| 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 | 42.3 | Very low | 55.7 | Low | 254 Ų | 254 | 137.4 Ų | 137.4 | 100% | 1.251 | 81% | 0.812 | S | S | * | * | 0 | 143.7 | 0 | -70.1 | 175.4 | 170.4 | 0 | 0 | 107.8 | |||||
| 2 | A | 47.6 | Very low | 55.3 | Low | 99 Ų | 99 | 141.6 Ų | 141.6 | 82% | 0.818 | 82% | 0.822 | S | S | * | * | trans | -120.4 | 141.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 3 | S | 53.7 | Low | 54.4 | Low | 112 Ų | 112 | 143.6 Ų | 143.6 | 78% | 0.783 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 142 | 175.1 | -174.6 | 0 | 0 | 0 | 0 | 110.2 | ||
| 4 | P | 58.7 | Low | 53.3 | Low | 111 Ų | 111 | 149 Ų | 149 | 72% | 0.721 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 153.7 | 166.4 | 29.5 | -34.9 | 0 | 0 | 0 | 111 | ||
| 5 | F | 61.3 | Low | 52.7 | Low | 186 Ų | 186 | 145.3 Ų | 145.3 | 82% | 0.816 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -99.1 | 136.5 | 178.6 | -178.9 | -92.1 | 0 | 0 | 0 | 110 | ||
| 6 | V | 58.9 | Low | 52 | Low | 120 Ų | 120 | 144.6 Ų | 144.6 | 73% | 0.727 | 82% | 0.816 | S | S | * | * | trans | -113.1 | 118.5 | -179 | -176.9 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 7 | P | 64.3 | Low | 51.4 | Low | 103 Ų | 103 | 142.9 Ų | 142.9 | 67% | 0.669 | 82% | 0.816 | S | S | * | * | trans | -72.1 | 146.1 | 176.5 | -17.1 | 31.5 | 0 | 0 | 0 | 112.8 | ||||
| 8 | V | 56.8 | Low | 50.6 | Low | 128 Ų | 128 | 139.1 Ų | 139.1 | 78% | 0.776 | 81% | 0.813 | S | S | * | * | trans | -107.8 | 134 | 172.3 | -178.3 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 9 | P | 59.8 | Low | 49.7 | Very low | 122 Ų | 122 | 136.3 Ų | 136.3 | 79% | 0.792 | 82% | 0.817 | S | S | * | * | trans | -68.1 | 149.3 | 178.2 | -20.2 | 33.1 | 0 | 0 | 0 | 113.8 | ||||
| 10 | I | 58.8 | Low | 49.3 | Very low | 154 Ų | 154 | 141.6 Ų | 141.6 | 79% | 0.79 | 82% | 0.821 | S | S | * | * | trans | -117.2 | 136.2 | 172.3 | -61.2 | 178 | 0 | 0 | 0 | 108.9 | ||||
| 11 | P | 50.5 | Low | 48.7 | Very low | 122 Ų | 122 | 142.4 Ų | 142.4 | 79% | 0.792 | 82% | 0.822 | S | S | * | * | trans | -73.2 | 135.5 | 178.5 | -12.8 | 28.1 | 0 | 0 | 0 | 112.5 | ||||
| 12 | M | 50.4 | Low | 48.4 | Very low | 188 Ų | 188 | 141.5 Ų | 141.5 | 93% | 0.926 | 81% | 0.805 | S | S | * | * | trans | -99.9 | 111.4 | 170.3 | -76.4 | -168.1 | 173.4 | 0 | 0 | 111.8 | ||||
| 13 | N | 43.7 | Very low | 48.1 | Very low | 168 Ų | 168 | 145.7 Ų | 145.7 | 90% | 0.898 | 80% | 0.799 | S | S | * | * | trans | -82 | 119 | 162.1 | -81.3 | -31.1 | 0 | 0 | 0 | 109.6 | ||||
| 14 | R | 40.2 | Very low | 47.7 | Very low | 219 Ų | 219 | 146.4 Ų | 146.4 | 83% | 0.826 | 80% | 0.801 | S | S | * | * | trans | -105.5 | 90.5 | 179.1 | -169.5 | 178.4 | -174.5 | 174.5 | 2.2 | 111.9 | L16 | R14-L16 HydrophobicContact CG-CG 4.44Š| ||
| 15 | A | 43.8 | Very low | 47.1 | Very low | 93 Ų | 93 | 148.1 Ų | 148.1 | 77% | 0.769 | 80% | 0.799 | S | S | * | * | trans | -83.8 | 139.5 | 159.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 16 | L | 41.4 | Very low | 45.8 | Very low | 134 Ų | 134 | 151.3 Ų | 151.3 | 70% | 0.702 | 81% | 0.806 | S | S | * | * | trans | -137.6 | 112.2 | 166.6 | -78.9 | 179.3 | 0 | 0 | 0 | 111.2 | R14 | R14-L16 HydrophobicContact CG-CG 4.44Š| ||
| 17 | S | 40.9 | Very low | 44.8 | Very low | 117 Ų | 117 | 150.1 Ų | 150.1 | 82% | 0.818 | 81% | 0.809 | S | S | * | * | trans | -66.6 | 152.8 | 151.3 | -157.4 | 0 | 0 | 0 | 0 | 108 | ||||
| 18 | G | 37.5 | Very low | 43.4 | Very low | 74 Ų | 74 | 150.2 Ų | 150.2 | 76% | 0.763 | 82% | 0.819 | S | S | * | * | cis | 126.3 | 93.2 | 12.3 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 19 | G | 33.8 | Very low | 42.6 | Very low | 85 Ų | 85 | 149.7 Ų | 149.7 | 88% | 0.876 | 82% | 0.82 | S | S | * | * | trans | -122.4 | 132.2 | -177.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 20 | R | 42.6 | Very low | 41.7 | Very low | 242 Ų | 242 | 152.4 Ų | 152.4 | 91% | 0.913 | 83% | 0.828 | S | S | * | * | trans | -94.4 | 158.6 | 178.9 | -61 | -179.8 | 174.6 | -155.3 | -2.1 | 110.8 | ||||
| 21 | L | 35.8 | Very low | 40.5 | Very low | 160 Ų | 160 | 148.3 Ų | 148.3 | 84% | 0.838 | 82% | 0.823 | S | S | * | * | -169.5 | 144.6 | 120.2 | -102 | 163.1 | 0 | 0 | 0 | 114.4 | |||||
| 22 | R | 36.7 | Very low | 39.8 | Very low | 234 Ų | 234 | 148.3 Ų | 148.3 | 88% | 0.883 | 83% | 0.826 | S | S | * | * | trans | 65.3 | 119.2 | 160 | -61.9 | -164.2 | 170.3 | -163 | -4.5 | 122.2 | ||||
| 23 | R | 39.7 | Very low | 39.2 | Very low | 188 Ų | 188 | 146.6 Ų | 146.6 | 71% | 0.709 | 83% | 0.826 | S | S | * | * | trans | -77.4 | 163.8 | 154 | -148 | -173.5 | -166.4 | -164.3 | 1.4 | 109.4 | Q25 | R23-Q25 VanDerWaalsContact CZ-CD 3.44Š| ||
| 24 | P | 47.3 | Very low | 38.8 | Very low | 126 Ų | 126 | 144.3 Ų | 144.3 | 82% | 0.818 | 82% | 0.823 | S | S | * | * | -138.7 | 176.2 | 97 | 38.6 | -27.3 | 0 | 0 | 0 | 114.1 | |||||
| 25 | Q | 45.4 | Very low | 38.6 | Very low | 147 Ų | 147 | 140.1 Ų | 140.1 | 69% | 0.687 | 83% | 0.827 | S | S | * | * | trans | -111.1 | 146.7 | 170.7 | -67 | 177.8 | -92.6 | 0 | 0 | 110.8 | R23 | R23-Q25 VanDerWaalsContact CZ-CD 3.44Š| ||
| 26 | R | 34.6 | Very low | 38 | Very low | 253 Ų | 253 | 138.9 Ų | 138.9 | 96% | 0.955 | 82% | 0.824 | S | S | * | * | trans | -155.3 | 166.7 | 133.3 | -145.4 | 170 | 177.7 | 109.8 | -0.6 | 109.7 | ||||
| 27 | A | 37.3 | Very low | 37.6 | Very low | 96 Ų | 96 | 138.7 Ų | 138.7 | 79% | 0.793 | 83% | 0.833 | S | S | * | * | trans | -133.4 | 152.8 | -178 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 28 | A | 33.7 | Very low | 37.4 | Very low | 105 Ų | 105 | 141.7 Ų | 141.7 | 87% | 0.868 | 84% | 0.835 | S | S | * | * | trans | -168.2 | 154.7 | 154.6 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 29 | S | 41.4 | Very low | 37.2 | Very low | 116 Ų | 116 | 143.7 Ų | 143.7 | 81% | 0.811 | 84% | 0.837 | S | S | * | * | trans | -91.8 | 171.7 | 175.5 | -42.6 | 0 | 0 | 0 | 0 | 112 | ||||
| 30 | L | 41.1 | Very low | 37.2 | Very low | 180 Ų | 180 | 145.1 Ų | 145.1 | 94% | 0.942 | 83% | 0.833 | S | S | * | * | trans | 173 | 142.9 | 135 | -95.4 | 168.4 | 0 | 0 | 0 | 112.2 | ||||
| 31 | G | 32.6 | Very low | 36.9 | Very low | 68 Ų | 68 | 139 Ų | 139 | 70% | 0.701 | 83% | 0.828 | S | S | * | * | trans | 67.9 | 125.4 | 166.2 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 32 | S | 36.7 | Very low | 37.3 | Very low | 122 Ų | 122 | 137.5 Ų | 137.5 | 85% | 0.853 | 83% | 0.827 | S | S | * | * | cis | 69.8 | 99.2 | 17.8 | -49.7 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 33 | V | 38 | Very low | 37.2 | Very low | 152 Ų | 152 | 133.6 Ų | 133.6 | 92% | 0.921 | 82% | 0.823 | S | S | * | * | -155 | 152.1 | 125.7 | -92.7 | 0 | 0 | 0 | 0 | 109.3 | |||||
| 34 | S | 35 | Very low | 36.9 | Very low | 119 Ų | 119 | 131.6 Ų | 131.6 | 83% | 0.832 | 83% | 0.831 | S | S | * | * | trans | -112.8 | 149.4 | 178.5 | -53.8 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 35 | S | 35.3 | Very low | 36.3 | Very low | 132 Ų | 132 | 137 Ų | 137 | 92% | 0.923 | 84% | 0.836 | S | S | * | * | trans | -143.8 | 104.9 | 153.8 | -78.9 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 36 | G | 31.3 | Very low | 35.7 | Very low | 67 Ų | 67 | 135.6 Ų | 135.6 | 69% | 0.691 | 84% | 0.841 | S | S | * | * | trans | -99.8 | 157.7 | 165.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 37 | S | 34.2 | Very low | 35.7 | Very low | 129 Ų | 129 | 128.1 Ų | 128.1 | 90% | 0.902 | 83% | 0.834 | S | S | * | * | trans | -150.7 | 144.9 | 160.4 | -84.4 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 38 | E | 36 | Very low | 35.6 | Very low | 181 Ų | 181 | 127.2 Ų | 127.2 | 85% | 0.846 | 83% | 0.834 | S | S | * | * | trans | -134.8 | 134.9 | -156.3 | -21.5 | -176.6 | 125.7 | 0 | 0 | 111.1 | ||||
| 39 | S | 32.6 | Very low | 35.7 | Very low | 115 Ų | 115 | 129.6 Ų | 129.6 | 80% | 0.804 | 83% | 0.832 | S | S | * | * | trans | -170.7 | 112.9 | 154.4 | 25.8 | 0 | 0 | 0 | 0 | 108 | ||||
| 40 | S | 33.5 | Very low | 35.6 | Very low | 115 Ų | 115 | 129.6 Ų | 129.6 | 80% | 0.804 | 82% | 0.819 | S | S | * | * | 80.1 | 86.7 | 58.2 | -62.5 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 41 | S | 37.3 | Very low | 35.2 | Very low | 114 Ų | 114 | 131.3 Ų | 131.3 | 80% | 0.797 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 149.1 | 168 | -36.9 | 0 | 0 | 0 | 0 | 111.9 | ||
| 42 | P | 43.8 | Very low | 35.1 | Very low | 128 Ų | 128 | 131.5 Ų | 131.5 | 83% | 0.831 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -85.4 | 152.1 | 157.1 | 33.6 | -31 | 0 | 0 | 0 | 111.6 | ||
| 43 | I | 35.1 | Very low | 35.1 | Very low | 153 Ų | 153 | 137.2 Ų | 137.2 | 79% | 0.785 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -89.1 | 138.8 | 178.8 | -67.4 | 162 | 0 | 0 | 0 | 110.3 | ||
| 44 | T | 32.7 | Very low | 34.8 | Very low | 145 Ų | 145 | 136.6 Ų | 136.6 | 89% | 0.89 | 82% | 0.815 | S | S | * | * | trans | -132.3 | 132.1 | 144 | 53.3 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 45 | R | 35.4 | Very low | 34.6 | Very low | 241 Ų | 241 | 134.6 Ų | 134.6 | 91% | 0.909 | 81% | 0.813 | S | S | * | * | trans | -134 | 131.2 | 166.5 | -91.1 | -172.7 | 169.8 | -166.1 | -2 | 107.7 | ||||
| 46 | S | 31.8 | Very low | 34.3 | Very low | 116 Ų | 116 | 132.5 Ų | 132.5 | 81% | 0.811 | 81% | 0.812 | S | S | * | * | trans | -138.6 | 103.8 | 158.5 | -163.7 | 0 | 0 | 0 | 0 | 104.7 | ||||
| 47 | A | 34.6 | Very low | 34.3 | Very low | 96 Ų | 96 | 132.6 Ų | 132.6 | 79% | 0.793 | 81% | 0.813 | S | S | * | * | 69.9 | 105.3 | 72.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 48 | G | 35.8 | Very low | 34.4 | Very low | 78 Ų | 78 | 133.1 Ų | 133.1 | 80% | 0.804 | 82% | 0.817 | S | S | * | * | trans | -145.5 | 101.5 | 179.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 49 | D | 35.9 | Very low | 34.1 | Very low | 154 Ų | 154 | 127.5 Ų | 127.5 | 82% | 0.824 | 81% | 0.808 | S | S | * | * | trans | -79.4 | 162.6 | 171.4 | -89.4 | -8.4 | 0 | 0 | 0 | 110.6 | ||||
| 50 | E | 38 | Very low | 34.3 | Very low | 116 Ų | 116 | 127.8 Ų | 127.8 | 54% | 0.542 | 81% | 0.81 | S | S | . | * | cis | -158.4 | 156.1 | -5 | -102.6 | -123.3 | 113.6 | 0 | 0 | 111.1 | ||||
| 51 | R | 34.2 | Very low | 34.4 | Very low | 217 Ų | 217 | 129.6 Ų | 129.6 | 82% | 0.819 | 81% | 0.805 | S | S | * | * | trans | 46.7 | 131.5 | 146.4 | -64.7 | 179.3 | -168.7 | 156.8 | 29.1 | 124.7 | ||||
| 52 | G | 29.6 | Very low | 34.2 | Very low | 71 Ų | 71 | 132.6 Ų | 132.6 | 73% | 0.732 | 80% | 0.799 | S | S | * | * | trans | 162 | 100.9 | 147.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 53 | R | 37.4 | Very low | 33.7 | Very low | 242 Ų | 242 | 133 Ų | 133 | 91% | 0.913 | 79% | 0.79 | S | S | * | * | 42.5 | 123.6 | 76.1 | -70.8 | -167.9 | 177.1 | -146 | 2.2 | 113 | |||||
| 54 | T | 32 | Very low | 33.8 | Very low | 140 Ų | 140 | 130.3 Ų | 130.3 | 86% | 0.859 | 79% | 0.785 | S | S | * | * | cis | -162.3 | 168.4 | 5.1 | 18.6 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 55 | G | 29.8 | Very low | 33.8 | Very low | 76 Ų | 76 | 135 Ų | 135 | 78% | 0.784 | 79% | 0.786 | S | S | * | * | cis | 145.1 | 135.7 | 0.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 56 | G | 30.3 | Very low | 34 | Very low | 88 Ų | 88 | 129.6 Ų | 129.6 | 91% | 0.907 | 78% | 0.784 | S | S | * | * | trans | 105.1 | 160.8 | -171 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 57 | G | 29.7 | Very low | 34.9 | Very low | 70 Ų | 70 | 130.2 Ų | 130.2 | 72% | 0.722 | 79% | 0.785 | S | S | * | * | cis | 167.4 | 144 | -6.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 58 | S | 37 | Very low | 35 | Very low | 139 Ų | 139 | 132.9 Ų | 132.9 | 97% | 0.972 | 79% | 0.786 | S | S | * | * | trans | 64.9 | 160.5 | -178.5 | -61.3 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 59 | G | 29.8 | Very low | 35 | Very low | 64 Ų | 64 | 140.2 Ų | 140.2 | 66% | 0.66 | 79% | 0.789 | S | S | * | * | cis | 154.1 | 147.6 | -9.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 60 | S | 36.8 | Very low | 35 | Very low | 121 Ų | 121 | 136.4 Ų | 136.4 | 85% | 0.846 | 78% | 0.78 | S | S | * | * | trans | 71.3 | 138.7 | -177.1 | -59.1 | 0 | 0 | 0 | 0 | 116 | ||||
| 61 | Q | 35 | Very low | 34.8 | Very low | 152 Ų | 152 | 137.4 Ų | 137.4 | 71% | 0.71 | 79% | 0.788 | S | S | * | * | cis | 107.1 | 138.1 | 15.3 | -167.3 | -160.2 | 99.2 | 0 | 0 | 113.5 | ||||
| 62 | R | 34.3 | Very low | 35.1 | Very low | 177 Ų | 177 | 138.8 Ų | 138.8 | 67% | 0.668 | 79% | 0.794 | S | S | * | * | trans | 102.1 | 112.7 | 168.6 | -60.6 | -162.8 | 172.3 | -116.4 | 5.4 | 115.3 | ||||
| 63 | Q | 33.3 | Very low | 35.3 | Very low | 138 Ų | 138 | 140.4 Ų | 140.4 | 65% | 0.645 | 79% | 0.794 | S | S | * | * | 70.3 | 107.2 | 89.1 | -67.7 | 164.6 | 4.2 | 0 | 0 | 111.7 | |||||
| 64 | S | 35.6 | Very low | 35.5 | Very low | 96 Ų | 96 | 137.1 Ų | 137.1 | 67% | 0.671 | 79% | 0.793 | S | S | * | * | 72.3 | 109.9 | 60.6 | 80.1 | 0 | 0 | 0 | 0 | 114.8 | |||||
| 65 | R | 32.7 | Very low | 36.1 | Very low | 244 Ų | 244 | 137 Ų | 137 | 92% | 0.921 | 79% | 0.793 | S | S | * | * | trans | 178.3 | 136.9 | 140.6 | -98.5 | 155.7 | -161.7 | -96.4 | 1.7 | 111 | ||||
| 66 | C | 40.8 | Very low | 37.3 | Very low | 126 Ų | 126 | 139 Ų | 139 | 85% | 0.851 | 79% | 0.792 | S | S | * | * | trans | -84.3 | 165.1 | 159.9 | -47.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 67 | P | 51 | Low | 38.3 | Very low | 130 Ų | 130 | 140.3 Ų | 140.3 | 84% | 0.844 | 78% | 0.784 | S | S | * | * | trans | -122.8 | 128.9 | 140.7 | 34.5 | -25.7 | 0 | 0 | 0 | 111.7 | ||||
| 68 | D | 36.3 | Very low | 39.2 | Very low | 152 Ų | 152 | 142.9 Ų | 142.9 | 81% | 0.813 | 79% | 0.789 | S | S | * | * | trans | -90.1 | 151 | 153.3 | 174.9 | 17.9 | 0 | 0 | 0 | 107.9 | ||||
| 69 | R | 35.2 | Very low | 39.4 | Very low | 231 Ų | 231 | 145.6 Ų | 145.6 | 87% | 0.872 | 79% | 0.786 | S | S | * | * | trans | 170.9 | 104.8 | 137.8 | -172.5 | 163.3 | -159.6 | 170.3 | 6 | 114.3 | ||||
| 70 | A | 35.6 | Very low | 39.8 | Very low | 75 Ų | 75 | 151.8 Ų | 151.8 | 62% | 0.62 | 80% | 0.798 | S | S | * | * | trans | 56.4 | 112 | 136.1 | 0 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 71 | N | 35.4 | Very low | 39.9 | Very low | 136 Ų | 136 | 151 Ų | 151 | 73% | 0.727 | 79% | 0.792 | S | S | * | * | 62.2 | 111 | 110.8 | -167 | 22.2 | 0 | 0 | 0 | 120.4 | |||||
| 72 | R | 38.8 | Very low | 40.6 | Very low | 246 Ų | 246 | 149.8 Ų | 149.8 | 93% | 0.928 | 80% | 0.797 | S | S | * | * | trans | -149.3 | 115.1 | 148.9 | -98.7 | 175.7 | -161 | -87.3 | -3.4 | 111.1 | ||||
| 73 | S | 35.1 | Very low | 41.2 | Very low | 105 Ų | 105 | 149.1 Ų | 149.1 | 73% | 0.734 | 81% | 0.806 | S | S | * | * | trans | -83.1 | 132.9 | 175.1 | -41.4 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 74 | L | 40.3 | Very low | 41.9 | Very low | 173 Ų | 173 | 148.6 Ų | 148.6 | 91% | 0.906 | 82% | 0.815 | S | S | * | * | trans | -143.5 | 117.4 | 163.1 | -77.3 | 179.1 | 0 | 0 | 0 | 110.6 | ||||
| 75 | T | 44.5 | Very low | 42.4 | Very low | 138 Ų | 138 | 155.7 Ų | 155.7 | 85% | 0.847 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -102.5 | 129.1 | 175.7 | 46.4 | 0 | 0 | 0 | 0 | 111.1 | ||
| 76 | P | 55.8 | Low | 42.4 | Very low | 119 Ų | 119 | 147.5 Ų | 147.5 | 77% | 0.773 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -72.3 | 155.3 | 165.3 | -15.8 | 31.4 | 0 | 0 | 0 | 112.3 | ||
| 77 | P | 50.7 | Low | 42.5 | Very low | 114 Ų | 114 | 153.2 Ų | 153.2 | 74% | 0.74 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -82.3 | 158 | 179.8 | 33.9 | -35.9 | 0 | 0 | 0 | 113.4 | ||
| 78 | P | 49.2 | Very low | 42.1 | Very low | 125 Ų | 125 | 152.6 Ų | 152.6 | 81% | 0.812 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -74.7 | 148.1 | 178 | 31.6 | -35.7 | 0 | 0 | 0 | 112.8 | ||
| 79 | Q | 40.8 | Very low | 42.3 | Very low | 195 Ų | 195 | 152.5 Ų | 152.5 | 91% | 0.911 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -95.7 | 163 | 169.4 | -68.5 | -158.6 | -35.3 | 0 | 0 | 112.3 | ||
| 80 | Q | 39.8 | Very low | 42.2 | Very low | 195 Ų | 195 | 144.7 Ų | 144.7 | 91% | 0.911 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -89.4 | 146.9 | -160.2 | -63.6 | 171 | -10 | 0 | 0 | 113.4 | ||
| 81 | S | 38.4 | Very low | 42.1 | Very low | 105 Ų | 105 | 147.6 Ų | 147.6 | 73% | 0.734 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -92.2 | 132 | 177.4 | 45.4 | 0 | 0 | 0 | 0 | 112.6 | ||
| 82 | P | 50.2 | Low | 42.4 | Very low | 126 Ų | 126 | 148.8 Ų | 148.8 | 82% | 0.818 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 133.9 | 169.6 | -15.4 | 31 | 0 | 0 | 0 | 112.1 | ||
| 83 | L | 46 | Very low | 42.3 | Very low | 163 Ų | 163 | 145.1 Ų | 145.1 | 85% | 0.853 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -93.3 | 122 | 173.6 | -68.8 | 171.8 | 0 | 0 | 0 | 111.4 | R85 | L83-R85 PolarHBondContact O-N 3.47Š|
| 84 | P | 48.3 | Very low | 42.4 | Very low | 127 Ų | 127 | 145 Ų | 145 | 83% | 0.825 | 82% | 0.821 | S | S | * | * | trans | -79.6 | 103.3 | 168 | 30.8 | -31.3 | 0 | 0 | 0 | 110.5 | G86 | P84-G86 PolarHBondContact O-N 3.29Š| ||
| 85 | R | 44.9 | Very low | 42.5 | Very low | 245 Ų | 245 | 141.8 Ų | 141.8 | 93% | 0.925 | 81% | 0.813 | S | S | * | * | trans | -86.2 | 105.9 | 174.7 | -176.2 | 177.3 | -179.5 | 169 | 0.4 | 110.3 | L83 | L83-R85 PolarHBondContact O-N 3.47Š| ||
| 86 | G | 33.9 | Very low | 42.4 | Very low | 72 Ų | 72 | 142 Ų | 142 | 74% | 0.742 | 81% | 0.813 | S | S | * | * | trans | -71.3 | 155.5 | -176.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | P84 | P84-G86 PolarHBondContact O-N 3.29Š| ||
| 87 | R | 43.2 | Very low | 41.8 | Very low | 245 Ų | 245 | 144 Ų | 144 | 93% | 0.925 | 81% | 0.813 | S | S | * | * | trans | -147.5 | 135.3 | 159.7 | -170.5 | 173.4 | -174 | 169.4 | 2.8 | 109.7 | ||||
| 88 | V | 41.4 | Very low | 40.9 | Very low | 117 Ų | 117 | 149.5 Ų | 149.5 | 71% | 0.709 | 82% | 0.82 | S | S | * | * | trans | -102.9 | 148.5 | 174.7 | 56.8 | 0 | 0 | 0 | 0 | 110 | ||||
| 89 | N | 40.9 | Very low | 40.5 | Very low | 151 Ų | 151 | 148.7 Ų | 148.7 | 81% | 0.807 | 82% | 0.817 | S | S | * | * | trans | 174.5 | 124.4 | 138.2 | -91.4 | 0.5 | 0 | 0 | 0 | 113.7 | ||||
| 90 | G | 33.7 | Very low | 40.5 | Very low | 66 Ų | 66 | 145.8 Ų | 145.8 | 68% | 0.68 | 81% | 0.813 | S | S | * | * | 63.4 | 92.1 | 127.7 | 0 | 0 | 0 | 0 | 0 | 122.3 | |||||
| 91 | T | 33.3 | Very low | 40.4 | Very low | 136 Ų | 136 | 141.3 Ų | 141.3 | 83% | 0.834 | 80% | 0.802 | S | S | * | * | 32.4 | 116.6 | 119 | -29.1 | 0 | 0 | 0 | 0 | 121.1 | |||||
| 92 | L | 40.9 | Very low | 40.7 | Very low | 162 Ų | 162 | 142.4 Ų | 142.4 | 85% | 0.848 | 81% | 0.807 | S | S | * | * | -170.6 | 176.4 | 101.6 | -145.3 | 99.9 | 0 | 0 | 0 | 111.6 | |||||
| 93 | E | 37.3 | Very low | 40.3 | Very low | 168 Ų | 168 | 146.8 Ų | 146.8 | 79% | 0.785 | 81% | 0.807 | S | S | * | * | trans | -70.7 | 154.1 | 179.3 | -70.1 | -171 | 95 | 0 | 0 | 115.2 | ||||
