| 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 | 42.5 | Very low | 43 | Very low | 247 Ų | 247 | 166.6 Ų | 166.6 | 100% | 1.217 | 88% | 0.875 | S | S | * | * | 0 | 119.2 | 0 | -83.6 | 168.2 | 152.9 | 0 | 0 | 107.8 | |||||
| 2 | F | 37.9 | Very low | 42.4 | Very low | 216 Ų | 216 | 162.8 Ų | 162.8 | 95% | 0.947 | 87% | 0.87 | S | S | * | * | trans | -71.8 | 145.5 | -174.3 | -70.3 | -98.2 | 0 | 0 | 0 | 111.6 | ||||
| 3 | S | 36.5 | Very low | 42.1 | Very low | 118 Ų | 118 | 155.7 Ų | 155.7 | 83% | 0.825 | 86% | 0.858 | S | S | * | * | -168.5 | 117.9 | 114.2 | -154.5 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 4 | A | 43.2 | Very low | 41.9 | Very low | 89 Ų | 89 | 157.1 Ų | 157.1 | 74% | 0.736 | 86% | 0.856 | S | S | * | * | trans | -81.3 | 148.5 | 169.4 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 5 | S | 52 | Low | 41.7 | Very low | 129 Ų | 129 | 158.8 Ų | 158.8 | 90% | 0.902 | 85% | 0.852 | S | S | * | * | trans | -126.8 | 126.9 | 162.2 | -73 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 6 | L | 48 | Very low | 41.9 | Very low | 146 Ų | 146 | 157.3 Ų | 157.3 | 76% | 0.764 | 84% | 0.842 | S | S | * | * | trans | -131.2 | 111.6 | -156.9 | 178.2 | 173.5 | 0 | 0 | 0 | 105.9 | ||||
| 7 | V | 46.3 | Very low | 41.8 | Very low | 136 Ų | 136 | 158.6 Ų | 158.6 | 82% | 0.824 | 84% | 0.842 | S | S | * | * | trans | -164.4 | 137.4 | 160.5 | 176.8 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 8 | R | 42 | Very low | 41.7 | Very low | 216 Ų | 216 | 156.8 Ų | 156.8 | 82% | 0.815 | 84% | 0.838 | S | S | * | * | cis | -170.7 | 131.3 | -22.6 | 171.2 | 175.6 | -75.7 | 160.2 | -4 | 103.7 | ||||
| 9 | A | 39.3 | Very low | 41.3 | Very low | 88 Ų | 88 | 154.2 Ų | 154.2 | 73% | 0.727 | 83% | 0.833 | S | S | * | * | trans | -58.7 | 145.3 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 10 | R | 37.8 | Very low | 41.3 | Very low | 257 Ų | 257 | 151.8 Ų | 151.8 | 97% | 0.97 | 83% | 0.828 | S | S | * | * | trans | -124.7 | 97.2 | 151.1 | -84.6 | -149.4 | 178.7 | -167.1 | 2.3 | 108.5 | ||||
| 11 | Q | 47.9 | Very low | 41 | Very low | 191 Ų | 191 | 147.7 Ų | 147.7 | 89% | 0.893 | 82% | 0.821 | S | S | * | * | trans | -105.7 | 123.7 | 159.6 | -149.6 | 168.9 | 19.9 | 0 | 0 | 105.3 | ||||
| 12 | C | 35.1 | Very low | 41 | Very low | 121 Ų | 121 | 145 Ų | 145 | 82% | 0.818 | 80% | 0.803 | S | S | * | * | trans | -134.1 | 101.5 | 166.5 | -161.6 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 13 | G | 38.8 | Very low | 40.7 | Very low | 70 Ų | 70 | 146.6 Ų | 146.6 | 72% | 0.722 | 80% | 0.803 | S | S | * | * | trans | -99.4 | 136.2 | 162.6 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 14 | E | 39.8 | Very low | 40.9 | Very low | 175 Ų | 175 | 148.8 Ų | 148.8 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | trans | -147 | 98.5 | 158.2 | -110.6 | 176.3 | 103.1 | 0 | 0 | 104.2 | ||||
| 15 | K | 38.4 | Very low | 41 | Very low | 183 Ų | 183 | 152.2 Ų | 152.2 | 80% | 0.796 | 81% | 0.81 | S | S | * | * | 47.6 | 112.4 | 88.6 | -87.5 | -163.3 | 171.8 | -173 | 0 | 115.6 | |||||
| 16 | L | 44.9 | Very low | 40.5 | Very low | 135 Ų | 135 | 152.3 Ų | 152.3 | 71% | 0.707 | 81% | 0.807 | S | S | * | * | trans | 68.8 | 116.4 | 133.5 | -65 | 166.3 | 0 | 0 | 0 | 119 | ||||
| 17 | Q | 39.8 | Very low | 40 | Very low | 179 Ų | 179 | 149.5 Ų | 149.5 | 84% | 0.836 | 81% | 0.805 | S | S | * | * | -149.2 | 105.5 | 129.2 | -99.1 | -73.9 | -55.3 | 0 | 0 | 109 | |||||
| 18 | V | 39.8 | Very low | 39.8 | Very low | 127 Ų | 127 | 149.2 Ų | 149.2 | 77% | 0.77 | 81% | 0.809 | S | S | * | * | trans | -76 | 128.3 | 152.8 | 163.3 | 0 | 0 | 0 | 0 | 106 | ||||
| 19 | S | 34.9 | Very low | 39.4 | Very low | 107 Ų | 107 | 142.7 Ų | 142.7 | 75% | 0.748 | 81% | 0.809 | S | S | * | * | trans | -147.3 | 114.6 | 160.1 | -168.4 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 20 | S | 40.4 | Very low | 39.4 | Very low | 105 Ų | 105 | 150.3 Ų | 150.3 | 73% | 0.734 | 82% | 0.819 | S | S | * | * | trans | -77.2 | 130.5 | 174.3 | 164.9 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 21 | G | 34.9 | Very low | 39.4 | Very low | 66 Ų | 66 | 144.4 Ų | 144.4 | 68% | 0.68 | 81% | 0.811 | S | S | * | * | trans | -147.6 | 76.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 22 | K | 43.8 | Very low | 38.9 | Very low | 191 Ų | 191 | 143.3 Ų | 143.3 | 83% | 0.83 | 81% | 0.811 | S | S | * | * | trans | -58.1 | 131.5 | 160.2 | -74.3 | 178.1 | 172.4 | -166.3 | 0 | 109.1 | ||||
| 23 | W | 31.9 | Very low | 38.8 | Very low | 249 Ų | 249 | 143.2 Ų | 143.2 | 94% | 0.943 | 81% | 0.811 | S | S | * | * | trans | -129.5 | 132.9 | 154.6 | -80.4 | 91.3 | 0 | 0 | 0 | 109.9 | ||||
| 24 | L | 40.6 | Very low | 38.7 | Very low | 164 Ų | 164 | 144.2 Ų | 144.2 | 86% | 0.859 | 81% | 0.813 | S | S | * | * | trans | -77.8 | 159.6 | -175.2 | -72.4 | 155.9 | 0 | 0 | 0 | 111.5 | ||||
| 25 | L | 43.9 | Very low | 38.7 | Very low | 162 Ų | 162 | 141.9 Ų | 141.9 | 85% | 0.848 | 81% | 0.81 | S | S | * | * | trans | -47.3 | 162.4 | 175.3 | -62.2 | 155.3 | 0 | 0 | 0 | 114.2 | ||||
| 26 | P | 42.1 | Very low | 38.6 | Very low | 131 Ų | 131 | 145.7 Ų | 145.7 | 85% | 0.851 | 82% | 0.82 | S | S | * | * | -128.5 | 159.5 | 110.3 | 36.7 | -30.1 | 0 | 0 | 0 | 113.8 | |||||
| 27 | A | 37.9 | Very low | 38.4 | Very low | 87 Ų | 87 | 144.4 Ų | 144.4 | 72% | 0.719 | 82% | 0.821 | S | S | * | * | trans | -88.8 | 158.4 | -169.7 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 28 | S | 41.8 | Very low | 38.6 | Very low | 130 Ų | 130 | 143.4 Ų | 143.4 | 91% | 0.909 | 82% | 0.82 | S | S | * | * | trans | 88.2 | 116.6 | 144.5 | 78.8 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 29 | G | 32.5 | Very low | 38.3 | Very low | 79 Ų | 79 | 147.6 Ų | 147.6 | 81% | 0.814 | 82% | 0.822 | S | S | * | * | trans | 177.3 | 85.1 | 166.4 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 30 | R | 40.6 | Very low | 38.4 | Very low | 248 Ų | 248 | 154.8 Ų | 154.8 | 94% | 0.936 | 83% | 0.833 | S | S | * | * | trans | -61.5 | 133.3 | -179.5 | -57.2 | 172.5 | -152.5 | -158.1 | 1.8 | 110.8 | ||||
| 31 | V | 37.8 | Very low | 37.9 | Very low | 133 Ų | 133 | 159.6 Ų | 159.6 | 81% | 0.806 | 84% | 0.835 | S | S | * | * | trans | -150.9 | 104.6 | 142.4 | -178.4 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 32 | L | 37.1 | Very low | 38.3 | Very low | 168 Ų | 168 | 165.7 Ų | 165.7 | 88% | 0.88 | 85% | 0.846 | S | S | * | * | trans | 38.7 | 97.4 | 143.4 | -55 | 165.9 | 0 | 0 | 0 | 119.4 | ||||
| 33 | S | 32.9 | Very low | 38.2 | Very low | 119 Ų | 119 | 165.4 Ų | 165.4 | 83% | 0.832 | 85% | 0.848 | S | S | * | * | trans | -83.9 | 108.4 | 156.9 | 73 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 34 | A | 36.9 | Very low | 39 | Very low | 91 Ų | 91 | 158.6 Ų | 158.6 | 75% | 0.752 | 84% | 0.835 | S | S | * | * | trans | -77.8 | 120.3 | 164.3 | 0 | 0 | 0 | 0 | 0 | 108.9 | W36 | A34-W36 PolarHBondContact O-N 3.38Š| ||
| 35 | T | 40.3 | Very low | 39.1 | Very low | 125 Ų | 125 | 156.8 Ų | 156.8 | 77% | 0.767 | 83% | 0.834 | S | S | * | * | trans | -60 | 119.6 | -179.1 | 37.4 | 0 | 0 | 0 | 0 | 112 | C37 | T35-C37 PolarHBondContact O-N 2.79Š| ||
| 36 | W | 35.1 | Very low | 38.5 | Very low | 264 Ų | 264 | 160.8 Ų | 160.8 | 100% | 1 | 84% | 0.837 | S | S | * | * | trans | -85.9 | 93.3 | 164 | -87.1 | 61.1 | 0 | 0 | 0 | 108.8 | A34 | A34-W36 PolarHBondContact O-N 3.38Š| ||
| 37 | C | 40.7 | Very low | 38.3 | Very low | 107 Ų | 107 | 166.4 Ų | 166.4 | 72% | 0.723 | 84% | 0.841 | S | S | * | * | trans | -121.1 | 113.1 | 166.4 | -86 | 0 | 0 | 0 | 0 | 110 | T35 | T35-C37 PolarHBondContact O-N 2.79Š| ||
| 38 | L | 44.5 | Very low | 38.5 | Very low | 158 Ų | 158 | 171 Ų | 171 | 83% | 0.827 | 85% | 0.848 | S | S | * | * | trans | 36.6 | 106.6 | 141.4 | -65.8 | 158.1 | 0 | 0 | 0 | 118.3 | ||||
| 39 | R | 34.4 | Very low | 38.6 | Very low | 215 Ų | 215 | 170.5 Ų | 170.5 | 81% | 0.811 | 84% | 0.842 | S | S | * | * | trans | -155.8 | 88.4 | 136.9 | -161.1 | 130.2 | 91.3 | -178.9 | 6.7 | 112 | R41 | R39-R41 HydrophobicContact CG-CB 4.39Å; R39-R41 PolarHBondContact O-N 2.56Å | ||
| 40 | W | 36 | Very low | 38.9 | Very low | 258 Ų | 258 | 171.5 Ų | 171.5 | 98% | 0.977 | 84% | 0.842 | S | S | * | * | trans | -63 | 102.6 | 157.9 | -88 | 82.5 | 0 | 0 | 0 | 108 | ||||
| 41 | R | 30.7 | Very low | 38.8 | Very low | 206 Ų | 206 | 167.9 Ų | 167.9 | 78% | 0.777 | 84% | 0.841 | S | S | * | * | trans | -113.9 | 115 | 171.1 | -154.1 | 179.5 | -163.6 | -142 | 3 | 107.1 | R39 Q43 | R39-R41 HydrophobicContact CG-CB 4.39Å; R39-R41 PolarHBondContact O-N 2.56Å; R41-Q43 PolarHBondContact O-N 2.9Å | ||
| 42 | H | 43.5 | Very low | 39.1 | Very low | 194 Ų | 194 | 172.7 Ų | 172.7 | 90% | 0.898 | 84% | 0.844 | S | S | * | * | trans | -43.3 | 128.9 | 169.7 | -90.3 | -96.7 | 0 | 0 | 0 | 111.5 | ||||
| 43 | Q | 40.1 | Very low | 39.3 | Very low | 186 Ų | 186 | 170.5 Ų | 170.5 | 87% | 0.869 | 84% | 0.84 | S | S | * | * | trans | -114.7 | 117.7 | 172.1 | -160.8 | 164.6 | 24.3 | 0 | 0 | 108.3 | R41 | R41-Q43 PolarHBondContact O-N 2.9Š| ||
| 44 | P | 49.7 | Very low | 39.4 | Very low | 105 Ų | 105 | 174.2 Ų | 174.2 | 68% | 0.682 | 84% | 0.841 | S | S | * | * | P | Polyproline II helix | trans | -78.9 | 158.8 | 172.2 | 31.7 | -31.8 | 0 | 0 | 0 | 110.8 | R46 | P44-R46 PolarHBondContact O-N 2.95Š|
| 45 | P | 43.4 | Very low | 39.3 | Very low | 127 Ų | 127 | 172.8 Ų | 172.8 | 83% | 0.825 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 124.8 | -173.1 | 28.9 | -32.3 | 0 | 0 | 0 | 111.7 | ||
| 46 | R | 31.4 | Very low | 39 | Very low | 246 Ų | 246 | 175.4 Ų | 175.4 | 93% | 0.928 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -76.1 | 119.7 | 164.5 | -89.8 | -169.5 | 175.4 | -179.1 | -0.7 | 108.9 | P44 | P44-R46 PolarHBondContact O-N 2.95Š|
| 47 | R | 36.8 | Very low | 39 | Very low | 248 Ų | 248 | 170.9 Ų | 170.9 | 94% | 0.936 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -78.7 | 122.8 | 165.6 | -72.6 | 179.8 | 173 | 165.1 | -2.4 | 108.8 | ||
| 48 | E | 41.5 | Very low | 39 | Very low | 184 Ų | 184 | 173.3 Ų | 173.3 | 86% | 0.86 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -87.1 | 147.8 | 163.4 | -74.2 | -159.5 | 114.3 | 0 | 0 | 110.7 | ||
| 49 | P | 44.3 | Very low | 38.9 | Very low | 120 Ų | 120 | 172.3 Ų | 172.3 | 78% | 0.779 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -82.6 | 148.6 | -179.6 | 32.8 | -32 | 0 | 0 | 0 | 112.5 | ||
| 50 | A | 38.7 | Very low | 39.1 | Very low | 99 Ų | 99 | 166.6 Ų | 166.6 | 82% | 0.818 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -62.5 | 133.2 | -178.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||
| 51 | L | 39 | Very low | 39.5 | Very low | 173 Ų | 173 | 162.4 Ų | 162.4 | 91% | 0.906 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -66 | 132.4 | 163.3 | -84.1 | 151.3 | 0 | 0 | 0 | 110.5 | ||
| 52 | R | 44.4 | Very low | 40.3 | Very low | 234 Ų | 234 | 159.4 Ų | 159.4 | 88% | 0.883 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 163.1 | 169.8 | -62.4 | -179.4 | 174.8 | -172.2 | -2.4 | 110.8 | ||
| 53 | P | 41.9 | Very low | 40.5 | Very low | 122 Ų | 122 | 156.4 Ų | 156.4 | 79% | 0.792 | 80% | 0.8 | S | S | * | * | -121.1 | 136.9 | 125.8 | 29 | -18.1 | 0 | 0 | 0 | 112.5 | |||||
| 54 | F | 33.4 | Very low | 40.4 | Very low | 196 Ų | 196 | 155 Ų | 155 | 86% | 0.86 | 80% | 0.797 | S | S | * | * | trans | 7.1 | 125.5 | 149 | -93.8 | -108.1 | 0 | 0 | 0 | 118.9 | ||||
| 55 | G | 35.3 | Very low | 39.6 | Very low | 61 Ų | 61 | 160.8 Ų | 160.8 | 63% | 0.629 | 81% | 0.805 | S | S | * | * | trans | -88.5 | 173.8 | 160.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 56 | F | 34.3 | Very low | 39.6 | Very low | 181 Ų | 181 | 159 Ų | 159 | 79% | 0.794 | 79% | 0.793 | S | S | * | * | trans | 174.4 | 105.3 | 137.9 | -99.8 | -74.8 | 0 | 0 | 0 | 107.7 | ||||
| 57 | L | 35 | Very low | 39.9 | Very low | 169 Ų | 169 | 156.1 Ų | 156.1 | 89% | 0.885 | 79% | 0.789 | S | S | * | * | -174.4 | 144.8 | 108.1 | -143.1 | 81.7 | 0 | 0 | 0 | 110.1 | |||||
| 58 | Q | 40.9 | Very low | 40.1 | Very low | 157 Ų | 157 | 148.9 Ų | 148.9 | 73% | 0.734 | 78% | 0.783 | S | S | * | * | trans | -91.5 | 170.1 | -166.6 | -73.4 | 165.4 | -28.5 | 0 | 0 | 114 | ||||
| 59 | D | 43.1 | Very low | 39.7 | Very low | 138 Ų | 138 | 144 Ų | 144 | 74% | 0.738 | 78% | 0.781 | S | S | * | * | trans | 82.5 | 112.9 | 145 | -86.4 | -56.2 | 0 | 0 | 0 | 119.7 | ||||
| 60 | A | 38.6 | Very low | 39.1 | Very low | 94 Ų | 94 | 142 Ų | 142 | 78% | 0.777 | 78% | 0.782 | S | S | * | * | -178.1 | 103.1 | 83.9 | 0 | 0 | 0 | 0 | 0 | 112 | |||||
| 61 | K | 42.9 | Very low | 39.4 | Very low | 170 Ų | 170 | 145.4 Ų | 145.4 | 74% | 0.739 | 79% | 0.786 | S | S | * | * | 20.9 | 117 | 129.2 | -131.1 | -170.1 | 176.1 | -170 | 0 | 118.4 | |||||
| 62 | Q | 48.6 | Very low | 39.3 | Very low | 143 Ų | 143 | 149.2 Ų | 149.2 | 67% | 0.668 | 79% | 0.788 | S | S | * | * | 167.8 | 114 | 96.2 | -84.7 | -171.4 | 22.5 | 0 | 0 | 113.5 | |||||
| 63 | N | 47.8 | Very low | 39 | Very low | 131 Ų | 131 | 143.1 Ų | 143.1 | 70% | 0.701 | 79% | 0.788 | S | S | * | * | trans | -35.1 | 145 | 142 | 43.7 | -26.4 | 0 | 0 | 0 | 116.6 | ||||
| 64 | I | 38.4 | Very low | 38.5 | Very low | 156 Ų | 156 | 141 Ų | 141 | 80% | 0.8 | 79% | 0.788 | S | S | * | * | trans | -167.2 | 111.5 | 135.8 | -86.6 | 139.2 | 0 | 0 | 0 | 110.9 | ||||
| 65 | W | 31.9 | Very low | 39 | Very low | 227 Ų | 227 | 141.9 Ų | 141.9 | 86% | 0.86 | 79% | 0.792 | S | S | * | * | trans | 23.4 | 133.6 | 137.9 | -127.6 | 50.4 | 0 | 0 | 0 | 125.1 | ||||
| 66 | T | 42.5 | Very low | 38.8 | Very low | 91 Ų | 91 | 145 Ų | 145 | 56% | 0.558 | 80% | 0.804 | S | S | * | * | trans | 32.3 | 153.9 | 138.8 | 66.3 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 67 | Q | 37.9 | Very low | 38.9 | Very low | 184 Ų | 184 | 140 Ų | 140 | 86% | 0.86 | 80% | 0.804 | S | S | * | * | cis | -166.5 | 164.1 | 43 | -152.9 | -167.5 | 15.1 | 0 | 0 | 111.3 | ||||
| 68 | A | 41.6 | Very low | 38.9 | Very low | 97 Ų | 97 | 135.8 Ų | 135.8 | 80% | 0.802 | 80% | 0.801 | S | S | * | * | trans | -54.6 | 157.8 | 171.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 69 | G | 32.3 | Very low | 38.9 | Very low | 80 Ų | 80 | 135.8 Ų | 135.8 | 83% | 0.825 | 81% | 0.806 | S | S | * | * | trans | 179.6 | 118.8 | 165.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 70 | G | 32.5 | Very low | 38.7 | Very low | 78 Ų | 78 | 134.1 Ų | 134.1 | 80% | 0.804 | 81% | 0.805 | S | S | * | * | trans | -87.9 | -175.6 | -171.5 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 71 | L | 44.5 | Very low | 38.8 | Very low | 171 Ų | 171 | 138.4 Ų | 138.4 | 90% | 0.895 | 81% | 0.806 | S | S | * | * | trans | -11.8 | 128.5 | 162.5 | -60.2 | 160.7 | 0 | 0 | 0 | 117.4 | ||||
| 72 | R | 37.2 | Very low | 38.5 | Very low | 253 Ų | 253 | 138.8 Ų | 138.8 | 96% | 0.955 | 81% | 0.811 | S | S | * | * | 177.5 | 158.7 | 113.4 | -98.5 | 179.6 | -171.4 | -152 | 3.2 | 113.8 | |||||
