| 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 | 40 | Very low | 40.6 | Very low | 251 Ų | 251 | 135.4 Ų | 135.4 | 100% | 1.236 | 85% | 0.849 | S | S | * | * | 0 | 138.8 | 0 | -70.5 | 177.1 | 176.3 | 0 | 0 | 107.8 | |||||
| 2 | S | 36.9 | Very low | 40.8 | Very low | 123 Ų | 123 | 139.5 Ų | 139.5 | 86% | 0.86 | 85% | 0.849 | S | S | * | * | trans | -84.4 | 157 | -151.5 | -38.3 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 3 | A | 36.9 | Very low | 41.2 | Very low | 90 Ų | 90 | 136.8 Ų | 136.8 | 74% | 0.744 | 84% | 0.836 | S | S | * | * | trans | -80.7 | 174.3 | 145.5 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 4 | P | 51 | Low | 41.2 | Very low | 132 Ų | 132 | 136.1 Ų | 136.1 | 86% | 0.857 | 84% | 0.835 | S | S | * | * | cis | -133.3 | -176.5 | -5.6 | 37.5 | -18.2 | 0 | 0 | 0 | 113.3 | ||||
| 5 | G | 34.3 | Very low | 41.1 | Very low | 75 Ų | 75 | 141.4 Ų | 141.4 | 77% | 0.773 | 84% | 0.836 | S | S | * | * | trans | 170.7 | 102.1 | 161.8 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 6 | Y | 41.8 | Very low | 41.2 | Very low | 231 Ų | 231 | 139.8 Ų | 139.8 | 91% | 0.906 | 83% | 0.831 | S | S | * | * | trans | -71.7 | 147.9 | 152 | -96 | -89.2 | 0 | 0 | 0 | 108.8 | ||||
| 7 | P | 45.1 | Very low | 41.1 | Very low | 126 Ų | 126 | 142.2 Ų | 142.2 | 82% | 0.818 | 83% | 0.831 | S | S | * | * | -152.1 | 164.3 | 94.4 | 36.4 | -17.5 | 0 | 0 | 0 | 115.7 | |||||
| 8 | G | 34 | Very low | 41.1 | Very low | 70 Ų | 70 | 140.9 Ų | 140.9 | 72% | 0.722 | 83% | 0.828 | S | S | * | * | trans | 122.8 | 93.6 | 145.2 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 9 | S | 44.4 | Very low | 40.8 | Very low | 122 Ų | 122 | 137.1 Ų | 137.1 | 85% | 0.853 | 82% | 0.821 | S | S | * | * | trans | -69.4 | 151.7 | 157.4 | -55.8 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 10 | P | 45 | Very low | 40.6 | Very low | 111 Ų | 111 | 140.3 Ų | 140.3 | 72% | 0.721 | 83% | 0.828 | S | S | * | * | trans | -138 | 136.8 | 134.5 | 17.6 | 3.9 | 0 | 0 | 0 | 115.2 | ||||
| 11 | N | 37.8 | Very low | 40.4 | Very low | 158 Ų | 158 | 138.8 Ų | 138.8 | 85% | 0.845 | 82% | 0.824 | S | S | * | * | trans | 66.9 | 93.9 | 143.8 | -66.2 | -10.2 | 0 | 0 | 0 | 120.3 | ||||
| 12 | H | 43 | Very low | 40.4 | Very low | 185 Ų | 185 | 131.6 Ų | 131.6 | 86% | 0.856 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -83.7 | 138.6 | 147.6 | -76.9 | -84.7 | 0 | 0 | 0 | 110.6 | ||
| 13 | P | 45.8 | Very low | 40.5 | Very low | 105 Ų | 105 | 130.8 Ų | 130.8 | 68% | 0.682 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 153.8 | 168.6 | 29.6 | -31.2 | 0 | 0 | 0 | 111.6 | ||
| 14 | P | 40.9 | Very low | 40.6 | Very low | 126 Ų | 126 | 132.5 Ų | 132.5 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 130.7 | -170.8 | 27.6 | -31.6 | 0 | 0 | 0 | 112.6 | ||
| 15 | Y | 40.2 | Very low | 39.9 | Very low | 216 Ų | 216 | 136.9 Ų | 136.9 | 85% | 0.847 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -71.2 | 137 | 165.8 | -83.4 | -91.2 | 0 | 0 | 0 | 110.6 | ||
| 16 | P | 41.6 | Very low | 40.2 | Very low | 116 Ų | 116 | 139.1 Ų | 139.1 | 75% | 0.753 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -73.1 | 127.6 | 171.8 | 27.2 | -29.7 | 0 | 0 | 0 | 111.1 | ||
| 17 | Q | 40.6 | Very low | 40.2 | Very low | 180 Ų | 180 | 134.6 Ų | 134.6 | 84% | 0.841 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 130.3 | 167.9 | -78.2 | -87 | -62.5 | 0 | 0 | 110.8 | G19 | Q17-G19 PolarHBondContact O-N 3.31Š|
