 0% | 0 | 25% | 0.252 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.8 | 155.4 | 157 | 0 | 0 | 0 | 0 | 0 | 109.8 | R203 L204 L227 N260 P261 F263 | R203-A224 CarbonylContact O-C 3.46Å; R203-A224 WeakPolarHBondContact O-CA 3.41Å; R203-A224 WeakPolarHBondContact O-CB 3.17Å; L204-A224 HydrophobicContact CD1-CB 3.87Å; A224-L227 HydrophobicContact CB-CD1 3.99Å; A224-L227 HydrophobicContact CB-CD2 4.02Å; A224-L227 HydrophobicContact CB-CG 4.04Å; A224-N260 CarbonylContact O-C 3.58Å; A224-N260 VanDerWaalsContact O-C 3.32Å; A224-N260 VanDerWaalsContact O-CA 3.27Å; A224-N260 WeakPolarHBondContact O-CA 3.24Å; A224-P261 HydrophobicContact CB-CG 3.82Å; A224-P261 PolarHBondContact N-O 2.94Å; A224-P261 WeakPolarHBondContact O-CD 3.46Å; A224-F263 HydrophobicContact CB-CE2 4.29Å |
| 225 | Q | 94.1 | Very high | 90 | Very high | 47 Ų | 47 | 47.4 Ų | 47.4 | 22% | 0.22 | 25% | 0.245 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -135.4 | 154.4 | 176.7 | -65.7 | -177.3 | -31.2 | 0 | 0 | 111.3 | F196 G202 R203 W205 L227 N260 | F196-Q225 HydrophobicContact CE1-CB 4.48Å; F196-Q225 HydrophobicContact CZ-CB 4.24Å; G202-Q225 CarbonylContact C-O 3.32Å; G202-Q225 WeakPolarHBondContact CA-O 3.47Å; R203-Q225 PolarHBondContact N-O 2.81Å; R203-Q225 PolarHBondContact O-N 3.25Å; W205-Q225 HydrophobicContact CH2-CB 3.96Å; W205-Q225 HydrophobicContact CH2-CG 3.95Å; W205-Q225 HydrophobicContact CZ3-CB 3.7Å; W205-Q225 HydrophobicContact CZ3-CG 3.73Å; Q225-L227 PolarHBondContact O-N 2.71Å; Q225-N260 VanDerWaalsContact CA-OD1 3.23Å; Q225-N260 WeakPolarHBondContact CA-OD1 3.48Å |
| 226 | H | 91.2 | Very high | 90.1 | Very high | 85 Ų | 85 | 44.3 Ų | 44.3 | 39% | 0.394 | 23% | 0.23 | S | C | . | . | S | Bend | trans | 52.4 | 35.6 | 176.5 | -62.2 | 171.6 | 0 | 0 | 0 | 114 | F196 G202 Q228 S259 N260 | F196-H226 HydrophobicContact CD1-CB 4.14Å; F196-H226 AromaticContact CD1-ND1 3.55Å; F196-H226 AromaticContact CD2-CE1 3.47Å; F196-H226 VanDerWaalsContact CD2-CE1 3.47Å; F196-H226 WeakPolarHBondContact CD2-CE1 3.43Å; F196-H226 AromaticContact CD2-ND1 3.12Å; F196-H226 WeakPolarHBondContact CD2-ND1 3.39Å; F196-H226 HydrophobicContact CE1-CB 4.01Å; F196-H226 AromaticContact CE1-CG 3.93Å; F196-H226 AromaticContact CE1-ND1 3.49Å; F196-H226 WeakPolarHBondContact CE1-ND1 3.41Å; F196-H226 AromaticContact CE2-CE1 3.21Å; F196-H226 WeakPolarHBondContact CE2-CE1 3.11Å; F196-H226 AromaticContact CE2-ND1 3.09Å; F196-H226 WeakPolarHBondContact CE2-ND1 3.49Å; F196-H226 AromaticContact CG-ND1 3.38Å; F196-H226 WeakPolarHBondContact CG-ND1 3.15Å; F196-H226 HydrophobicContact CZ-CB 4.49Å; F196-H226 AromaticContact CZ-CE1 3.7Å; F196-H226 AromaticContact CZ-CG 3.93Å; F196-H226 AromaticContact CZ-ND1 3.28Å; F196-H226 VanDerWaalsContact CZ-ND1 3.28Å; F196-H226 WeakPolarHBondContact CZ-ND1 3.4Å; G202-H226 WeakPolarHBondContact CA-O 3.43Å; G202-H226 PolarHBondContact N-O 3.12Å; H226-Q228 PolarHBondContact O-N 3.23Å; H226-S259 PolarHBondContact N-O 3.36Å; H226-N260 PolarHBondContact N-OD1 2.81Å |
| 227 | L | 92.8 | Very high | 90.1 | Very high | 5 Ų | 5 | 39.3 Ų | 39.3 | 3% | 0.026 | 21% | 0.212 | C | C | . | . | trans | -62.9 | 111.4 | 176.2 | -65.7 | -178.8 | 0 | 0 | 0 | 110.5 | A224 Q225 A229 P236 S259 P261 V285 L297 L321 | A224-L227 HydrophobicContact CB-CD1 3.99Å; A224-L227 HydrophobicContact CB-CD2 4.02Å; A224-L227 HydrophobicContact CB-CG 4.04Å; Q225-L227 PolarHBondContact O-N 2.71Å; L227-A229 PolarHBondContact O-N 2.83Å; L227-P236 HydrophobicContact CD1-CB 3.58Å; L227-P236 HydrophobicContact CD1-CG 4.06Å; L227-S259 WeakPolarHBondContact CB-O 3.24Å; L227-S259 WeakPolarHBondContact CG-O 3.12Å; L227-S259 PolarHBondContact N-O 2.95Å; L227-S259 WeakPolarHBondContact O-CB 3.4Å; L227-P261 HydrophobicContact CD1-CG 3.79Å; L227-V285 HydrophobicContact CD1-CG1 4.06Å; L227-V285 HydrophobicContact CD2-CG1 4.06Å; L227-L297 HydrophobicContact CB-CD1 4.28Å; L227-L321 HydrophobicContact CD2-CD1 4Å; L227-L321 HydrophobicContact CD2-CD2 3.85Å | ||
| 228 | Q | 87.9 | Confident | 90.3 | Very high | 120 Ų | 120 | 39.3 Ų | 39.3 | 56% | 0.561 | 21% | 0.212 | S | C | * | . | trans | -73.9 | 115.2 | 175.4 | -65 | -61.4 | -23.5 | 0 | 0 | 109.3 | C200 L201 H226 L297 | C200-Q228 VanDerWaalsContact O-CG 3.3Å; C200-Q228 WeakPolarHBondContact O-CG 3.48Å; L201-Q228 PolarHBondContact O-N 2.71Å; H226-Q228 PolarHBondContact O-N 3.23Å; Q228-L297 WeakPolarHBondContact O-CD2 3.41Å | ||
| 229 | A | 80.3 | Confident | 90.4 | Very high | 27 Ų | 27 | 39.2 Ų | 39.2 | 22% | 0.223 | 21% | 0.21 | C | C | . | . | trans | -116 | 140.5 | 178.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | L227 S231 C234 L297 | L227-A229 PolarHBondContact O-N 2.83Å; A229-S231 PolarHBondContact O-N 2.91Å; A229-C234 HydrophobicContact CB-CB 3.55Å; A229-L297 HydrophobicContact CB-CD2 4.5Å | ||
| 230 | P | 76 | Confident | 90.4 | Very high | 94 Ų | 94 | 39.2 Ų | 39.2 | 61% | 0.61 | 21% | 0.21 | S | C | * | . | S | Bend | trans | -67.7 | 5.1 | 177.1 | -26 | 38.8 | 0 | 0 | 0 | 115.8 | ||
| 231 | S | 71.8 | Confident | 90.3 | Very high | 63 Ų | 63 | 40.4 Ų | 40.4 | 44% | 0.441 | 21% | 0.214 | S | C | . | . | S | Bend | trans | -137.8 | 146.4 | -179 | -174.1 | 0 | 0 | 0 | 0 | 109.7 | A229 T233 | A229-S231 PolarHBondContact O-N 2.91Å; S231-T233 PolarHBondContact O-N 2.85Å |
| 232 | E | 70.4 | Confident | 90.1 | Very high | 203 Ų | 203 | 41 Ų | 41 | 95% | 0.949 | 22% | 0.217 | S | C | * | . | S | Bend | trans | -48.5 | -26.2 | -177.6 | -60.6 | 177.4 | 161.8 | 0 | 0 | 114.8 | ||
| 233 | T | 80.4 | Confident | 89.8 | Confident | 53 Ų | 53 | 40.2 Ų | 40.2 | 33% | 0.325 | 21% | 0.213 | S | C | . | . | S | Bend | trans | -124.8 | 111 | 176.1 | 64.3 | 0 | 0 | 0 | 0 | 111.5 | S231 K257 H287 | S231-T233 PolarHBondContact O-N 2.85Å; T233-K257 HydrophobicContact CG2-CB 4.49Å; T233-K257 HydrophobicContact CG2-CD 4.41Å; T233-K257 HydrophobicContact CG2-CG 4.32Å; T233-H287 PolarHBondContact O-CE1 2.92Å; T233-H287 VanDerWaalsContact O-CE1 3.25Å |
| 234 | C | 87.1 | Confident | 89.1 | Confident | 6 Ų | 6 | 41.8 Ų | 41.8 | 4% | 0.041 | 23% | 0.227 | C | C | . | . | trans | -76.1 | 136.9 | 174.3 | -170.1 | 0 | 0 | 0 | 0 | 112.1 | A229 K257 T258 | A229-C234 HydrophobicContact CB-CB 3.55Å; C234-K257 CarbonylContact O-C 3.58Å; C234-K257 VanDerWaalsContact O-C 3.32Å; C234-K257 WeakPolarHBondContact O-CA 3.36Å; C234-K257 PolarHBondContact O-N 2.81Å; C234-T258 WeakPolarHBondContact CB-O 3.48Å; C234-T258 PolarHBondContact O-N 3.45Å | ||
| 235 | S | 93.6 | Very high | 88.5 | Confident | 22 Ų | 22 | 44.4 Ų | 44.4 | 15% | 0.154 | 24% | 0.241 | C | C | . | . | trans | -119.9 | 85.1 | 166.9 | -62.1 | 0 | 0 | 0 | 0 | 109.7 | K255 K257 H287 V288 | S235-K255 CarbonylContact C-O 3.51Å; S235-K255 WeakPolarHBondContact CA-O 3.05Å; S235-K255 WeakPolarHBondContact CB-O 3.37Å; S235-K257 PolarHBondContact OG-N 2.82Å; S235-H287 PolarHBondContact N-ND1 2.83Å; S235-V288 WeakPolarHBondContact CB-O 3.47Å; S235-V288 PolarHBondContact O-N 3.06Å | ||
| 236 | P | 95.6 | Very high | 87.9 | Confident | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 25% | 0.253 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.8 | 145.4 | -167.3 | 29.4 | -35.1 | 0 | 0 | 0 | 113.5 | L227 T254 K255 T258 P261 F263 Y286 | L227-P236 HydrophobicContact CD1-CB 3.58Å; L227-P236 HydrophobicContact CD1-CG 4.06Å; P236-T254 WeakPolarHBondContact O-CA 3.43Å; P236-K255 VanDerWaalsContact CD-O 3.31Å; P236-K255 WeakPolarHBondContact CD-O 3.1Å; P236-K255 HydrophobicContact CG-CB 4.24Å; P236-K255 PolarHBondContact O-N 2.81Å; P236-T258 VanDerWaalsContact CD-O 3.26Å; P236-T258 WeakPolarHBondContact CD-O 3.3Å; P236-T258 HydrophobicContact CG-CG2 4.4Å; P236-T258 WeakPolarHBondContact CG-O 3.44Å; P236-P261 HydrophobicContact CB-CG 4.15Å; P236-P261 HydrophobicContact CG-CB 3.66Å; P236-P261 HydrophobicContact CG-CG 3.54Å; P236-F263 HydrophobicContact CB-CZ 4.37Å; P236-Y286 CarbonylContact C-O 3.49Å; P236-Y286 VanDerWaalsContact CA-O 3.28Å; P236-Y286 WeakPolarHBondContact CA-O 3.41Å |
| 237 | L | 96.6 | Very high | 87.5 | Confident | 1 Ų | 1 | 54.3 Ų | 54.3 | 1% | 0.005 | 28% | 0.277 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.3 | 133.4 | 179.5 | 175.9 | 68.2 | 0 | 0 | 0 | 108.6 | Q251 S252 T254 Y286 V288 H294 | L237-Q251 HydrophobicContact CD1-CG 3.75Å; L237-Q251 HydrophobicContact CD2-CG 4.34Å; L237-Q251 HydrophobicContact CG-CG 4.16Å; L237-S252 WeakPolarHBondContact CD1-O 3.18Å; L237-T254 HydrophobicContact CB-CG2 4.45Å; L237-Y286 PolarHBondContact N-O 2.81Å; L237-Y286 PolarHBondContact O-N 3.05Å; L237-V288 HydrophobicContact CB-CG2 3.76Å; L237-V288 HydrophobicContact CD2-CG2 3.75Å; L237-V288 HydrophobicContact CG-CG2 4.4Å; L237-H294 WeakPolarHBondContact CD2-CE1 3.41Å |
| 238 | V | 98 | Very high | 87.3 | Confident | 0 Ų | 0 | 63.2 Ų | 63.2 | 0% | 0 | 31% | 0.31 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.2 | 132.7 | 179.4 | -169.9 | 0 | 0 | 0 | 0 | 110.4 | L221 L240 Q251 S252 F263 F283 S284 V285 | L221-V238 HydrophobicContact CD1-CB 4.39Å; L221-V238 HydrophobicContact CD1-CG1 4.17Å; L221-V238 HydrophobicContact CD1-CG2 4.28Å; L221-V238 HydrophobicContact CD2-CB 3.83Å; L221-V238 HydrophobicContact CD2-CG1 4.38Å; L221-V238 HydrophobicContact CD2-CG2 3.97Å; V238-L240 HydrophobicContact CB-CD1 4.48Å; V238-L240 HydrophobicContact CG1-CD1 4.07Å; V238-Q251 WeakPolarHBondContact O-CA 3.49Å; V238-S252 PolarHBondContact N-OG 2.92Å; V238-S252 PolarHBondContact O-N 3.12Å; V238-F263 HydrophobicContact CG2-CE1 4.08Å; V238-F263 HydrophobicContact CG2-CE2 3.85Å; V238-F263 HydrophobicContact CG2-CZ 3.57Å; V238-F283 HydrophobicContact CG1-CB 4.1Å; V238-F283 HydrophobicContact CG1-CD1 3.99Å; V238-S284 WeakPolarHBondContact CA-O 3.26Å; V238-V285 HydrophobicContact CG1-CG2 4.39Å; V238-V285 HydrophobicContact CG2-CG1 4.42Å; V238-V285 HydrophobicContact CG2-CG2 4.17Å |
| 239 | K | 97.8 | Very high | 87.7 | Confident | 31 Ų | 31 | 61.6 Ų | 61.6 | 14% | 0.135 | 30% | 0.302 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.1 | 136.2 | 165.4 | -67.9 | -173.4 | 177.3 | -171.6 | 0 | 109.9 | Y241 F249 L250 Q251 F283 S284 Y286 | K239-Y241 HydrophobicContact CB-CD2 4.42Å; K239-Y241 HydrophobicContact CB-CE2 3.58Å; K239-Y241 WeakPolarHBondContact CD-OH 3.43Å; K239-F249 HydrophobicContact CB-CD2 4.29Å; K239-F249 HydrophobicContact CD-CD2 3.76Å; K239-F249 HydrophobicContact CD-CE2 3.81Å; K239-F249 HydrophobicContact CD-CG 4.21Å; K239-F249 HydrophobicContact CD-CZ 4.3Å; K239-F249 HydrophobicContact CG-CD2 3.91Å; K239-F249 HydrophobicContact CG-CE2 4.2Å; K239-L250 CarbonylContact C-O 3.39Å; K239-L250 WeakPolarHBondContact CA-O 3.2Å; K239-Q251 HydrophobicContact CG-CG 4.02Å; K239-F283 CarbonylContact O-C 3.22Å; K239-F283 WeakPolarHBondContact O-CA 3.18Å; K239-S284 PolarHBondContact N-O 2.88Å; K239-S284 PolarHBondContact O-N 3.03Å; K239-Y286 HydrophobicContact CB-CE2 4.15Å; K239-Y286 HydrophobicContact CD-CD2 4.49Å; K239-Y286 HydrophobicContact CD-CE2 3.82Å; K239-Y286 HydrophobicContact CG-CD2 4.32Å; K239-Y286 HydrophobicContact CG-CE2 3.96Å |
| 240 | L | 98.1 | Very high | 88.5 | Confident | 0 Ų | 0 | 63.1 Ų | 63.1 | 0% | 0 | 31% | 0.306 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.7 | 129.5 | -179.2 | -65 | 81.3 | 0 | 0 | 0 | 109.2 | V219 V238 F249 L250 F267 F269 K282 F283 | V219-L240 HydrophobicContact CB-CD2 4.34Å; V219-L240 HydrophobicContact CG1-CD2 3.75Å; V238-L240 HydrophobicContact CB-CD1 4.48Å; V238-L240 HydrophobicContact CG1-CD1 4.07Å; L240-F249 CarbonylContact O-C 3.58Å; L240-F249 WeakPolarHBondContact O-CA 3.28Å; L240-F249 WeakPolarHBondContact O-CB 3.27Å; L240-L250 HydrophobicContact CB-CB 4.46Å; L240-L250 PolarHBondContact N-O 2.98Å; L240-L250 PolarHBondContact O-N 2.92Å; L240-F267 HydrophobicContact CD1-CD2 4.04Å; L240-F267 HydrophobicContact CD1-CE2 3.88Å; L240-F267 HydrophobicContact CD1-CG 4.5Å; L240-F267 HydrophobicContact CD1-CZ 4.21Å; L240-F267 HydrophobicContact CD2-CB 4.23Å; L240-F267 HydrophobicContact CD2-CD2 3.57Å; L240-F267 HydrophobicContact CD2-CE2 4.2Å; L240-F267 HydrophobicContact CD2-CG 3.99Å; L240-F267 HydrophobicContact CG-CD2 4.48Å; L240-F269 HydrophobicContact CB-CE2 4.32Å; L240-F269 HydrophobicContact CB-CZ 3.92Å; L240-K282 CarbonylContact C-O 3.59Å; L240-K282 WeakPolarHBondContact CA-O 3.31Å; L240-F283 HydrophobicContact CD1-CD1 4.47Å; L240-F283 HydrophobicContact CD2-CD1 3.99Å; L240-F283 HydrophobicContact CD2-CE1 3.54Å; L240-F283 HydrophobicContact CD2-CZ 4.42Å; L240-F283 HydrophobicContact CG-CD1 3.71Å; L240-F283 HydrophobicContact CG-CE1 3.83Å |
| 241 | Y | 95.8 | Very high | 89.5 | Confident | 27 Ų | 27 | 62.5 Ų | 62.5 | 11% | 0.106 | 30% | 0.295 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127 | 146.8 | 179.1 | -54.5 | -106.4 | 0 | 0 | 0 | 109.8 | K239 E246 F249 K282 | K239-Y241 HydrophobicContact CB-CD2 4.42Å; K239-Y241 HydrophobicContact CB-CE2 3.58Å; K239-Y241 WeakPolarHBondContact CD-OH 3.43Å; Y241-E246 WeakPolarHBondContact CE1-O 3.44Å; Y241-F249 HydrophobicContact CD1-CB 3.7Å; Y241-F249 HydrophobicContact CD2-CB 4.41Å; Y241-F249 HydrophobicContact CE1-CB 3.55Å; Y241-F249 HydrophobicContact CE1-CD1 4.1Å; Y241-F249 HydrophobicContact CE1-CG 4.14Å; Y241-F249 HydrophobicContact CE2-CB 4.25Å; Y241-F249 HydrophobicContact CG-CB 4.14Å; Y241-K282 HydrophobicContact CD2-CD 4.49Å; Y241-K282 HydrophobicContact CD2-CG 4.18Å; Y241-K282 PolarHBondContact N-O 2.85Å; Y241-K282 PolarHBondContact O-N 2.89Å |
| 242 | L | 94.5 | Very high | 90.8 | Very high | 13 Ų | 13 | 59.8 Ų | 59.8 | 7% | 0.068 | 28% | 0.276 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.4 | 86.8 | 173.5 | -171 | 66.5 | 0 | 0 | 0 | 109.6 | L217 D245 F269 V271 R279 L304 | L217-L242 HydrophobicContact CD2-CD1 3.96Å; L242-D245 PolarHBondContact O-N 2.91Å; L242-F269 HydrophobicContact CB-CD1 3.77Å; L242-F269 HydrophobicContact CB-CE1 3.97Å; L242-F269 HydrophobicContact CB-CG 4.17Å; L242-F269 HydrophobicContact CD2-CB 3.79Å; L242-F269 HydrophobicContact CD2-CD1 4.35Å; L242-F269 HydrophobicContact CD2-CG 4.15Å; L242-V271 HydrophobicContact CD2-CB 3.88Å; L242-V271 HydrophobicContact CD2-CG1 3.98Å; L242-V271 HydrophobicContact CD2-CG2 4.07Å; L242-R279 HydrophobicContact CD1-CB 3.67Å; L242-R279 HydrophobicContact CD1-CG 4.23Å; L242-R279 HydrophobicContact CD2-CG 4.4Å; L242-R279 HydrophobicContact CG-CB 4.1Å; L242-R279 HydrophobicContact CG-CG 4.18Å; L242-L304 HydrophobicContact CD1-CD1 3.69Å |
| 243 | L | 89.8 | Confident | 92 | Very high | 14 Ų | 14 | 57.2 Ų | 57.2 | 7% | 0.073 | 26% | 0.261 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -61.4 | 145.5 | -173.6 | -55.2 | -176.8 | 0 | 0 | 0 | 111.3 | E246 R279 V280 K282 L301 | L243-E246 HydrophobicContact CD2-CG 3.45Å; L243-E246 VanDerWaalsContact CD2-CG 3.45Å; L243-R279 WeakPolarHBondContact O-CD 3.15Å; L243-V280 HydrophobicContact CB-CB 4.14Å; L243-V280 WeakPolarHBondContact CB-O 3.21Å; L243-V280 HydrophobicContact CD1-CB 4.22Å; L243-V280 HydrophobicContact CD1-CG1 4.34Å; L243-V280 HydrophobicContact CG-CB 4.49Å; L243-V280 WeakPolarHBondContact CG-O 3.49Å; L243-V280 PolarHBondContact N-O 2.97Å; L243-V280 PolarHBondContact O-N 2.99Å; L243-K282 HydrophobicContact CD1-CB 3.94Å; L243-K282 HydrophobicContact CD1-CD 4.27Å; L243-K282 HydrophobicContact CD2-CB 4.36Å; L243-K282 HydrophobicContact CD2-CD 4.43Å; L243-K282 HydrophobicContact CG-CB 4.02Å; L243-L301 HydrophobicContact CD1-CD2 4.26Å |
| 244 | P | 82.2 | Confident | 92.8 | Very high | 67 Ų | 67 | 57.6 Ų | 57.6 | 44% | 0.435 | 26% | 0.263 | S | S | . | . | T | Hydrogen-bonded Turn | cis | -79.4 | 7.9 | 6.5 | 30.4 | -38.2 | 0 | 0 | 0 | 117.4 | E246 | P244-E246 PolarHBondContact O-N 2.93Š|
| 245 | D | 84.4 | Confident | 93.1 | Very high | 55 Ų | 55 | 60 Ų | 60 | 29% | 0.294 | 27% | 0.273 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.6 | 91 | 173.7 | -168.1 | -9.4 | 0 | 0 | 0 | 111.1 | L242 R247 R248 | L242-D245 PolarHBondContact O-N 2.91Å; D245-R247 PolarHBondContact OD1-N 2.8Å; D245-R248 PolarHBondContact OD1-N 2.78Å; D245-R248 VanDerWaalsContact OD2-CD 3.25Å; D245-R248 WeakPolarHBondContact OD2-CD 3.16Å; D245-R248 WeakPolarHBondContact OD2-CG 3.38Å; D245-R248 IonicContact OD2-NE 2.79Å |
| 246 | E | 81.1 | Confident | 93 | Very high | 102 Ų | 102 | 69.3 Ų | 69.3 | 48% | 0.477 | 31% | 0.305 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.8 | -12.4 | 172.3 | -68.5 | -177.2 | 173.9 | 0 | 0 | 113 | Y241 L243 P244 | Y241-E246 WeakPolarHBondContact CE1-O 3.44Å; L243-E246 HydrophobicContact CD2-CG 3.45Å; L243-E246 VanDerWaalsContact CD2-CG 3.45Å; P244-E246 PolarHBondContact O-N 2.93Å |
| 247 | R | 83.5 | Confident | 92.7 | Very high | 237 Ų | 237 | 77 Ų | 77 | 89% | 0.894 | 34% | 0.338 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -80.6 | -30.7 | -176.9 | -63 | -175.4 | -179.2 | -173.2 | 1.4 | 111.7 | D245 | D245-R247 PolarHBondContact OD1-N 2.8Å |
| 248 | R | 89.1 | Confident | 92.5 | Very high | 192 Ų | 192 | 79 Ų | 79 | 73% | 0.725 | 35% | 0.351 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -103 | 128.7 | 177.4 | -59.9 | -174.7 | -179.6 | 178.2 | -0.9 | 110.3 | D245 | D245-R248 PolarHBondContact OD1-N 2.78Å; D245-R248 VanDerWaalsContact OD2-CD 3.25Å; D245-R248 WeakPolarHBondContact OD2-CD 3.16Å; D245-R248 WeakPolarHBondContact OD2-CG 3.38Å; D245-R248 IonicContact OD2-NE 2.79Å |
| 249 | F | 95.7 | Very high | 92.2 | Very high | 87 Ų | 87 | 81.4 Ų | 81.4 | 38% | 0.382 | 37% | 0.368 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.3 | 149.3 | 171.9 | 64.8 | -90.4 | 0 | 0 | 0 | 111.1 | K239 L240 Y241 Q251 | K239-F249 HydrophobicContact CB-CD2 4.29Å; K239-F249 HydrophobicContact CD-CD2 3.76Å; K239-F249 HydrophobicContact CD-CE2 3.81Å; K239-F249 HydrophobicContact CD-CG 4.21Å; K239-F249 HydrophobicContact CD-CZ 4.3Å; K239-F249 HydrophobicContact CG-CD2 3.91Å; K239-F249 HydrophobicContact CG-CE2 4.2Å; L240-F249 CarbonylContact O-C 3.58Å; L240-F249 WeakPolarHBondContact O-CA 3.28Å; L240-F249 WeakPolarHBondContact O-CB 3.27Å; Y241-F249 HydrophobicContact CD1-CB 3.7Å; Y241-F249 HydrophobicContact CD2-CB 4.41Å; Y241-F249 HydrophobicContact CE1-CB 3.55Å; Y241-F249 HydrophobicContact CE1-CD1 4.1Å; Y241-F249 HydrophobicContact CE1-CG 4.14Å; Y241-F249 HydrophobicContact CE2-CB 4.25Å; Y241-F249 HydrophobicContact CG-CB 4.14Å; F249-Q251 HydrophobicContact CD2-CB 4.15Å; F249-Q251 HydrophobicContact CE2-CB 4.14Å |
| 250 | L | 97.6 | Very high | 92 | Very high | 58 Ų | 58 | 83.2 Ų | 83.2 | 30% | 0.304 | 38% | 0.379 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.6 | 153.2 | 163.6 | -57.1 | 178.5 | 0 | 0 | 0 | 108.1 | K239 L240 F267 I268 F269 | K239-L250 CarbonylContact C-O 3.39Å; K239-L250 WeakPolarHBondContact CA-O 3.2Å; L240-L250 HydrophobicContact CB-CB 4.46Å; L240-L250 PolarHBondContact N-O 2.98Å; L240-L250 PolarHBondContact O-N 2.92Å; L250-F267 HydrophobicContact CB-CD1 3.7Å; L250-F267 HydrophobicContact CB-CE1 4.31Å; L250-F267 HydrophobicContact CB-CG 4.34Å; L250-F267 HydrophobicContact CD1-CB 3.8Å; L250-F267 HydrophobicContact CD1-CD1 4.19Å; L250-F267 HydrophobicContact CD1-CG 4.42Å; L250-I268 WeakPolarHBondContact CD1-O 3.43Å; L250-F269 HydrophobicContact CB-CZ 4.36Å; L250-F269 HydrophobicContact CD1-CD1 4.21Å; L250-F269 HydrophobicContact CD1-CD2 4.32Å; L250-F269 HydrophobicContact CD1-CE1 3.88Å; L250-F269 HydrophobicContact CD1-CE2 4Å; L250-F269 HydrophobicContact CD1-CG 4.42Å; L250-F269 HydrophobicContact CD1-CZ 3.77Å; L250-F269 HydrophobicContact CG-CE1 3.97Å; L250-F269 HydrophobicContact CG-CZ 4Å |
| 251 | Q | 97.6 | Very high | 91.9 | Very high | 82 Ų | 82 | 83.2 Ų | 83.2 | 38% | 0.383 | 38% | 0.379 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.1 | 136.1 | -171.8 | -168.1 | -174.3 | -89.9 | 0 | 0 | 111 | L237 V238 K239 F249 | L237-Q251 HydrophobicContact CD1-CG 3.75Å; L237-Q251 HydrophobicContact CD2-CG 4.34Å; L237-Q251 HydrophobicContact CG-CG 4.16Å; V238-Q251 WeakPolarHBondContact O-CA 3.49Å; K239-Q251 HydrophobicContact CG-CG 4.02Å; F249-Q251 HydrophobicContact CD2-CB 4.15Å; F249-Q251 HydrophobicContact CE2-CB 4.14Å |
| 252 | S | 98.1 | Very high | 92 | Very high | 6 Ų | 6 | 86.4 Ų | 86.4 | 4% | 0.042 | 40% | 0.395 | C | S | . | . | P | Polyproline II helix | trans | -71.6 | 172 | 173.9 | 81.6 | 0 | 0 | 0 | 0 | 112.9 | L237 V238 F263 E265 | L237-S252 WeakPolarHBondContact CD1-O 3.18Å; V238-S252 PolarHBondContact N-OG 2.92Å; V238-S252 PolarHBondContact O-N 3.12Å; S252-F263 WeakPolarHBondContact OG-CE1 3.37Å; S252-E265 WeakPolarHBondContact CA-OE2 3.49Å |
| 253 | K | 96.6 | Very high | 92.1 | Very high | 149 Ų | 149 | 86 Ų | 86 | 65% | 0.648 | 39% | 0.393 | S | S | * | . | P | Polyproline II helix | trans | -71 | 145.9 | 160.2 | -60.8 | 164.4 | -172.8 | 167.4 | 0 | 108.9 | K255 E265 | K253-K255 PolarHBondContact O-N 3.5Å; K253-E265 WeakPolarHBondContact CB-OE1 3.47Å; K253-E265 PolarHBondContact N-OE1 3.38Å; K253-E265 PolarHBondContact N-OE2 2.83Å |