| 94 | A | 36.2 | Very low | 40.1 | Very low | 103 Ų | 103 | 144.3 Ų | 144.3 | 85% | 0.851 | 80% | 0.803 | S | S | * | * | trans | -148 | 124.1 | 141.3 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 95 | S | 43.6 | Very low | 39.6 | Very low | 105 Ų | 105 | 145.6 Ų | 145.6 | 73% | 0.734 | 80% | 0.8 | S | S | * | * | trans | -103.6 | 116.1 | -173.5 | 43 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 96 | V | 41.7 | Very low | 39.4 | Very low | 142 Ų | 142 | 138.7 Ų | 138.7 | 86% | 0.861 | 79% | 0.79 | S | S | * | * | trans | -140.1 | 106.8 | 170.3 | -176 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 97 | Q | 43.2 | Very low | 39.6 | Very low | 162 Ų | 162 | 140.9 Ų | 140.9 | 76% | 0.757 | 78% | 0.784 | S | S | * | * | trans | -78.1 | 146.9 | 155.8 | -70.5 | -179.7 | -17.3 | 0 | 0 | 108.9 | ||||
| 98 | Y | 33 | Very low | 39.7 | Very low | 229 Ų | 229 | 135.1 Ų | 135.1 | 90% | 0.898 | 78% | 0.778 | S | S | * | * | 179 | 165.6 | 123.8 | -97.4 | -59.9 | 0 | 0 | 0 | 112.3 | |||||
| 99 | S | 40.3 | Very low | 39.6 | Very low | 108 Ų | 108 | 134.3 Ų | 134.3 | 76% | 0.755 | 78% | 0.778 | S | S | * | * | trans | 77.8 | 94.2 | 169.7 | -146.6 | 0 | 0 | 0 | 0 | 117.3 | C101 | S99-C101 PolarHBondContact O-N 3.28Š| ||
| 100 | T | 41 | Very low | 39.5 | Very low | 135 Ų | 135 | 129.8 Ų | 129.8 | 83% | 0.828 | 77% | 0.767 | S | S | * | * | trans | -67.8 | 119.6 | 171.8 | -51.4 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 101 | C | 37.4 | Very low | 39.8 | Very low | 100 Ų | 100 | 131.2 Ų | 131.2 | 68% | 0.676 | 77% | 0.767 | S | S | * | * | trans | -120 | 114.7 | 160.5 | -73 | 0 | 0 | 0 | 0 | 108.2 | S99 R103 | S99-C101 PolarHBondContact O-N 3.28Å; C101-R103 PolarHBondContact O-N 2.9Å | ||
| 102 | P | 43.8 | Very low | 40.2 | Very low | 129 Ų | 129 | 133.5 Ų | 133.5 | 84% | 0.838 | 77% | 0.768 | S | S | * | * | trans | -72 | 81 | 171.6 | 30.8 | -33 | 0 | 0 | 0 | 108.8 | S104 | P102-S104 PolarHBondContact O-N 2.78Š| ||
| 103 | R | 42.6 | Very low | 40.2 | Very low | 218 Ų | 218 | 133.2 Ų | 133.2 | 82% | 0.823 | 76% | 0.762 | S | S | * | * | trans | -61.2 | 125 | 164.2 | -75.9 | -168.8 | 171.8 | -159.8 | -2.8 | 106.8 | C101 M105 | C101-R103 PolarHBondContact O-N 2.9Å; R103-M105 VanDerWaalsContact C-N 3.32Å; R103-M105 PolarHBondContact O-N 2.93Å | ||
| 104 | S | 42.3 | Very low | 40.7 | Very low | 110 Ų | 110 | 128.8 Ų | 128.8 | 77% | 0.769 | 76% | 0.755 | S | S | * | * | trans | -63.6 | 98.4 | 171 | -176.2 | 0 | 0 | 0 | 0 | 108 | P102 S106 | P102-S104 PolarHBondContact O-N 2.78Å; S104-S106 PolarHBondContact O-N 2.86Å | ||
| 105 | M | 37 | Very low | 41.4 | Very low | 155 Ų | 155 | 132.2 Ų | 132.2 | 76% | 0.764 | 75% | 0.753 | S | S | * | * | trans | -66.1 | 85.1 | 151.7 | 42.3 | -108.4 | -76.5 | 0 | 0 | 107.1 | R103 D107 | R103-M105 VanDerWaalsContact C-N 3.32Å; R103-M105 PolarHBondContact O-N 2.93Å; M105-D107 PolarHBondContact O-N 2.81Å | ||
| 106 | S | 40.9 | Very low | 42.3 | Very low | 100 Ų | 100 | 134.1 Ų | 134.1 | 70% | 0.699 | 75% | 0.75 | S | S | * | * | trans | -62.4 | 81.2 | 144.1 | 58.3 | 0 | 0 | 0 | 0 | 106.5 | S104 P108 | S104-S106 PolarHBondContact O-N 2.86Å; S106-P108 VanDerWaalsContact O-CD 3.31Å; S106-P108 WeakPolarHBondContact O-CD 3.31Å | ||
| 107 | D | 38.2 | Very low | 43.7 | Very low | 118 Ų | 118 | 135.1 Ų | 135.1 | 63% | 0.631 | 74% | 0.739 | S | S | * | * | trans | -50.2 | 124.6 | 160.1 | -92.9 | -46.6 | 0 | 0 | 0 | 106.3 | M105 S109 | M105-D107 PolarHBondContact O-N 2.81Å; D107-S109 PolarHBondContact O-N 3.03Å | ||
| 108 | P | 45.8 | Very low | 45.7 | Very low | 123 Ų | 123 | 132.2 Ų | 132.2 | 80% | 0.799 | 73% | 0.734 | S | S | * | * | trans | -67.6 | 81 | 151.9 | 32.3 | -29.7 | 0 | 0 | 0 | 105.3 | S106 G110 | S106-P108 VanDerWaalsContact O-CD 3.31Å; S106-P108 WeakPolarHBondContact O-CD 3.31Å; P108-G110 PolarHBondContact O-N 3.47Å | ||
| 109 | S | 38.9 | Very low | 48.5 | Very low | 100 Ų | 100 | 122.6 Ų | 122.6 | 70% | 0.699 | 70% | 0.698 | S | S | * | * | trans | -61.6 | 70.4 | 147.2 | -78.5 | 0 | 0 | 0 | 0 | 106.7 | D107 S111 | D107-S109 PolarHBondContact O-N 3.03Å; S109-S111 PolarHBondContact O-N 2.73Å; S109-S111 PolarHBondContact O-OG 2.72Å | ||
| 110 | G | 37.5 | Very low | 51.2 | Low | 57 Ų | 57 | 121 Ų | 121 | 59% | 0.588 | 68% | 0.683 | S | S | * | * | trans | -61.9 | 77.3 | 148.6 | 0 | 0 | 0 | 0 | 0 | 105.7 | P108 Q112 | P108-G110 PolarHBondContact O-N 3.47Å; G110-Q112 PolarHBondContact O-N 2.8Å | ||
| 111 | S | 40.9 | Very low | 53.8 | Low | 95 Ų | 95 | 114.8 Ų | 114.8 | 66% | 0.664 | 65% | 0.645 | S | S | * | * | trans | -44.7 | 99.6 | 140.7 | 36.4 | 0 | 0 | 0 | 0 | 105 | S109 Q113 | S109-S111 PolarHBondContact O-N 2.73Å; S109-S111 PolarHBondContact O-OG 2.72Å; S111-Q113 PolarHBondContact O-N 2.98Å | ||
| 112 | Q | 42.1 | Very low | 56.7 | Low | 184 Ų | 184 | 111.7 Ų | 111.7 | 86% | 0.86 | 62% | 0.624 | S | S | * | * | trans | -64.9 | 85.2 | 164.6 | -66.3 | -178.4 | 16 | 0 | 0 | 104.8 | G110 A114 | G110-Q112 PolarHBondContact O-N 2.8Å; Q112-A114 PolarHBondContact O-N 3.46Å | ||
| 113 | Q | 40.5 | Very low | 59.2 | Low | 156 Ų | 156 | 106 Ų | 106 | 73% | 0.729 | 59% | 0.586 | S | S | * | * | trans | -57.1 | 80 | 136.3 | -64.7 | -175.6 | 10.8 | 0 | 0 | 104.8 | S111 E115 | S111-Q113 PolarHBondContact O-N 2.98Å; Q113-E115 PolarHBondContact O-N 3.2Å; Q113-E115 VanDerWaalsContact O-N 3.11Å | ||
| 114 | A | 48.1 | Very low | 61.8 | Low | 76 Ų | 76 | 99.9 Ų | 99.9 | 63% | 0.628 | 57% | 0.569 | S | S | * | * | trans | -50.9 | 117.2 | 148 | 0 | 0 | 0 | 0 | 0 | 103.8 | Q112 E116 | Q112-A114 PolarHBondContact O-N 3.46Å; A114-E116 PolarHBondContact O-N 2.89Å | ||
| 115 | E | 50.5 | Low | 64.3 | Low | 175 Ų | 175 | 95.5 Ų | 95.5 | 82% | 0.818 | 54% | 0.541 | S | S | * | . | trans | -63.6 | 80.3 | 172.6 | -76.2 | -90.8 | 120.3 | 0 | 0 | 106.5 | Q113 R117 | Q113-E115 PolarHBondContact O-N 3.2Å; Q113-E115 VanDerWaalsContact O-N 3.11Å; E115-R117 PolarHBondContact O-N 3.16Å | ||
| 116 | E | 62.7 | Low | 67 | Low | 144 Ų | 144 | 91.3 Ų | 91.3 | 67% | 0.673 | 52% | 0.518 | S | S | * | . | trans | -67 | 101.3 | -170 | -171.9 | 172.7 | -156.8 | 0 | 0 | 107.6 | A114 | A114-E116 PolarHBondContact O-N 2.89Š| ||
| 117 | R | 71.6 | Confident | 69.4 | Low | 164 Ų | 164 | 90.7 Ų | 90.7 | 62% | 0.619 | 50% | 0.504 | S | S | * | . | P | Polyproline II helix | trans | -64.7 | 131.7 | -164.9 | -157 | 174.4 | -163.8 | 137.8 | 4.4 | 108.4 | E115 I119 | E115-R117 PolarHBondContact O-N 3.16Å; R117-I119 PolarHBondContact O-N 2.87Å; R117-I119 VanDerWaalsContact O-N 3.16Å |
| 118 | P | 84.1 | Confident | 71.8 | Confident | 101 Ų | 101 | 87.4 Ų | 87.4 | 66% | 0.656 | 49% | 0.488 | S | S | * | . | P | Polyproline II helix | trans | -51.2 | 125.5 | -177.8 | -30.6 | 35.9 | 0 | 0 | 0 | 112 | T120 | P118-T120 PolarHBondContact O-N 2.7Å; P118-T120 PolarHBondContact O-OG1 3.11Å |
| 119 | I | 93.1 | Very high | 73.5 | Confident | 27 Ų | 27 | 82.4 Ų | 82.4 | 14% | 0.138 | 45% | 0.454 | C | S | . | . | P | Polyproline II helix | trans | -54.8 | 124.7 | -176.5 | -62.1 | 162.6 | 0 | 0 | 0 | 108.5 | R117 P121 V142 R143 K144 V207 L224 | R117-I119 PolarHBondContact O-N 2.87Å; R117-I119 VanDerWaalsContact O-N 3.16Å; I119-P121 WeakPolarHBondContact O-CD 3.36Å; I119-V142 HydrophobicContact CG2-CG1 3.84Å; I119-R143 CarbonylContact C-O 3.58Å; I119-R143 WeakPolarHBondContact CA-O 3.44Å; I119-K144 HydrophobicContact CG1-CB 4.49Å; I119-K144 HydrophobicContact CG1-CG 4.34Å; I119-V207 WeakPolarHBondContact O-CG2 3.5Å; I119-L224 HydrophobicContact CD1-CD1 3.63Å; I119-L224 HydrophobicContact CD1-CD2 3.9Å; I119-L224 HydrophobicContact CD1-CG 4.38Å; I119-L224 HydrophobicContact CG2-CD2 4.05Å |
| 120 | T | 95.3 | Very high | 75.5 | Confident | 74 Ų | 74 | 83.5 Ų | 83.5 | 45% | 0.454 | 45% | 0.448 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.5 | 85.1 | -170.5 | -58.1 | 0 | 0 | 0 | 0 | 110.6 | P118 R143 | P118-T120 PolarHBondContact O-N 2.7Å; P118-T120 PolarHBondContact O-OG1 3.11Å; T120-R143 PolarHBondContact N-O 2.81Å; T120-R143 PolarHBondContact O-N 2.98Å |
| 121 | P | 96.6 | Very high | 76.5 | Confident | 4 Ų | 4 | 88.3 Ų | 88.3 | 3% | 0.026 | 46% | 0.455 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.4 | 129.9 | 175.7 | 31 | -34.9 | 0 | 0 | 0 | 111.7 | I119 L141 Q200 L203 V207 L222 | I119-P121 WeakPolarHBondContact O-CD 3.36Å; P121-L141 CarbonylContact C-O 3.5Å; P121-L141 WeakPolarHBondContact CA-O 3.38Å; P121-Q200 PolarHBondContact O-NE2 2.8Å; P121-Q200 VanDerWaalsContact O-NE2 3.14Å; P121-L203 HydrophobicContact CB-CB 4.39Å; P121-L203 HydrophobicContact CB-CD1 4.42Å; P121-L203 HydrophobicContact CB-CD2 4.22Å; P121-L203 HydrophobicContact CG-CB 4.01Å; P121-L203 HydrophobicContact CG-CD2 4.29Å; P121-V207 HydrophobicContact CG-CG1 3.78Å; P121-V207 HydrophobicContact CG-CG2 4.31Å; P121-L222 HydrophobicContact CB-CD2 4.22Å |
| 122 | T | 97.8 | Very high | 77.4 | Confident | 36 Ų | 36 | 93.2 Ų | 93.2 | 22% | 0.221 | 46% | 0.459 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.6 | 128.3 | -178 | -49.9 | 0 | 0 | 0 | 0 | 111.1 | L124 L140 L141 Q200 | T122-L124 HydrophobicContact CG2-CD2 4.41Å; T122-L124 PolarHBondContact O-N 3.44Å; T122-L140 CarbonylContact O-C 3.55Å; T122-L140 WeakPolarHBondContact O-CA 3.39Å; T122-L141 PolarHBondContact N-O 3.32Å; T122-L141 PolarHBondContact O-N 2.77Å; T122-Q200 VanDerWaalsContact CA-OE1 3.27Å |
| 123 | V | 97.8 | Very high | 78.6 | Confident | 9 Ų | 9 | 86.9 Ų | 86.9 | 6% | 0.055 | 44% | 0.438 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -80 | 106.6 | 172.9 | -165.2 | 0 | 0 | 0 | 0 | 108.6 | Y138 L140 Q196 L199 Q200 L203 | V123-Y138 HydrophobicContact CG1-CD1 4.13Å; V123-L140 HydrophobicContact CB-CD2 4.24Å; V123-L140 HydrophobicContact CG1-CD2 4Å; V123-L140 HydrophobicContact CG2-CD2 3.89Å; V123-Q196 HydrophobicContact CB-CG 4.1Å; V123-Q196 HydrophobicContact CG1-CG 3.71Å; V123-Q196 PolarHBondContact O-NE2 2.64Å; V123-Q196 VanDerWaalsContact O-NE2 3.16Å; V123-L199 HydrophobicContact CG2-CB 4.44Å; V123-Q200 HydrophobicContact CB-CB 4.49Å; V123-Q200 HydrophobicContact CG2-CB 3.89Å; V123-L203 HydrophobicContact CG2-CD1 3.71Å |
| 124 | L | 96.3 | Very high | 80.6 | Confident | 89 Ų | 89 | 84 Ų | 84 | 47% | 0.466 | 42% | 0.423 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.8 | -27.1 | -178.7 | -63.9 | -173.1 | 0 | 0 | 0 | 113.1 | T122 K139 L141 | T122-L124 HydrophobicContact CG2-CD2 4.41Å; T122-L124 PolarHBondContact O-N 3.44Å; L124-K139 HydrophobicContact CB-CG 4.42Å; L124-K139 HydrophobicContact CD1-CD 4.32Å; L124-K139 HydrophobicContact CD1-CG 4.36Å; L124-K139 PolarHBondContact N-O 3.49Å; L124-L141 HydrophobicContact CD1-CB 3.91Å; L124-L141 HydrophobicContact CD2-CB 3.86Å; L124-L141 HydrophobicContact CD2-CD2 4.07Å; L124-L141 HydrophobicContact CG-CB 3.79Å |
| 125 | G | 95.1 | Very high | 82.3 | Confident | 18 Ų | 18 | 82 Ų | 82 | 19% | 0.186 | 40% | 0.401 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 165.1 | -175.6 | -171.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | K139 Q196 | G125-K139 PolarHBondContact O-N 3.25Å; G125-Q196 VanDerWaalsContact CA-OE1 3.31Å |
| 126 | Y | 93.7 | Very high | 84.1 | Confident | 68 Ų | 68 | 74.5 Ų | 74.5 | 27% | 0.267 | 37% | 0.367 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.3 | 159.2 | 168.3 | 60 | -95.1 | 0 | 0 | 0 | 111.3 | V128 T136 V137 S189 L192 E193 | Y126-V128 HydrophobicContact CD2-CG2 4.27Å; Y126-V128 HydrophobicContact CE2-CG2 4.45Å; Y126-T136 HydrophobicContact CD2-CG2 4.08Å; Y126-T136 HydrophobicContact CG-CG2 4.19Å; Y126-V137 CarbonylContact C-O 3.53Å; Y126-V137 WeakPolarHBondContact CA-O 3.45Å; Y126-V137 WeakPolarHBondContact CB-O 3.45Å; Y126-S189 PolarHBondContact OH-OG 2.92Å; Y126-L192 HydrophobicContact CD1-CB 3.91Å; Y126-L192 HydrophobicContact CD2-CB 4.26Å; Y126-L192 HydrophobicContact CD2-CD1 3.74Å; Y126-L192 HydrophobicContact CE1-CB 3.51Å; Y126-L192 HydrophobicContact CE2-CB 3.89Å; Y126-L192 HydrophobicContact CE2-CD1 3.45Å; Y126-L192 VanDerWaalsContact CE2-CD1 3.45Å; Y126-L192 HydrophobicContact CE2-CG 4.32Å; Y126-L192 HydrophobicContact CG-CB 4.27Å; Y126-L192 HydrophobicContact CG-CD1 4.44Å; Y126-L192 VanDerWaalsContact CZ-CB 3.49Å; Y126-E193 HydrophobicContact CE1-CG 4.25Å |
| 127 | E | 90 | Very high | 85.5 | Confident | 86 Ų | 86 | 68 Ų | 68 | 40% | 0.402 | 34% | 0.337 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.1 | 137.5 | 171.6 | -169.8 | 171.8 | 157.4 | 0 | 0 | 108.4 | T136 V137 | E127-T136 WeakPolarHBondContact O-CA 3.43Å; E127-V137 PolarHBondContact N-O 3.09Å; E127-V137 PolarHBondContact O-N 2.9Å |
| 128 | V | 89 | Confident | 86.5 | Confident | 49 Ų | 49 | 60.3 Ų | 60.3 | 30% | 0.297 | 31% | 0.308 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.5 | 107.7 | 175.2 | -177.3 | 0 | 0 | 0 | 0 | 107.5 | Y126 K134 F135 T136 Y187 L192 | Y126-V128 HydrophobicContact CD2-CG2 4.27Å; Y126-V128 HydrophobicContact CE2-CG2 4.45Å; V128-K134 HydrophobicContact CG1-CD 4.45Å; V128-K134 HydrophobicContact CG1-CG 3.99Å; V128-F135 CarbonylContact C-O 3.59Å; V128-F135 WeakPolarHBondContact CA-O 3.47Å; V128-T136 HydrophobicContact CG2-CG2 4.26Å; V128-Y187 HydrophobicContact CG1-CD1 3.98Å; V128-L192 HydrophobicContact CG2-CD1 4.01Å |
| 129 | M | 82.6 | Confident | 87 | Confident | 19 Ų | 19 | 59.6 Ų | 59.6 | 9% | 0.094 | 30% | 0.295 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.9 | 144.5 | -179.9 | -58.5 | -146.4 | 75.9 | 0 | 0 | 110.1 | K134 F135 V137 R238 | M129-K134 VanDerWaalsContact O-CA 3.29Å; M129-K134 WeakPolarHBondContact O-CA 3.46Å; M129-F135 HydrophobicContact CB-CD1 4.25Å; M129-F135 HydrophobicContact CB-CD2 4.28Å; M129-F135 HydrophobicContact CB-CE1 3.82Å; M129-F135 HydrophobicContact CB-CE2 3.86Å; M129-F135 HydrophobicContact CB-CG 4.47Å; M129-F135 HydrophobicContact CB-CZ 3.61Å; M129-F135 HydrophobicContact CG-CE2 3.99Å; M129-F135 HydrophobicContact CG-CZ 4.07Å; M129-F135 PolarHBondContact N-O 3.44Å; M129-F135 PolarHBondContact O-N 3.14Å; M129-F135 HydrophobicContact SD-CE2 4.17Å; M129-F135 HydrophobicContact SD-CZ 4.02Å; M129-V137 HydrophobicContact CG-CG2 4.25Å; M129-R238 HydrophobicContact SD-CG 4.41Å |
| 130 | E | 80 | Confident | 87.2 | Confident | 122 Ų | 122 | 58.3 Ų | 58.3 | 57% | 0.57 | 29% | 0.288 | S | S | * | . | trans | -136.3 | 1.2 | -175.3 | -66 | -168.7 | 162.9 | 0 | 0 | 114.7 | R132 K134 | E130-R132 PolarHBondContact O-N 3.43Å; E130-R132 VanDerWaalsContact O-N 3.08Å; E130-K134 HydrophobicContact CG-CB 4.41Å; E130-K134 HydrophobicContact CG-CD 4.23Å; E130-K134 HydrophobicContact CG-CG 4Å; E130-K134 VanDerWaalsContact OE1-CD 3.27Å; E130-K134 WeakPolarHBondContact OE1-CD 3.44Å; E130-K134 WeakPolarHBondContact OE1-CE 3.42Å; E130-K134 IonicContact OE1-NZ 2.67Å; E130-K134 PolarHBondContact OE1-NZ 2.93Å | ||
| 131 | E | 58.4 | Low | 87.2 | Confident | 158 Ų | 158 | 55.6 Ų | 55.6 | 74% | 0.738 | 27% | 0.271 | S | S | * | . | S | Bend | trans | -62.4 | -22.5 | -168.8 | -65.8 | -174.4 | 129.5 | 0 | 0 | 115.4 | ||
| 132 | R | 59.7 | Low | 87.1 | Confident | 198 Ų | 198 | 55.4 Ų | 55.4 | 75% | 0.747 | 27% | 0.27 | S | S | * | . | S | Bend | trans | -140.4 | -43 | 178 | -69.2 | -178.8 | 173.2 | 139.2 | -38.8 | 112.5 | E130 E242 | E130-R132 PolarHBondContact O-N 3.43Å; E130-R132 VanDerWaalsContact O-N 3.08Å; R132-E242 IonicContact CZ-OE1 2.74Å; R132-E242 IonicContact CZ-OE2 2.84Å; R132-E242 IonicContact NH1-OE1 3.06Å; R132-E242 PolarHBondContact NH1-OE1 2.8Å; R132-E242 IonicContact NH1-OE2 3.9Å; R132-E242 PolarHBondContact NH1-OE2 2.85Å; R132-E242 IonicContact NH2-OE1 3.49Å; R132-E242 PolarHBondContact NH2-OE1 3.43Å |
| 133 | A | 68.3 | Low | 87 | Confident | 51 Ų | 51 | 59.4 Ų | 59.4 | 42% | 0.421 | 28% | 0.28 | S | S | . | . | S | Bend | trans | -138.9 | 158.8 | 170.3 | 0 | 0 | 0 | 0 | 0 | 108.4 | F135 | A133-F135 WeakPolarHBondContact O-CD1 3.28Š|
| 134 | K | 82 | Confident | 86.7 | Confident | 95 Ų | 95 | 61.1 Ų | 61.1 | 41% | 0.413 | 29% | 0.287 | S | S | . | . | trans | -86.4 | 121.8 | 176.4 | -170.3 | 165.1 | -176.7 | 151.7 | 0 | 110.3 | V128 M129 E130 Y187 | V128-K134 HydrophobicContact CG1-CD 4.45Å; V128-K134 HydrophobicContact CG1-CG 3.99Å; M129-K134 VanDerWaalsContact O-CA 3.29Å; M129-K134 WeakPolarHBondContact O-CA 3.46Å; E130-K134 HydrophobicContact CG-CB 4.41Å; E130-K134 HydrophobicContact CG-CD 4.23Å; E130-K134 HydrophobicContact CG-CG 4Å; E130-K134 VanDerWaalsContact OE1-CD 3.27Å; E130-K134 WeakPolarHBondContact OE1-CD 3.44Å; E130-K134 WeakPolarHBondContact OE1-CE 3.42Å; E130-K134 IonicContact OE1-NZ 2.67Å; E130-K134 PolarHBondContact OE1-NZ 2.93Å; K134-Y187 HydrophobicContact CB-CE2 4.48Å; K134-Y187 HydrophobicContact CD-CD1 4.43Å; K134-Y187 HydrophobicContact CD-CD2 3.8Å; K134-Y187 HydrophobicContact CD-CE1 4.41Å; K134-Y187 HydrophobicContact CD-CE2 3.76Å; K134-Y187 HydrophobicContact CD-CG 4.16Å; K134-Y187 VanDerWaalsContact CE-CG 3.45Å; K134-Y187 HydrophobicContact CG-CD1 4.18Å; K134-Y187 HydrophobicContact CG-CD2 4.24Å; K134-Y187 HydrophobicContact CG-CE1 3.81Å; K134-Y187 HydrophobicContact CG-CE2 3.86Å; K134-Y187 HydrophobicContact CG-CG 4.41Å; K134-Y187 PolarHBondContact O-OH 3.09Å | ||
| 135 | F | 83.3 | Confident | 86.3 | Confident | 35 Ų | 35 | 59.4 Ų | 59.4 | 15% | 0.154 | 28% | 0.282 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -151.4 | 161.1 | 177.1 | 62.6 | -88.5 | 0 | 0 | 0 | 112.5 | V128 M129 A133 V137 R155 C241 E245 | V128-F135 CarbonylContact C-O 3.59Å; V128-F135 WeakPolarHBondContact CA-O 3.47Å; M129-F135 HydrophobicContact CB-CD1 4.25Å; M129-F135 HydrophobicContact CB-CD2 4.28Å; M129-F135 HydrophobicContact CB-CE1 3.82Å; M129-F135 HydrophobicContact CB-CE2 3.86Å; M129-F135 HydrophobicContact CB-CG 4.47Å; M129-F135 HydrophobicContact CB-CZ 3.61Å; M129-F135 HydrophobicContact CG-CE2 3.99Å; M129-F135 HydrophobicContact CG-CZ 4.07Å; M129-F135 PolarHBondContact N-O 3.44Å; M129-F135 PolarHBondContact O-N 3.14Å; M129-F135 HydrophobicContact SD-CE2 4.17Å; M129-F135 HydrophobicContact SD-CZ 4.02Å; A133-F135 WeakPolarHBondContact O-CD1 3.28Å; F135-V137 HydrophobicContact CD2-CG2 3.58Å; F135-V137 HydrophobicContact CE2-CG2 3.38Å; F135-R155 HydrophobicContact CD2-CG 4.49Å; F135-C241 HydrophobicContact CE2-CB 4.29Å; F135-E245 WeakPolarHBondContact CD1-OE1 3.38Å; F135-E245 WeakPolarHBondContact CE1-OE2 3.43Å; F135-E245 WeakPolarHBondContact CG-OE1 3.49Å |
| 136 | T | 90 | Very high | 85.9 | Confident | 18 Ų | 18 | 66.2 Ų | 66.2 | 11% | 0.11 | 31% | 0.31 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.4 | 129.7 | 178.7 | -47 | 0 | 0 | 0 | 0 | 111.8 | Y126 E127 V128 Y138 L192 | Y126-T136 HydrophobicContact CD2-CG2 4.08Å; Y126-T136 HydrophobicContact CG-CG2 4.19Å; E127-T136 WeakPolarHBondContact O-CA 3.43Å; V128-T136 HydrophobicContact CG2-CG2 4.26Å; T136-Y138 HydrophobicContact CG2-CE2 4.24Å; T136-L192 HydrophobicContact CG2-CD1 4.08Å; T136-L192 HydrophobicContact CG2-CD2 3.95Å |