| 73 | A | 38.6 | Very low | 38.6 | Very low | 106 Ų | 106 | 138.5 Ų | 138.5 | 88% | 0.876 | 82% | 0.818 | S | S | * | * | trans | -68 | 164 | -169.8 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 74 | G | 30.7 | Very low | 38.6 | Very low | 77 Ų | 77 | 137.2 Ų | 137.2 | 79% | 0.794 | 82% | 0.82 | S | S | * | * | trans | 178.1 | 98.6 | 160.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 75 | K | 44.7 | Very low | 39.2 | Very low | 216 Ų | 216 | 134.6 Ų | 134.6 | 94% | 0.939 | 81% | 0.81 | S | S | * | * | trans | -67.2 | 147.3 | 164.5 | -84.3 | 176.6 | 169.5 | 177.2 | 0 | 110.1 | ||||
| 76 | S | 30.6 | Very low | 40.1 | Very low | 125 Ų | 125 | 131.8 Ų | 131.8 | 87% | 0.874 | 81% | 0.807 | S | S | * | * | -164.1 | 141.9 | 127.6 | -156.2 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 77 | G | 37.5 | Very low | 40.6 | Very low | 77 Ų | 77 | 137.6 Ų | 137.6 | 79% | 0.794 | 82% | 0.819 | S | S | * | * | trans | -88 | 175.6 | -175.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 78 | G | 33.3 | Very low | 41.3 | Very low | 80 Ų | 80 | 133.1 Ų | 133.1 | 83% | 0.825 | 80% | 0.801 | S | S | * | * | trans | -179.4 | 100.8 | 172.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 79 | N | 42.8 | Very low | 41.9 | Very low | 158 Ų | 158 | 134.9 Ų | 134.9 | 85% | 0.845 | 79% | 0.792 | S | S | * | * | trans | -68.5 | 138.2 | 176.4 | 173.9 | 30.9 | 0 | 0 | 0 | 112 | ||||
| 80 | S | 37.6 | Very low | 43 | Very low | 102 Ų | 102 | 137.9 Ų | 137.9 | 71% | 0.713 | 78% | 0.782 | S | S | * | * | trans | -178.8 | 110 | 144.2 | 172.6 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 81 | K | 41.6 | Very low | 44.1 | Very low | 185 Ų | 185 | 139.7 Ų | 139.7 | 80% | 0.804 | 77% | 0.77 | S | S | * | * | trans | 31.4 | 136.2 | 137.9 | -59.2 | -178.5 | 178.8 | -178.9 | 0 | 120.2 | ||||
| 82 | Q | 36.5 | Very low | 44.8 | Very low | 178 Ų | 178 | 137.8 Ų | 137.8 | 83% | 0.832 | 76% | 0.757 | S | S | * | * | trans | 111 | 90.9 | 132.8 | -148.7 | 171.6 | 0.6 | 0 | 0 | 116.7 | ||||
| 83 | V | 50.4 | Low | 46 | Very low | 137 Ų | 137 | 129.9 Ų | 129.9 | 83% | 0.83 | 74% | 0.737 | S | S | * | * | 29 | 119.9 | 125 | -176.8 | 0 | 0 | 0 | 0 | 117.1 | |||||
| 84 | S | 48 | Very low | 47.1 | Very low | 104 Ų | 104 | 130 Ų | 130 | 73% | 0.727 | 72% | 0.722 | S | S | * | * | trans | 127 | 42.4 | 152.8 | -169.3 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 85 | V | 49.8 | Very low | 48.5 | Very low | 100 Ų | 100 | 131.3 Ų | 131.3 | 61% | 0.606 | 71% | 0.71 | S | S | * | * | trans | -140.1 | 49.8 | 163.2 | -163.1 | 0 | 0 | 0 | 0 | 110.7 | D88 | V85-D88 HydrophobicContact CG1-CB 4.28Š| ||
| 86 | Q | 50.7 | Low | 49.6 | Very low | 169 Ų | 169 | 123.5 Ų | 123.5 | 79% | 0.79 | 68% | 0.683 | S | S | * | * | S | Bend | trans | -107.3 | -15.2 | 173.1 | -141.2 | -176.7 | 24.1 | 0 | 0 | 112.4 | ||
| 87 | R | 53.5 | Low | 51.2 | Low | 213 Ų | 213 | 119.8 Ų | 119.8 | 80% | 0.804 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -78.2 | -42.8 | 174.2 | -74 | -172.2 | 172.7 | 100.3 | -0.8 | 111.3 | K90 Q91 | R87-K90 PolarHBondContact O-N 2.87Å; R87-Q91 WeakPolarHBondContact O-CB 3.27Å; R87-Q91 PolarHBondContact O-N 2.89Å |
| 88 | D | 53.1 | Low | 52.6 | Low | 90 Ų | 90 | 119 Ų | 119 | 48% | 0.481 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -68.9 | -43 | -179.4 | -65.6 | -60.9 | 0 | 0 | 0 | 113.4 | V85 K90 Q91 E92 | V85-D88 HydrophobicContact CG1-CB 4.28Å; D88-K90 VanDerWaalsContact C-N 3.35Å; D88-K90 PolarHBondContact O-N 3.32Å; D88-Q91 CarbonylContact O-C 3.6Å; D88-Q91 PolarHBondContact O-N 2.81Å; D88-E92 WeakPolarHBondContact O-CB 3.43Å; D88-E92 WeakPolarHBondContact O-CG 3.19Å; D88-E92 PolarHBondContact O-N 2.83Å |
| 89 | Q | 54.9 | Low | 54.1 | Low | 133 Ų | 133 | 120.8 Ų | 120.8 | 62% | 0.621 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -64.5 | -36.8 | 176.6 | -78.2 | -171.3 | -8.2 | 0 | 0 | 113.2 | T93 | Q89-T93 WeakPolarHBondContact O-CB 3.26Å; Q89-T93 VanDerWaalsContact O-CG2 3.28Å; Q89-T93 WeakPolarHBondContact O-CG2 3.04Å; Q89-T93 PolarHBondContact O-N 3.28Å; Q89-T93 PolarHBondContact O-OG1 3.49Å |
| 90 | K | 54.6 | Low | 55.3 | Low | 143 Ų | 143 | 119.9 Ų | 119.9 | 62% | 0.622 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -71.2 | -35.7 | 175.5 | -167.6 | 178.7 | 179.5 | -175.7 | 0 | 111.1 | R87 D88 T93 L94 | R87-K90 PolarHBondContact O-N 2.87Å; D88-K90 VanDerWaalsContact C-N 3.35Å; D88-K90 PolarHBondContact O-N 3.32Å; K90-T93 VanDerWaalsContact CA-OG1 3.3Å; K90-T93 WeakPolarHBondContact CA-OG1 3.16Å; K90-T93 PolarHBondContact O-OG1 3.44Å; K90-T93 VanDerWaalsContact O-OG1 3.06Å; K90-L94 HydrophobicContact CG-CD1 4.34Å; K90-L94 WeakPolarHBondContact O-CB 3.5Å; K90-L94 WeakPolarHBondContact O-CG 3.23Å; K90-L94 PolarHBondContact O-N 3.37Å |
| 91 | Q | 56.4 | Low | 56.7 | Low | 116 Ų | 116 | 120.1 Ų | 120.1 | 54% | 0.542 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -72.8 | -40.7 | 177.6 | -168.3 | 160.8 | -12.7 | 0 | 0 | 111.4 | R87 D88 L94 L95 | R87-Q91 WeakPolarHBondContact O-CB 3.27Å; R87-Q91 PolarHBondContact O-N 2.89Å; D88-Q91 CarbonylContact O-C 3.6Å; D88-Q91 PolarHBondContact O-N 2.81Å; Q91-L94 PolarHBondContact O-N 2.91Å; Q91-L95 HydrophobicContact CG-CD1 4.24Å; Q91-L95 WeakPolarHBondContact O-CB 3.37Å; Q91-L95 WeakPolarHBondContact O-CG 3.48Å; Q91-L95 PolarHBondContact O-N 3.39Å |
| 92 | E | 58.7 | Low | 57.9 | Low | 131 Ų | 131 | 119.1 Ų | 119.1 | 61% | 0.612 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -68.1 | -37.4 | 174.1 | -72.5 | -170.9 | 169.3 | 0 | 0 | 112.8 | D88 L95 S96 | D88-E92 WeakPolarHBondContact O-CB 3.43Å; D88-E92 WeakPolarHBondContact O-CG 3.19Å; D88-E92 PolarHBondContact O-N 2.83Å; E92-L95 PolarHBondContact O-N 3.06Å; E92-S96 WeakPolarHBondContact O-CB 3.19Å; E92-S96 PolarHBondContact O-N 2.88Å |
| 93 | T | 61.7 | Low | 59.3 | Low | 88 Ų | 88 | 115.8 Ų | 115.8 | 54% | 0.54 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -69.3 | -34.2 | 173.2 | 46.8 | 0 | 0 | 0 | 0 | 112.2 | Q89 K90 A97 | Q89-T93 WeakPolarHBondContact O-CB 3.26Å; Q89-T93 VanDerWaalsContact O-CG2 3.28Å; Q89-T93 WeakPolarHBondContact O-CG2 3.04Å; Q89-T93 PolarHBondContact O-N 3.28Å; Q89-T93 PolarHBondContact O-OG1 3.49Å; K90-T93 VanDerWaalsContact CA-OG1 3.3Å; K90-T93 WeakPolarHBondContact CA-OG1 3.16Å; K90-T93 PolarHBondContact O-OG1 3.44Å; K90-T93 VanDerWaalsContact O-OG1 3.06Å; T93-A97 WeakPolarHBondContact O-CB 3.39Å; T93-A97 PolarHBondContact O-N 3.12Å |
| 94 | L | 61.3 | Low | 60.1 | Low | 107 Ų | 107 | 112 Ų | 112 | 56% | 0.56 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -72.9 | -38 | 172.8 | -73.4 | 174.8 | 0 | 0 | 0 | 112.6 | K90 Q91 A97 A98 | K90-L94 HydrophobicContact CG-CD1 4.34Å; K90-L94 WeakPolarHBondContact O-CB 3.5Å; K90-L94 WeakPolarHBondContact O-CG 3.23Å; K90-L94 PolarHBondContact O-N 3.37Å; Q91-L94 PolarHBondContact O-N 2.91Å; L94-A97 PolarHBondContact O-N 3.23Å; L94-A98 WeakPolarHBondContact O-CB 3.01Å; L94-A98 PolarHBondContact O-N 3.45Å |
| 95 | L | 61.2 | Low | 61.3 | Low | 105 Ų | 105 | 108.8 Ų | 108.8 | 55% | 0.55 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -67.9 | -38.7 | 173.5 | -69.4 | 173.1 | 0 | 0 | 0 | 110.8 | Q91 E92 Q99 | Q91-L95 HydrophobicContact CG-CD1 4.24Å; Q91-L95 WeakPolarHBondContact O-CB 3.37Å; Q91-L95 WeakPolarHBondContact O-CG 3.48Å; Q91-L95 PolarHBondContact O-N 3.39Å; E92-L95 PolarHBondContact O-N 3.06Å; L95-Q99 WeakPolarHBondContact O-CB 3.48Å; L95-Q99 PolarHBondContact O-N 3.32Å |
| 96 | S | 66.9 | Low | 62.4 | Low | 53 Ų | 53 | 111.9 Ų | 111.9 | 37% | 0.371 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -68.3 | -40.4 | 173 | -173.7 | 0 | 0 | 0 | 0 | 112 | E92 Q99 K100 | E92-S96 WeakPolarHBondContact O-CB 3.19Å; E92-S96 PolarHBondContact O-N 2.88Å; S96-Q99 PolarHBondContact O-N 3.11Å; S96-K100 VanDerWaalsContact O-CB 3.3Å; S96-K100 WeakPolarHBondContact O-CB 3.37Å; S96-K100 WeakPolarHBondContact O-CG 3.25Å; S96-K100 PolarHBondContact O-N 2.77Å |
| 97 | A | 65.1 | Low | 63.7 | Low | 46 Ų | 46 | 108.2 Ų | 108.2 | 38% | 0.38 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -67.1 | -43.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | T93 L94 Q99 K100 V101 | T93-A97 WeakPolarHBondContact O-CB 3.39Å; T93-A97 PolarHBondContact O-N 3.12Å; L94-A97 PolarHBondContact O-N 3.23Å; A97-Q99 VanDerWaalsContact C-N 3.33Å; A97-Q99 PolarHBondContact O-N 3.33Å; A97-K100 PolarHBondContact O-N 3.44Å; A97-V101 WeakPolarHBondContact O-CB 3.39Å; A97-V101 WeakPolarHBondContact O-CG2 3.41Å; A97-V101 PolarHBondContact O-N 3.02Å |
| 98 | A | 66.6 | Low | 65.2 | Low | 60 Ų | 60 | 104.8 Ų | 104.8 | 50% | 0.496 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -65 | -37.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | L94 V101 K102 | L94-A98 WeakPolarHBondContact O-CB 3.01Å; L94-A98 PolarHBondContact O-N 3.45Å; A98-V101 PolarHBondContact O-N 2.9Å; A98-K102 VanDerWaalsContact O-CB 3.22Å; A98-K102 WeakPolarHBondContact O-CB 3.5Å; A98-K102 PolarHBondContact O-N 2.73Å |
| 99 | Q | 65.6 | Low | 66.8 | Low | 119 Ų | 119 | 104.5 Ų | 104.5 | 56% | 0.556 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -69.4 | -40 | 175.1 | -171.5 | 174.2 | -32.7 | 0 | 0 | 111.6 | L95 S96 A97 K102 E103 | L95-Q99 WeakPolarHBondContact O-CB 3.48Å; L95-Q99 PolarHBondContact O-N 3.32Å; S96-Q99 PolarHBondContact O-N 3.11Å; A97-Q99 VanDerWaalsContact C-N 3.33Å; A97-Q99 PolarHBondContact O-N 3.33Å; Q99-K102 CarbonylContact O-C 3.6Å; Q99-K102 WeakPolarHBondContact O-CB 3.4Å; Q99-K102 PolarHBondContact O-N 2.98Å; Q99-E103 WeakPolarHBondContact O-CB 3.02Å; Q99-E103 PolarHBondContact O-N 3.16Å |
| 100 | K | 67.1 | Low | 68.5 | Low | 139 Ų | 139 | 105.1 Ų | 105.1 | 60% | 0.604 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -64.2 | -39.6 | 172.3 | -76.6 | 176 | -177.9 | -169.6 | 0 | 112.5 | S96 A97 K102 E103 A104 | S96-K100 VanDerWaalsContact O-CB 3.3Å; S96-K100 WeakPolarHBondContact O-CB 3.37Å; S96-K100 WeakPolarHBondContact O-CG 3.25Å; S96-K100 PolarHBondContact O-N 2.77Å; A97-K100 PolarHBondContact O-N 3.44Å; K100-K102 VanDerWaalsContact C-N 3.34Å; K100-E103 PolarHBondContact O-N 3.29Å; K100-A104 VanDerWaalsContact O-CB 3.31Å; K100-A104 WeakPolarHBondContact O-CB 3.2Å; K100-A104 PolarHBondContact O-N 2.84Å |
| 101 | V | 67.9 | Low | 70.3 | Confident | 106 Ų | 106 | 104.7 Ų | 104.7 | 64% | 0.642 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -67.3 | -37.4 | 173.7 | 170.9 | 0 | 0 | 0 | 0 | 110.7 | A97 A98 A104 G105 | A97-V101 WeakPolarHBondContact O-CB 3.39Å; A97-V101 WeakPolarHBondContact O-CG2 3.41Å; A97-V101 PolarHBondContact O-N 3.02Å; A98-V101 PolarHBondContact O-N 2.9Å; V101-A104 PolarHBondContact O-N 2.89Å; V101-G105 PolarHBondContact O-N 3.07Å |
| 102 | K | 66.1 | Low | 72.1 | Confident | 164 Ų | 164 | 102.2 Ų | 102.2 | 71% | 0.713 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -69.1 | -35.2 | 176.4 | -166.5 | 176 | -176.8 | -177.1 | 0 | 112.3 | A98 Q99 K100 | A98-K102 VanDerWaalsContact O-CB 3.22Å; A98-K102 WeakPolarHBondContact O-CB 3.5Å; A98-K102 PolarHBondContact O-N 2.73Å; Q99-K102 CarbonylContact O-C 3.6Å; Q99-K102 WeakPolarHBondContact O-CB 3.4Å; Q99-K102 PolarHBondContact O-N 2.98Å; K100-K102 VanDerWaalsContact C-N 3.34Å |
| 103 | E | 66.3 | Low | 73.8 | Confident | 109 Ų | 109 | 100.6 Ų | 100.6 | 51% | 0.509 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -69.6 | -47.1 | 171.8 | -80.8 | 170 | -179.1 | 0 | 0 | 111.3 | Q99 K100 G105 R106 D107 | Q99-E103 WeakPolarHBondContact O-CB 3.02Å; Q99-E103 PolarHBondContact O-N 3.16Å; K100-E103 PolarHBondContact O-N 3.29Å; E103-G105 PolarHBondContact O-N 3.37Å; E103-R106 WeakPolarHBondContact O-CB 3.49Å; E103-R106 PolarHBondContact O-N 2.76Å; E103-D107 PolarHBondContact O-N 2.8Å |
| 104 | A | 67.3 | Low | 75.4 | Confident | 57 Ų | 57 | 100.3 Ų | 100.3 | 47% | 0.471 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.1 | -30.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | K100 V101 R106 D107 F108 | K100-A104 VanDerWaalsContact O-CB 3.31Å; K100-A104 WeakPolarHBondContact O-CB 3.2Å; K100-A104 PolarHBondContact O-N 2.84Å; V101-A104 PolarHBondContact O-N 2.89Å; A104-R106 VanDerWaalsContact C-N 3.29Å; A104-R106 PolarHBondContact O-N 3.35Å; A104-D107 PolarHBondContact O-N 3.45Å; A104-F108 PolarHBondContact O-N 3.24Å |
| 105 | G | 72.3 | Confident | 77.1 | Confident | 36 Ų | 36 | 100.9 Ų | 100.9 | 37% | 0.371 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -66 | -28.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | V101 E103 T109 | V101-G105 PolarHBondContact O-N 3.07Å; E103-G105 PolarHBondContact O-N 3.37Å; G105-T109 PolarHBondContact O-N 3.15Å; G105-T109 PolarHBondContact O-OG1 3.03Å; G105-T109 VanDerWaalsContact O-OG1 3.08Å |
| 106 | R | 73.3 | Confident | 78.8 | Confident | 165 Ų | 165 | 100 Ų | 100 | 62% | 0.623 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -73.1 | -40.4 | 174.9 | -64.8 | -179.7 | 70.9 | 179.7 | 1.4 | 111 | E103 A104 F108 T109 Y110 | E103-R106 WeakPolarHBondContact O-CB 3.49Å; E103-R106 PolarHBondContact O-N 2.76Å; A104-R106 VanDerWaalsContact C-N 3.29Å; A104-R106 PolarHBondContact O-N 3.35Å; R106-F108 VanDerWaalsContact C-N 3.33Å; R106-F108 PolarHBondContact O-N 2.69Å; R106-T109 WeakPolarHBondContact O-CB 3.37Å; R106-T109 PolarHBondContact O-N 3.09Å; R106-Y110 VanDerWaalsContact O-CD2 3.23Å; R106-Y110 WeakPolarHBondContact O-CD2 3.46Å; R106-Y110 PolarHBondContact O-N 3.46Å |
| 107 | D | 77.3 | Confident | 80.3 | Confident | 93 Ų | 93 | 99.1 Ų | 99.1 | 50% | 0.497 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.3 | -40.5 | 175.4 | -68.8 | -16.8 | 0 | 0 | 0 | 111.4 | E103 A104 T109 Y110 F111 | E103-D107 PolarHBondContact O-N 2.8Å; A104-D107 PolarHBondContact O-N 3.45Å; D107-T109 PolarHBondContact O-N 3.16Å; D107-Y110 PolarHBondContact O-N 2.94Å; D107-Y110 VanDerWaalsContact O-N 3.08Å; D107-F111 HydrophobicContact CB-CD2 4.46Å; D107-F111 HydrophobicContact CB-CE2 4.3Å; D107-F111 WeakPolarHBondContact O-CD2 3.04Å; D107-F111 PolarHBondContact O-N 2.8Å |
| 108 | F | 86.3 | Confident | 81.8 | Confident | 140 Ų | 140 | 102.2 Ų | 102.2 | 61% | 0.614 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -57.1 | -37.3 | 174.7 | -172 | -100.4 | 0 | 0 | 0 | 112.5 | A104 R106 Y110 F111 V112 | A104-F108 PolarHBondContact O-N 3.24Å; R106-F108 VanDerWaalsContact C-N 3.33Å; R106-F108 PolarHBondContact O-N 2.69Å; F108-Y110 PolarHBondContact O-N 2.62Å; F108-F111 PolarHBondContact O-N 2.91Å; F108-V112 HydrophobicContact CD1-CG2 3.93Å; F108-V112 HydrophobicContact CE1-CG2 3.56Å; F108-V112 HydrophobicContact CZ-CG2 3.9Å; F108-V112 WeakPolarHBondContact O-CG2 3.37Å; F108-V112 PolarHBondContact O-N 2.83Å |