| 254 | T | 95.6 | Very high | 92.5 | Very high | 60 Ų | 60 | 90.3 Ų | 90.3 | 37% | 0.368 | 42% | 0.416 | S | S | . | . | P | Polyproline II helix | trans | -73.6 | 121.8 | 171.1 | -46.5 | 0 | 0 | 0 | 0 | 109.2 | P236 L237 V288 | P236-T254 WeakPolarHBondContact O-CA 3.43Å; L237-T254 HydrophobicContact CB-CG2 4.45Å; T254-V288 HydrophobicContact CG2-CB 4.09Å; T254-V288 HydrophobicContact CG2-CG2 3.93Å |
| 255 | K | 94.9 | Very high | 93.3 | Very high | 57 Ų | 57 | 88.1 Ų | 88.1 | 25% | 0.248 | 40% | 0.4 | C | S | . | . | P | Polyproline II helix | trans | -85.9 | 149.4 | 167.8 | -51.5 | -69 | 168.1 | 140.2 | 0 | 108 | S235 P236 K253 T258 P261 Q262 F263 E265 | S235-K255 CarbonylContact C-O 3.51Å; S235-K255 WeakPolarHBondContact CA-O 3.05Å; S235-K255 WeakPolarHBondContact CB-O 3.37Å; P236-K255 VanDerWaalsContact CD-O 3.31Å; P236-K255 WeakPolarHBondContact CD-O 3.1Å; P236-K255 HydrophobicContact CG-CB 4.24Å; P236-K255 PolarHBondContact O-N 2.81Å; K253-K255 PolarHBondContact O-N 3.5Å; K255-T258 HydrophobicContact CB-CG2 4.13Å; K255-P261 HydrophobicContact CB-CB 4Å; K255-P261 HydrophobicContact CG-CB 3.91Å; K255-Q262 WeakPolarHBondContact CD-O 3.11Å; K255-Q262 WeakPolarHBondContact CE-O 3.48Å; K255-Q262 PolarHBondContact NZ-O 2.9Å; K255-F263 HydrophobicContact CG-CD1 3.97Å; K255-F263 HydrophobicContact CG-CE1 3.78Å; K255-F263 HydrophobicContact CG-CZ 4.46Å; K255-F263 PolarHBondContact NZ-O 3.27Å; K255-E265 IonicContact NZ-OE1 3.1Å |
| 256 | R | 90.8 | Very high | 93.9 | Very high | 217 Ų | 217 | 91.2 Ų | 91.2 | 82% | 0.819 | 41% | 0.412 | S | S | * | . | trans | -111.5 | 137.6 | -171.2 | -66.2 | -177.7 | 179.7 | -179.3 | 0.8 | 111.2 | T258 | R256-T258 PolarHBondContact O-N 2.84Š| ||
| 257 | K | 89.6 | Confident | 94.7 | Very high | 161 Ų | 161 | 87.4 Ų | 87.4 | 70% | 0.7 | 39% | 0.394 | S | S | * | . | S | Bend | trans | 49.1 | 47.5 | 171.2 | -55.4 | -173.2 | 177.3 | -174.9 | 0 | 114.4 | T233 C234 S235 | T233-K257 HydrophobicContact CG2-CB 4.49Å; T233-K257 HydrophobicContact CG2-CD 4.41Å; T233-K257 HydrophobicContact CG2-CG 4.32Å; C234-K257 CarbonylContact O-C 3.58Å; C234-K257 VanDerWaalsContact O-C 3.32Å; C234-K257 WeakPolarHBondContact O-CA 3.36Å; C234-K257 PolarHBondContact O-N 2.81Å; S235-K257 PolarHBondContact OG-N 2.82Å |
| 258 | T | 92.6 | Very high | 95.3 | Very high | 44 Ų | 44 | 80.7 Ų | 80.7 | 27% | 0.27 | 38% | 0.375 | S | S | . | . | trans | -146.1 | 135.1 | 176.1 | 179.6 | 0 | 0 | 0 | 0 | 111.8 | C234 P236 K255 R256 N260 P261 | C234-T258 WeakPolarHBondContact CB-O 3.48Å; C234-T258 PolarHBondContact O-N 3.45Å; P236-T258 VanDerWaalsContact CD-O 3.26Å; P236-T258 WeakPolarHBondContact CD-O 3.3Å; P236-T258 HydrophobicContact CG-CG2 4.4Å; P236-T258 WeakPolarHBondContact CG-O 3.44Å; K255-T258 HydrophobicContact CB-CG2 4.13Å; R256-T258 PolarHBondContact O-N 2.84Å; T258-N260 VanDerWaalsContact OG1-C 3.31Å; T258-N260 PolarHBondContact OG1-N 3.35Å; T258-N260 PolarHBondContact OG1-O 3.18Å; T258-P261 HydrophobicContact CG2-CB 4.07Å | ||
| 259 | S | 91.8 | Very high | 95.7 | Very high | 51 Ų | 51 | 72.6 Ų | 72.6 | 36% | 0.357 | 35% | 0.345 | S | S | . | . | S | Bend | trans | -87.4 | -7.7 | 167.3 | 49.7 | 0 | 0 | 0 | 0 | 113 | H226 L227 P261 | H226-S259 PolarHBondContact N-O 3.36Å; L227-S259 WeakPolarHBondContact CB-O 3.24Å; L227-S259 WeakPolarHBondContact CG-O 3.12Å; L227-S259 PolarHBondContact N-O 2.95Å; L227-S259 WeakPolarHBondContact O-CB 3.4Å; S259-P261 WeakPolarHBondContact O-CD 3.41Å |
| 260 | N | 93.9 | Very high | 95.6 | Very high | 68 Ų | 68 | 74.1 Ų | 74.1 | 36% | 0.364 | 35% | 0.353 | S | S | . | . | S | Bend | trans | -124 | 62.8 | -179.2 | -61.2 | -46.6 | 0 | 0 | 0 | 110.8 | A224 Q225 H226 T258 | A224-N260 CarbonylContact O-C 3.58Å; A224-N260 VanDerWaalsContact O-C 3.32Å; A224-N260 VanDerWaalsContact O-CA 3.27Å; A224-N260 WeakPolarHBondContact O-CA 3.24Å; Q225-N260 VanDerWaalsContact CA-OD1 3.23Å; Q225-N260 WeakPolarHBondContact CA-OD1 3.48Å; H226-N260 PolarHBondContact N-OD1 2.81Å; T258-N260 VanDerWaalsContact OG1-C 3.31Å; T258-N260 PolarHBondContact OG1-N 3.35Å; T258-N260 PolarHBondContact OG1-O 3.18Å |
| 261 | P | 95.8 | Very high | 95.4 | Very high | 1 Ų | 1 | 71.9 Ų | 71.9 | 1% | 0.006 | 34% | 0.342 | C | S | . | . | trans | -70 | 130.6 | -177.6 | 30.4 | -38 | 0 | 0 | 0 | 112.7 | K223 A224 L227 P236 K255 T258 S259 F263 | K223-P261 CarbonylContact C-O 3.32Å; K223-P261 VanDerWaalsContact CA-O 3.32Å; K223-P261 WeakPolarHBondContact CA-O 3.25Å; A224-P261 HydrophobicContact CB-CG 3.82Å; A224-P261 PolarHBondContact N-O 2.94Å; A224-P261 WeakPolarHBondContact O-CD 3.46Å; L227-P261 HydrophobicContact CD1-CG 3.79Å; P236-P261 HydrophobicContact CB-CG 4.15Å; P236-P261 HydrophobicContact CG-CB 3.66Å; P236-P261 HydrophobicContact CG-CG 3.54Å; K255-P261 HydrophobicContact CB-CB 4Å; K255-P261 HydrophobicContact CG-CB 3.91Å; T258-P261 HydrophobicContact CG2-CB 4.07Å; S259-P261 WeakPolarHBondContact O-CD 3.41Å; P261-F263 HydrophobicContact CB-CD2 4.28Å; P261-F263 HydrophobicContact CB-CE1 4.38Å; P261-F263 HydrophobicContact CB-CE2 3.71Å; P261-F263 HydrophobicContact CB-CZ 3.75Å; P261-F263 HydrophobicContact CG-CD2 4.31Å; P261-F263 HydrophobicContact CG-CE2 3.43Å; P261-F263 VanDerWaalsContact CG-CE2 3.43Å; P261-F263 HydrophobicContact CG-CZ 3.67Å | ||
| 262 | Q | 96.9 | Very high | 95.2 | Very high | 93 Ų | 93 | 69.8 Ų | 69.8 | 44% | 0.435 | 34% | 0.336 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.2 | 123.3 | 156.1 | -59.1 | -61.5 | -43.6 | 0 | 0 | 107.9 | K255 | K255-Q262 WeakPolarHBondContact CD-O 3.11Å; K255-Q262 WeakPolarHBondContact CE-O 3.48Å; K255-Q262 PolarHBondContact NZ-O 2.9Å |
| 263 | F | 97.5 | Very high | 94.9 | Very high | 5 Ų | 5 | 71.4 Ų | 71.4 | 2% | 0.022 | 35% | 0.347 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.5 | -61.9 | 178.2 | -70.4 | -77.7 | 0 | 0 | 0 | 110.9 | L221 I222 A224 P236 V238 S252 K255 P261 E265 | L221-F263 HydrophobicContact CB-CB 4.38Å; L221-F263 HydrophobicContact CD1-CD2 4.44Å; L221-F263 HydrophobicContact CD2-CB 3.76Å; L221-F263 HydrophobicContact CD2-CD1 3.79Å; L221-F263 HydrophobicContact CD2-CD2 3.94Å; L221-F263 HydrophobicContact CD2-CE1 4.4Å; L221-F263 HydrophobicContact CD2-CE2 4.5Å; L221-F263 HydrophobicContact CD2-CG 3.55Å; L221-F263 HydrophobicContact CG-CB 3.74Å; L221-F263 HydrophobicContact CG-CD2 3.91Å; L221-F263 HydrophobicContact CG-CG 3.82Å; L221-F263 WeakPolarHBondContact O-CB 3.41Å; I222-F263 WeakPolarHBondContact O-CA 3.39Å; I222-F263 WeakPolarHBondContact O-CB 3.44Å; I222-F263 PolarHBondContact O-N 2.8Å; A224-F263 HydrophobicContact CB-CE2 4.29Å; P236-F263 HydrophobicContact CB-CZ 4.37Å; V238-F263 HydrophobicContact CG2-CE1 4.08Å; V238-F263 HydrophobicContact CG2-CE2 3.85Å; V238-F263 HydrophobicContact CG2-CZ 3.57Å; S252-F263 WeakPolarHBondContact OG-CE1 3.37Å; K255-F263 HydrophobicContact CG-CD1 3.97Å; K255-F263 HydrophobicContact CG-CE1 3.78Å; K255-F263 HydrophobicContact CG-CZ 4.46Å; K255-F263 PolarHBondContact NZ-O 3.27Å; P261-F263 HydrophobicContact CB-CD2 4.28Å; P261-F263 HydrophobicContact CB-CE1 4.38Å; P261-F263 HydrophobicContact CB-CE2 3.71Å; P261-F263 HydrophobicContact CB-CZ 3.75Å; P261-F263 HydrophobicContact CG-CD2 4.31Å; P261-F263 HydrophobicContact CG-CE2 3.43Å; P261-F263 VanDerWaalsContact CG-CE2 3.43Å; P261-F263 HydrophobicContact CG-CZ 3.67Å; F263-E265 VanDerWaalsContact C-N 3.34Å |
| 264 | D | 97.1 | Very high | 94.5 | Very high | 104 Ų | 104 | 72.6 Ų | 72.6 | 56% | 0.556 | 35% | 0.353 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | 53.4 | 47.9 | -175 | -53 | -56 | 0 | 0 | 0 | 112.5 | L221 I222 | L221-D264 WeakPolarHBondContact O-CA 3.44Å; L221-D264 PolarHBondContact O-N 3Å; I222-D264 PolarHBondContact O-N 3.36Å; I222-D264 VanDerWaalsContact O-N 3.17Å |
| 265 | E | 98.3 | Very high | 94.1 | Very high | 21 Ų | 21 | 71.7 Ų | 71.7 | 10% | 0.098 | 35% | 0.347 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.6 | 137.7 | -175.7 | -71.3 | 175.5 | -129 | 0 | 0 | 110.9 | L221 S252 K253 K255 F263 F267 | L221-E265 PolarHBondContact N-O 3.34Å; L221-E265 PolarHBondContact O-N 3.31Å; S252-E265 WeakPolarHBondContact CA-OE2 3.49Å; K253-E265 WeakPolarHBondContact CB-OE1 3.47Å; K253-E265 PolarHBondContact N-OE1 3.38Å; K253-E265 PolarHBondContact N-OE2 2.83Å; K255-E265 IonicContact NZ-OE1 3.1Å; F263-E265 VanDerWaalsContact C-N 3.34Å; E265-F267 HydrophobicContact CB-CE2 3.81Å; E265-F267 HydrophobicContact CB-CZ 3.87Å |
| 266 | H | 97.3 | Very high | 93.9 | Very high | 120 Ų | 120 | 69.2 Ų | 69.2 | 56% | 0.556 | 34% | 0.337 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -111 | 138.7 | -177.6 | -73.9 | -108.1 | 0 | 0 | 0 | 111.5 | R314 | H266-R314 VanDerWaalsContact CE1-CZ 3.5Å; H266-R314 PolarHBondContact CE1-NH1 3.07Å; H266-R314 PolarHBondContact CE1-NH2 3.32Å; H266-R314 VanDerWaalsContact CE1-NH2 3.35Å |
| 267 | F | 98.1 | Very high | 93.8 | Very high | 23 Ų | 23 | 61.6 Ų | 61.6 | 10% | 0.101 | 31% | 0.314 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.4 | 147.2 | -176 | -60 | -75 | 0 | 0 | 0 | 110.2 | V219 L221 L240 L250 E265 | V219-F267 HydrophobicContact CB-CB 4.4Å; V219-F267 PolarHBondContact N-O 3.25Å; V219-F267 PolarHBondContact O-N 3.37Å; L221-F267 HydrophobicContact CB-CD2 4.26Å; L221-F267 HydrophobicContact CB-CE2 3.78Å; L221-F267 HydrophobicContact CD2-CE2 4.09Å; L240-F267 HydrophobicContact CD1-CD2 4.04Å; L240-F267 HydrophobicContact CD1-CE2 3.88Å; L240-F267 HydrophobicContact CD1-CG 4.5Å; L240-F267 HydrophobicContact CD1-CZ 4.21Å; L240-F267 HydrophobicContact CD2-CB 4.23Å; L240-F267 HydrophobicContact CD2-CD2 3.57Å; L240-F267 HydrophobicContact CD2-CE2 4.2Å; L240-F267 HydrophobicContact CD2-CG 3.99Å; L240-F267 HydrophobicContact CG-CD2 4.48Å; L250-F267 HydrophobicContact CB-CD1 3.7Å; L250-F267 HydrophobicContact CB-CE1 4.31Å; L250-F267 HydrophobicContact CB-CG 4.34Å; L250-F267 HydrophobicContact CD1-CB 3.8Å; L250-F267 HydrophobicContact CD1-CD1 4.19Å; L250-F267 HydrophobicContact CD1-CG 4.42Å; E265-F267 HydrophobicContact CB-CE2 3.81Å; E265-F267 HydrophobicContact CB-CZ 3.87Å |
| 268 | I | 97.1 | Very high | 93.6 | Very high | 95 Ų | 95 | 57.3 Ų | 57.3 | 49% | 0.487 | 30% | 0.297 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.8 | 125 | -177.9 | -52.9 | -175.5 | 0 | 0 | 0 | 108.9 | R216 L217 L218 L250 | R216-I268 HydrophobicContact CB-CG2 4.05Å; R216-I268 HydrophobicContact CG-CG2 3.91Å; L217-I268 WeakPolarHBondContact O-CA 3.39Å; L218-I268 HydrophobicContact CD2-CB 4.49Å; L218-I268 HydrophobicContact CD2-CD1 3.92Å; L218-I268 HydrophobicContact CD2-CG1 3.76Å; L218-I268 HydrophobicContact CD2-CG2 4.21Å; L250-I268 WeakPolarHBondContact CD1-O 3.43Å |
| 269 | F | 96.2 | Very high | 93.4 | Very high | 22 Ų | 22 | 58.3 Ų | 58.3 | 10% | 0.096 | 30% | 0.296 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.1 | 126.3 | 168.4 | -64.2 | -88.1 | 0 | 0 | 0 | 109.6 | R216 L217 V219 L240 L242 L250 L281 | R216-F269 WeakPolarHBondContact CA-O 3.49Å; L217-F269 HydrophobicContact CB-CB 4.36Å; L217-F269 HydrophobicContact CD2-CD2 4.29Å; L217-F269 PolarHBondContact N-O 2.78Å; L217-F269 PolarHBondContact O-N 2.86Å; V219-F269 HydrophobicContact CG2-CD2 4.13Å; V219-F269 HydrophobicContact CG2-CE2 4.2Å; L240-F269 HydrophobicContact CB-CE2 4.32Å; L240-F269 HydrophobicContact CB-CZ 3.92Å; L242-F269 HydrophobicContact CB-CD1 3.77Å; L242-F269 HydrophobicContact CB-CE1 3.97Å; L242-F269 HydrophobicContact CB-CG 4.17Å; L242-F269 HydrophobicContact CD2-CB 3.79Å; L242-F269 HydrophobicContact CD2-CD1 4.35Å; L242-F269 HydrophobicContact CD2-CG 4.15Å; L250-F269 HydrophobicContact CB-CZ 4.36Å; L250-F269 HydrophobicContact CD1-CD1 4.21Å; L250-F269 HydrophobicContact CD1-CD2 4.32Å; L250-F269 HydrophobicContact CD1-CE1 3.88Å; L250-F269 HydrophobicContact CD1-CE2 4Å; L250-F269 HydrophobicContact CD1-CG 4.42Å; L250-F269 HydrophobicContact CD1-CZ 3.77Å; L250-F269 HydrophobicContact CG-CE1 3.97Å; L250-F269 HydrophobicContact CG-CZ 4Å; F269-L281 HydrophobicContact CE2-CD1 3.91Å; F269-L281 HydrophobicContact CZ-CD1 4.46Å |
| 270 | Q | 95 | Very high | 93.4 | Very high | 120 Ų | 120 | 56.5 Ų | 56.5 | 56% | 0.561 | 28% | 0.282 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -80 | 118.6 | 170.9 | -167.6 | 74.2 | 46.4 | 0 | 0 | 108.7 | A214 E215 | A214-Q270 PolarHBondContact O-NE2 3.41Å; E215-Q270 PolarHBondContact O-NE2 3.02Å |
| 271 | V | 93.3 | Very high | 93.5 | Very high | 11 Ų | 11 | 53.2 Ų | 53.2 | 7% | 0.067 | 27% | 0.265 | C | S | . | . | trans | -157.1 | 127.2 | -171.8 | 52 | 0 | 0 | 0 | 0 | 110.7 | Y210 E215 L217 L242 I276 R279 | Y210-V271 HydrophobicContact CE2-CG1 4.1Å; Y210-V271 PolarHBondContact OH-O 3.02Å; Y210-V271 VanDerWaalsContact OH-O 3.05Å; E215-V271 CarbonylContact C-O 3.53Å; E215-V271 PolarHBondContact O-N 2.78Å; E215-V271 VanDerWaalsContact O-O 3.07Å; L217-V271 HydrophobicContact CB-CG1 3.85Å; L242-V271 HydrophobicContact CD2-CB 3.88Å; L242-V271 HydrophobicContact CD2-CG1 3.98Å; L242-V271 HydrophobicContact CD2-CG2 4.07Å; V271-I276 HydrophobicContact CB-CD1 4.48Å; V271-I276 HydrophobicContact CG1-CD1 3.63Å; V271-I276 HydrophobicContact CG2-CB 4.38Å; V271-I276 HydrophobicContact CG2-CD1 4.01Å; V271-R279 HydrophobicContact CG2-CG 4.2Å | ||
| 272 | S | 93.1 | Very high | 93.4 | Very high | 38 Ų | 38 | 54.4 Ų | 54.4 | 27% | 0.266 | 27% | 0.27 | S | S | . | . | trans | -69.1 | 141.7 | -176.5 | 178 | 0 | 0 | 0 | 0 | 113.2 | E215 K274 T275 I276 | E215-S272 VanDerWaalsContact CD-CA 3.47Å; E215-S272 WeakPolarHBondContact OE1-CA 3.47Å; E215-S272 VanDerWaalsContact OE1-CB 3.24Å; E215-S272 WeakPolarHBondContact OE1-CB 3.2Å; E215-S272 PolarHBondContact OE1-OG 3.39Å; E215-S272 WeakPolarHBondContact OE2-CB 3.49Å; S272-K274 PolarHBondContact O-N 2.92Å; S272-K274 VanDerWaalsContact O-N 3.1Å; S272-T275 PolarHBondContact O-N 3.04Å; S272-T275 PolarHBondContact O-OG1 3.07Å; S272-I276 PolarHBondContact O-N 2.91Å | ||
| 273 | S | 90.5 | Very high | 93.5 | Very high | 39 Ų | 39 | 50 Ų | 50 | 27% | 0.273 | 25% | 0.249 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -51.3 | -31.8 | 176.7 | 53.2 | 0 | 0 | 0 | 0 | 113.1 | Y210 E215 T275 | Y210-S273 WeakPolarHBondContact OH-CA 3.35Å; Y210-S273 PolarHBondContact OH-N 3.01Å; E215-S273 PolarHBondContact OE1-N 2.84Å; E215-S273 PolarHBondContact OE1-OG 3.47Å; E215-S273 VanDerWaalsContact OE1-OG 3.1Å; S273-T275 PolarHBondContact O-N 2.8Å |
| 274 | K | 88.4 | Confident | 93.4 | Very high | 175 Ų | 175 | 49.8 Ų | 49.8 | 76% | 0.761 | 25% | 0.248 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -68.3 | -20.1 | 177.5 | -62.4 | 177.5 | -177.8 | 175.1 | 0 | 114 | S272 | S272-K274 PolarHBondContact O-N 2.92Å; S272-K274 VanDerWaalsContact O-N 3.1Å |
| 275 | T | 88.4 | Confident | 93.4 | Very high | 41 Ų | 41 | 44.8 Ų | 44.8 | 25% | 0.252 | 22% | 0.222 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -123.5 | -13.3 | -173.6 | 73.7 | 0 | 0 | 0 | 0 | 114.4 | S272 S273 T277 Q278 R279 | S272-T275 PolarHBondContact O-N 3.04Å; S272-T275 PolarHBondContact O-OG1 3.07Å; S273-T275 PolarHBondContact O-N 2.8Å; T275-T277 PolarHBondContact O-N 2.9Å; T275-Q278 PolarHBondContact O-N 3.3Å; T275-Q278 VanDerWaalsContact O-N 3.08Å; T275-R279 WeakPolarHBondContact O-CG 3.44Å; T275-R279 PolarHBondContact OG1-NH2 2.66Å |
| 276 | I | 90.5 | Very high | 93.3 | Very high | 5 Ų | 5 | 45.5 Ų | 45.5 | 3% | 0.026 | 22% | 0.224 | C | C | . | . | G | 310 helix | trans | -54.9 | -38.4 | -176.4 | -172.1 | 54.6 | 0 | 0 | 0 | 112.3 | Y210 L217 V271 S272 Q278 R279 L304 L309 | Y210-I276 HydrophobicContact CD2-CD1 4.29Å; Y210-I276 HydrophobicContact CD2-CG1 3.89Å; Y210-I276 HydrophobicContact CE1-CG2 4.22Å; Y210-I276 HydrophobicContact CE2-CB 4.27Å; Y210-I276 HydrophobicContact CE2-CD1 4.42Å; Y210-I276 HydrophobicContact CE2-CG1 4.02Å; Y210-I276 HydrophobicContact CG-CG1 4.31Å; L217-I276 HydrophobicContact CB-CD1 4.35Å; L217-I276 HydrophobicContact CD1-CD1 4.35Å; L217-I276 HydrophobicContact CD2-CD1 4.35Å; V271-I276 HydrophobicContact CB-CD1 4.48Å; V271-I276 HydrophobicContact CG1-CD1 3.63Å; V271-I276 HydrophobicContact CG2-CB 4.38Å; V271-I276 HydrophobicContact CG2-CD1 4.01Å; S272-I276 PolarHBondContact O-N 2.91Å; I276-Q278 PolarHBondContact O-N 2.84Å; I276-Q278 VanDerWaalsContact O-N 3.09Å; I276-R279 WeakPolarHBondContact O-CB 3.29Å; I276-R279 PolarHBondContact O-N 2.81Å; I276-L304 HydrophobicContact CD1-CD1 3.62Å; I276-L309 HydrophobicContact CG1-CD1 3.65Å; I276-L309 HydrophobicContact CG2-CD1 4.34Å |
| 277 | T | 88.3 | Confident | 93.1 | Very high | 57 Ų | 57 | 40.2 Ų | 40.2 | 35% | 0.35 | 20% | 0.199 | S | C | . | . | G | 310 helix | trans | -64.7 | -14.9 | -177.2 | 64.6 | 0 | 0 | 0 | 0 | 114.4 | T275 L304 N306 | T275-T277 PolarHBondContact O-N 2.9Å; T277-L304 CarbonylContact C-O 3.57Å; T277-L304 WeakPolarHBondContact CA-O 3.49Å; T277-N306 WeakPolarHBondContact CG2-OD1 3.4Å |
| 278 | Q | 84.7 | Confident | 92.9 | Very high | 71 Ų | 71 | 40 Ų | 40 | 33% | 0.332 | 20% | 0.2 | S | C | . | . | G | 310 helix | trans | -108 | -0.9 | -178.1 | -59.8 | 168.8 | -11.9 | 0 | 0 | 112.2 | T275 I276 L391 | T275-Q278 PolarHBondContact O-N 3.3Å; T275-Q278 VanDerWaalsContact O-N 3.08Å; I276-Q278 PolarHBondContact O-N 2.84Å; I276-Q278 VanDerWaalsContact O-N 3.09Å; Q278-L391 VanDerWaalsContact OE1-CD1 3.25Å |
| 279 | R | 88.8 | Confident | 92.5 | Very high | 65 Ų | 65 | 38 Ų | 38 | 25% | 0.245 | 19% | 0.19 | C | C | . | . | trans | -89.1 | 154 | -178.4 | -59 | -61.1 | 175.5 | 154.7 | -2.9 | 111.7 | L242 L243 V271 T275 I276 L304 | L242-R279 HydrophobicContact CD1-CB 3.67Å; L242-R279 HydrophobicContact CD1-CG 4.23Å; L242-R279 HydrophobicContact CD2-CG 4.4Å; L242-R279 HydrophobicContact CG-CB 4.1Å; L242-R279 HydrophobicContact CG-CG 4.18Å; L243-R279 WeakPolarHBondContact O-CD 3.15Å; V271-R279 HydrophobicContact CG2-CG 4.2Å; T275-R279 WeakPolarHBondContact O-CG 3.44Å; T275-R279 PolarHBondContact OG1-NH2 2.66Å; I276-R279 WeakPolarHBondContact O-CB 3.29Å; I276-R279 PolarHBondContact O-N 2.81Å; R279-L304 HydrophobicContact CB-CD1 4.11Å; R279-L304 PolarHBondContact O-N 2.88Å | ||
| 280 | V | 92.3 | Very high | 92 | Very high | 12 Ų | 12 | 48.5 Ų | 48.5 | 7% | 0.073 | 23% | 0.229 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -121.9 | 121.2 | 172.2 | -176.2 | 0 | 0 | 0 | 0 | 108.5 | L243 K282 L301 P303 V397 | L243-V280 HydrophobicContact CB-CB 4.14Å; L243-V280 WeakPolarHBondContact CB-O 3.21Å; L243-V280 HydrophobicContact CD1-CB 4.22Å; L243-V280 HydrophobicContact CD1-CG1 4.34Å; L243-V280 HydrophobicContact CG-CB 4.49Å; L243-V280 WeakPolarHBondContact CG-O 3.49Å; L243-V280 PolarHBondContact N-O 2.97Å; L243-V280 PolarHBondContact O-N 2.99Å; V280-K282 PolarHBondContact O-N 3.19Å; V280-L301 HydrophobicContact CG1-CB 3.95Å; V280-P303 HydrophobicContact CG2-CB 4.4Å; V280-P303 HydrophobicContact CG2-CG 4.41Å; V280-V397 HydrophobicContact CG1-CG2 4.23Å; V280-V397 HydrophobicContact CG2-CB 3.92Å; V280-V397 HydrophobicContact CG2-CG2 4.02Å |
| 281 | L | 95.1 | Very high | 91.6 | Very high | 0 Ų | 0 | 50.9 Ų | 50.9 | 0% | 0 | 24% | 0.24 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -78.9 | 112.4 | 171.9 | -178.2 | 62.5 | 0 | 0 | 0 | 108.3 | V208 V219 F269 F283 F302 L304 | V208-L281 HydrophobicContact CG1-CD2 3.87Å; V219-L281 HydrophobicContact CG1-CD2 3.87Å; V219-L281 HydrophobicContact CG2-CD1 4.1Å; V219-L281 HydrophobicContact CG2-CD2 3.76Å; F269-L281 HydrophobicContact CE2-CD1 3.91Å; F269-L281 HydrophobicContact CZ-CD1 4.46Å; L281-F283 HydrophobicContact CD2-CE2 3.62Å; L281-F283 HydrophobicContact CD2-CZ 3.57Å; L281-F283 HydrophobicContact CG-CD2 4.35Å; L281-F283 HydrophobicContact CG-CE2 3.66Å; L281-F283 HydrophobicContact CG-CZ 3.91Å; L281-F302 HydrophobicContact CB-CB 4.41Å; L281-F302 PolarHBondContact N-O 2.83Å; L281-F302 PolarHBondContact O-N 2.87Å; L281-L304 HydrophobicContact CB-CD1 4.39Å; L281-L304 HydrophobicContact CB-CD2 4.47Å; L281-L304 HydrophobicContact CB-CG 4.45Å |
| 282 | K | 95.3 | Very high | 91.3 | Very high | 25 Ų | 25 | 60.4 Ų | 60.4 | 11% | 0.109 | 28% | 0.275 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.6 | 124.3 | 176.7 | 167.8 | 170.9 | 176.4 | 155.1 | 0 | 109.7 | L240 Y241 L243 V280 S284 V300 L301 E324 | L240-K282 CarbonylContact C-O 3.59Å; L240-K282 WeakPolarHBondContact CA-O 3.31Å; Y241-K282 HydrophobicContact CD2-CD 4.49Å; Y241-K282 HydrophobicContact CD2-CG 4.18Å; Y241-K282 PolarHBondContact N-O 2.85Å; Y241-K282 PolarHBondContact O-N 2.89Å; L243-K282 HydrophobicContact CD1-CB 3.94Å; L243-K282 HydrophobicContact CD1-CD 4.27Å; L243-K282 HydrophobicContact CD2-CB 4.36Å; L243-K282 HydrophobicContact CD2-CD 4.43Å; L243-K282 HydrophobicContact CG-CB 4.02Å; V280-K282 PolarHBondContact O-N 3.19Å; K282-S284 WeakPolarHBondContact CE-OG 3.13Å; K282-V300 CarbonylContact C-O 3.53Å; K282-V300 WeakPolarHBondContact CA-O 2.98Å; K282-L301 HydrophobicContact CB-CD2 3.61Å; K282-L301 HydrophobicContact CD-CD2 3.8Å; K282-L301 HydrophobicContact CG-CD2 3.66Å; K282-E324 IonicContact NZ-OE1 3.53Å; K282-E324 PolarHBondContact NZ-OE1 2.88Å |