| 137 | V | 91 | Very high | 85.5 | Confident | 8 Ų | 8 | 70.1 Ų | 70.1 | 5% | 0.048 | 34% | 0.335 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.7 | 139.3 | 177.5 | -169.9 | 0 | 0 | 0 | 0 | 109.4 | Y126 E127 M129 F135 F153 R155 | Y126-V137 CarbonylContact C-O 3.53Å; Y126-V137 WeakPolarHBondContact CA-O 3.45Å; Y126-V137 WeakPolarHBondContact CB-O 3.45Å; E127-V137 PolarHBondContact N-O 3.09Å; E127-V137 PolarHBondContact O-N 2.9Å; M129-V137 HydrophobicContact CG-CG2 4.25Å; F135-V137 HydrophobicContact CD2-CG2 3.58Å; F135-V137 HydrophobicContact CE2-CG2 3.38Å; V137-F153 HydrophobicContact CG1-CB 3.67Å; V137-F153 HydrophobicContact CG1-CD1 3.97Å; V137-F153 HydrophobicContact CG1-CG 4.32Å; V137-R155 HydrophobicContact CG2-CG 4.15Å |
| 138 | Y | 93.7 | Very high | 85.6 | Confident | 1 Ų | 1 | 69.1 Ų | 69.1 | 0% | 0.004 | 33% | 0.331 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.2 | 130.7 | 174.9 | -63.9 | -90.6 | 0 | 0 | 0 | 110 | V123 T136 F153 R154 L192 R195 Q196 L199 | V123-Y138 HydrophobicContact CG1-CD1 4.13Å; T136-Y138 HydrophobicContact CG2-CE2 4.24Å; Y138-F153 WeakPolarHBondContact O-CA 3.11Å; Y138-R154 PolarHBondContact N-O 3Å; Y138-R154 PolarHBondContact O-N 3.16Å; Y138-L192 WeakPolarHBondContact OH-CD2 3.4Å; Y138-R195 HydrophobicContact CE1-CG 4.45Å; Y138-R195 WeakPolarHBondContact OH-CD 3.45Å; Y138-R195 WeakPolarHBondContact OH-CG 3.41Å; Y138-Q196 HydrophobicContact CD1-CB 4.48Å; Y138-Q196 HydrophobicContact CE1-CB 4.2Å; Y138-L199 HydrophobicContact CD1-CD1 3.8Å; Y138-L199 HydrophobicContact CD2-CD1 3.67Å; Y138-L199 HydrophobicContact CE1-CD1 3.85Å; Y138-L199 HydrophobicContact CE2-CD1 3.77Å; Y138-L199 HydrophobicContact CG-CD1 3.72Å |
| 139 | K | 94.3 | Very high | 85.8 | Confident | 86 Ų | 86 | 70.7 Ų | 70.7 | 37% | 0.374 | 34% | 0.337 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.7 | 110.9 | 180 | -172.9 | 175.5 | -172.9 | 170.7 | 0 | 109.5 | L124 G125 V151 F153 | L124-K139 HydrophobicContact CB-CG 4.42Å; L124-K139 HydrophobicContact CD1-CD 4.32Å; L124-K139 HydrophobicContact CD1-CG 4.36Å; L124-K139 PolarHBondContact N-O 3.49Å; G125-K139 PolarHBondContact O-N 3.25Å; K139-V151 HydrophobicContact CD-CG1 4.38Å; K139-V151 HydrophobicContact CG-CG1 3.64Å; K139-F153 HydrophobicContact CB-CD1 4.16Å; K139-F153 HydrophobicContact CB-CE1 3.96Å; K139-F153 HydrophobicContact CD-CE1 3.95Å; K139-F153 HydrophobicContact CD-CZ 4.07Å; K139-F153 HydrophobicContact CG-CD1 4.24Å; K139-F153 HydrophobicContact CG-CE1 3.73Å; K139-F153 HydrophobicContact CG-CZ 4.01Å |
| 140 | L | 95.6 | Very high | 86.3 | Confident | 0 Ų | 0 | 70.5 Ų | 70.5 | 0% | 0 | 34% | 0.335 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.7 | 122.4 | -176.4 | -44.6 | -174.9 | 0 | 0 | 0 | 109.6 | T122 V123 V151 V152 R154 F159 L203 F221 | T122-L140 CarbonylContact O-C 3.55Å; T122-L140 WeakPolarHBondContact O-CA 3.39Å; V123-L140 HydrophobicContact CB-CD2 4.24Å; V123-L140 HydrophobicContact CG1-CD2 4Å; V123-L140 HydrophobicContact CG2-CD2 3.89Å; L140-V151 CarbonylContact O-C 3.57Å; L140-V151 VanDerWaalsContact O-CA 3.28Å; L140-V151 WeakPolarHBondContact O-CA 3.4Å; L140-V152 WeakPolarHBondContact CA-O 3.24Å; L140-V152 HydrophobicContact CB-CG2 3.86Å; L140-V152 WeakPolarHBondContact CB-O 3.49Å; L140-V152 HydrophobicContact CD1-CG2 4.05Å; L140-V152 HydrophobicContact CG-CG2 4.3Å; L140-V152 PolarHBondContact N-O 3.46Å; L140-V152 PolarHBondContact O-N 2.98Å; L140-R154 HydrophobicContact CD1-CB 4.16Å; L140-R154 HydrophobicContact CD1-CG 3.83Å; L140-F159 HydrophobicContact CD1-CE1 4.45Å; L140-F159 HydrophobicContact CD1-CZ 3.78Å; L140-F159 HydrophobicContact CD2-CZ 4.02Å; L140-F159 HydrophobicContact CG-CZ 4.5Å; L140-L203 HydrophobicContact CD1-CD1 4.23Å; L140-L203 HydrophobicContact CD2-CD1 4.02Å; L140-F221 HydrophobicContact CD1-CE1 3.94Å; L140-F221 HydrophobicContact CD1-CZ 4.32Å |
| 141 | L | 95.4 | Very high | 87 | Confident | 18 Ų | 18 | 66.2 Ų | 66.2 | 9% | 0.094 | 32% | 0.317 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.2 | 116.2 | 166.8 | 175.8 | 60.6 | 0 | 0 | 0 | 108.7 | P121 T122 L124 R143 N149 W150 | P121-L141 CarbonylContact C-O 3.5Å; P121-L141 WeakPolarHBondContact CA-O 3.38Å; T122-L141 PolarHBondContact N-O 3.32Å; T122-L141 PolarHBondContact O-N 2.77Å; L124-L141 HydrophobicContact CD1-CB 3.91Å; L124-L141 HydrophobicContact CD2-CB 3.86Å; L124-L141 HydrophobicContact CD2-CD2 4.07Å; L124-L141 HydrophobicContact CG-CB 3.79Å; L141-R143 HydrophobicContact CD2-CG 4.47Å; L141-R143 HydrophobicContact CG-CG 4.2Å; L141-N149 HydrophobicContact CD1-CB 4.43Å; L141-W150 WeakPolarHBondContact CD1-O 3.28Å |
| 142 | V | 95.8 | Very high | 88.6 | Confident | 0 Ų | 0 | 58.8 Ų | 58.8 | 0% | 0 | 28% | 0.283 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.5 | 123.8 | 172.8 | -173.3 | 0 | 0 | 0 | 0 | 107.9 | I119 N149 W150 V152 L222 L224 | I119-V142 HydrophobicContact CG2-CG1 3.84Å; V142-N149 CarbonylContact O-C 3.59Å; V142-N149 WeakPolarHBondContact O-CA 3.46Å; V142-N149 WeakPolarHBondContact O-CB 3.13Å; V142-W150 HydrophobicContact CB-CD2 4.12Å; V142-W150 HydrophobicContact CB-CZ2 3.95Å; V142-W150 HydrophobicContact CG1-CD2 4.46Å; V142-W150 HydrophobicContact CG1-CH2 3.89Å; V142-W150 HydrophobicContact CG1-CZ2 3.5Å; V142-W150 VanDerWaalsContact CG1-CZ2 3.5Å; V142-W150 HydrophobicContact CG1-CZ3 4.5Å; V142-W150 PolarHBondContact N-O 2.82Å; V142-W150 PolarHBondContact O-N 3.15Å; V142-V152 HydrophobicContact CG2-CG2 4.12Å; V142-L222 HydrophobicContact CG2-CB 4.3Å; V142-L222 HydrophobicContact CG2-CD2 4.13Å; V142-L224 HydrophobicContact CG1-CD2 4.02Å |
| 143 | R | 94.8 | Very high | 90.1 | Very high | 119 Ų | 119 | 49.9 Ų | 49.9 | 45% | 0.449 | 25% | 0.249 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -113.8 | 118.3 | 171.5 | -64.4 | -179.3 | 176.3 | 125.9 | -5.3 | 108.8 | I119 T120 L141 N149 | I119-R143 CarbonylContact C-O 3.58Å; I119-R143 WeakPolarHBondContact CA-O 3.44Å; T120-R143 PolarHBondContact N-O 2.81Å; T120-R143 PolarHBondContact O-N 2.98Å; L141-R143 HydrophobicContact CD2-CG 4.47Å; L141-R143 HydrophobicContact CG-CG 4.2Å; R143-N149 HydrophobicContact CB-CB 4.41Å; R143-N149 HydrophobicContact CG-CB 3.97Å |
| 144 | K | 91.3 | Very high | 91.2 | Very high | 46 Ų | 46 | 48.2 Ų | 48.2 | 20% | 0.2 | 23% | 0.232 | C | C | . | . | S | Bend | trans | -102.8 | -41 | 176.2 | 177.9 | 170.9 | 152.4 | -156.3 | 0 | 111 | I119 E148 W150 | I119-K144 HydrophobicContact CG1-CB 4.49Å; I119-K144 HydrophobicContact CG1-CG 4.34Å; K144-E148 WeakPolarHBondContact CD-OE1 3.44Å; K144-E148 VanDerWaalsContact CD-OE2 3.3Å; K144-E148 WeakPolarHBondContact CD-OE2 3.41Å; K144-E148 WeakPolarHBondContact CE-OE1 3.32Å; K144-E148 WeakPolarHBondContact CE-OE2 3.47Å; K144-E148 PolarHBondContact N-O 3.26Å; K144-E148 IonicContact NZ-OE1 3.19Å; K144-E148 PolarHBondContact NZ-OE1 3.43Å; K144-E148 IonicContact NZ-OE2 3.09Å; K144-E148 PolarHBondContact NZ-OE2 2.85Å; K144-W150 HydrophobicContact CB-CH2 3.98Å; K144-W150 HydrophobicContact CB-CZ3 3.83Å; K144-W150 HydrophobicContact CD-CH2 4.04Å; K144-W150 HydrophobicContact CD-CZ3 4.28Å |
| 145 | S | 88.9 | Confident | 91.7 | Very high | 52 Ų | 52 | 45 Ų | 45 | 36% | 0.364 | 22% | 0.218 | S | C | . | . | S | Bend | trans | -133.1 | -163.6 | 169.4 | 76.6 | 0 | 0 | 0 | 0 | 111.5 | D147 E148 | S145-D147 PolarHBondContact OG-N 2.91Å; S145-E148 PolarHBondContact N-O 3.47Å; S145-E148 VanDerWaalsContact N-O 3.12Å; S145-E148 WeakPolarHBondContact OG-CB 3.48Å; S145-E148 PolarHBondContact OG-N 3.38Å |
| 146 | Q | 85.3 | Confident | 92.2 | Very high | 162 Ų | 162 | 44.7 Ų | 44.7 | 76% | 0.757 | 22% | 0.215 | S | C | * | . | S | Bend | trans | -74.4 | -38.2 | 175.2 | -65.5 | -171.7 | -81.2 | 0 | 0 | 111.6 | ||
| 147 | D | 87 | Confident | 92.2 | Very high | 150 Ų | 150 | 46.6 Ų | 46.6 | 80% | 0.802 | 23% | 0.227 | S | C | * | . | S | Bend | trans | -96.4 | -30 | -179.1 | -52.9 | -68.1 | 0 | 0 | 0 | 111.7 | S145 N149 | S145-D147 PolarHBondContact OG-N 2.91Å; D147-N149 PolarHBondContact O-N 3.25Å; D147-N149 PolarHBondContact O-ND2 3.24Å |
| 148 | E | 91 | Very high | 92.3 | Very high | 65 Ų | 65 | 46.8 Ų | 46.8 | 30% | 0.304 | 23% | 0.228 | S | C | . | . | trans | -90 | 96.3 | -179.1 | -158.2 | -168.1 | 173.7 | 0 | 0 | 111.3 | K144 S145 W150 | K144-E148 WeakPolarHBondContact CD-OE1 3.44Å; K144-E148 VanDerWaalsContact CD-OE2 3.3Å; K144-E148 WeakPolarHBondContact CD-OE2 3.41Å; K144-E148 WeakPolarHBondContact CE-OE1 3.32Å; K144-E148 WeakPolarHBondContact CE-OE2 3.47Å; K144-E148 PolarHBondContact N-O 3.26Å; K144-E148 IonicContact NZ-OE1 3.19Å; K144-E148 PolarHBondContact NZ-OE1 3.43Å; K144-E148 IonicContact NZ-OE2 3.09Å; K144-E148 PolarHBondContact NZ-OE2 2.85Å; S145-E148 PolarHBondContact N-O 3.47Å; S145-E148 VanDerWaalsContact N-O 3.12Å; S145-E148 WeakPolarHBondContact OG-CB 3.48Å; S145-E148 PolarHBondContact OG-N 3.38Å; E148-W150 HydrophobicContact CG-CE3 4.46Å; E148-W150 HydrophobicContact CG-CZ3 4Å | ||
| 149 | N | 93.5 | Very high | 92.3 | Very high | 81 Ų | 81 | 46.7 Ų | 46.7 | 43% | 0.433 | 23% | 0.228 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -150.3 | 143.5 | 176.7 | 71.2 | 115.6 | 0 | 0 | 0 | 111.5 | L141 V142 R143 D147 | L141-N149 HydrophobicContact CD1-CB 4.43Å; V142-N149 CarbonylContact O-C 3.59Å; V142-N149 WeakPolarHBondContact O-CA 3.46Å; V142-N149 WeakPolarHBondContact O-CB 3.13Å; R143-N149 HydrophobicContact CB-CB 4.41Å; R143-N149 HydrophobicContact CG-CB 3.97Å; D147-N149 PolarHBondContact O-N 3.25Å; D147-N149 PolarHBondContact O-ND2 3.24Å |
| 150 | W | 94.1 | Very high | 92.3 | Very high | 16 Ų | 16 | 43.1 Ų | 43.1 | 6% | 0.061 | 21% | 0.213 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -148.9 | 170 | -175.3 | 62.8 | 96.3 | 0 | 0 | 0 | 111.2 | L141 V142 K144 E148 L222 C223 L224 P227 | L141-W150 WeakPolarHBondContact CD1-O 3.28Å; V142-W150 HydrophobicContact CB-CD2 4.12Å; V142-W150 HydrophobicContact CB-CZ2 3.95Å; V142-W150 HydrophobicContact CG1-CD2 4.46Å; V142-W150 HydrophobicContact CG1-CH2 3.89Å; V142-W150 HydrophobicContact CG1-CZ2 3.5Å; V142-W150 VanDerWaalsContact CG1-CZ2 3.5Å; V142-W150 HydrophobicContact CG1-CZ3 4.5Å; V142-W150 PolarHBondContact N-O 2.82Å; V142-W150 PolarHBondContact O-N 3.15Å; K144-W150 HydrophobicContact CB-CH2 3.98Å; K144-W150 HydrophobicContact CB-CZ3 3.83Å; K144-W150 HydrophobicContact CD-CH2 4.04Å; K144-W150 HydrophobicContact CD-CZ3 4.28Å; E148-W150 HydrophobicContact CG-CE3 4.46Å; E148-W150 HydrophobicContact CG-CZ3 4Å; W150-L222 WeakPolarHBondContact CZ2-O 3.27Å; W150-L222 PolarHBondContact NE1-O 3.25Å; W150-C223 WeakPolarHBondContact CZ2-O 3.29Å; W150-L224 HydrophobicContact CH2-CD2 4.06Å; W150-L224 HydrophobicContact CZ2-CD2 3.84Å; W150-P227 HydrophobicContact CB-CB 4.45Å; W150-P227 HydrophobicContact CD2-CB 3.42Å; W150-P227 VanDerWaalsContact CD2-CB 3.42Å; W150-P227 HydrophobicContact CE3-CB 3.62Å; W150-P227 HydrophobicContact CE3-CG 4.49Å; W150-P227 HydrophobicContact CG-CB 3.81Å; W150-P227 HydrophobicContact CH2-CB 4.2Å; W150-P227 HydrophobicContact CZ2-CB 4.02Å; W150-P227 HydrophobicContact CZ3-CB 4.02Å |
| 151 | V | 92.9 | Very high | 92.2 | Very high | 31 Ų | 31 | 48.3 Ų | 48.3 | 19% | 0.188 | 23% | 0.233 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -105.2 | 136 | 174.8 | 176.6 | 0 | 0 | 0 | 0 | 109.3 | K139 L140 F153 S233 | K139-V151 HydrophobicContact CD-CG1 4.38Å; K139-V151 HydrophobicContact CG-CG1 3.64Å; L140-V151 CarbonylContact O-C 3.57Å; L140-V151 VanDerWaalsContact O-CA 3.28Å; L140-V151 WeakPolarHBondContact O-CA 3.4Å; V151-F153 HydrophobicContact CG1-CD2 3.87Å; V151-F153 HydrophobicContact CG1-CE2 3.5Å; V151-F153 VanDerWaalsContact CG1-CE2 3.5Å; V151-F153 HydrophobicContact CG1-CZ 3.94Å; V151-S233 WeakPolarHBondContact O-CB 3.41Å |
| 152 | V | 92.6 | Very high | 92.1 | Very high | 2 Ų | 2 | 47.7 Ų | 47.7 | 1% | 0.012 | 23% | 0.23 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -120.5 | 149.8 | 160.9 | -56 | 0 | 0 | 0 | 0 | 109.7 | L140 V142 R154 C223 P228 | L140-V152 WeakPolarHBondContact CA-O 3.24Å; L140-V152 HydrophobicContact CB-CG2 3.86Å; L140-V152 WeakPolarHBondContact CB-O 3.49Å; L140-V152 HydrophobicContact CD1-CG2 4.05Å; L140-V152 HydrophobicContact CG-CG2 4.3Å; L140-V152 PolarHBondContact N-O 3.46Å; L140-V152 PolarHBondContact O-N 2.98Å; V142-V152 HydrophobicContact CG2-CG2 4.12Å; V152-R154 HydrophobicContact CG2-CG 4.33Å; V152-C223 HydrophobicContact CG1-CB 3.97Å; V152-P228 HydrophobicContact CG1-CG 4.15Å |
| 153 | F | 91.4 | Very high | 92.1 | Very high | 11 Ų | 11 | 48 Ų | 48 | 5% | 0.048 | 23% | 0.232 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -114.5 | 132.1 | 178.2 | -68.9 | -98.6 | 0 | 0 | 0 | 109.2 | V137 Y138 K139 V151 S233 L234 S237 | V137-F153 HydrophobicContact CG1-CB 3.67Å; V137-F153 HydrophobicContact CG1-CD1 3.97Å; V137-F153 HydrophobicContact CG1-CG 4.32Å; Y138-F153 WeakPolarHBondContact O-CA 3.11Å; K139-F153 HydrophobicContact CB-CD1 4.16Å; K139-F153 HydrophobicContact CB-CE1 3.96Å; K139-F153 HydrophobicContact CD-CE1 3.95Å; K139-F153 HydrophobicContact CD-CZ 4.07Å; K139-F153 HydrophobicContact CG-CD1 4.24Å; K139-F153 HydrophobicContact CG-CE1 3.73Å; K139-F153 HydrophobicContact CG-CZ 4.01Å; V151-F153 HydrophobicContact CG1-CD2 3.87Å; V151-F153 HydrophobicContact CG1-CE2 3.5Å; V151-F153 VanDerWaalsContact CG1-CE2 3.5Å; V151-F153 HydrophobicContact CG1-CZ 3.94Å; F153-S233 VanDerWaalsContact CD2-O 3.31Å; F153-S233 WeakPolarHBondContact CD2-O 3.49Å; F153-L234 HydrophobicContact CD1-CD1 4.48Å; F153-L234 HydrophobicContact CE1-CD1 4.05Å; F153-L234 HydrophobicContact CE2-CB 4.04Å; F153-L234 HydrophobicContact CE2-CD1 4.13Å; F153-L234 HydrophobicContact CZ-CB 4.35Å; F153-L234 HydrophobicContact CZ-CD1 3.85Å; F153-S237 WeakPolarHBondContact CB-OG 3.46Å |
| 154 | R | 92 | Very high | 92 | Very high | 17 Ų | 17 | 45.8 Ų | 45.8 | 6% | 0.064 | 23% | 0.228 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -142 | 139.3 | -173.7 | -60.4 | -65.9 | 177 | -116.7 | 10.8 | 110.9 | Y138 L140 V152 F159 F221 C223 | Y138-R154 PolarHBondContact N-O 3Å; Y138-R154 PolarHBondContact O-N 3.16Å; L140-R154 HydrophobicContact CD1-CB 4.16Å; L140-R154 HydrophobicContact CD1-CG 3.83Å; V152-R154 HydrophobicContact CG2-CG 4.33Å; R154-F159 HydrophobicContact CB-CD2 4.42Å; R154-F159 HydrophobicContact CB-CE2 3.89Å; R154-F159 HydrophobicContact CB-CZ 4.49Å; R154-F221 HydrophobicContact CB-CE2 4.09Å; R154-F221 HydrophobicContact CB-CZ 3.84Å; R154-F221 HydrophobicContact CG-CD2 4.46Å; R154-F221 HydrophobicContact CG-CE1 4.11Å; R154-F221 HydrophobicContact CG-CE2 3.82Å; R154-F221 HydrophobicContact CG-CZ 3.61Å; R154-F221 VanDerWaalsContact CZ-O 3.29Å; R154-F221 PolarHBondContact NE-O 2.95Å; R154-F221 PolarHBondContact NH2-O 3.03Å; R154-C223 PolarHBondContact NH2-SG 2.99Å |
| 155 | R | 91.9 | Very high | 92.1 | Very high | 27 Ų | 27 | 47.8 Ų | 47.8 | 10% | 0.102 | 24% | 0.237 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -91.8 | 160.2 | 174.1 | -62.1 | -179.2 | -61.3 | 151.5 | -0.7 | 110 | F135 V137 T157 D158 F159 C241 E245 | F135-R155 HydrophobicContact CD2-CG 4.49Å; V137-R155 HydrophobicContact CG2-CG 4.15Å; R155-T157 PolarHBondContact O-N 3.39Å; R155-T157 VanDerWaalsContact O-N 3.09Å; R155-D158 WeakPolarHBondContact CB-OD2 3.2Å; R155-D158 PolarHBondContact N-OD2 3.02Å; R155-D158 WeakPolarHBondContact O-CB 3.37Å; R155-D158 PolarHBondContact O-N 3.47Å; R155-F159 WeakPolarHBondContact O-CD2 3.12Å; R155-F159 PolarHBondContact O-N 3.31Å; R155-C241 VanDerWaalsContact CD-SG 3.6Å; R155-C241 PolarHBondContact NE-SG 3.36Å; R155-C241 VanDerWaalsContact NE-SG 3.44Å; R155-E245 IonicContact CZ-OE1 2.78Å; R155-E245 IonicContact NE-OE1 3.36Å; R155-E245 VanDerWaalsContact NH1-CD 3.34Å; R155-E245 IonicContact NH1-OE1 3.18Å; R155-E245 PolarHBondContact NH1-OE1 3.47Å |
| 156 | Y | 93.2 | Very high | 92.4 | Very high | 28 Ų | 28 | 45.4 Ų | 45.4 | 11% | 0.11 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -54.2 | -32.1 | 178.8 | 176 | -86.2 | 0 | 0 | 0 | 113.2 | D158 F159 S160 P178 K180 R195 L199 | Y156-D158 PolarHBondContact O-N 3.06Å; Y156-F159 PolarHBondContact O-N 3.37Å; Y156-S160 PolarHBondContact O-N 2.89Å; Y156-P178 HydrophobicContact CE2-CG 4.19Å; Y156-P178 WeakPolarHBondContact CE2-O 3.41Å; Y156-P178 PolarHBondContact OH-O 3.48Å; Y156-K180 HydrophobicContact CE1-CD 4.38Å; Y156-K180 HydrophobicContact CE1-CG 3.55Å; Y156-R195 HydrophobicContact CD2-CG 4.2Å; Y156-L199 HydrophobicContact CD2-CD2 4.33Å |
| 157 | T | 90.4 | Very high | 92.8 | Very high | 59 Ų | 59 | 42 Ų | 42 | 36% | 0.362 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -59.3 | -33.1 | 174.7 | 45.7 | 0 | 0 | 0 | 0 | 113.3 | R155 S160 R161 | R155-T157 PolarHBondContact O-N 3.39Å; R155-T157 VanDerWaalsContact O-N 3.09Å; T157-S160 WeakPolarHBondContact O-CB 3.46Å; T157-S160 PolarHBondContact O-N 3.3Å; T157-R161 WeakPolarHBondContact O-CG 3.43Å; T157-R161 PolarHBondContact O-N 2.88Å |
| 158 | D | 92.4 | Very high | 93.2 | Very high | 11 Ų | 11 | 42.6 Ų | 42.6 | 6% | 0.059 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -81.3 | -35.6 | -173.3 | -46.9 | -38.9 | 0 | 0 | 0 | 109.7 | R155 Y156 R161 L162 F221 | R155-D158 WeakPolarHBondContact CB-OD2 3.2Å; R155-D158 PolarHBondContact N-OD2 3.02Å; R155-D158 WeakPolarHBondContact O-CB 3.37Å; R155-D158 PolarHBondContact O-N 3.47Å; Y156-D158 PolarHBondContact O-N 3.06Å; D158-R161 PolarHBondContact O-N 3.33Å; D158-R161 IonicContact OD1-NH1 3.37Å; D158-R161 PolarHBondContact OD1-NH1 2.89Å; D158-R161 VanDerWaalsContact OD1-NH1 3.09Å; D158-L162 WeakPolarHBondContact O-CB 3.17Å; D158-L162 PolarHBondContact O-N 2.84Å; D158-F221 HydrophobicContact CB-CE2 4.03Å |
| 159 | F | 95.3 | Very high | 93.3 | Very high | 0 Ų | 0 | 44.2 Ų | 44.2 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -60.4 | -41.2 | 164.8 | -71.4 | -87.3 | 0 | 0 | 0 | 112.7 | L140 R154 R155 Y156 L162 N163 L177 L199 F202 L203 F221 | L140-F159 HydrophobicContact CD1-CE1 4.45Å; L140-F159 HydrophobicContact CD1-CZ 3.78Å; L140-F159 HydrophobicContact CD2-CZ 4.02Å; L140-F159 HydrophobicContact CG-CZ 4.5Å; R154-F159 HydrophobicContact CB-CD2 4.42Å; R154-F159 HydrophobicContact CB-CE2 3.89Å; R154-F159 HydrophobicContact CB-CZ 4.49Å; R155-F159 WeakPolarHBondContact O-CD2 3.12Å; R155-F159 PolarHBondContact O-N 3.31Å; Y156-F159 PolarHBondContact O-N 3.37Å; F159-L162 PolarHBondContact O-N 2.87Å; F159-N163 WeakPolarHBondContact O-CB 3.32Å; F159-N163 PolarHBondContact O-N 2.67Å; F159-L177 HydrophobicContact CB-CD2 3.96Å; F159-L199 HydrophobicContact CB-CD2 3.94Å; F159-L199 HydrophobicContact CD1-CD2 3.72Å; F159-L199 HydrophobicContact CD2-CD1 4.07Å; F159-L199 HydrophobicContact CD2-CD2 3.83Å; F159-L199 HydrophobicContact CE1-CB 4.35Å; F159-L199 HydrophobicContact CE1-CD2 4.05Å; F159-L199 HydrophobicContact CE2-CD1 3.84Å; F159-L199 HydrophobicContact CE2-CD2 4.18Å; F159-L199 HydrophobicContact CE2-CG 4.46Å; F159-L199 HydrophobicContact CG-CD2 3.58Å; F159-L199 HydrophobicContact CZ-CB 4.28Å; F159-L199 HydrophobicContact CZ-CD1 4.22Å; F159-L199 HydrophobicContact CZ-CD2 4.26Å; F159-L199 HydrophobicContact CZ-CG 4.48Å; F159-F202 AromaticContact CD1-CD1 3.71Å; F159-F202 HydrophobicContact CD1-CD1 3.71Å; F159-F202 AromaticContact CD1-CE1 3.75Å; F159-F202 HydrophobicContact CD1-CE1 3.75Å; F159-F202 HydrophobicContact CE1-CD1 4.13Å; F159-F202 HydrophobicContact CE1-CE1 4.42Å; F159-L203 HydrophobicContact CE1-CD1 4.04Å; F159-L203 HydrophobicContact CE1-CD2 4.04Å; F159-L203 HydrophobicContact CE1-CG 3.93Å; F159-L203 HydrophobicContact CZ-CD1 4.29Å; F159-F221 HydrophobicContact CD1-CE1 4.17Å; F159-F221 HydrophobicContact CD1-CE2 4.45Å; F159-F221 AromaticContact CD1-CZ 3.59Å; F159-F221 HydrophobicContact CD1-CZ 3.59Å; F159-F221 HydrophobicContact CD2-CZ 4Å; F159-F221 AromaticContact CE1-CE1 3.87Å; F159-F221 HydrophobicContact CE1-CE1 3.87Å; F159-F221 AromaticContact CE1-CZ 3.58Å; F159-F221 HydrophobicContact CE1-CZ 3.58Å; F159-F221 AromaticContact CE2-CZ 3.98Å; F159-F221 HydrophobicContact CE2-CZ 3.98Å; F159-F221 HydrophobicContact CG-CE2 4.37Å; F159-F221 AromaticContact CG-CZ 3.82Å; F159-F221 HydrophobicContact CG-CZ 3.82Å; F159-F221 HydrophobicContact CZ-CE1 4.25Å; F159-F221 AromaticContact CZ-CZ 3.79Å; F159-F221 HydrophobicContact CZ-CZ 3.79Å |