| 109 | T | 86.7 | Confident | 83.3 | Confident | 84 Ų | 84 | 101.6 Ų | 101.6 | 52% | 0.515 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -62.6 | -43.2 | 177.1 | -54.4 | 0 | 0 | 0 | 0 | 111.2 | G105 R106 D107 V112 V113 | G105-T109 PolarHBondContact O-N 3.15Å; G105-T109 PolarHBondContact O-OG1 3.03Å; G105-T109 VanDerWaalsContact O-OG1 3.08Å; R106-T109 WeakPolarHBondContact O-CB 3.37Å; R106-T109 PolarHBondContact O-N 3.09Å; D107-T109 PolarHBondContact O-N 3.16Å; T109-V112 PolarHBondContact O-N 3.41Å; T109-V113 WeakPolarHBondContact O-CG2 3.39Å; T109-V113 PolarHBondContact O-N 2.79Å; T109-V113 VanDerWaalsContact O-N 3.15Å |
| 110 | Y | 89.4 | Confident | 84.8 | Confident | 146 Ų | 146 | 100.8 Ų | 100.8 | 57% | 0.573 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -66.9 | -40 | 175.5 | -60.9 | -60.7 | 0 | 0 | 0 | 112.1 | R106 D107 F108 V112 V113 V114 | R106-Y110 VanDerWaalsContact O-CD2 3.23Å; R106-Y110 WeakPolarHBondContact O-CD2 3.46Å; R106-Y110 PolarHBondContact O-N 3.46Å; D107-Y110 PolarHBondContact O-N 2.94Å; D107-Y110 VanDerWaalsContact O-N 3.08Å; F108-Y110 PolarHBondContact O-N 2.62Å; Y110-V112 VanDerWaalsContact C-N 3.35Å; Y110-V112 PolarHBondContact O-N 2.88Å; Y110-V113 PolarHBondContact O-N 2.91Å; Y110-V114 VanDerWaalsContact O-CG2 3.3Å; Y110-V114 WeakPolarHBondContact O-CG2 3.35Å; Y110-V114 PolarHBondContact O-N 2.91Å |
| 111 | F | 93.1 | Very high | 86.1 | Confident | 135 Ų | 135 | 98.7 Ų | 98.7 | 59% | 0.592 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -59.4 | -43.2 | 174.5 | -79.4 | -70.6 | 0 | 0 | 0 | 112.4 | D107 F108 V113 V114 L115 | D107-F111 HydrophobicContact CB-CD2 4.46Å; D107-F111 HydrophobicContact CB-CE2 4.3Å; D107-F111 WeakPolarHBondContact O-CD2 3.04Å; D107-F111 PolarHBondContact O-N 2.8Å; F108-F111 PolarHBondContact O-N 2.91Å; F111-V113 PolarHBondContact O-N 3.12Å; F111-V114 PolarHBondContact O-N 3.34Å; F111-L115 WeakPolarHBondContact O-CB 3.39Å; F111-L115 WeakPolarHBondContact O-CG 2.99Å; F111-L115 PolarHBondContact O-N 2.75Å |
| 112 | V | 94.3 | Very high | 87.5 | Confident | 64 Ų | 64 | 95.6 Ų | 95.6 | 39% | 0.388 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -60.8 | -46.3 | 176.7 | 171.5 | 0 | 0 | 0 | 0 | 110.7 | F108 T109 Y110 V114 L115 V116 | F108-V112 HydrophobicContact CD1-CG2 3.93Å; F108-V112 HydrophobicContact CE1-CG2 3.56Å; F108-V112 HydrophobicContact CZ-CG2 3.9Å; F108-V112 WeakPolarHBondContact O-CG2 3.37Å; F108-V112 PolarHBondContact O-N 2.83Å; T109-V112 PolarHBondContact O-N 3.41Å; Y110-V112 VanDerWaalsContact C-N 3.35Å; Y110-V112 PolarHBondContact O-N 2.88Å; V112-V114 VanDerWaalsContact C-N 3.33Å; V112-V114 PolarHBondContact O-N 2.98Å; V112-L115 PolarHBondContact O-N 3.03Å; V112-V116 HydrophobicContact CG1-CG2 4.49Å; V112-V116 VanDerWaalsContact O-CG2 3.32Å; V112-V116 WeakPolarHBondContact O-CG2 3.43Å; V112-V116 PolarHBondContact O-N 2.94Å |
| 113 | V | 94.6 | Very high | 88.9 | Confident | 96 Ų | 96 | 89.5 Ų | 89.5 | 58% | 0.582 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -61.5 | -41.8 | 178.2 | 174.8 | 0 | 0 | 0 | 0 | 111.3 | T109 Y110 F111 V116 G117 | T109-V113 WeakPolarHBondContact O-CG2 3.39Å; T109-V113 PolarHBondContact O-N 2.79Å; T109-V113 VanDerWaalsContact O-N 3.15Å; Y110-V113 PolarHBondContact O-N 2.91Å; F111-V113 PolarHBondContact O-N 3.12Å; V113-V116 PolarHBondContact O-N 3.1Å; V113-G117 PolarHBondContact O-N 2.91Å |
| 114 | V | 95.8 | Very high | 90.2 | Very high | 82 Ų | 82 | 89.5 Ų | 89.5 | 50% | 0.497 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64 | -44.5 | 176.8 | 171.7 | 0 | 0 | 0 | 0 | 111.5 | Y110 F111 V112 V116 G117 I118 | Y110-V114 VanDerWaalsContact O-CG2 3.3Å; Y110-V114 WeakPolarHBondContact O-CG2 3.35Å; Y110-V114 PolarHBondContact O-N 2.91Å; F111-V114 PolarHBondContact O-N 3.34Å; V112-V114 VanDerWaalsContact C-N 3.33Å; V112-V114 PolarHBondContact O-N 2.98Å; V114-V116 PolarHBondContact O-N 3.27Å; V114-G117 PolarHBondContact O-N 2.83Å; V114-I118 HydrophobicContact CG1-CD1 3.95Å; V114-I118 WeakPolarHBondContact O-CG1 3.26Å; V114-I118 PolarHBondContact O-N 2.86Å |
| 115 | L | 96.9 | Very high | 91.4 | Very high | 119 Ų | 119 | 92.6 Ų | 92.6 | 62% | 0.623 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63.1 | -41.1 | 177.8 | -73.2 | 174 | 0 | 0 | 0 | 112 | F111 V112 G117 I118 G119 | F111-L115 WeakPolarHBondContact O-CB 3.39Å; F111-L115 WeakPolarHBondContact O-CG 2.99Å; F111-L115 PolarHBondContact O-N 2.75Å; V112-L115 PolarHBondContact O-N 3.03Å; L115-G117 VanDerWaalsContact C-N 3.34Å; L115-I118 PolarHBondContact O-N 2.82Å; L115-G119 PolarHBondContact O-N 3.03Å |
| 116 | V | 97 | Very high | 92.3 | Very high | 88 Ų | 88 | 98.2 Ų | 98.2 | 53% | 0.533 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -62 | -44.2 | 173.8 | 172.1 | 0 | 0 | 0 | 0 | 110.5 | V112 V113 V114 I118 G119 V120 | V112-V116 HydrophobicContact CG1-CG2 4.49Å; V112-V116 VanDerWaalsContact O-CG2 3.32Å; V112-V116 WeakPolarHBondContact O-CG2 3.43Å; V112-V116 PolarHBondContact O-N 2.94Å; V113-V116 PolarHBondContact O-N 3.1Å; V114-V116 PolarHBondContact O-N 3.27Å; V116-I118 PolarHBondContact O-N 2.88Å; V116-G119 PolarHBondContact O-N 3.42Å; V116-V120 HydrophobicContact CG1-CG2 4.31Å; V116-V120 WeakPolarHBondContact O-CG2 3.48Å; V116-V120 PolarHBondContact O-N 2.81Å |
| 117 | G | 96.9 | Very high | 93.1 | Very high | 34 Ų | 34 | 94.5 Ų | 94.5 | 35% | 0.351 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -59 | -45.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113 | V113 V114 L115 T121 | V113-G117 PolarHBondContact O-N 2.91Å; V114-G117 PolarHBondContact O-N 2.83Å; L115-G117 VanDerWaalsContact C-N 3.34Å; G117-T121 VanDerWaalsContact O-CB 3.26Å; G117-T121 WeakPolarHBondContact O-CB 3.11Å; G117-T121 PolarHBondContact O-N 2.92Å; G117-T121 PolarHBondContact O-OG1 2.85Å |
| 118 | I | 97.4 | Very high | 93.5 | Very high | 110 Ų | 110 | 93.7 Ų | 93.7 | 56% | 0.564 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -66.3 | -40 | 175.6 | -65.4 | 169.1 | 0 | 0 | 0 | 110.8 | V114 L115 V116 G122 | V114-I118 HydrophobicContact CG1-CD1 3.95Å; V114-I118 WeakPolarHBondContact O-CG1 3.26Å; V114-I118 PolarHBondContact O-N 2.86Å; L115-I118 PolarHBondContact O-N 2.82Å; V116-I118 PolarHBondContact O-N 2.88Å; I118-G122 WeakPolarHBondContact O-CA 3.41Å; I118-G122 PolarHBondContact O-N 2.88Å |
| 119 | G | 97.4 | Very high | 93.2 | Very high | 48 Ų | 48 | 91.2 Ų | 91.2 | 50% | 0.495 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.2 | -48.5 | 178 | 0 | 0 | 0 | 0 | 0 | 112.6 | L115 V116 G123 | L115-G119 PolarHBondContact O-N 3.03Å; V116-G119 PolarHBondContact O-N 3.42Å; G119-G123 PolarHBondContact O-N 3.13Å |
| 120 | V | 96.9 | Very high | 92.9 | Very high | 101 Ų | 101 | 93 Ų | 93 | 61% | 0.612 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -65.3 | -48.3 | 178.2 | 175 | 0 | 0 | 0 | 0 | 110.7 | V116 G123 L124 | V116-V120 HydrophobicContact CG1-CG2 4.31Å; V116-V120 WeakPolarHBondContact O-CG2 3.48Å; V116-V120 PolarHBondContact O-N 2.81Å; V120-G123 PolarHBondContact O-N 3.27Å; V120-L124 PolarHBondContact O-N 2.79Å |
| 121 | T | 96.2 | Very high | 92.1 | Very high | 95 Ų | 95 | 92.8 Ų | 92.8 | 58% | 0.583 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -65.5 | -45.3 | -178.8 | -52.8 | 0 | 0 | 0 | 0 | 111.2 | G117 F125 | G117-T121 VanDerWaalsContact O-CB 3.26Å; G117-T121 WeakPolarHBondContact O-CB 3.11Å; G117-T121 PolarHBondContact O-N 2.92Å; G117-T121 PolarHBondContact O-OG1 2.85Å; T121-F125 VanDerWaalsContact O-CB 3.23Å; T121-F125 WeakPolarHBondContact O-CB 3.46Å; T121-F125 PolarHBondContact O-N 2.91Å |
| 122 | G | 96.3 | Very high | 91 | Very high | 41 Ų | 41 | 91.9 Ų | 91.9 | 42% | 0.423 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -66.2 | -39.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | I118 Y126 | I118-G122 WeakPolarHBondContact O-CA 3.41Å; I118-G122 PolarHBondContact O-N 2.88Å; G122-Y126 VanDerWaalsContact O-CB 3.24Å; G122-Y126 WeakPolarHBondContact O-CB 3.22Å; G122-Y126 PolarHBondContact O-N 3.43Å |
| 123 | G | 95.6 | Very high | 89.3 | Confident | 36 Ų | 36 | 94.8 Ų | 94.8 | 37% | 0.371 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.6 | -47.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | G119 V120 Y126 V127 | G119-G123 PolarHBondContact O-N 3.13Å; V120-G123 PolarHBondContact O-N 3.27Å; G123-Y126 WeakPolarHBondContact O-CB 3.4Å; G123-Y126 PolarHBondContact O-N 3.29Å; G123-V127 WeakPolarHBondContact O-CG2 3.3Å; G123-V127 PolarHBondContact O-N 2.88Å |
| 124 | L | 93.8 | Very high | 87.8 | Confident | 110 Ų | 110 | 92.9 Ų | 92.9 | 58% | 0.576 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -63.1 | -45.9 | 176.9 | 179.9 | 61.6 | 0 | 0 | 0 | 111.5 | V120 Y126 V127 I128 | V120-L124 PolarHBondContact O-N 2.79Å; L124-Y126 VanDerWaalsContact C-N 3.29Å; L124-Y126 PolarHBondContact O-N 2.81Å; L124-V127 PolarHBondContact O-N 3.44Å; L124-I128 HydrophobicContact CD1-CD1 4.13Å; L124-I128 HydrophobicContact CD1-CG1 4.47Å; L124-I128 HydrophobicContact CG-CD1 3.98Å; L124-I128 WeakPolarHBondContact O-CG1 3.38Å; L124-I128 PolarHBondContact O-N 3.01Å |
| 125 | F | 93.2 | Very high | 85.9 | Confident | 122 Ų | 122 | 90.2 Ų | 90.2 | 54% | 0.535 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.4 | -41.1 | 177 | -161.9 | -97.9 | 0 | 0 | 0 | 111 | T121 V127 I128 F129 | T121-F125 VanDerWaalsContact O-CB 3.23Å; T121-F125 WeakPolarHBondContact O-CB 3.46Å; T121-F125 PolarHBondContact O-N 2.91Å; F125-V127 PolarHBondContact O-N 3.43Å; F125-I128 PolarHBondContact O-N 3.43Å; F125-F129 AromaticContact CD1-CD2 3.46Å; F125-F129 HydrophobicContact CD1-CD2 3.46Å; F125-F129 VanDerWaalsContact CD1-CD2 3.46Å; F125-F129 AromaticContact CD1-CE2 3.56Å; F125-F129 HydrophobicContact CD1-CE2 3.56Å; F125-F129 HydrophobicContact CD1-CG 4.23Å; F125-F129 HydrophobicContact CD1-CZ 4.34Å; F125-F129 HydrophobicContact CD2-CD2 4.17Å; F125-F129 AromaticContact CD2-CE2 3.79Å; F125-F129 HydrophobicContact CD2-CE2 3.79Å; F125-F129 HydrophobicContact CE1-CD1 4.44Å; F125-F129 AromaticContact CE1-CD2 3.39Å; F125-F129 HydrophobicContact CE1-CD2 3.39Å; F125-F129 HydrophobicContact CE1-CE1 4.13Å; F125-F129 AromaticContact CE1-CE2 3.04Å; F125-F129 HydrophobicContact CE1-CE2 3.04Å; F125-F129 HydrophobicContact CE1-CG 4.1Å; F125-F129 AromaticContact CE1-CZ 3.43Å; F125-F129 HydrophobicContact CE1-CZ 3.43Å; F125-F129 VanDerWaalsContact CE1-CZ 3.43Å; F125-F129 HydrophobicContact CE2-CD2 4.11Å; F125-F129 AromaticContact CE2-CE2 3.31Å; F125-F129 HydrophobicContact CE2-CE2 3.31Å; F125-F129 AromaticContact CE2-CZ 4Å; F125-F129 HydrophobicContact CE2-CZ 4Å; F125-F129 AromaticContact CG-CD2 3.88Å; F125-F129 HydrophobicContact CG-CD2 3.88Å; F125-F129 AromaticContact CG-CE2 3.93Å; F125-F129 HydrophobicContact CG-CE2 3.93Å; F125-F129 AromaticContact CZ-CD2 3.77Å; F125-F129 HydrophobicContact CZ-CD2 3.77Å; F125-F129 HydrophobicContact CZ-CE1 4.31Å; F125-F129 AromaticContact CZ-CE2 2.92Å; F125-F129 HydrophobicContact CZ-CE2 2.92Å; F125-F129 AromaticContact CZ-CZ 3.24Å; F125-F129 HydrophobicContact CZ-CZ 3.24Å; F125-F129 WeakPolarHBondContact O-CB 3.31Å; F125-F129 VanDerWaalsContact O-CD2 3.23Å; F125-F129 WeakPolarHBondContact O-CD2 3.47Å; F125-F129 PolarHBondContact O-N 3.11Å |
| 126 | Y | 90.1 | Very high | 84.3 | Confident | 153 Ų | 153 | 86.5 Ų | 86.5 | 60% | 0.6 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -60.2 | -45.2 | 175.7 | 177.7 | -96.3 | 0 | 0 | 0 | 112.3 | G122 G123 L124 F129 K130 | G122-Y126 VanDerWaalsContact O-CB 3.24Å; G122-Y126 WeakPolarHBondContact O-CB 3.22Å; G122-Y126 PolarHBondContact O-N 3.43Å; G123-Y126 WeakPolarHBondContact O-CB 3.4Å; G123-Y126 PolarHBondContact O-N 3.29Å; L124-Y126 VanDerWaalsContact C-N 3.29Å; L124-Y126 PolarHBondContact O-N 2.81Å; Y126-F129 PolarHBondContact O-N 2.93Å; Y126-K130 HydrophobicContact CE1-CD 3.96Å; Y126-K130 WeakPolarHBondContact O-CB 3.4Å; Y126-K130 PolarHBondContact O-N 3.32Å |
| 127 | V | 89.5 | Confident | 83.3 | Confident | 87 Ų | 87 | 83.1 Ų | 83.1 | 53% | 0.527 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -62.6 | -45.6 | 178.2 | 173.9 | 0 | 0 | 0 | 0 | 111.1 | G123 L124 F125 K130 E131 | G123-V127 WeakPolarHBondContact O-CG2 3.3Å; G123-V127 PolarHBondContact O-N 2.88Å; L124-V127 PolarHBondContact O-N 3.44Å; F125-V127 PolarHBondContact O-N 3.43Å; V127-K130 PolarHBondContact O-N 3.45Å; V127-E131 WeakPolarHBondContact O-CB 3.38Å; V127-E131 PolarHBondContact O-N 3.36Å |
| 128 | I | 85.8 | Confident | 82.7 | Confident | 77 Ų | 77 | 82.7 Ų | 82.7 | 40% | 0.395 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -63.9 | -46.6 | 179.5 | -64.8 | 166.4 | 0 | 0 | 0 | 111.1 | L124 F125 K130 E131 L132 | L124-I128 HydrophobicContact CD1-CD1 4.13Å; L124-I128 HydrophobicContact CD1-CG1 4.47Å; L124-I128 HydrophobicContact CG-CD1 3.98Å; L124-I128 WeakPolarHBondContact O-CG1 3.38Å; L124-I128 PolarHBondContact O-N 3.01Å; F125-I128 PolarHBondContact O-N 3.43Å; I128-K130 VanDerWaalsContact C-N 3.33Å; I128-E131 PolarHBondContact O-N 2.96Å; I128-L132 HydrophobicContact CG2-CD1 3.78Å; I128-L132 HydrophobicContact CG2-CG 4.35Å; I128-L132 WeakPolarHBondContact O-CB 3.33Å; I128-L132 WeakPolarHBondContact O-CG 3.43Å; I128-L132 PolarHBondContact O-N 3.17Å |
| 129 | F | 80.7 | Confident | 82.1 | Confident | 88 Ų | 88 | 81.3 Ų | 81.3 | 39% | 0.386 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -65.2 | -41 | 178.1 | -89.4 | -102.9 | 0 | 0 | 0 | 111.4 | F125 Y126 E131 F133 | F125-F129 AromaticContact CD1-CD2 3.46Å; F125-F129 HydrophobicContact CD1-CD2 3.46Å; F125-F129 VanDerWaalsContact CD1-CD2 3.46Å; F125-F129 AromaticContact CD1-CE2 3.56Å; F125-F129 HydrophobicContact CD1-CE2 3.56Å; F125-F129 HydrophobicContact CD1-CG 4.23Å; F125-F129 HydrophobicContact CD1-CZ 4.34Å; F125-F129 HydrophobicContact CD2-CD2 4.17Å; F125-F129 AromaticContact CD2-CE2 3.79Å; F125-F129 HydrophobicContact CD2-CE2 3.79Å; F125-F129 HydrophobicContact CE1-CD1 4.44Å; F125-F129 AromaticContact CE1-CD2 3.39Å; F125-F129 HydrophobicContact CE1-CD2 3.39Å; F125-F129 HydrophobicContact CE1-CE1 4.13Å; F125-F129 AromaticContact CE1-CE2 3.04Å; F125-F129 HydrophobicContact CE1-CE2 3.04Å; F125-F129 HydrophobicContact CE1-CG 4.1Å; F125-F129 AromaticContact CE1-CZ 3.43Å; F125-F129 HydrophobicContact CE1-CZ 3.43Å; F125-F129 VanDerWaalsContact CE1-CZ 3.43Å; F125-F129 HydrophobicContact CE2-CD2 4.11Å; F125-F129 AromaticContact CE2-CE2 3.31Å; F125-F129 HydrophobicContact CE2-CE2 3.31Å; F125-F129 AromaticContact CE2-CZ 4Å; F125-F129 HydrophobicContact CE2-CZ 4Å; F125-F129 AromaticContact CG-CD2 3.88Å; F125-F129 HydrophobicContact CG-CD2 3.88Å; F125-F129 AromaticContact CG-CE2 3.93Å; F125-F129 HydrophobicContact CG-CE2 3.93Å; F125-F129 AromaticContact CZ-CD2 3.77Å; F125-F129 HydrophobicContact CZ-CD2 3.77Å; F125-F129 HydrophobicContact CZ-CE1 4.31Å; F125-F129 AromaticContact CZ-CE2 2.92Å; F125-F129 HydrophobicContact CZ-CE2 2.92Å; F125-F129 AromaticContact CZ-CZ 3.24Å; F125-F129 HydrophobicContact CZ-CZ 3.24Å; F125-F129 WeakPolarHBondContact O-CB 3.31Å; F125-F129 VanDerWaalsContact O-CD2 3.23Å; F125-F129 WeakPolarHBondContact O-CD2 3.47Å; F125-F129 PolarHBondContact O-N 3.11Å; Y126-F129 PolarHBondContact O-N 2.93Å; F129-E131 VanDerWaalsContact C-N 3.34Å; F129-F133 HydrophobicContact CB-CD2 4.49Å; F129-F133 AromaticContact CD1-CD2 3.79Å; F129-F133 HydrophobicContact CD1-CD2 3.79Å; F129-F133 AromaticContact CD1-CE2 3.63Å; F129-F133 HydrophobicContact CD1-CE2 3.63Å; F129-F133 HydrophobicContact CE1-CD2 4.42Å; F129-F133 AromaticContact CE1-CE2 3.79Å; F129-F133 HydrophobicContact CE1-CE2 3.79Å; F129-F133 HydrophobicContact CG-CD2 4.44Å; F129-F133 VanDerWaalsContact O-CB 3.27Å; F129-F133 WeakPolarHBondContact O-CB 3.48Å; F129-F133 WeakPolarHBondContact O-CD2 3.3Å; F129-F133 PolarHBondContact O-N 3.3Å |