| 283 | F | 97.6 | Very high | 91.2 | Very high | 0 Ų | 0 | 65.5 Ų | 65.5 | 0% | 0 | 29% | 0.292 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103 | 127.8 | 165.5 | -56.9 | -98.2 | 0 | 0 | 0 | 108.5 | L204 F206 V219 L221 V238 K239 L240 L281 Q299 V300 | L204-F283 HydrophobicContact CD2-CB 3.55Å; L204-F283 HydrophobicContact CD2-CD1 3.75Å; L204-F283 HydrophobicContact CD2-CD2 4.06Å; L204-F283 HydrophobicContact CD2-CE1 4.43Å; L204-F283 HydrophobicContact CD2-CG 3.53Å; F206-F283 HydrophobicContact CB-CE1 4.08Å; F206-F283 HydrophobicContact CB-CE2 4.42Å; F206-F283 HydrophobicContact CB-CZ 3.66Å; F206-F283 HydrophobicContact CD1-CD2 4.44Å; F206-F283 AromaticContact CD1-CE2 3.76Å; F206-F283 HydrophobicContact CD1-CE2 3.76Å; F206-F283 AromaticContact CD1-CZ 3.87Å; F206-F283 HydrophobicContact CD1-CZ 3.87Å; F206-F283 AromaticContact CD2-CE2 3.75Å; F206-F283 HydrophobicContact CD2-CE2 3.75Å; F206-F283 AromaticContact CD2-CZ 3.56Å; F206-F283 HydrophobicContact CD2-CZ 3.56Å; F206-F283 HydrophobicContact CE1-CD2 4.46Å; F206-F283 AromaticContact CE1-CE2 3.88Å; F206-F283 HydrophobicContact CE1-CE2 3.88Å; F206-F283 HydrophobicContact CE1-CZ 4.43Å; F206-F283 AromaticContact CE2-CE2 3.86Å; F206-F283 HydrophobicContact CE2-CE2 3.86Å; F206-F283 HydrophobicContact CE2-CZ 4.15Å; F206-F283 HydrophobicContact CG-CE1 4.24Å; F206-F283 AromaticContact CG-CE2 3.7Å; F206-F283 HydrophobicContact CG-CE2 3.7Å; F206-F283 AromaticContact CG-CZ 3.4Å; F206-F283 HydrophobicContact CG-CZ 3.4Å; F206-F283 VanDerWaalsContact CG-CZ 3.4Å; F206-F283 AromaticContact CZ-CE2 3.93Å; F206-F283 HydrophobicContact CZ-CE2 3.93Å; V219-F283 HydrophobicContact CG1-CE1 4.03Å; V219-F283 HydrophobicContact CG1-CZ 3.82Å; L221-F283 HydrophobicContact CD1-CD1 4.18Å; L221-F283 HydrophobicContact CD1-CE1 4.14Å; V238-F283 HydrophobicContact CG1-CB 4.1Å; V238-F283 HydrophobicContact CG1-CD1 3.99Å; K239-F283 CarbonylContact O-C 3.22Å; K239-F283 WeakPolarHBondContact O-CA 3.18Å; L240-F283 HydrophobicContact CD1-CD1 4.47Å; L240-F283 HydrophobicContact CD2-CD1 3.99Å; L240-F283 HydrophobicContact CD2-CE1 3.54Å; L240-F283 HydrophobicContact CD2-CZ 4.42Å; L240-F283 HydrophobicContact CG-CD1 3.71Å; L240-F283 HydrophobicContact CG-CE1 3.83Å; L281-F283 HydrophobicContact CD2-CE2 3.62Å; L281-F283 HydrophobicContact CD2-CZ 3.57Å; L281-F283 HydrophobicContact CG-CD2 4.35Å; L281-F283 HydrophobicContact CG-CE2 3.66Å; L281-F283 HydrophobicContact CG-CZ 3.91Å; F283-Q299 CarbonylContact O-C 3.54Å; F283-Q299 WeakPolarHBondContact O-CA 3.21Å; F283-Q299 WeakPolarHBondContact O-CB 3.45Å; F283-V300 HydrophobicContact CB-CB 4.28Å; F283-V300 HydrophobicContact CD2-CB 4.18Å; F283-V300 HydrophobicContact CD2-CG1 4.21Å; F283-V300 PolarHBondContact N-O 3.2Å; F283-V300 PolarHBondContact O-N 3.47Å |
| 284 | S | 96.9 | Very high | 91.3 | Very high | 1 Ų | 1 | 67.3 Ų | 67.3 | 1% | 0.007 | 30% | 0.296 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.9 | 116.3 | 169.8 | -70.8 | 0 | 0 | 0 | 0 | 108.7 | V238 K239 K282 Y286 | V238-S284 WeakPolarHBondContact CA-O 3.26Å; K239-S284 PolarHBondContact N-O 2.88Å; K239-S284 PolarHBondContact O-N 3.03Å; K282-S284 WeakPolarHBondContact CE-OG 3.13Å; S284-Y286 VanDerWaalsContact CB-CE2 3.47Å; S284-Y286 WeakPolarHBondContact O-CD2 3.35Å |
| 285 | V | 96.9 | Very high | 91.5 | Very high | 0 Ų | 0 | 63.3 Ų | 63.3 | 0% | 0 | 28% | 0.28 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.8 | 120.9 | -177.4 | -174 | 0 | 0 | 0 | 0 | 108.8 | L227 V238 L296 L297 G298 L321 | L227-V285 HydrophobicContact CD1-CG1 4.06Å; L227-V285 HydrophobicContact CD2-CG1 4.06Å; V238-V285 HydrophobicContact CG1-CG2 4.39Å; V238-V285 HydrophobicContact CG2-CG1 4.42Å; V238-V285 HydrophobicContact CG2-CG2 4.17Å; V285-L296 WeakPolarHBondContact O-CD1 3.37Å; V285-L297 PolarHBondContact O-N 2.83Å; V285-G298 PolarHBondContact N-O 2.93Å; V285-G298 PolarHBondContact O-N 2.97Å; V285-L321 HydrophobicContact CB-CD2 3.69Å; V285-L321 HydrophobicContact CG1-CD2 4.2Å; V285-L321 HydrophobicContact CG2-CD2 3.76Å; V285-L321 HydrophobicContact CG2-CG 4.29Å |
| 286 | Y | 95.4 | Very high | 91.7 | Very high | 35 Ų | 35 | 63.7 Ų | 63.7 | 14% | 0.137 | 28% | 0.28 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.2 | 143.3 | -177.8 | -63.3 | -90.2 | 0 | 0 | 0 | 111.3 | P236 L237 K239 S284 H294 Q295 L296 | P236-Y286 CarbonylContact C-O 3.49Å; P236-Y286 VanDerWaalsContact CA-O 3.28Å; P236-Y286 WeakPolarHBondContact CA-O 3.41Å; L237-Y286 PolarHBondContact N-O 2.81Å; L237-Y286 PolarHBondContact O-N 3.05Å; K239-Y286 HydrophobicContact CB-CE2 4.15Å; K239-Y286 HydrophobicContact CD-CD2 4.49Å; K239-Y286 HydrophobicContact CD-CE2 3.82Å; K239-Y286 HydrophobicContact CG-CD2 4.32Å; K239-Y286 HydrophobicContact CG-CE2 3.96Å; S284-Y286 VanDerWaalsContact CB-CE2 3.47Å; S284-Y286 WeakPolarHBondContact O-CD2 3.35Å; Y286-H294 HydrophobicContact CD1-CB 3.82Å; Y286-H294 HydrophobicContact CE1-CB 4.44Å; Y286-H294 HydrophobicContact CG-CB 4.25Å; Y286-Q295 CarbonylContact C-O 3.55Å; Y286-Q295 WeakPolarHBondContact CA-O 3.2Å; Y286-L296 HydrophobicContact CD1-CB 4.05Å; Y286-L296 HydrophobicContact CD1-CD1 3.99Å; Y286-L296 HydrophobicContact CD2-CD1 4.43Å; Y286-L296 HydrophobicContact CE1-CB 3.9Å; Y286-L296 HydrophobicContact CE1-CD1 3.63Å; Y286-L296 HydrophobicContact CE1-CG 4.38Å; Y286-L296 HydrophobicContact CE2-CD1 4.12Å; Y286-L296 HydrophobicContact CG-CD1 4.37Å |
| 287 | H | 94.3 | Very high | 91.9 | Very high | 9 Ų | 9 | 64.2 Ų | 64.2 | 4% | 0.042 | 28% | 0.283 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.7 | 130.8 | 155.2 | 173.5 | 85.2 | 0 | 0 | 0 | 109.4 | T233 S235 Q295 L297 | T233-H287 PolarHBondContact O-CE1 2.92Å; T233-H287 VanDerWaalsContact O-CE1 3.25Å; S235-H287 PolarHBondContact N-ND1 2.83Å; H287-Q295 PolarHBondContact N-O 3.48Å; H287-Q295 PolarHBondContact O-N 3.11Å; H287-L297 HydrophobicContact CB-CD1 4.17Å; H287-L297 HydrophobicContact CB-CD2 3.72Å; H287-L297 HydrophobicContact CB-CG 4.04Å |
| 288 | V | 92.9 | Very high | 92.1 | Very high | 19 Ų | 19 | 61.6 Ų | 61.6 | 12% | 0.115 | 27% | 0.267 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100 | 115.2 | 170.4 | -175.7 | 0 | 0 | 0 | 0 | 108.9 | S235 L237 T254 R292 | S235-V288 WeakPolarHBondContact CB-O 3.47Å; S235-V288 PolarHBondContact O-N 3.06Å; L237-V288 HydrophobicContact CB-CG2 3.76Å; L237-V288 HydrophobicContact CD2-CG2 3.75Å; L237-V288 HydrophobicContact CG-CG2 4.4Å; T254-V288 HydrophobicContact CG2-CB 4.09Å; T254-V288 HydrophobicContact CG2-CG2 3.93Å; V288-R292 HydrophobicContact CG1-CB 4.42Å |
| 289 | D | 88 | Confident | 92.6 | Very high | 52 Ų | 52 | 58.9 Ų | 58.9 | 28% | 0.278 | 26% | 0.255 | S | S | . | . | trans | -78.6 | -178.9 | -177.4 | 78.8 | 5.3 | 0 | 0 | 0 | 113.2 | Q291 R292 K293 | D289-Q291 PolarHBondContact O-N 3.4Å; D289-Q291 VanDerWaalsContact OD1-C 3.23Å; D289-Q291 VanDerWaalsContact OD1-CA 3.24Å; D289-Q291 WeakPolarHBondContact OD1-CA 3.36Å; D289-Q291 WeakPolarHBondContact OD1-CB 3.07Å; D289-Q291 PolarHBondContact OD1-N 2.8Å; D289-R292 PolarHBondContact O-N 2.95Å; D289-R292 PolarHBondContact OD1-N 3.04Å; D289-K293 PolarHBondContact N-O 2.88Å; D289-K293 PolarHBondContact OD1-N 3.4Å; D289-K293 WeakPolarHBondContact OD2-CB 3.4Å | ||
| 290 | R | 85.9 | Confident | 92.9 | Very high | 244 Ų | 244 | 56 Ų | 56 | 92% | 0.921 | 24% | 0.244 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -63.2 | -25.2 | 177.8 | -62.7 | -174.9 | -174.7 | -177.4 | 3.7 | 113.4 | R292 | R290-R292 VanDerWaalsContact C-N 3.31Š|
| 291 | Q | 87.4 | Confident | 92.9 | Very high | 170 Ų | 170 | 56.9 Ų | 56.9 | 79% | 0.794 | 25% | 0.249 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -89 | 2.3 | 176.9 | -59.4 | -176.9 | -4.4 | 0 | 0 | 112.3 | D289 K293 | D289-Q291 PolarHBondContact O-N 3.4Å; D289-Q291 VanDerWaalsContact OD1-C 3.23Å; D289-Q291 VanDerWaalsContact OD1-CA 3.24Å; D289-Q291 WeakPolarHBondContact OD1-CA 3.36Å; D289-Q291 WeakPolarHBondContact OD1-CB 3.07Å; D289-Q291 PolarHBondContact OD1-N 2.8Å; Q291-K293 PolarHBondContact O-N 3.3Å |
| 292 | R | 87.1 | Confident | 92.8 | Very high | 211 Ų | 211 | 57.3 Ų | 57.3 | 80% | 0.796 | 25% | 0.25 | S | S | * | . | trans | 62.3 | 20.8 | -171.7 | -51.9 | -174.7 | 178.5 | -149.4 | 3 | 114.2 | V288 D289 R290 H294 | V288-R292 HydrophobicContact CG1-CB 4.42Å; D289-R292 PolarHBondContact O-N 2.95Å; D289-R292 PolarHBondContact OD1-N 3.04Å; R290-R292 VanDerWaalsContact C-N 3.31Å; R292-H294 PolarHBondContact O-CD2 3.47Å | ||
| 293 | K | 90.1 | Very high | 92.6 | Very high | 144 Ų | 144 | 56.9 Ų | 56.9 | 63% | 0.626 | 25% | 0.25 | S | S | * | . | trans | -73.2 | 137.9 | 168.1 | -170.4 | -179.3 | 176.8 | -177.2 | 0 | 108.5 | D289 Q291 | D289-K293 PolarHBondContact N-O 2.88Å; D289-K293 PolarHBondContact OD1-N 3.4Å; D289-K293 WeakPolarHBondContact OD2-CB 3.4Å; Q291-K293 PolarHBondContact O-N 3.3Å | ||
| 294 | H | 92.9 | Very high | 92.2 | Very high | 77 Ų | 77 | 56.9 Ų | 56.9 | 36% | 0.356 | 25% | 0.25 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.7 | 121.5 | 176 | -68.5 | -154 | 0 | 0 | 0 | 108.8 | L237 Y286 R292 | L237-H294 WeakPolarHBondContact CD2-CE1 3.41Å; Y286-H294 HydrophobicContact CD1-CB 3.82Å; Y286-H294 HydrophobicContact CE1-CB 4.44Å; Y286-H294 HydrophobicContact CG-CB 4.25Å; R292-H294 PolarHBondContact O-CD2 3.47Å |
| 295 | Q | 92.6 | Very high | 91.5 | Very high | 92 Ų | 92 | 59.9 Ų | 59.9 | 43% | 0.43 | 26% | 0.263 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.8 | 124.1 | 170.9 | -179.1 | 171.4 | 28.7 | 0 | 0 | 108.6 | Y286 H287 | Y286-Q295 CarbonylContact C-O 3.55Å; Y286-Q295 WeakPolarHBondContact CA-O 3.2Å; H287-Q295 PolarHBondContact N-O 3.48Å; H287-Q295 PolarHBondContact O-N 3.11Å |
| 296 | L | 93.3 | Very high | 90.2 | Very high | 48 Ų | 48 | 65.1 Ų | 65.1 | 25% | 0.251 | 29% | 0.291 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -70 | 133.3 | 177.9 | -171.6 | 74.8 | 0 | 0 | 0 | 109.8 | V285 Y286 E324 | V285-L296 WeakPolarHBondContact O-CD1 3.37Å; Y286-L296 HydrophobicContact CD1-CB 4.05Å; Y286-L296 HydrophobicContact CD1-CD1 3.99Å; Y286-L296 HydrophobicContact CD2-CD1 4.43Å; Y286-L296 HydrophobicContact CE1-CB 3.9Å; Y286-L296 HydrophobicContact CE1-CD1 3.63Å; Y286-L296 HydrophobicContact CE1-CG 4.38Å; Y286-L296 HydrophobicContact CE2-CD1 4.12Å; Y286-L296 HydrophobicContact CG-CD1 4.37Å; L296-E324 HydrophobicContact CD2-CB 3.42Å; L296-E324 VanDerWaalsContact CD2-CB 3.42Å; L296-E324 HydrophobicContact CD2-CG 4.25Å; L296-E324 VanDerWaalsContact CD2-OE2 3.26Å; L296-E324 WeakPolarHBondContact CD2-OE2 3.5Å |
| 297 | L | 93.4 | Very high | 88.7 | Confident | 17 Ų | 17 | 70.7 Ų | 70.7 | 9% | 0.089 | 32% | 0.318 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.1 | -39.3 | 171.1 | -56.8 | -173.5 | 0 | 0 | 0 | 111 | L227 Q228 A229 V285 H287 | L227-L297 HydrophobicContact CB-CD1 4.28Å; Q228-L297 WeakPolarHBondContact O-CD2 3.41Å; A229-L297 HydrophobicContact CB-CD2 4.5Å; V285-L297 PolarHBondContact O-N 2.83Å; H287-L297 HydrophobicContact CB-CD1 4.17Å; H287-L297 HydrophobicContact CB-CD2 3.72Å; H287-L297 HydrophobicContact CB-CG 4.04Å |
| 298 | G | 94.3 | Very high | 87.3 | Confident | 1 Ų | 1 | 71.4 Ų | 71.4 | 1% | 0.01 | 32% | 0.323 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 175 | -177.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112 | V285 E322 | V285-G298 PolarHBondContact N-O 2.93Å; V285-G298 PolarHBondContact O-N 2.97Å; G298-E322 CarbonylContact C-O 3.39Å; G298-E322 VanDerWaalsContact CA-O 3.26Å; G298-E322 WeakPolarHBondContact CA-O 3.26Å |
| 299 | Q | 94.8 | Very high | 86.4 | Confident | 14 Ų | 14 | 72.1 Ų | 72.1 | 7% | 0.065 | 33% | 0.326 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.2 | 155.7 | -178.5 | 60.8 | 175.6 | -18 | 0 | 0 | 112.7 | F283 E322 E324 | F283-Q299 CarbonylContact O-C 3.54Å; F283-Q299 WeakPolarHBondContact O-CA 3.21Å; F283-Q299 WeakPolarHBondContact O-CB 3.45Å; Q299-E322 PolarHBondContact N-O 3.12Å; Q299-E322 PolarHBondContact O-N 3.48Å; Q299-E324 PolarHBondContact OE1-OE1 2.68Å |
| 300 | V | 94.7 | Very high | 85.3 | Confident | 4 Ų | 4 | 74.6 Ų | 74.6 | 2% | 0.024 | 34% | 0.343 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.8 | 129.6 | 168.6 | 172.1 | 0 | 0 | 0 | 0 | 107.9 | L204 F206 K282 F283 R319 | L204-V300 HydrophobicContact CB-CG2 4.2Å; L204-V300 HydrophobicContact CD2-CG2 4.2Å; F206-V300 HydrophobicContact CE1-CG1 4.16Å; K282-V300 CarbonylContact C-O 3.53Å; K282-V300 WeakPolarHBondContact CA-O 2.98Å; F283-V300 HydrophobicContact CB-CB 4.28Å; F283-V300 HydrophobicContact CD2-CB 4.18Å; F283-V300 HydrophobicContact CD2-CG1 4.21Å; F283-V300 PolarHBondContact N-O 3.2Å; F283-V300 PolarHBondContact O-N 3.47Å; V300-R319 HydrophobicContact CB-CB 4.44Å; V300-R319 HydrophobicContact CG1-CB 3.55Å; V300-R319 HydrophobicContact CG1-CG 3.86Å; V300-R319 HydrophobicContact CG2-CB 3.99Å |
| 301 | L | 92.7 | Very high | 84.3 | Confident | 32 Ų | 32 | 65.1 Ų | 65.1 | 17% | 0.168 | 32% | 0.322 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.3 | 120.7 | 169.6 | -58.8 | -172.5 | 0 | 0 | 0 | 109.4 | L243 V280 K282 R354 V397 | L243-L301 HydrophobicContact CD1-CD2 4.26Å; V280-L301 HydrophobicContact CG1-CB 3.95Å; K282-L301 HydrophobicContact CB-CD2 3.61Å; K282-L301 HydrophobicContact CD-CD2 3.8Å; K282-L301 HydrophobicContact CG-CD2 3.66Å; L301-R354 VanDerWaalsContact CD1-NH1 3.34Å; L301-V397 HydrophobicContact CD1-CG2 3.9Å |
| 302 | F | 92.5 | Very high | 83.2 | Confident | 9 Ų | 9 | 63.6 Ų | 63.6 | 4% | 0.039 | 32% | 0.319 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.9 | 101.4 | -179.6 | -173.8 | -100.4 | 0 | 0 | 0 | 111.2 | F206 V208 L281 L304 T308 I317 | F206-F302 HydrophobicContact CE2-CB 4.32Å; F206-F302 HydrophobicContact CE2-CD1 4.06Å; F206-F302 HydrophobicContact CE2-CD2 4.31Å; F206-F302 AromaticContact CE2-CG 3.95Å; F206-F302 HydrophobicContact CE2-CG 3.95Å; F206-F302 HydrophobicContact CZ-CB 3.97Å; F206-F302 HydrophobicContact CZ-CD1 4.39Å; F206-F302 AromaticContact CZ-CD2 3.89Å; F206-F302 HydrophobicContact CZ-CD2 3.89Å; F206-F302 AromaticContact CZ-CG 3.8Å; F206-F302 HydrophobicContact CZ-CG 3.8Å; V208-F302 HydrophobicContact CG1-CD1 4.46Å; V208-F302 HydrophobicContact CG1-CE1 4.35Å; V208-F302 HydrophobicContact CG2-CE1 4.15Å; L281-F302 HydrophobicContact CB-CB 4.41Å; L281-F302 PolarHBondContact N-O 2.83Å; L281-F302 PolarHBondContact O-N 2.87Å; F302-L304 HydrophobicContact CD1-CD2 3.77Å; F302-L304 HydrophobicContact CE1-CD2 3.83Å; F302-L304 PolarHBondContact O-N 2.86Å; F302-T308 HydrophobicContact CE1-CG2 4.38Å; F302-T308 HydrophobicContact CZ-CG2 3.72Å; F302-I317 HydrophobicContact CE1-CD1 3.92Å; F302-I317 HydrophobicContact CE2-CD1 3.66Å; F302-I317 HydrophobicContact CE2-CG2 4.06Å; F302-I317 HydrophobicContact CZ-CD1 3.23Å |
| 303 | P | 90.9 | Very high | 82.4 | Confident | 16 Ų | 16 | 58.2 Ų | 58.2 | 10% | 0.104 | 31% | 0.312 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -66.6 | 128 | 173.8 | -22.1 | 35.1 | 0 | 0 | 0 | 111.3 | V280 K305 V397 | V280-P303 HydrophobicContact CG2-CB 4.4Å; V280-P303 HydrophobicContact CG2-CG 4.41Å; P303-K305 VanDerWaalsContact C-N 3.32Å; P303-K305 HydrophobicContact CB-CG 4.4Å; P303-K305 PolarHBondContact O-N 2.89Å; P303-V397 HydrophobicContact CG-CB 4.03Å; P303-V397 HydrophobicContact CG-CG1 3.42Å; P303-V397 VanDerWaalsContact CG-CG1 3.42Å |
| 304 | L | 90 | Very high | 82.1 | Confident | 0 Ų | 0 | 56.7 Ų | 56.7 | 0% | 0 | 30% | 0.303 | C | S | . | . | trans | -85.3 | 72 | -177.8 | -63.8 | 170.2 | 0 | 0 | 0 | 109.9 | V208 L217 L242 I276 T277 R279 L281 F302 L309 | V208-L304 HydrophobicContact CG1-CD2 4.31Å; L217-L304 HydrophobicContact CD1-CD1 4.23Å; L217-L304 HydrophobicContact CD1-CD2 4.26Å; L217-L304 HydrophobicContact CD2-CD1 3.53Å; L242-L304 HydrophobicContact CD1-CD1 3.69Å; I276-L304 HydrophobicContact CD1-CD1 3.62Å; T277-L304 CarbonylContact C-O 3.57Å; T277-L304 WeakPolarHBondContact CA-O 3.49Å; R279-L304 HydrophobicContact CB-CD1 4.11Å; R279-L304 PolarHBondContact O-N 2.88Å; L281-L304 HydrophobicContact CB-CD1 4.39Å; L281-L304 HydrophobicContact CB-CD2 4.47Å; L281-L304 HydrophobicContact CB-CG 4.45Å; F302-L304 HydrophobicContact CD1-CD2 3.77Å; F302-L304 HydrophobicContact CE1-CD2 3.83Å; F302-L304 PolarHBondContact O-N 2.86Å; L304-L309 HydrophobicContact CB-CD1 4.33Å; L304-L309 HydrophobicContact CD2-CD2 4.41Å | ||
| 305 | K | 82.1 | Confident | 81.9 | Confident | 64 Ų | 64 | 57.8 Ų | 57.8 | 28% | 0.278 | 30% | 0.304 | S | S | . | . | trans | -77.2 | 155 | 178.1 | -63 | -173.3 | 176.8 | -171.8 | 0 | 111.3 | P303 E307 T308 Y398 N399 | P303-K305 VanDerWaalsContact C-N 3.32Å; P303-K305 HydrophobicContact CB-CG 4.4Å; P303-K305 PolarHBondContact O-N 2.89Å; K305-E307 VanDerWaalsContact C-N 3.31Å; K305-E307 PolarHBondContact O-N 2.89Å; K305-T308 PolarHBondContact N-OG1 2.99Å; K305-T308 WeakPolarHBondContact O-CB 3.37Å; K305-T308 PolarHBondContact O-N 2.85Å; K305-T308 PolarHBondContact O-OG1 3.05Å; K305-Y398 WeakPolarHBondContact CE-O 3.38Å; K305-Y398 PolarHBondContact NZ-O 2.72Å; K305-N399 PolarHBondContact NZ-O 2.91Å | ||
| 306 | N | 69.2 | Low | 81.9 | Confident | 109 Ų | 109 | 57.7 Ų | 57.7 | 58% | 0.583 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -43.1 | -55 | 177.5 | -76.1 | 7.5 | 0 | 0 | 0 | 112.5 | T277 T308 L309 V310 | T277-N306 WeakPolarHBondContact CG2-OD1 3.4Å; N306-T308 PolarHBondContact O-N 3.47Å; N306-L309 CarbonylContact O-C 3.52Å; N306-L309 WeakPolarHBondContact O-CA 3.24Å; N306-L309 PolarHBondContact O-N 3.42Å; N306-V310 WeakPolarHBondContact O-CG2 3.18Å; N306-V310 PolarHBondContact O-N 2.87Å |
| 307 | E | 63.5 | Low | 81.8 | Confident | 152 Ų | 152 | 56.2 Ų | 56.2 | 71% | 0.71 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -54 | -23.6 | -179.2 | -63.3 | 166.3 | -169.5 | 0 | 0 | 114.7 | K305 R315 | K305-E307 VanDerWaalsContact C-N 3.31Å; K305-E307 PolarHBondContact O-N 2.89Å; E307-R315 VanDerWaalsContact O-CZ 3.25Å; E307-R315 PolarHBondContact O-NH1 3.1Å; E307-R315 PolarHBondContact O-NH2 2.62Å |
| 308 | T | 64.9 | Low | 81.8 | Confident | 25 Ų | 25 | 59.3 Ų | 59.3 | 15% | 0.153 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -85 | -18.8 | 177.8 | 68.9 | 0 | 0 | 0 | 0 | 113.5 | F302 K305 N306 | F302-T308 HydrophobicContact CE1-CG2 4.38Å; F302-T308 HydrophobicContact CZ-CG2 3.72Å; K305-T308 PolarHBondContact N-OG1 2.99Å; K305-T308 WeakPolarHBondContact O-CB 3.37Å; K305-T308 PolarHBondContact O-N 2.85Å; K305-T308 PolarHBondContact O-OG1 3.05Å; N306-T308 PolarHBondContact O-N 3.47Å |
| 309 | L | 73.9 | Confident | 81.8 | Confident | 33 Ų | 33 | 64.4 Ų | 64.4 | 17% | 0.173 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -115.9 | 5.3 | -178.3 | -55 | -179.6 | 0 | 0 | 0 | 112.8 | V208 Y210 L217 I276 L304 N306 G311 | V208-L309 HydrophobicContact CG2-CD2 4.42Å; Y210-L309 HydrophobicContact CG-CD1 4.41Å; L217-L309 HydrophobicContact CD1-CD2 4.36Å; I276-L309 HydrophobicContact CG1-CD1 3.65Å; I276-L309 HydrophobicContact CG2-CD1 4.34Å; L304-L309 HydrophobicContact CB-CD1 4.33Å; L304-L309 HydrophobicContact CD2-CD2 4.41Å; N306-L309 CarbonylContact O-C 3.52Å; N306-L309 WeakPolarHBondContact O-CA 3.24Å; N306-L309 PolarHBondContact O-N 3.42Å; L309-G311 PolarHBondContact O-N 2.87Å |
| 310 | V | 66.1 | Low | 81.7 | Confident | 104 Ų | 104 | 66.3 Ų | 66.3 | 63% | 0.63 | 34% | 0.341 | S | S | * | . | trans | -71.7 | 124.3 | 174.5 | 163.3 | 0 | 0 | 0 | 0 | 109.8 | N306 R315 | N306-V310 WeakPolarHBondContact O-CG2 3.18Å; N306-V310 PolarHBondContact O-N 2.87Å; V310-R315 PolarHBondContact O-NH2 2.72Å | ||
| 311 | G | 64.1 | Low | 81.6 | Confident | 46 Ų | 46 | 66.5 Ų | 66.5 | 47% | 0.474 | 34% | 0.342 | S | S | . | . | S | Bend | trans | 91.4 | 131.3 | -174.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | L309 C313 | L309-G311 PolarHBondContact O-N 2.87Å; G311-C313 PolarHBondContact O-N 3.18Å |
| 312 | D | 63.5 | Low | 81.6 | Confident | 138 Ų | 138 | 67.4 Ų | 67.4 | 74% | 0.738 | 35% | 0.346 | S | S | * | . | S | Bend | trans | -73.5 | 56.3 | 175.1 | -55 | -59 | 0 | 0 | 0 | 110.7 | ||
| 313 | C | 71 | Confident | 81.4 | Confident | 97 Ų | 97 | 70.2 Ų | 70.2 | 66% | 0.655 | 37% | 0.371 | S | S | * | . | S | Bend | trans | -141.5 | 117.8 | -171.7 | -71.8 | 0 | 0 | 0 | 0 | 110.2 | G311 R315 | G311-C313 PolarHBondContact O-N 3.18Å; C313-R315 PolarHBondContact O-N 3.3Å |
| 314 | R | 83.9 | Confident | 81 | Confident | 113 Ų | 113 | 72.9 Ų | 72.9 | 43% | 0.426 | 38% | 0.382 | S | S | . | . | trans | -43.3 | 103.3 | 170.9 | -170 | 177.2 | 176 | -171.2 | 0.7 | 114.2 | S207 E209 H266 | S207-R314 PolarHBondContact OG-NE 3.09Å; S207-R314 PolarHBondContact OG-NH2 3.1Å; S207-R314 VanDerWaalsContact OG-NH2 3.17Å; E209-R314 HydrophobicContact CB-CB 4.47Å; E209-R314 PolarHBondContact OE1-N 3.05Å; E209-R314 WeakPolarHBondContact OE2-CB 3.42Å; H266-R314 VanDerWaalsContact CE1-CZ 3.5Å; H266-R314 PolarHBondContact CE1-NH1 3.07Å; H266-R314 PolarHBondContact CE1-NH2 3.32Å; H266-R314 VanDerWaalsContact CE1-NH2 3.35Å | ||