| 160 | S | 94 | Very high | 93.3 | Very high | 10 Ų | 10 | 43 Ų | 43 | 7% | 0.07 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -59 | -54.1 | 173.2 | -168.2 | 0 | 0 | 0 | 0 | 110.1 | Y156 T157 L162 N163 D164 K180 | Y156-S160 PolarHBondContact O-N 2.89Å; T157-S160 WeakPolarHBondContact O-CB 3.46Å; T157-S160 PolarHBondContact O-N 3.3Å; S160-L162 VanDerWaalsContact C-N 3.3Å; S160-L162 PolarHBondContact O-N 2.99Å; S160-N163 PolarHBondContact O-N 2.9Å; S160-N163 VanDerWaalsContact O-N 3.08Å; S160-D164 WeakPolarHBondContact O-CB 3.38Å; S160-D164 PolarHBondContact O-N 2.77Å; S160-D164 PolarHBondContact OG-OD2 2.9Å; S160-K180 PolarHBondContact OG-NZ 3.46Å |
| 161 | R | 92.6 | Very high | 93.2 | Very high | 110 Ų | 110 | 47 Ų | 47 | 42% | 0.415 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -56.2 | -41.7 | 179.8 | -72.4 | 163 | 171.5 | 168.6 | -10.8 | 112.8 | T157 D158 D164 K165 | T157-R161 WeakPolarHBondContact O-CG 3.43Å; T157-R161 PolarHBondContact O-N 2.88Å; D158-R161 PolarHBondContact O-N 3.33Å; D158-R161 IonicContact OD1-NH1 3.37Å; D158-R161 PolarHBondContact OD1-NH1 2.89Å; D158-R161 VanDerWaalsContact OD1-NH1 3.09Å; R161-D164 PolarHBondContact O-N 2.89Å; R161-K165 PolarHBondContact O-N 3.32Å |
| 162 | L | 94.6 | Very high | 93.1 | Very high | 5 Ų | 5 | 49.3 Ų | 49.3 | 3% | 0.026 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -63 | -49.7 | 174.5 | 176.9 | 61.3 | 0 | 0 | 0 | 111.4 | D158 F159 S160 D164 K165 L166 F202 L206 P217 V218 F221 | D158-L162 WeakPolarHBondContact O-CB 3.17Å; D158-L162 PolarHBondContact O-N 2.84Å; F159-L162 PolarHBondContact O-N 2.87Å; S160-L162 VanDerWaalsContact C-N 3.3Å; S160-L162 PolarHBondContact O-N 2.99Å; L162-D164 VanDerWaalsContact C-N 3.25Å; L162-D164 PolarHBondContact O-N 3.01Å; L162-K165 PolarHBondContact O-N 3.12Å; L162-L166 HydrophobicContact CD1-CD1 3.88Å; L162-L166 HydrophobicContact CD1-CG 4.06Å; L162-L166 HydrophobicContact CD2-CD1 4.47Å; L162-L166 HydrophobicContact CG-CD1 3.79Å; L162-L166 HydrophobicContact CG-CG 4.39Å; L162-L166 WeakPolarHBondContact O-CB 3.42Å; L162-L166 VanDerWaalsContact O-CG 3.22Å; L162-L166 WeakPolarHBondContact O-CG 3.44Å; L162-L166 PolarHBondContact O-N 2.83Å; L162-F202 HydrophobicContact CD2-CE1 4.08Å; L162-F202 HydrophobicContact CD2-CZ 4.19Å; L162-F202 HydrophobicContact CG-CZ 4.4Å; L162-L206 HydrophobicContact CD2-CD2 3.9Å; L162-P217 HydrophobicContact CD1-CB 3.67Å; L162-P217 WeakPolarHBondContact CD1-O 3.22Å; L162-V218 HydrophobicContact CD1-CG2 4.04Å; L162-F221 HydrophobicContact CB-CD2 4.23Å; L162-F221 HydrophobicContact CD1-CB 4.49Å; L162-F221 HydrophobicContact CD2-CB 3.9Å; L162-F221 HydrophobicContact CD2-CD1 3.77Å; L162-F221 HydrophobicContact CD2-CD2 3.97Å; L162-F221 HydrophobicContact CD2-CE1 4.28Å; L162-F221 HydrophobicContact CD2-CE2 4.44Å; L162-F221 HydrophobicContact CD2-CG 3.61Å |
| 163 | N | 95.1 | Very high | 93.1 | Very high | 7 Ų | 7 | 50.8 Ų | 50.8 | 4% | 0.037 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -60.6 | -37.4 | 177.7 | -167.8 | 10.5 | 0 | 0 | 0 | 111.8 | F159 S160 L166 K167 L175 L177 F202 | F159-N163 WeakPolarHBondContact O-CB 3.32Å; F159-N163 PolarHBondContact O-N 2.67Å; S160-N163 PolarHBondContact O-N 2.9Å; S160-N163 VanDerWaalsContact O-N 3.08Å; N163-L166 PolarHBondContact O-N 2.82Å; N163-K167 VanDerWaalsContact CG-CE 3.46Å; N163-K167 WeakPolarHBondContact O-CE 3.47Å; N163-K167 VanDerWaalsContact O-CG 3.29Å; N163-K167 WeakPolarHBondContact O-CG 3.42Å; N163-K167 PolarHBondContact O-N 3.31Å; N163-K167 VanDerWaalsContact OD1-CE 3.22Å; N163-K167 WeakPolarHBondContact OD1-CE 3.21Å; N163-L175 PolarHBondContact ND2-O 3.27Å; N163-L175 PolarHBondContact OD1-O 2.97Å; N163-L177 HydrophobicContact CB-CD1 3.69Å; N163-L177 HydrophobicContact CB-CG 4.31Å; N163-L177 WeakPolarHBondContact ND2-CD1 3.43Å; N163-F202 HydrophobicContact CB-CE2 3.78Å; N163-F202 HydrophobicContact CB-CZ 4.17Å |
| 164 | D | 93.5 | Very high | 92.9 | Very high | 71 Ų | 71 | 60.9 Ų | 60.9 | 38% | 0.38 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -70.3 | -43.8 | -179.9 | -61.1 | -36.3 | 0 | 0 | 0 | 110.8 | S160 R161 L162 L166 K167 E168 | S160-D164 WeakPolarHBondContact O-CB 3.38Å; S160-D164 PolarHBondContact O-N 2.77Å; S160-D164 PolarHBondContact OG-OD2 2.9Å; R161-D164 PolarHBondContact O-N 2.89Å; L162-D164 VanDerWaalsContact C-N 3.25Å; L162-D164 PolarHBondContact O-N 3.01Å; D164-L166 VanDerWaalsContact C-N 3.32Å; D164-L166 PolarHBondContact O-N 2.83Å; D164-K167 PolarHBondContact O-N 2.87Å; D164-K167 IonicContact OD1-NZ 2.9Å; D164-K167 PolarHBondContact OD1-NZ 3.02Å; D164-E168 PolarHBondContact O-N 3.34Å |
| 165 | K | 92.8 | Very high | 92.8 | Very high | 88 Ų | 88 | 60.6 Ų | 60.6 | 38% | 0.383 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -56 | -42.6 | 166.9 | -77.9 | -173.4 | 176.2 | -170.2 | 0 | 112.2 | R161 L162 E168 M169 P217 E220 | R161-K165 PolarHBondContact O-N 3.32Å; L162-K165 PolarHBondContact O-N 3.12Å; K165-E168 WeakPolarHBondContact O-CB 3.09Å; K165-E168 PolarHBondContact O-N 2.98Å; K165-M169 WeakPolarHBondContact O-CG 3.3Å; K165-M169 PolarHBondContact O-N 2.92Å; K165-M169 VanDerWaalsContact O-N 3.08Å; K165-P217 HydrophobicContact CD-CB 3.74Å; K165-P217 HydrophobicContact CD-CG 3.77Å; K165-E220 IonicContact NZ-OE2 2.66Å; K165-E220 PolarHBondContact NZ-OE2 3.01Å |
| 166 | L | 94.8 | Very high | 92.7 | Very high | 2 Ų | 2 | 63.3 Ų | 63.3 | 1% | 0.01 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -70.5 | -32 | -175.8 | -73.7 | 169.9 | 0 | 0 | 0 | 113.3 | L162 N163 D164 E168 F170 L175 L206 I212 V218 | L162-L166 HydrophobicContact CD1-CD1 3.88Å; L162-L166 HydrophobicContact CD1-CG 4.06Å; L162-L166 HydrophobicContact CD2-CD1 4.47Å; L162-L166 HydrophobicContact CG-CD1 3.79Å; L162-L166 HydrophobicContact CG-CG 4.39Å; L162-L166 WeakPolarHBondContact O-CB 3.42Å; L162-L166 VanDerWaalsContact O-CG 3.22Å; L162-L166 WeakPolarHBondContact O-CG 3.44Å; L162-L166 PolarHBondContact O-N 2.83Å; N163-L166 PolarHBondContact O-N 2.82Å; D164-L166 VanDerWaalsContact C-N 3.32Å; D164-L166 PolarHBondContact O-N 2.83Å; L166-E168 VanDerWaalsContact C-N 3.32Å; L166-F170 HydrophobicContact CD2-CD2 3.81Å; L166-F170 HydrophobicContact CD2-CE2 3.79Å; L166-F170 WeakPolarHBondContact O-CA 3.37Å; L166-F170 WeakPolarHBondContact O-CB 3.44Å; L166-F170 PolarHBondContact O-N 3.3Å; L166-L175 HydrophobicContact CD1-CD1 3.98Å; L166-L206 HydrophobicContact CD1-CD1 3.36Å; L166-I212 HydrophobicContact CD2-CG2 4.1Å; L166-V218 HydrophobicContact CD1-CG2 4.43Å; L166-V218 HydrophobicContact CD2-CG2 4.32Å |
| 167 | K | 94.3 | Very high | 92.7 | Very high | 90 Ų | 90 | 63.7 Ų | 63.7 | 39% | 0.391 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -66 | -35.7 | 172.8 | -68.2 | 159.5 | -158 | 164.8 | 0 | 112.2 | N163 D164 P171 | N163-K167 VanDerWaalsContact CG-CE 3.46Å; N163-K167 WeakPolarHBondContact O-CE 3.47Å; N163-K167 VanDerWaalsContact O-CG 3.29Å; N163-K167 WeakPolarHBondContact O-CG 3.42Å; N163-K167 PolarHBondContact O-N 3.31Å; N163-K167 VanDerWaalsContact OD1-CE 3.22Å; N163-K167 WeakPolarHBondContact OD1-CE 3.21Å; D164-K167 PolarHBondContact O-N 2.87Å; D164-K167 IonicContact OD1-NZ 2.9Å; D164-K167 PolarHBondContact OD1-NZ 3.02Å; K167-P171 VanDerWaalsContact O-CA 3.29Å; K167-P171 WeakPolarHBondContact O-CA 3.01Å |
| 168 | E | 93.9 | Very high | 92.8 | Very high | 164 Ų | 164 | 61.6 Ų | 61.6 | 77% | 0.766 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -68.4 | -48.7 | 177.2 | -174.5 | -177.8 | 175.3 | 0 | 0 | 110.8 | D164 K165 L166 | D164-E168 PolarHBondContact O-N 3.34Å; K165-E168 WeakPolarHBondContact O-CB 3.09Å; K165-E168 PolarHBondContact O-N 2.98Å; L166-E168 VanDerWaalsContact C-N 3.32Å |
| 169 | M | 93.8 | Very high | 92.6 | Very high | 98 Ų | 98 | 65.7 Ų | 65.7 | 48% | 0.483 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -71.3 | -33.2 | 178.6 | -66.3 | 179.5 | 67.8 | 0 | 0 | 113.8 | K165 C215 P217 | K165-M169 WeakPolarHBondContact O-CG 3.3Å; K165-M169 PolarHBondContact O-N 2.92Å; K165-M169 VanDerWaalsContact O-N 3.08Å; M169-C215 HydrophobicContact CE-CB 4.29Å; M169-P217 HydrophobicContact SD-CG 3.75Å |
| 170 | F | 94.8 | Very high | 92.2 | Very high | 55 Ų | 55 | 70.4 Ų | 70.4 | 24% | 0.241 | 36% | 0.364 | C | S | . | . | trans | -135.1 | 69.5 | -172 | -52.8 | -80.3 | 0 | 0 | 0 | 111.1 | L166 G172 F173 I212 C215 | L166-F170 HydrophobicContact CD2-CD2 3.81Å; L166-F170 HydrophobicContact CD2-CE2 3.79Å; L166-F170 WeakPolarHBondContact O-CA 3.37Å; L166-F170 WeakPolarHBondContact O-CB 3.44Å; L166-F170 PolarHBondContact O-N 3.3Å; F170-G172 PolarHBondContact O-N 2.84Å; F170-F173 HydrophobicContact CB-CB 3.83Å; F170-F173 WeakPolarHBondContact O-CB 3.32Å; F170-F173 PolarHBondContact O-N 3.06Å; F170-I212 HydrophobicContact CD1-CG1 4.16Å; F170-I212 HydrophobicContact CD2-CG1 3.94Å; F170-I212 HydrophobicContact CE1-CG1 4.11Å; F170-I212 HydrophobicContact CE2-CG1 3.9Å; F170-I212 HydrophobicContact CG-CG1 4.07Å; F170-I212 HydrophobicContact CZ-CG1 3.98Å; F170-C215 HydrophobicContact CE2-CB 4.18Å; F170-C215 HydrophobicContact CZ-CB 4.06Å | ||
| 171 | P | 91.8 | Very high | 91.8 | Very high | 101 Ų | 101 | 72.3 Ų | 72.3 | 66% | 0.656 | 37% | 0.37 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.4 | -18.7 | -172.4 | 23.3 | -34.7 | 0 | 0 | 0 | 115.2 | K167 | K167-P171 VanDerWaalsContact O-CA 3.29Å; K167-P171 WeakPolarHBondContact O-CA 3.01Å |
| 172 | G | 91 | Very high | 90.9 | Very high | 79 Ų | 79 | 76.4 Ų | 76.4 | 81% | 0.814 | 39% | 0.386 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.3 | -16.9 | 170.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | F170 | F170-G172 PolarHBondContact O-N 2.84Š|
| 173 | F | 91.4 | Very high | 89.6 | Confident | 33 Ų | 33 | 85.6 Ų | 85.6 | 15% | 0.145 | 43% | 0.426 | C | S | . | . | trans | -95.9 | 134.7 | -178.9 | -178.9 | -121.3 | 0 | 0 | 0 | 110.6 | F170 L175 H209 I212 | F170-F173 HydrophobicContact CB-CB 3.83Å; F170-F173 WeakPolarHBondContact O-CB 3.32Å; F170-F173 PolarHBondContact O-N 3.06Å; F173-L175 HydrophobicContact CD1-CG 4.33Å; F173-L175 HydrophobicContact CE1-CD1 3.52Å; F173-L175 HydrophobicContact CE1-CD2 4.07Å; F173-L175 HydrophobicContact CE1-CG 3.46Å; F173-L175 VanDerWaalsContact CE1-CG 3.46Å; F173-L175 HydrophobicContact CE2-CD2 4.3Å; F173-L175 HydrophobicContact CE2-CG 4.41Å; F173-L175 HydrophobicContact CZ-CD1 3.86Å; F173-L175 HydrophobicContact CZ-CD2 3.57Å; F173-L175 HydrophobicContact CZ-CG 3.52Å; F173-H209 AromaticContact CE2-CD2 3.42Å; F173-H209 VanDerWaalsContact CE2-CD2 3.42Å; F173-H209 WeakPolarHBondContact CE2-CD2 3.44Å; F173-H209 AromaticContact CE2-NE2 3.66Å; F173-H209 AromaticContact CZ-CD2 3.97Å; F173-I212 HydrophobicContact CB-CD1 4.21Å; F173-I212 HydrophobicContact CD1-CD1 3.54Å; F173-I212 HydrophobicContact CD1-CG1 4.21Å; F173-I212 HydrophobicContact CD1-CG2 4.44Å; F173-I212 HydrophobicContact CD2-CD1 3.82Å; F173-I212 HydrophobicContact CE1-CD1 3.68Å; F173-I212 HydrophobicContact CE1-CG1 4.26Å; F173-I212 HydrophobicContact CE1-CG2 3.77Å; F173-I212 HydrophobicContact CE2-CD1 3.97Å; F173-I212 HydrophobicContact CG-CD1 3.6Å; F173-I212 HydrophobicContact CZ-CD1 3.89Å; F173-I212 HydrophobicContact CZ-CG2 4.28Å | ||
| 174 | R | 88.5 | Confident | 89 | Confident | 223 Ų | 223 | 92.4 Ų | 92.4 | 84% | 0.842 | 46% | 0.455 | S | S | * | . | trans | -134.1 | 97.5 | -172.8 | -66.6 | -175.1 | 178.6 | -173.6 | -0.5 | 111.3 | ||||
| 175 | L | 89.3 | Confident | 88.5 | Confident | 12 Ų | 12 | 93.7 Ų | 93.7 | 6% | 0.063 | 46% | 0.462 | C | S | . | . | trans | -84.8 | 123.8 | 169.5 | -72.4 | 172.9 | 0 | 0 | 0 | 111.2 | N163 L166 F173 F202 N205 L206 | N163-L175 PolarHBondContact ND2-O 3.27Å; N163-L175 PolarHBondContact OD1-O 2.97Å; L166-L175 HydrophobicContact CD1-CD1 3.98Å; F173-L175 HydrophobicContact CD1-CG 4.33Å; F173-L175 HydrophobicContact CE1-CD1 3.52Å; F173-L175 HydrophobicContact CE1-CD2 4.07Å; F173-L175 HydrophobicContact CE1-CG 3.46Å; F173-L175 VanDerWaalsContact CE1-CG 3.46Å; F173-L175 HydrophobicContact CE2-CD2 4.3Å; F173-L175 HydrophobicContact CE2-CG 4.41Å; F173-L175 HydrophobicContact CZ-CD1 3.86Å; F173-L175 HydrophobicContact CZ-CD2 3.57Å; F173-L175 HydrophobicContact CZ-CG 3.52Å; L175-F202 HydrophobicContact CB-CD2 3.71Å; L175-F202 HydrophobicContact CB-CE2 3.59Å; L175-F202 HydrophobicContact CD1-CD2 3.96Å; L175-F202 HydrophobicContact CD1-CE2 3.45Å; L175-F202 VanDerWaalsContact CD1-CE2 3.45Å; L175-F202 HydrophobicContact CD1-CZ 3.77Å; L175-F202 HydrophobicContact CG-CD2 4.26Å; L175-F202 HydrophobicContact CG-CE2 4.08Å; L175-N205 HydrophobicContact CD2-CB 3.41Å; L175-N205 VanDerWaalsContact CD2-CB 3.41Å; L175-L206 HydrophobicContact CD1-CB 4.21Å; L175-L206 HydrophobicContact CD1-CD1 3.63Å | ||
| 176 | S | 90 | Very high | 88.1 | Confident | 84 Ų | 84 | 91.9 Ų | 91.9 | 59% | 0.587 | 46% | 0.456 | S | S | * | . | trans | -72.1 | 135.9 | 164.6 | 46.7 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 177 | L | 93 | Very high | 87.9 | Confident | 36 Ų | 36 | 95.7 Ų | 95.7 | 19% | 0.188 | 47% | 0.471 | C | S | . | . | trans | -111.7 | 149.2 | 164.4 | -79.8 | 171.9 | 0 | 0 | 0 | 108.8 | F159 N163 L199 F202 | F159-L177 HydrophobicContact CB-CD2 3.96Å; N163-L177 HydrophobicContact CB-CD1 3.69Å; N163-L177 HydrophobicContact CB-CG 4.31Å; N163-L177 WeakPolarHBondContact ND2-CD1 3.43Å; L177-L199 HydrophobicContact CD2-CD2 3.83Å; L177-F202 HydrophobicContact CD2-CB 4.14Å; L177-F202 HydrophobicContact CD2-CD1 4.3Å; L177-F202 HydrophobicContact CD2-CD2 3.32Å; L177-F202 HydrophobicContact CD2-CE2 3.71Å; L177-F202 HydrophobicContact CD2-CG 3.66Å; L177-F202 HydrophobicContact CD2-CZ 4.35Å; L177-F202 HydrophobicContact CG-CD2 3.8Å; L177-F202 HydrophobicContact CG-CE2 3.98Å | ||
| 178 | P | 92.9 | Very high | 87.8 | Confident | 15 Ų | 15 | 94.1 Ų | 94.1 | 10% | 0.097 | 47% | 0.467 | C | S | . | . | P | Polyproline II helix | trans | -58.6 | 148 | 166.2 | 24 | -29.9 | 0 | 0 | 0 | 109.9 | Y156 R195 L199 | Y156-P178 HydrophobicContact CE2-CG 4.19Å; Y156-P178 WeakPolarHBondContact CE2-O 3.41Å; Y156-P178 PolarHBondContact OH-O 3.48Å; P178-R195 HydrophobicContact CB-CG 4.39Å; P178-R195 HydrophobicContact CG-CG 3.97Å; P178-L199 HydrophobicContact CG-CD2 4.04Å; P178-L199 HydrophobicContact CG-CG 4Å |
| 179 | P | 88.1 | Confident | 87.8 | Confident | 97 Ų | 97 | 88.9 Ų | 88.9 | 63% | 0.63 | 45% | 0.449 | S | S | * | . | P | Polyproline II helix | trans | -65.2 | 155.4 | -166.9 | 22.6 | -32.9 | 0 | 0 | 0 | 114.8 | R195 | P179-R195 PolarHBondContact O-NH2 2.88Š|
| 180 | K | 87.1 | Confident | 87.8 | Confident | 98 Ų | 98 | 89.8 Ų | 89.8 | 43% | 0.426 | 46% | 0.456 | S | S | . | . | P | Polyproline II helix | trans | -70.8 | 128.4 | 162.9 | -74.9 | 172 | -176.9 | 170.4 | 0 | 108.1 | Y156 S160 W182 | Y156-K180 HydrophobicContact CE1-CD 4.38Å; Y156-K180 HydrophobicContact CE1-CG 3.55Å; S160-K180 PolarHBondContact OG-NZ 3.46Å; K180-W182 HydrophobicContact CB-CZ2 4.08Å; K180-W182 VanDerWaalsContact CB-NE1 3.34Å; K180-W182 HydrophobicContact CD-CZ2 3.92Å |
| 181 | R | 84.2 | Confident | 87.8 | Confident | 50 Ų | 50 | 88 Ų | 88 | 19% | 0.189 | 45% | 0.447 | C | S | . | . | trans | -103 | 92.6 | -175.9 | -179.3 | 158 | 159.3 | 154 | -12.8 | 109.5 | K184 D185 N186 D188 F191 | R181-K184 HydrophobicContact CG-CB 4.07Å; R181-K184 VanDerWaalsContact NE-CB 3.28Å; R181-D185 PolarHBondContact NE-O 3.33Å; R181-D185 PolarHBondContact NH2-O 3.06Å; R181-N186 PolarHBondContact O-ND2 3.18Å; R181-D188 IonicContact CZ-OD1 2.69Å; R181-D188 IonicContact NH1-OD1 2.82Å; R181-D188 PolarHBondContact NH1-OD1 2.67Å; R181-D188 VanDerWaalsContact NH2-CB 3.26Å; R181-D188 VanDerWaalsContact NH2-CG 3.33Å; R181-D188 IonicContact NH2-OD1 3.89Å; R181-D188 PolarHBondContact NH2-OD1 2.96Å; R181-F191 HydrophobicContact CB-CE1 4.05Å; R181-F191 HydrophobicContact CB-CE2 3.83Å; R181-F191 HydrophobicContact CB-CZ 3.4Å; R181-F191 VanDerWaalsContact CD-CD2 3.45Å; R181-F191 HydrophobicContact CG-CE1 4.35Å; R181-F191 HydrophobicContact CG-CE2 4.23Å; R181-F191 HydrophobicContact CG-CZ 4.01Å; R181-F191 VanDerWaalsContact NH1-CB 3.27Å | ||
| 182 | W | 75.2 | Confident | 87.9 | Confident | 196 Ų | 196 | 83.2 Ų | 83.2 | 74% | 0.742 | 42% | 0.416 | S | S | * | . | trans | -86.6 | -25.5 | -171 | -55.4 | 89.7 | 0 | 0 | 0 | 114.3 | K180 | K180-W182 HydrophobicContact CB-CZ2 4.08Å; K180-W182 VanDerWaalsContact CB-NE1 3.34Å; K180-W182 HydrophobicContact CD-CZ2 3.92Å | ||
| 183 | F | 65.4 | Low | 88.1 | Confident | 199 Ų | 199 | 84 Ų | 84 | 87% | 0.873 | 40% | 0.399 | S | S | * | . | S | Bend | trans | -127.5 | 22.7 | -165 | -57.1 | -63.8 | 0 | 0 | 0 | 114.6 | ||
| 184 | K | 82.8 | Confident | 88.3 | Confident | 150 Ų | 150 | 87.9 Ų | 87.9 | 65% | 0.652 | 42% | 0.421 | S | S | * | . | S | Bend | trans | -150.8 | 163.3 | 177.5 | -73.8 | -169.3 | 178.5 | -173.7 | 0 | 109.9 | R181 N186 | R181-K184 HydrophobicContact CG-CB 4.07Å; R181-K184 VanDerWaalsContact NE-CB 3.28Å; K184-N186 PolarHBondContact O-N 3.16Å; K184-N186 PolarHBondContact O-ND2 3.46Å |
| 185 | D | 83.9 | Confident | 88.7 | Confident | 98 Ų | 98 | 77.9 Ų | 77.9 | 52% | 0.524 | 38% | 0.384 | S | S | . | . | trans | -50.1 | 132.8 | 171 | -174.6 | -0.6 | 0 | 0 | 0 | 110.9 | R181 Y187 | R181-D185 PolarHBondContact NE-O 3.33Å; R181-D185 PolarHBondContact NH2-O 3.06Å; D185-Y187 WeakPolarHBondContact OD1-CD2 3.42Å; D185-Y187 PolarHBondContact OD1-N 2.79Å | ||
| 186 | N | 84.5 | Confident | 89.1 | Confident | 49 Ų | 49 | 79.2 Ų | 79.2 | 26% | 0.262 | 39% | 0.389 | S | S | . | . | S | Bend | trans | -89.7 | -4.1 | 180 | -89.3 | -102.5 | 0 | 0 | 0 | 113.6 | R181 K184 L192 | R181-N186 PolarHBondContact O-ND2 3.18Å; K184-N186 PolarHBondContact O-N 3.16Å; K184-N186 PolarHBondContact O-ND2 3.46Å; N186-L192 VanDerWaalsContact O-CD2 3.32Å; N186-L192 WeakPolarHBondContact O-CD2 3.31Å |