| 18 | P | 40.8 | Very low | 39.7 | Very low | 119 Ų | 119 | 134.7 Ų | 134.7 | 77% | 0.773 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -78.7 | 117.3 | 163.5 | -8.5 | 25.6 | 0 | 0 | 0 | 109.4 | ||
| 19 | G | 34.8 | Very low | 39.7 | Very low | 68 Ų | 68 | 136.1 Ų | 136.1 | 70% | 0.701 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 143.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113 | Q17 S21 | Q17-G19 PolarHBondContact O-N 3.31Å; G19-S21 PolarHBondContact O-N 3.31Å |
| 20 | Q | 37.8 | Very low | 39 | Very low | 202 Ų | 202 | 134.4 Ų | 134.4 | 94% | 0.944 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 117.1 | 164.5 | -68.2 | 174.2 | 3.1 | 0 | 0 | 109.1 | ||
| 21 | S | 35.7 | Very low | 38.3 | Very low | 109 Ų | 109 | 132.2 Ų | 132.2 | 76% | 0.762 | 80% | 0.803 | S | S | * | * | trans | -148.3 | 92.7 | 161.4 | 46.2 | 0 | 0 | 0 | 0 | 109.1 | G19 | G19-S21 PolarHBondContact O-N 3.31Š| ||
| 22 | A | 39.6 | Very low | 38.4 | Very low | 99 Ų | 99 | 136 Ų | 136 | 82% | 0.818 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 129.1 | 169.8 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||
| 23 | P | 39.8 | Very low | 38.2 | Very low | 107 Ų | 107 | 132.9 Ų | 132.9 | 70% | 0.695 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -80.7 | 143.1 | 167.3 | 30.1 | -29.4 | 0 | 0 | 0 | 110.7 | ||
| 24 | P | 38 | Very low | 37.6 | Very low | 125 Ų | 125 | 131.8 Ų | 131.8 | 81% | 0.812 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -78.1 | 132 | -176.5 | 29.7 | -31.4 | 0 | 0 | 0 | 111.8 | ||
| 25 | Y | 36.4 | Very low | 37.2 | Very low | 224 Ų | 224 | 132.3 Ų | 132.3 | 88% | 0.878 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -70.4 | 137.7 | 169.5 | -69 | -90.7 | 0 | 0 | 0 | 111 | ||
| 26 | P | 40.5 | Very low | 37.4 | Very low | 123 Ų | 123 | 127.9 Ų | 127.9 | 80% | 0.799 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -83.8 | 127.2 | 164.4 | 29.9 | -27.2 | 0 | 0 | 0 | 110.9 | ||
| 27 | V | 41.5 | Very low | 37.3 | Very low | 136 Ų | 136 | 126.7 Ų | 126.7 | 82% | 0.824 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -77.4 | 132.7 | 173.4 | -140.4 | 0 | 0 | 0 | 0 | 109.2 | A29 | V27-A29 PolarHBondContact O-N 3.07Š|
| 28 | P | 36.4 | Very low | 37.2 | Very low | 128 Ų | 128 | 127.4 Ų | 127.4 | 83% | 0.831 | 80% | 0.802 | S | S | * | * | trans | -83.4 | 103.9 | 166.2 | -7.5 | 24.9 | 0 | 0 | 0 | 109.8 | G30 | P28-G30 PolarHBondContact O-N 3.04Š| ||
| 29 | A | 33.4 | Very low | 37.2 | Very low | 100 Ų | 100 | 126.3 Ų | 126.3 | 83% | 0.826 | 80% | 0.803 | S | S | * | * | trans | -81.6 | 98.8 | 164.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | V27 G31 | V27-A29 PolarHBondContact O-N 3.07Å; A29-G31 PolarHBondContact O-N 3.3Å | ||
| 30 | G | 30.2 | Very low | 37.7 | Very low | 86 Ų | 86 | 128.7 Ų | 128.7 | 89% | 0.887 | 81% | 0.806 | S | S | * | * | trans | -86.4 | 81 | 170.7 | 0 | 0 | 0 | 0 | 0 | 111 | P28 | P28-G30 PolarHBondContact O-N 3.04Š| ||
| 31 | G | 30.2 | Very low | 38 | Very low | 64 Ų | 64 | 125 Ų | 125 | 66% | 0.66 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -103.7 | 122.2 | 165.5 | 0 | 0 | 0 | 0 | 0 | 109.3 | A29 P33 | A29-G31 PolarHBondContact O-N 3.3Å; G31-P33 WeakPolarHBondContact O-CD 3.46Å |
| 32 | Y | 40 | Very low | 38 | Very low | 238 Ų | 238 | 126.2 Ų | 126.2 | 93% | 0.933 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -77.5 | 127 | 168.6 | -91 | -94.4 | 0 | 0 | 0 | 110 | ||