| 315 | R | 88.3 | Confident | 80.1 | Confident | 100 Ų | 100 | 75.3 Ų | 75.3 | 38% | 0.377 | 40% | 0.398 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.5 | 122.9 | 177.3 | -170.9 | 179.5 | -60.4 | -170.1 | 10.8 | 111 | S207 V208 E307 V310 C313 I317 | S207-R315 CarbonylContact C-O 3.52Å; S207-R315 WeakPolarHBondContact CA-O 3.48Å; S207-R315 WeakPolarHBondContact CB-O 3.43Å; V208-R315 PolarHBondContact N-O 2.88Å; V208-R315 PolarHBondContact O-N 2.99Å; E307-R315 VanDerWaalsContact O-CZ 3.25Å; E307-R315 PolarHBondContact O-NH1 3.1Å; E307-R315 PolarHBondContact O-NH2 2.62Å; V310-R315 PolarHBondContact O-NH2 2.72Å; C313-R315 PolarHBondContact O-N 3.3Å; R315-I317 HydrophobicContact CG-CD1 4.36Å; R315-I317 HydrophobicContact CG-CG1 4.05Å |
| 316 | V | 92.1 | Very high | 79.5 | Confident | 89 Ų | 89 | 80.4 Ų | 80.4 | 54% | 0.539 | 43% | 0.428 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.4 | 136.3 | 171.2 | -179.9 | 0 | 0 | 0 | 0 | 110.1 | I222 | I222-V316 HydrophobicContact CD1-CG1 3.81Å; I222-V316 HydrophobicContact CD1-CG2 4.08Å |
| 317 | I | 92.8 | Very high | 79.8 | Confident | 18 Ų | 18 | 81.7 Ų | 81.7 | 9% | 0.092 | 43% | 0.43 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.7 | 138.1 | -174 | -53.4 | -177.3 | 0 | 0 | 0 | 108.8 | W205 F206 V208 F302 R315 | W205-I317 WeakPolarHBondContact CA-O 3.12Å; F206-I317 HydrophobicContact CE1-CG2 4.45Å; F206-I317 HydrophobicContact CE2-CB 4.13Å; F206-I317 HydrophobicContact CE2-CD1 4.48Å; F206-I317 HydrophobicContact CE2-CG2 4.4Å; F206-I317 HydrophobicContact CZ-CB 4.13Å; F206-I317 HydrophobicContact CZ-CG2 3.96Å; F206-I317 PolarHBondContact N-O 3.19Å; F206-I317 PolarHBondContact O-N 3.48Å; V208-I317 HydrophobicContact CG2-CD1 3.78Å; F302-I317 HydrophobicContact CE1-CD1 3.92Å; F302-I317 HydrophobicContact CE2-CD1 3.66Å; F302-I317 HydrophobicContact CE2-CG2 4.06Å; F302-I317 HydrophobicContact CZ-CD1 3.23Å; R315-I317 HydrophobicContact CG-CD1 4.36Å; R315-I317 HydrophobicContact CG-CG1 4.05Å |
| 318 | W | 93.3 | Very high | 80.3 | Confident | 81 Ų | 81 | 79.7 Ų | 79.7 | 31% | 0.307 | 43% | 0.431 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.7 | 147.8 | 169.1 | 60.7 | -104.7 | 0 | 0 | 0 | 111.9 | R203 L204 W205 | R203-W318 HydrophobicContact CG-CB 4.28Å; R203-W318 HydrophobicContact CG-CE3 4.32Å; L204-W318 CarbonylContact O-C 3.6Å; L204-W318 VanDerWaalsContact O-CA 3.27Å; L204-W318 WeakPolarHBondContact O-CA 3.02Å; W205-W318 HydrophobicContact CD2-CB 4.02Å; W205-W318 HydrophobicContact CG-CB 3.98Å |
| 319 | R | 93.1 | Very high | 81.1 | Confident | 109 Ų | 109 | 81.6 Ų | 81.6 | 41% | 0.411 | 44% | 0.443 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.7 | 140.9 | 174.2 | -69.8 | -63.8 | 176.1 | -106.5 | 10.4 | 111 | L204 F206 V300 | L204-R319 PolarHBondContact N-O 3.17Å; L204-R319 PolarHBondContact O-N 3.05Å; F206-R319 HydrophobicContact CE1-CB 4.39Å; F206-R319 HydrophobicContact CE1-CG 4.14Å; F206-R319 HydrophobicContact CZ-CG 4.35Å; V300-R319 HydrophobicContact CB-CB 4.44Å; V300-R319 HydrophobicContact CG1-CB 3.55Å; V300-R319 HydrophobicContact CG1-CG 3.86Å; V300-R319 HydrophobicContact CG2-CB 3.99Å |
| 320 | D | 93 | Very high | 81.7 | Confident | 53 Ų | 53 | 81.9 Ų | 81.9 | 28% | 0.283 | 45% | 0.448 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.3 | 144.8 | 171.6 | -59.1 | -36.5 | 0 | 0 | 0 | 110.7 | R203 | R203-D320 IonicContact CZ-OD1 2.68Å; R203-D320 IonicContact NE-OD1 3.87Å; R203-D320 PolarHBondContact NE-OD1 3.08Å; R203-D320 IonicContact NH2-OD1 2.77Å; R203-D320 PolarHBondContact NH2-OD1 3.43Å; R203-D320 VanDerWaalsContact NH2-OD1 3.12Å; R203-D320 IonicContact NH2-OD2 3.8Å |
| 321 | L | 93.6 | Very high | 82.7 | Confident | 8 Ų | 8 | 82.3 Ų | 82.3 | 4% | 0.042 | 44% | 0.443 | C | S | . | . | P | Polyproline II helix | trans | -72.7 | 127.8 | 174.9 | -81.8 | 79.8 | 0 | 0 | 0 | 109.8 | L201 G202 L204 L227 V285 | L201-L321 HydrophobicContact CB-CB 3.86Å; G202-L321 VanDerWaalsContact C-CD1 3.45Å; G202-L321 VanDerWaalsContact O-CD1 3.24Å; G202-L321 WeakPolarHBondContact O-CD1 3.49Å; G202-L321 PolarHBondContact O-N 3.41Å; L204-L321 HydrophobicContact CB-CD1 4.11Å; L227-L321 HydrophobicContact CD2-CD1 4Å; L227-L321 HydrophobicContact CD2-CD2 3.85Å; V285-L321 HydrophobicContact CB-CD2 3.69Å; V285-L321 HydrophobicContact CG1-CD2 4.2Å; V285-L321 HydrophobicContact CG2-CD2 3.76Å; V285-L321 HydrophobicContact CG2-CG 4.29Å |
| 322 | E | 90.9 | Very high | 83.9 | Confident | 52 Ų | 52 | 81.5 Ų | 81.5 | 24% | 0.243 | 43% | 0.427 | C | S | . | . | B | Isolated β-bridge | trans | -95.5 | 146.9 | 169.3 | -62.7 | -167.9 | 122.2 | 0 | 0 | 111.1 | G298 Q299 R354 K463 | G298-E322 CarbonylContact C-O 3.39Å; G298-E322 VanDerWaalsContact CA-O 3.26Å; G298-E322 WeakPolarHBondContact CA-O 3.26Å; Q299-E322 PolarHBondContact N-O 3.12Å; Q299-E322 PolarHBondContact O-N 3.48Å; E322-R354 IonicContact OE1-NH2 3.69Å; E322-R354 IonicContact OE2-CZ 3.12Å; E322-R354 IonicContact OE2-NH1 2.72Å; E322-R354 PolarHBondContact OE2-NH1 2.81Å; E322-R354 IonicContact OE2-NH2 2.71Å; E322-R354 PolarHBondContact OE2-NH2 2.93Å; E322-K463 IonicContact OE1-NZ 3.71Å; E322-K463 PolarHBondContact OE1-NZ 3.05Å |
| 323 | A | 88.4 | Confident | 85.3 | Confident | 68 Ų | 68 | 75 Ų | 75 | 56% | 0.562 | 39% | 0.392 | S | S | * | . | P | Polyproline II helix | trans | -61.5 | 140.1 | 169.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | L201 | L201-A323 HydrophobicContact CD1-CB 3.93Å; L201-A323 VanDerWaalsContact CD1-N 3.32Å |
| 324 | E | 82.9 | Confident | 86.4 | Confident | 72 Ų | 72 | 70.8 Ų | 70.8 | 34% | 0.336 | 36% | 0.363 | S | S | . | . | P | Polyproline II helix | trans | -77.1 | 129.5 | 164.1 | -168.4 | 157.4 | -113.6 | 0 | 0 | 108.7 | K282 L296 Q299 L326 | K282-E324 IonicContact NZ-OE1 3.53Å; K282-E324 PolarHBondContact NZ-OE1 2.88Å; L296-E324 HydrophobicContact CD2-CB 3.42Å; L296-E324 VanDerWaalsContact CD2-CB 3.42Å; L296-E324 HydrophobicContact CD2-CG 4.25Å; L296-E324 VanDerWaalsContact CD2-OE2 3.26Å; L296-E324 WeakPolarHBondContact CD2-OE2 3.5Å; Q299-E324 PolarHBondContact OE1-OE1 2.68Å; E324-L326 PolarHBondContact O-N 3.09Å; E324-L326 VanDerWaalsContact O-N 3.09Å |
| 325 | S | 72.3 | Confident | 86.9 | Confident | 50 Ų | 50 | 65.4 Ų | 65.4 | 35% | 0.35 | 34% | 0.343 | S | S | . | . | trans | -67.5 | 109.5 | 179.9 | 179.1 | 0 | 0 | 0 | 0 | 109 | E327 K356 | S325-E327 PolarHBondContact O-N 3.34Å; S325-K356 PolarHBondContact OG-NZ 2.89Å | ||
| 326 | L | 68.3 | Low | 87.3 | Confident | 172 Ų | 172 | 61.1 Ų | 61.1 | 90% | 0.901 | 33% | 0.327 | S | S | * | . | trans | -73.2 | -16.8 | 177 | -60.4 | 179.5 | 0 | 0 | 0 | 112.7 | E324 | E324-L326 PolarHBondContact O-N 3.09Å; E324-L326 VanDerWaalsContact O-N 3.09Å | ||
| 327 | E | 74.9 | Confident | 87.5 | Confident | 136 Ų | 136 | 56.9 Ų | 56.9 | 64% | 0.636 | 30% | 0.301 | S | S | * | . | S | Bend | trans | -70 | 128.3 | 174.3 | -67.1 | -177.1 | 163.9 | 0 | 0 | 110.5 | S325 K356 | S325-E327 PolarHBondContact O-N 3.34Å; E327-K356 PolarHBondContact O-NZ 3.1Å |
| 328 | P | 75.8 | Confident | 87.8 | Confident | 110 Ų | 110 | 56.5 Ų | 56.5 | 71% | 0.714 | 30% | 0.3 | S | S | * | . | P | Polyproline II helix | trans | -57.9 | 143.9 | 173.6 | 27.4 | -34.4 | 0 | 0 | 0 | 109.3 | ||
| 329 | P | 80.3 | Confident | 87.9 | Confident | 64 Ų | 64 | 52.6 Ų | 52.6 | 42% | 0.416 | 29% | 0.285 | S | S | . | . | P | Polyproline II helix | trans | -56.8 | 144.8 | 178 | -24.2 | 33.9 | 0 | 0 | 0 | 112.3 | D334 K356 | P329-D334 VanDerWaalsContact CA-OD2 3.27Å; P329-D334 WeakPolarHBondContact CA-OD2 3.49Å; P329-K356 HydrophobicContact CB-CG 4.44Å; P329-K356 HydrophobicContact CG-CD 4.43Å; P329-K356 HydrophobicContact CG-CG 4.42Å |
| 330 | S | 88.1 | Confident | 88.1 | Confident | 39 Ų | 39 | 47.9 Ų | 47.9 | 27% | 0.273 | 27% | 0.269 | S | S | . | . | P | Polyproline II helix | trans | -57.7 | 165.9 | 172.8 | -65.7 | 0 | 0 | 0 | 0 | 112 | F332 G333 D334 A467 | S330-F332 VanDerWaalsContact C-N 3.27Å; S330-F332 PolarHBondContact O-N 2.73Å; S330-F332 VanDerWaalsContact O-N 3.1Å; S330-G333 WeakPolarHBondContact O-CA 3.47Å; S330-G333 PolarHBondContact O-N 2.67Å; S330-D334 WeakPolarHBondContact CB-OD1 3.29Å; S330-D334 PolarHBondContact N-OD2 3.05Å; S330-D334 PolarHBondContact OG-OD1 3.13Å; S330-A467 VanDerWaalsContact OG-CB 3.27Å; S330-A467 WeakPolarHBondContact OG-CB 3.46Å |
| 331 | E | 86.6 | Confident | 88.2 | Confident | 113 Ų | 113 | 45.5 Ų | 45.5 | 53% | 0.528 | 26% | 0.256 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -52.4 | -41 | -171.8 | -168.8 | -174.5 | 178.6 | 0 | 0 | 114.1 | R359 | E331-R359 WeakPolarHBondContact O-CD 3.49Å; E331-R359 PolarHBondContact O-NE 3.16Å; E331-R359 IonicContact OE1-NH1 2.75Å; E331-R359 PolarHBondContact OE1-NH1 3.28Å |
| 332 | F | 88.8 | Confident | 88.3 | Confident | 30 Ų | 30 | 46.3 Ų | 46.3 | 13% | 0.132 | 26% | 0.26 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -103.1 | 13.7 | 178.6 | -54.7 | -80.2 | 0 | 0 | 0 | 112.8 | S330 L468 R470 | S330-F332 VanDerWaalsContact C-N 3.27Å; S330-F332 PolarHBondContact O-N 2.73Å; S330-F332 VanDerWaalsContact O-N 3.1Å; F332-L468 HydrophobicContact CB-CB 4Å; F332-L468 WeakPolarHBondContact CD2-O 3.37Å; F332-L468 WeakPolarHBondContact O-CD1 3.47Å; F332-R470 HydrophobicContact CD1-CG 4.45Å; F332-R470 HydrophobicContact CE1-CG 3.82Å; F332-R470 HydrophobicContact CE2-CB 4.22Å; F332-R470 HydrophobicContact CE2-CG 3.99Å; F332-R470 HydrophobicContact CZ-CB 4.3Å; F332-R470 HydrophobicContact CZ-CG 3.58Å |
| 333 | G | 92.6 | Very high | 88.3 | Confident | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 27% | 0.269 | C | S | . | . | trans | 83.7 | 177.4 | -168.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | S330 K356 G357 L468 | S330-G333 WeakPolarHBondContact O-CA 3.47Å; S330-G333 PolarHBondContact O-N 2.67Å; G333-K356 CarbonylContact C-O 3.55Å; G333-K356 WeakPolarHBondContact CA-O 2.87Å; G333-G357 WeakPolarHBondContact CA-O 3.36Å; G333-G357 PolarHBondContact N-O 3.27Å; G333-L468 WeakPolarHBondContact O-CB 3.18Å; G333-L468 PolarHBondContact O-N 3.01Å | ||
| 334 | D | 93.8 | Very high | 88.5 | Confident | 10 Ų | 10 | 53.4 Ų | 53.4 | 5% | 0.053 | 28% | 0.278 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.5 | 147.3 | 176.7 | -55.2 | -79.6 | 0 | 0 | 0 | 110.3 | P329 S330 A355 K356 W465 H466 A467 | P329-D334 VanDerWaalsContact CA-OD2 3.27Å; P329-D334 WeakPolarHBondContact CA-OD2 3.49Å; S330-D334 WeakPolarHBondContact CB-OD1 3.29Å; S330-D334 PolarHBondContact N-OD2 3.05Å; S330-D334 PolarHBondContact OG-OD1 3.13Å; D334-A355 CarbonylContact O-C 3.57Å; D334-A355 WeakPolarHBondContact O-CA 3.14Å; D334-A355 WeakPolarHBondContact O-CB 3.47Å; D334-K356 HydrophobicContact CB-CG 4.01Å; D334-K356 PolarHBondContact N-O 3.12Å; D334-K356 PolarHBondContact O-N 3.26Å; D334-K356 WeakPolarHBondContact OD2-CE 3.16Å; D334-K356 IonicContact OD2-NZ 3.06Å; D334-W465 HydrophobicContact CB-CE3 3.73Å; D334-W465 HydrophobicContact CB-CZ3 4.14Å; D334-H466 CarbonylContact C-O 3.57Å; D334-H466 VanDerWaalsContact CA-O 3.27Å; D334-H466 WeakPolarHBondContact CA-O 3.14Å; D334-A467 WeakPolarHBondContact OD1-CA 3.5Å |
| 335 | L | 95.9 | Very high | 89 | Confident | 0 Ų | 0 | 54.5 Ų | 54.5 | 0% | 0 | 29% | 0.286 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.2 | 129.3 | 176.4 | -174.9 | 69.1 | 0 | 0 | 0 | 110.2 | F337 V352 A355 V371 L418 V420 V435 H466 L468 | L335-F337 HydrophobicContact CD2-CD1 4.11Å; L335-F337 HydrophobicContact CD2-CE1 4.5Å; L335-F337 HydrophobicContact CG-CD1 4.13Å; L335-V352 HydrophobicContact CD1-CG1 4.3Å; L335-A355 HydrophobicContact CD1-CB 3.96Å; L335-V371 HydrophobicContact CD1-CG2 4.09Å; L335-V371 HydrophobicContact CD2-CG1 4.2Å; L335-L418 HydrophobicContact CD2-CB 3.79Å; L335-L418 HydrophobicContact CD2-CD2 3.91Å; L335-V420 HydrophobicContact CD1-CG2 4.39Å; L335-V420 HydrophobicContact CD2-CG2 4.45Å; L335-V435 HydrophobicContact CD2-CG1 4.17Å; L335-H466 PolarHBondContact N-O 3.48Å; L335-H466 PolarHBondContact O-N 2.85Å; L335-L468 HydrophobicContact CB-CD2 4Å; L335-L468 HydrophobicContact CB-CG 4.33Å |
| 336 | Q | 95.8 | Very high | 90 | Very high | 9 Ų | 9 | 53.3 Ų | 53.3 | 4% | 0.042 | 28% | 0.277 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.6 | 126.9 | 172.2 | -153.3 | 179.6 | 15.1 | 0 | 0 | 110.3 | L353 R354 K463 R464 W465 | Q336-L353 HydrophobicContact CB-CB 4.37Å; Q336-L353 HydrophobicContact CG-CD1 4.18Å; Q336-L353 WeakPolarHBondContact O-CB 3.49Å; Q336-L353 PolarHBondContact O-N 3.12Å; Q336-R354 HydrophobicContact CB-CG 4.12Å; Q336-R354 PolarHBondContact N-O 3.48Å; Q336-R354 PolarHBondContact O-N 3.4Å; Q336-R354 VanDerWaalsContact OE1-CZ 3.23Å; Q336-K463 HydrophobicContact CG-CG 4.32Å; Q336-R464 WeakPolarHBondContact CA-O 3.46Å; Q336-R464 WeakPolarHBondContact CG-O 3.44Å; Q336-W465 HydrophobicContact CB-CD2 3.64Å; Q336-W465 HydrophobicContact CB-CE3 3.58Å; Q336-W465 HydrophobicContact CB-CG 4.32Å; Q336-W465 HydrophobicContact CB-CH2 3.93Å; Q336-W465 HydrophobicContact CB-CZ2 3.99Å; Q336-W465 HydrophobicContact CB-CZ3 3.71Å; Q336-W465 VanDerWaalsContact CD-CE2 3.44Å; Q336-W465 HydrophobicContact CG-CD2 3.74Å; Q336-W465 HydrophobicContact CG-CE3 4.22Å; Q336-W465 HydrophobicContact CG-CG 3.98Å; Q336-W465 HydrophobicContact CG-CZ2 4.26Å |
| 337 | F | 97.4 | Very high | 91.3 | Very high | 0 Ų | 0 | 49.4 Ų | 49.4 | 0% | 0 | 25% | 0.25 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -148 | 159.3 | 173.3 | 60.4 | -84.2 | 0 | 0 | 0 | 111.1 | L335 L339 V350 V351 L418 V435 V437 H450 R464 H466 | L335-F337 HydrophobicContact CD2-CD1 4.11Å; L335-F337 HydrophobicContact CD2-CE1 4.5Å; L335-F337 HydrophobicContact CG-CD1 4.13Å; F337-L339 HydrophobicContact CD2-CD2 4.02Å; F337-L339 HydrophobicContact CD2-CG 4.09Å; F337-L339 HydrophobicContact CE2-CD1 4.17Å; F337-L339 HydrophobicContact CE2-CD2 3.95Å; F337-L339 HydrophobicContact CE2-CG 3.9Å; F337-V350 HydrophobicContact CD2-CG1 4.37Å; F337-V351 CarbonylContact C-O 3.52Å; F337-V351 WeakPolarHBondContact CA-O 3.37Å; F337-V351 VanDerWaalsContact CB-O 3.25Å; F337-V351 WeakPolarHBondContact CB-O 3.35Å; F337-L418 HydrophobicContact CB-CD2 4.19Å; F337-L418 HydrophobicContact CD1-CD2 3.81Å; F337-L418 HydrophobicContact CD2-CD1 4.43Å; F337-L418 HydrophobicContact CD2-CD2 4.04Å; F337-L418 HydrophobicContact CE1-CD1 4.25Å; F337-L418 HydrophobicContact CE1-CD2 4.15Å; F337-L418 HydrophobicContact CE2-CD1 3.98Å; F337-L418 HydrophobicContact CE2-CD2 4.37Å; F337-L418 HydrophobicContact CG-CD2 3.75Å; F337-L418 HydrophobicContact CZ-CD1 3.88Å; F337-L418 HydrophobicContact CZ-CD2 4.42Å; F337-V435 HydrophobicContact CE1-CG1 3.9Å; F337-V435 HydrophobicContact CZ-CG1 4.42Å; F337-V437 HydrophobicContact CE2-CG1 4.35Å; F337-V437 HydrophobicContact CE2-CG2 4.2Å; F337-V437 HydrophobicContact CZ-CG1 3.81Å; F337-V437 HydrophobicContact CZ-CG2 4.32Å; F337-H450 AromaticContact CD2-CE1 2.87Å; F337-H450 WeakPolarHBondContact CD2-CE1 3.43Å; F337-H450 AromaticContact CE2-CE1 2.93Å; F337-H450 WeakPolarHBondContact CE2-CE1 3.44Å; F337-H450 AromaticContact CE2-ND1 3.58Å; F337-H450 AromaticContact CG-CE1 3.57Å; F337-H450 AromaticContact CZ-CE1 3.68Å; F337-H450 AromaticContact CZ-ND1 3.88Å; F337-H450 PolarHBondContact O-CE1 2.93Å; F337-R464 PolarHBondContact N-O 2.96Å; F337-R464 PolarHBondContact O-N 2.96Å; F337-H466 HydrophobicContact CE1-CB 4.27Å; F337-H466 AromaticContact CE1-CD2 3.28Å; F337-H466 WeakPolarHBondContact CE1-CD2 3.21Å; F337-H466 AromaticContact CZ-CD2 3.42Å; F337-H466 VanDerWaalsContact CZ-CD2 3.42Å; F337-H466 WeakPolarHBondContact CZ-CD2 3.37Å; F337-H466 AromaticContact CZ-NE2 3.77Å |
| 338 | C | 97.3 | Very high | 92.3 | Very high | 10 Ų | 10 | 43 Ų | 43 | 7% | 0.068 | 22% | 0.22 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -104.5 | 150.1 | 170.6 | -50.2 | 0 | 0 | 0 | 0 | 111.1 | V350 V351 L461 V462 | C338-V350 WeakPolarHBondContact O-CA 3.44Å; C338-V351 HydrophobicContact CB-CB 4.03Å; C338-V351 HydrophobicContact CB-CG2 4.38Å; C338-V351 PolarHBondContact N-O 3.08Å; C338-V351 PolarHBondContact O-N 3.4Å; C338-L461 HydrophobicContact CB-CB 4.2Å; C338-L461 HydrophobicContact CB-CD2 3.79Å; C338-V462 CarbonylContact C-O 3.45Å; C338-V462 WeakPolarHBondContact CA-O 3.27Å |
| 339 | L | 97.1 | Very high | 93.3 | Very high | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 19% | 0.193 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -121.6 | 143.4 | 169.1 | -65.4 | 180 | 0 | 0 | 0 | 109.5 | F337 T349 V350 L416 V437 H450 W451 M454 V462 | F337-L339 HydrophobicContact CD2-CD2 4.02Å; F337-L339 HydrophobicContact CD2-CG 4.09Å; F337-L339 HydrophobicContact CE2-CD1 4.17Å; F337-L339 HydrophobicContact CE2-CD2 3.95Å; F337-L339 HydrophobicContact CE2-CG 3.9Å; L339-T349 WeakPolarHBondContact CA-O 3.14Å; L339-V350 HydrophobicContact CD2-CB 4.4Å; L339-V350 HydrophobicContact CD2-CG1 4.14Å; L339-V350 HydrophobicContact CD2-CG2 3.93Å; L339-L416 HydrophobicContact CD2-CD1 3.65Å; L339-V437 HydrophobicContact CD1-CG2 4.02Å; L339-H450 PolarHBondContact N-NE2 3.07Å; L339-H450 VanDerWaalsContact N-NE2 3.13Å; L339-W451 HydrophobicContact CD1-CE3 4.38Å; L339-M454 HydrophobicContact CB-CB 4.01Å; L339-M454 HydrophobicContact CB-CG 3.89Å; L339-M454 HydrophobicContact CB-SD 3.65Å; L339-M454 HydrophobicContact CD1-SD 4.3Å; L339-M454 HydrophobicContact CG-SD 4.46Å; L339-V462 PolarHBondContact N-O 2.95Å; L339-V462 PolarHBondContact O-N 3.05Å |
| 340 | S | 96.5 | Very high | 94.1 | Very high | 10 Ų | 10 | 35.8 Ų | 35.8 | 7% | 0.07 | 17% | 0.173 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -149.3 | 136.5 | 170.5 | -170.7 | 0 | 0 | 0 | 0 | 109.1 | T349 E460 | S340-T349 PolarHBondContact N-O 2.69Å; S340-T349 PolarHBondContact O-N 3.06Å; S340-E460 WeakPolarHBondContact CA-O 3.25Å; S340-E460 WeakPolarHBondContact CB-O 3.37Å; S340-E460 PolarHBondContact OG-O 2.75Å |
| 341 | Y | 95.9 | Very high | 94.5 | Very high | 2 Ų | 2 | 34.6 Ų | 34.6 | 1% | 0.008 | 16% | 0.164 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -112.5 | 143.7 | 171.1 | -172.8 | -110.9 | 0 | 0 | 0 | 110.6 | D343 L348 A406 A408 L411 L455 K459 | Y341-D343 WeakPolarHBondContact CD1-OD1 3.33Å; Y341-D343 HydrophobicContact CE1-CB 3.97Å; Y341-D343 VanDerWaalsContact CE1-CG 3.47Å; Y341-L348 HydrophobicContact CD2-CB 4.17Å; Y341-A406 WeakPolarHBondContact CE2-O 3.45Å; Y341-A406 PolarHBondContact OH-O 3.33Å; Y341-A406 VanDerWaalsContact OH-O 3.08Å; Y341-A408 PolarHBondContact OH-N 2.84Å; Y341-L411 HydrophobicContact CD1-CD1 3.86Å; Y341-L411 HydrophobicContact CD2-CD1 4.24Å; Y341-L411 HydrophobicContact CD2-CD2 4.2Å; Y341-L411 HydrophobicContact CE1-CD1 3.53Å; Y341-L411 HydrophobicContact CE2-CD1 3.97Å; Y341-L411 HydrophobicContact CE2-CD2 3.99Å; Y341-L411 HydrophobicContact CE2-CG 4.39Å; Y341-L411 HydrophobicContact CG-CD1 4.2Å; Y341-L455 HydrophobicContact CD1-CD2 4.41Å; Y341-K459 PolarHBondContact O-N 2.81Å |
| 342 | N | 94.4 | Very high | 95 | Very high | 26 Ų | 26 | 29.2 Ų | 29.2 | 14% | 0.139 | 14% | 0.139 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -133 | 98.7 | 173.9 | -175.6 | -14 | 0 | 0 | 0 | 109.8 | Y344 L345 S346 R347 K459 | N342-Y344 VanDerWaalsContact C-N 3.34Å; N342-Y344 PolarHBondContact O-N 2.84Å; N342-Y344 PolarHBondContact OD1-N 3.25Å; N342-L345 CarbonylContact O-C 3.57Å; N342-L345 PolarHBondContact O-N 2.97Å; N342-L345 VanDerWaalsContact O-N 3.12Å; N342-S346 PolarHBondContact O-N 2.76Å; N342-S346 VanDerWaalsContact O-N 3.13Å; N342-R347 PolarHBondContact N-O 2.97Å; N342-R347 PolarHBondContact O-N 3.46Å; N342-R347 VanDerWaalsContact O-N 3.07Å; N342-K459 HydrophobicContact CB-CG 4.42Å |
| 343 | D | 92.3 | Very high | 95.3 | Very high | 81 Ų | 81 | 29.1 Ų | 29.1 | 43% | 0.433 | 14% | 0.14 | S | C | . | . | G | 310 helix | trans | -54.2 | -45.3 | -176.3 | -52.1 | 57.4 | 0 | 0 | 0 | 112.3 | Y341 L345 S346 | Y341-D343 WeakPolarHBondContact CD1-OD1 3.33Å; Y341-D343 HydrophobicContact CE1-CB 3.97Å; Y341-D343 VanDerWaalsContact CE1-CG 3.47Å; D343-L345 PolarHBondContact O-N 3.02Å; D343-S346 PolarHBondContact O-N 2.99Å; D343-S346 VanDerWaalsContact O-N 3.12Å |
| 344 | Y | 91.3 | Very high | 95.3 | Very high | 188 Ų | 188 | 30.1 Ų | 30.1 | 74% | 0.737 | 14% | 0.144 | S | C | * | . | G | 310 helix | trans | -60.4 | -21 | -179.3 | -62.9 | -83.6 | 0 | 0 | 0 | 113.7 | N342 | N342-Y344 VanDerWaalsContact C-N 3.34Å; N342-Y344 PolarHBondContact O-N 2.84Å; N342-Y344 PolarHBondContact OD1-N 3.25Å |
| 345 | L | 92.9 | Very high | 95.3 | Very high | 95 Ų | 95 | 29.8 Ų | 29.8 | 50% | 0.497 | 14% | 0.142 | S | C | . | . | G | 310 helix | trans | -121.1 | 9.3 | -176.2 | -59.2 | 173.9 | 0 | 0 | 0 | 111.7 | N342 D343 R347 | N342-L345 CarbonylContact O-C 3.57Å; N342-L345 PolarHBondContact O-N 2.97Å; N342-L345 VanDerWaalsContact O-N 3.12Å; D343-L345 PolarHBondContact O-N 3.02Å; L345-R347 HydrophobicContact CB-CB 4.16Å; L345-R347 VanDerWaalsContact CD1-NH1 3.27Å; L345-R347 PolarHBondContact O-N 2.74Å; L345-R347 VanDerWaalsContact O-N 3.14Å |