| 187 | Y | 89.3 | Confident | 89.4 | Confident | 83 Ų | 83 | 80.9 Ų | 80.9 | 33% | 0.325 | 39% | 0.391 | S | S | . | . | trans | -108.8 | 5.2 | -175.1 | -45.5 | -65.9 | 0 | 0 | 0 | 114.5 | V128 K134 D185 | V128-Y187 HydrophobicContact CG1-CD1 3.98Å; K134-Y187 HydrophobicContact CB-CE2 4.48Å; K134-Y187 HydrophobicContact CD-CD1 4.43Å; K134-Y187 HydrophobicContact CD-CD2 3.8Å; K134-Y187 HydrophobicContact CD-CE1 4.41Å; K134-Y187 HydrophobicContact CD-CE2 3.76Å; K134-Y187 HydrophobicContact CD-CG 4.16Å; K134-Y187 VanDerWaalsContact CE-CG 3.45Å; K134-Y187 HydrophobicContact CG-CD1 4.18Å; K134-Y187 HydrophobicContact CG-CD2 4.24Å; K134-Y187 HydrophobicContact CG-CE1 3.81Å; K134-Y187 HydrophobicContact CG-CE2 3.86Å; K134-Y187 HydrophobicContact CG-CG 4.41Å; K134-Y187 PolarHBondContact O-OH 3.09Å; D185-Y187 WeakPolarHBondContact OD1-CD2 3.42Å; D185-Y187 PolarHBondContact OD1-N 2.79Å | ||
| 188 | D | 92.8 | Very high | 89.7 | Confident | 56 Ų | 56 | 80.2 Ų | 80.2 | 30% | 0.299 | 39% | 0.393 | S | S | . | . | trans | -54.1 | 127.4 | 170 | 177.7 | -153.1 | 0 | 0 | 0 | 112.1 | R181 F191 L192 | R181-D188 IonicContact CZ-OD1 2.69Å; R181-D188 IonicContact NH1-OD1 2.82Å; R181-D188 PolarHBondContact NH1-OD1 2.67Å; R181-D188 VanDerWaalsContact NH2-CB 3.26Å; R181-D188 VanDerWaalsContact NH2-CG 3.33Å; R181-D188 IonicContact NH2-OD1 3.89Å; R181-D188 PolarHBondContact NH2-OD1 2.96Å; D188-F191 HydrophobicContact CB-CB 3.98Å; D188-F191 WeakPolarHBondContact O-CB 3.43Å; D188-F191 PolarHBondContact O-N 3.31Å; D188-F191 WeakPolarHBondContact OD1-CB 3.28Å; D188-L192 WeakPolarHBondContact O-CG 3.14Å; D188-L192 PolarHBondContact O-N 2.71Å | ||
| 189 | S | 93.4 | Very high | 89.9 | Confident | 55 Ų | 55 | 79.5 Ų | 79.5 | 39% | 0.385 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -65 | -55.7 | -168.9 | -156.9 | 0 | 0 | 0 | 0 | 112.1 | Y126 F191 L192 E193 | Y126-S189 PolarHBondContact OH-OG 2.92Å; S189-F191 PolarHBondContact O-N 2.72Å; S189-L192 PolarHBondContact O-N 3.25Å; S189-E193 WeakPolarHBondContact O-CG 3.03Å; S189-E193 PolarHBondContact O-N 3.41Å; S189-E193 PolarHBondContact OG-OE1 3.06Å |
| 190 | D | 93.8 | Very high | 90.4 | Very high | 117 Ų | 117 | 76.4 Ų | 76.4 | 63% | 0.626 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -47.3 | -39 | 176.9 | -55.7 | 16.9 | 0 | 0 | 0 | 111.4 | D194 | D190-D194 WeakPolarHBondContact O-CB 3.29Å; D190-D194 PolarHBondContact O-N 2.83Å |
| 191 | F | 94.8 | Very high | 90.9 | Very high | 16 Ų | 16 | 73.6 Ų | 73.6 | 7% | 0.07 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -75.6 | -38.2 | 178.8 | 170.7 | -107.9 | 0 | 0 | 0 | 114.7 | R181 D188 S189 E193 R195 | R181-F191 HydrophobicContact CB-CE1 4.05Å; R181-F191 HydrophobicContact CB-CE2 3.83Å; R181-F191 HydrophobicContact CB-CZ 3.4Å; R181-F191 VanDerWaalsContact CD-CD2 3.45Å; R181-F191 HydrophobicContact CG-CE1 4.35Å; R181-F191 HydrophobicContact CG-CE2 4.23Å; R181-F191 HydrophobicContact CG-CZ 4.01Å; R181-F191 VanDerWaalsContact NH1-CB 3.27Å; D188-F191 HydrophobicContact CB-CB 3.98Å; D188-F191 WeakPolarHBondContact O-CB 3.43Å; D188-F191 PolarHBondContact O-N 3.31Å; D188-F191 WeakPolarHBondContact OD1-CB 3.28Å; S189-F191 PolarHBondContact O-N 2.72Å; F191-E193 VanDerWaalsContact C-N 3.29Å; F191-R195 WeakPolarHBondContact O-CB 3.29Å; F191-R195 PolarHBondContact O-N 2.89Å |
| 192 | L | 94.7 | Very high | 91.5 | Very high | 1 Ų | 1 | 71.2 Ų | 71.2 | 1% | 0.005 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -70.2 | -31.2 | 174.8 | -68.8 | -175.9 | 0 | 0 | 0 | 111 | Y126 V128 T136 Y138 N186 D188 S189 Q196 | Y126-L192 HydrophobicContact CD1-CB 3.91Å; Y126-L192 HydrophobicContact CD2-CB 4.26Å; Y126-L192 HydrophobicContact CD2-CD1 3.74Å; Y126-L192 HydrophobicContact CE1-CB 3.51Å; Y126-L192 HydrophobicContact CE2-CB 3.89Å; Y126-L192 HydrophobicContact CE2-CD1 3.45Å; Y126-L192 VanDerWaalsContact CE2-CD1 3.45Å; Y126-L192 HydrophobicContact CE2-CG 4.32Å; Y126-L192 HydrophobicContact CG-CB 4.27Å; Y126-L192 HydrophobicContact CG-CD1 4.44Å; Y126-L192 VanDerWaalsContact CZ-CB 3.49Å; V128-L192 HydrophobicContact CG2-CD1 4.01Å; T136-L192 HydrophobicContact CG2-CD1 4.08Å; T136-L192 HydrophobicContact CG2-CD2 3.95Å; Y138-L192 WeakPolarHBondContact OH-CD2 3.4Å; N186-L192 VanDerWaalsContact O-CD2 3.32Å; N186-L192 WeakPolarHBondContact O-CD2 3.31Å; D188-L192 WeakPolarHBondContact O-CG 3.14Å; D188-L192 PolarHBondContact O-N 2.71Å; S189-L192 PolarHBondContact O-N 3.25Å; L192-Q196 VanDerWaalsContact O-CB 3.28Å; L192-Q196 WeakPolarHBondContact O-CB 3.41Å; L192-Q196 PolarHBondContact O-N 2.87Å |
| 193 | E | 95.4 | Very high | 92.6 | Very high | 97 Ų | 97 | 61.9 Ų | 61.9 | 45% | 0.453 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -69 | -51.5 | 171.2 | -68.2 | 171 | -127.6 | 0 | 0 | 111.7 | Y126 S189 F191 R195 Q196 L197 | Y126-E193 HydrophobicContact CE1-CG 4.25Å; S189-E193 WeakPolarHBondContact O-CG 3.03Å; S189-E193 PolarHBondContact O-N 3.41Å; S189-E193 PolarHBondContact OG-OE1 3.06Å; F191-E193 VanDerWaalsContact C-N 3.29Å; E193-R195 VanDerWaalsContact C-N 3.26Å; E193-R195 PolarHBondContact O-N 2.92Å; E193-Q196 WeakPolarHBondContact O-CB 3.08Å; E193-Q196 PolarHBondContact O-N 2.86Å; E193-Q196 VanDerWaalsContact O-N 3.09Å; E193-L197 WeakPolarHBondContact O-CG 3.22Å; E193-L197 PolarHBondContact O-N 3.01Å |
| 194 | D | 95.8 | Very high | 94 | Very high | 113 Ų | 113 | 57.8 Ų | 57.8 | 60% | 0.604 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -53.1 | -44.1 | 171.2 | -94.4 | -13.8 | 0 | 0 | 0 | 111.8 | D190 L197 G198 | D190-D194 WeakPolarHBondContact O-CB 3.29Å; D190-D194 PolarHBondContact O-N 2.83Å; D194-L197 PolarHBondContact O-N 3.43Å; D194-G198 PolarHBondContact O-N 2.66Å |
| 195 | R | 96.8 | Very high | 94.6 | Very high | 14 Ų | 14 | 54.4 Ų | 54.4 | 5% | 0.053 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -68.1 | -40 | 177.9 | -179.9 | 173.9 | -94 | 176 | -8.6 | 111.3 | Y138 Y156 P178 P179 F191 E193 G198 L199 | Y138-R195 HydrophobicContact CE1-CG 4.45Å; Y138-R195 WeakPolarHBondContact OH-CD 3.45Å; Y138-R195 WeakPolarHBondContact OH-CG 3.41Å; Y156-R195 HydrophobicContact CD2-CG 4.2Å; P178-R195 HydrophobicContact CB-CG 4.39Å; P178-R195 HydrophobicContact CG-CG 3.97Å; P179-R195 PolarHBondContact O-NH2 2.88Å; F191-R195 WeakPolarHBondContact O-CB 3.29Å; F191-R195 PolarHBondContact O-N 2.89Å; E193-R195 VanDerWaalsContact C-N 3.26Å; E193-R195 PolarHBondContact O-N 2.92Å; R195-G198 PolarHBondContact O-N 3.33Å; R195-L199 HydrophobicContact CG-CD1 4.08Å; R195-L199 HydrophobicContact CG-CG 4.33Å; R195-L199 WeakPolarHBondContact O-CB 3.37Å; R195-L199 VanDerWaalsContact O-CG 3.24Å; R195-L199 WeakPolarHBondContact O-CG 3.47Å; R195-L199 PolarHBondContact O-N 3.41Å |
| 196 | Q | 97.3 | Very high | 95.2 | Very high | 39 Ų | 39 | 49.7 Ų | 49.7 | 18% | 0.182 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -60.2 | -44 | 173.8 | 167.8 | 163.3 | -10.2 | 0 | 0 | 111.5 | V123 G125 Y138 L192 E193 L199 Q200 | V123-Q196 HydrophobicContact CB-CG 4.1Å; V123-Q196 HydrophobicContact CG1-CG 3.71Å; V123-Q196 PolarHBondContact O-NE2 2.64Å; V123-Q196 VanDerWaalsContact O-NE2 3.16Å; G125-Q196 VanDerWaalsContact CA-OE1 3.31Å; Y138-Q196 HydrophobicContact CD1-CB 4.48Å; Y138-Q196 HydrophobicContact CE1-CB 4.2Å; L192-Q196 VanDerWaalsContact O-CB 3.28Å; L192-Q196 WeakPolarHBondContact O-CB 3.41Å; L192-Q196 PolarHBondContact O-N 2.87Å; E193-Q196 WeakPolarHBondContact O-CB 3.08Å; E193-Q196 PolarHBondContact O-N 2.86Å; E193-Q196 VanDerWaalsContact O-N 3.09Å; Q196-L199 PolarHBondContact O-N 3.34Å; Q196-Q200 WeakPolarHBondContact O-CB 3.48Å; Q196-Q200 PolarHBondContact O-N 3.44Å |
| 197 | L | 97.2 | Very high | 95.7 | Very high | 120 Ų | 120 | 49 Ų | 49 | 63% | 0.628 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -61.4 | -46 | 175.1 | -67.7 | 172.8 | 0 | 0 | 0 | 111.6 | E193 D194 L199 Q200 A201 | E193-L197 WeakPolarHBondContact O-CG 3.22Å; E193-L197 PolarHBondContact O-N 3.01Å; D194-L197 PolarHBondContact O-N 3.43Å; L197-L199 VanDerWaalsContact C-N 3.35Å; L197-L199 PolarHBondContact O-N 3.03Å; L197-Q200 PolarHBondContact O-N 2.83Å; L197-A201 PolarHBondContact O-N 3.35Å |
| 198 | G | 97.8 | Very high | 95.8 | Very high | 21 Ų | 21 | 48.6 Ų | 48.6 | 22% | 0.216 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -62.7 | -37.3 | 176 | 0 | 0 | 0 | 0 | 0 | 113.7 | D194 R195 F202 | D194-G198 PolarHBondContact O-N 2.66Å; R195-G198 PolarHBondContact O-N 3.33Å; G198-F202 WeakPolarHBondContact O-CB 3.41Å; G198-F202 PolarHBondContact O-N 2.9Å |
| 199 | L | 98.1 | Very high | 95.7 | Very high | 0 Ų | 0 | 50.5 Ų | 50.5 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -72.2 | -33.2 | 175.3 | -68.2 | 177.5 | 0 | 0 | 0 | 112.2 | V123 Y138 Y156 F159 L177 P178 R195 Q196 L197 F202 L203 | V123-L199 HydrophobicContact CG2-CB 4.44Å; Y138-L199 HydrophobicContact CD1-CD1 3.8Å; Y138-L199 HydrophobicContact CD2-CD1 3.67Å; Y138-L199 HydrophobicContact CE1-CD1 3.85Å; Y138-L199 HydrophobicContact CE2-CD1 3.77Å; Y138-L199 HydrophobicContact CG-CD1 3.72Å; Y156-L199 HydrophobicContact CD2-CD2 4.33Å; F159-L199 HydrophobicContact CB-CD2 3.94Å; F159-L199 HydrophobicContact CD1-CD2 3.72Å; F159-L199 HydrophobicContact CD2-CD1 4.07Å; F159-L199 HydrophobicContact CD2-CD2 3.83Å; F159-L199 HydrophobicContact CE1-CB 4.35Å; F159-L199 HydrophobicContact CE1-CD2 4.05Å; F159-L199 HydrophobicContact CE2-CD1 3.84Å; F159-L199 HydrophobicContact CE2-CD2 4.18Å; F159-L199 HydrophobicContact CE2-CG 4.46Å; F159-L199 HydrophobicContact CG-CD2 3.58Å; F159-L199 HydrophobicContact CZ-CB 4.28Å; F159-L199 HydrophobicContact CZ-CD1 4.22Å; F159-L199 HydrophobicContact CZ-CD2 4.26Å; F159-L199 HydrophobicContact CZ-CG 4.48Å; L177-L199 HydrophobicContact CD2-CD2 3.83Å; P178-L199 HydrophobicContact CG-CD2 4.04Å; P178-L199 HydrophobicContact CG-CG 4Å; R195-L199 HydrophobicContact CG-CD1 4.08Å; R195-L199 HydrophobicContact CG-CG 4.33Å; R195-L199 WeakPolarHBondContact O-CB 3.37Å; R195-L199 VanDerWaalsContact O-CG 3.24Å; R195-L199 WeakPolarHBondContact O-CG 3.47Å; R195-L199 PolarHBondContact O-N 3.41Å; Q196-L199 PolarHBondContact O-N 3.34Å; L197-L199 VanDerWaalsContact C-N 3.35Å; L197-L199 PolarHBondContact O-N 3.03Å; L199-F202 PolarHBondContact O-N 2.95Å; L199-L203 WeakPolarHBondContact O-CB 3.17Å; L199-L203 WeakPolarHBondContact O-CG 3.43Å; L199-L203 PolarHBondContact O-N 2.88Å |
| 200 | Q | 98.2 | Very high | 95.6 | Very high | 33 Ų | 33 | 55.7 Ų | 55.7 | 15% | 0.154 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -66.1 | -41.5 | 172.4 | -179.9 | 61 | 86.5 | 0 | 0 | 111.8 | P121 T122 V123 Q196 L197 L203 Q204 | P121-Q200 PolarHBondContact O-NE2 2.8Å; P121-Q200 VanDerWaalsContact O-NE2 3.14Å; T122-Q200 VanDerWaalsContact CA-OE1 3.27Å; V123-Q200 HydrophobicContact CB-CB 4.49Å; V123-Q200 HydrophobicContact CG2-CB 3.89Å; Q196-Q200 WeakPolarHBondContact O-CB 3.48Å; Q196-Q200 PolarHBondContact O-N 3.44Å; L197-Q200 PolarHBondContact O-N 2.83Å; Q200-L203 PolarHBondContact O-N 3.36Å; Q200-Q204 WeakPolarHBondContact O-CG 3.47Å; Q200-Q204 PolarHBondContact O-N 2.97Å |
| 201 | A | 97.7 | Very high | 95.5 | Very high | 38 Ų | 38 | 56.3 Ų | 56.3 | 31% | 0.314 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -66.1 | -41.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112 | L197 L203 Q204 N205 | L197-A201 PolarHBondContact O-N 3.35Å; A201-L203 VanDerWaalsContact C-N 3.34Å; A201-L203 PolarHBondContact O-N 3.07Å; A201-Q204 PolarHBondContact O-N 3.13Å; A201-N205 PolarHBondContact O-N 2.92Å; A201-N205 PolarHBondContact O-ND2 3.38Å |
| 202 | F | 97.5 | Very high | 95.5 | Very high | 0 Ų | 0 | 56.2 Ų | 56.2 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -54.8 | -49.5 | 171.1 | 173.3 | -87.7 | 0 | 0 | 0 | 111.3 | F159 L162 N163 L175 L177 G198 L199 Q204 N205 L206 | F159-F202 AromaticContact CD1-CD1 3.71Å; F159-F202 HydrophobicContact CD1-CD1 3.71Å; F159-F202 AromaticContact CD1-CE1 3.75Å; F159-F202 HydrophobicContact CD1-CE1 3.75Å; F159-F202 HydrophobicContact CE1-CD1 4.13Å; F159-F202 HydrophobicContact CE1-CE1 4.42Å; L162-F202 HydrophobicContact CD2-CE1 4.08Å; L162-F202 HydrophobicContact CD2-CZ 4.19Å; L162-F202 HydrophobicContact CG-CZ 4.4Å; N163-F202 HydrophobicContact CB-CE2 3.78Å; N163-F202 HydrophobicContact CB-CZ 4.17Å; L175-F202 HydrophobicContact CB-CD2 3.71Å; L175-F202 HydrophobicContact CB-CE2 3.59Å; L175-F202 HydrophobicContact CD1-CD2 3.96Å; L175-F202 HydrophobicContact CD1-CE2 3.45Å; L175-F202 VanDerWaalsContact CD1-CE2 3.45Å; L175-F202 HydrophobicContact CD1-CZ 3.77Å; L175-F202 HydrophobicContact CG-CD2 4.26Å; L175-F202 HydrophobicContact CG-CE2 4.08Å; L177-F202 HydrophobicContact CD2-CB 4.14Å; L177-F202 HydrophobicContact CD2-CD1 4.3Å; L177-F202 HydrophobicContact CD2-CD2 3.32Å; L177-F202 HydrophobicContact CD2-CE2 3.71Å; L177-F202 HydrophobicContact CD2-CG 3.66Å; L177-F202 HydrophobicContact CD2-CZ 4.35Å; L177-F202 HydrophobicContact CG-CD2 3.8Å; L177-F202 HydrophobicContact CG-CE2 3.98Å; G198-F202 WeakPolarHBondContact O-CB 3.41Å; G198-F202 PolarHBondContact O-N 2.9Å; L199-F202 PolarHBondContact O-N 2.95Å; F202-Q204 PolarHBondContact O-N 3.3Å; F202-N205 PolarHBondContact O-N 2.92Å; F202-L206 HydrophobicContact CE1-CD2 4.19Å; F202-L206 VanDerWaalsContact O-CB 3.28Å; F202-L206 WeakPolarHBondContact O-CB 3.18Å; F202-L206 PolarHBondContact O-N 2.99Å |
| 203 | L | 97.3 | Very high | 95.5 | Very high | 0 Ų | 0 | 56.5 Ų | 56.5 | 0% | 0 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -64.8 | -36.9 | -179.4 | -76.4 | 169.2 | 0 | 0 | 0 | 113.6 | P121 V123 L140 F159 L199 Q200 A201 L206 V207 F221 L222 | P121-L203 HydrophobicContact CB-CB 4.39Å; P121-L203 HydrophobicContact CB-CD1 4.42Å; P121-L203 HydrophobicContact CB-CD2 4.22Å; P121-L203 HydrophobicContact CG-CB 4.01Å; P121-L203 HydrophobicContact CG-CD2 4.29Å; V123-L203 HydrophobicContact CG2-CD1 3.71Å; L140-L203 HydrophobicContact CD1-CD1 4.23Å; L140-L203 HydrophobicContact CD2-CD1 4.02Å; F159-L203 HydrophobicContact CE1-CD1 4.04Å; F159-L203 HydrophobicContact CE1-CD2 4.04Å; F159-L203 HydrophobicContact CE1-CG 3.93Å; F159-L203 HydrophobicContact CZ-CD1 4.29Å; L199-L203 WeakPolarHBondContact O-CB 3.17Å; L199-L203 WeakPolarHBondContact O-CG 3.43Å; L199-L203 PolarHBondContact O-N 2.88Å; Q200-L203 PolarHBondContact O-N 3.36Å; A201-L203 VanDerWaalsContact C-N 3.34Å; A201-L203 PolarHBondContact O-N 3.07Å; L203-L206 HydrophobicContact CD2-CD2 4.26Å; L203-L206 WeakPolarHBondContact O-CB 3.34Å; L203-L206 PolarHBondContact O-N 2.88Å; L203-V207 PolarHBondContact O-N 3.08Å; L203-F221 HydrophobicContact CD2-CE1 4.21Å; L203-L222 HydrophobicContact CD2-CD2 4.22Å |
| 204 | Q | 96.1 | Very high | 95.4 | Very high | 114 Ų | 114 | 55.8 Ų | 55.8 | 53% | 0.533 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -65.5 | -48.2 | 175.4 | -74.9 | 167.2 | -4.7 | 0 | 0 | 111.4 | Q200 A201 F202 L206 V207 A208 | Q200-Q204 WeakPolarHBondContact O-CG 3.47Å; Q200-Q204 PolarHBondContact O-N 2.97Å; A201-Q204 PolarHBondContact O-N 3.13Å; F202-Q204 PolarHBondContact O-N 3.3Å; Q204-L206 VanDerWaalsContact C-N 3.26Å; Q204-L206 PolarHBondContact O-N 3.15Å; Q204-V207 PolarHBondContact O-N 3.48Å; Q204-A208 WeakPolarHBondContact O-CB 3.42Å; Q204-A208 PolarHBondContact O-N 2.93Å; Q204-A208 VanDerWaalsContact O-N 3.15Å |
| 205 | N | 95.3 | Very high | 95.4 | Very high | 78 Ų | 78 | 51 Ų | 51 | 42% | 0.417 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -66.5 | -28.9 | 177.8 | -67.7 | -40.5 | 0 | 0 | 0 | 112.5 | L175 A201 F202 | L175-N205 HydrophobicContact CD2-CB 3.41Å; L175-N205 VanDerWaalsContact CD2-CB 3.41Å; A201-N205 PolarHBondContact O-N 2.92Å; A201-N205 PolarHBondContact O-ND2 3.38Å; F202-N205 PolarHBondContact O-N 2.92Å |
| 206 | L | 95.1 | Very high | 95.4 | Very high | 0 Ų | 0 | 55.4 Ų | 55.4 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -64.5 | -48.1 | 176.8 | -177.7 | 71 | 0 | 0 | 0 | 112.4 | L162 L166 L175 F202 L203 Q204 I212 V218 | L162-L206 HydrophobicContact CD2-CD2 3.9Å; L166-L206 HydrophobicContact CD1-CD1 3.36Å; L175-L206 HydrophobicContact CD1-CB 4.21Å; L175-L206 HydrophobicContact CD1-CD1 3.63Å; F202-L206 HydrophobicContact CE1-CD2 4.19Å; F202-L206 VanDerWaalsContact O-CB 3.28Å; F202-L206 WeakPolarHBondContact O-CB 3.18Å; F202-L206 PolarHBondContact O-N 2.99Å; L203-L206 HydrophobicContact CD2-CD2 4.26Å; L203-L206 WeakPolarHBondContact O-CB 3.34Å; L203-L206 PolarHBondContact O-N 2.88Å; Q204-L206 VanDerWaalsContact C-N 3.26Å; Q204-L206 PolarHBondContact O-N 3.15Å; L206-I212 HydrophobicContact CD1-CG2 3.78Å; L206-V218 HydrophobicContact CD1-CG2 3.73Å; L206-V218 HydrophobicContact CD2-CG1 3.95Å; L206-V218 HydrophobicContact CD2-CG2 4.14Å; L206-V218 HydrophobicContact CG-CG1 4.26Å; L206-V218 HydrophobicContact CG-CG2 4.13Å |
| 207 | V | 94.4 | Very high | 95.3 | Very high | 35 Ų | 35 | 54.1 Ų | 54.1 | 21% | 0.212 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -85.7 | -12.1 | -177.2 | -57.8 | 0 | 0 | 0 | 0 | 113.8 | I119 P121 L203 Q204 H209 L222 | I119-V207 WeakPolarHBondContact O-CG2 3.5Å; P121-V207 HydrophobicContact CG-CG1 3.78Å; P121-V207 HydrophobicContact CG-CG2 4.31Å; L203-V207 PolarHBondContact O-N 3.08Å; Q204-V207 PolarHBondContact O-N 3.48Å; V207-H209 PolarHBondContact O-N 3.27Å; V207-L222 HydrophobicContact CG1-CD1 4.44Å |
| 208 | A | 93.1 | Very high | 95.2 | Very high | 74 Ų | 74 | 48.4 Ų | 48.4 | 61% | 0.612 | 27% | 0.268 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63 | -22.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | Q204 | Q204-A208 WeakPolarHBondContact O-CB 3.42Å; Q204-A208 PolarHBondContact O-N 2.93Å; Q204-A208 VanDerWaalsContact O-N 3.15Å |
| 209 | H | 90.9 | Very high | 95.1 | Very high | 96 Ų | 96 | 52 Ų | 52 | 44% | 0.444 | 28% | 0.275 | S | S | . | . | S | Bend | trans | -108.8 | 115.8 | 178.2 | -63.5 | -84.6 | 0 | 0 | 0 | 110.4 | F173 V207 D211 I212 G213 | F173-H209 AromaticContact CE2-CD2 3.42Å; F173-H209 VanDerWaalsContact CE2-CD2 3.42Å; F173-H209 WeakPolarHBondContact CE2-CD2 3.44Å; F173-H209 AromaticContact CE2-NE2 3.66Å; F173-H209 AromaticContact CZ-CD2 3.97Å; V207-H209 PolarHBondContact O-N 3.27Å; H209-D211 VanDerWaalsContact C-N 3.34Å; H209-D211 PolarHBondContact O-N 2.78Å; H209-I212 HydrophobicContact CB-CB 4.15Å; H209-I212 HydrophobicContact CB-CD1 3.71Å; H209-I212 HydrophobicContact CB-CG1 4.44Å; H209-I212 PolarHBondContact O-N 3.16Å; H209-G213 PolarHBondContact O-N 3.04Å |
| 210 | K | 90.3 | Very high | 94.9 | Very high | 164 Ų | 164 | 56.6 Ų | 56.6 | 71% | 0.713 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -55.1 | -45.2 | -173 | -172.3 | 175.6 | -179.4 | 175.3 | 0 | 113.2 | I212 G213 N214 | K210-I212 VanDerWaalsContact C-N 3.33Å; K210-I212 PolarHBondContact O-N 3.25Å; K210-G213 PolarHBondContact O-N 3.44Å; K210-N214 WeakPolarHBondContact O-CB 3.42Å; K210-N214 PolarHBondContact O-N 3.32Å; K210-N214 VanDerWaalsContact O-N 3.09Å; K210-N214 PolarHBondContact O-ND2 3.48Å |