| 130 | K | 79.6 | Confident | 81.6 | Confident | 120 Ų | 120 | 84.6 Ų | 84.6 | 52% | 0.522 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -60.1 | -47.5 | 173.8 | -173.7 | -179.7 | 171.4 | -177.9 | 0 | 109.4 | Y126 V127 I128 S134 | Y126-K130 HydrophobicContact CE1-CD 3.96Å; Y126-K130 WeakPolarHBondContact O-CB 3.4Å; Y126-K130 PolarHBondContact O-N 3.32Å; V127-K130 PolarHBondContact O-N 3.45Å; I128-K130 VanDerWaalsContact C-N 3.33Å; K130-S134 WeakPolarHBondContact O-CA 3.2Å; K130-S134 WeakPolarHBondContact O-CB 3.42Å; K130-S134 PolarHBondContact O-N 3.16Å |
| 131 | E | 72.2 | Confident | 81.3 | Confident | 143 Ų | 143 | 80.3 Ų | 80.3 | 67% | 0.668 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -64.7 | -46.4 | -178.8 | -161.6 | 65.2 | -168.7 | 0 | 0 | 112.6 | V127 I128 F129 | V127-E131 WeakPolarHBondContact O-CB 3.38Å; V127-E131 PolarHBondContact O-N 3.36Å; I128-E131 PolarHBondContact O-N 2.96Å; F129-E131 VanDerWaalsContact C-N 3.34Å |
| 132 | L | 71.9 | Confident | 81 | Confident | 116 Ų | 116 | 78 Ų | 78 | 61% | 0.607 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -72.9 | -30.6 | -177.2 | -68.8 | 177.2 | 0 | 0 | 0 | 113.6 | I128 S137 | I128-L132 HydrophobicContact CG2-CD1 3.78Å; I128-L132 HydrophobicContact CG2-CG 4.35Å; I128-L132 WeakPolarHBondContact O-CB 3.33Å; I128-L132 WeakPolarHBondContact O-CG 3.43Å; I128-L132 PolarHBondContact O-N 3.17Å; L132-S137 WeakPolarHBondContact O-CB 3.42Å |
| 133 | F | 58.3 | Low | 80.8 | Confident | 124 Ų | 124 | 77.5 Ų | 77.5 | 54% | 0.544 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -104.3 | 1.1 | 178 | -66.4 | -83.6 | 0 | 0 | 0 | 113.2 | F129 S135 | F129-F133 HydrophobicContact CB-CD2 4.49Å; F129-F133 AromaticContact CD1-CD2 3.79Å; F129-F133 HydrophobicContact CD1-CD2 3.79Å; F129-F133 AromaticContact CD1-CE2 3.63Å; F129-F133 HydrophobicContact CD1-CE2 3.63Å; F129-F133 HydrophobicContact CE1-CD2 4.42Å; F129-F133 AromaticContact CE1-CE2 3.79Å; F129-F133 HydrophobicContact CE1-CE2 3.79Å; F129-F133 HydrophobicContact CG-CD2 4.44Å; F129-F133 VanDerWaalsContact O-CB 3.27Å; F129-F133 WeakPolarHBondContact O-CB 3.48Å; F129-F133 WeakPolarHBondContact O-CD2 3.3Å; F129-F133 PolarHBondContact O-N 3.3Å; F133-S135 PolarHBondContact O-N 2.96Å |
| 134 | S | 62.5 | Low | 80.6 | Confident | 57 Ų | 57 | 79.4 Ų | 79.4 | 40% | 0.399 | 41% | 0.407 | S | S | . | . | S | Bend | trans | -77.2 | 95.1 | 177.6 | 171.9 | 0 | 0 | 0 | 0 | 109.3 | K130 S136 | K130-S134 WeakPolarHBondContact O-CA 3.2Å; K130-S134 WeakPolarHBondContact O-CB 3.42Å; K130-S134 PolarHBondContact O-N 3.16Å; S134-S136 PolarHBondContact O-N 2.88Å; S134-S136 PolarHBondContact O-OG 2.91Å |
| 135 | S | 55.9 | Low | 80.6 | Confident | 26 Ų | 26 | 74.3 Ų | 74.3 | 18% | 0.182 | 38% | 0.381 | C | S | . | . | S | Bend | trans | 56.2 | -15.7 | 164 | -146 | 0 | 0 | 0 | 0 | 118.3 | F133 F221 | F133-S135 PolarHBondContact O-N 2.96Å; S135-F221 WeakPolarHBondContact O-CD2 3.23Å |
| 136 | S | 62.8 | Low | 80.6 | Confident | 41 Ų | 41 | 69.1 Ų | 69.1 | 29% | 0.287 | 36% | 0.359 | S | S | . | . | trans | -106.1 | 1.2 | -171.9 | -39.2 | 0 | 0 | 0 | 0 | 112.8 | S134 F221 | S134-S136 PolarHBondContact O-N 2.88Å; S134-S136 PolarHBondContact O-OG 2.91Å; S136-F221 VanDerWaalsContact CB-CE2 3.43Å; S136-F221 VanDerWaalsContact OG-CE2 3.27Å; S136-F221 WeakPolarHBondContact OG-CE2 3.21Å | ||
| 137 | S | 76.1 | Confident | 80.8 | Confident | 17 Ų | 17 | 68 Ų | 68 | 12% | 0.119 | 36% | 0.359 | C | S | . | . | trans | -77.8 | 128.4 | -176.5 | -170.7 | 0 | 0 | 0 | 0 | 111 | L132 S139 K140 | L132-S137 WeakPolarHBondContact O-CB 3.42Å; S137-S139 PolarHBondContact O-N 2.86Å; S137-S139 VanDerWaalsContact O-N 3.14Å; S137-K140 PolarHBondContact O-N 2.86Å | ||
| 138 | P | 84 | Confident | 81 | Confident | 25 Ų | 25 | 67 Ų | 67 | 16% | 0.162 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -54.7 | -33.1 | 175.4 | -25.1 | 31.7 | 0 | 0 | 0 | 113.4 | K140 I141 Y142 H180 M191 L193 | P138-K140 PolarHBondContact O-N 2.67Å; P138-I141 PolarHBondContact O-N 2.84Å; P138-Y142 VanDerWaalsContact O-CB 3.32Å; P138-Y142 WeakPolarHBondContact O-CB 3.3Å; P138-Y142 PolarHBondContact O-N 3.46Å; P138-H180 HydrophobicContact CB-CB 4.09Å; P138-H180 HydrophobicContact CG-CB 4.06Å; P138-M191 HydrophobicContact CB-SD 4.42Å; P138-M191 HydrophobicContact CG-CE 4.47Å; P138-M191 HydrophobicContact CG-SD 3.86Å; P138-L193 HydrophobicContact CB-CD2 4.03Å; P138-L193 WeakPolarHBondContact O-CD2 3.46Å |
| 139 | S | 85.4 | Confident | 81.4 | Confident | 81 Ų | 81 | 63.3 Ų | 63.3 | 57% | 0.566 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -65.3 | -36.4 | -177.5 | -58.8 | 0 | 0 | 0 | 0 | 113.1 | S137 G143 | S137-S139 PolarHBondContact O-N 2.86Å; S137-S139 VanDerWaalsContact O-N 3.14Å; S139-G143 PolarHBondContact O-N 2.88Å; S139-G143 VanDerWaalsContact O-N 3.07Å |
| 140 | K | 86.9 | Confident | 82 | Confident | 117 Ų | 117 | 65 Ų | 65 | 51% | 0.509 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -69.4 | -48 | 179 | -175.4 | 173.3 | -179.7 | 171.8 | 0 | 110.6 | S137 P138 Y142 G143 D144 | S137-K140 PolarHBondContact O-N 2.86Å; P138-K140 PolarHBondContact O-N 2.67Å; K140-Y142 VanDerWaalsContact C-N 3.29Å; K140-Y142 PolarHBondContact O-N 2.91Å; K140-G143 PolarHBondContact O-N 3.41Å; K140-G143 VanDerWaalsContact O-N 3.09Å; K140-D144 VanDerWaalsContact O-CG 3.3Å; K140-D144 PolarHBondContact O-N 3.25Å |
| 141 | I | 89.9 | Confident | 82.6 | Confident | 11 Ų | 11 | 63.3 Ų | 63.3 | 6% | 0.056 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -64.2 | -36.6 | 178.8 | -67.7 | 154.2 | 0 | 0 | 0 | 111.2 | P138 A145 M191 L193 V210 V212 F221 | P138-I141 PolarHBondContact O-N 2.84Å; I141-A145 WeakPolarHBondContact O-CB 3.47Å; I141-A145 PolarHBondContact O-N 3.24Å; I141-M191 HydrophobicContact CD1-CE 3.09Å; I141-M191 HydrophobicContact CG1-CE 4.46Å; I141-L193 HydrophobicContact CB-CD1 4.33Å; I141-L193 HydrophobicContact CB-CD2 4.07Å; I141-L193 HydrophobicContact CG2-CD1 3.63Å; I141-L193 HydrophobicContact CG2-CD2 3.94Å; I141-L193 HydrophobicContact CG2-CG 4.44Å; I141-V210 HydrophobicContact CG2-CG1 3.99Å; I141-V212 HydrophobicContact CD1-CG1 4.27Å; I141-V212 HydrophobicContact CD1-CG2 3.78Å; I141-V212 HydrophobicContact CG1-CG1 4.31Å; I141-V212 HydrophobicContact CG2-CG1 3.63Å; I141-F221 HydrophobicContact CD1-CB 4.23Å; I141-F221 HydrophobicContact CD1-CG 4.33Å |
| 142 | Y | 91.1 | Very high | 83.7 | Confident | 45 Ų | 45 | 58.3 Ų | 58.3 | 18% | 0.176 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -59.7 | -47.2 | 171 | 166 | -99.2 | 0 | 0 | 0 | 112.2 | P138 K140 A145 L146 G165 V178 F195 | P138-Y142 VanDerWaalsContact O-CB 3.32Å; P138-Y142 WeakPolarHBondContact O-CB 3.3Å; P138-Y142 PolarHBondContact O-N 3.46Å; K140-Y142 VanDerWaalsContact C-N 3.29Å; K140-Y142 PolarHBondContact O-N 2.91Å; Y142-A145 PolarHBondContact O-N 3.09Å; Y142-L146 HydrophobicContact CE1-CD2 4.27Å; Y142-L146 VanDerWaalsContact O-CB 3.27Å; Y142-L146 WeakPolarHBondContact O-CB 3.46Å; Y142-L146 PolarHBondContact O-N 2.86Å; Y142-G165 WeakPolarHBondContact OH-CA 3.34Å; Y142-G165 PolarHBondContact OH-O 3.39Å; Y142-V178 HydrophobicContact CD1-CG2 4.37Å; Y142-V178 HydrophobicContact CD2-CG1 4.48Å; Y142-V178 HydrophobicContact CD2-CG2 3.55Å; Y142-V178 HydrophobicContact CE2-CG2 4.01Å; Y142-V178 HydrophobicContact CG-CG2 3.74Å; Y142-F195 HydrophobicContact CD2-CB 4.03Å; Y142-F195 AromaticContact CD2-CD1 3.73Å; Y142-F195 HydrophobicContact CD2-CD1 3.73Å; Y142-F195 AromaticContact CD2-CD2 3.97Å; Y142-F195 HydrophobicContact CD2-CD2 3.97Å; Y142-F195 HydrophobicContact CD2-CE1 4.05Å; Y142-F195 HydrophobicContact CD2-CE2 4.28Å; Y142-F195 AromaticContact CD2-CG 3.66Å; Y142-F195 HydrophobicContact CD2-CG 3.66Å; Y142-F195 HydrophobicContact CD2-CZ 4.31Å; Y142-F195 HydrophobicContact CE2-CB 3.92Å; Y142-F195 HydrophobicContact CE2-CD1 4.2Å; Y142-F195 AromaticContact CE2-CD2 3.58Å; Y142-F195 HydrophobicContact CE2-CD2 3.58Å; Y142-F195 HydrophobicContact CE2-CE2 4.02Å; Y142-F195 AromaticContact CE2-CG 3.66Å; Y142-F195 HydrophobicContact CE2-CG 3.66Å; Y142-F195 HydrophobicContact CE2-CZ 4.49Å |
| 143 | G | 91.5 | Very high | 84.7 | Confident | 31 Ų | 31 | 57.2 Ų | 57.2 | 32% | 0.32 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -58.5 | -51.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | S139 K140 A145 L146 E147 | S139-G143 PolarHBondContact O-N 2.88Å; S139-G143 VanDerWaalsContact O-N 3.07Å; K140-G143 PolarHBondContact O-N 3.41Å; K140-G143 VanDerWaalsContact O-N 3.09Å; G143-A145 PolarHBondContact O-N 2.98Å; G143-L146 PolarHBondContact O-N 2.73Å; G143-E147 PolarHBondContact O-N 2.76Å |
| 144 | D | 91.5 | Very high | 86.4 | Confident | 77 Ų | 77 | 56.4 Ų | 56.4 | 41% | 0.412 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -61.1 | -43.5 | 179.7 | -62.3 | -15.6 | 0 | 0 | 0 | 111.3 | K140 E147 K148 | K140-D144 VanDerWaalsContact O-CG 3.3Å; K140-D144 PolarHBondContact O-N 3.25Å; D144-E147 PolarHBondContact O-N 2.89Å; D144-K148 WeakPolarHBondContact O-CG 3.18Å; D144-K148 PolarHBondContact O-N 2.96Å |
| 145 | A | 93.4 | Very high | 87.8 | Confident | 3 Ų | 3 | 53.7 Ų | 53.7 | 3% | 0.025 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -67.6 | -39.7 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | I141 Y142 G143 E147 K148 C149 F195 V210 I226 | I141-A145 WeakPolarHBondContact O-CB 3.47Å; I141-A145 PolarHBondContact O-N 3.24Å; Y142-A145 PolarHBondContact O-N 3.09Å; G143-A145 PolarHBondContact O-N 2.98Å; A145-E147 VanDerWaalsContact C-N 3.33Å; A145-K148 PolarHBondContact O-N 3.07Å; A145-C149 PolarHBondContact O-N 3.13Å; A145-C149 PolarHBondContact O-SG 3.31Å; A145-F195 HydrophobicContact CB-CE1 4.01Å; A145-F195 HydrophobicContact CB-CZ 4.02Å; A145-V210 HydrophobicContact CB-CG2 3.66Å; A145-I226 HydrophobicContact CB-CD1 4.13Å |
| 146 | L | 93.8 | Very high | 89.6 | Confident | 13 Ų | 13 | 54.8 Ų | 54.8 | 7% | 0.068 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -65.8 | -37.7 | 176.9 | -178.3 | 64.4 | 0 | 0 | 0 | 111.3 | Y142 G143 C149 R150 F195 I197 | Y142-L146 HydrophobicContact CE1-CD2 4.27Å; Y142-L146 VanDerWaalsContact O-CB 3.27Å; Y142-L146 WeakPolarHBondContact O-CB 3.46Å; Y142-L146 PolarHBondContact O-N 2.86Å; G143-L146 PolarHBondContact O-N 2.73Å; L146-C149 WeakPolarHBondContact O-CB 3.37Å; L146-C149 PolarHBondContact O-N 2.7Å; L146-R150 WeakPolarHBondContact O-CG 3.34Å; L146-R150 PolarHBondContact O-N 3.29Å; L146-F195 HydrophobicContact CD1-CE2 4.29Å; L146-I197 HydrophobicContact CD1-CG2 3.98Å |
| 147 | E | 93.8 | Very high | 90.9 | Very high | 129 Ų | 129 | 56.7 Ų | 56.7 | 60% | 0.603 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -66.5 | -41 | 174.8 | -172.5 | 168.6 | -171 | 0 | 0 | 112 | G143 D144 A145 C149 R150 S151 | G143-E147 PolarHBondContact O-N 2.76Å; D144-E147 PolarHBondContact O-N 2.89Å; A145-E147 VanDerWaalsContact C-N 3.33Å; E147-C149 VanDerWaalsContact C-N 3.32Å; E147-C149 PolarHBondContact O-N 3.02Å; E147-R150 PolarHBondContact O-N 2.91Å; E147-R150 VanDerWaalsContact O-N 3.16Å; E147-S151 PolarHBondContact O-N 2.67Å; E147-S151 PolarHBondContact O-OG 2.7Å |
| 148 | K | 93.6 | Very high | 91.7 | Very high | 66 Ų | 66 | 56.4 Ų | 56.4 | 29% | 0.287 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -60.2 | -40.7 | 170.5 | -72.8 | 179.8 | 178.2 | -172.8 | 0 | 112.2 | D144 A145 R150 S151 H152 I226 I240 E241 | D144-K148 WeakPolarHBondContact O-CG 3.18Å; D144-K148 PolarHBondContact O-N 2.96Å; A145-K148 PolarHBondContact O-N 3.07Å; K148-R150 VanDerWaalsContact C-N 3.33Å; K148-R150 PolarHBondContact O-N 2.95Å; K148-S151 WeakPolarHBondContact CA-OG 3.2Å; K148-S151 PolarHBondContact O-N 3Å; K148-S151 PolarHBondContact O-OG 3.19Å; K148-H152 WeakPolarHBondContact O-CB 3.44Å; K148-H152 PolarHBondContact O-N 3.44Å; K148-H152 VanDerWaalsContact O-N 3.16Å; K148-I226 HydrophobicContact CB-CD1 4.43Å; K148-I226 HydrophobicContact CD-CD1 3.63Å; K148-I240 HydrophobicContact CB-CG2 4.25Å; K148-E241 IonicContact NZ-OE1 2.7Å; K148-E241 IonicContact NZ-OE2 2.79Å; K148-E241 PolarHBondContact NZ-OE2 2.68Å |
| 149 | C | 93.4 | Very high | 92 | Very high | 0 Ų | 0 | 55.2 Ų | 55.2 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -63 | -39.4 | 174 | -64.4 | 0 | 0 | 0 | 0 | 112.2 | A145 L146 E147 S151 I155 I240 | A145-C149 PolarHBondContact O-N 3.13Å; A145-C149 PolarHBondContact O-SG 3.31Å; L146-C149 WeakPolarHBondContact O-CB 3.37Å; L146-C149 PolarHBondContact O-N 2.7Å; E147-C149 VanDerWaalsContact C-N 3.32Å; E147-C149 PolarHBondContact O-N 3.02Å; C149-S151 VanDerWaalsContact C-N 3.34Å; C149-I155 HydrophobicContact CB-CG2 4.47Å; C149-I155 WeakPolarHBondContact O-CB 2.9Å; C149-I155 VanDerWaalsContact O-CG2 3.26Å; C149-I155 WeakPolarHBondContact O-CG2 3.44Å; C149-I240 HydrophobicContact CB-CD1 4.11Å; C149-I240 WeakPolarHBondContact SG-CD1 3.35Å |
| 150 | R | 93.4 | Very high | 92.3 | Very high | 122 Ų | 122 | 52.4 Ų | 52.4 | 46% | 0.46 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -70.2 | -28.3 | -179.9 | -77.4 | 170.9 | 174.4 | 171.9 | -0.9 | 114 | L146 E147 K148 I156 I163 | L146-R150 WeakPolarHBondContact O-CG 3.34Å; L146-R150 PolarHBondContact O-N 3.29Å; E147-R150 PolarHBondContact O-N 2.91Å; E147-R150 VanDerWaalsContact O-N 3.16Å; K148-R150 VanDerWaalsContact C-N 3.33Å; K148-R150 PolarHBondContact O-N 2.95Å; R150-I156 VanDerWaalsContact O-CD1 3.31Å; R150-I156 WeakPolarHBondContact O-CD1 3.46Å; R150-I156 WeakPolarHBondContact O-CG1 3.4Å; R150-I163 HydrophobicContact CG-CB 4.11Å; R150-I163 HydrophobicContact CG-CD1 4.39Å; R150-I163 PolarHBondContact NE-O 2.78Å; R150-I163 VanDerWaalsContact NE-O 3.13Å; R150-I163 PolarHBondContact NH2-O 3.31Å |
| 151 | S | 94 | Very high | 92.4 | Very high | 85 Ų | 85 | 53.5 Ų | 53.5 | 59% | 0.594 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -90.9 | -14.7 | 179.9 | 48.6 | 0 | 0 | 0 | 0 | 113.4 | E147 K148 C149 | E147-S151 PolarHBondContact O-N 2.67Å; E147-S151 PolarHBondContact O-OG 2.7Å; K148-S151 WeakPolarHBondContact CA-OG 3.2Å; K148-S151 PolarHBondContact O-N 3Å; K148-S151 PolarHBondContact O-OG 3.19Å; C149-S151 VanDerWaalsContact C-N 3.34Å |