| 346 | S | 94.3 | Very high | 95 | Very high | 24 Ų | 24 | 31 Ų | 31 | 17% | 0.168 | 15% | 0.147 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 41.7 | 45.5 | -172.3 | -62 | 0 | 0 | 0 | 0 | 112.4 | N342 D343 K405 A406 D407 | N342-S346 PolarHBondContact O-N 2.76Å; N342-S346 VanDerWaalsContact O-N 3.13Å; D343-S346 PolarHBondContact O-N 2.99Å; D343-S346 VanDerWaalsContact O-N 3.12Å; S346-K405 CarbonylContact O-C 3.47Å; S346-K405 VanDerWaalsContact O-CA 3.3Å; S346-K405 WeakPolarHBondContact O-CA 3.45Å; S346-A406 CarbonylContact C-O 3.42Å; S346-A406 VanDerWaalsContact C-O 3.24Å; S346-A406 WeakPolarHBondContact CA-O 3.48Å; S346-A406 WeakPolarHBondContact CB-O 3.43Å; S346-A406 PolarHBondContact O-N 3.01Å; S346-A406 VanDerWaalsContact O-O 3.05Å; S346-D407 WeakPolarHBondContact CB-OD1 3.28Å; S346-D407 PolarHBondContact OG-OD1 2.87Å |
| 347 | R | 95.1 | Very high | 94.7 | Very high | 91 Ų | 91 | 31.5 Ų | 31.5 | 34% | 0.343 | 16% | 0.155 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -121.5 | 112.5 | -165.2 | -172.3 | 168.2 | 67 | -129.3 | 6.8 | 112.6 | N342 L345 F404 | N342-R347 PolarHBondContact N-O 2.97Å; N342-R347 PolarHBondContact O-N 3.46Å; N342-R347 VanDerWaalsContact O-N 3.07Å; L345-R347 HydrophobicContact CB-CB 4.16Å; L345-R347 VanDerWaalsContact CD1-NH1 3.27Å; L345-R347 PolarHBondContact O-N 2.74Å; L345-R347 VanDerWaalsContact O-N 3.14Å; R347-F404 WeakPolarHBondContact CA-O 3.1Å |
| 348 | L | 95.7 | Very high | 94.3 | Very high | 0 Ų | 0 | 31.7 Ų | 31.7 | 0% | 0 | 16% | 0.156 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -88.9 | 117.9 | 168.1 | -179.6 | 56.5 | 0 | 0 | 0 | 109.3 | Y341 L375 S403 F404 A406 L416 W451 M454 | Y341-L348 HydrophobicContact CD2-CB 4.17Å; L348-L375 HydrophobicContact CD2-CD1 4.29Å; L348-S403 CarbonylContact O-C 3.59Å; L348-S403 WeakPolarHBondContact O-CA 3.43Å; L348-F404 HydrophobicContact CB-CB 4.5Å; L348-F404 PolarHBondContact N-O 3.46Å; L348-F404 PolarHBondContact O-N 3.12Å; L348-A406 HydrophobicContact CB-CB 4.48Å; L348-L416 HydrophobicContact CD1-CD1 4.45Å; L348-L416 HydrophobicContact CD2-CD1 3.78Å; L348-L416 HydrophobicContact CD2-CD2 4.17Å; L348-L416 HydrophobicContact CD2-CG 3.97Å; L348-L416 HydrophobicContact CG-CD1 4.21Å; L348-W451 HydrophobicContact CD2-CH2 3.92Å; L348-W451 HydrophobicContact CD2-CZ3 4.12Å; L348-M454 HydrophobicContact CD1-CE 4.03Å; L348-M454 HydrophobicContact CD1-SD 3.35Å; L348-M454 WeakPolarHBondContact CD1-SD 3.34Å |
| 349 | T | 96.8 | Very high | 93.8 | Very high | 23 Ų | 23 | 38 Ų | 38 | 14% | 0.141 | 18% | 0.178 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -110.2 | 124.3 | 179.9 | -66.2 | 0 | 0 | 0 | 0 | 110 | L339 S340 V351 T401 F402 | L339-T349 WeakPolarHBondContact CA-O 3.14Å; S340-T349 PolarHBondContact N-O 2.69Å; S340-T349 PolarHBondContact O-N 3.06Å; T349-V351 HydrophobicContact CG2-CG2 4.38Å; T349-T401 HydrophobicContact CG2-CG2 3.66Å; T349-F402 WeakPolarHBondContact CA-O 3.41Å |
| 350 | V | 97.7 | Very high | 93.2 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 19% | 0.188 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -116.2 | 122.4 | 179.2 | -172.6 | 0 | 0 | 0 | 0 | 108.3 | F337 C338 L339 V352 V373 F402 F404 L416 L418 | F337-V350 HydrophobicContact CD2-CG1 4.37Å; C338-V350 WeakPolarHBondContact O-CA 3.44Å; L339-V350 HydrophobicContact CD2-CB 4.4Å; L339-V350 HydrophobicContact CD2-CG1 4.14Å; L339-V350 HydrophobicContact CD2-CG2 3.93Å; V350-V352 HydrophobicContact CG1-CG2 4.45Å; V350-V373 HydrophobicContact CB-CG1 4.38Å; V350-V373 HydrophobicContact CG1-CG1 4.14Å; V350-V373 HydrophobicContact CG2-CG1 4.36Å; V350-F402 PolarHBondContact N-O 3Å; V350-F402 PolarHBondContact O-N 3.35Å; V350-F404 HydrophobicContact CG2-CD2 4.22Å; V350-F404 HydrophobicContact CG2-CE2 4.09Å; V350-L416 HydrophobicContact CG2-CD1 3.44Å; V350-L416 VanDerWaalsContact CG2-CD1 3.44Å; V350-L416 HydrophobicContact CG2-CD2 4.22Å; V350-L418 HydrophobicContact CG1-CD2 4.18Å |
| 351 | V | 97.4 | Very high | 92.3 | Very high | 15 Ų | 15 | 44.1 Ų | 44.1 | 9% | 0.091 | 21% | 0.207 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -109.5 | 106.3 | 175.5 | -171.4 | 0 | 0 | 0 | 0 | 108.8 | F337 C338 T349 L353 E400 T401 L461 | F337-V351 CarbonylContact C-O 3.52Å; F337-V351 WeakPolarHBondContact CA-O 3.37Å; F337-V351 VanDerWaalsContact CB-O 3.25Å; F337-V351 WeakPolarHBondContact CB-O 3.35Å; C338-V351 HydrophobicContact CB-CB 4.03Å; C338-V351 HydrophobicContact CB-CG2 4.38Å; C338-V351 PolarHBondContact N-O 3.08Å; C338-V351 PolarHBondContact O-N 3.4Å; T349-V351 HydrophobicContact CG2-CG2 4.38Å; V351-L353 HydrophobicContact CG1-CD2 3.79Å; V351-L353 PolarHBondContact O-N 3.45Å; V351-E400 CarbonylContact C-O 3.58Å; V351-E400 WeakPolarHBondContact CA-O 3.48Å; V351-T401 HydrophobicContact CG2-CG2 4.1Å; V351-L461 HydrophobicContact CG2-CD2 3.69Å |
| 352 | V | 97.2 | Very high | 90.9 | Very high | 0 Ų | 0 | 53.4 Ų | 53.4 | 0% | 0 | 25% | 0.25 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.3 | 112.7 | 175.6 | -177.7 | 0 | 0 | 0 | 0 | 107.9 | L335 V350 V371 V373 T387 Y398 N399 E400 F402 L418 | L335-V352 HydrophobicContact CD1-CG1 4.3Å; V350-V352 HydrophobicContact CG1-CG2 4.45Å; V352-V371 HydrophobicContact CG1-CB 4.21Å; V352-V371 HydrophobicContact CG1-CG1 4.49Å; V352-V371 HydrophobicContact CG1-CG2 3.92Å; V352-V373 HydrophobicContact CG2-CG2 3.65Å; V352-T387 HydrophobicContact CB-CG2 4.1Å; V352-T387 HydrophobicContact CG1-CG2 4.05Å; V352-T387 HydrophobicContact CG2-CG2 4.41Å; V352-Y398 HydrophobicContact CG1-CD2 3.79Å; V352-Y398 HydrophobicContact CG1-CG 4.22Å; V352-N399 VanDerWaalsContact O-CA 3.29Å; V352-N399 WeakPolarHBondContact O-CA 3.48Å; V352-N399 PolarHBondContact O-N 2.57Å; V352-E400 PolarHBondContact N-O 3.17Å; V352-E400 PolarHBondContact O-N 2.88Å; V352-F402 HydrophobicContact CB-CE2 4.21Å; V352-F402 HydrophobicContact CG2-CD2 4Å; V352-F402 HydrophobicContact CG2-CE2 3.74Å; V352-L418 HydrophobicContact CG2-CD2 4.04Å |
| 353 | L | 93.8 | Very high | 89.1 | Confident | 27 Ų | 27 | 57.5 Ų | 57.5 | 14% | 0.141 | 27% | 0.272 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.1 | -66.2 | -174.7 | -63.9 | 176.5 | 0 | 0 | 0 | 111.1 | Q336 V351 Y398 N399 K463 | Q336-L353 HydrophobicContact CB-CB 4.37Å; Q336-L353 HydrophobicContact CG-CD1 4.18Å; Q336-L353 WeakPolarHBondContact O-CB 3.49Å; Q336-L353 PolarHBondContact O-N 3.12Å; V351-L353 HydrophobicContact CG1-CD2 3.79Å; V351-L353 PolarHBondContact O-N 3.45Å; L353-Y398 PolarHBondContact O-N 3.2Å; L353-N399 WeakPolarHBondContact CA-OD1 3.48Å; L353-N399 WeakPolarHBondContact CD2-OD1 3.48Å; L353-N399 PolarHBondContact O-N 2.87Å; L353-N399 PolarHBondContact O-OD1 2.79Å; L353-K463 HydrophobicContact CD1-CD 3.52Å; L353-K463 HydrophobicContact CD1-CG 3.86Å |
| 354 | R | 92.9 | Very high | 87.4 | Confident | 22 Ų | 22 | 64.9 Ų | 64.9 | 8% | 0.083 | 29% | 0.294 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -163.4 | 164.3 | -174.5 | 58.8 | -179.9 | 174.7 | -144.9 | -17.5 | 111.7 | L301 E322 Q336 P396 V397 W465 | L301-R354 VanDerWaalsContact CD1-NH1 3.34Å; E322-R354 IonicContact OE1-NH2 3.69Å; E322-R354 IonicContact OE2-CZ 3.12Å; E322-R354 IonicContact OE2-NH1 2.72Å; E322-R354 PolarHBondContact OE2-NH1 2.81Å; E322-R354 IonicContact OE2-NH2 2.71Å; E322-R354 PolarHBondContact OE2-NH2 2.93Å; Q336-R354 HydrophobicContact CB-CG 4.12Å; Q336-R354 PolarHBondContact N-O 3.48Å; Q336-R354 PolarHBondContact O-N 3.4Å; Q336-R354 VanDerWaalsContact OE1-CZ 3.23Å; R354-P396 CarbonylContact C-O 3.6Å; R354-P396 WeakPolarHBondContact CA-O 3.22Å; R354-P396 VanDerWaalsContact CB-O 3.27Å; R354-P396 WeakPolarHBondContact CB-O 3.24Å; R354-V397 HydrophobicContact CB-CB 4.19Å; R354-V397 HydrophobicContact CB-CG1 4.17Å; R354-V397 HydrophobicContact CB-CG2 3.93Å; R354-W465 HydrophobicContact CG-CH2 3.88Å; R354-W465 HydrophobicContact CG-CZ2 4.39Å |
| 355 | A | 93.6 | Very high | 86 | Confident | 2 Ų | 2 | 57.7 Ų | 57.7 | 2% | 0.017 | 28% | 0.277 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.6 | 161 | 163.5 | 0 | 0 | 0 | 0 | 0 | 111 | D334 L335 L358 N395 P396 | D334-A355 CarbonylContact O-C 3.57Å; D334-A355 WeakPolarHBondContact O-CA 3.14Å; D334-A355 WeakPolarHBondContact O-CB 3.47Å; L335-A355 HydrophobicContact CD1-CB 3.96Å; A355-L358 HydrophobicContact CB-CD1 3.92Å; A355-L358 HydrophobicContact CB-CD2 3.87Å; A355-L358 HydrophobicContact CB-CG 3.93Å; A355-N395 CarbonylContact O-C 3.49Å; A355-N395 VanDerWaalsContact O-CA 3.28Å; A355-N395 WeakPolarHBondContact O-CA 2.93Å; A355-P396 HydrophobicContact CB-CG 4.01Å; A355-P396 PolarHBondContact N-O 2.88Å |
| 356 | K | 90.3 | Very high | 84.4 | Confident | 27 Ų | 27 | 59.5 Ų | 59.5 | 12% | 0.117 | 29% | 0.286 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.4 | 145.8 | 171.5 | 67.7 | 172.7 | -178.2 | 152.1 | 0 | 111.3 | S325 E327 P329 G333 D334 L358 N395 W465 | S325-K356 PolarHBondContact OG-NZ 2.89Å; E327-K356 PolarHBondContact O-NZ 3.1Å; P329-K356 HydrophobicContact CB-CG 4.44Å; P329-K356 HydrophobicContact CG-CD 4.43Å; P329-K356 HydrophobicContact CG-CG 4.42Å; G333-K356 CarbonylContact C-O 3.55Å; G333-K356 WeakPolarHBondContact CA-O 2.87Å; D334-K356 HydrophobicContact CB-CG 4.01Å; D334-K356 PolarHBondContact N-O 3.12Å; D334-K356 PolarHBondContact O-N 3.26Å; D334-K356 WeakPolarHBondContact OD2-CE 3.16Å; D334-K356 IonicContact OD2-NZ 3.06Å; K356-L358 VanDerWaalsContact C-N 3.33Å; K356-L358 PolarHBondContact O-N 3.25Å; K356-N395 VanDerWaalsContact CA-OD1 3.32Å; K356-N395 WeakPolarHBondContact CA-OD1 3.44Å; K356-W465 HydrophobicContact CB-CH2 4.05Å; K356-W465 HydrophobicContact CB-CZ3 4.18Å; K356-W465 HydrophobicContact CD-CH2 3.97Å; K356-W465 HydrophobicContact CD-CZ2 4.4Å; K356-W465 HydrophobicContact CD-CZ3 4.07Å; K356-W465 HydrophobicContact CG-CE3 4.39Å; K356-W465 HydrophobicContact CG-CH2 3.82Å; K356-W465 HydrophobicContact CG-CZ3 3.64Å |
| 357 | G | 88.1 | Confident | 83.6 | Confident | 19 Ų | 19 | 59.4 Ų | 59.4 | 20% | 0.196 | 28% | 0.284 | C | S | . | . | S | Bend | trans | 62.1 | 31.4 | 171.7 | 0 | 0 | 0 | 0 | 0 | 115.6 | G333 R359 I394 N395 | G333-G357 WeakPolarHBondContact CA-O 3.36Å; G333-G357 PolarHBondContact N-O 3.27Å; G357-R359 PolarHBondContact O-N 3.49Å; G357-I394 PolarHBondContact N-O 3.42Å; G357-I394 VanDerWaalsContact N-O 3.15Å; G357-N395 PolarHBondContact N-OD1 2.77Å |
| 358 | L | 90 | Very high | 83.2 | Confident | 4 Ų | 4 | 55.7 Ų | 55.7 | 2% | 0.021 | 27% | 0.272 | C | S | . | . | trans | -63 | 132.4 | 177.2 | -61.4 | -179.5 | 0 | 0 | 0 | 111.2 | A355 K356 L360 V369 I394 P396 V420 L432 L468 | A355-L358 HydrophobicContact CB-CD1 3.92Å; A355-L358 HydrophobicContact CB-CD2 3.87Å; A355-L358 HydrophobicContact CB-CG 3.93Å; K356-L358 VanDerWaalsContact C-N 3.33Å; K356-L358 PolarHBondContact O-N 3.25Å; L358-L360 HydrophobicContact CB-CD2 4.25Å; L358-L360 PolarHBondContact O-N 2.88Å; L358-V369 HydrophobicContact CD1-CG1 3.84Å; L358-I394 PolarHBondContact N-O 3.01Å; L358-I394 WeakPolarHBondContact O-CG2 3.28Å; L358-P396 HydrophobicContact CD1-CG 3.63Å; L358-V420 HydrophobicContact CD1-CG1 3.91Å; L358-V420 HydrophobicContact CD2-CG1 4.17Å; L358-L432 HydrophobicContact CB-CD1 4.4Å; L358-L468 HydrophobicContact CD2-CD1 3.44Å; L358-L468 VanDerWaalsContact CD2-CD1 3.44Å | ||
| 359 | R | 86.3 | Confident | 83 | Confident | 143 Ų | 143 | 55.7 Ų | 55.7 | 54% | 0.54 | 27% | 0.272 | S | S | . | . | trans | -82.5 | 93.2 | 170 | -69.5 | -171.7 | 177.5 | 162.6 | 8 | 109.9 | E331 G357 L432 | E331-R359 WeakPolarHBondContact O-CD 3.49Å; E331-R359 PolarHBondContact O-NE 3.16Å; E331-R359 IonicContact OE1-NH1 2.75Å; E331-R359 PolarHBondContact OE1-NH1 3.28Å; G357-R359 PolarHBondContact O-N 3.49Å; R359-L432 WeakPolarHBondContact O-CD2 3.39Å | ||
| 360 | L | 84.3 | Confident | 82.9 | Confident | 41 Ų | 41 | 55.6 Ų | 55.6 | 22% | 0.215 | 27% | 0.27 | C | S | . | . | trans | -72 | 138.7 | 171.8 | -51.3 | -177.4 | 0 | 0 | 0 | 109.6 | L358 E362 V367 V369 I394 L432 | L358-L360 HydrophobicContact CB-CD2 4.25Å; L358-L360 PolarHBondContact O-N 2.88Å; L360-E362 PolarHBondContact O-N 3.49Å; L360-V367 HydrophobicContact CD1-CG1 4.27Å; L360-V369 HydrophobicContact CD2-CG2 3.53Å; L360-I394 HydrophobicContact CD1-CG2 4.03Å; L360-I394 HydrophobicContact CG-CG2 4.06Å; L360-L432 HydrophobicContact CD2-CD1 3.72Å | ||
| 361 | Q | 79 | Confident | 82.8 | Confident | 97 Ų | 97 | 55.6 Ų | 55.6 | 45% | 0.453 | 27% | 0.27 | S | S | . | . | trans | -78.4 | 116.6 | 171.6 | -173.8 | 170 | -1.3 | 0 | 0 | 109.1 | D363 Q422 M424 | Q361-D363 VanDerWaalsContact C-N 3.32Å; Q361-D363 PolarHBondContact O-N 2.73Å; Q361-Q422 PolarHBondContact O-NE2 3.38Å; Q361-M424 HydrophobicContact CB-CE 3.68Å; Q361-M424 HydrophobicContact CG-CE 3.85Å | ||
| 362 | E | 66.6 | Low | 82.8 | Confident | 197 Ų | 197 | 58 Ų | 58 | 92% | 0.921 | 28% | 0.279 | S | S | * | . | trans | -77.7 | 78.6 | 177.9 | -66.4 | -176.4 | 168.6 | 0 | 0 | 110.7 | L360 | L360-E362 PolarHBondContact O-N 3.49Š| ||
| 363 | D | 55.4 | Low | 82.8 | Confident | 111 Ų | 111 | 58 Ų | 58 | 59% | 0.594 | 28% | 0.279 | S | S | * | . | trans | -117.6 | 147.7 | 160.3 | -149.4 | -11.1 | 0 | 0 | 0 | 109.8 | Q361 G365 | Q361-D363 VanDerWaalsContact C-N 3.32Å; Q361-D363 PolarHBondContact O-N 2.73Å; D363-G365 PolarHBondContact O-N 3.1Å | ||
| 364 | R | 56.1 | Low | 83 | Confident | 236 Ų | 236 | 57.5 Ų | 57.5 | 89% | 0.891 | 28% | 0.278 | S | S | * | . | S | Bend | trans | -66.8 | 116.4 | -156.8 | -57.7 | -179.7 | -172.1 | -154.5 | 0.5 | 111.8 | ||
| 365 | G | 62.1 | Low | 83.2 | Confident | 38 Ų | 38 | 56.8 Ų | 56.8 | 39% | 0.392 | 28% | 0.276 | S | S | . | . | S | Bend | trans | 163 | 174.3 | 172.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | D363 V367 E425 | D363-G365 PolarHBondContact O-N 3.1Å; G365-V367 PolarHBondContact O-N 3.46Å; G365-E425 WeakPolarHBondContact CA-OE2 3.01Å |
| 366 | I | 58.9 | Low | 83.2 | Confident | 133 Ų | 133 | 58.7 Ų | 58.7 | 68% | 0.682 | 29% | 0.285 | S | S | * | . | trans | -74.3 | 96.7 | 170.9 | -62.9 | 177.4 | 0 | 0 | 0 | 108.6 | L391 | I366-L391 HydrophobicContact CG2-CD1 3.9Å; I366-L391 HydrophobicContact CG2-CD2 4.08Å; I366-L391 HydrophobicContact CG2-CG 4.44Å | ||
| 367 | V | 78.9 | Confident | 83.3 | Confident | 21 Ų | 21 | 58.4 Ų | 58.4 | 13% | 0.127 | 29% | 0.285 | C | S | . | . | trans | -70.1 | 130.8 | 176 | 171.9 | 0 | 0 | 0 | 0 | 110.7 | L360 G365 V369 L391 G392 Q422 | L360-V367 HydrophobicContact CD1-CG1 4.27Å; G365-V367 PolarHBondContact O-N 3.46Å; V367-V369 HydrophobicContact CG1-CG2 4.34Å; V367-L391 WeakPolarHBondContact O-CA 3.16Å; V367-G392 PolarHBondContact O-N 2.78Å; V367-Q422 HydrophobicContact CG1-CG 3.44Å; V367-Q422 VanDerWaalsContact CG1-CG 3.44Å; V367-Q422 VanDerWaalsContact CG1-NE2 3.28Å; V367-Q422 VanDerWaalsContact CG2-NE2 3.31Å | ||
| 368 | S | 86.6 | Confident | 83.4 | Confident | 14 Ų | 14 | 63.3 Ų | 63.3 | 10% | 0.098 | 30% | 0.302 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.3 | 148.5 | 168.1 | 78.9 | 0 | 0 | 0 | 0 | 111.7 | V390 Q422 N423 | S368-V390 CarbonylContact C-O 3.52Å; S368-V390 WeakPolarHBondContact CA-O 3.27Å; S368-Q422 CarbonylContact O-C 3.55Å; S368-Q422 WeakPolarHBondContact O-CA 3.38Å; S368-N423 PolarHBondContact N-O 2.93Å; S368-N423 PolarHBondContact O-N 3.08Å; S368-N423 WeakPolarHBondContact OG-CB 3.38Å |
| 369 | V | 91.4 | Very high | 83.2 | Confident | 0 Ų | 0 | 68.8 Ų | 68.8 | 0% | 0 | 33% | 0.332 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.4 | 127.9 | -176.3 | -168.9 | 0 | 0 | 0 | 0 | 110.4 | L358 L360 V367 V390 Y398 V420 V421 L432 | L358-V369 HydrophobicContact CD1-CG1 3.84Å; L360-V369 HydrophobicContact CD2-CG2 3.53Å; V367-V369 HydrophobicContact CG1-CG2 4.34Å; V369-V390 PolarHBondContact N-O 3.36Å; V369-V390 PolarHBondContact O-N 2.97Å; V369-Y398 WeakPolarHBondContact O-CE1 3.38Å; V369-Y398 PolarHBondContact O-OH 3.07Å; V369-V420 HydrophobicContact CG1-CG1 3.55Å; V369-V421 WeakPolarHBondContact CA-O 3.41Å; V369-L432 HydrophobicContact CG1-CD1 4.34Å |
| 370 | F | 94.1 | Very high | 83.4 | Confident | 20 Ų | 20 | 69.5 Ų | 69.5 | 9% | 0.088 | 34% | 0.339 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.9 | 160.9 | 177 | 67.5 | -82.9 | 0 | 0 | 0 | 110.9 | K372 K386 T387 A389 V421 N423 | F370-K372 HydrophobicContact CD2-CG 4.32Å; F370-K372 HydrophobicContact CE2-CD 4.41Å; F370-K372 HydrophobicContact CE2-CG 3.69Å; F370-K386 HydrophobicContact CD2-CB 4.14Å; F370-K386 HydrophobicContact CD2-CD 4.18Å; F370-K386 HydrophobicContact CD2-CG 4.19Å; F370-K386 HydrophobicContact CE2-CB 4.49Å; F370-K386 HydrophobicContact CE2-CD 3.73Å; F370-K386 HydrophobicContact CE2-CG 4.04Å; F370-T387 WeakPolarHBondContact CA-OG1 3.32Å; F370-T387 WeakPolarHBondContact CB-OG1 3.48Å; F370-A389 HydrophobicContact CB-CB 4.25Å; F370-V421 HydrophobicContact CD1-CB 4.42Å; F370-V421 HydrophobicContact CE1-CB 3.92Å; F370-V421 HydrophobicContact CE1-CG1 3.79Å; F370-V421 HydrophobicContact CE2-CB 4.12Å; F370-V421 HydrophobicContact CE2-CG1 4.49Å; F370-V421 HydrophobicContact CE2-CG2 4.49Å; F370-V421 HydrophobicContact CZ-CB 3.76Å; F370-V421 HydrophobicContact CZ-CG1 3.68Å; F370-V421 HydrophobicContact CZ-CG2 4.44Å; F370-V421 PolarHBondContact N-O 3.13Å; F370-V421 PolarHBondContact O-N 3.2Å; F370-N423 HydrophobicContact CE1-CB 4.4Å |
| 371 | V | 96.7 | Very high | 83.8 | Confident | 0 Ų | 0 | 74 Ų | 74 | 0% | 0 | 36% | 0.356 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.4 | 126 | 176.5 | -171.2 | 0 | 0 | 0 | 0 | 109.4 | L335 V352 V373 K386 T387 Y398 L418 T419 V420 | L335-V371 HydrophobicContact CD1-CG2 4.09Å; L335-V371 HydrophobicContact CD2-CG1 4.2Å; V352-V371 HydrophobicContact CG1-CB 4.21Å; V352-V371 HydrophobicContact CG1-CG1 4.49Å; V352-V371 HydrophobicContact CG1-CG2 3.92Å; V371-V373 HydrophobicContact CG1-CG2 4.24Å; V371-K386 WeakPolarHBondContact O-CA 3.12Å; V371-T387 HydrophobicContact CB-CG2 3.92Å; V371-T387 HydrophobicContact CG2-CG2 4.39Å; V371-T387 PolarHBondContact N-OG1 2.83Å; V371-T387 PolarHBondContact O-N 2.91Å; V371-Y398 HydrophobicContact CG2-CD2 4.15Å; V371-Y398 HydrophobicContact CG2-CE2 3.62Å; V371-L418 HydrophobicContact CG1-CB 4.17Å; V371-T419 CarbonylContact C-O 3.5Å; V371-T419 WeakPolarHBondContact CA-O 3.42Å; V371-V420 HydrophobicContact CG2-CG2 4.29Å |
| 372 | K | 96.8 | Very high | 84.6 | Confident | 65 Ų | 65 | 73 Ų | 73 | 28% | 0.283 | 36% | 0.357 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.1 | 120.1 | 163.8 | -67.9 | 180 | 179.2 | 170.7 | 0 | 108.2 | F370 K385 K386 L418 T419 V421 | F370-K372 HydrophobicContact CD2-CG 4.32Å; F370-K372 HydrophobicContact CE2-CD 4.41Å; F370-K372 HydrophobicContact CE2-CG 3.69Å; K372-K385 CarbonylContact C-O 3.54Å; K372-K385 WeakPolarHBondContact CA-O 3.25Å; K372-K386 HydrophobicContact CG-CG 4.28Å; K372-L418 WeakPolarHBondContact O-CA 3.35Å; K372-T419 PolarHBondContact N-O 3.3Å; K372-T419 PolarHBondContact O-N 2.84Å; K372-V421 HydrophobicContact CD-CG2 3.94Å; K372-V421 HydrophobicContact CG-CG2 4.1Å |
| 373 | V | 97.8 | Very high | 86 | Confident | 0 Ų | 0 | 69 Ų | 69 | 0% | 0 | 34% | 0.337 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.6 | 111.8 | 172.5 | -174.8 | 0 | 0 | 0 | 0 | 107.9 | V350 V352 V371 C384 K385 F402 F404 L416 L418 | V350-V373 HydrophobicContact CB-CG1 4.38Å; V350-V373 HydrophobicContact CG1-CG1 4.14Å; V350-V373 HydrophobicContact CG2-CG1 4.36Å; V352-V373 HydrophobicContact CG2-CG2 3.65Å; V371-V373 HydrophobicContact CG1-CG2 4.24Å; V373-C384 CarbonylContact O-C 3.42Å; V373-C384 WeakPolarHBondContact O-CA 3.44Å; V373-K385 PolarHBondContact N-O 2.84Å; V373-K385 PolarHBondContact O-N 2.99Å; V373-F402 HydrophobicContact CB-CD2 4.41Å; V373-F402 HydrophobicContact CG2-CD2 3.84Å; V373-F402 HydrophobicContact CG2-CE2 3.97Å; V373-F404 HydrophobicContact CB-CZ 4.23Å; V373-F404 HydrophobicContact CG1-CE2 3.74Å; V373-F404 HydrophobicContact CG1-CZ 3.74Å; V373-L416 HydrophobicContact CG1-CD2 4.43Å; V373-L418 HydrophobicContact CG1-CG 4.37Å; V373-L418 HydrophobicContact CG2-CD2 4.22Å; V373-L418 HydrophobicContact CG2-CG 4.32Å |
| 374 | S | 96.9 | Very high | 87.9 | Confident | 18 Ų | 18 | 65.9 Ų | 65.9 | 13% | 0.126 | 32% | 0.323 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118 | 123 | -174.5 | -58.3 | 0 | 0 | 0 | 0 | 111 | K383 C384 L416 S417 | S374-K383 CarbonylContact C-O 3.5Å; S374-K383 WeakPolarHBondContact CA-O 3.48Å; S374-C384 PolarHBondContact OG-SG 2.79Å; S374-L416 WeakPolarHBondContact O-CA 3.4Å; S374-S417 PolarHBondContact N-O 2.99Å; S374-S417 PolarHBondContact O-N 2.94Å |
| 375 | L | 96.6 | Very high | 89.9 | Confident | 6 Ų | 6 | 57.7 Ų | 57.7 | 3% | 0.031 | 29% | 0.294 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.8 | 128.7 | 169 | -178.9 | 63.7 | 0 | 0 | 0 | 109.9 | L348 V382 K383 F404 A414 L416 | L348-L375 HydrophobicContact CD2-CD1 4.29Å; L375-V382 HydrophobicContact CB-CB 4.42Å; L375-V382 HydrophobicContact CD2-CB 4.37Å; L375-V382 HydrophobicContact CD2-CG1 4.19Å; L375-V382 HydrophobicContact CG-CB 4.22Å; L375-V382 WeakPolarHBondContact O-CB 3.39Å; L375-V382 PolarHBondContact O-N 2.65Å; L375-K383 PolarHBondContact N-O 1.85Å; L375-K383 PolarHBondContact O-N 3.25Å; L375-F404 HydrophobicContact CB-CD1 3.83Å; L375-F404 HydrophobicContact CB-CE1 4.14Å; L375-F404 HydrophobicContact CB-CG 4.38Å; L375-F404 HydrophobicContact CD2-CB 3.92Å; L375-F404 HydrophobicContact CD2-CD1 4.24Å; L375-F404 HydrophobicContact CD2-CG 4.34Å; L375-A414 HydrophobicContact CD1-CB 4.3Å; L375-L416 HydrophobicContact CB-CD2 4.16Å; L375-L416 HydrophobicContact CD1-CD2 3.93Å; L375-L416 HydrophobicContact CD1-CG 4.42Å |