| 211 | D | 92.2 | Very high | 94.7 | Very high | 130 Ų | 130 | 55.8 Ų | 55.8 | 70% | 0.695 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -72.6 | -29.7 | -173 | -47.7 | -44.4 | 0 | 0 | 0 | 112.5 | H209 C215 | H209-D211 VanDerWaalsContact C-N 3.34Å; H209-D211 PolarHBondContact O-N 2.78Å; D211-C215 PolarHBondContact O-N 3.18Å |
| 212 | I | 94 | Very high | 94.6 | Very high | 13 Ų | 13 | 54 Ų | 54 | 7% | 0.067 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -78.9 | -46.4 | 174.2 | -71.5 | 147.9 | 0 | 0 | 0 | 110.3 | L166 F170 F173 L206 H209 K210 N214 C215 V218 | L166-I212 HydrophobicContact CD2-CG2 4.1Å; F170-I212 HydrophobicContact CD1-CG1 4.16Å; F170-I212 HydrophobicContact CD2-CG1 3.94Å; F170-I212 HydrophobicContact CE1-CG1 4.11Å; F170-I212 HydrophobicContact CE2-CG1 3.9Å; F170-I212 HydrophobicContact CG-CG1 4.07Å; F170-I212 HydrophobicContact CZ-CG1 3.98Å; F173-I212 HydrophobicContact CB-CD1 4.21Å; F173-I212 HydrophobicContact CD1-CD1 3.54Å; F173-I212 HydrophobicContact CD1-CG1 4.21Å; F173-I212 HydrophobicContact CD1-CG2 4.44Å; F173-I212 HydrophobicContact CD2-CD1 3.82Å; F173-I212 HydrophobicContact CE1-CD1 3.68Å; F173-I212 HydrophobicContact CE1-CG1 4.26Å; F173-I212 HydrophobicContact CE1-CG2 3.77Å; F173-I212 HydrophobicContact CE2-CD1 3.97Å; F173-I212 HydrophobicContact CG-CD1 3.6Å; F173-I212 HydrophobicContact CZ-CD1 3.89Å; F173-I212 HydrophobicContact CZ-CG2 4.28Å; L206-I212 HydrophobicContact CD1-CG2 3.78Å; H209-I212 HydrophobicContact CB-CB 4.15Å; H209-I212 HydrophobicContact CB-CD1 3.71Å; H209-I212 HydrophobicContact CB-CG1 4.44Å; H209-I212 PolarHBondContact O-N 3.16Å; K210-I212 VanDerWaalsContact C-N 3.33Å; K210-I212 PolarHBondContact O-N 3.25Å; I212-N214 PolarHBondContact O-N 2.69Å; I212-N214 VanDerWaalsContact O-N 3.16Å; I212-C215 PolarHBondContact O-N 2.87Å; I212-C215 PolarHBondContact O-SG 3.09Å; I212-V218 WeakPolarHBondContact O-CG2 3.36Å |
| 213 | G | 94.1 | Very high | 94.4 | Very high | 8 Ų | 8 | 54.8 Ų | 54.8 | 8% | 0.082 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -58.8 | -27.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | H209 K210 V218 | H209-G213 PolarHBondContact O-N 3.04Å; K210-G213 PolarHBondContact O-N 3.44Å; G213-V218 WeakPolarHBondContact O-CG1 3.25Å |
| 214 | N | 94.1 | Very high | 94.2 | Very high | 81 Ų | 81 | 55.2 Ų | 55.2 | 43% | 0.433 | 29% | 0.285 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -100.4 | 1.9 | 177.6 | -68.8 | -75.2 | 0 | 0 | 0 | 114.3 | K210 I212 R219 | K210-N214 WeakPolarHBondContact O-CB 3.42Å; K210-N214 PolarHBondContact O-N 3.32Å; K210-N214 VanDerWaalsContact O-N 3.09Å; K210-N214 PolarHBondContact O-ND2 3.48Å; I212-N214 PolarHBondContact O-N 2.69Å; I212-N214 VanDerWaalsContact O-N 3.16Å; N214-R219 WeakPolarHBondContact O-CD 3.16Å |
| 215 | C | 95.8 | Very high | 94.1 | Very high | 13 Ų | 13 | 54.4 Ų | 54.4 | 9% | 0.088 | 28% | 0.284 | C | S | . | . | S | Bend | trans | -73.5 | 149.8 | 178.8 | 82.5 | 0 | 0 | 0 | 0 | 111.3 | M169 F170 D211 I212 V218 R219 | M169-C215 HydrophobicContact CE-CB 4.29Å; F170-C215 HydrophobicContact CE2-CB 4.18Å; F170-C215 HydrophobicContact CZ-CB 4.06Å; D211-C215 PolarHBondContact O-N 3.18Å; I212-C215 PolarHBondContact O-N 2.87Å; I212-C215 PolarHBondContact O-SG 3.09Å; C215-V218 PolarHBondContact O-N 2.9Å; C215-R219 PolarHBondContact O-N 3.31Å; C215-R219 VanDerWaalsContact O-N 3.13Å |
| 216 | L | 96.1 | Very high | 93.8 | Very high | 107 Ų | 107 | 57.3 Ų | 57.3 | 56% | 0.56 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -50.6 | -46.9 | -172.6 | 176.6 | 64.8 | 0 | 0 | 0 | 114 | V218 R219 E220 | L216-V218 PolarHBondContact O-N 3.35Å; L216-V218 VanDerWaalsContact O-N 3.16Å; L216-R219 PolarHBondContact O-N 3Å; L216-R219 VanDerWaalsContact O-N 3.15Å; L216-E220 HydrophobicContact CD1-CG 4.12Å; L216-E220 HydrophobicContact CG-CG 4.31Å; L216-E220 WeakPolarHBondContact O-CB 3.46Å; L216-E220 WeakPolarHBondContact O-CG 3.42Å; L216-E220 PolarHBondContact O-N 3.15Å |
| 217 | P | 95.4 | Very high | 93.6 | Very high | 12 Ų | 12 | 59.8 Ų | 59.8 | 8% | 0.078 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -58.4 | -27.9 | 176.3 | -29.5 | 37.9 | 0 | 0 | 0 | 116 | L162 K165 M169 F221 | L162-P217 HydrophobicContact CD1-CB 3.67Å; L162-P217 WeakPolarHBondContact CD1-O 3.22Å; K165-P217 HydrophobicContact CD-CB 3.74Å; K165-P217 HydrophobicContact CD-CG 3.77Å; M169-P217 HydrophobicContact SD-CG 3.75Å; P217-F221 WeakPolarHBondContact O-CB 3.34Å; P217-F221 PolarHBondContact O-N 2.98Å |
| 218 | V | 96.3 | Very high | 93.4 | Very high | 0 Ų | 0 | 58.9 Ų | 58.9 | 0% | 0 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -82.9 | -37.5 | 178 | 177.9 | 0 | 0 | 0 | 0 | 110.7 | L162 L166 L206 I212 G213 C215 L216 F221 L222 | L162-V218 HydrophobicContact CD1-CG2 4.04Å; L166-V218 HydrophobicContact CD1-CG2 4.43Å; L166-V218 HydrophobicContact CD2-CG2 4.32Å; L206-V218 HydrophobicContact CD1-CG2 3.73Å; L206-V218 HydrophobicContact CD2-CG1 3.95Å; L206-V218 HydrophobicContact CD2-CG2 4.14Å; L206-V218 HydrophobicContact CG-CG1 4.26Å; L206-V218 HydrophobicContact CG-CG2 4.13Å; I212-V218 WeakPolarHBondContact O-CG2 3.36Å; G213-V218 WeakPolarHBondContact O-CG1 3.25Å; C215-V218 PolarHBondContact O-N 2.9Å; L216-V218 PolarHBondContact O-N 3.35Å; L216-V218 VanDerWaalsContact O-N 3.16Å; V218-F221 PolarHBondContact O-N 2.96Å; V218-L222 HydrophobicContact CG1-CD1 3.87Å; V218-L222 HydrophobicContact CG1-CG 4.37Å; V218-L222 WeakPolarHBondContact O-CB 3.39Å; V218-L222 PolarHBondContact O-N 2.8Å |
| 219 | R | 95.8 | Very high | 92.9 | Very high | 97 Ų | 97 | 56.4 Ų | 56.4 | 37% | 0.366 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -60.7 | -46.7 | 171.3 | -70.8 | 168 | 64.9 | 168.2 | 5.7 | 111.9 | N214 C215 L216 C223 L224 D225 | N214-R219 WeakPolarHBondContact O-CD 3.16Å; C215-R219 PolarHBondContact O-N 3.31Å; C215-R219 VanDerWaalsContact O-N 3.13Å; L216-R219 PolarHBondContact O-N 3Å; L216-R219 VanDerWaalsContact O-N 3.15Å; R219-C223 WeakPolarHBondContact O-CA 3.17Å; R219-C223 PolarHBondContact O-N 2.66Å; R219-L224 HydrophobicContact CB-CB 4.31Å; R219-L224 HydrophobicContact CB-CD1 4.4Å; R219-L224 HydrophobicContact CG-CB 4.22Å; R219-L224 HydrophobicContact CG-CD1 3.83Å; R219-L224 HydrophobicContact CG-CG 4.43Å; R219-L224 PolarHBondContact O-N 3.37Å; R219-D225 WeakPolarHBondContact CB-OD2 3.15Å; R219-D225 IonicContact CZ-OD1 3.31Å; R219-D225 IonicContact CZ-OD2 3.34Å; R219-D225 IonicContact NE-OD1 2.72Å; R219-D225 PolarHBondContact NE-OD1 2.92Å; R219-D225 IonicContact NE-OD2 2.64Å; R219-D225 PolarHBondContact NE-OD2 3.19Å; R219-D225 IonicContact NH2-OD1 2.93Å; R219-D225 PolarHBondContact NH2-OD1 3.45Å; R219-D225 IonicContact NH2-OD2 3.76Å; R219-D225 PolarHBondContact NH2-OD2 2.87Å |
| 220 | E | 93.6 | Very high | 92.2 | Very high | 96 Ų | 96 | 57.5 Ų | 57.5 | 45% | 0.449 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -55.1 | -53.7 | 168.8 | -71.2 | 171 | 177.2 | 0 | 0 | 111.1 | K165 L216 L222 C223 | K165-E220 IonicContact NZ-OE2 2.66Å; K165-E220 PolarHBondContact NZ-OE2 3.01Å; L216-E220 HydrophobicContact CD1-CG 4.12Å; L216-E220 HydrophobicContact CG-CG 4.31Å; L216-E220 WeakPolarHBondContact O-CB 3.46Å; L216-E220 WeakPolarHBondContact O-CG 3.42Å; L216-E220 PolarHBondContact O-N 3.15Å; E220-L222 VanDerWaalsContact C-N 3.35Å; E220-L222 PolarHBondContact O-N 2.87Å; E220-C223 PolarHBondContact O-N 3.44Å |
| 221 | F | 94.4 | Very high | 91.2 | Very high | 16 Ų | 16 | 58.1 Ų | 58.1 | 7% | 0.07 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -65.1 | -35.3 | -172.8 | -176.8 | -92.3 | 0 | 0 | 0 | 113.4 | L140 R154 D158 F159 L162 L203 P217 V218 | L140-F221 HydrophobicContact CD1-CE1 3.94Å; L140-F221 HydrophobicContact CD1-CZ 4.32Å; R154-F221 HydrophobicContact CB-CE2 4.09Å; R154-F221 HydrophobicContact CB-CZ 3.84Å; R154-F221 HydrophobicContact CG-CD2 4.46Å; R154-F221 HydrophobicContact CG-CE1 4.11Å; R154-F221 HydrophobicContact CG-CE2 3.82Å; R154-F221 HydrophobicContact CG-CZ 3.61Å; R154-F221 VanDerWaalsContact CZ-O 3.29Å; R154-F221 PolarHBondContact NE-O 2.95Å; R154-F221 PolarHBondContact NH2-O 3.03Å; D158-F221 HydrophobicContact CB-CE2 4.03Å; F159-F221 HydrophobicContact CD1-CE1 4.17Å; F159-F221 HydrophobicContact CD1-CE2 4.45Å; F159-F221 AromaticContact CD1-CZ 3.59Å; F159-F221 HydrophobicContact CD1-CZ 3.59Å; F159-F221 HydrophobicContact CD2-CZ 4Å; F159-F221 AromaticContact CE1-CE1 3.87Å; F159-F221 HydrophobicContact CE1-CE1 3.87Å; F159-F221 AromaticContact CE1-CZ 3.58Å; F159-F221 HydrophobicContact CE1-CZ 3.58Å; F159-F221 AromaticContact CE2-CZ 3.98Å; F159-F221 HydrophobicContact CE2-CZ 3.98Å; F159-F221 HydrophobicContact CG-CE2 4.37Å; F159-F221 AromaticContact CG-CZ 3.82Å; F159-F221 HydrophobicContact CG-CZ 3.82Å; F159-F221 HydrophobicContact CZ-CE1 4.25Å; F159-F221 AromaticContact CZ-CZ 3.79Å; F159-F221 HydrophobicContact CZ-CZ 3.79Å; L162-F221 HydrophobicContact CB-CD2 4.23Å; L162-F221 HydrophobicContact CD1-CB 4.49Å; L162-F221 HydrophobicContact CD2-CB 3.9Å; L162-F221 HydrophobicContact CD2-CD1 3.77Å; L162-F221 HydrophobicContact CD2-CD2 3.97Å; L162-F221 HydrophobicContact CD2-CE1 4.28Å; L162-F221 HydrophobicContact CD2-CE2 4.44Å; L162-F221 HydrophobicContact CD2-CG 3.61Å; L203-F221 HydrophobicContact CD2-CE1 4.21Å; P217-F221 WeakPolarHBondContact O-CB 3.34Å; P217-F221 PolarHBondContact O-N 2.98Å; V218-F221 PolarHBondContact O-N 2.96Å |
| 222 | L | 94.9 | Very high | 90.3 | Very high | 1 Ų | 1 | 56.4 Ų | 56.4 | 1% | 0.005 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -95.7 | -3.3 | 179.7 | -61.8 | 177.4 | 0 | 0 | 0 | 113.9 | P121 V142 W150 L203 V207 V218 E220 L224 | P121-L222 HydrophobicContact CB-CD2 4.22Å; V142-L222 HydrophobicContact CG2-CB 4.3Å; V142-L222 HydrophobicContact CG2-CD2 4.13Å; W150-L222 WeakPolarHBondContact CZ2-O 3.27Å; W150-L222 PolarHBondContact NE1-O 3.25Å; L203-L222 HydrophobicContact CD2-CD2 4.22Å; V207-L222 HydrophobicContact CG1-CD1 4.44Å; V218-L222 HydrophobicContact CG1-CD1 3.87Å; V218-L222 HydrophobicContact CG1-CG 4.37Å; V218-L222 WeakPolarHBondContact O-CB 3.39Å; V218-L222 PolarHBondContact O-N 2.8Å; E220-L222 VanDerWaalsContact C-N 3.35Å; E220-L222 PolarHBondContact O-N 2.87Å; L222-L224 HydrophobicContact CB-CD2 3.66Å; L222-L224 HydrophobicContact CB-CG 3.88Å; L222-L224 HydrophobicContact CD1-CD2 4.25Å |
| 223 | C | 93.9 | Very high | 89.2 | Confident | 15 Ų | 15 | 56.1 Ų | 56.1 | 10% | 0.101 | 30% | 0.301 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 54.4 | 48.1 | -171 | -56.9 | 0 | 0 | 0 | 0 | 113.2 | W150 V152 R154 R219 E220 D225 P227 | W150-C223 WeakPolarHBondContact CZ2-O 3.29Å; V152-C223 HydrophobicContact CG1-CB 3.97Å; R154-C223 PolarHBondContact NH2-SG 2.99Å; R219-C223 WeakPolarHBondContact O-CA 3.17Å; R219-C223 PolarHBondContact O-N 2.66Å; E220-C223 PolarHBondContact O-N 3.44Å; C223-D225 VanDerWaalsContact C-N 3.28Å; C223-D225 PolarHBondContact O-N 3.05Å; C223-P227 WeakPolarHBondContact O-CA 3.27Å |
| 224 | L | 93.2 | Very high | 87.9 | Confident | 10 Ų | 10 | 58.2 Ų | 58.2 | 5% | 0.052 | 31% | 0.31 | C | S | . | . | S | Bend | trans | -70.4 | -20.8 | -175.2 | -60.4 | -175.7 | 0 | 0 | 0 | 114.6 | I119 V142 W150 R219 L222 | I119-L224 HydrophobicContact CD1-CD1 3.63Å; I119-L224 HydrophobicContact CD1-CD2 3.9Å; I119-L224 HydrophobicContact CD1-CG 4.38Å; I119-L224 HydrophobicContact CG2-CD2 4.05Å; V142-L224 HydrophobicContact CG1-CD2 4.02Å; W150-L224 HydrophobicContact CH2-CD2 4.06Å; W150-L224 HydrophobicContact CZ2-CD2 3.84Å; R219-L224 HydrophobicContact CB-CB 4.31Å; R219-L224 HydrophobicContact CB-CD1 4.4Å; R219-L224 HydrophobicContact CG-CB 4.22Å; R219-L224 HydrophobicContact CG-CD1 3.83Å; R219-L224 HydrophobicContact CG-CG 4.43Å; R219-L224 PolarHBondContact O-N 3.37Å; L222-L224 HydrophobicContact CB-CD2 3.66Å; L222-L224 HydrophobicContact CB-CG 3.88Å; L222-L224 HydrophobicContact CD1-CD2 4.25Å |
| 225 | D | 92.5 | Very high | 86.9 | Confident | 96 Ų | 96 | 60.6 Ų | 60.6 | 51% | 0.513 | 32% | 0.318 | S | S | . | . | S | Bend | trans | -105.6 | -28.4 | -172.9 | -62.7 | -53.9 | 0 | 0 | 0 | 113.7 | R219 C223 | R219-D225 WeakPolarHBondContact CB-OD2 3.15Å; R219-D225 IonicContact CZ-OD1 3.31Å; R219-D225 IonicContact CZ-OD2 3.34Å; R219-D225 IonicContact NE-OD1 2.72Å; R219-D225 PolarHBondContact NE-OD1 2.92Å; R219-D225 IonicContact NE-OD2 2.64Å; R219-D225 PolarHBondContact NE-OD2 3.19Å; R219-D225 IonicContact NH2-OD1 2.93Å; R219-D225 PolarHBondContact NH2-OD1 3.45Å; R219-D225 IonicContact NH2-OD2 3.76Å; R219-D225 PolarHBondContact NH2-OD2 2.87Å; C223-D225 VanDerWaalsContact C-N 3.28Å; C223-D225 PolarHBondContact O-N 3.05Å |
| 226 | D | 90.4 | Very high | 85.5 | Confident | 140 Ų | 140 | 64.5 Ų | 64.5 | 75% | 0.749 | 34% | 0.335 | S | S | * | . | S | Bend | trans | -137.5 | 78.7 | 177.2 | -166.9 | 14.4 | 0 | 0 | 0 | 108.1 | ||
| 227 | P | 91.3 | Very high | 84.2 | Confident | 51 Ų | 51 | 59.6 Ų | 59.6 | 33% | 0.331 | 31% | 0.31 | S | S | . | . | P | Polyproline II helix | trans | -76.1 | 123.5 | -171.7 | 28.8 | -33.7 | 0 | 0 | 0 | 111 | W150 C223 | W150-P227 HydrophobicContact CB-CB 4.45Å; W150-P227 HydrophobicContact CD2-CB 3.42Å; W150-P227 VanDerWaalsContact CD2-CB 3.42Å; W150-P227 HydrophobicContact CE3-CB 3.62Å; W150-P227 HydrophobicContact CE3-CG 4.49Å; W150-P227 HydrophobicContact CG-CB 3.81Å; W150-P227 HydrophobicContact CH2-CB 4.2Å; W150-P227 HydrophobicContact CZ2-CB 4.02Å; W150-P227 HydrophobicContact CZ3-CB 4.02Å; C223-P227 WeakPolarHBondContact O-CA 3.27Å |
| 228 | P | 88.7 | Confident | 83 | Confident | 16 Ų | 16 | 63.1 Ų | 63.1 | 10% | 0.104 | 32% | 0.322 | C | S | . | . | P | Polyproline II helix | trans | -65 | 144.3 | -175.9 | 26.2 | -36.3 | 0 | 0 | 0 | 112.3 | V152 | V152-P228 HydrophobicContact CG1-CG 4.15Š|
| 229 | G | 83.5 | Confident | 81.5 | Confident | 23 Ų | 23 | 65.5 Ų | 65.5 | 24% | 0.237 | 34% | 0.342 | C | S | . | . | P | Polyproline II helix | trans | -65.7 | 165.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | F231 D232 S233 | G229-F231 PolarHBondContact O-N 3.45Å; G229-D232 WeakPolarHBondContact CA-OD2 3.44Å; G229-D232 PolarHBondContact N-OD2 3.21Å; G229-D232 PolarHBondContact O-N 3.32Å; G229-S233 PolarHBondContact O-N 2.93Å |
| 230 | P | 75.3 | Confident | 80.1 | Confident | 118 Ų | 118 | 65.6 Ų | 65.6 | 77% | 0.766 | 35% | 0.345 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.3 | -22 | -174.9 | -26.8 | 35.8 | 0 | 0 | 0 | 115.1 | ||
| 231 | F | 69.2 | Low | 78.9 | Confident | 178 Ų | 178 | 61.1 Ų | 61.1 | 78% | 0.781 | 32% | 0.324 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -102.7 | -36.4 | 178.7 | -58.5 | -75.6 | 0 | 0 | 0 | 111.9 | G229 S233 | G229-F231 PolarHBondContact O-N 3.45Å; F231-S233 PolarHBondContact O-N 2.82Å |
| 232 | D | 74 | Confident | 77.5 | Confident | 94 Ų | 94 | 63.6 Ų | 63.6 | 50% | 0.503 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -68.2 | -35.2 | -174.5 | -43.1 | -81.1 | 0 | 0 | 0 | 112.1 | G229 L234 E235 E236 | G229-D232 WeakPolarHBondContact CA-OD2 3.44Å; G229-D232 PolarHBondContact N-OD2 3.21Å; G229-D232 PolarHBondContact O-N 3.32Å; D232-L234 PolarHBondContact O-N 3.09Å; D232-E235 PolarHBondContact O-N 2.64Å; D232-E236 WeakPolarHBondContact O-CB 3.35Å; D232-E236 PolarHBondContact O-N 3.08Å |
| 233 | S | 70.9 | Confident | 76.4 | Confident | 7 Ų | 7 | 67.7 Ų | 67.7 | 5% | 0.049 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -52 | -32.2 | -177.7 | 57.9 | 0 | 0 | 0 | 0 | 115.3 | V151 F153 G229 F231 S237 | V151-S233 WeakPolarHBondContact O-CB 3.41Å; F153-S233 VanDerWaalsContact CD2-O 3.31Å; F153-S233 WeakPolarHBondContact CD2-O 3.49Å; G229-S233 PolarHBondContact O-N 2.93Å; F231-S233 PolarHBondContact O-N 2.82Å; S233-S237 VanDerWaalsContact O-CB 3.25Å; S233-S237 WeakPolarHBondContact O-CB 3.45Å; S233-S237 PolarHBondContact O-OG 2.85Å |
| 234 | L | 67.3 | Low | 75.2 | Confident | 52 Ų | 52 | 68.3 Ų | 68.3 | 27% | 0.272 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -86.9 | -33.4 | 178.2 | -176.6 | 58.9 | 0 | 0 | 0 | 112.3 | F153 D232 S237 R238 | F153-L234 HydrophobicContact CD1-CD1 4.48Å; F153-L234 HydrophobicContact CE1-CD1 4.05Å; F153-L234 HydrophobicContact CE2-CB 4.04Å; F153-L234 HydrophobicContact CE2-CD1 4.13Å; F153-L234 HydrophobicContact CZ-CB 4.35Å; F153-L234 HydrophobicContact CZ-CD1 3.85Å; D232-L234 PolarHBondContact O-N 3.09Å; L234-S237 PolarHBondContact O-OG 3.11Å; L234-R238 WeakPolarHBondContact O-CB 3.47Å; L234-R238 VanDerWaalsContact O-CD 3.27Å; L234-R238 WeakPolarHBondContact O-CD 3.37Å; L234-R238 WeakPolarHBondContact O-CG 3.48Å; L234-R238 PolarHBondContact O-N 3.15Å |
| 235 | E | 72.4 | Confident | 74 | Confident | 130 Ų | 130 | 69.8 Ų | 69.8 | 61% | 0.607 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -73.9 | -49.1 | -180 | -159 | 72.5 | -175.8 | 0 | 0 | 111 | D232 S237 R238 A239 | D232-E235 PolarHBondContact O-N 2.64Å; E235-S237 PolarHBondContact O-N 3.44Å; E235-R238 PolarHBondContact O-N 2.92Å; E235-R238 IonicContact OE2-NH1 2.64Å; E235-A239 PolarHBondContact O-N 3.3Å; E235-A239 VanDerWaalsContact O-N 3.1Å |
| 236 | E | 67.8 | Low | 73 | Confident | 95 Ų | 95 | 71.6 Ų | 71.6 | 44% | 0.444 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -58 | -46.9 | 176.2 | -173.4 | -146.8 | 169.8 | 0 | 0 | 111.2 | D232 R238 A239 F240 | D232-E236 WeakPolarHBondContact O-CB 3.35Å; D232-E236 PolarHBondContact O-N 3.08Å; E236-R238 PolarHBondContact O-N 3.33Å; E236-A239 PolarHBondContact O-N 3.1Å; E236-F240 WeakPolarHBondContact O-CB 3.25Å; E236-F240 PolarHBondContact O-N 3.49Å |
| 237 | S | 66.8 | Low | 72.2 | Confident | 5 Ų | 5 | 66.7 Ų | 66.7 | 4% | 0.035 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -71.2 | -30.1 | -178 | 61.3 | 0 | 0 | 0 | 0 | 113.4 | F153 S233 L234 E235 C241 | F153-S237 WeakPolarHBondContact CB-OG 3.46Å; S233-S237 VanDerWaalsContact O-CB 3.25Å; S233-S237 WeakPolarHBondContact O-CB 3.45Å; S233-S237 PolarHBondContact O-OG 2.85Å; L234-S237 PolarHBondContact O-OG 3.11Å; E235-S237 PolarHBondContact O-N 3.44Å; S237-C241 WeakPolarHBondContact O-CB 3.39Å; S237-C241 PolarHBondContact O-N 3.32Å; S237-C241 PolarHBondContact O-SG 3.45Å |
| 238 | R | 70.3 | Confident | 71.6 | Confident | 85 Ų | 85 | 67.8 Ų | 67.8 | 32% | 0.321 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -61.9 | -52.5 | 168 | -78.2 | 165.5 | 177 | 177.4 | -7.4 | 110.7 | M129 L234 E235 E236 F240 C241 E242 | M129-R238 HydrophobicContact SD-CG 4.41Å; L234-R238 WeakPolarHBondContact O-CB 3.47Å; L234-R238 VanDerWaalsContact O-CD 3.27Å; L234-R238 WeakPolarHBondContact O-CD 3.37Å; L234-R238 WeakPolarHBondContact O-CG 3.48Å; L234-R238 PolarHBondContact O-N 3.15Å; E235-R238 PolarHBondContact O-N 2.92Å; E235-R238 IonicContact OE2-NH1 2.64Å; E236-R238 PolarHBondContact O-N 3.33Å; R238-F240 VanDerWaalsContact C-N 3.3Å; R238-F240 PolarHBondContact O-N 2.91Å; R238-C241 PolarHBondContact O-N 3.18Å; R238-C241 VanDerWaalsContact O-N 3.15Å; R238-E242 WeakPolarHBondContact O-CB 3.48Å; R238-E242 PolarHBondContact O-N 3.08Å |