| 152 | H | 94.7 | Very high | 92.5 | Very high | 39 Ų | 39 | 57 Ų | 57 | 18% | 0.181 | 32% | 0.316 | C | S | . | . | trans | -77.8 | 121.2 | -176.5 | -163.3 | -88.6 | 0 | 0 | 0 | 112.1 | K148 E154 I155 I156 I240 | K148-H152 WeakPolarHBondContact O-CB 3.44Å; K148-H152 PolarHBondContact O-N 3.44Å; K148-H152 VanDerWaalsContact O-N 3.16Å; H152-E154 VanDerWaalsContact C-N 3.3Å; H152-E154 IonicContact CE1-OE2 3.96Å; H152-E154 PolarHBondContact ND1-N 3.12Å; H152-E154 PolarHBondContact O-N 2.88Å; H152-I155 HydrophobicContact CB-CB 4.28Å; H152-I155 HydrophobicContact CB-CG1 3.9Å; H152-I155 PolarHBondContact O-N 2.88Å; H152-I156 WeakPolarHBondContact O-CG1 3.16Å; H152-I156 PolarHBondContact O-N 3.14Å; H152-I156 VanDerWaalsContact O-N 3.09Å; H152-I240 HydrophobicContact CB-CG1 4.32Å; H152-I240 HydrophobicContact CB-CG2 4.38Å | ||
| 153 | P | 93.4 | Very high | 92.6 | Very high | 93 Ų | 93 | 55.2 Ų | 55.2 | 60% | 0.604 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -62.7 | -34.2 | -171.5 | 24.3 | -34.2 | 0 | 0 | 0 | 113.2 | I156 A157 | P153-I156 PolarHBondContact O-N 3.17Å; P153-A157 WeakPolarHBondContact O-CB 3.05Å; P153-A157 PolarHBondContact O-N 2.82Å |
| 154 | E | 92.2 | Very high | 92.6 | Very high | 106 Ų | 106 | 59 Ų | 59 | 50% | 0.495 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -67.8 | -36.3 | 177.5 | -59.6 | -169.4 | 167 | 0 | 0 | 112.4 | H152 A157 V158 I238 | H152-E154 VanDerWaalsContact C-N 3.3Å; H152-E154 IonicContact CE1-OE2 3.96Å; H152-E154 PolarHBondContact ND1-N 3.12Å; H152-E154 PolarHBondContact O-N 2.88Å; E154-A157 PolarHBondContact O-N 3.26Å; E154-V158 WeakPolarHBondContact O-CG2 3.43Å; E154-V158 PolarHBondContact O-N 3.25Å; E154-V158 VanDerWaalsContact O-N 3.12Å; E154-I238 HydrophobicContact CB-CD1 4.45Å; E154-I238 HydrophobicContact CB-CG2 4Å; E154-I238 WeakPolarHBondContact OE2-CG2 3.3Å |
| 155 | I | 93.2 | Very high | 92.6 | Very high | 0 Ų | 0 | 56.1 Ų | 56.1 | 0% | 0 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -69.2 | -44.3 | 178 | -60.1 | -63.5 | 0 | 0 | 0 | 109.2 | C149 H152 A157 V158 F159 I163 I197 V228 I238 I240 | C149-I155 HydrophobicContact CB-CG2 4.47Å; C149-I155 WeakPolarHBondContact O-CB 2.9Å; C149-I155 VanDerWaalsContact O-CG2 3.26Å; C149-I155 WeakPolarHBondContact O-CG2 3.44Å; H152-I155 HydrophobicContact CB-CB 4.28Å; H152-I155 HydrophobicContact CB-CG1 3.9Å; H152-I155 PolarHBondContact O-N 2.88Å; I155-A157 VanDerWaalsContact C-N 3.28Å; I155-A157 PolarHBondContact O-N 3.37Å; I155-V158 PolarHBondContact O-N 2.79Å; I155-V158 VanDerWaalsContact O-N 3.11Å; I155-F159 HydrophobicContact CD1-CE2 4.46Å; I155-F159 HydrophobicContact CG2-CD2 3.67Å; I155-F159 HydrophobicContact CG2-CE2 4.23Å; I155-F159 WeakPolarHBondContact O-CD2 3.24Å; I155-F159 PolarHBondContact O-N 2.76Å; I155-I163 HydrophobicContact CG2-CD1 3.86Å; I155-I197 HydrophobicContact CG2-CD1 4.37Å; I155-V228 HydrophobicContact CD1-CB 3.73Å; I155-V228 HydrophobicContact CD1-CG1 4.1Å; I155-V228 HydrophobicContact CD1-CG2 3.62Å; I155-I238 HydrophobicContact CD1-CB 3.83Å; I155-I238 HydrophobicContact CD1-CD1 3.92Å; I155-I238 HydrophobicContact CD1-CG1 4.49Å; I155-I238 HydrophobicContact CD1-CG2 3.6Å; I155-I238 HydrophobicContact CG1-CG2 4.22Å; I155-I240 HydrophobicContact CD1-CD1 4.24Å; I155-I240 HydrophobicContact CD1-CG1 4.41Å; I155-I240 HydrophobicContact CG1-CD1 3.95Å; I155-I240 HydrophobicContact CG1-CG1 4.16Å |
| 156 | I | 93 | Very high | 92.5 | Very high | 49 Ų | 49 | 58.7 Ų | 58.7 | 25% | 0.251 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -58.3 | -43.2 | 174.8 | -60.8 | 167.3 | 0 | 0 | 0 | 110.3 | R150 H152 P153 V158 G160 E161 | R150-I156 VanDerWaalsContact O-CD1 3.31Å; R150-I156 WeakPolarHBondContact O-CD1 3.46Å; R150-I156 WeakPolarHBondContact O-CG1 3.4Å; H152-I156 WeakPolarHBondContact O-CG1 3.16Å; H152-I156 PolarHBondContact O-N 3.14Å; H152-I156 VanDerWaalsContact O-N 3.09Å; P153-I156 PolarHBondContact O-N 3.17Å; I156-V158 VanDerWaalsContact C-N 3.27Å; I156-V158 PolarHBondContact O-N 2.9Å; I156-G160 WeakPolarHBondContact O-CA 3.27Å; I156-G160 PolarHBondContact O-N 3.06Å; I156-E161 HydrophobicContact CG2-CG 4.14Å |
| 157 | A | 91.5 | Very high | 92.3 | Very high | 81 Ų | 81 | 58.3 Ų | 58.3 | 67% | 0.669 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -63.7 | -30.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | P153 E154 I155 | P153-A157 WeakPolarHBondContact O-CB 3.05Å; P153-A157 PolarHBondContact O-N 2.82Å; E154-A157 PolarHBondContact O-N 3.26Å; I155-A157 VanDerWaalsContact C-N 3.28Å; I155-A157 PolarHBondContact O-N 3.37Å |
| 158 | V | 91.2 | Very high | 92 | Very high | 12 Ų | 12 | 56.3 Ų | 56.3 | 7% | 0.073 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -80.1 | -57.7 | 176.9 | -170.1 | 0 | 0 | 0 | 0 | 111 | E154 I155 I156 K204 V230 I238 | E154-V158 WeakPolarHBondContact O-CG2 3.43Å; E154-V158 PolarHBondContact O-N 3.25Å; E154-V158 VanDerWaalsContact O-N 3.12Å; I155-V158 PolarHBondContact O-N 2.79Å; I155-V158 VanDerWaalsContact O-N 3.11Å; I156-V158 VanDerWaalsContact C-N 3.27Å; I156-V158 PolarHBondContact O-N 2.9Å; V158-K204 WeakPolarHBondContact O-CD 3.39Å; V158-K204 WeakPolarHBondContact O-CE 3.24Å; V158-K204 PolarHBondContact O-NZ 2.9Å; V158-V230 HydrophobicContact CG1-CG1 3.99Å; V158-V230 HydrophobicContact CG1-CG2 4Å; V158-I238 HydrophobicContact CG2-CD1 3.32Å |
| 159 | F | 92 | Very high | 91.3 | Very high | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -91.9 | -22.5 | -164.2 | -68.3 | -80.6 | 0 | 0 | 0 | 112.8 | I155 I163 I197 G199 S200 K204 V228 V230 | I155-F159 HydrophobicContact CD1-CE2 4.46Å; I155-F159 HydrophobicContact CG2-CD2 3.67Å; I155-F159 HydrophobicContact CG2-CE2 4.23Å; I155-F159 WeakPolarHBondContact O-CD2 3.24Å; I155-F159 PolarHBondContact O-N 2.76Å; F159-I163 HydrophobicContact CB-CG1 4.25Å; F159-I197 HydrophobicContact CD2-CD1 4.09Å; F159-I197 HydrophobicContact CE1-CD1 4.29Å; F159-I197 HydrophobicContact CE1-CG1 4.29Å; F159-I197 HydrophobicContact CE2-CD1 3.76Å; F159-I197 HydrophobicContact CZ-CD1 3.87Å; F159-I197 HydrophobicContact CZ-CG1 4.19Å; F159-G199 CarbonylContact O-C 3.57Å; F159-G199 WeakPolarHBondContact O-CA 3.11Å; F159-S200 PolarHBondContact O-N 2.94Å; F159-K204 HydrophobicContact CD1-CB 4.2Å; F159-V228 HydrophobicContact CE2-CG1 4.01Å; F159-V228 HydrophobicContact CZ-CG1 4.15Å; F159-V230 HydrophobicContact CE2-CG2 4.06Å; F159-V230 HydrophobicContact CZ-CB 4.48Å; F159-V230 HydrophobicContact CZ-CG1 4.31Å; F159-V230 HydrophobicContact CZ-CG2 3.93Å |
| 160 | G | 91.1 | Very high | 90.6 | Very high | 21 Ų | 21 | 59.7 Ų | 59.7 | 22% | 0.216 | 34% | 0.337 | C | S | . | . | trans | 70.4 | 172 | -172.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | I156 I163 | I156-G160 WeakPolarHBondContact O-CA 3.27Å; I156-G160 PolarHBondContact O-N 3.06Å; G160-I163 WeakPolarHBondContact O-CG1 2.99Å | ||
| 161 | E | 88.9 | Confident | 89.7 | Confident | 141 Ų | 141 | 66.2 Ų | 66.2 | 66% | 0.659 | 36% | 0.362 | S | S | * | . | S | Bend | trans | -98.4 | 134.6 | 171.4 | -65.9 | -178.4 | 176.5 | 0 | 0 | 109.7 | I156 S200 | I156-E161 HydrophobicContact CG2-CG 4.14Å; E161-S200 WeakPolarHBondContact O-CB 3.47Å |
| 162 | P | 90.9 | Very high | 89 | Confident | 83 Ų | 83 | 73.6 Ų | 73.6 | 54% | 0.539 | 38% | 0.377 | S | S | . | . | S | Bend | cis | -91.7 | 146 | 7.3 | 34.4 | -34.7 | 0 | 0 | 0 | 114.8 | ||
| 163 | I | 93.4 | Very high | 88.2 | Confident | 8 Ų | 8 | 74.4 Ų | 74.4 | 4% | 0.041 | 40% | 0.395 | C | S | . | . | P | Polyproline II helix | trans | -97.3 | 123.3 | 175.5 | -57.2 | 163.6 | 0 | 0 | 0 | 110.7 | R150 I155 F159 G160 I197 | R150-I163 HydrophobicContact CG-CB 4.11Å; R150-I163 HydrophobicContact CG-CD1 4.39Å; R150-I163 PolarHBondContact NE-O 2.78Å; R150-I163 VanDerWaalsContact NE-O 3.13Å; R150-I163 PolarHBondContact NH2-O 3.31Å; I155-I163 HydrophobicContact CG2-CD1 3.86Å; F159-I163 HydrophobicContact CB-CG1 4.25Å; G160-I163 WeakPolarHBondContact O-CG1 2.99Å; I163-I197 HydrophobicContact CG2-CB 4.23Å; I163-I197 HydrophobicContact CG2-CG2 4.49Å |
| 164 | K | 92.3 | Very high | 87.5 | Confident | 110 Ų | 110 | 77.5 Ų | 77.5 | 48% | 0.478 | 40% | 0.395 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.3 | 139.3 | 176.5 | -63.6 | 177.3 | -175 | 168.9 | 0 | 110.2 | Y166 I197 E198 | K164-Y166 HydrophobicContact CB-CE2 4.05Å; K164-Y166 VanDerWaalsContact CD-OH 3.3Å; K164-Y166 WeakPolarHBondContact CD-OH 3.47Å; K164-I197 CarbonylContact O-C 3.53Å; K164-I197 WeakPolarHBondContact O-CA 3.4Å; K164-E198 PolarHBondContact N-O 3.42Å; K164-E198 PolarHBondContact O-N 3.36Å |
| 165 | G | 91.8 | Very high | 86.9 | Confident | 17 Ų | 17 | 78 Ų | 78 | 18% | 0.175 | 39% | 0.392 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109 | 140.3 | 172.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | Y142 Y196 | Y142-G165 WeakPolarHBondContact OH-CA 3.34Å; Y142-G165 PolarHBondContact OH-O 3.39Å; G165-Y196 CarbonylContact C-O 3.41Å; G165-Y196 WeakPolarHBondContact CA-O 3.43Å |
| 166 | Y | 90.5 | Very high | 86.1 | Confident | 58 Ų | 58 | 84.8 Ų | 84.8 | 23% | 0.227 | 42% | 0.424 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.2 | 147.5 | 177.4 | -54.4 | -73.2 | 0 | 0 | 0 | 111.1 | K164 F195 Y196 E198 | K164-Y166 HydrophobicContact CB-CE2 4.05Å; K164-Y166 VanDerWaalsContact CD-OH 3.3Å; K164-Y166 WeakPolarHBondContact CD-OH 3.47Å; Y166-F195 WeakPolarHBondContact O-CB 3.41Å; Y166-Y196 PolarHBondContact N-O 3.43Å; Y166-Y196 PolarHBondContact O-N 3.48Å; Y166-E198 HydrophobicContact CD2-CB 4.36Å; Y166-E198 HydrophobicContact CE2-CB 3.62Å; Y166-E198 HydrophobicContact CE2-CG 4.49Å; Y166-E198 WeakPolarHBondContact CE2-OE2 3.27Å; Y166-E198 PolarHBondContact OH-OE2 3.29Å |
| 167 | G | 90.1 | Very high | 85.5 | Confident | 4 Ų | 4 | 88.1 Ų | 88.1 | 4% | 0.041 | 44% | 0.442 | C | S | . | . | trans | -73.3 | -177.6 | 168.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | R175 L177 | G167-R175 PolarHBondContact N-O 2.83Å; G167-R175 VanDerWaalsContact N-O 3.12Å; G167-L177 CarbonylContact C-O 3.58Å; G167-L177 WeakPolarHBondContact CA-O 3.32Å | ||
| 168 | E | 86.3 | Confident | 85.1 | Confident | 88 Ų | 88 | 85.1 Ų | 85.1 | 41% | 0.411 | 42% | 0.415 | S | S | . | . | B | Isolated β-bridge | trans | -62.5 | 136.9 | 172.9 | -170.6 | 169.8 | -175.4 | 0 | 0 | 110.8 | T170 L177 S179 | E168-T170 PolarHBondContact O-N 3.24Å; E168-L177 PolarHBondContact N-O 3.3Å; E168-S179 WeakPolarHBondContact OE2-CB 3.21Å; E168-S179 PolarHBondContact OE2-OG 3.41Å |
| 169 | A | 80.4 | Confident | 84.8 | Confident | 58 Ų | 58 | 86.1 Ų | 86.1 | 48% | 0.479 | 42% | 0.422 | S | S | . | . | P | Polyproline II helix | trans | -74.9 | 116.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 109.6 | R175 | A169-R175 HydrophobicContact CB-CG 4.29Š|
| 170 | T | 79.1 | Confident | 84.7 | Confident | 78 Ų | 78 | 89.9 Ų | 89.9 | 48% | 0.479 | 44% | 0.44 | S | S | . | . | P | Polyproline II helix | trans | -64.5 | 153.6 | 166.5 | -52.1 | 0 | 0 | 0 | 0 | 109.4 | E168 R172 G173 R174 | E168-T170 PolarHBondContact O-N 3.24Å; T170-R172 PolarHBondContact O-N 3.47Å; T170-G173 PolarHBondContact O-N 3.06Å; T170-R174 PolarHBondContact N-O 3.48Å; T170-R174 PolarHBondContact OG1-O 2.9Å |
| 171 | R | 73.9 | Confident | 84.6 | Confident | 260 Ų | 260 | 94 Ų | 94 | 98% | 0.981 | 46% | 0.456 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -47.4 | -26.1 | 173.2 | -172.3 | 178.8 | 176.4 | -171 | 0.3 | 114.3 | ||
| 172 | R | 78.8 | Confident | 84.6 | Confident | 240 Ų | 240 | 91.5 Ų | 91.5 | 91% | 0.906 | 44% | 0.444 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.6 | 7 | 176.6 | -61.9 | -175.5 | -177.7 | 171.9 | 1.2 | 114.7 | T170 | T170-R172 PolarHBondContact O-N 3.47Š|
| 173 | G | 77.5 | Confident | 84.6 | Confident | 56 Ų | 56 | 90 Ų | 90 | 58% | 0.577 | 43% | 0.428 | S | S | * | . | S | Bend | trans | 82.2 | 4.3 | 179 | 0 | 0 | 0 | 0 | 0 | 116.1 | T170 | T170-G173 PolarHBondContact O-N 3.06Š|
| 174 | R | 78.6 | Confident | 84.5 | Confident | 158 Ų | 158 | 95.9 Ų | 95.9 | 60% | 0.596 | 46% | 0.458 | S | S | * | . | trans | -80.2 | 127.7 | 177.6 | -163.3 | 169 | 179.8 | 170.8 | -1.6 | 109.8 | T170 Q176 | T170-R174 PolarHBondContact N-O 3.48Å; T170-R174 PolarHBondContact OG1-O 2.9Å; R174-Q176 HydrophobicContact CG-CB 4.36Å; R174-Q176 HydrophobicContact CG-CG 3.95Å | ||
| 175 | R | 80.4 | Confident | 84.2 | Confident | 117 Ų | 117 | 95 Ų | 95 | 44% | 0.442 | 45% | 0.454 | S | S | . | . | trans | -112 | 37.9 | -175.1 | -60.5 | -175.5 | 178.7 | 179.2 | -2.9 | 114 | G167 A169 | G167-R175 PolarHBondContact N-O 2.83Å; G167-R175 VanDerWaalsContact N-O 3.12Å; A169-R175 HydrophobicContact CB-CG 4.29Å | ||
| 176 | Q | 76.4 | Confident | 84 | Confident | 141 Ų | 141 | 100.7 Ų | 100.7 | 66% | 0.659 | 48% | 0.481 | S | S | * | . | trans | -95.1 | -18.6 | -167.8 | -71.5 | -174.5 | -13.4 | 0 | 0 | 114.8 | R174 | R174-Q176 HydrophobicContact CG-CB 4.36Å; R174-Q176 HydrophobicContact CG-CG 3.95Å | ||
| 177 | L | 80 | Confident | 83.7 | Confident | 120 Ų | 120 | 101.2 Ų | 101.2 | 63% | 0.628 | 50% | 0.504 | S | S | * | . | B | Isolated β-bridge | trans | -110.6 | 130.2 | -173.9 | -175.1 | 64.4 | 0 | 0 | 0 | 110.9 | G167 E168 | G167-L177 CarbonylContact C-O 3.58Å; G167-L177 WeakPolarHBondContact CA-O 3.32Å; E168-L177 PolarHBondContact N-O 3.3Å |
| 178 | V | 83.4 | Confident | 83.6 | Confident | 17 Ų | 17 | 103 Ų | 103 | 10% | 0.103 | 51% | 0.512 | C | S | . | . | trans | -78.1 | 131.4 | 172.6 | 177.9 | 0 | 0 | 0 | 0 | 109.1 | Y142 H180 L193 F195 | Y142-V178 HydrophobicContact CD1-CG2 4.37Å; Y142-V178 HydrophobicContact CD2-CG1 4.48Å; Y142-V178 HydrophobicContact CD2-CG2 3.55Å; Y142-V178 HydrophobicContact CE2-CG2 4.01Å; Y142-V178 HydrophobicContact CG-CG2 3.74Å; V178-H180 PolarHBondContact O-N 3.43Å; V178-H180 PolarHBondContact O-ND1 3.04Å; V178-L193 HydrophobicContact CG1-CB 4.16Å; V178-L193 HydrophobicContact CG1-CD2 4.14Å; V178-F195 HydrophobicContact CG1-CB 4.18Å | ||
| 179 | S | 85.1 | Confident | 83.7 | Confident | 33 Ų | 33 | 101.8 Ų | 101.8 | 23% | 0.231 | 51% | 0.506 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -68.6 | 119.3 | 174.8 | -155.6 | 0 | 0 | 0 | 0 | 108.2 | E168 L193 K194 | E168-S179 WeakPolarHBondContact OE2-CB 3.21Å; E168-S179 PolarHBondContact OE2-OG 3.41Å; S179-L193 CarbonylContact O-C 3.42Å; S179-L193 WeakPolarHBondContact O-CA 3.16Å; S179-K194 WeakPolarHBondContact CB-O 3.3Å; S179-K194 PolarHBondContact N-O 2.95Å; S179-K194 PolarHBondContact O-N 3.2Å |
| 180 | H | 89.1 | Confident | 84.2 | Confident | 79 Ų | 79 | 99.3 Ų | 99.3 | 37% | 0.366 | 48% | 0.484 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.8 | 143.7 | 179.1 | 65.5 | -77.8 | 0 | 0 | 0 | 110.1 | P138 V178 M191 R192 L193 | P138-H180 HydrophobicContact CB-CB 4.09Å; P138-H180 HydrophobicContact CG-CB 4.06Å; V178-H180 PolarHBondContact O-N 3.43Å; V178-H180 PolarHBondContact O-ND1 3.04Å; H180-M191 HydrophobicContact CB-SD 4.5Å; H180-R192 CarbonylContact C-O 3.54Å; H180-R192 VanDerWaalsContact CA-O 3.24Å; H180-R192 WeakPolarHBondContact CA-O 3.48Å; H180-L193 HydrophobicContact CB-CG 4.38Å |