| 376 | M | 94.7 | Very high | 91.5 | Very high | 42 Ų | 42 | 62 Ų | 62 | 21% | 0.207 | 30% | 0.302 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.7 | 145.3 | 174.8 | -43.5 | -98 | 53 | 0 | 0 | 107.8 | K380 F381 A414 S415 | M376-K380 CarbonylContact C-O 3.59Å; M376-K380 VanDerWaalsContact CA-O 3.29Å; M376-K380 WeakPolarHBondContact CA-O 3.44Å; M376-F381 HydrophobicContact CE-CB 3.84Å; M376-F381 HydrophobicContact CE-CD2 3.89Å; M376-F381 HydrophobicContact CE-CG 4.35Å; M376-A414 CarbonylContact O-C 3.57Å; M376-A414 VanDerWaalsContact O-CA 3.3Å; M376-A414 WeakPolarHBondContact O-CA 3.36Å; M376-S415 WeakPolarHBondContact CB-O 3.35Å; M376-S415 PolarHBondContact N-O 3Å; M376-S415 PolarHBondContact O-N 3.02Å |
| 377 | N | 93.1 | Very high | 93.2 | Very high | 22 Ų | 22 | 56.1 Ų | 56.1 | 12% | 0.118 | 27% | 0.272 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.3 | 127.1 | 168.1 | -173.4 | 1.9 | 0 | 0 | 0 | 108.4 | N379 K380 V382 E410 T413 | N377-N379 PolarHBondContact O-N 3.14Å; N377-K380 PolarHBondContact N-O 2.87Å; N377-K380 WeakPolarHBondContact O-CA 3.3Å; N377-K380 WeakPolarHBondContact O-CB 3.49Å; N377-K380 PolarHBondContact O-N 2.9Å; N377-V382 HydrophobicContact CB-CG2 3.63Å; N377-E410 PolarHBondContact ND2-OE1 2.58Å; N377-T413 CarbonylContact C-O 3.54Å; N377-T413 WeakPolarHBondContact CA-O 3.15Å; N377-T413 WeakPolarHBondContact OD1-CB 3.19Å; N377-T413 PolarHBondContact OD1-O 3.34Å; N377-T413 PolarHBondContact OD1-OG1 2.95Å |
| 378 | H | 89.6 | Confident | 93.8 | Very high | 121 Ų | 121 | 58 Ų | 58 | 56% | 0.56 | 29% | 0.287 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51 | 41.1 | -171.2 | -64.1 | 71.7 | 0 | 0 | 0 | 113 | K380 T413 | H378-K380 PolarHBondContact O-N 3.08Å; H378-T413 WeakPolarHBondContact CE1-CB 3.49Å; H378-T413 PolarHBondContact CE1-OG1 2.84Å; H378-T413 PolarHBondContact N-O 3.09Å; H378-T413 WeakPolarHBondContact ND1-CB 3.36Å; H378-T413 PolarHBondContact ND1-OG1 2.81Å |
| 379 | N | 85.4 | Confident | 94 | Very high | 120 Ų | 120 | 59.5 Ų | 59.5 | 64% | 0.642 | 30% | 0.299 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57.3 | 9.2 | -170.3 | -69.1 | -15.4 | 0 | 0 | 0 | 116 | N377 Y442 | N377-N379 PolarHBondContact O-N 3.14Å; N379-Y442 WeakPolarHBondContact OD1-CE1 3.43Å |
| 380 | K | 90.4 | Very high | 93.8 | Very high | 158 Ų | 158 | 60.2 Ų | 60.2 | 69% | 0.687 | 30% | 0.304 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -94.4 | 146.5 | 173.5 | -62.4 | -179.7 | -178.1 | 176.1 | 0 | 110.8 | M376 N377 H378 V382 | M376-K380 CarbonylContact C-O 3.59Å; M376-K380 VanDerWaalsContact CA-O 3.29Å; M376-K380 WeakPolarHBondContact CA-O 3.44Å; N377-K380 PolarHBondContact N-O 2.87Å; N377-K380 WeakPolarHBondContact O-CA 3.3Å; N377-K380 WeakPolarHBondContact O-CB 3.49Å; N377-K380 PolarHBondContact O-N 2.9Å; H378-K380 PolarHBondContact O-N 3.08Å; K380-V382 PolarHBondContact O-N 3.28Å |
| 381 | F | 93.5 | Very high | 93.3 | Very high | 134 Ų | 134 | 62.2 Ų | 62.2 | 59% | 0.588 | 32% | 0.315 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -73 | 124.6 | 179.4 | -179.7 | -99.4 | 0 | 0 | 0 | 112.3 | M376 C384 | M376-F381 HydrophobicContact CE-CB 3.84Å; M376-F381 HydrophobicContact CE-CD2 3.89Å; M376-F381 HydrophobicContact CE-CG 4.35Å; F381-C384 HydrophobicContact CE2-CB 3.75Å; F381-C384 HydrophobicContact CZ-CB 3.6Å; F381-C384 VanDerWaalsContact CZ-N 3.31Å |
| 382 | V | 94.4 | Very high | 92.3 | Very high | 76 Ų | 76 | 64.6 Ų | 64.6 | 46% | 0.461 | 34% | 0.339 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103 | -58.1 | 176.5 | -176.5 | 0 | 0 | 0 | 0 | 110.5 | L375 N377 K380 | L375-V382 HydrophobicContact CB-CB 4.42Å; L375-V382 HydrophobicContact CD2-CB 4.37Å; L375-V382 HydrophobicContact CD2-CG1 4.19Å; L375-V382 HydrophobicContact CG-CB 4.22Å; L375-V382 WeakPolarHBondContact O-CB 3.39Å; L375-V382 PolarHBondContact O-N 2.65Å; N377-V382 HydrophobicContact CB-CG2 3.63Å; K380-V382 PolarHBondContact O-N 3.28Å |
| 383 | K | 95.8 | Very high | 91.6 | Very high | 114 Ų | 114 | 62.1 Ų | 62.1 | 50% | 0.496 | 33% | 0.331 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -159.4 | 140.6 | -174.7 | -164.1 | 161.7 | -168.8 | 160.9 | 0 | 112.3 | S374 L375 F404 | S374-K383 CarbonylContact C-O 3.5Å; S374-K383 WeakPolarHBondContact CA-O 3.48Å; L375-K383 PolarHBondContact N-O 1.85Å; L375-K383 PolarHBondContact O-N 3.25Å; K383-F404 HydrophobicContact CB-CD1 4.12Å; K383-F404 HydrophobicContact CB-CE1 4.14Å; K383-F404 HydrophobicContact CD-CD1 4.47Å; K383-F404 HydrophobicContact CG-CD1 4.43Å; K383-F404 HydrophobicContact CG-CE1 4.29Å |
| 384 | C | 96.5 | Very high | 91.1 | Very high | 46 Ų | 46 | 66.2 Ų | 66.2 | 31% | 0.311 | 35% | 0.352 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.2 | 143.5 | 169.4 | -166.8 | 0 | 0 | 0 | 0 | 110.2 | V373 S374 F381 | V373-C384 CarbonylContact O-C 3.42Å; V373-C384 WeakPolarHBondContact O-CA 3.44Å; S374-C384 PolarHBondContact OG-SG 2.79Å; F381-C384 HydrophobicContact CE2-CB 3.75Å; F381-C384 HydrophobicContact CZ-CB 3.6Å; F381-C384 VanDerWaalsContact CZ-N 3.31Å |
| 385 | K | 97.4 | Very high | 90.7 | Very high | 63 Ų | 63 | 67.5 Ų | 67.5 | 27% | 0.274 | 36% | 0.357 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.8 | 157.3 | 165.8 | -65.8 | -173.8 | 171.4 | -175 | 0 | 108.9 | K372 V373 F402 S403 F404 | K372-K385 CarbonylContact C-O 3.54Å; K372-K385 WeakPolarHBondContact CA-O 3.25Å; V373-K385 PolarHBondContact N-O 2.84Å; V373-K385 PolarHBondContact O-N 2.99Å; K385-F402 HydrophobicContact CB-CD1 3.73Å; K385-F402 HydrophobicContact CB-CE1 4.1Å; K385-F402 HydrophobicContact CB-CG 4.28Å; K385-F402 HydrophobicContact CD-CB 4.03Å; K385-F402 HydrophobicContact CD-CD1 3.76Å; K385-F402 HydrophobicContact CD-CG 4.27Å; K385-F402 HydrophobicContact CG-CD1 4.38Å; K385-S403 PolarHBondContact NZ-O 2.84Å; K385-F404 HydrophobicContact CB-CZ 4.27Å; K385-F404 HydrophobicContact CD-CE1 4.28Å; K385-F404 HydrophobicContact CD-CZ 4.08Å; K385-F404 HydrophobicContact CG-CE1 4.16Å; K385-F404 HydrophobicContact CG-CZ 4.09Å |
| 386 | K | 96.1 | Very high | 90.4 | Very high | 128 Ų | 128 | 67.2 Ų | 67.2 | 56% | 0.557 | 36% | 0.356 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -124.9 | 145.4 | -179.9 | -62.5 | 179.9 | -177.3 | 178.1 | 0 | 109.4 | F370 V371 K372 F402 | F370-K386 HydrophobicContact CD2-CB 4.14Å; F370-K386 HydrophobicContact CD2-CD 4.18Å; F370-K386 HydrophobicContact CD2-CG 4.19Å; F370-K386 HydrophobicContact CE2-CB 4.49Å; F370-K386 HydrophobicContact CE2-CD 3.73Å; F370-K386 HydrophobicContact CE2-CG 4.04Å; V371-K386 WeakPolarHBondContact O-CA 3.12Å; K372-K386 HydrophobicContact CG-CG 4.28Å; K386-F402 WeakPolarHBondContact O-CE1 3.49Å |
| 387 | T | 95.1 | Very high | 90.2 | Very high | 11 Ų | 11 | 65.8 Ų | 65.8 | 7% | 0.067 | 35% | 0.349 | C | S | . | . | P | Polyproline II helix | trans | -71.9 | 167.4 | 164.7 | 64.3 | 0 | 0 | 0 | 0 | 111.6 | V352 F370 V371 Y398 E400 F402 | V352-T387 HydrophobicContact CB-CG2 4.1Å; V352-T387 HydrophobicContact CG1-CG2 4.05Å; V352-T387 HydrophobicContact CG2-CG2 4.41Å; F370-T387 WeakPolarHBondContact CA-OG1 3.32Å; F370-T387 WeakPolarHBondContact CB-OG1 3.48Å; V371-T387 HydrophobicContact CB-CG2 3.92Å; V371-T387 HydrophobicContact CG2-CG2 4.39Å; V371-T387 PolarHBondContact N-OG1 2.83Å; V371-T387 PolarHBondContact O-N 2.91Å; T387-Y398 HydrophobicContact CG2-CD1 3.98Å; T387-Y398 HydrophobicContact CG2-CG 4.02Å; T387-Y398 WeakPolarHBondContact OG1-CD1 3.44Å; T387-Y398 WeakPolarHBondContact OG1-CE1 3.46Å; T387-E400 WeakPolarHBondContact CA-OE2 3.4Å; T387-F402 HydrophobicContact CG2-CE2 3.75Å; T387-F402 HydrophobicContact CG2-CZ 3.7Å |
| 388 | S | 91.1 | Very high | 90.2 | Very high | 61 Ų | 61 | 64.7 Ų | 64.7 | 43% | 0.427 | 34% | 0.343 | S | S | . | . | P | Polyproline II helix | trans | -54.3 | 153.3 | 154.9 | 67.4 | 0 | 0 | 0 | 0 | 111.1 | Y398 E400 | S388-Y398 WeakPolarHBondContact O-CE1 3.41Å; S388-E400 VanDerWaalsContact CB-OE1 3.24Å; S388-E400 WeakPolarHBondContact CB-OE1 3.44Å; S388-E400 PolarHBondContact N-OE1 3.01Å; S388-E400 PolarHBondContact N-OE2 3.44Å; S388-E400 PolarHBondContact OG-OE1 2.94Å |
| 389 | A | 89.7 | Confident | 90.3 | Very high | 44 Ų | 44 | 62 Ų | 62 | 36% | 0.364 | 33% | 0.333 | S | S | . | . | P | Polyproline II helix | trans | -96.2 | 122.8 | -179.5 | 0 | 0 | 0 | 0 | 0 | 110.4 | F370 | F370-A389 HydrophobicContact CB-CB 4.25Š|
| 390 | V | 87.4 | Confident | 90.7 | Very high | 16 Ų | 16 | 58 Ų | 58 | 10% | 0.097 | 31% | 0.31 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.4 | 127 | 179.4 | 179.3 | 0 | 0 | 0 | 0 | 109 | S368 V369 P396 Y398 | S368-V390 CarbonylContact C-O 3.52Å; S368-V390 WeakPolarHBondContact CA-O 3.27Å; V369-V390 PolarHBondContact N-O 3.36Å; V369-V390 PolarHBondContact O-N 2.97Å; V390-P396 HydrophobicContact CB-CB 3.81Å; V390-P396 HydrophobicContact CG1-CB 3.85Å; V390-P396 HydrophobicContact CG2-CB 4.07Å; V390-Y398 HydrophobicContact CB-CE1 4.41Å; V390-Y398 HydrophobicContact CG2-CD1 3.94Å; V390-Y398 HydrophobicContact CG2-CE1 3.67Å |
| 391 | L | 84.8 | Confident | 91 | Very high | 61 Ų | 61 | 54.8 Ų | 54.8 | 32% | 0.319 | 30% | 0.304 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.1 | 133.9 | -177.5 | -56.7 | -167.8 | 0 | 0 | 0 | 112 | Q278 I366 V367 S393 | Q278-L391 VanDerWaalsContact OE1-CD1 3.25Å; I366-L391 HydrophobicContact CG2-CD1 3.9Å; I366-L391 HydrophobicContact CG2-CD2 4.08Å; I366-L391 HydrophobicContact CG2-CG 4.44Å; V367-L391 WeakPolarHBondContact O-CA 3.16Å; L391-S393 PolarHBondContact O-N 3.35Å |
| 392 | G | 75.2 | Confident | 91.1 | Very high | 50 Ų | 50 | 49.1 Ų | 49.1 | 52% | 0.515 | 28% | 0.279 | S | S | . | . | S | Bend | trans | 59.1 | 17.3 | 162.2 | 0 | 0 | 0 | 0 | 0 | 117.4 | V367 | V367-G392 PolarHBondContact O-N 2.78Š|
| 393 | S | 82.8 | Confident | 91.2 | Very high | 14 Ų | 14 | 47.8 Ų | 47.8 | 10% | 0.098 | 27% | 0.273 | C | S | . | . | trans | -107.1 | 127.1 | -176.3 | -172.2 | 0 | 0 | 0 | 0 | 112.6 | L391 N395 | L391-S393 PolarHBondContact O-N 3.35Å; S393-N395 PolarHBondContact OG-N 2.89Å; S393-N395 VanDerWaalsContact OG-N 3.09Å; S393-N395 PolarHBondContact OG-O 2.81Å | ||
| 394 | I | 87.3 | Confident | 91.2 | Very high | 86 Ų | 86 | 42.6 Ų | 42.6 | 44% | 0.441 | 25% | 0.251 | S | S | . | . | S | Bend | trans | -75.4 | -15.3 | 166.5 | 62.1 | 170.2 | 0 | 0 | 0 | 112.6 | G357 L358 L360 P396 | G357-I394 PolarHBondContact N-O 3.42Å; G357-I394 VanDerWaalsContact N-O 3.15Å; L358-I394 PolarHBondContact N-O 3.01Å; L358-I394 WeakPolarHBondContact O-CG2 3.28Å; L360-I394 HydrophobicContact CD1-CG2 4.03Å; L360-I394 HydrophobicContact CG-CG2 4.06Å; I394-P396 VanDerWaalsContact C-CD 3.42Å |
| 395 | N | 88.2 | Confident | 91.1 | Very high | 44 Ų | 44 | 47.3 Ų | 47.3 | 24% | 0.235 | 27% | 0.266 | C | S | . | . | S | Bend | trans | -125.8 | 58.9 | -179.1 | -61.2 | -38 | 0 | 0 | 0 | 110.2 | A355 K356 G357 S393 | A355-N395 CarbonylContact O-C 3.49Å; A355-N395 VanDerWaalsContact O-CA 3.28Å; A355-N395 WeakPolarHBondContact O-CA 2.93Å; K356-N395 VanDerWaalsContact CA-OD1 3.32Å; K356-N395 WeakPolarHBondContact CA-OD1 3.44Å; G357-N395 PolarHBondContact N-OD1 2.77Å; S393-N395 PolarHBondContact OG-N 2.89Å; S393-N395 VanDerWaalsContact OG-N 3.09Å; S393-N395 PolarHBondContact OG-O 2.81Å |
| 396 | P | 90.3 | Very high | 90.9 | Very high | 1 Ų | 1 | 44.4 Ų | 44.4 | 1% | 0.006 | 25% | 0.254 | C | S | . | . | trans | -72.2 | 140.9 | -173.5 | 31.1 | -35.4 | 0 | 0 | 0 | 111.4 | R354 A355 L358 V390 I394 Y398 | R354-P396 CarbonylContact C-O 3.6Å; R354-P396 WeakPolarHBondContact CA-O 3.22Å; R354-P396 VanDerWaalsContact CB-O 3.27Å; R354-P396 WeakPolarHBondContact CB-O 3.24Å; A355-P396 HydrophobicContact CB-CG 4.01Å; A355-P396 PolarHBondContact N-O 2.88Å; L358-P396 HydrophobicContact CD1-CG 3.63Å; V390-P396 HydrophobicContact CB-CB 3.81Å; V390-P396 HydrophobicContact CG1-CB 3.85Å; V390-P396 HydrophobicContact CG2-CB 4.07Å; I394-P396 VanDerWaalsContact C-CD 3.42Å; P396-Y398 HydrophobicContact CB-CE1 4.36Å; P396-Y398 HydrophobicContact CB-CE2 3.97Å; P396-Y398 HydrophobicContact CG-CE2 3.81Å; P396-Y398 WeakPolarHBondContact CG-OH 3.45Å | ||
| 397 | V | 90.8 | Very high | 90.8 | Very high | 11 Ų | 11 | 40.9 Ų | 40.9 | 7% | 0.067 | 24% | 0.241 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -114.9 | 123.4 | 174.2 | -172.7 | 0 | 0 | 0 | 0 | 108.8 | V280 L301 P303 R354 | V280-V397 HydrophobicContact CG1-CG2 4.23Å; V280-V397 HydrophobicContact CG2-CB 3.92Å; V280-V397 HydrophobicContact CG2-CG2 4.02Å; L301-V397 HydrophobicContact CD1-CG2 3.9Å; P303-V397 HydrophobicContact CG-CB 4.03Å; P303-V397 HydrophobicContact CG-CG1 3.42Å; P303-V397 VanDerWaalsContact CG-CG1 3.42Å; R354-V397 HydrophobicContact CB-CB 4.19Å; R354-V397 HydrophobicContact CB-CG1 4.17Å; R354-V397 HydrophobicContact CB-CG2 3.93Å |
| 398 | Y | 92 | Very high | 90.6 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 26% | 0.259 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.7 | -53.6 | -176.4 | -57.9 | -74 | 0 | 0 | 0 | 110.9 | K305 V352 L353 V369 V371 T387 S388 V390 P396 E400 | K305-Y398 WeakPolarHBondContact CE-O 3.38Å; K305-Y398 PolarHBondContact NZ-O 2.72Å; V352-Y398 HydrophobicContact CG1-CD2 3.79Å; V352-Y398 HydrophobicContact CG1-CG 4.22Å; L353-Y398 PolarHBondContact O-N 3.2Å; V369-Y398 WeakPolarHBondContact O-CE1 3.38Å; V369-Y398 PolarHBondContact O-OH 3.07Å; V371-Y398 HydrophobicContact CG2-CD2 4.15Å; V371-Y398 HydrophobicContact CG2-CE2 3.62Å; T387-Y398 HydrophobicContact CG2-CD1 3.98Å; T387-Y398 HydrophobicContact CG2-CG 4.02Å; T387-Y398 WeakPolarHBondContact OG1-CD1 3.44Å; T387-Y398 WeakPolarHBondContact OG1-CE1 3.46Å; S388-Y398 WeakPolarHBondContact O-CE1 3.41Å; V390-Y398 HydrophobicContact CB-CE1 4.41Å; V390-Y398 HydrophobicContact CG2-CD1 3.94Å; V390-Y398 HydrophobicContact CG2-CE1 3.67Å; P396-Y398 HydrophobicContact CB-CE1 4.36Å; P396-Y398 HydrophobicContact CB-CE2 3.97Å; P396-Y398 HydrophobicContact CG-CE2 3.81Å; P396-Y398 WeakPolarHBondContact CG-OH 3.45Å; Y398-E400 PolarHBondContact O-N 2.97Å |
| 399 | N | 91.2 | Very high | 90.5 | Very high | 65 Ų | 65 | 46 Ų | 46 | 35% | 0.348 | 28% | 0.275 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 44.5 | 58.7 | -171.5 | -67.2 | -16.5 | 0 | 0 | 0 | 111.7 | K305 V352 L353 | K305-N399 PolarHBondContact NZ-O 2.91Å; V352-N399 VanDerWaalsContact O-CA 3.29Å; V352-N399 WeakPolarHBondContact O-CA 3.48Å; V352-N399 PolarHBondContact O-N 2.57Å; L353-N399 WeakPolarHBondContact CA-OD1 3.48Å; L353-N399 WeakPolarHBondContact CD2-OD1 3.48Å; L353-N399 PolarHBondContact O-N 2.87Å; L353-N399 PolarHBondContact O-OD1 2.79Å |
| 400 | E | 94.5 | Very high | 90.6 | Very high | 34 Ų | 34 | 47.1 Ų | 47.1 | 16% | 0.159 | 27% | 0.273 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.6 | 137.9 | -176.9 | -77.7 | 177.2 | -121.7 | 0 | 0 | 111.8 | V351 V352 T387 S388 Y398 F402 | V351-E400 CarbonylContact C-O 3.58Å; V351-E400 WeakPolarHBondContact CA-O 3.48Å; V352-E400 PolarHBondContact N-O 3.17Å; V352-E400 PolarHBondContact O-N 2.88Å; T387-E400 WeakPolarHBondContact CA-OE2 3.4Å; S388-E400 VanDerWaalsContact CB-OE1 3.24Å; S388-E400 WeakPolarHBondContact CB-OE1 3.44Å; S388-E400 PolarHBondContact N-OE1 3.01Å; S388-E400 PolarHBondContact N-OE2 3.44Å; S388-E400 PolarHBondContact OG-OE1 2.94Å; Y398-E400 PolarHBondContact O-N 2.97Å; E400-F402 HydrophobicContact CB-CE2 4.14Å; E400-F402 HydrophobicContact CB-CZ 3.95Å |
| 401 | T | 96.1 | Very high | 90.8 | Very high | 91 Ų | 91 | 46.8 Ų | 46.8 | 56% | 0.558 | 27% | 0.271 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -108.3 | 128.4 | -174.5 | -59.1 | 0 | 0 | 0 | 0 | 111.4 | T349 V351 | T349-T401 HydrophobicContact CG2-CG2 3.66Å; V351-T401 HydrophobicContact CG2-CG2 4.1Å |
| 402 | F | 97.1 | Very high | 91.1 | Very high | 16 Ų | 16 | 49.4 Ų | 49.4 | 7% | 0.07 | 29% | 0.285 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.1 | 118.5 | 179.4 | -56.6 | -66.4 | 0 | 0 | 0 | 110.9 | T349 V350 V352 V373 K385 K386 T387 E400 F404 | T349-F402 WeakPolarHBondContact CA-O 3.41Å; V350-F402 PolarHBondContact N-O 3Å; V350-F402 PolarHBondContact O-N 3.35Å; V352-F402 HydrophobicContact CB-CE2 4.21Å; V352-F402 HydrophobicContact CG2-CD2 4Å; V352-F402 HydrophobicContact CG2-CE2 3.74Å; V373-F402 HydrophobicContact CB-CD2 4.41Å; V373-F402 HydrophobicContact CG2-CD2 3.84Å; V373-F402 HydrophobicContact CG2-CE2 3.97Å; K385-F402 HydrophobicContact CB-CD1 3.73Å; K385-F402 HydrophobicContact CB-CE1 4.1Å; K385-F402 HydrophobicContact CB-CG 4.28Å; K385-F402 HydrophobicContact CD-CB 4.03Å; K385-F402 HydrophobicContact CD-CD1 3.76Å; K385-F402 HydrophobicContact CD-CG 4.27Å; K385-F402 HydrophobicContact CG-CD1 4.38Å; K386-F402 WeakPolarHBondContact O-CE1 3.49Å; T387-F402 HydrophobicContact CG2-CE2 3.75Å; T387-F402 HydrophobicContact CG2-CZ 3.7Å; E400-F402 HydrophobicContact CB-CE2 4.14Å; E400-F402 HydrophobicContact CB-CZ 3.95Å; F402-F404 HydrophobicContact CB-CE2 3.82Å; F402-F404 HydrophobicContact CB-CZ 4.39Å |
| 403 | S | 96.1 | Very high | 91.9 | Very high | 47 Ų | 47 | 48.6 Ų | 48.6 | 33% | 0.329 | 27% | 0.27 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.4 | 135.3 | 171.2 | -60.7 | 0 | 0 | 0 | 0 | 111.8 | L348 K385 | L348-S403 CarbonylContact O-C 3.59Å; L348-S403 WeakPolarHBondContact O-CA 3.43Å; K385-S403 PolarHBondContact NZ-O 2.84Å |
| 404 | F | 96 | Very high | 92.5 | Very high | 5 Ų | 5 | 48 Ų | 48 | 2% | 0.022 | 27% | 0.266 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120 | 147 | 171.2 | -60.4 | -94.5 | 0 | 0 | 0 | 109 | R347 L348 V350 V373 L375 K383 K385 F402 L416 | R347-F404 WeakPolarHBondContact CA-O 3.1Å; L348-F404 HydrophobicContact CB-CB 4.5Å; L348-F404 PolarHBondContact N-O 3.46Å; L348-F404 PolarHBondContact O-N 3.12Å; V350-F404 HydrophobicContact CG2-CD2 4.22Å; V350-F404 HydrophobicContact CG2-CE2 4.09Å; V373-F404 HydrophobicContact CB-CZ 4.23Å; V373-F404 HydrophobicContact CG1-CE2 3.74Å; V373-F404 HydrophobicContact CG1-CZ 3.74Å; L375-F404 HydrophobicContact CB-CD1 3.83Å; L375-F404 HydrophobicContact CB-CE1 4.14Å; L375-F404 HydrophobicContact CB-CG 4.38Å; L375-F404 HydrophobicContact CD2-CB 3.92Å; L375-F404 HydrophobicContact CD2-CD1 4.24Å; L375-F404 HydrophobicContact CD2-CG 4.34Å; K383-F404 HydrophobicContact CB-CD1 4.12Å; K383-F404 HydrophobicContact CB-CE1 4.14Å; K383-F404 HydrophobicContact CD-CD1 4.47Å; K383-F404 HydrophobicContact CG-CD1 4.43Å; K383-F404 HydrophobicContact CG-CE1 4.29Å; K385-F404 HydrophobicContact CB-CZ 4.27Å; K385-F404 HydrophobicContact CD-CE1 4.28Å; K385-F404 HydrophobicContact CD-CZ 4.08Å; K385-F404 HydrophobicContact CG-CE1 4.16Å; K385-F404 HydrophobicContact CG-CZ 4.09Å; F402-F404 HydrophobicContact CB-CE2 3.82Å; F402-F404 HydrophobicContact CB-CZ 4.39Å; F404-L416 HydrophobicContact CE2-CD2 4.47Å |
| 405 | K | 94.3 | Very high | 92.9 | Very high | 145 Ų | 145 | 44.1 Ų | 44.1 | 63% | 0.63 | 25% | 0.246 | S | C | * | . | E | Extended strand (participates in β ladder) | trans | -85.6 | 128.6 | 166.1 | -168.6 | -172 | 175.7 | -158.4 | 0 | 107.4 | S346 D407 | S346-K405 CarbonylContact O-C 3.47Å; S346-K405 VanDerWaalsContact O-CA 3.3Å; S346-K405 WeakPolarHBondContact O-CA 3.45Å; K405-D407 WeakPolarHBondContact CE-OD1 3.27Å; K405-D407 IonicContact NZ-OD1 3.76Å; K405-D407 IonicContact NZ-OD2 3.12Å |
| 406 | A | 92.8 | Very high | 93.3 | Very high | 2 Ų | 2 | 42 Ų | 42 | 2% | 0.017 | 24% | 0.235 | C | C | . | . | trans | -149.7 | 120 | 173.1 | 0 | 0 | 0 | 0 | 0 | 106.4 | Y341 S346 L348 L411 | Y341-A406 WeakPolarHBondContact CE2-O 3.45Å; Y341-A406 PolarHBondContact OH-O 3.33Å; Y341-A406 VanDerWaalsContact OH-O 3.08Å; S346-A406 CarbonylContact C-O 3.42Å; S346-A406 VanDerWaalsContact C-O 3.24Å; S346-A406 WeakPolarHBondContact CA-O 3.48Å; S346-A406 WeakPolarHBondContact CB-O 3.43Å; S346-A406 PolarHBondContact O-N 3.01Å; S346-A406 VanDerWaalsContact O-O 3.05Å; L348-A406 HydrophobicContact CB-CB 4.48Å; A406-L411 HydrophobicContact CB-CD2 4.24Å | ||
| 407 | D | 93.1 | Very high | 93.5 | Very high | 55 Ų | 55 | 42.6 Ų | 42.6 | 29% | 0.294 | 24% | 0.24 | S | C | . | . | trans | -78 | 152.4 | -179.9 | -67.2 | -49 | 0 | 0 | 0 | 109.9 | S346 K405 T409 E410 | S346-D407 WeakPolarHBondContact CB-OD1 3.28Å; S346-D407 PolarHBondContact OG-OD1 2.87Å; K405-D407 WeakPolarHBondContact CE-OD1 3.27Å; K405-D407 IonicContact NZ-OD1 3.76Å; K405-D407 IonicContact NZ-OD2 3.12Å; D407-T409 PolarHBondContact O-N 2.91Å; D407-T409 VanDerWaalsContact O-N 3.12Å; D407-E410 HydrophobicContact CB-CG 4.34Å; D407-E410 PolarHBondContact N-OE2 3.06Å; D407-E410 WeakPolarHBondContact O-CA 3.42Å; D407-E410 WeakPolarHBondContact O-CB 3.06Å; D407-E410 PolarHBondContact O-N 2.89Å | ||