| 239 | A | 65.4 | Low | 71.1 | Confident | 51 Ų | 51 | 74.8 Ų | 74.8 | 42% | 0.421 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -59.9 | -38.1 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | E235 E236 T243 | E235-A239 PolarHBondContact O-N 3.3Å; E235-A239 VanDerWaalsContact O-N 3.1Å; E236-A239 PolarHBondContact O-N 3.1Å; A239-T243 WeakPolarHBondContact O-CB 3.34Å; A239-T243 PolarHBondContact O-N 2.92Å; A239-T243 PolarHBondContact O-OG1 3.48Å |
| 240 | F | 65.9 | Low | 71.1 | Confident | 98 Ų | 98 | 81 Ų | 81 | 43% | 0.43 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -69.7 | -40.4 | 174.9 | -174.9 | -107.6 | 0 | 0 | 0 | 112.6 | E236 R238 L244 | E236-F240 WeakPolarHBondContact O-CB 3.25Å; E236-F240 PolarHBondContact O-N 3.49Å; R238-F240 VanDerWaalsContact C-N 3.3Å; R238-F240 PolarHBondContact O-N 2.91Å; F240-L244 HydrophobicContact CD1-CD1 3.75Å; F240-L244 HydrophobicContact CE1-CD1 3.32Å; F240-L244 HydrophobicContact CE1-CG 4.35Å; F240-L244 HydrophobicContact CE2-CD1 4.21Å; F240-L244 HydrophobicContact CE2-CG 4.47Å; F240-L244 HydrophobicContact CG-CD1 4.37Å; F240-L244 HydrophobicContact CZ-CD1 3.58Å; F240-L244 HydrophobicContact CZ-CG 4.29Å; F240-L244 WeakPolarHBondContact O-CB 3.33Å; F240-L244 VanDerWaalsContact O-CG 3.25Å; F240-L244 WeakPolarHBondContact O-CG 3.38Å; F240-L244 PolarHBondContact O-N 3.05Å; F240-L244 VanDerWaalsContact O-N 3.13Å |
| 241 | C | 68.3 | Low | 71.6 | Confident | 3 Ų | 3 | 79.4 Ų | 79.4 | 2% | 0.02 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -64.7 | -46.4 | 174.6 | -69.4 | 0 | 0 | 0 | 0 | 111.5 | F135 R155 S237 R238 L244 E245 | F135-C241 HydrophobicContact CE2-CB 4.29Å; R155-C241 VanDerWaalsContact CD-SG 3.6Å; R155-C241 PolarHBondContact NE-SG 3.36Å; R155-C241 VanDerWaalsContact NE-SG 3.44Å; S237-C241 WeakPolarHBondContact O-CB 3.39Å; S237-C241 PolarHBondContact O-N 3.32Å; S237-C241 PolarHBondContact O-SG 3.45Å; R238-C241 PolarHBondContact O-N 3.18Å; R238-C241 VanDerWaalsContact O-N 3.15Å; C241-L244 CarbonylContact O-C 3.58Å; C241-L244 PolarHBondContact O-N 3.46Å; C241-E245 WeakPolarHBondContact O-CB 3.42Å; C241-E245 VanDerWaalsContact O-CG 3.25Å; C241-E245 WeakPolarHBondContact O-CG 3.25Å; C241-E245 PolarHBondContact O-N 2.99Å |
| 242 | E | 66.4 | Low | 72.5 | Confident | 67 Ų | 67 | 76.4 Ų | 76.4 | 31% | 0.313 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -53.9 | -55 | 175.7 | 178.5 | 167.8 | -174.7 | 0 | 0 | 111.3 | R132 R238 L244 E245 E246 | R132-E242 IonicContact CZ-OE1 2.74Å; R132-E242 IonicContact CZ-OE2 2.84Å; R132-E242 IonicContact NH1-OE1 3.06Å; R132-E242 PolarHBondContact NH1-OE1 2.8Å; R132-E242 IonicContact NH1-OE2 3.9Å; R132-E242 PolarHBondContact NH1-OE2 2.85Å; R132-E242 IonicContact NH2-OE1 3.49Å; R132-E242 PolarHBondContact NH2-OE1 3.43Å; R238-E242 WeakPolarHBondContact O-CB 3.48Å; R238-E242 PolarHBondContact O-N 3.08Å; E242-L244 VanDerWaalsContact C-N 3.27Å; E242-L244 PolarHBondContact O-N 3.2Å; E242-E245 PolarHBondContact O-N 2.87Å; E242-E246 PolarHBondContact O-N 3.13Å |
| 243 | T | 72.1 | Confident | 73.3 | Confident | 88 Ų | 88 | 76.6 Ų | 76.6 | 54% | 0.54 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -56.7 | -40 | 177.9 | -55 | 0 | 0 | 0 | 0 | 112.6 | A239 S247 | A239-T243 WeakPolarHBondContact O-CB 3.34Å; A239-T243 PolarHBondContact O-N 2.92Å; A239-T243 PolarHBondContact O-OG1 3.48Å; T243-S247 WeakPolarHBondContact O-CB 3.34Å; T243-S247 PolarHBondContact O-N 3.26Å |
| 244 | L | 67.6 | Low | 74.4 | Confident | 27 Ų | 27 | 81.1 Ų | 81.1 | 14% | 0.141 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -74.5 | -25.4 | 177.6 | -74.6 | 177.6 | 0 | 0 | 0 | 113.5 | F240 C241 E242 N248 | F240-L244 HydrophobicContact CD1-CD1 3.75Å; F240-L244 HydrophobicContact CE1-CD1 3.32Å; F240-L244 HydrophobicContact CE1-CG 4.35Å; F240-L244 HydrophobicContact CE2-CD1 4.21Å; F240-L244 HydrophobicContact CE2-CG 4.47Å; F240-L244 HydrophobicContact CG-CD1 4.37Å; F240-L244 HydrophobicContact CZ-CD1 3.58Å; F240-L244 HydrophobicContact CZ-CG 4.29Å; F240-L244 WeakPolarHBondContact O-CB 3.33Å; F240-L244 VanDerWaalsContact O-CG 3.25Å; F240-L244 WeakPolarHBondContact O-CG 3.38Å; F240-L244 PolarHBondContact O-N 3.05Å; F240-L244 VanDerWaalsContact O-N 3.13Å; C241-L244 CarbonylContact O-C 3.58Å; C241-L244 PolarHBondContact O-N 3.46Å; E242-L244 VanDerWaalsContact C-N 3.27Å; E242-L244 PolarHBondContact O-N 3.2Å; L244-N248 WeakPolarHBondContact O-CB 3.37Å; L244-N248 PolarHBondContact O-N 3.21Å |
| 245 | E | 67.3 | Low | 75.9 | Confident | 42 Ų | 42 | 84.7 Ų | 84.7 | 20% | 0.196 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -77.9 | -43.9 | 177.1 | -77.1 | 168.5 | -164.7 | 0 | 0 | 111.2 | F135 R155 C241 E242 S247 N248 Y249 | F135-E245 WeakPolarHBondContact CD1-OE1 3.38Å; F135-E245 WeakPolarHBondContact CE1-OE2 3.43Å; F135-E245 WeakPolarHBondContact CG-OE1 3.49Å; R155-E245 IonicContact CZ-OE1 2.78Å; R155-E245 IonicContact NE-OE1 3.36Å; R155-E245 VanDerWaalsContact NH1-CD 3.34Å; R155-E245 IonicContact NH1-OE1 3.18Å; R155-E245 PolarHBondContact NH1-OE1 3.47Å; C241-E245 WeakPolarHBondContact O-CB 3.42Å; C241-E245 VanDerWaalsContact O-CG 3.25Å; C241-E245 WeakPolarHBondContact O-CG 3.25Å; C241-E245 PolarHBondContact O-N 2.99Å; E242-E245 PolarHBondContact O-N 2.87Å; E245-S247 VanDerWaalsContact C-N 3.31Å; E245-S247 PolarHBondContact O-N 3.25Å; E245-N248 PolarHBondContact O-N 3.2Å; E245-Y249 WeakPolarHBondContact O-CB 3.35Å; E245-Y249 PolarHBondContact O-N 2.84Å |
| 246 | E | 73.1 | Confident | 77 | Confident | 133 Ų | 133 | 83.2 Ų | 83.2 | 62% | 0.621 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -55.7 | -47 | 169.4 | -67.7 | -168.5 | 151.4 | 0 | 0 | 111.5 | E242 N248 Y249 R250 | E242-E246 PolarHBondContact O-N 3.13Å; E246-N248 PolarHBondContact O-N 2.96Å; E246-Y249 PolarHBondContact O-N 2.74Å; E246-R250 WeakPolarHBondContact O-CB 3.42Å; E246-R250 PolarHBondContact O-N 2.96Å |
| 247 | S | 73.4 | Confident | 78.4 | Confident | 38 Ų | 38 | 83.2 Ų | 83.2 | 27% | 0.266 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -64 | -38.9 | 178.3 | -167 | 0 | 0 | 0 | 0 | 112.2 | T243 E245 R250 L251 | T243-S247 WeakPolarHBondContact O-CB 3.34Å; T243-S247 PolarHBondContact O-N 3.26Å; E245-S247 VanDerWaalsContact C-N 3.31Å; E245-S247 PolarHBondContact O-N 3.25Å; S247-R250 PolarHBondContact OG-NH2 3.43Å; S247-L251 VanDerWaalsContact O-CG 3.29Å; S247-L251 WeakPolarHBondContact O-CG 3.39Å; S247-L251 PolarHBondContact O-N 3.26Å; S247-L251 VanDerWaalsContact O-N 3.11Å |
| 248 | N | 78.4 | Confident | 79.9 | Confident | 73 Ų | 73 | 88 Ų | 88 | 39% | 0.39 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -70 | -43.4 | 177 | -162.2 | -98.2 | 0 | 0 | 0 | 112.3 | L244 E245 E246 R250 L251 Q252 | L244-N248 WeakPolarHBondContact O-CB 3.37Å; L244-N248 PolarHBondContact O-N 3.21Å; E245-N248 PolarHBondContact O-N 3.2Å; E246-N248 PolarHBondContact O-N 2.96Å; N248-R250 PolarHBondContact O-N 3.03Å; N248-L251 PolarHBondContact O-N 2.76Å; N248-Q252 WeakPolarHBondContact O-CG 3.42Å; N248-Q252 PolarHBondContact O-N 2.93Å; N248-Q252 PolarHBondContact OD1-NE2 3.49Å |
| 249 | Y | 78.6 | Confident | 81.2 | Confident | 163 Ų | 163 | 88.2 Ų | 88.2 | 64% | 0.639 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -60.1 | -43.9 | 175.3 | 173.8 | -107.7 | 0 | 0 | 0 | 111.8 | E245 E246 L251 Q252 K253 | E245-Y249 WeakPolarHBondContact O-CB 3.35Å; E245-Y249 PolarHBondContact O-N 2.84Å; E246-Y249 PolarHBondContact O-N 2.74Å; Y249-L251 PolarHBondContact O-N 3.02Å; Y249-Q252 PolarHBondContact O-N 3.45Å; Y249-K253 WeakPolarHBondContact O-CB 3.29Å; Y249-K253 PolarHBondContact O-N 2.97Å |
| 250 | R | 81.8 | Confident | 82.8 | Confident | 153 Ų | 153 | 91.9 Ų | 91.9 | 58% | 0.577 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -57.2 | -48.9 | 173.5 | -179.5 | -178.8 | 61.7 | -175.6 | -5.1 | 111.8 | E246 S247 N248 Q252 K253 E254 | E246-R250 WeakPolarHBondContact O-CB 3.42Å; E246-R250 PolarHBondContact O-N 2.96Å; S247-R250 PolarHBondContact OG-NH2 3.43Å; N248-R250 PolarHBondContact O-N 3.03Å; R250-Q252 PolarHBondContact O-N 2.87Å; R250-K253 PolarHBondContact O-N 3.26Å; R250-E254 WeakPolarHBondContact O-CB 3.47Å; R250-E254 PolarHBondContact O-N 2.93Å |
| 251 | L | 87.7 | Confident | 84.3 | Confident | 85 Ų | 85 | 91.6 Ų | 91.6 | 45% | 0.445 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -64.4 | -37.5 | 179.1 | -72.2 | 167.9 | 0 | 0 | 0 | 112.6 | S247 N248 Y249 L255 | S247-L251 VanDerWaalsContact O-CG 3.29Å; S247-L251 WeakPolarHBondContact O-CG 3.39Å; S247-L251 PolarHBondContact O-N 3.26Å; S247-L251 VanDerWaalsContact O-N 3.11Å; N248-L251 PolarHBondContact O-N 2.76Å; Y249-L251 PolarHBondContact O-N 3.02Å; L251-L255 WeakPolarHBondContact O-CB 3.47Å; L251-L255 PolarHBondContact O-N 2.94Å |
| 252 | Q | 87.7 | Confident | 85.8 | Confident | 116 Ų | 116 | 95.2 Ų | 95.2 | 54% | 0.542 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -65.1 | -42 | 173.7 | -71.5 | -177.7 | 24 | 0 | 0 | 112 | N248 Y249 R250 L255 L256 | N248-Q252 WeakPolarHBondContact O-CG 3.42Å; N248-Q252 PolarHBondContact O-N 2.93Å; N248-Q252 PolarHBondContact OD1-NE2 3.49Å; Y249-Q252 PolarHBondContact O-N 3.45Å; R250-Q252 PolarHBondContact O-N 2.87Å; Q252-L255 PolarHBondContact O-N 3.48Å; Q252-L256 WeakPolarHBondContact O-CB 3.36Å; Q252-L256 PolarHBondContact O-N 3.11Å |
| 253 | K | 90.8 | Very high | 87.3 | Confident | 97 Ų | 97 | 95.5 Ų | 95.5 | 42% | 0.422 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -63.2 | -44.8 | 176 | -178.4 | -179.4 | 176 | -65.4 | 0 | 111.5 | Y249 R250 L256 E257 | Y249-K253 WeakPolarHBondContact O-CB 3.29Å; Y249-K253 PolarHBondContact O-N 2.97Å; R250-K253 PolarHBondContact O-N 3.26Å; K253-L256 PolarHBondContact O-N 2.92Å; K253-E257 WeakPolarHBondContact CE-OE1 3.3Å; K253-E257 IonicContact NZ-OE1 2.63Å; K253-E257 PolarHBondContact NZ-OE1 3.43Å; K253-E257 IonicContact NZ-OE2 3.04Å; K253-E257 PolarHBondContact NZ-OE2 2.94Å; K253-E257 WeakPolarHBondContact O-CG 3.36Å; K253-E257 PolarHBondContact O-N 3.32Å |
| 254 | E | 94.3 | Very high | 88.5 | Confident | 102 Ų | 102 | 94 Ų | 94 | 48% | 0.477 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -63.2 | -44.1 | 177.6 | -173.5 | 173.6 | -177.3 | 0 | 0 | 111.8 | R250 L256 E257 K258 | R250-E254 WeakPolarHBondContact O-CB 3.47Å; R250-E254 PolarHBondContact O-N 2.93Å; E254-L256 VanDerWaalsContact C-N 3.34Å; E254-L256 PolarHBondContact O-N 2.92Å; E254-E257 PolarHBondContact O-N 3.41Å; E254-K258 WeakPolarHBondContact O-CB 3.48Å; E254-K258 WeakPolarHBondContact O-CG 3.44Å; E254-K258 PolarHBondContact O-N 3.25Å |
| 255 | L | 97.3 | Very high | 90 | Very high | 128 Ų | 128 | 97.6 Ų | 97.6 | 67% | 0.67 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -58 | -43.3 | 172.1 | -89.6 | 166.2 | 0 | 0 | 0 | 112.5 | L251 Q252 E257 K258 Q259 | L251-L255 WeakPolarHBondContact O-CB 3.47Å; L251-L255 PolarHBondContact O-N 2.94Å; Q252-L255 PolarHBondContact O-N 3.48Å; L255-E257 VanDerWaalsContact C-N 3.35Å; L255-K258 PolarHBondContact O-N 3.32Å; L255-Q259 WeakPolarHBondContact O-CB 3.34Å; L255-Q259 PolarHBondContact O-N 3.49Å |
| 256 | L | 96.9 | Very high | 91.4 | Very high | 99 Ų | 99 | 101.1 Ų | 101.1 | 52% | 0.518 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -67.5 | -34.7 | 178.3 | -179.2 | 62.4 | 0 | 0 | 0 | 112.5 | Q252 K253 E254 K260 | Q252-L256 WeakPolarHBondContact O-CB 3.36Å; Q252-L256 PolarHBondContact O-N 3.11Å; K253-L256 PolarHBondContact O-N 2.92Å; E254-L256 VanDerWaalsContact C-N 3.34Å; E254-L256 PolarHBondContact O-N 2.92Å; L256-K260 WeakPolarHBondContact O-CG 3.44Å; L256-K260 PolarHBondContact O-N 2.86Å |
| 257 | E | 97.4 | Very high | 92.6 | Very high | 94 Ų | 94 | 102.7 Ų | 102.7 | 44% | 0.439 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -71.2 | -42.7 | 175.3 | -75.9 | 168.6 | 179.8 | 0 | 0 | 111.2 | K253 E254 L255 Q259 K260 E261 | K253-E257 WeakPolarHBondContact CE-OE1 3.3Å; K253-E257 IonicContact NZ-OE1 2.63Å; K253-E257 PolarHBondContact NZ-OE1 3.43Å; K253-E257 IonicContact NZ-OE2 3.04Å; K253-E257 PolarHBondContact NZ-OE2 2.94Å; K253-E257 WeakPolarHBondContact O-CG 3.36Å; K253-E257 PolarHBondContact O-N 3.32Å; E254-E257 PolarHBondContact O-N 3.41Å; L255-E257 VanDerWaalsContact C-N 3.35Å; E257-Q259 PolarHBondContact O-N 3.3Å; E257-K260 PolarHBondContact O-N 3.24Å; E257-E261 PolarHBondContact O-N 3.49Å |
| 258 | K | 97.8 | Very high | 93.8 | Very high | 106 Ų | 106 | 106.6 Ų | 106.6 | 46% | 0.461 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.5 | -36.5 | 173.6 | -71.9 | -74.5 | 156.2 | -162.8 | 0 | 113 | E254 L255 E261 I262 | E254-K258 WeakPolarHBondContact O-CB 3.48Å; E254-K258 WeakPolarHBondContact O-CG 3.44Å; E254-K258 PolarHBondContact O-N 3.25Å; L255-K258 PolarHBondContact O-N 3.32Å; K258-E261 WeakPolarHBondContact CD-OE2 3.44Å; K258-E261 WeakPolarHBondContact CE-OE2 3.49Å; K258-E261 IonicContact NZ-OE1 3.84Å; K258-E261 IonicContact NZ-OE2 2.67Å; K258-E261 PolarHBondContact NZ-OE2 2.95Å; K258-E261 WeakPolarHBondContact O-CB 3.37Å; K258-E261 PolarHBondContact O-N 3.4Å; K258-I262 VanDerWaalsContact O-CG1 3.3Å; K258-I262 WeakPolarHBondContact O-CG1 3.42Å; K258-I262 PolarHBondContact O-N 2.94Å |
| 259 | Q | 98.2 | Very high | 94.7 | Very high | 89 Ų | 89 | 107.9 Ų | 107.9 | 42% | 0.416 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.8 | -44.9 | 174.1 | -174.5 | 57.4 | 56.4 | 0 | 0 | 111.6 | L255 E257 E261 I262 D263 | L255-Q259 WeakPolarHBondContact O-CB 3.34Å; L255-Q259 PolarHBondContact O-N 3.49Å; E257-Q259 PolarHBondContact O-N 3.3Å; Q259-E261 VanDerWaalsContact C-N 3.3Å; Q259-E261 PolarHBondContact O-N 3.3Å; Q259-I262 PolarHBondContact O-N 3.25Å; Q259-D263 PolarHBondContact NE2-OD1 3.49Å; Q259-D263 PolarHBondContact NE2-OD2 3.03Å; Q259-D263 VanDerWaalsContact O-CG 3.27Å; Q259-D263 PolarHBondContact O-N 3.04Å |
| 260 | K | 98.3 | Very high | 95.7 | Very high | 128 Ų | 128 | 105.1 Ų | 105.1 | 56% | 0.557 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -62.6 | -36.2 | 175.4 | -69.6 | 166.7 | -176.2 | 172.7 | 0 | 112.7 | L256 E257 S264 | L256-K260 WeakPolarHBondContact O-CG 3.44Å; L256-K260 PolarHBondContact O-N 2.86Å; E257-K260 PolarHBondContact O-N 3.24Å; K260-S264 VanDerWaalsContact O-CB 3.29Å; K260-S264 WeakPolarHBondContact O-CB 3.45Å; K260-S264 PolarHBondContact O-N 2.97Å |
| 261 | E | 98 | Very high | 96.4 | Very high | 93 Ų | 93 | 102.6 Ų | 102.6 | 44% | 0.435 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64.3 | -47.5 | 174.2 | -172.9 | 176 | -165.2 | 0 | 0 | 111.1 | E257 K258 Q259 D263 S264 L265 | E257-E261 PolarHBondContact O-N 3.49Å; K258-E261 WeakPolarHBondContact CD-OE2 3.44Å; K258-E261 WeakPolarHBondContact CE-OE2 3.49Å; K258-E261 IonicContact NZ-OE1 3.84Å; K258-E261 IonicContact NZ-OE2 2.67Å; K258-E261 PolarHBondContact NZ-OE2 2.95Å; K258-E261 WeakPolarHBondContact O-CB 3.37Å; K258-E261 PolarHBondContact O-N 3.4Å; Q259-E261 VanDerWaalsContact C-N 3.3Å; Q259-E261 PolarHBondContact O-N 3.3Å; E261-D263 PolarHBondContact O-N 2.63Å; E261-S264 WeakPolarHBondContact O-CB 3.32Å; E261-S264 PolarHBondContact O-N 3.29Å; E261-L265 HydrophobicContact CG-CD1 4.2Å; E261-L265 VanDerWaalsContact O-CG 3.32Å; E261-L265 WeakPolarHBondContact O-CG 3.47Å; E261-L265 PolarHBondContact O-N 2.92Å |
| 262 | I | 98.3 | Very high | 96.8 | Very high | 78 Ų | 78 | 104.9 Ų | 104.9 | 40% | 0.4 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -57.3 | -46.3 | 174.9 | -71.3 | 163.8 | 0 | 0 | 0 | 111.4 | K258 Q259 S264 L265 K266 | K258-I262 VanDerWaalsContact O-CG1 3.3Å; K258-I262 WeakPolarHBondContact O-CG1 3.42Å; K258-I262 PolarHBondContact O-N 2.94Å; Q259-I262 PolarHBondContact O-N 3.25Å; I262-S264 VanDerWaalsContact C-N 3.33Å; I262-S264 PolarHBondContact O-N 3.21Å; I262-L265 PolarHBondContact O-N 3.24Å; I262-K266 HydrophobicContact CG2-CD 4.17Å; I262-K266 WeakPolarHBondContact O-CG 3.46Å; I262-K266 PolarHBondContact O-N 3.27Å |
| 263 | D | 98.3 | Very high | 97.3 | Very high | 74 Ų | 74 | 104 Ų | 104 | 40% | 0.396 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -71.9 | -28.4 | -177.6 | -61.8 | -30.9 | 0 | 0 | 0 | 112.6 | Q259 E261 K266 R267 | Q259-D263 PolarHBondContact NE2-OD1 3.49Å; Q259-D263 PolarHBondContact NE2-OD2 3.03Å; Q259-D263 VanDerWaalsContact O-CG 3.27Å; Q259-D263 PolarHBondContact O-N 3.04Å; E261-D263 PolarHBondContact O-N 2.63Å; D263-K266 IonicContact OD1-NZ 3.25Å; D263-K266 PolarHBondContact OD1-NZ 3.46Å; D263-R267 PolarHBondContact O-N 3.02Å |
| 264 | S | 98.3 | Very high | 97.6 | Very high | 57 Ų | 57 | 104.5 Ų | 104.5 | 40% | 0.399 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -69.3 | -42 | 169.7 | -175.4 | 0 | 0 | 0 | 0 | 112.1 | K260 E261 I262 K268 | K260-S264 VanDerWaalsContact O-CB 3.29Å; K260-S264 WeakPolarHBondContact O-CB 3.45Å; K260-S264 PolarHBondContact O-N 2.97Å; E261-S264 WeakPolarHBondContact O-CB 3.32Å; E261-S264 PolarHBondContact O-N 3.29Å; I262-S264 VanDerWaalsContact C-N 3.33Å; I262-S264 PolarHBondContact O-N 3.21Å; S264-K268 WeakPolarHBondContact O-CG 3.29Å; S264-K268 PolarHBondContact O-N 3.49Å |
| 265 | L | 98 | Very high | 97.7 | Very high | 101 Ų | 101 | 102.4 Ų | 102.4 | 53% | 0.529 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -67.6 | -41.6 | 177.1 | -71.3 | 170.5 | 0 | 0 | 0 | 112 | E261 I262 R267 K268 L269 | E261-L265 HydrophobicContact CG-CD1 4.2Å; E261-L265 VanDerWaalsContact O-CG 3.32Å; E261-L265 WeakPolarHBondContact O-CG 3.47Å; E261-L265 PolarHBondContact O-N 2.92Å; I262-L265 PolarHBondContact O-N 3.24Å; L265-R267 PolarHBondContact O-N 3.44Å; L265-K268 PolarHBondContact O-N 3.34Å; L265-L269 PolarHBondContact O-N 2.9Å |
| 266 | K | 97.9 | Very high | 97.7 | Very high | 117 Ų | 117 | 100.6 Ų | 100.6 | 51% | 0.509 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -56.9 | -45.6 | 174.4 | -76.2 | 171.8 | -177.4 | 166.9 | 0 | 112.4 | I262 D263 K268 L269 E270 | I262-K266 HydrophobicContact CG2-CD 4.17Å; I262-K266 WeakPolarHBondContact O-CG 3.46Å; I262-K266 PolarHBondContact O-N 3.27Å; D263-K266 IonicContact OD1-NZ 3.25Å; D263-K266 PolarHBondContact OD1-NZ 3.46Å; K266-K268 PolarHBondContact O-N 2.91Å; K266-L269 WeakPolarHBondContact O-CB 3.29Å; K266-L269 PolarHBondContact O-N 3.22Å; K266-E270 PolarHBondContact O-N 2.67Å |
| 267 | R | 98.3 | Very high | 97.6 | Very high | 165 Ų | 165 | 100.4 Ų | 100.4 | 62% | 0.623 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -62 | -44 | 177.2 | -169.5 | -171.2 | -56.5 | -170.3 | 0.3 | 112 | D263 L265 L269 E270 E271 | D263-R267 PolarHBondContact O-N 3.02Å; L265-R267 PolarHBondContact O-N 3.44Å; R267-L269 VanDerWaalsContact C-N 3.27Å; R267-L269 PolarHBondContact O-N 3.28Å; R267-E270 PolarHBondContact O-N 2.76Å; R267-E271 WeakPolarHBondContact CD-OE1 3.34Å; R267-E271 WeakPolarHBondContact CG-OE1 3.39Å; R267-E271 WeakPolarHBondContact O-CB 3.32Å; R267-E271 VanDerWaalsContact O-CG 3.29Å; R267-E271 WeakPolarHBondContact O-CG 3.46Å; R267-E271 PolarHBondContact O-N 2.95Å |