| 181 | I | 89.6 | Confident | 84.7 | Confident | 108 Ų | 108 | 95.6 Ų | 95.6 | 55% | 0.554 | 46% | 0.462 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -133.5 | 117.9 | 175.8 | -58.2 | 174.7 | 0 | 0 | 0 | 107.2 | M191 R192 | I181-M191 WeakPolarHBondContact O-CA 3.2Å; I181-R192 PolarHBondContact N-O 3.47Å; I181-R192 PolarHBondContact O-N 3.41Å |
| 182 | E | 89.7 | Confident | 85.6 | Confident | 88 Ų | 88 | 88.5 Ų | 88.5 | 41% | 0.411 | 44% | 0.435 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.2 | 134.4 | 171.3 | -63.8 | -178.8 | -164.1 | 0 | 0 | 109.1 | K189 H190 M191 | E182-K189 WeakPolarHBondContact OE2-CE 3.2Å; E182-K189 IonicContact OE2-NZ 3.25Å; E182-K189 PolarHBondContact OE2-NZ 2.74Å; E182-H190 WeakPolarHBondContact CA-O 3.04Å; E182-M191 HydrophobicContact CG-CB 4.29Å; E182-M191 HydrophobicContact CG-CG 3.95Å; E182-M191 HydrophobicContact CG-SD 3.86Å |
| 183 | Y | 90 | Very high | 86.3 | Confident | 51 Ų | 51 | 77.2 Ų | 77.2 | 20% | 0.2 | 39% | 0.392 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -148.6 | 158.9 | 177.2 | 64.9 | -80.9 | 0 | 0 | 0 | 110.2 | K185 H190 R192 E211 | Y183-K185 HydrophobicContact CD2-CB 4.22Å; Y183-K185 HydrophobicContact CE2-CB 4Å; Y183-H190 HydrophobicContact CD1-CB 4.04Å; Y183-H190 HydrophobicContact CD2-CB 3.96Å; Y183-H190 HydrophobicContact CE1-CB 3.54Å; Y183-H190 HydrophobicContact CE2-CB 3.49Å; Y183-H190 VanDerWaalsContact CE2-CB 3.49Å; Y183-H190 AromaticContact CE2-CG 3.87Å; Y183-H190 HydrophobicContact CG-CB 4.22Å; Y183-H190 AromaticContact CZ-CG 3.89Å; Y183-H190 PolarHBondContact N-O 3.2Å; Y183-H190 WeakPolarHBondContact O-CA 3.33Å; Y183-H190 PolarHBondContact O-N 3.46Å; Y183-R192 HydrophobicContact CE1-CB 4.35Å; Y183-R192 HydrophobicContact CE1-CG 3.73Å; Y183-R192 VanDerWaalsContact OH-CZ 3.32Å; Y183-R192 PolarHBondContact OH-NE 2.86Å; Y183-R192 VanDerWaalsContact OH-NE 3.1Å; Y183-R192 PolarHBondContact OH-NH2 3.38Å; Y183-R192 VanDerWaalsContact OH-NH2 3.16Å; Y183-E211 PolarHBondContact OH-OE1 3.08Å; Y183-E211 PolarHBondContact OH-OE2 3.49Å |
| 184 | I | 90.8 | Very high | 87.1 | Confident | 133 Ų | 133 | 78 Ų | 78 | 68% | 0.682 | 38% | 0.38 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -106.5 | 129 | 178.9 | -58.4 | 171 | 0 | 0 | 0 | 107.7 | L188 | I184-L188 WeakPolarHBondContact CA-O 3.41Å |
| 185 | K | 87.8 | Confident | 87.8 | Confident | 90 Ų | 90 | 70.5 Ų | 70.5 | 39% | 0.391 | 35% | 0.352 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.5 | 131.8 | 175.8 | -165.1 | -168.8 | 172.4 | -170.2 | 0 | 108.9 | Y183 G187 L188 | Y183-K185 HydrophobicContact CD2-CB 4.22Å; Y183-K185 HydrophobicContact CE2-CB 4Å; K185-G187 PolarHBondContact O-N 3.03Å; K185-G187 VanDerWaalsContact O-N 3.12Å; K185-L188 PolarHBondContact N-O 2.96Å; K185-L188 PolarHBondContact O-N 2.98Å; K185-L188 VanDerWaalsContact O-O 3.09Å |
| 186 | D | 86.7 | Confident | 88.4 | Confident | 137 Ų | 137 | 68.3 Ų | 68.3 | 73% | 0.733 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.4 | 31.7 | 179.4 | -50.1 | -44.3 | 0 | 0 | 0 | 113.1 | L188 | D186-L188 PolarHBondContact O-N 3.36Š|
| 187 | G | 84.7 | Confident | 89.3 | Confident | 70 Ų | 70 | 61.7 Ų | 61.7 | 72% | 0.722 | 31% | 0.313 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 76.7 | 0.1 | -176.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | K185 | K185-G187 PolarHBondContact O-N 3.03Å; K185-G187 VanDerWaalsContact O-N 3.12Å |
| 188 | L | 87.2 | Confident | 89.9 | Confident | 40 Ų | 40 | 57.9 Ų | 57.9 | 21% | 0.209 | 29% | 0.292 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107 | 145.4 | 179.4 | -62 | 172.3 | 0 | 0 | 0 | 110.3 | I184 K185 D186 H190 P216 | I184-L188 WeakPolarHBondContact CA-O 3.41Å; K185-L188 PolarHBondContact N-O 2.96Å; K185-L188 PolarHBondContact O-N 2.98Å; K185-L188 VanDerWaalsContact O-O 3.09Å; D186-L188 PolarHBondContact O-N 3.36Å; L188-H190 PolarHBondContact O-CD2 2.75Å; L188-P216 HydrophobicContact CD2-CB 4.2Å; L188-P216 HydrophobicContact CD2-CG 4Å |
| 189 | K | 88.7 | Confident | 90.3 | Very high | 63 Ų | 63 | 57.5 Ų | 57.5 | 27% | 0.274 | 29% | 0.292 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.3 | 128.1 | 176.9 | -161.8 | 177.3 | 176.4 | -176.1 | 0 | 109.3 | E182 E214 F221 | E182-K189 WeakPolarHBondContact OE2-CE 3.2Å; E182-K189 IonicContact OE2-NZ 3.25Å; E182-K189 PolarHBondContact OE2-NZ 2.74Å; K189-E214 HydrophobicContact CB-CB 4.01Å; K189-E214 WeakPolarHBondContact CB-OE2 3.3Å; K189-E214 VanDerWaalsContact O-CB 3.3Å; K189-E214 WeakPolarHBondContact O-CB 3.27Å; K189-E214 PolarHBondContact O-N 2.89Å; K189-F221 HydrophobicContact CD-CZ 4.31Å |
| 190 | H | 90.8 | Very high | 90.5 | Very high | 6 Ų | 6 | 59.2 Ų | 59.2 | 3% | 0.028 | 30% | 0.303 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.2 | 148.9 | 172.7 | -71.6 | -109.3 | 0 | 0 | 0 | 109.2 | E182 Y183 L188 E211 V212 | E182-H190 WeakPolarHBondContact CA-O 3.04Å; Y183-H190 HydrophobicContact CD1-CB 4.04Å; Y183-H190 HydrophobicContact CD2-CB 3.96Å; Y183-H190 HydrophobicContact CE1-CB 3.54Å; Y183-H190 HydrophobicContact CE2-CB 3.49Å; Y183-H190 VanDerWaalsContact CE2-CB 3.49Å; Y183-H190 AromaticContact CE2-CG 3.87Å; Y183-H190 HydrophobicContact CG-CB 4.22Å; Y183-H190 AromaticContact CZ-CG 3.89Å; Y183-H190 PolarHBondContact N-O 3.2Å; Y183-H190 WeakPolarHBondContact O-CA 3.33Å; Y183-H190 PolarHBondContact O-N 3.46Å; L188-H190 PolarHBondContact O-CD2 2.75Å; H190-E211 IonicContact ND1-OE1 2.73Å; H190-E211 PolarHBondContact ND1-OE1 3.41Å; H190-V212 WeakPolarHBondContact CA-O 3.12Å |
| 191 | M | 90.8 | Very high | 90.5 | Very high | 0 Ų | 0 | 60.4 Ų | 60.4 | 0% | 0 | 31% | 0.309 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.6 | 128.8 | 170.6 | -176.3 | 168.3 | 56.7 | 0 | 0 | 109.5 | P138 I141 H180 I181 E182 L193 V212 F221 | P138-M191 HydrophobicContact CB-SD 4.42Å; P138-M191 HydrophobicContact CG-CE 4.47Å; P138-M191 HydrophobicContact CG-SD 3.86Å; I141-M191 HydrophobicContact CD1-CE 3.09Å; I141-M191 HydrophobicContact CG1-CE 4.46Å; H180-M191 HydrophobicContact CB-SD 4.5Å; I181-M191 WeakPolarHBondContact O-CA 3.2Å; E182-M191 HydrophobicContact CG-CB 4.29Å; E182-M191 HydrophobicContact CG-CG 3.95Å; E182-M191 HydrophobicContact CG-SD 3.86Å; M191-L193 HydrophobicContact CE-CD1 4.14Å; M191-L193 HydrophobicContact CG-CD1 3.91Å; M191-L193 HydrophobicContact SD-CD1 4.48Å; M191-V212 HydrophobicContact CB-CG2 3.68Å; M191-V212 HydrophobicContact CE-CG2 4.17Å; M191-V212 PolarHBondContact N-O 2.85Å; M191-V212 WeakPolarHBondContact O-CG2 3.32Å; M191-V212 PolarHBondContact O-N 3.37Å; M191-F221 HydrophobicContact CB-CE1 4.35Å |
| 192 | R | 92.4 | Very high | 90.2 | Very high | 111 Ų | 111 | 61.3 Ų | 61.3 | 42% | 0.419 | 32% | 0.322 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104 | 132.5 | 172.4 | -83.2 | 165.8 | -176.9 | 172.5 | 6.8 | 109.1 | H180 I181 Y183 V210 E211 | H180-R192 CarbonylContact C-O 3.54Å; H180-R192 VanDerWaalsContact CA-O 3.24Å; H180-R192 WeakPolarHBondContact CA-O 3.48Å; I181-R192 PolarHBondContact N-O 3.47Å; I181-R192 PolarHBondContact O-N 3.41Å; Y183-R192 HydrophobicContact CE1-CB 4.35Å; Y183-R192 HydrophobicContact CE1-CG 3.73Å; Y183-R192 VanDerWaalsContact OH-CZ 3.32Å; Y183-R192 PolarHBondContact OH-NE 2.86Å; Y183-R192 VanDerWaalsContact OH-NE 3.1Å; Y183-R192 PolarHBondContact OH-NH2 3.38Å; Y183-R192 VanDerWaalsContact OH-NH2 3.16Å; R192-V210 CarbonylContact C-O 3.19Å; R192-V210 VanDerWaalsContact CA-O 3.3Å; R192-V210 WeakPolarHBondContact CA-O 2.75Å; R192-E211 HydrophobicContact CG-CB 4.1Å; R192-E211 HydrophobicContact CG-CG 3.94Å; R192-E211 IonicContact CZ-OE2 3.71Å; R192-E211 VanDerWaalsContact CZ-OE2 3.25Å; R192-E211 IonicContact NE-OE2 2.62Å; R192-E211 PolarHBondContact NE-OE2 3.04Å; R192-E211 IonicContact NH2-OE2 3.94Å; R192-E211 PolarHBondContact NH2-OE2 3.39Å |
| 193 | L | 92.9 | Very high | 90 | Very high | 3 Ų | 3 | 59.3 Ų | 59.3 | 2% | 0.016 | 33% | 0.325 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.2 | 141.4 | 173 | -59.1 | 82.4 | 0 | 0 | 0 | 109.1 | P138 I141 V178 S179 H180 M191 V210 V212 | P138-L193 HydrophobicContact CB-CD2 4.03Å; P138-L193 WeakPolarHBondContact O-CD2 3.46Å; I141-L193 HydrophobicContact CB-CD1 4.33Å; I141-L193 HydrophobicContact CB-CD2 4.07Å; I141-L193 HydrophobicContact CG2-CD1 3.63Å; I141-L193 HydrophobicContact CG2-CD2 3.94Å; I141-L193 HydrophobicContact CG2-CG 4.44Å; V178-L193 HydrophobicContact CG1-CB 4.16Å; V178-L193 HydrophobicContact CG1-CD2 4.14Å; S179-L193 CarbonylContact O-C 3.42Å; S179-L193 WeakPolarHBondContact O-CA 3.16Å; H180-L193 HydrophobicContact CB-CG 4.38Å; M191-L193 HydrophobicContact CE-CD1 4.14Å; M191-L193 HydrophobicContact CG-CD1 3.91Å; M191-L193 HydrophobicContact SD-CD1 4.48Å; L193-V210 HydrophobicContact CB-CB 4.27Å; L193-V210 HydrophobicContact CD1-CG1 4.5Å; L193-V210 PolarHBondContact N-O 3.27Å; L193-V210 PolarHBondContact O-N 3.47Å; L193-V212 HydrophobicContact CD1-CG2 4.44Å |
| 194 | K | 93.3 | Very high | 90 | Very high | 73 Ų | 73 | 59.1 Ų | 59.1 | 32% | 0.317 | 33% | 0.325 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.5 | 125.5 | 172 | -177 | -171.7 | -177.6 | -172.8 | 0 | 108.8 | S179 Y196 T207 V208 | S179-K194 WeakPolarHBondContact CB-O 3.3Å; S179-K194 PolarHBondContact N-O 2.95Å; S179-K194 PolarHBondContact O-N 3.2Å; K194-Y196 PolarHBondContact NZ-OH 2.95Å; K194-T207 HydrophobicContact CD-CG2 4.31Å; K194-T207 HydrophobicContact CG-CG2 3.92Å; K194-V208 WeakPolarHBondContact CA-O 3.37Å |
| 195 | F | 94.5 | Very high | 90.1 | Very high | 0 Ų | 0 | 56.7 Ų | 56.7 | 0% | 0 | 31% | 0.311 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -143.4 | 170.5 | 175.6 | 64.4 | -90.8 | 0 | 0 | 0 | 110.5 | Y142 A145 L146 Y166 V178 I197 V208 V210 | Y142-F195 HydrophobicContact CD2-CB 4.03Å; Y142-F195 AromaticContact CD2-CD1 3.73Å; Y142-F195 HydrophobicContact CD2-CD1 3.73Å; Y142-F195 AromaticContact CD2-CD2 3.97Å; Y142-F195 HydrophobicContact CD2-CD2 3.97Å; Y142-F195 HydrophobicContact CD2-CE1 4.05Å; Y142-F195 HydrophobicContact CD2-CE2 4.28Å; Y142-F195 AromaticContact CD2-CG 3.66Å; Y142-F195 HydrophobicContact CD2-CG 3.66Å; Y142-F195 HydrophobicContact CD2-CZ 4.31Å; Y142-F195 HydrophobicContact CE2-CB 3.92Å; Y142-F195 HydrophobicContact CE2-CD1 4.2Å; Y142-F195 AromaticContact CE2-CD2 3.58Å; Y142-F195 HydrophobicContact CE2-CD2 3.58Å; Y142-F195 HydrophobicContact CE2-CE2 4.02Å; Y142-F195 AromaticContact CE2-CG 3.66Å; Y142-F195 HydrophobicContact CE2-CG 3.66Å; Y142-F195 HydrophobicContact CE2-CZ 4.49Å; A145-F195 HydrophobicContact CB-CE1 4.01Å; A145-F195 HydrophobicContact CB-CZ 4.02Å; L146-F195 HydrophobicContact CD1-CE2 4.29Å; Y166-F195 WeakPolarHBondContact O-CB 3.41Å; V178-F195 HydrophobicContact CG1-CB 4.18Å; F195-I197 HydrophobicContact CD2-CG2 4.04Å; F195-I197 HydrophobicContact CE2-CG2 3.73Å; F195-V208 HydrophobicContact CD1-CB 4.1Å; F195-V208 HydrophobicContact CD1-CG1 4.41Å; F195-V208 HydrophobicContact CD2-CB 3.9Å; F195-V208 HydrophobicContact CD2-CG2 3.98Å; F195-V208 HydrophobicContact CE1-CB 3.78Å; F195-V208 HydrophobicContact CE1-CG1 3.64Å; F195-V208 HydrophobicContact CE2-CB 3.56Å; F195-V208 HydrophobicContact CE2-CG1 3.97Å; F195-V208 HydrophobicContact CE2-CG2 3.5Å; F195-V208 HydrophobicContact CG-CB 4.18Å; F195-V208 HydrophobicContact CZ-CB 3.51Å; F195-V208 HydrophobicContact CZ-CG1 3.4Å; F195-V208 HydrophobicContact CZ-CG2 3.87Å; F195-V208 PolarHBondContact N-O 3.25Å; F195-V208 VanDerWaalsContact N-O 3.13Å; F195-V208 PolarHBondContact O-N 2.93Å; F195-V210 HydrophobicContact CE1-CG2 3.71Å; F195-V210 HydrophobicContact CZ-CG2 4.5Å |
| 196 | Y | 93.7 | Very high | 90.4 | Very high | 71 Ų | 71 | 52.4 Ų | 52.4 | 28% | 0.278 | 29% | 0.292 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.5 | 144.5 | -175.3 | -61.6 | -84.8 | 0 | 0 | 0 | 109.9 | G165 Y166 K194 G206 T207 | G165-Y196 CarbonylContact C-O 3.41Å; G165-Y196 WeakPolarHBondContact CA-O 3.43Å; Y166-Y196 PolarHBondContact N-O 3.43Å; Y166-Y196 PolarHBondContact O-N 3.48Å; K194-Y196 PolarHBondContact NZ-OH 2.95Å; Y196-G206 CarbonylContact C-O 3.6Å; Y196-G206 WeakPolarHBondContact CA-O 3.41Å; Y196-T207 HydrophobicContact CD1-CG2 4.36Å; Y196-T207 WeakPolarHBondContact CD1-OG1 3.39Å; Y196-T207 HydrophobicContact CE1-CG2 4.07Å; Y196-T207 VanDerWaalsContact CE1-OG1 3.3Å; Y196-T207 WeakPolarHBondContact CE1-OG1 3.23Å |
| 197 | I | 94 | Very high | 90.8 | Very high | 2 Ų | 2 | 46.4 Ų | 46.4 | 1% | 0.01 | 26% | 0.26 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.6 | 149.2 | 172.8 | 61 | 169.6 | 0 | 0 | 0 | 110.6 | L146 I155 F159 I163 K164 F195 Q205 G206 V208 V228 | L146-I197 HydrophobicContact CD1-CG2 3.98Å; I155-I197 HydrophobicContact CG2-CD1 4.37Å; F159-I197 HydrophobicContact CD2-CD1 4.09Å; F159-I197 HydrophobicContact CE1-CD1 4.29Å; F159-I197 HydrophobicContact CE1-CG1 4.29Å; F159-I197 HydrophobicContact CE2-CD1 3.76Å; F159-I197 HydrophobicContact CZ-CD1 3.87Å; F159-I197 HydrophobicContact CZ-CG1 4.19Å; I163-I197 HydrophobicContact CG2-CB 4.23Å; I163-I197 HydrophobicContact CG2-CG2 4.49Å; K164-I197 CarbonylContact O-C 3.53Å; K164-I197 WeakPolarHBondContact O-CA 3.4Å; F195-I197 HydrophobicContact CD2-CG2 4.04Å; F195-I197 HydrophobicContact CE2-CG2 3.73Å; I197-Q205 WeakPolarHBondContact O-CA 3.23Å; I197-G206 PolarHBondContact N-O 3.31Å; I197-G206 PolarHBondContact O-N 2.95Å; I197-V208 HydrophobicContact CB-CG2 4.36Å; I197-V208 HydrophobicContact CD1-CG2 3.98Å; I197-V208 HydrophobicContact CG1-CG2 3.93Å; I197-V208 HydrophobicContact CG2-CG2 3.62Å; I197-V228 HydrophobicContact CD1-CG1 3.64Å; I197-V228 HydrophobicContact CG1-CG1 4.31Å |
| 198 | E | 92.7 | Very high | 91.3 | Very high | 41 Ų | 41 | 43 Ų | 43 | 19% | 0.192 | 23% | 0.226 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -129.9 | 134.7 | 176.1 | -174.4 | 176.5 | -151.2 | 0 | 0 | 108.7 | K164 Y166 Q205 | K164-E198 PolarHBondContact N-O 3.42Å; K164-E198 PolarHBondContact O-N 3.36Å; Y166-E198 HydrophobicContact CD2-CB 4.36Å; Y166-E198 HydrophobicContact CE2-CB 3.62Å; Y166-E198 HydrophobicContact CE2-CG 4.49Å; Y166-E198 WeakPolarHBondContact CE2-OE2 3.27Å; Y166-E198 PolarHBondContact OH-OE2 3.29Å; E198-Q205 HydrophobicContact CG-CG 4.31Å |
| 199 | G | 92.4 | Very high | 91.6 | Very high | 9 Ų | 9 | 43.7 Ų | 43.7 | 9% | 0.093 | 23% | 0.228 | C | C | . | . | trans | -81.8 | -174.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | F159 K204 | F159-G199 CarbonylContact O-C 3.57Å; F159-G199 WeakPolarHBondContact O-CA 3.11Å; G199-K204 PolarHBondContact N-O 3.15Å | ||
| 200 | S | 89.8 | Confident | 91.9 | Very high | 68 Ų | 68 | 40.8 Ų | 40.8 | 48% | 0.476 | 22% | 0.215 | S | C | . | . | S | Bend | trans | -70.6 | -34.2 | 174.9 | -174.1 | 0 | 0 | 0 | 0 | 112.2 | F159 E161 | F159-S200 PolarHBondContact O-N 2.94Å; E161-S200 WeakPolarHBondContact O-CB 3.47Å |