| 408 | A | 91.3 | Very high | 93.9 | Very high | 54 Ų | 54 | 42.1 Ų | 42.1 | 45% | 0.446 | 24% | 0.236 | S | C | . | . | G | 310 helix | trans | -57.9 | -34.5 | -169.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | Y341 E410 L411 | Y341-A408 PolarHBondContact OH-N 2.84Å; A408-E410 PolarHBondContact O-N 2.58Å; A408-L411 PolarHBondContact O-N 2.85Å |
| 409 | T | 90.3 | Very high | 94 | Very high | 125 Ų | 125 | 42.6 Ų | 42.6 | 77% | 0.767 | 24% | 0.239 | S | C | * | . | G | 310 helix | trans | -69 | -16.8 | 175.3 | 52.5 | 0 | 0 | 0 | 0 | 114.3 | D407 | D407-T409 PolarHBondContact O-N 2.91Å; D407-T409 VanDerWaalsContact O-N 3.12Å |
| 410 | E | 90.4 | Very high | 94.2 | Very high | 68 Ų | 68 | 39.5 Ų | 39.5 | 32% | 0.318 | 22% | 0.223 | S | C | . | . | G | 310 helix | trans | -90.1 | -14.8 | 177.6 | -58.3 | -173.5 | 114.4 | 0 | 0 | 112.4 | N377 D407 A408 D412 T413 A414 | N377-E410 PolarHBondContact ND2-OE1 2.58Å; D407-E410 HydrophobicContact CB-CG 4.34Å; D407-E410 PolarHBondContact N-OE2 3.06Å; D407-E410 WeakPolarHBondContact O-CA 3.42Å; D407-E410 WeakPolarHBondContact O-CB 3.06Å; D407-E410 PolarHBondContact O-N 2.89Å; A408-E410 PolarHBondContact O-N 2.58Å; E410-D412 VanDerWaalsContact C-N 3.32Å; E410-D412 PolarHBondContact O-N 2.9Å; E410-T413 CarbonylContact O-C 3.56Å; E410-T413 PolarHBondContact O-N 2.95Å; E410-T413 PolarHBondContact O-OG1 3Å; E410-T413 VanDerWaalsContact O-OG1 3.06Å; E410-A414 VanDerWaalsContact O-CB 3.29Å; E410-A414 WeakPolarHBondContact O-CB 3.13Å; E410-A414 PolarHBondContact O-N 2.88Å |
| 411 | L | 91.6 | Very high | 94.2 | Very high | 9 Ų | 9 | 38 Ų | 38 | 5% | 0.047 | 22% | 0.216 | C | C | . | . | G | 310 helix | trans | -63.8 | -35.6 | -173.2 | -69 | 176.8 | 0 | 0 | 0 | 112.9 | Y341 A406 A408 T413 A414 P439 W451 L455 | Y341-L411 HydrophobicContact CD1-CD1 3.86Å; Y341-L411 HydrophobicContact CD2-CD1 4.24Å; Y341-L411 HydrophobicContact CD2-CD2 4.2Å; Y341-L411 HydrophobicContact CE1-CD1 3.53Å; Y341-L411 HydrophobicContact CE2-CD1 3.97Å; Y341-L411 HydrophobicContact CE2-CD2 3.99Å; Y341-L411 HydrophobicContact CE2-CG 4.39Å; Y341-L411 HydrophobicContact CG-CD1 4.2Å; A406-L411 HydrophobicContact CB-CD2 4.24Å; A408-L411 PolarHBondContact O-N 2.85Å; L411-T413 PolarHBondContact O-N 3.15Å; L411-A414 PolarHBondContact O-N 3.05Å; L411-P439 WeakPolarHBondContact O-CG 3.27Å; L411-W451 HydrophobicContact CB-CZ2 4.45Å; L411-W451 HydrophobicContact CD2-CH2 4.39Å; L411-W451 HydrophobicContact CD2-CZ2 4.07Å; L411-L455 HydrophobicContact CD1-CD2 3.62Å |
| 412 | D | 91 | Very high | 93.9 | Very high | 115 Ų | 115 | 33.7 Ų | 33.7 | 62% | 0.615 | 19% | 0.189 | S | C | * | . | G | 310 helix | trans | -65.2 | -18.4 | 176 | -68.1 | -26.3 | 0 | 0 | 0 | 113.2 | E410 P439 | E410-D412 VanDerWaalsContact C-N 3.32Å; E410-D412 PolarHBondContact O-N 2.9Å; D412-P439 WeakPolarHBondContact O-CG 3.33Å |
| 413 | T | 93.2 | Very high | 93.4 | Very high | 33 Ų | 33 | 35.3 Ų | 35.3 | 20% | 0.202 | 20% | 0.199 | C | C | . | . | G | 310 helix | trans | -118 | 1.7 | -179.6 | 57.6 | 0 | 0 | 0 | 0 | 113.2 | N377 H378 E410 L411 Y442 | N377-T413 CarbonylContact C-O 3.54Å; N377-T413 WeakPolarHBondContact CA-O 3.15Å; N377-T413 WeakPolarHBondContact OD1-CB 3.19Å; N377-T413 PolarHBondContact OD1-O 3.34Å; N377-T413 PolarHBondContact OD1-OG1 2.95Å; H378-T413 WeakPolarHBondContact CE1-CB 3.49Å; H378-T413 PolarHBondContact CE1-OG1 2.84Å; H378-T413 PolarHBondContact N-O 3.09Å; H378-T413 WeakPolarHBondContact ND1-CB 3.36Å; H378-T413 PolarHBondContact ND1-OG1 2.81Å; E410-T413 CarbonylContact O-C 3.56Å; E410-T413 PolarHBondContact O-N 2.95Å; E410-T413 PolarHBondContact O-OG1 3Å; E410-T413 VanDerWaalsContact O-OG1 3.06Å; L411-T413 PolarHBondContact O-N 3.15Å; T413-Y442 PolarHBondContact O-OH 2.86Å |
| 414 | A | 94.9 | Very high | 92.8 | Very high | 2 Ų | 2 | 34.9 Ų | 34.9 | 2% | 0.017 | 19% | 0.192 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -90.7 | 146.6 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | L375 M376 E410 L411 P439 W451 | L375-A414 HydrophobicContact CD1-CB 4.3Å; M376-A414 CarbonylContact O-C 3.57Å; M376-A414 VanDerWaalsContact O-CA 3.3Å; M376-A414 WeakPolarHBondContact O-CA 3.36Å; E410-A414 VanDerWaalsContact O-CB 3.29Å; E410-A414 WeakPolarHBondContact O-CB 3.13Å; E410-A414 PolarHBondContact O-N 2.88Å; L411-A414 PolarHBondContact O-N 3.05Å; A414-P439 WeakPolarHBondContact O-CD 3.39Å; A414-W451 HydrophobicContact CB-CH2 4.33Å; A414-W451 HydrophobicContact CB-CZ2 4.42Å |
| 415 | S | 95.6 | Very high | 91.8 | Very high | 4 Ų | 4 | 41.3 Ų | 41.3 | 3% | 0.028 | 22% | 0.222 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -143.8 | 147 | 165.9 | 54.2 | 0 | 0 | 0 | 0 | 111.4 | M376 V437 | M376-S415 WeakPolarHBondContact CB-O 3.35Å; M376-S415 PolarHBondContact N-O 3Å; M376-S415 PolarHBondContact O-N 3.02Å; S415-V437 WeakPolarHBondContact CA-O 3.48Å |
| 416 | L | 96.1 | Very high | 90.6 | Very high | 0 Ų | 0 | 37.5 Ų | 37.5 | 0% | 0 | 22% | 0.224 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -103.7 | 122.6 | 175.5 | -75.5 | 173.5 | 0 | 0 | 0 | 109.6 | L339 L348 V350 V373 S374 L375 F404 L418 V436 V437 W451 | L339-L416 HydrophobicContact CD2-CD1 3.65Å; L348-L416 HydrophobicContact CD1-CD1 4.45Å; L348-L416 HydrophobicContact CD2-CD1 3.78Å; L348-L416 HydrophobicContact CD2-CD2 4.17Å; L348-L416 HydrophobicContact CD2-CG 3.97Å; L348-L416 HydrophobicContact CG-CD1 4.21Å; V350-L416 HydrophobicContact CG2-CD1 3.44Å; V350-L416 VanDerWaalsContact CG2-CD1 3.44Å; V350-L416 HydrophobicContact CG2-CD2 4.22Å; V373-L416 HydrophobicContact CG1-CD2 4.43Å; S374-L416 WeakPolarHBondContact O-CA 3.4Å; L375-L416 HydrophobicContact CB-CD2 4.16Å; L375-L416 HydrophobicContact CD1-CD2 3.93Å; L375-L416 HydrophobicContact CD1-CG 4.42Å; F404-L416 HydrophobicContact CE2-CD2 4.47Å; L416-L418 HydrophobicContact CB-CD1 4.28Å; L416-V436 CarbonylContact O-C 3.59Å; L416-V436 VanDerWaalsContact O-CA 3.29Å; L416-V436 WeakPolarHBondContact O-CA 3.45Å; L416-V437 HydrophobicContact CB-CG2 3.75Å; L416-V437 HydrophobicContact CD1-CG2 4.36Å; L416-V437 PolarHBondContact N-O 2.91Å; L416-V437 PolarHBondContact O-N 2.85Å; L416-W451 HydrophobicContact CD1-CZ3 4.09Å; L416-W451 HydrophobicContact CG-CZ3 4.21Å |
| 417 | S | 95.9 | Very high | 89.4 | Confident | 14 Ų | 14 | 44.7 Ų | 44.7 | 10% | 0.098 | 26% | 0.262 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.7 | 116.2 | 168.9 | 173.9 | 0 | 0 | 0 | 0 | 109.4 | S374 T419 R434 | S374-S417 PolarHBondContact N-O 2.99Å; S374-S417 PolarHBondContact O-N 2.94Å; S417-T419 PolarHBondContact OG-OG1 2.85Å; S417-R434 VanDerWaalsContact OG-CD 3.27Å; S417-R434 WeakPolarHBondContact OG-CD 3.39Å |
| 418 | L | 97.4 | Very high | 88.6 | Confident | 0 Ų | 0 | 49.1 Ų | 49.1 | 0% | 0 | 28% | 0.279 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.2 | 114.1 | 169.6 | -62.8 | 88.3 | 0 | 0 | 0 | 108.8 | L335 F337 V350 V352 V371 K372 V373 L416 R434 V435 V437 | L335-L418 HydrophobicContact CD2-CB 3.79Å; L335-L418 HydrophobicContact CD2-CD2 3.91Å; F337-L418 HydrophobicContact CB-CD2 4.19Å; F337-L418 HydrophobicContact CD1-CD2 3.81Å; F337-L418 HydrophobicContact CD2-CD1 4.43Å; F337-L418 HydrophobicContact CD2-CD2 4.04Å; F337-L418 HydrophobicContact CE1-CD1 4.25Å; F337-L418 HydrophobicContact CE1-CD2 4.15Å; F337-L418 HydrophobicContact CE2-CD1 3.98Å; F337-L418 HydrophobicContact CE2-CD2 4.37Å; F337-L418 HydrophobicContact CG-CD2 3.75Å; F337-L418 HydrophobicContact CZ-CD1 3.88Å; F337-L418 HydrophobicContact CZ-CD2 4.42Å; V350-L418 HydrophobicContact CG1-CD2 4.18Å; V352-L418 HydrophobicContact CG2-CD2 4.04Å; V371-L418 HydrophobicContact CG1-CB 4.17Å; K372-L418 WeakPolarHBondContact O-CA 3.35Å; V373-L418 HydrophobicContact CG1-CG 4.37Å; V373-L418 HydrophobicContact CG2-CD2 4.22Å; V373-L418 HydrophobicContact CG2-CG 4.32Å; L416-L418 HydrophobicContact CB-CD1 4.28Å; L418-R434 WeakPolarHBondContact O-CA 3.48Å; L418-V435 HydrophobicContact CB-CG1 3.82Å; L418-V435 HydrophobicContact CD1-CG1 4.43Å; L418-V435 PolarHBondContact N-O 3.29Å; L418-V435 PolarHBondContact O-N 3.37Å; L418-V437 HydrophobicContact CD1-CG2 4.4Å |
| 419 | T | 96.1 | Very high | 88.4 | Confident | 10 Ų | 10 | 49.7 Ų | 49.7 | 6% | 0.061 | 28% | 0.28 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.5 | 120.5 | -175.9 | -60.6 | 0 | 0 | 0 | 0 | 110.1 | V371 K372 S417 V421 Q431 | V371-T419 CarbonylContact C-O 3.5Å; V371-T419 WeakPolarHBondContact CA-O 3.42Å; K372-T419 PolarHBondContact N-O 3.3Å; K372-T419 PolarHBondContact O-N 2.84Å; S417-T419 PolarHBondContact OG-OG1 2.85Å; T419-V421 HydrophobicContact CG2-CG2 3.87Å; T419-Q431 HydrophobicContact CG2-CB 4.46Å; T419-Q431 HydrophobicContact CG2-CG 3.56Å; T419-Q431 VanDerWaalsContact CG2-OE1 3.23Å |
| 420 | V | 95.3 | Very high | 88.3 | Confident | 0 Ų | 0 | 47.8 Ų | 47.8 | 0% | 0 | 26% | 0.262 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.4 | 124 | 173.8 | -174.5 | 0 | 0 | 0 | 0 | 108.9 | L335 L358 V369 V371 L432 G433 L468 | L335-V420 HydrophobicContact CD1-CG2 4.39Å; L335-V420 HydrophobicContact CD2-CG2 4.45Å; L358-V420 HydrophobicContact CD1-CG1 3.91Å; L358-V420 HydrophobicContact CD2-CG1 4.17Å; V369-V420 HydrophobicContact CG1-CG1 3.55Å; V371-V420 HydrophobicContact CG2-CG2 4.29Å; V420-L432 HydrophobicContact CB-CB 4.46Å; V420-L432 HydrophobicContact CG1-CB 4.34Å; V420-L432 HydrophobicContact CG1-CD1 4.15Å; V420-L432 PolarHBondContact O-N 2.9Å; V420-G433 PolarHBondContact N-O 3.06Å; V420-L468 HydrophobicContact CB-CD1 4.3Å; V420-L468 HydrophobicContact CG2-CD1 3.67Å; V420-L468 HydrophobicContact CG2-CD2 3.81Å; V420-L468 HydrophobicContact CG2-CG 4.43Å |
| 421 | V | 92.8 | Very high | 88.3 | Confident | 3 Ų | 3 | 47.1 Ų | 47.1 | 2% | 0.018 | 26% | 0.259 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123 | 127.9 | -175.7 | -177 | 0 | 0 | 0 | 0 | 109.7 | V369 F370 K372 T419 Q430 | V369-V421 WeakPolarHBondContact CA-O 3.41Å; F370-V421 HydrophobicContact CD1-CB 4.42Å; F370-V421 HydrophobicContact CE1-CB 3.92Å; F370-V421 HydrophobicContact CE1-CG1 3.79Å; F370-V421 HydrophobicContact CE2-CB 4.12Å; F370-V421 HydrophobicContact CE2-CG1 4.49Å; F370-V421 HydrophobicContact CE2-CG2 4.49Å; F370-V421 HydrophobicContact CZ-CB 3.76Å; F370-V421 HydrophobicContact CZ-CG1 3.68Å; F370-V421 HydrophobicContact CZ-CG2 4.44Å; F370-V421 PolarHBondContact N-O 3.13Å; F370-V421 PolarHBondContact O-N 3.2Å; K372-V421 HydrophobicContact CD-CG2 3.94Å; K372-V421 HydrophobicContact CG-CG2 4.1Å; T419-V421 HydrophobicContact CG2-CG2 3.87Å; V421-Q430 WeakPolarHBondContact CA-O 3.41Å |
| 422 | Q | 90.5 | Very high | 88.3 | Confident | 0 Ų | 0 | 47.6 Ų | 47.6 | 0% | 0 | 26% | 0.262 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.3 | 123.2 | 167.4 | -169.8 | -175.1 | -8.4 | 0 | 0 | 108.6 | Q361 V367 S368 S429 Q430 L432 | Q361-Q422 PolarHBondContact O-NE2 3.38Å; V367-Q422 HydrophobicContact CG1-CG 3.44Å; V367-Q422 VanDerWaalsContact CG1-CG 3.44Å; V367-Q422 VanDerWaalsContact CG1-NE2 3.28Å; V367-Q422 VanDerWaalsContact CG2-NE2 3.31Å; S368-Q422 CarbonylContact O-C 3.55Å; S368-Q422 WeakPolarHBondContact O-CA 3.38Å; Q422-S429 CarbonylContact O-C 3.55Å; Q422-S429 WeakPolarHBondContact O-CA 3.49Å; Q422-Q430 HydrophobicContact CB-CB 4.49Å; Q422-Q430 PolarHBondContact N-O 2.9Å; Q422-Q430 PolarHBondContact O-N 3.3Å; Q422-L432 HydrophobicContact CB-CD1 4.11Å; Q422-L432 HydrophobicContact CB-CD2 3.81Å; Q422-L432 HydrophobicContact CB-CG 3.88Å |
| 423 | N | 87.6 | Confident | 88.4 | Confident | 51 Ų | 51 | 42.1 Ų | 42.1 | 27% | 0.273 | 23% | 0.232 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -87.5 | 134.7 | 164.7 | -157.3 | 29.5 | 0 | 0 | 0 | 109.5 | S368 F370 | S368-N423 PolarHBondContact N-O 2.93Å; S368-N423 PolarHBondContact O-N 3.08Å; S368-N423 WeakPolarHBondContact OG-CB 3.38Å; F370-N423 HydrophobicContact CE1-CB 4.4Å |
| 424 | M | 82.8 | Confident | 88.5 | Confident | 37 Ų | 37 | 44.4 Ų | 44.4 | 18% | 0.182 | 24% | 0.237 | C | C | . | . | trans | -111.2 | 170.2 | 176.5 | -57.9 | 178.6 | 163.1 | 0 | 0 | 110.5 | Q361 K428 Q430 | Q361-M424 HydrophobicContact CB-CE 3.68Å; Q361-M424 HydrophobicContact CG-CE 3.85Å; M424-K428 HydrophobicContact CB-CB 4.3Å; M424-K428 VanDerWaalsContact CB-O 3.28Å; M424-K428 WeakPolarHBondContact CB-O 3.49Å; M424-K428 PolarHBondContact N-O 2.82Å; M424-Q430 HydrophobicContact CE-CB 3.85Å; M424-Q430 HydrophobicContact CE-CG 4.43Å; M424-Q430 HydrophobicContact SD-CB 4.45Å | ||
| 425 | E | 74.9 | Confident | 88.5 | Confident | 141 Ų | 141 | 44.6 Ų | 44.6 | 66% | 0.659 | 24% | 0.238 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -66.3 | 135.5 | 174.1 | -160.7 | 160.7 | 166.6 | 0 | 0 | 110.7 | G365 | G365-E425 WeakPolarHBondContact CA-OE2 3.01Š|
| 426 | G | 69.3 | Low | 88.5 | Confident | 65 Ų | 65 | 46.6 Ų | 46.6 | 67% | 0.67 | 25% | 0.25 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 83.6 | 36 | -178.4 | 0 | 0 | 0 | 0 | 0 | 116.3 | K428 | G426-K428 PolarHBondContact O-N 3.2Å; G426-K428 VanDerWaalsContact O-N 3.11Å |
| 427 | D | 66.7 | Low | 88.5 | Confident | 152 Ų | 152 | 46.6 Ų | 46.6 | 81% | 0.813 | 25% | 0.25 | S | C | * | . | S | Bend | trans | 58.8 | 20.5 | 174.6 | -156.7 | 35.2 | 0 | 0 | 0 | 115.6 | ||
| 428 | K | 77.8 | Confident | 88.5 | Confident | 149 Ų | 149 | 45.9 Ų | 45.9 | 65% | 0.648 | 25% | 0.245 | S | C | * | . | trans | -88.2 | 118.2 | 172.5 | -68 | 176.8 | -176.3 | 174.7 | 0 | 109.4 | M424 G426 | M424-K428 HydrophobicContact CB-CB 4.3Å; M424-K428 VanDerWaalsContact CB-O 3.28Å; M424-K428 WeakPolarHBondContact CB-O 3.49Å; M424-K428 PolarHBondContact N-O 2.82Å; G426-K428 PolarHBondContact O-N 3.2Å; G426-K428 VanDerWaalsContact O-N 3.11Å | ||
| 429 | S | 86.1 | Confident | 88.3 | Confident | 65 Ų | 65 | 46.3 Ų | 46.3 | 46% | 0.455 | 25% | 0.248 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -107.4 | 118.3 | 174.3 | 80.5 | 0 | 0 | 0 | 0 | 111.2 | Q422 | Q422-S429 CarbonylContact O-C 3.55Å; Q422-S429 WeakPolarHBondContact O-CA 3.49Å |
| 430 | Q | 88.1 | Confident | 88.1 | Confident | 85 Ų | 85 | 53.2 Ų | 53.2 | 40% | 0.397 | 27% | 0.274 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.4 | 133.3 | 175.9 | 178.8 | 55.8 | 43.8 | 0 | 0 | 110.6 | V421 Q422 M424 | V421-Q430 WeakPolarHBondContact CA-O 3.41Å; Q422-Q430 HydrophobicContact CB-CB 4.49Å; Q422-Q430 PolarHBondContact N-O 2.9Å; Q422-Q430 PolarHBondContact O-N 3.3Å; M424-Q430 HydrophobicContact CE-CB 3.85Å; M424-Q430 HydrophobicContact CE-CG 4.43Å; M424-Q430 HydrophobicContact SD-CB 4.45Å |
| 431 | Q | 91.3 | Very high | 87.8 | Confident | 55 Ų | 55 | 59.1 Ų | 59.1 | 26% | 0.257 | 30% | 0.303 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.1 | 125.4 | 170.3 | 177.1 | 164.5 | -31.3 | 0 | 0 | 110.2 | T419 T471 | T419-Q431 HydrophobicContact CG2-CB 4.46Å; T419-Q431 HydrophobicContact CG2-CG 3.56Å; T419-Q431 VanDerWaalsContact CG2-OE1 3.23Å; Q431-T471 PolarHBondContact NE2-OG1 3.22Å |
| 432 | L | 90.9 | Very high | 87.6 | Confident | 19 Ų | 19 | 62.4 Ų | 62.4 | 10% | 0.099 | 32% | 0.315 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.4 | -39.3 | 177.2 | -62.1 | -172.4 | 0 | 0 | 0 | 112 | L358 R359 L360 V369 V420 Q422 | L358-L432 HydrophobicContact CB-CD1 4.4Å; R359-L432 WeakPolarHBondContact O-CD2 3.39Å; L360-L432 HydrophobicContact CD2-CD1 3.72Å; V369-L432 HydrophobicContact CG1-CD1 4.34Å; V420-L432 HydrophobicContact CB-CB 4.46Å; V420-L432 HydrophobicContact CG1-CB 4.34Å; V420-L432 HydrophobicContact CG1-CD1 4.15Å; V420-L432 PolarHBondContact O-N 2.9Å; Q422-L432 HydrophobicContact CB-CD1 4.11Å; Q422-L432 HydrophobicContact CB-CD2 3.81Å; Q422-L432 HydrophobicContact CB-CG 3.88Å |
| 433 | G | 93 | Very high | 87.6 | Confident | 0 Ų | 0 | 63 Ų | 63 | 0% | 0 | 32% | 0.319 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -178.8 | 166.9 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | V420 C469 | V420-G433 PolarHBondContact N-O 3.06Å; G433-C469 WeakPolarHBondContact CA-O 3.28Å |
| 434 | R | 95 | Very high | 87.9 | Confident | 81 Ų | 81 | 69.8 Ų | 69.8 | 31% | 0.306 | 34% | 0.341 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -140 | 143.3 | -178.5 | 174.3 | 178.1 | 64.9 | -161 | 0.5 | 110.2 | S417 L418 V436 C469 T471 | S417-R434 VanDerWaalsContact OG-CD 3.27Å; S417-R434 WeakPolarHBondContact OG-CD 3.39Å; L418-R434 WeakPolarHBondContact O-CA 3.48Å; R434-V436 HydrophobicContact CG-CG2 4.17Å; R434-C469 PolarHBondContact N-O 3.11Å; R434-C469 PolarHBondContact O-N 3.18Å; R434-T471 VanDerWaalsContact CZ-CG2 3.43Å |
| 435 | V | 95.9 | Very high | 88.4 | Confident | 5 Ų | 5 | 70.1 Ų | 70.1 | 3% | 0.03 | 35% | 0.354 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.9 | 143 | 161 | 57.3 | 0 | 0 | 0 | 0 | 108.3 | L335 F337 L418 V437 E447 H466 L468 | L335-V435 HydrophobicContact CD2-CG1 4.17Å; F337-V435 HydrophobicContact CE1-CG1 3.9Å; F337-V435 HydrophobicContact CZ-CG1 4.42Å; L418-V435 HydrophobicContact CB-CG1 3.82Å; L418-V435 HydrophobicContact CD1-CG1 4.43Å; L418-V435 PolarHBondContact N-O 3.29Å; L418-V435 PolarHBondContact O-N 3.37Å; V435-V437 HydrophobicContact CG2-CG1 4.28Å; V435-E447 HydrophobicContact CG2-CG 4.01Å; V435-H466 HydrophobicContact CB-CB 4.32Å; V435-H466 HydrophobicContact CG2-CB 3.71Å; V435-L468 HydrophobicContact CG1-CD2 4.46Å |
| 436 | V | 95.6 | Very high | 89.2 | Confident | 46 Ų | 46 | 68.8 Ų | 68.8 | 28% | 0.279 | 34% | 0.343 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.5 | 137.5 | 170.6 | -177.5 | 0 | 0 | 0 | 0 | 107.3 | L416 R434 T443 E447 | L416-V436 CarbonylContact O-C 3.59Å; L416-V436 VanDerWaalsContact O-CA 3.29Å; L416-V436 WeakPolarHBondContact O-CA 3.45Å; R434-V436 HydrophobicContact CG-CG2 4.17Å; V436-T443 HydrophobicContact CB-CG2 4.35Å; V436-T443 HydrophobicContact CG1-CG2 4.06Å; V436-T443 WeakPolarHBondContact O-CG2 3.22Å; V436-E447 WeakPolarHBondContact O-CB 3.06Å; V436-E447 WeakPolarHBondContact O-CG 3.38Å |
| 437 | V | 96.3 | Very high | 90.5 | Very high | 0 Ų | 0 | 67.5 Ų | 67.5 | 0% | 0 | 32% | 0.32 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.9 | 145.7 | 172.8 | -64.5 | 0 | 0 | 0 | 0 | 109.4 | F337 L339 S415 L416 L418 V435 E447 W451 | F337-V437 HydrophobicContact CE2-CG1 4.35Å; F337-V437 HydrophobicContact CE2-CG2 4.2Å; F337-V437 HydrophobicContact CZ-CG1 3.81Å; F337-V437 HydrophobicContact CZ-CG2 4.32Å; L339-V437 HydrophobicContact CD1-CG2 4.02Å; S415-V437 WeakPolarHBondContact CA-O 3.48Å; L416-V437 HydrophobicContact CB-CG2 3.75Å; L416-V437 HydrophobicContact CD1-CG2 4.36Å; L416-V437 PolarHBondContact N-O 2.91Å; L416-V437 PolarHBondContact O-N 2.85Å; L418-V437 HydrophobicContact CD1-CG2 4.4Å; V435-V437 HydrophobicContact CG2-CG1 4.28Å; V437-E447 HydrophobicContact CG1-CB 4.1Å; V437-E447 HydrophobicContact CG1-CG 4.4Å; V437-W451 HydrophobicContact CG2-CE3 4.4Å |
| 438 | G | 95.1 | Very high | 91.9 | Very high | 0 Ų | 0 | 61.6 Ų | 61.6 | 0% | 0 | 29% | 0.288 | C | S | . | . | trans | 170.1 | -179.7 | -174.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | T443 L448 W451 | G438-T443 PolarHBondContact O-OG1 3.09Å; G438-L448 WeakPolarHBondContact O-CD1 3.27Å; G438-W451 VanDerWaalsContact C-CG 3.45Å | ||
| 439 | P | 94 | Very high | 92.7 | Very high | 9 Ų | 9 | 58.9 Ų | 58.9 | 6% | 0.058 | 28% | 0.277 | C | S | . | . | S | Bend | trans | -65.8 | 171.2 | 176.6 | 29.8 | -35.4 | 0 | 0 | 0 | 112.1 | L411 D412 A414 M441 Y442 T443 | L411-P439 WeakPolarHBondContact O-CG 3.27Å; D412-P439 WeakPolarHBondContact O-CG 3.33Å; A414-P439 WeakPolarHBondContact O-CD 3.39Å; P439-M441 PolarHBondContact O-N 3.5Å; P439-Y442 HydrophobicContact CG-CD2 3.87Å; P439-Y442 HydrophobicContact CG-CE2 4.12Å; P439-Y442 PolarHBondContact O-N 2.88Å; P439-T443 PolarHBondContact O-N 3.06Å |
| 440 | Y | 91.6 | Very high | 93.2 | Very high | 155 Ų | 155 | 55.8 Ų | 55.8 | 61% | 0.608 | 26% | 0.256 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.1 | -20.8 | -168 | 88.6 | -87.8 | 0 | 0 | 0 | 115.6 | Y442 | Y440-Y442 VanDerWaalsContact C-N 3.3Š|
| 441 | M | 89.1 | Confident | 93.6 | Very high | 124 Ų | 124 | 51.8 Ų | 51.8 | 61% | 0.611 | 24% | 0.237 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -68 | -27.3 | 176.2 | -71.6 | -65 | -71.7 | 0 | 0 | 113.1 | P439 | P439-M441 PolarHBondContact O-N 3.5Š|
| 442 | Y | 88.4 | Confident | 93.8 | Very high | 71 Ų | 71 | 52.9 Ų | 52.9 | 28% | 0.278 | 25% | 0.245 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -110.7 | -30.8 | -176.3 | -57 | -72.3 | 0 | 0 | 0 | 113.3 | N379 T413 P439 Y440 | N379-Y442 WeakPolarHBondContact OD1-CE1 3.43Å; T413-Y442 PolarHBondContact O-OH 2.86Å; P439-Y442 HydrophobicContact CG-CD2 3.87Å; P439-Y442 HydrophobicContact CG-CE2 4.12Å; P439-Y442 PolarHBondContact O-N 2.88Å; Y440-Y442 VanDerWaalsContact C-N 3.3Å |