| 268 | K | 97.8 | Very high | 97.3 | Very high | 120 Ų | 120 | 101.9 Ų | 101.9 | 52% | 0.522 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -64.4 | -31.9 | 176.6 | -71.4 | 175.8 | -179.7 | 179.9 | 0 | 112.7 | S264 L265 K266 K272 | S264-K268 WeakPolarHBondContact O-CG 3.29Å; S264-K268 PolarHBondContact O-N 3.49Å; L265-K268 PolarHBondContact O-N 3.34Å; K266-K268 PolarHBondContact O-N 2.91Å; K268-K272 WeakPolarHBondContact O-CB 3.32Å; K268-K272 WeakPolarHBondContact O-CG 3.38Å; K268-K272 PolarHBondContact O-N 3.39Å |
| 269 | L | 98.1 | Very high | 97.1 | Very high | 100 Ų | 100 | 102.3 Ų | 102.3 | 52% | 0.524 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -66.8 | -50.7 | 173.2 | -178.6 | 63.2 | 0 | 0 | 0 | 110.3 | L265 K266 R267 E271 K272 E273 | L265-L269 PolarHBondContact O-N 2.9Å; K266-L269 WeakPolarHBondContact O-CB 3.29Å; K266-L269 PolarHBondContact O-N 3.22Å; R267-L269 VanDerWaalsContact C-N 3.27Å; R267-L269 PolarHBondContact O-N 3.28Å; L269-E271 PolarHBondContact O-N 2.97Å; L269-K272 CarbonylContact O-C 3.55Å; L269-K272 WeakPolarHBondContact O-CA 3.44Å; L269-K272 WeakPolarHBondContact O-CB 3.41Å; L269-K272 PolarHBondContact O-N 3.38Å; L269-E273 HydrophobicContact CD1-CG 4.46Å; L269-E273 HydrophobicContact CG-CG 4.46Å; L269-E273 WeakPolarHBondContact CG-OE1 3.44Å; L269-E273 WeakPolarHBondContact O-CG 3.48Å; L269-E273 PolarHBondContact O-N 3.13Å |
| 270 | E | 97.9 | Very high | 96.8 | Very high | 106 Ų | 106 | 102.8 Ų | 102.8 | 50% | 0.495 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -58.2 | -43.1 | 176.8 | -177.2 | 176.9 | -156.9 | 0 | 0 | 112.4 | K266 R267 K272 E273 Q274 | K266-E270 PolarHBondContact O-N 2.67Å; R267-E270 PolarHBondContact O-N 2.76Å; E270-K272 VanDerWaalsContact C-N 3.26Å; E270-K272 PolarHBondContact O-N 3.1Å; E270-E273 PolarHBondContact O-N 3.16Å; E270-Q274 WeakPolarHBondContact O-CB 3.5Å; E270-Q274 VanDerWaalsContact O-CG 3.3Å; E270-Q274 WeakPolarHBondContact O-CG 3.19Å; E270-Q274 PolarHBondContact O-N 3.4Å |
| 271 | E | 97.9 | Very high | 96.2 | Very high | 99 Ų | 99 | 102.1 Ų | 102.1 | 46% | 0.463 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -58.8 | -35.6 | 172.4 | -74.1 | 166.8 | -166.8 | 0 | 0 | 112.3 | R267 L269 T275 | R267-E271 WeakPolarHBondContact CD-OE1 3.34Å; R267-E271 WeakPolarHBondContact CG-OE1 3.39Å; R267-E271 WeakPolarHBondContact O-CB 3.32Å; R267-E271 VanDerWaalsContact O-CG 3.29Å; R267-E271 WeakPolarHBondContact O-CG 3.46Å; R267-E271 PolarHBondContact O-N 2.95Å; L269-E271 PolarHBondContact O-N 2.97Å; E271-T275 PolarHBondContact O-N 2.96Å; E271-T275 VanDerWaalsContact O-N 3.16Å; E271-T275 PolarHBondContact O-OG1 3.25Å |
| 272 | K | 96.5 | Very high | 95.5 | Very high | 134 Ų | 134 | 105.4 Ų | 105.4 | 58% | 0.583 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -79.1 | -40.1 | 178.2 | -71.7 | -69 | 176.9 | -170.7 | 0 | 112.5 | K268 L269 E270 T275 I276 | K268-K272 WeakPolarHBondContact O-CB 3.32Å; K268-K272 WeakPolarHBondContact O-CG 3.38Å; K268-K272 PolarHBondContact O-N 3.39Å; L269-K272 CarbonylContact O-C 3.55Å; L269-K272 WeakPolarHBondContact O-CA 3.44Å; L269-K272 WeakPolarHBondContact O-CB 3.41Å; L269-K272 PolarHBondContact O-N 3.38Å; E270-K272 VanDerWaalsContact C-N 3.26Å; E270-K272 PolarHBondContact O-N 3.1Å; K272-T275 WeakPolarHBondContact O-CB 3.4Å; K272-T275 PolarHBondContact O-N 2.83Å; K272-T275 VanDerWaalsContact O-N 3.13Å; K272-I276 VanDerWaalsContact O-CG1 3.32Å; K272-I276 WeakPolarHBondContact O-CG1 3.3Å; K272-I276 PolarHBondContact O-N 2.86Å |
| 273 | E | 97.4 | Very high | 94.8 | Very high | 97 Ų | 97 | 105.3 Ų | 105.3 | 45% | 0.453 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -58.6 | -46.8 | 173 | -70.7 | 168.6 | 169.5 | 0 | 0 | 110.7 | L269 E270 T275 I276 L277 | L269-E273 HydrophobicContact CD1-CG 4.46Å; L269-E273 HydrophobicContact CG-CG 4.46Å; L269-E273 WeakPolarHBondContact CG-OE1 3.44Å; L269-E273 WeakPolarHBondContact O-CG 3.48Å; L269-E273 PolarHBondContact O-N 3.13Å; E270-E273 PolarHBondContact O-N 3.16Å; E273-T275 VanDerWaalsContact C-N 3.32Å; E273-T275 PolarHBondContact O-N 2.73Å; E273-I276 PolarHBondContact O-N 2.89Å; E273-L277 WeakPolarHBondContact O-CG 3.36Å; E273-L277 PolarHBondContact O-N 3.2Å |
| 274 | Q | 96.8 | Very high | 93.8 | Very high | 107 Ų | 107 | 108.5 Ų | 108.5 | 50% | 0.5 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -60.7 | -38.9 | 173.3 | -69.6 | 175.3 | 22.7 | 0 | 0 | 112.6 | E270 M278 | E270-Q274 WeakPolarHBondContact O-CB 3.5Å; E270-Q274 VanDerWaalsContact O-CG 3.3Å; E270-Q274 WeakPolarHBondContact O-CG 3.19Å; E270-Q274 PolarHBondContact O-N 3.4Å; Q274-M278 WeakPolarHBondContact O-CG 3.43Å; Q274-M278 PolarHBondContact O-N 3.34Å; Q274-M278 VanDerWaalsContact O-N 3.1Å |
| 275 | T | 96.3 | Very high | 91.9 | Very high | 58 Ų | 58 | 108.5 Ų | 108.5 | 36% | 0.356 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -64.6 | -43.9 | 175.9 | -57.6 | 0 | 0 | 0 | 0 | 111.7 | E271 K272 E273 M278 L279 | E271-T275 PolarHBondContact O-N 2.96Å; E271-T275 VanDerWaalsContact O-N 3.16Å; E271-T275 PolarHBondContact O-OG1 3.25Å; K272-T275 WeakPolarHBondContact O-CB 3.4Å; K272-T275 PolarHBondContact O-N 2.83Å; K272-T275 VanDerWaalsContact O-N 3.13Å; E273-T275 VanDerWaalsContact C-N 3.32Å; E273-T275 PolarHBondContact O-N 2.73Å; T275-M278 PolarHBondContact O-N 3.4Å; T275-L279 HydrophobicContact CG2-CD1 4.3Å; T275-L279 WeakPolarHBondContact O-CG 3.49Å; T275-L279 PolarHBondContact O-N 3.22Å; T275-L279 VanDerWaalsContact O-N 3.15Å |
| 276 | I | 96.7 | Very high | 89.6 | Confident | 91 Ų | 91 | 106.7 Ų | 106.7 | 47% | 0.467 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -62.3 | -49.2 | 177.9 | -69.8 | 162 | 0 | 0 | 0 | 109.9 | K272 E273 M278 L279 E280 | K272-I276 VanDerWaalsContact O-CG1 3.32Å; K272-I276 WeakPolarHBondContact O-CG1 3.3Å; K272-I276 PolarHBondContact O-N 2.86Å; E273-I276 PolarHBondContact O-N 2.89Å; I276-M278 VanDerWaalsContact C-N 3.28Å; I276-M278 PolarHBondContact O-N 2.93Å; I276-L279 PolarHBondContact O-N 2.89Å; I276-E280 HydrophobicContact CG2-CG 4.15Å; I276-E280 WeakPolarHBondContact CG2-OE1 3.47Å; I276-E280 WeakPolarHBondContact O-CG 3.44Å; I276-E280 PolarHBondContact O-N 3.06Å |
| 277 | L | 94.8 | Very high | 87.5 | Confident | 94 Ų | 94 | 106.6 Ų | 106.6 | 49% | 0.492 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -57.3 | -37.7 | 177.4 | -71.1 | 168.3 | 0 | 0 | 0 | 112.5 | E273 N281 | E273-L277 WeakPolarHBondContact O-CG 3.36Å; E273-L277 PolarHBondContact O-N 3.2Å; L277-N281 WeakPolarHBondContact O-CB 3.43Å; L277-N281 PolarHBondContact O-N 3.24Å; L277-N281 PolarHBondContact O-ND2 3.02Å |
| 278 | M | 92.4 | Very high | 85.4 | Confident | 125 Ų | 125 | 104.6 Ų | 104.6 | 62% | 0.616 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -66.2 | -39.4 | 174.2 | -73.9 | -170.9 | -66.3 | 0 | 0 | 112.7 | Q274 T275 I276 H282 | Q274-M278 WeakPolarHBondContact O-CG 3.43Å; Q274-M278 PolarHBondContact O-N 3.34Å; Q274-M278 VanDerWaalsContact O-N 3.1Å; T275-M278 PolarHBondContact O-N 3.4Å; I276-M278 VanDerWaalsContact C-N 3.28Å; I276-M278 PolarHBondContact O-N 2.93Å; M278-H282 WeakPolarHBondContact O-CB 3.47Å; M278-H282 PolarHBondContact O-N 3.3Å |
| 279 | L | 93.1 | Very high | 83 | Confident | 116 Ų | 116 | 102.7 Ų | 102.7 | 61% | 0.607 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -70.1 | -40.9 | 177.9 | -66.8 | 171.4 | 0 | 0 | 0 | 111.9 | T275 I276 H282 A283 | T275-L279 HydrophobicContact CG2-CD1 4.3Å; T275-L279 WeakPolarHBondContact O-CG 3.49Å; T275-L279 PolarHBondContact O-N 3.22Å; T275-L279 VanDerWaalsContact O-N 3.15Å; I276-L279 PolarHBondContact O-N 2.89Å; L279-H282 PolarHBondContact O-N 2.85Å; L279-A283 WeakPolarHBondContact O-CB 3.38Å; L279-A283 PolarHBondContact O-N 3.09Å |
| 280 | E | 91.4 | Very high | 80.3 | Confident | 98 Ų | 98 | 103.1 Ų | 103.1 | 46% | 0.458 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -62.3 | -43.6 | 174.4 | -71.2 | 175.7 | 164.6 | 0 | 0 | 111.8 | I276 H282 A283 N284 | I276-E280 HydrophobicContact CG2-CG 4.15Å; I276-E280 WeakPolarHBondContact CG2-OE1 3.47Å; I276-E280 WeakPolarHBondContact O-CG 3.44Å; I276-E280 PolarHBondContact O-N 3.06Å; E280-H282 VanDerWaalsContact C-N 3.32Å; E280-H282 PolarHBondContact O-N 2.86Å; E280-A283 PolarHBondContact O-N 3.45Å; E280-N284 WeakPolarHBondContact O-CB 3.5Å; E280-N284 PolarHBondContact O-N 2.99Å; E280-N284 PolarHBondContact O-ND2 3.25Å; E280-N284 VanDerWaalsContact O-ND2 3.09Å |
| 281 | N | 86.3 | Confident | 78.3 | Confident | 115 Ų | 115 | 104.3 Ų | 104.3 | 62% | 0.615 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -63.8 | -36.3 | 174.4 | -80.4 | -63.5 | 0 | 0 | 0 | 112.2 | L277 G285 | L277-N281 WeakPolarHBondContact O-CB 3.43Å; L277-N281 PolarHBondContact O-N 3.24Å; L277-N281 PolarHBondContact O-ND2 3.02Å; N281-G285 WeakPolarHBondContact O-CA 3.39Å; N281-G285 PolarHBondContact O-N 3.34Å |
| 282 | H | 83.3 | Confident | 75.4 | Confident | 161 Ų | 161 | 105.5 Ų | 105.5 | 75% | 0.745 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -71.1 | -36.1 | 175 | -170.6 | -78.1 | 0 | 0 | 0 | 112.5 | M278 L279 E280 | M278-H282 WeakPolarHBondContact O-CB 3.47Å; M278-H282 PolarHBondContact O-N 3.3Å; L279-H282 PolarHBondContact O-N 2.85Å; E280-H282 VanDerWaalsContact C-N 3.32Å; E280-H282 PolarHBondContact O-N 2.86Å |
| 283 | A | 84.2 | Confident | 73 | Confident | 77 Ų | 77 | 103.6 Ų | 103.6 | 64% | 0.636 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -69 | -42.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | L279 E280 G285 | L279-A283 WeakPolarHBondContact O-CB 3.38Å; L279-A283 PolarHBondContact O-N 3.09Å; E280-A283 PolarHBondContact O-N 3.45Å; A283-G285 VanDerWaalsContact C-N 3.33Å |
| 284 | N | 75.9 | Confident | 70.3 | Confident | 141 Ų | 141 | 107.5 Ų | 107.5 | 75% | 0.754 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -76.6 | -18.9 | 176.9 | -69 | -42 | 0 | 0 | 0 | 113.2 | E280 G286 | E280-N284 WeakPolarHBondContact O-CB 3.5Å; E280-N284 PolarHBondContact O-N 2.99Å; E280-N284 PolarHBondContact O-ND2 3.25Å; E280-N284 VanDerWaalsContact O-ND2 3.09Å; N284-G286 PolarHBondContact O-N 3.15Å |
| 285 | G | 59.8 | Low | 68 | Low | 56 Ų | 56 | 108.3 Ų | 108.3 | 58% | 0.577 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.3 | 14 | 179.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | N281 A283 S287 | N281-G285 WeakPolarHBondContact O-CA 3.39Å; N281-G285 PolarHBondContact O-N 3.34Å; A283-G285 VanDerWaalsContact C-N 3.33Å; G285-S287 PolarHBondContact O-N 3Å |
| 286 | G | 49.8 | Very low | 65.5 | Low | 64 Ų | 64 | 110.6 Ų | 110.6 | 66% | 0.66 | 71% | 0.712 | S | S | * | * | trans | -63.8 | 98.6 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | N284 | N284-G286 PolarHBondContact O-N 3.15Š| ||
| 287 | S | 53.3 | Low | 63.1 | Low | 114 Ų | 114 | 115.8 Ų | 115.8 | 80% | 0.797 | 73% | 0.734 | S | S | * | * | trans | -65.4 | 139.2 | 178.7 | -166.8 | 0 | 0 | 0 | 0 | 112.4 | G285 | G285-S287 PolarHBondContact O-N 3Š| ||
| 288 | P | 54.8 | Low | 60.6 | Low | 124 Ų | 124 | 114.6 Ų | 114.6 | 81% | 0.805 | 75% | 0.745 | S | S | * | * | trans | -85 | 137.9 | -165.7 | 32.2 | -36.2 | 0 | 0 | 0 | 115 | ||||
| 289 | G | 46 | Very low | 58.5 | Low | 79 Ų | 79 | 114.5 Ų | 114.5 | 81% | 0.814 | 76% | 0.757 | S | S | * | * | trans | 88.1 | 113.3 | 151.1 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 290 | S | 42.4 | Very low | 56.7 | Low | 110 Ų | 110 | 117.9 Ų | 117.9 | 77% | 0.769 | 77% | 0.769 | S | S | * | * | trans | -136.4 | 106.5 | 158.9 | -174.5 | 0 | 0 | 0 | 0 | 109.6 | C292 | S290-C292 PolarHBondContact O-N 3.3Š| ||
| 291 | P | 54.8 | Low | 54.5 | Low | 130 Ų | 130 | 118.9 Ų | 118.9 | 84% | 0.844 | 79% | 0.787 | S | S | * | * | trans | -91.4 | 86 | -173.2 | 34.5 | -33.5 | 0 | 0 | 0 | 112.2 | ||||
| 292 | C | 37.1 | Very low | 52.9 | Low | 125 Ų | 125 | 118.2 Ų | 118.2 | 85% | 0.845 | 79% | 0.791 | S | S | * | * | trans | -109.6 | 76.4 | 168.4 | -80.7 | 0 | 0 | 0 | 0 | 111.3 | S290 | S290-C292 PolarHBondContact O-N 3.3Š| ||
| 293 | A | 45.8 | Very low | 51.2 | Low | 94 Ų | 94 | 115 Ų | 115 | 78% | 0.777 | 79% | 0.793 | S | S | * | * | trans | -89.2 | 119.1 | 166.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 294 | L | 42.6 | Very low | 49.7 | Very low | 179 Ų | 179 | 118.2 Ų | 118.2 | 94% | 0.937 | 80% | 0.799 | S | S | * | * | trans | -151.2 | 145.8 | 143.9 | -90.1 | -167.7 | 0 | 0 | 0 | 109.8 | ||||
| 295 | S | 48 | Very low | 48.6 | Very low | 124 Ų | 124 | 116 Ų | 116 | 87% | 0.867 | 80% | 0.801 | S | S | * | * | trans | -91 | 149.1 | -167.7 | -47.7 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 296 | A | 43 | Very low | 48.2 | Very low | 106 Ų | 106 | 120.9 Ų | 120.9 | 88% | 0.876 | 81% | 0.814 | S | S | * | * | trans | -136.4 | 153.3 | 151.7 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 297 | Q | 46.9 | Very low | 48.7 | Very low | 199 Ų | 199 | 124.5 Ų | 124.5 | 93% | 0.93 | 82% | 0.823 | S | S | * | * | trans | -127.7 | 131.5 | -159 | -176.8 | 179.4 | 11.4 | 0 | 0 | 112.2 | ||||
| 298 | G | 42.1 | Very low | 48.8 | Very low | 69 Ų | 69 | 127.6 Ų | 127.6 | 71% | 0.711 | 83% | 0.825 | S | S | * | * | trans | 79.7 | 120.5 | 157.4 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 299 | S | 49 | Very low | 48.3 | Very low | 123 Ų | 123 | 127.2 Ų | 127.2 | 86% | 0.86 | 83% | 0.825 | S | S | * | * | -168.3 | 131.9 | 121.7 | -75.9 | 0 | 0 | 0 | 0 | 108.9 | |||||
| 300 | E | 55.3 | Low | 48.8 | Very low | 187 Ų | 187 | 129 Ų | 129 | 87% | 0.874 | 83% | 0.825 | S | S | * | * | trans | -75.4 | 145.6 | 173 | 59.5 | -113.8 | 66.8 | 0 | 0 | 112.9 | ||||
| 301 | S | 44.1 | Very low | 49.3 | Very low | 120 Ų | 120 | 128.7 Ų | 128.7 | 84% | 0.839 | 83% | 0.829 | S | S | * | * | trans | -157.2 | 120.2 | 150.7 | -170.7 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 302 | S | 53.3 | Low | 49.7 | Very low | 100 Ų | 100 | 127.4 Ų | 127.4 | 70% | 0.699 | 83% | 0.829 | S | S | * | * | trans | -68.8 | 145.3 | 169 | 155.1 | 0 | 0 | 0 | 0 | 111 | ||||
| 303 | A | 48.1 | Very low | 50.6 | Low | 95 Ų | 95 | 130.2 Ų | 130.2 | 79% | 0.785 | 83% | 0.83 | S | S | * | * | trans | -166.2 | 123.8 | 130.2 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 304 | D | 51.2 | Low | 51 | Low | 143 Ų | 143 | 130 Ų | 130 | 77% | 0.765 | 83% | 0.828 | S | S | * | * | trans | -81.1 | 150.3 | -178.8 | -48.5 | -96.5 | 0 | 0 | 0 | 112.3 | ||||
| 305 | A | 53.2 | Low | 51.7 | Low | 96 Ų | 96 | 127.9 Ų | 127.9 | 79% | 0.793 | 82% | 0.817 | S | S | * | * | trans | -160.3 | 80.1 | 167.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | V307 | A305-V307 PolarHBondContact O-N 3.48Š| ||
| 306 | D | 52.1 | Low | 52.1 | Low | 158 Ų | 158 | 130 Ų | 130 | 85% | 0.845 | 81% | 0.814 | S | S | * | * | trans | -61.2 | 132.1 | 169.4 | -65.3 | -78 | 0 | 0 | 0 | 111.4 | ||||
| 307 | V | 59.4 | Low | 52.3 | Low | 140 Ų | 140 | 132.3 Ų | 132.3 | 85% | 0.848 | 81% | 0.811 | S | S | * | * | trans | -131 | 117.6 | 156.7 | 178.8 | 0 | 0 | 0 | 0 | 107.6 | A305 | A305-V307 PolarHBondContact O-N 3.48Š| ||
| 308 | E | 54.9 | Low | 52.5 | Low | 179 Ų | 179 | 128.9 Ų | 128.9 | 84% | 0.836 | 80% | 0.804 | S | S | * | * | trans | -68.7 | 136.5 | -166.1 | -159.8 | 168.2 | 104.7 | 0 | 0 | 112.7 | ||||
| 309 | S | 44.8 | Very low | 53.8 | Low | 116 Ų | 116 | 130.9 Ų | 130.9 | 81% | 0.811 | 81% | 0.805 | S | S | * | * | trans | -83.4 | 131.3 | 172.8 | -67.6 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 310 | S | 56.6 | Low | 54 | Low | 117 Ų | 117 | 132.1 Ų | 132.1 | 82% | 0.818 | 80% | 0.802 | S | S | * | * | trans | -125.9 | 94.6 | 170.7 | -82.7 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 311 | A | 53.9 | Low | 53.8 | Low | 102 Ų | 102 | 129.4 Ų | 129.4 | 84% | 0.843 | 79% | 0.793 | S | S | * | * | trans | -122.7 | 123.2 | 161.5 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 312 | A | 61.7 | Low | 54 | Low | 103 Ų | 103 | 129.4 Ų | 129.4 | 85% | 0.851 | 79% | 0.788 | S | S | * | * | trans | -129.7 | 110.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 313 | E | 57.1 | Low | 53.7 | Low | 185 Ų | 185 | 128.2 Ų | 128.2 | 86% | 0.864 | 79% | 0.792 | S | S | * | * | trans | -109.8 | 166.2 | 174.8 | -83.1 | -70.2 | 166.4 | 0 | 0 | 109.5 | ||||
| 314 | A | 54.6 | Low | 53.8 | Low | 88 Ų | 88 | 135.1 Ų | 135.1 | 73% | 0.727 | 80% | 0.797 | S | S | * | * | trans | 71.5 | 154.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 315 | D | 55.7 | Low | 53.8 | Low | 135 Ų | 135 | 132.5 Ų | 132.5 | 72% | 0.722 | 80% | 0.796 | S | S | * | * | cis | -144.3 | -179.1 | -1.2 | -146.8 | -18.4 | 0 | 0 | 0 | 112.4 | ||||
| 316 | Q | 57.5 | Low | 53.8 | Low | 169 Ų | 169 | 132.1 Ų | 132.1 | 79% | 0.79 | 79% | 0.793 | S | S | * | * | trans | -63.4 | 150.2 | 176.1 | -57.6 | 145.5 | 82.4 | 0 | 0 | 113.5 | ||||
| 317 | D | 46 | Very low | 54.2 | Low | 154 Ų | 154 | 130.5 Ų | 130.5 | 82% | 0.824 | 79% | 0.791 | S | S | * | * | trans | -158.6 | 136 | 141.8 | -142.3 | -28.7 | 0 | 0 | 0 | 114.8 | ||||
| 318 | T | 51.2 | Low | 54.3 | Low | 127 Ų | 127 | 134.2 Ų | 134.2 | 78% | 0.779 | 81% | 0.813 | S | S | * | * | trans | -174.7 | 149.7 | 166.3 | 54.5 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 319 | P | 70.1 | Confident | 54.3 | Low | 111 Ų | 111 | 132 Ų | 132 | 72% | 0.721 | 81% | 0.812 | S | S | * | * | cis | -134.7 | -146.7 | 7.3 | 43.2 | -23 | 0 | 0 | 0 | 113.7 | ||||
| 320 | D | 52.8 | Low | 54.8 | Low | 149 Ų | 149 | 132.8 Ų | 132.8 | 80% | 0.797 | 81% | 0.812 | S | S | * | * | trans | 68.4 | 150 | 174.3 | -87.1 | -130 | 0 | 0 | 0 | 116.9 | ||||
| 321 | D | 52.3 | Low | 54.7 | Low | 130 Ų | 130 | 133.7 Ų | 133.7 | 70% | 0.695 | 81% | 0.812 | S | S | * | * | cis | -149.4 | -169.9 | -15.5 | -167.8 | 36.2 | 0 | 0 | 0 | 105.6 | ||||
| 322 | T | 47.6 | Very low | 54.7 | Low | 120 Ų | 120 | 135.6 Ų | 135.6 | 74% | 0.736 | 81% | 0.81 | S | S | * | * | cis | -149.4 | 143.5 | 14.4 | -58 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 323 | G | 46.3 | Very low | 54.3 | Low | 75 Ų | 75 | 137.6 Ų | 137.6 | 77% | 0.773 | 81% | 0.808 | S | S | * | * | trans | -156.5 | 23.6 | -177.1 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 324 | R | 51.1 | Low | 54.1 | Low | 240 Ų | 240 | 134.5 Ų | 134.5 | 91% | 0.906 | 80% | 0.804 | S | S | * | * | trans | -59 | 148.9 | 175.1 | -136.2 | 179 | 170.9 | -163.1 | -1.7 | 110.3 | ||||
| 325 | A | 50.1 | Low | 54.1 | Low | 89 Ų | 89 | 137.8 Ų | 137.8 | 74% | 0.736 | 81% | 0.809 | S | S | * | * | cis | -175.9 | 177.5 | 39.1 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 326 | A | 53.3 | Low | 54 | Low | 88 Ų | 88 | 138 Ų | 138 | 73% | 0.727 | 82% | 0.816 | S | S | * | * | cis | -170 | 160.4 | -28 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 327 | P | 60.9 | Low | 53.7 | Low | 124 Ų | 124 | 135.4 Ų | 135.4 | 81% | 0.805 | 82% | 0.818 | S | S | * | * | trans | -91.5 | 161.1 | 178.2 | 36.3 | -35.1 | 0 | 0 | 0 | 114.2 | ||||
| 328 | V | 62.5 | Low | 54.4 | Low | 218 Ų | 218 | 133.7 Ų | 133.7 | 100% | 1.321 | 82% | 0.818 | S | S | * | * | trans | -135 | 0 | 159.1 | 179.5 | 0 | 0 | 0 | 0 | 107.4 |
Retrieved 328 of 328 residues in 51.3 ms
(Link to these results)