| 201 | E | 87.6 | Confident | 92 | Very high | 105 Ų | 105 | 40.5 Ų | 40.5 | 49% | 0.491 | 21% | 0.214 | S | C | . | . | S | Bend | trans | -82.6 | 132.6 | 179.4 | -72.9 | 172.4 | -129.7 | 0 | 0 | 111 | G203 K204 | E201-G203 PolarHBondContact O-N 2.91Å; E201-K204 HydrophobicContact CB-CD 3.95Å; E201-K204 HydrophobicContact CB-CG 4.04Å; E201-K204 PolarHBondContact O-N 3.41Å; E201-K204 VanDerWaalsContact O-N 3.17Å; E201-K204 IonicContact OE1-NZ 2.89Å; E201-K204 PolarHBondContact OE1-NZ 3.5Å; E201-K204 WeakPolarHBondContact OE2-CE 3.48Å; E201-K204 IonicContact OE2-NZ 3.44Å; E201-K204 PolarHBondContact OE2-NZ 3.27Å |
| 202 | P | 84.6 | Confident | 92.1 | Very high | 127 Ų | 127 | 40.6 Ų | 40.6 | 83% | 0.825 | 22% | 0.215 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -62.3 | 129.7 | 177.8 | 26.9 | -33.2 | 0 | 0 | 0 | 110 | ||
| 203 | G | 84.5 | Confident | 92 | Very high | 45 Ų | 45 | 38.7 Ų | 38.7 | 46% | 0.464 | 21% | 0.209 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 92.8 | -3.5 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | E201 Q205 T232 | E201-G203 PolarHBondContact O-N 2.91Å; G203-Q205 PolarHBondContact O-N 3.42Å; G203-T232 PolarHBondContact O-OG1 3.46Å |
| 204 | K | 90.4 | Very high | 91.8 | Very high | 48 Ų | 48 | 41.4 Ų | 41.4 | 21% | 0.209 | 22% | 0.222 | C | C | . | . | trans | -87.7 | 97.3 | 167.3 | -67.9 | -165 | 178.9 | 166.2 | 0 | 110.5 | V158 F159 G199 E201 T232 | V158-K204 WeakPolarHBondContact O-CD 3.39Å; V158-K204 WeakPolarHBondContact O-CE 3.24Å; V158-K204 PolarHBondContact O-NZ 2.9Å; F159-K204 HydrophobicContact CD1-CB 4.2Å; G199-K204 PolarHBondContact N-O 3.15Å; E201-K204 HydrophobicContact CB-CD 3.95Å; E201-K204 HydrophobicContact CB-CG 4.04Å; E201-K204 PolarHBondContact O-N 3.41Å; E201-K204 VanDerWaalsContact O-N 3.17Å; E201-K204 IonicContact OE1-NZ 2.89Å; E201-K204 PolarHBondContact OE1-NZ 3.5Å; E201-K204 WeakPolarHBondContact OE2-CE 3.48Å; E201-K204 IonicContact OE2-NZ 3.44Å; E201-K204 PolarHBondContact OE2-NZ 3.27Å; K204-T232 WeakPolarHBondContact CA-OG1 3.19Å | ||
| 205 | Q | 92.6 | Very high | 91.4 | Very high | 82 Ų | 82 | 39.4 Ų | 39.4 | 38% | 0.383 | 22% | 0.215 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -123.3 | 151.5 | 179.8 | -66.4 | 178.3 | 10.7 | 0 | 0 | 110.2 | I197 E198 G203 D231 T232 | I197-Q205 WeakPolarHBondContact O-CA 3.23Å; E198-Q205 HydrophobicContact CG-CG 4.31Å; G203-Q205 PolarHBondContact O-N 3.42Å; Q205-D231 WeakPolarHBondContact O-CB 3.3Å; Q205-D231 PolarHBondContact O-N 3.43Å; Q205-T232 PolarHBondContact N-OG1 2.8Å |
| 206 | G | 93.8 | Very high | 90.7 | Very high | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 24% | 0.244 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -147.9 | 158 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y196 I197 D229 | Y196-G206 CarbonylContact C-O 3.6Å; Y196-G206 WeakPolarHBondContact CA-O 3.41Å; I197-G206 PolarHBondContact N-O 3.31Å; I197-G206 PolarHBondContact O-N 2.95Å; G206-D229 CarbonylContact C-O 3.52Å; G206-D229 WeakPolarHBondContact CA-O 3.13Å |
| 207 | T | 94.9 | Very high | 89.9 | Confident | 10 Ų | 10 | 49 Ų | 49 | 6% | 0.061 | 27% | 0.27 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.6 | 124.6 | 175.9 | -59.7 | 0 | 0 | 0 | 0 | 108.7 | K194 Y196 H209 V228 D229 D231 | K194-T207 HydrophobicContact CD-CG2 4.31Å; K194-T207 HydrophobicContact CG-CG2 3.92Å; Y196-T207 HydrophobicContact CD1-CG2 4.36Å; Y196-T207 WeakPolarHBondContact CD1-OG1 3.39Å; Y196-T207 HydrophobicContact CE1-CG2 4.07Å; Y196-T207 VanDerWaalsContact CE1-OG1 3.3Å; Y196-T207 WeakPolarHBondContact CE1-OG1 3.23Å; T207-H209 WeakPolarHBondContact CG2-NE2 3.37Å; T207-V228 CarbonylContact O-C 3.52Å; T207-V228 WeakPolarHBondContact O-CA 3.49Å; T207-D229 PolarHBondContact N-O 3.49Å; T207-D229 PolarHBondContact O-N 2.82Å; T207-D231 PolarHBondContact OG1-OD2 3.44Å |
| 208 | V | 95.4 | Very high | 88.9 | Confident | 0 Ų | 0 | 57.7 Ų | 57.7 | 0% | 0 | 30% | 0.303 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.9 | 129 | 177.5 | -171.3 | 0 | 0 | 0 | 0 | 109.3 | K194 F195 I197 V210 I226 F227 V228 | K194-V208 WeakPolarHBondContact CA-O 3.37Å; F195-V208 HydrophobicContact CD1-CB 4.1Å; F195-V208 HydrophobicContact CD1-CG1 4.41Å; F195-V208 HydrophobicContact CD2-CB 3.9Å; F195-V208 HydrophobicContact CD2-CG2 3.98Å; F195-V208 HydrophobicContact CE1-CB 3.78Å; F195-V208 HydrophobicContact CE1-CG1 3.64Å; F195-V208 HydrophobicContact CE2-CB 3.56Å; F195-V208 HydrophobicContact CE2-CG1 3.97Å; F195-V208 HydrophobicContact CE2-CG2 3.5Å; F195-V208 HydrophobicContact CG-CB 4.18Å; F195-V208 HydrophobicContact CZ-CB 3.51Å; F195-V208 HydrophobicContact CZ-CG1 3.4Å; F195-V208 HydrophobicContact CZ-CG2 3.87Å; F195-V208 PolarHBondContact N-O 3.25Å; F195-V208 VanDerWaalsContact N-O 3.13Å; F195-V208 PolarHBondContact O-N 2.93Å; I197-V208 HydrophobicContact CB-CG2 4.36Å; I197-V208 HydrophobicContact CD1-CG2 3.98Å; I197-V208 HydrophobicContact CG1-CG2 3.93Å; I197-V208 HydrophobicContact CG2-CG2 3.62Å; V208-V210 HydrophobicContact CG1-CG2 3.98Å; V208-I226 HydrophobicContact CG1-CG2 4.05Å; V208-F227 WeakPolarHBondContact CA-O 3.5Å; V208-V228 HydrophobicContact CB-CG2 4.48Å; V208-V228 HydrophobicContact CG1-CG2 4.15Å; V208-V228 HydrophobicContact CG2-CG1 4.2Å; V208-V228 HydrophobicContact CG2-CG2 3.89Å |
| 209 | H | 95 | Very high | 88 | Confident | 54 Ų | 54 | 57.7 Ų | 57.7 | 25% | 0.25 | 31% | 0.314 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.3 | 121 | 175.2 | -70 | -80.4 | 0 | 0 | 0 | 109.2 | T207 F227 D229 | T207-H209 WeakPolarHBondContact CG2-NE2 3.37Å; H209-F227 HydrophobicContact CB-CD1 4.17Å; H209-F227 HydrophobicContact CB-CD2 3.96Å; H209-F227 HydrophobicContact CB-CE1 3.71Å; H209-F227 HydrophobicContact CB-CE2 3.46Å; H209-F227 VanDerWaalsContact CB-CE2 3.46Å; H209-F227 HydrophobicContact CB-CG 4.3Å; H209-F227 HydrophobicContact CB-CZ 3.31Å; H209-F227 AromaticContact CD2-CE2 3.4Å; H209-F227 WeakPolarHBondContact CD2-CE2 3.22Å; H209-F227 AromaticContact CD2-CZ 3.93Å; H209-F227 AromaticContact CG-CE2 3.61Å; H209-F227 AromaticContact CG-CZ 3.69Å; H209-F227 PolarHBondContact N-O 3.19Å; H209-F227 PolarHBondContact O-N 3.33Å; H209-D229 IonicContact CD2-OD2 3.03Å; H209-D229 IonicContact NE2-OD2 3.6Å |
| 210 | V | 94.5 | Very high | 87.3 | Confident | 2 Ų | 2 | 65 Ų | 65 | 1% | 0.012 | 34% | 0.339 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.8 | 132.9 | 179.1 | -177.9 | 0 | 0 | 0 | 0 | 108.6 | I141 A145 R192 L193 F195 V208 V212 I226 | I141-V210 HydrophobicContact CG2-CG1 3.99Å; A145-V210 HydrophobicContact CB-CG2 3.66Å; R192-V210 CarbonylContact C-O 3.19Å; R192-V210 VanDerWaalsContact CA-O 3.3Å; R192-V210 WeakPolarHBondContact CA-O 2.75Å; L193-V210 HydrophobicContact CB-CB 4.27Å; L193-V210 HydrophobicContact CD1-CG1 4.5Å; L193-V210 PolarHBondContact N-O 3.27Å; L193-V210 PolarHBondContact O-N 3.47Å; F195-V210 HydrophobicContact CE1-CG2 3.71Å; F195-V210 HydrophobicContact CZ-CG2 4.5Å; V208-V210 HydrophobicContact CG1-CG2 3.98Å; V210-V212 HydrophobicContact CG1-CG1 4.17Å; V210-I226 HydrophobicContact CG1-CG1 4.1Å; V210-I226 HydrophobicContact CG2-CG1 4.2Å; V210-I226 HydrophobicContact CG2-CG2 4.2Å |
| 211 | E | 92.9 | Very high | 87 | Confident | 0 Ų | 0 | 63 Ų | 63 | 0% | 0 | 32% | 0.321 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.5 | 129.3 | 165.7 | -174.1 | 175 | 132 | 0 | 0 | 109.3 | Y183 H190 R192 R224 Y225 | Y183-E211 PolarHBondContact OH-OE1 3.08Å; Y183-E211 PolarHBondContact OH-OE2 3.49Å; H190-E211 IonicContact ND1-OE1 2.73Å; H190-E211 PolarHBondContact ND1-OE1 3.41Å; R192-E211 HydrophobicContact CG-CB 4.1Å; R192-E211 HydrophobicContact CG-CG 3.94Å; R192-E211 IonicContact CZ-OE2 3.71Å; R192-E211 VanDerWaalsContact CZ-OE2 3.25Å; R192-E211 IonicContact NE-OE2 2.62Å; R192-E211 PolarHBondContact NE-OE2 3.04Å; R192-E211 IonicContact NH2-OE2 3.94Å; R192-E211 PolarHBondContact NH2-OE2 3.39Å; E211-R224 HydrophobicContact CG-CB 4.49Å; E211-R224 WeakPolarHBondContact O-CB 3.43Å; E211-R224 PolarHBondContact O-N 2.96Å; E211-R224 VanDerWaalsContact OE1-CD 3.25Å; E211-R224 WeakPolarHBondContact OE1-CD 3.26Å; E211-R224 IonicContact OE1-CZ 3.74Å; E211-R224 IonicContact OE1-NE 3.91Å; E211-R224 IonicContact OE1-NH1 2.77Å; E211-R224 PolarHBondContact OE1-NH1 3.47Å; E211-Y225 HydrophobicContact CB-CD1 3.98Å; E211-Y225 HydrophobicContact CB-CD2 4.2Å; E211-Y225 HydrophobicContact CB-CE1 3.5Å; E211-Y225 HydrophobicContact CB-CE2 3.71Å; E211-Y225 HydrophobicContact CB-CG 4.33Å; E211-Y225 HydrophobicContact CG-CE1 4.09Å; E211-Y225 PolarHBondContact N-O 3.08Å; E211-Y225 PolarHBondContact O-N 2.85Å; E211-Y225 WeakPolarHBondContact OE2-CE1 3.32Å; E211-Y225 PolarHBondContact OE2-OH 3.35Å |
| 212 | V | 92 | Very high | 87.1 | Confident | 2 Ų | 2 | 62.3 Ų | 62.3 | 1% | 0.012 | 32% | 0.318 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.4 | 151 | 171.7 | -63.4 | 0 | 0 | 0 | 0 | 110.2 | I141 H190 M191 L193 V210 F221 E222 V223 | I141-V212 HydrophobicContact CD1-CG1 4.27Å; I141-V212 HydrophobicContact CD1-CG2 3.78Å; I141-V212 HydrophobicContact CG1-CG1 4.31Å; I141-V212 HydrophobicContact CG2-CG1 3.63Å; H190-V212 WeakPolarHBondContact CA-O 3.12Å; M191-V212 HydrophobicContact CB-CG2 3.68Å; M191-V212 HydrophobicContact CE-CG2 4.17Å; M191-V212 PolarHBondContact N-O 2.85Å; M191-V212 WeakPolarHBondContact O-CG2 3.32Å; M191-V212 PolarHBondContact O-N 3.37Å; L193-V212 HydrophobicContact CD1-CG2 4.44Å; V210-V212 HydrophobicContact CG1-CG1 4.17Å; V212-F221 HydrophobicContact CB-CB 4.13Å; V212-F221 HydrophobicContact CB-CD1 4.11Å; V212-F221 HydrophobicContact CG2-CB 4.2Å; V212-F221 HydrophobicContact CG2-CD1 3.51Å; V212-F221 HydrophobicContact CG2-CE1 4.32Å; V212-F221 HydrophobicContact CG2-CG 4.19Å; V212-E222 CarbonylContact C-O 3.49Å; V212-E222 WeakPolarHBondContact CA-O 3.41Å; V212-E222 WeakPolarHBondContact CB-O 3.49Å; V212-V223 HydrophobicContact CG1-CG2 4.16Å |
| 213 | K | 90.8 | Very high | 87.4 | Confident | 71 Ų | 71 | 57.6 Ų | 57.6 | 31% | 0.309 | 29% | 0.287 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123 | 136 | 177.7 | 178.1 | -176.6 | 174.9 | -170.6 | 0 | 109 | F221 E222 | K213-F221 CarbonylContact O-C 3.57Å; K213-F221 WeakPolarHBondContact O-CA 3.37Å; K213-E222 PolarHBondContact N-O 2.98Å; K213-E222 PolarHBondContact O-N 3.44Å |
| 214 | E | 87.8 | Confident | 87.7 | Confident | 60 Ų | 60 | 58.2 Ų | 58.2 | 28% | 0.28 | 28% | 0.276 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.5 | 128 | 172.1 | -174.2 | 172.3 | -166.4 | 0 | 0 | 110.2 | K189 F221 | K189-E214 HydrophobicContact CB-CB 4.01Å; K189-E214 WeakPolarHBondContact CB-OE2 3.3Å; K189-E214 VanDerWaalsContact O-CB 3.3Å; K189-E214 WeakPolarHBondContact O-CB 3.27Å; K189-E214 PolarHBondContact O-N 2.89Å; E214-F221 HydrophobicContact CB-CD1 4.4Å; E214-F221 HydrophobicContact CB-CE1 4.1Å; E214-F221 HydrophobicContact CB-CZ 4.29Å |
| 215 | N | 85.8 | Confident | 87.9 | Confident | 30 Ų | 30 | 57.2 Ų | 57.2 | 16% | 0.16 | 27% | 0.27 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91 | 123 | 173.2 | -81.2 | -74.1 | 0 | 0 | 0 | 111.3 | E217 R218 G219 R220 E222 | N215-E217 PolarHBondContact O-N 3.44Å; N215-R218 PolarHBondContact O-N 3.25Å; N215-G219 WeakPolarHBondContact O-CA 3.32Å; N215-G219 PolarHBondContact O-N 3.46Å; N215-R220 PolarHBondContact N-O 2.9Å; N215-E222 WeakPolarHBondContact ND2-CB 3.1Å; N215-E222 WeakPolarHBondContact ND2-CG 3.37Å; N215-E222 PolarHBondContact ND2-OE1 3.23Å; N215-E222 PolarHBondContact ND2-OE2 2.87Å |
| 216 | P | 79.2 | Confident | 88 | Confident | 95 Ų | 95 | 53.3 Ų | 53.3 | 62% | 0.617 | 25% | 0.252 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.9 | -25.6 | -178.2 | 27.9 | -34 | 0 | 0 | 0 | 112.3 | L188 | L188-P216 HydrophobicContact CD2-CB 4.2Å; L188-P216 HydrophobicContact CD2-CG 4Å |
| 217 | E | 77.5 | Confident | 88.1 | Confident | 179 Ų | 179 | 55.2 Ų | 55.2 | 84% | 0.836 | 26% | 0.261 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.3 | -34.7 | -177.9 | -59.3 | -172 | 170.5 | 0 | 0 | 113.5 | N215 | N215-E217 PolarHBondContact O-N 3.44Š|
| 218 | R | 72.4 | Confident | 88.1 | Confident | 183 Ų | 183 | 54.7 Ų | 54.7 | 69% | 0.691 | 26% | 0.258 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -113.7 | -11.2 | -173.6 | -67.6 | -173.4 | 176.3 | -169.3 | -0.6 | 113.6 | N215 R220 | N215-R218 PolarHBondContact O-N 3.25Å; R218-R220 HydrophobicContact CB-CB 4.42Å; R218-R220 HydrophobicContact CB-CG 4.49Å; R218-R220 PolarHBondContact O-N 2.83Å |
| 219 | G | 73.4 | Confident | 88.1 | Confident | 41 Ų | 41 | 56.9 Ų | 56.9 | 42% | 0.423 | 27% | 0.269 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 59.2 | 26.1 | -173 | 0 | 0 | 0 | 0 | 0 | 113 | N215 | N215-G219 WeakPolarHBondContact O-CA 3.32Å; N215-G219 PolarHBondContact O-N 3.46Å |
| 220 | R | 78.5 | Confident | 88 | Confident | 163 Ų | 163 | 54.8 Ų | 54.8 | 62% | 0.615 | 26% | 0.26 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -117.7 | 148 | -178.4 | -69.3 | -174.1 | -176.6 | -174.2 | 1.7 | 110 | N215 R218 | N215-R220 PolarHBondContact N-O 2.9Å; R218-R220 HydrophobicContact CB-CB 4.42Å; R218-R220 HydrophobicContact CB-CG 4.49Å; R218-R220 PolarHBondContact O-N 2.83Å |
| 221 | F | 84.6 | Confident | 87.8 | Confident | 25 Ų | 25 | 58.1 Ų | 58.1 | 11% | 0.11 | 28% | 0.278 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.8 | 123 | 171.3 | -73.1 | -92.7 | 0 | 0 | 0 | 109.4 | S135 S136 I141 K189 M191 V212 K213 E214 | S135-F221 WeakPolarHBondContact O-CD2 3.23Å; S136-F221 VanDerWaalsContact CB-CE2 3.43Å; S136-F221 VanDerWaalsContact OG-CE2 3.27Å; S136-F221 WeakPolarHBondContact OG-CE2 3.21Å; I141-F221 HydrophobicContact CD1-CB 4.23Å; I141-F221 HydrophobicContact CD1-CG 4.33Å; K189-F221 HydrophobicContact CD-CZ 4.31Å; M191-F221 HydrophobicContact CB-CE1 4.35Å; V212-F221 HydrophobicContact CB-CB 4.13Å; V212-F221 HydrophobicContact CB-CD1 4.11Å; V212-F221 HydrophobicContact CG2-CB 4.2Å; V212-F221 HydrophobicContact CG2-CD1 3.51Å; V212-F221 HydrophobicContact CG2-CE1 4.32Å; V212-F221 HydrophobicContact CG2-CG 4.19Å; K213-F221 CarbonylContact O-C 3.57Å; K213-F221 WeakPolarHBondContact O-CA 3.37Å; E214-F221 HydrophobicContact CB-CD1 4.4Å; E214-F221 HydrophobicContact CB-CE1 4.1Å; E214-F221 HydrophobicContact CB-CZ 4.29Å |
| 222 | E | 88.4 | Confident | 87.5 | Confident | 91 Ų | 91 | 60.3 Ų | 60.3 | 43% | 0.425 | 29% | 0.291 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.8 | 144.7 | 169.1 | -70.9 | 174.5 | -173.6 | 0 | 0 | 109.9 | V212 K213 N215 R224 | V212-E222 CarbonylContact C-O 3.49Å; V212-E222 WeakPolarHBondContact CA-O 3.41Å; V212-E222 WeakPolarHBondContact CB-O 3.49Å; K213-E222 PolarHBondContact N-O 2.98Å; K213-E222 PolarHBondContact O-N 3.44Å; N215-E222 WeakPolarHBondContact ND2-CB 3.1Å; N215-E222 WeakPolarHBondContact ND2-CG 3.37Å; N215-E222 PolarHBondContact ND2-OE1 3.23Å; N215-E222 PolarHBondContact ND2-OE2 2.87Å; E222-R224 PolarHBondContact O-N 2.86Å |