| 443 | T | 91.2 | Very high | 94 | Very high | 13 Ų | 13 | 54.1 Ų | 54.1 | 8% | 0.08 | 25% | 0.25 | C | S | . | . | trans | -138.5 | 165 | -173.2 | 73.3 | 0 | 0 | 0 | 0 | 113.2 | V436 G438 P439 E447 L448 | V436-T443 HydrophobicContact CB-CG2 4.35Å; V436-T443 HydrophobicContact CG1-CG2 4.06Å; V436-T443 WeakPolarHBondContact O-CG2 3.22Å; G438-T443 PolarHBondContact O-OG1 3.09Å; P439-T443 PolarHBondContact O-N 3.06Å; T443-E447 HydrophobicContact CG2-CB 4.36Å; T443-L448 WeakPolarHBondContact OG1-CA 3.47Å; T443-L448 PolarHBondContact OG1-N 2.87Å | ||
| 444 | R | 91.9 | Very high | 94.2 | Very high | 193 Ų | 193 | 54.1 Ų | 54.1 | 73% | 0.728 | 25% | 0.25 | S | S | * | . | trans | -142.8 | 158.2 | -177.1 | -63 | -70.9 | 178.5 | 81.1 | 0.4 | 108.2 | ||||
| 445 | G | 93.8 | Very high | 94.1 | Very high | 45 Ų | 45 | 53.2 Ų | 53.2 | 46% | 0.464 | 25% | 0.251 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 68.6 | -140.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | E447 L448 E449 | G445-E447 PolarHBondContact O-N 3.23Å; G445-L448 WeakPolarHBondContact O-CB 3.48Å; G445-L448 PolarHBondContact O-N 2.92Å; G445-L448 VanDerWaalsContact O-N 3.08Å; G445-E449 WeakPolarHBondContact O-CG 3.29Å; G445-E449 PolarHBondContact O-N 2.83Å |
| 446 | R | 93 | Very high | 94 | Very high | 112 Ų | 112 | 57 Ų | 57 | 42% | 0.423 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -61.1 | -32.1 | -170.7 | -62.2 | -170 | -62.5 | -166.5 | 0.9 | 113.1 | H450 H466 | R446-H450 WeakPolarHBondContact O-CB 3.47Å; R446-H450 PolarHBondContact O-N 2.87Å; R446-H466 PolarHBondContact O-CE1 3.27Å |
| 447 | E | 95.1 | Very high | 93.8 | Very high | 39 Ų | 39 | 58.5 Ų | 58.5 | 18% | 0.182 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -67.7 | -38.6 | 179 | -67.7 | 71.9 | -164.6 | 0 | 0 | 111.7 | V435 V436 V437 T443 G445 H466 | V435-E447 HydrophobicContact CG2-CG 4.01Å; V436-E447 WeakPolarHBondContact O-CB 3.06Å; V436-E447 WeakPolarHBondContact O-CG 3.38Å; V437-E447 HydrophobicContact CG1-CB 4.1Å; V437-E447 HydrophobicContact CG1-CG 4.4Å; T443-E447 HydrophobicContact CG2-CB 4.36Å; G445-E447 PolarHBondContact O-N 3.23Å; E447-H466 IonicContact OE1-ND1 2.69Å |
| 448 | L | 95.8 | Very high | 93.4 | Very high | 27 Ų | 27 | 61.6 Ų | 61.6 | 14% | 0.141 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -74.2 | -47.5 | 173.4 | 175.6 | 59.7 | 0 | 0 | 0 | 110.8 | G438 T443 G445 H450 W451 D452 | G438-L448 WeakPolarHBondContact O-CD1 3.27Å; T443-L448 WeakPolarHBondContact OG1-CA 3.47Å; T443-L448 PolarHBondContact OG1-N 2.87Å; G445-L448 WeakPolarHBondContact O-CB 3.48Å; G445-L448 PolarHBondContact O-N 2.92Å; G445-L448 VanDerWaalsContact O-N 3.08Å; L448-H450 PolarHBondContact O-N 2.86Å; L448-H450 VanDerWaalsContact O-N 3.17Å; L448-W451 WeakPolarHBondContact O-CA 3.29Å; L448-W451 WeakPolarHBondContact O-CB 3.49Å; L448-W451 PolarHBondContact O-N 2.96Å; L448-D452 WeakPolarHBondContact CD1-OD2 3.48Å; L448-D452 WeakPolarHBondContact CG-OD2 3.38Å; L448-D452 PolarHBondContact O-N 3.49Å |
| 449 | E | 96.5 | Very high | 92.9 | Very high | 92 Ų | 92 | 67.6 Ų | 67.6 | 43% | 0.43 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -54 | -37.1 | 176.2 | -70.4 | 168.2 | -152.9 | 0 | 0 | 112.5 | G445 E453 R464 | G445-E449 WeakPolarHBondContact O-CG 3.29Å; G445-E449 PolarHBondContact O-N 2.83Å; E449-E453 WeakPolarHBondContact O-CB 3.35Å; E449-E453 PolarHBondContact O-N 3.45Å; E449-R464 IonicContact OE2-CZ 3.71Å; E449-R464 IonicContact OE2-NH1 3.8Å; E449-R464 PolarHBondContact OE2-NH1 2.94Å; E449-R464 IonicContact OE2-NH2 3.61Å |
| 450 | H | 96.7 | Very high | 92.8 | Very high | 0 Ų | 0 | 72.7 Ų | 72.7 | 0% | 0 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -68.4 | -36.2 | 177.7 | -169.8 | -168 | 0 | 0 | 0 | 112.5 | F337 L339 R446 L448 M454 V462 R464 H466 | F337-H450 AromaticContact CD2-CE1 2.87Å; F337-H450 WeakPolarHBondContact CD2-CE1 3.43Å; F337-H450 AromaticContact CE2-CE1 2.93Å; F337-H450 WeakPolarHBondContact CE2-CE1 3.44Å; F337-H450 AromaticContact CE2-ND1 3.58Å; F337-H450 AromaticContact CG-CE1 3.57Å; F337-H450 AromaticContact CZ-CE1 3.68Å; F337-H450 AromaticContact CZ-ND1 3.88Å; F337-H450 PolarHBondContact O-CE1 2.93Å; L339-H450 PolarHBondContact N-NE2 3.07Å; L339-H450 VanDerWaalsContact N-NE2 3.13Å; R446-H450 WeakPolarHBondContact O-CB 3.47Å; R446-H450 PolarHBondContact O-N 2.87Å; L448-H450 PolarHBondContact O-N 2.86Å; L448-H450 VanDerWaalsContact O-N 3.17Å; H450-M454 WeakPolarHBondContact O-CB 3.3Å; H450-M454 PolarHBondContact O-N 2.92Å; H450-M454 VanDerWaalsContact O-N 3.16Å; H450-V462 WeakPolarHBondContact NE2-CB 3.42Å; H450-V462 PolarHBondContact NE2-O 3.19Å; H450-R464 HydrophobicContact CB-CB 4.45Å; H450-R464 HydrophobicContact CB-CG 3.96Å; H450-R464 VanDerWaalsContact CD2-CG 3.44Å; H450-R464 WeakPolarHBondContact CD2-CG 3.36Å; H450-H466 AromaticContact CG-NE2 3.6Å; H450-H466 AromaticContact ND1-CD2 3.83Å; H450-H466 AromaticContact ND1-CE1 3.76Å; H450-H466 AromaticContact ND1-NE2 2.87Å; H450-H466 PolarHBondContact ND1-NE2 2.88Å |
| 451 | W | 96.3 | Very high | 92.9 | Very high | 1 Ų | 1 | 69.9 Ų | 69.9 | 0% | 0.004 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -71.1 | -47.6 | 176.3 | -173 | -93.5 | 0 | 0 | 0 | 111.4 | L339 L348 L411 A414 L416 V437 G438 L448 E453 M454 L455 | L339-W451 HydrophobicContact CD1-CE3 4.38Å; L348-W451 HydrophobicContact CD2-CH2 3.92Å; L348-W451 HydrophobicContact CD2-CZ3 4.12Å; L411-W451 HydrophobicContact CB-CZ2 4.45Å; L411-W451 HydrophobicContact CD2-CH2 4.39Å; L411-W451 HydrophobicContact CD2-CZ2 4.07Å; A414-W451 HydrophobicContact CB-CH2 4.33Å; A414-W451 HydrophobicContact CB-CZ2 4.42Å; L416-W451 HydrophobicContact CD1-CZ3 4.09Å; L416-W451 HydrophobicContact CG-CZ3 4.21Å; V437-W451 HydrophobicContact CG2-CE3 4.4Å; G438-W451 VanDerWaalsContact C-CG 3.45Å; L448-W451 WeakPolarHBondContact O-CA 3.29Å; L448-W451 WeakPolarHBondContact O-CB 3.49Å; L448-W451 PolarHBondContact O-N 2.96Å; W451-E453 PolarHBondContact O-N 3.1Å; W451-M454 HydrophobicContact CD2-CE 3.84Å; W451-M454 HydrophobicContact CE3-CE 3.88Å; W451-M454 HydrophobicContact CG-CE 4.41Å; W451-M454 HydrophobicContact CH2-CE 4.31Å; W451-M454 HydrophobicContact CZ2-CE 4.26Å; W451-M454 HydrophobicContact CZ3-CE 4.13Å; W451-M454 WeakPolarHBondContact O-CB 3.48Å; W451-M454 PolarHBondContact O-N 3.38Å; W451-L455 WeakPolarHBondContact O-CG 3.45Å; W451-L455 PolarHBondContact O-N 3.04Å; W451-L455 VanDerWaalsContact O-N 3.1Å |
| 452 | D | 95.4 | Very high | 93.1 | Very high | 78 Ų | 78 | 64.4 Ų | 64.4 | 42% | 0.417 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -66.2 | -39.2 | 179.2 | -64.2 | -14 | 0 | 0 | 0 | 111.3 | L448 M454 L455 S456 | L448-D452 WeakPolarHBondContact CD1-OD2 3.48Å; L448-D452 WeakPolarHBondContact CG-OD2 3.38Å; L448-D452 PolarHBondContact O-N 3.49Å; D452-M454 PolarHBondContact O-N 2.85Å; D452-L455 PolarHBondContact O-N 2.83Å; D452-S456 PolarHBondContact O-N 3.44Å; D452-S456 PolarHBondContact O-OG 2.88Å |
| 453 | E | 95.3 | Very high | 93.4 | Very high | 46 Ų | 46 | 65.9 Ų | 65.9 | 22% | 0.215 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -63.6 | -41.6 | 175.2 | -172 | 177.5 | -172.9 | 0 | 0 | 111.3 | E449 W451 L455 S456 K457 V462 R464 | E449-E453 WeakPolarHBondContact O-CB 3.35Å; E449-E453 PolarHBondContact O-N 3.45Å; W451-E453 PolarHBondContact O-N 3.1Å; E453-L455 VanDerWaalsContact C-N 3.32Å; E453-L455 PolarHBondContact O-N 2.87Å; E453-S456 WeakPolarHBondContact CA-OG 3.29Å; E453-S456 PolarHBondContact O-N 2.86Å; E453-S456 PolarHBondContact O-OG 2.91Å; E453-K457 HydrophobicContact CG-CD 4.08Å; E453-K457 PolarHBondContact O-N 2.83Å; E453-K457 VanDerWaalsContact O-N 3.12Å; E453-K457 IonicContact OE1-NZ 3.34Å; E453-K457 PolarHBondContact OE1-NZ 2.77Å; E453-V462 HydrophobicContact CB-CG1 4.11Å; E453-V462 VanDerWaalsContact CD-CG1 3.46Å; E453-V462 HydrophobicContact CG-CG1 3.76Å; E453-V462 HydrophobicContact CG-CG2 3.99Å; E453-V462 WeakPolarHBondContact OE2-CG1 3.42Å; E453-R464 IonicContact OE2-CZ 2.73Å; E453-R464 IonicContact OE2-NE 2.67Å; E453-R464 PolarHBondContact OE2-NE 3.06Å; E453-R464 VanDerWaalsContact OE2-NE 3.1Å; E453-R464 IonicContact OE2-NH2 3.57Å; E453-R464 PolarHBondContact OE2-NH2 2.91Å |
| 454 | M | 95.7 | Very high | 93.6 | Very high | 0 Ų | 0 | 68.5 Ų | 68.5 | 0% | 0 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -57.5 | -43.3 | 173.8 | 171.9 | -159.2 | 66.7 | 0 | 0 | 111.7 | L339 L348 H450 W451 D452 K457 | L339-M454 HydrophobicContact CB-CB 4.01Å; L339-M454 HydrophobicContact CB-CG 3.89Å; L339-M454 HydrophobicContact CB-SD 3.65Å; L339-M454 HydrophobicContact CD1-SD 4.3Å; L339-M454 HydrophobicContact CG-SD 4.46Å; L348-M454 HydrophobicContact CD1-CE 4.03Å; L348-M454 HydrophobicContact CD1-SD 3.35Å; L348-M454 WeakPolarHBondContact CD1-SD 3.34Å; H450-M454 WeakPolarHBondContact O-CB 3.3Å; H450-M454 PolarHBondContact O-N 2.92Å; H450-M454 VanDerWaalsContact O-N 3.16Å; W451-M454 HydrophobicContact CD2-CE 3.84Å; W451-M454 HydrophobicContact CE3-CE 3.88Å; W451-M454 HydrophobicContact CG-CE 4.41Å; W451-M454 HydrophobicContact CH2-CE 4.31Å; W451-M454 HydrophobicContact CZ2-CE 4.26Å; W451-M454 HydrophobicContact CZ3-CE 4.13Å; W451-M454 WeakPolarHBondContact O-CB 3.48Å; W451-M454 PolarHBondContact O-N 3.38Å; D452-M454 PolarHBondContact O-N 2.85Å; M454-K457 CarbonylContact O-C 3.55Å; M454-K457 PolarHBondContact O-N 3.24Å |
| 455 | L | 93.4 | Very high | 93.7 | Very high | 62 Ų | 62 | 62.5 Ų | 62.5 | 33% | 0.325 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -70.7 | -35.5 | 179.2 | -65.4 | 175.9 | 0 | 0 | 0 | 112.2 | Y341 L411 W451 D452 E453 K457 | Y341-L455 HydrophobicContact CD1-CD2 4.41Å; L411-L455 HydrophobicContact CD1-CD2 3.62Å; W451-L455 WeakPolarHBondContact O-CG 3.45Å; W451-L455 PolarHBondContact O-N 3.04Å; W451-L455 VanDerWaalsContact O-N 3.1Å; D452-L455 PolarHBondContact O-N 2.83Å; E453-L455 VanDerWaalsContact C-N 3.32Å; E453-L455 PolarHBondContact O-N 2.87Å; L455-K457 VanDerWaalsContact C-N 3.27Å; L455-K457 PolarHBondContact O-N 3.29Å |
| 456 | S | 94.1 | Very high | 93.7 | Very high | 83 Ų | 83 | 60.4 Ų | 60.4 | 58% | 0.58 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -70.8 | -20.3 | 177 | 71.6 | 0 | 0 | 0 | 0 | 114.3 | D452 E453 P458 | D452-S456 PolarHBondContact O-N 3.44Å; D452-S456 PolarHBondContact O-OG 2.88Å; E453-S456 WeakPolarHBondContact CA-OG 3.29Å; E453-S456 PolarHBondContact O-N 2.86Å; E453-S456 PolarHBondContact O-OG 2.91Å; S456-P458 VanDerWaalsContact C-CD 3.48Å; S456-P458 WeakPolarHBondContact O-CD 3.46Å |
| 457 | K | 91.9 | Very high | 93.8 | Very high | 78 Ų | 78 | 55.9 Ų | 55.9 | 34% | 0.339 | 28% | 0.276 | S | S | . | . | S | Bend | trans | -122.8 | 67.4 | -177.4 | -63.1 | 175.6 | 179.9 | 176.3 | 0 | 111.2 | E453 M454 L455 K459 E460 V462 | E453-K457 HydrophobicContact CG-CD 4.08Å; E453-K457 PolarHBondContact O-N 2.83Å; E453-K457 VanDerWaalsContact O-N 3.12Å; E453-K457 IonicContact OE1-NZ 3.34Å; E453-K457 PolarHBondContact OE1-NZ 2.77Å; M454-K457 CarbonylContact O-C 3.55Å; M454-K457 PolarHBondContact O-N 3.24Å; L455-K457 VanDerWaalsContact C-N 3.27Å; L455-K457 PolarHBondContact O-N 3.29Å; K457-K459 PolarHBondContact O-N 2.8Å; K457-E460 HydrophobicContact CB-CB 4.1Å; K457-E460 HydrophobicContact CB-CG 4.41Å; K457-E460 PolarHBondContact O-N 2.86Å; K457-V462 HydrophobicContact CB-CG2 4.46Å; K457-V462 HydrophobicContact CD-CG2 4.35Å |
| 458 | P | 86.4 | Confident | 93.7 | Very high | 66 Ų | 66 | 54.2 Ų | 54.2 | 43% | 0.429 | 27% | 0.269 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.5 | 140.3 | -176.8 | 25.9 | -35.1 | 0 | 0 | 0 | 111.2 | S456 E460 | S456-P458 VanDerWaalsContact C-CD 3.48Å; S456-P458 WeakPolarHBondContact O-CD 3.46Å; P458-E460 PolarHBondContact O-N 2.87Å |
| 459 | K | 85.6 | Confident | 93.4 | Very high | 125 Ų | 125 | 56.5 Ų | 56.5 | 54% | 0.543 | 29% | 0.286 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 68.2 | -8.5 | -175.7 | -48.2 | 168.9 | -174.1 | 170.7 | 0 | 116.2 | Y341 N342 K457 | Y341-K459 PolarHBondContact O-N 2.81Å; N342-K459 HydrophobicContact CB-CG 4.42Å; K457-K459 PolarHBondContact O-N 2.8Å |
| 460 | E | 91.4 | Very high | 92.6 | Very high | 116 Ų | 116 | 61 Ų | 61 | 54% | 0.542 | 30% | 0.299 | S | S | . | . | S | Bend | trans | -84 | 154 | 171.1 | -64.1 | -170.8 | 179.6 | 0 | 0 | 111.6 | S340 K457 P458 | S340-E460 WeakPolarHBondContact CA-O 3.25Å; S340-E460 WeakPolarHBondContact CB-O 3.37Å; S340-E460 PolarHBondContact OG-O 2.75Å; K457-E460 HydrophobicContact CB-CB 4.1Å; K457-E460 HydrophobicContact CB-CG 4.41Å; K457-E460 PolarHBondContact O-N 2.86Å; P458-E460 PolarHBondContact O-N 2.87Å |
| 461 | L | 93.2 | Very high | 91.1 | Very high | 97 Ų | 97 | 63.3 Ų | 63.3 | 51% | 0.508 | 31% | 0.313 | S | S | . | . | trans | -98.5 | 94.8 | 176.5 | -81.4 | 164.6 | 0 | 0 | 0 | 110.5 | C338 V351 K463 | C338-L461 HydrophobicContact CB-CB 4.2Å; C338-L461 HydrophobicContact CB-CD2 3.79Å; V351-L461 HydrophobicContact CG2-CD2 3.69Å; L461-K463 PolarHBondContact O-N 3.28Å | ||
| 462 | V | 95.1 | Very high | 88.6 | Confident | 9 Ų | 9 | 68.8 Ų | 68.8 | 6% | 0.055 | 35% | 0.347 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -74 | 116.6 | 177 | -176 | 0 | 0 | 0 | 0 | 109.5 | C338 L339 H450 E453 K457 R464 | C338-V462 CarbonylContact C-O 3.45Å; C338-V462 WeakPolarHBondContact CA-O 3.27Å; L339-V462 PolarHBondContact N-O 2.95Å; L339-V462 PolarHBondContact O-N 3.05Å; H450-V462 WeakPolarHBondContact NE2-CB 3.42Å; H450-V462 PolarHBondContact NE2-O 3.19Å; E453-V462 HydrophobicContact CB-CG1 4.11Å; E453-V462 VanDerWaalsContact CD-CG1 3.46Å; E453-V462 HydrophobicContact CG-CG1 3.76Å; E453-V462 HydrophobicContact CG-CG2 3.99Å; E453-V462 WeakPolarHBondContact OE2-CG1 3.42Å; K457-V462 HydrophobicContact CB-CG2 4.46Å; K457-V462 HydrophobicContact CD-CG2 4.35Å; V462-R464 HydrophobicContact CG1-CG 4.45Å |
| 463 | K | 94.1 | Very high | 85.7 | Confident | 102 Ų | 102 | 73.5 Ų | 73.5 | 44% | 0.443 | 37% | 0.367 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.2 | 117.9 | -176.6 | -176.9 | 171.7 | 69.5 | 177.9 | 0 | 111.3 | E322 Q336 L353 L461 | E322-K463 IonicContact OE1-NZ 3.71Å; E322-K463 PolarHBondContact OE1-NZ 3.05Å; Q336-K463 HydrophobicContact CG-CG 4.32Å; L353-K463 HydrophobicContact CD1-CD 3.52Å; L353-K463 HydrophobicContact CD1-CG 3.86Å; L461-K463 PolarHBondContact O-N 3.28Å |
| 464 | R | 94.1 | Very high | 82.7 | Confident | 67 Ų | 67 | 80.9 Ų | 80.9 | 25% | 0.253 | 42% | 0.418 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -131 | 156 | 175.9 | -65.1 | -81 | -167.5 | 122.3 | -4.5 | 111.4 | Q336 F337 E449 H450 E453 V462 H466 | Q336-R464 WeakPolarHBondContact CA-O 3.46Å; Q336-R464 WeakPolarHBondContact CG-O 3.44Å; F337-R464 PolarHBondContact N-O 2.96Å; F337-R464 PolarHBondContact O-N 2.96Å; E449-R464 IonicContact OE2-CZ 3.71Å; E449-R464 IonicContact OE2-NH1 3.8Å; E449-R464 PolarHBondContact OE2-NH1 2.94Å; E449-R464 IonicContact OE2-NH2 3.61Å; H450-R464 HydrophobicContact CB-CB 4.45Å; H450-R464 HydrophobicContact CB-CG 3.96Å; H450-R464 VanDerWaalsContact CD2-CG 3.44Å; H450-R464 WeakPolarHBondContact CD2-CG 3.36Å; E453-R464 IonicContact OE2-CZ 2.73Å; E453-R464 IonicContact OE2-NE 2.67Å; E453-R464 PolarHBondContact OE2-NE 3.06Å; E453-R464 VanDerWaalsContact OE2-NE 3.1Å; E453-R464 IonicContact OE2-NH2 3.57Å; E453-R464 PolarHBondContact OE2-NH2 2.91Å; V462-R464 HydrophobicContact CG1-CG 4.45Å; R464-H466 WeakPolarHBondContact CB-NE2 3.38Å |
| 465 | W | 94.1 | Very high | 82 | Confident | 68 Ų | 68 | 84.9 Ų | 84.9 | 26% | 0.258 | 44% | 0.439 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.6 | 140.6 | 164.2 | -78.3 | 102.4 | 0 | 0 | 0 | 108.9 | D334 Q336 R354 K356 | D334-W465 HydrophobicContact CB-CE3 3.73Å; D334-W465 HydrophobicContact CB-CZ3 4.14Å; Q336-W465 HydrophobicContact CB-CD2 3.64Å; Q336-W465 HydrophobicContact CB-CE3 3.58Å; Q336-W465 HydrophobicContact CB-CG 4.32Å; Q336-W465 HydrophobicContact CB-CH2 3.93Å; Q336-W465 HydrophobicContact CB-CZ2 3.99Å; Q336-W465 HydrophobicContact CB-CZ3 3.71Å; Q336-W465 VanDerWaalsContact CD-CE2 3.44Å; Q336-W465 HydrophobicContact CG-CD2 3.74Å; Q336-W465 HydrophobicContact CG-CE3 4.22Å; Q336-W465 HydrophobicContact CG-CG 3.98Å; Q336-W465 HydrophobicContact CG-CZ2 4.26Å; R354-W465 HydrophobicContact CG-CH2 3.88Å; R354-W465 HydrophobicContact CG-CZ2 4.39Å; K356-W465 HydrophobicContact CB-CH2 4.05Å; K356-W465 HydrophobicContact CB-CZ3 4.18Å; K356-W465 HydrophobicContact CD-CH2 3.97Å; K356-W465 HydrophobicContact CD-CZ2 4.4Å; K356-W465 HydrophobicContact CD-CZ3 4.07Å; K356-W465 HydrophobicContact CG-CE3 4.39Å; K356-W465 HydrophobicContact CG-CH2 3.82Å; K356-W465 HydrophobicContact CG-CZ3 3.64Å |
| 466 | H | 95.1 | Very high | 81.4 | Confident | 0 Ų | 0 | 86.1 Ų | 86.1 | 0% | 0 | 45% | 0.445 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.8 | 141.5 | 175.4 | -65 | -85.3 | 0 | 0 | 0 | 111.2 | D334 L335 F337 V435 R446 E447 H450 R464 | D334-H466 CarbonylContact C-O 3.57Å; D334-H466 VanDerWaalsContact CA-O 3.27Å; D334-H466 WeakPolarHBondContact CA-O 3.14Å; L335-H466 PolarHBondContact N-O 3.48Å; L335-H466 PolarHBondContact O-N 2.85Å; F337-H466 HydrophobicContact CE1-CB 4.27Å; F337-H466 AromaticContact CE1-CD2 3.28Å; F337-H466 WeakPolarHBondContact CE1-CD2 3.21Å; F337-H466 AromaticContact CZ-CD2 3.42Å; F337-H466 VanDerWaalsContact CZ-CD2 3.42Å; F337-H466 WeakPolarHBondContact CZ-CD2 3.37Å; F337-H466 AromaticContact CZ-NE2 3.77Å; V435-H466 HydrophobicContact CB-CB 4.32Å; V435-H466 HydrophobicContact CG2-CB 3.71Å; R446-H466 PolarHBondContact O-CE1 3.27Å; E447-H466 IonicContact OE1-ND1 2.69Å; H450-H466 AromaticContact CG-NE2 3.6Å; H450-H466 AromaticContact ND1-CD2 3.83Å; H450-H466 AromaticContact ND1-CE1 3.76Å; H450-H466 AromaticContact ND1-NE2 2.87Å; H450-H466 PolarHBondContact ND1-NE2 2.88Å; R464-H466 WeakPolarHBondContact CB-NE2 3.38Å |
| 467 | A | 93.8 | Very high | 80.7 | Confident | 17 Ų | 17 | 86.3 Ų | 86.3 | 14% | 0.14 | 44% | 0.438 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -72 | 135.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | S330 D334 C469 | S330-A467 VanDerWaalsContact OG-CB 3.27Å; S330-A467 WeakPolarHBondContact OG-CB 3.46Å; D334-A467 WeakPolarHBondContact OD1-CA 3.5Å; A467-C469 PolarHBondContact O-N 3.42Å |
| 468 | L | 94.2 | Very high | 80 | Confident | 5 Ų | 5 | 86.8 Ų | 86.8 | 3% | 0.026 | 44% | 0.444 | C | S | . | . | P | Polyproline II helix | trans | -78.4 | 126.1 | 173.4 | -67.3 | 169.1 | 0 | 0 | 0 | 109.3 | F332 G333 L335 L358 V420 V435 | F332-L468 HydrophobicContact CB-CB 4Å; F332-L468 WeakPolarHBondContact CD2-O 3.37Å; F332-L468 WeakPolarHBondContact O-CD1 3.47Å; G333-L468 WeakPolarHBondContact O-CB 3.18Å; G333-L468 PolarHBondContact O-N 3.01Å; L335-L468 HydrophobicContact CB-CD2 4Å; L335-L468 HydrophobicContact CB-CG 4.33Å; L358-L468 HydrophobicContact CD2-CD1 3.44Å; L358-L468 VanDerWaalsContact CD2-CD1 3.44Å; V420-L468 HydrophobicContact CB-CD1 4.3Å; V420-L468 HydrophobicContact CG2-CD1 3.67Å; V420-L468 HydrophobicContact CG2-CD2 3.81Å; V420-L468 HydrophobicContact CG2-CG 4.43Å; V435-L468 HydrophobicContact CG1-CD2 4.46Å |
| 469 | C | 88.4 | Confident | 79.6 | Confident | 74 Ų | 74 | 88.1 Ų | 88.1 | 50% | 0.5 | 45% | 0.445 | S | S | . | . | B | Isolated β-bridge | trans | -96 | 153 | 175.8 | -63.9 | 0 | 0 | 0 | 0 | 111.1 | G433 R434 A467 | G433-C469 WeakPolarHBondContact CA-O 3.28Å; R434-C469 PolarHBondContact N-O 3.11Å; R434-C469 PolarHBondContact O-N 3.18Å; A467-C469 PolarHBondContact O-N 3.42Å |
| 470 | R | 80.6 | Confident | 79.2 | Confident | 186 Ų | 186 | 85.6 Ų | 85.6 | 70% | 0.702 | 44% | 0.438 | S | S | * | . | P | Polyproline II helix | trans | -62.9 | 138 | 169.2 | -119.4 | 175.1 | 175.2 | -171 | -5.2 | 110.3 | F332 T472 | F332-R470 HydrophobicContact CD1-CG 4.45Å; F332-R470 HydrophobicContact CE1-CG 3.82Å; F332-R470 HydrophobicContact CE2-CB 4.22Å; F332-R470 HydrophobicContact CE2-CG 3.99Å; F332-R470 HydrophobicContact CZ-CB 4.3Å; F332-R470 HydrophobicContact CZ-CG 3.58Å; R470-T472 PolarHBondContact O-N 3.15Å; R470-T472 VanDerWaalsContact O-N 3.15Å |
| 471 | T | 65.1 | Low | 78.4 | Confident | 49 Ų | 49 | 83.4 Ų | 83.4 | 30% | 0.301 | 43% | 0.431 | S | S | . | . | trans | -68.6 | 104.8 | 160.3 | -3.4 | 0 | 0 | 0 | 0 | 108.4 | Q431 R434 | Q431-T471 PolarHBondContact NE2-OG1 3.22Å; R434-T471 VanDerWaalsContact CZ-CG2 3.43Å | ||
| 472 | T | 44.6 | Very low | 77.2 | Confident | 116 Ų | 116 | 82.4 Ų | 82.4 | 71% | 0.712 | 43% | 0.425 | S | S | * | . | trans | -69.4 | 122.7 | 137.5 | 31.1 | 0 | 0 | 0 | 0 | 107 | R470 | R470-T472 PolarHBondContact O-N 3.15Å; R470-T472 VanDerWaalsContact O-N 3.15Å | ||
| 473 | E | 33 | Very low | 75.8 | Confident | 178 Ų | 178 | 88.5 Ų | 88.5 | 83% | 0.832 | 46% | 0.455 | S | S | * | . | trans | -68.7 | 140.8 | 149.2 | -68.4 | -173.6 | 124.3 | 0 | 0 | 107.3 | ||||
| 474 | P | 32.2 | Very low | 74.1 | Confident | 200 Ų | 200 | 87.3 Ų | 87.3 | 100% | 1.299 | 46% | 0.457 | S | S | * | . | trans | -72.8 | 0 | 171.9 | 32.7 | -34.7 | 0 | 0 | 0 | 112.1 |
Retrieved 474 of 474 residues in 313.9 ms
(Link to these results)