| 223 | V | 90.5 | Very high | 86.9 | Confident | 28 Ų | 28 | 69.2 Ų | 69.2 | 17% | 0.17 | 33% | 0.33 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.1 | 120.3 | 178.1 | 176.6 | 0 | 0 | 0 | 0 | 108.5 | V212 I226 E241 N243 | V212-V223 HydrophobicContact CG1-CG2 4.16Å; V223-I226 HydrophobicContact CG1-CD1 3.66Å; V223-I226 HydrophobicContact CG1-CG1 3.48Å; V223-I226 VanDerWaalsContact CG1-CG1 3.48Å; V223-I226 HydrophobicContact CG2-CD1 4.45Å; V223-E241 HydrophobicContact CG1-CG 4.42Å; V223-N243 PolarHBondContact O-ND2 3.37Å |
| 224 | R | 92.1 | Very high | 86.6 | Confident | 59 Ų | 59 | 70 Ų | 70 | 22% | 0.223 | 34% | 0.343 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.6 | -48.4 | 174.4 | -170 | -176.5 | -178.9 | -152.4 | -6 | 110.7 | E211 E222 N243 | E211-R224 HydrophobicContact CG-CB 4.49Å; E211-R224 WeakPolarHBondContact O-CB 3.43Å; E211-R224 PolarHBondContact O-N 2.96Å; E211-R224 VanDerWaalsContact OE1-CD 3.25Å; E211-R224 WeakPolarHBondContact OE1-CD 3.26Å; E211-R224 IonicContact OE1-CZ 3.74Å; E211-R224 IonicContact OE1-NE 3.91Å; E211-R224 IonicContact OE1-NH1 2.77Å; E211-R224 PolarHBondContact OE1-NH1 3.47Å; E222-R224 PolarHBondContact O-N 2.86Å; R224-N243 CarbonylContact O-C 3.52Å; R224-N243 WeakPolarHBondContact O-CA 3.31Å; R224-N243 PolarHBondContact O-N 2.78Å |
| 225 | Y | 94.1 | Very high | 86.6 | Confident | 26 Ų | 26 | 77.2 Ų | 77.2 | 10% | 0.102 | 37% | 0.367 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -155 | 151.7 | 171.6 | 60.5 | -102.9 | 0 | 0 | 0 | 111.6 | E211 F227 E241 R244 | E211-Y225 HydrophobicContact CB-CD1 3.98Å; E211-Y225 HydrophobicContact CB-CD2 4.2Å; E211-Y225 HydrophobicContact CB-CE1 3.5Å; E211-Y225 HydrophobicContact CB-CE2 3.71Å; E211-Y225 HydrophobicContact CB-CG 4.33Å; E211-Y225 HydrophobicContact CG-CE1 4.09Å; E211-Y225 PolarHBondContact N-O 3.08Å; E211-Y225 PolarHBondContact O-N 2.85Å; E211-Y225 WeakPolarHBondContact OE2-CE1 3.32Å; E211-Y225 PolarHBondContact OE2-OH 3.35Å; Y225-F227 AromaticContact CD2-CD1 3.52Å; Y225-F227 HydrophobicContact CD2-CD1 3.52Å; Y225-F227 AromaticContact CD2-CE1 3.61Å; Y225-F227 HydrophobicContact CD2-CE1 3.61Å; Y225-F227 AromaticContact CE2-CD1 3.77Å; Y225-F227 HydrophobicContact CE2-CD1 3.77Å; Y225-F227 AromaticContact CE2-CE1 3.32Å; Y225-F227 HydrophobicContact CE2-CE1 3.32Å; Y225-F227 HydrophobicContact CE2-CZ 4.42Å; Y225-E241 CarbonylContact C-O 3.6Å; Y225-E241 WeakPolarHBondContact CA-O 3.28Å; Y225-E241 WeakPolarHBondContact CB-O 3.4Å; Y225-R244 HydrophobicContact CD1-CG 4.37Å |
| 226 | I | 95.1 | Very high | 86.9 | Confident | 0 Ų | 0 | 81.8 Ų | 81.8 | 0% | 0 | 38% | 0.382 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.9 | 122.2 | 168.9 | -58 | 173.1 | 0 | 0 | 0 | 107.1 | A145 K148 V208 V210 V223 I240 E241 | A145-I226 HydrophobicContact CB-CD1 4.13Å; K148-I226 HydrophobicContact CB-CD1 4.43Å; K148-I226 HydrophobicContact CD-CD1 3.63Å; V208-I226 HydrophobicContact CG1-CG2 4.05Å; V210-I226 HydrophobicContact CG1-CG1 4.1Å; V210-I226 HydrophobicContact CG2-CG1 4.2Å; V210-I226 HydrophobicContact CG2-CG2 4.2Å; V223-I226 HydrophobicContact CG1-CD1 3.66Å; V223-I226 HydrophobicContact CG1-CG1 3.48Å; V223-I226 VanDerWaalsContact CG1-CG1 3.48Å; V223-I226 HydrophobicContact CG2-CD1 4.45Å; I226-I240 HydrophobicContact CB-CB 4.24Å; I226-I240 HydrophobicContact CG2-CB 4.19Å; I226-I240 HydrophobicContact CG2-CD1 3.88Å; I226-I240 HydrophobicContact CG2-CG1 4.48Å; I226-I240 PolarHBondContact O-N 2.91Å; I226-E241 PolarHBondContact N-O 3.06Å; I226-E241 PolarHBondContact O-N 3.19Å |
| 227 | F | 95.1 | Very high | 87.6 | Confident | 40 Ų | 40 | 81.2 Ų | 81.2 | 18% | 0.175 | 38% | 0.377 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.8 | 153.8 | 169.6 | 64.8 | -95.9 | 0 | 0 | 0 | 111.2 | V208 H209 Y225 T237 I238 V239 | V208-F227 WeakPolarHBondContact CA-O 3.5Å; H209-F227 HydrophobicContact CB-CD1 4.17Å; H209-F227 HydrophobicContact CB-CD2 3.96Å; H209-F227 HydrophobicContact CB-CE1 3.71Å; H209-F227 HydrophobicContact CB-CE2 3.46Å; H209-F227 VanDerWaalsContact CB-CE2 3.46Å; H209-F227 HydrophobicContact CB-CG 4.3Å; H209-F227 HydrophobicContact CB-CZ 3.31Å; H209-F227 AromaticContact CD2-CE2 3.4Å; H209-F227 WeakPolarHBondContact CD2-CE2 3.22Å; H209-F227 AromaticContact CD2-CZ 3.93Å; H209-F227 AromaticContact CG-CE2 3.61Å; H209-F227 AromaticContact CG-CZ 3.69Å; H209-F227 PolarHBondContact N-O 3.19Å; H209-F227 PolarHBondContact O-N 3.33Å; Y225-F227 AromaticContact CD2-CD1 3.52Å; Y225-F227 HydrophobicContact CD2-CD1 3.52Å; Y225-F227 AromaticContact CD2-CE1 3.61Å; Y225-F227 HydrophobicContact CD2-CE1 3.61Å; Y225-F227 AromaticContact CE2-CD1 3.77Å; Y225-F227 HydrophobicContact CE2-CD1 3.77Å; Y225-F227 AromaticContact CE2-CE1 3.32Å; Y225-F227 HydrophobicContact CE2-CE1 3.32Å; Y225-F227 HydrophobicContact CE2-CZ 4.42Å; F227-T237 HydrophobicContact CB-CG2 3.96Å; F227-T237 HydrophobicContact CD2-CG2 3.67Å; F227-T237 HydrophobicContact CG-CG2 4.12Å; F227-I238 CarbonylContact C-O 3.51Å; F227-I238 VanDerWaalsContact CA-O 3.23Å; F227-I238 WeakPolarHBondContact CA-O 3.33Å; F227-I238 WeakPolarHBondContact CB-O 3.13Å; F227-V239 HydrophobicContact CB-CG2 4.28Å |
| 228 | V | 95.3 | Very high | 88.4 | Confident | 0 Ų | 0 | 73 Ų | 73 | 0% | 0 | 34% | 0.339 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.6 | 117.9 | -178.9 | -177 | 0 | 0 | 0 | 0 | 108.1 | I155 F159 I197 T207 V208 T237 I238 I240 | I155-V228 HydrophobicContact CD1-CB 3.73Å; I155-V228 HydrophobicContact CD1-CG1 4.1Å; I155-V228 HydrophobicContact CD1-CG2 3.62Å; F159-V228 HydrophobicContact CE2-CG1 4.01Å; F159-V228 HydrophobicContact CZ-CG1 4.15Å; I197-V228 HydrophobicContact CD1-CG1 3.64Å; I197-V228 HydrophobicContact CG1-CG1 4.31Å; T207-V228 CarbonylContact O-C 3.52Å; T207-V228 WeakPolarHBondContact O-CA 3.49Å; V208-V228 HydrophobicContact CB-CG2 4.48Å; V208-V228 HydrophobicContact CG1-CG2 4.15Å; V208-V228 HydrophobicContact CG2-CG1 4.2Å; V208-V228 HydrophobicContact CG2-CG2 3.89Å; V228-T237 CarbonylContact O-C 3.53Å; V228-T237 WeakPolarHBondContact O-CA 3.16Å; V228-I238 PolarHBondContact N-O 2.78Å; V228-I238 PolarHBondContact O-N 2.96Å; V228-I240 HydrophobicContact CG2-CD1 3.64Å; V228-I240 HydrophobicContact CG2-CG1 4.41Å |
| 229 | D | 95.1 | Very high | 89.4 | Confident | 46 Ų | 46 | 67.8 Ų | 67.8 | 25% | 0.246 | 33% | 0.327 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.6 | 119.5 | 168.1 | -75 | -35.5 | 0 | 0 | 0 | 109.1 | G206 T207 H209 D231 T237 | G206-D229 CarbonylContact C-O 3.52Å; G206-D229 WeakPolarHBondContact CA-O 3.13Å; T207-D229 PolarHBondContact N-O 3.49Å; T207-D229 PolarHBondContact O-N 2.82Å; H209-D229 IonicContact CD2-OD2 3.03Å; H209-D229 IonicContact NE2-OD2 3.6Å; D229-D231 PolarHBondContact O-N 2.79Å; D229-T237 VanDerWaalsContact OD1-CB 3.26Å; D229-T237 WeakPolarHBondContact OD1-CB 3.1Å; D229-T237 WeakPolarHBondContact OD1-CG2 3.35Å; D229-T237 PolarHBondContact OD1-OG1 3.01Å |
| 230 | V | 93.8 | Very high | 90.3 | Very high | 9 Ų | 9 | 67.3 Ų | 67.3 | 6% | 0.055 | 32% | 0.315 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.9 | 116.2 | 173.7 | -175.3 | 0 | 0 | 0 | 0 | 108 | V158 F159 T232 R236 I238 | V158-V230 HydrophobicContact CG1-CG1 3.99Å; V158-V230 HydrophobicContact CG1-CG2 4Å; F159-V230 HydrophobicContact CE2-CG2 4.06Å; F159-V230 HydrophobicContact CZ-CB 4.48Å; F159-V230 HydrophobicContact CZ-CG1 4.31Å; F159-V230 HydrophobicContact CZ-CG2 3.93Å; V230-T232 VanDerWaalsContact C-N 3.33Å; V230-R236 HydrophobicContact CB-CG 4.14Å; V230-R236 WeakPolarHBondContact CB-O 3.16Å; V230-R236 HydrophobicContact CG2-CG 3.87Å; V230-R236 WeakPolarHBondContact CG2-O 3.15Å; V230-R236 PolarHBondContact N-O 3.34Å; V230-I238 HydrophobicContact CG2-CD1 4.19Å |
| 231 | D | 90.1 | Very high | 90.9 | Very high | 72 Ų | 72 | 61.9 Ų | 61.9 | 39% | 0.385 | 30% | 0.296 | S | S | . | . | trans | -75.6 | -28.9 | -178 | -66.4 | -41.6 | 0 | 0 | 0 | 111.4 | Q205 T207 D229 | Q205-D231 WeakPolarHBondContact O-CB 3.3Å; Q205-D231 PolarHBondContact O-N 3.43Å; T207-D231 PolarHBondContact OG1-OD2 3.44Å; D229-D231 PolarHBondContact O-N 2.79Å | ||
| 232 | T | 86.3 | Confident | 91.2 | Very high | 46 Ų | 46 | 64.9 Ų | 64.9 | 28% | 0.282 | 31% | 0.313 | S | S | . | . | S | Bend | trans | -73 | 144 | 179.1 | -44.2 | 0 | 0 | 0 | 0 | 111.6 | G203 K204 Q205 V230 P234 R235 | G203-T232 PolarHBondContact O-OG1 3.46Å; K204-T232 WeakPolarHBondContact CA-OG1 3.19Å; Q205-T232 PolarHBondContact N-OG1 2.8Å; V230-T232 VanDerWaalsContact C-N 3.33Å; T232-P234 CarbonylContact O-C 3.55Å; T232-P234 VanDerWaalsContact O-O 3.13Å; T232-R235 PolarHBondContact O-N 3.48Å |
| 233 | F | 80 | Confident | 91.2 | Very high | 190 Ų | 190 | 65.1 Ų | 65.1 | 83% | 0.833 | 32% | 0.318 | S | S | * | . | S | Bend | trans | -71.2 | 135.3 | 178.7 | -169.7 | -92.5 | 0 | 0 | 0 | 111.5 | ||
| 234 | P | 83.5 | Confident | 90.2 | Very high | 88 Ų | 88 | 73.1 Ų | 73.1 | 57% | 0.571 | 35% | 0.345 | S | S | * | . | S | Bend | cis | -76.6 | 134 | -2.3 | 31 | -33.9 | 0 | 0 | 0 | 112.4 | T232 R236 | T232-P234 CarbonylContact O-C 3.55Å; T232-P234 VanDerWaalsContact O-O 3.13Å; P234-R236 PolarHBondContact O-N 2.8Å |
| 235 | R | 88.1 | Confident | 90.2 | Very high | 211 Ų | 211 | 73.8 Ų | 73.8 | 80% | 0.796 | 35% | 0.351 | S | S | * | . | P | Polyproline II helix | trans | -65.1 | 123.1 | 177.1 | -68.5 | -176.5 | 179.5 | 169.9 | 0.7 | 109.5 | T232 | T232-R235 PolarHBondContact O-N 3.48Š|
| 236 | R | 91.8 | Very high | 90 | Very high | 126 Ų | 126 | 76.3 Ų | 76.3 | 48% | 0.475 | 36% | 0.364 | S | S | . | . | trans | -142.9 | 148.6 | 175.9 | 60.1 | 174.6 | 171.7 | -178.9 | -7.2 | 110.1 | V230 P234 | V230-R236 HydrophobicContact CB-CG 4.14Å; V230-R236 WeakPolarHBondContact CB-O 3.16Å; V230-R236 HydrophobicContact CG2-CG 3.87Å; V230-R236 WeakPolarHBondContact CG2-O 3.15Å; V230-R236 PolarHBondContact N-O 3.34Å; P234-R236 PolarHBondContact O-N 2.8Å | ||
| 237 | T | 93.9 | Very high | 89.7 | Confident | 83 Ų | 83 | 80.6 Ų | 80.6 | 51% | 0.509 | 38% | 0.384 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.5 | 127.3 | 172.7 | -50.2 | 0 | 0 | 0 | 0 | 108.4 | F227 V228 D229 | F227-T237 HydrophobicContact CB-CG2 3.96Å; F227-T237 HydrophobicContact CD2-CG2 3.67Å; F227-T237 HydrophobicContact CG-CG2 4.12Å; V228-T237 CarbonylContact O-C 3.53Å; V228-T237 WeakPolarHBondContact O-CA 3.16Å; D229-T237 VanDerWaalsContact OD1-CB 3.26Å; D229-T237 WeakPolarHBondContact OD1-CB 3.1Å; D229-T237 WeakPolarHBondContact OD1-CG2 3.35Å; D229-T237 PolarHBondContact OD1-OG1 3.01Å |
| 238 | I | 93.6 | Very high | 89.3 | Confident | 5 Ų | 5 | 82.9 Ų | 82.9 | 3% | 0.026 | 40% | 0.397 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.8 | 121.8 | 176.2 | -65 | 167.4 | 0 | 0 | 0 | 107.4 | E154 I155 V158 F227 V228 V230 | E154-I238 HydrophobicContact CB-CD1 4.45Å; E154-I238 HydrophobicContact CB-CG2 4Å; E154-I238 WeakPolarHBondContact OE2-CG2 3.3Å; I155-I238 HydrophobicContact CD1-CB 3.83Å; I155-I238 HydrophobicContact CD1-CD1 3.92Å; I155-I238 HydrophobicContact CD1-CG1 4.49Å; I155-I238 HydrophobicContact CD1-CG2 3.6Å; I155-I238 HydrophobicContact CG1-CG2 4.22Å; V158-I238 HydrophobicContact CG2-CD1 3.32Å; F227-I238 CarbonylContact C-O 3.51Å; F227-I238 VanDerWaalsContact CA-O 3.23Å; F227-I238 WeakPolarHBondContact CA-O 3.33Å; F227-I238 WeakPolarHBondContact CB-O 3.13Å; V228-I238 PolarHBondContact N-O 2.78Å; V228-I238 PolarHBondContact O-N 2.96Å; V230-I238 HydrophobicContact CG2-CD1 4.19Å |
| 239 | V | 94.6 | Very high | 89 | Confident | 75 Ų | 75 | 88.1 Ų | 88.1 | 46% | 0.455 | 42% | 0.421 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.5 | 118.1 | 178.3 | -176.7 | 0 | 0 | 0 | 0 | 107.6 | F227 D242 | F227-V239 HydrophobicContact CB-CG2 4.28Å; V239-D242 HydrophobicContact CG1-CB 3.81Å |
| 240 | I | 92.9 | Very high | 88.6 | Confident | 30 Ų | 30 | 90.9 Ų | 90.9 | 15% | 0.154 | 43% | 0.433 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.7 | -42.7 | -179.6 | -63.8 | 172.1 | 0 | 0 | 0 | 109.6 | K148 C149 H152 I155 I226 V228 | K148-I240 HydrophobicContact CB-CG2 4.25Å; C149-I240 HydrophobicContact CB-CD1 4.11Å; C149-I240 WeakPolarHBondContact SG-CD1 3.35Å; H152-I240 HydrophobicContact CB-CG1 4.32Å; H152-I240 HydrophobicContact CB-CG2 4.38Å; I155-I240 HydrophobicContact CD1-CD1 4.24Å; I155-I240 HydrophobicContact CD1-CG1 4.41Å; I155-I240 HydrophobicContact CG1-CD1 3.95Å; I155-I240 HydrophobicContact CG1-CG1 4.16Å; I226-I240 HydrophobicContact CB-CB 4.24Å; I226-I240 HydrophobicContact CG2-CB 4.19Å; I226-I240 HydrophobicContact CG2-CD1 3.88Å; I226-I240 HydrophobicContact CG2-CG1 4.48Å; I226-I240 PolarHBondContact O-N 2.91Å; V228-I240 HydrophobicContact CG2-CD1 3.64Å; V228-I240 HydrophobicContact CG2-CG1 4.41Å |
| 241 | E | 91.1 | Very high | 88.2 | Confident | 50 Ų | 50 | 96.8 Ų | 96.8 | 23% | 0.234 | 46% | 0.46 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.7 | 132.3 | -177.8 | -169.3 | 171.5 | 175.4 | 0 | 0 | 108.6 | K148 V223 Y225 I226 N243 | K148-E241 IonicContact NZ-OE1 2.7Å; K148-E241 IonicContact NZ-OE2 2.79Å; K148-E241 PolarHBondContact NZ-OE2 2.68Å; V223-E241 HydrophobicContact CG1-CG 4.42Å; Y225-E241 CarbonylContact C-O 3.6Å; Y225-E241 WeakPolarHBondContact CA-O 3.28Å; Y225-E241 WeakPolarHBondContact CB-O 3.4Å; I226-E241 PolarHBondContact N-O 3.06Å; I226-E241 PolarHBondContact O-N 3.19Å; E241-N243 PolarHBondContact OE1-ND2 3.46Å |
| 242 | D | 90.8 | Very high | 88 | Confident | 87 Ų | 87 | 98.7 Ų | 98.7 | 47% | 0.465 | 47% | 0.466 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.2 | 102 | 177.3 | -163.2 | -0.5 | 0 | 0 | 0 | 109.3 | V239 R244 | V239-D242 HydrophobicContact CG1-CB 3.81Å; D242-R244 VanDerWaalsContact OD1-CB 3.27Å; D242-R244 WeakPolarHBondContact OD1-CB 3.19Å; D242-R244 WeakPolarHBondContact OD1-CD 3.34Å; D242-R244 WeakPolarHBondContact OD1-CG 3.32Å; D242-R244 PolarHBondContact OD1-N 2.75Å; D242-R244 IonicContact OD1-NE 3.77Å |
| 243 | N | 86.6 | Confident | 88.2 | Confident | 97 Ų | 97 | 103.1 Ų | 103.1 | 52% | 0.519 | 48% | 0.481 | S | S | . | . | trans | -111.3 | 38.6 | 177.9 | -59.6 | -41.7 | 0 | 0 | 0 | 109.7 | V223 R224 E241 | V223-N243 PolarHBondContact O-ND2 3.37Å; R224-N243 CarbonylContact O-C 3.52Å; R224-N243 WeakPolarHBondContact O-CA 3.31Å; R224-N243 PolarHBondContact O-N 2.78Å; E241-N243 PolarHBondContact OE1-ND2 3.46Å | ||
| 244 | R | 71.5 | Confident | 88.9 | Confident | 195 Ų | 195 | 95.2 Ų | 95.2 | 74% | 0.736 | 45% | 0.449 | S | S | * | . | trans | -69.8 | 0 | -177 | -87.5 | 175.4 | -176.7 | -172.5 | 3.7 | 115 | Y225 D242 | Y225-R244 HydrophobicContact CD1-CG 4.37Å; D242-R244 VanDerWaalsContact OD1-CB 3.27Å; D242-R244 WeakPolarHBondContact OD1-CB 3.19Å; D242-R244 WeakPolarHBondContact OD1-CD 3.34Å; D242-R244 WeakPolarHBondContact OD1-CG 3.32Å; D242-R244 PolarHBondContact OD1-N 2.75Å; D242-R244 IonicContact OD1-NE 3.77Å |
Retrieved 244 of 244 residues in 254.1 ms
(Link to these results)