| 33 | P | 37.4 | Very low | 37.7 | Very low | 119 Ų | 119 | 124.6 Ų | 124.6 | 77% | 0.773 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -103.7 | 124 | 153.2 | 9.9 | 11.2 | 0 | 0 | 0 | 108.8 | G31 | G31-P33 WeakPolarHBondContact O-CD 3.46Š|
| 34 | G | 34.6 | Very low | 37.2 | Very low | 82 Ų | 82 | 130 Ų | 130 | 85% | 0.845 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 144.2 | 168 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||
| 35 | D | 32.6 | Very low | 37 | Very low | 137 Ų | 137 | 131.5 Ų | 131.5 | 73% | 0.733 | 81% | 0.812 | S | S | * | * | trans | -124 | 129.2 | 161.1 | -167.3 | -55.9 | 0 | 0 | 0 | 108.7 | S37 | D35-S37 PolarHBondContact O-N 3.37Š| ||
| 36 | P | 42.6 | Very low | 36.8 | Very low | 124 Ų | 124 | 129.5 Ų | 129.5 | 81% | 0.805 | 81% | 0.813 | S | S | * | * | trans | -88.3 | 97 | -177.1 | 34.5 | -32.4 | 0 | 0 | 0 | 111.8 | ||||
| 37 | S | 40.5 | Very low | 36.4 | Very low | 91 Ų | 91 | 127.2 Ų | 127.2 | 64% | 0.636 | 81% | 0.812 | S | S | * | * | trans | -159 | 101.1 | 159.5 | 50.8 | 0 | 0 | 0 | 0 | 112 | D35 | D35-S37 PolarHBondContact O-N 3.37Š| ||
| 38 | Q | 37.9 | Very low | 35.9 | Very low | 195 Ų | 195 | 129.1 Ų | 129.1 | 91% | 0.911 | 81% | 0.812 | S | S | * | * | trans | 175.9 | 128.2 | 132.1 | -94 | 163.4 | 44.8 | 0 | 0 | 111.2 | ||||
| 39 | A | 41.1 | Very low | 35.8 | Very low | 96 Ų | 96 | 132.4 Ų | 132.4 | 79% | 0.793 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -78.7 | 148.8 | -177.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||
| 40 | P | 45 | Very low | 35.7 | Very low | 118 Ų | 118 | 135.8 Ų | 135.8 | 77% | 0.766 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -85.5 | 153.5 | 160.5 | 32.1 | -28.9 | 0 | 0 | 0 | 111.8 | ||
| 41 | P | 45.3 | Very low | 35.9 | Very low | 125 Ų | 125 | 139 Ų | 139 | 81% | 0.812 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 157.3 | -169.1 | 30.2 | -34.6 | 0 | 0 | 0 | 114.2 | ||
| 42 | P | 35.3 | Very low | 36.1 | Very low | 133 Ų | 133 | 145.1 Ų | 145.1 | 86% | 0.864 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -87.7 | 137.1 | -176.8 | 32.9 | -30.9 | 0 | 0 | 0 | 112.8 | ||
| 43 | G | 33.4 | Very low | 36 | Very low | 66 Ų | 66 | 139 Ų | 139 | 68% | 0.68 | 81% | 0.812 | S | S | * | * | trans | 159.8 | 90.8 | 164 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 44 | F | 30 | Very low | 35.8 | Very low | 220 Ų | 220 | 139.5 Ų | 139.5 | 97% | 0.965 | 82% | 0.816 | S | S | * | * | 162.2 | 132 | 116.4 | -101.6 | -90.6 | 0 | 0 | 0 | 110.6 | |||||
| 45 | N | 32.2 | Very low | 36.1 | Very low | 157 Ų | 157 | 142.1 Ų | 142.1 | 84% | 0.84 | 82% | 0.815 | S | S | * | * | trans | -85.3 | 147.6 | -167.6 | -152.5 | 0.7 | 0 | 0 | 0 | 111.4 | ||||
| 46 | M | 33.4 | Very low | 36.2 | Very low | 181 Ų | 181 | 144.3 Ų | 144.3 | 89% | 0.892 | 82% | 0.823 | S | S | * | * | trans | -62 | 141.6 | 168.7 | -97.2 | -170.3 | -173.2 | 0 | 0 | 111.2 | ||||
| 47 | G | 31.3 | Very low | 35.9 | Very low | 76 Ų | 76 | 149.5 Ų | 149.5 | 78% | 0.784 | 83% | 0.828 | S | S | * | * | trans | -145.8 | 113.5 | 165.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 48 | H | 32 | Very low | 35.7 | Very low | 176 Ų | 176 | 153.6 Ų | 153.6 | 82% | 0.815 | 84% | 0.837 | S | S | * | * | trans | -58.2 | 143.7 | 176.3 | -75.8 | -57.9 | 0 | 0 | 0 | 113.7 | ||||
| 49 | H | 33.3 | Very low | 35.8 | Very low | 196 Ų | 196 | 150.2 Ų | 150.2 | 91% | 0.907 | 83% | 0.832 | S | S | * | * | trans | -142.9 | 127.3 | 141.8 | -89.3 | -80.5 | 0 | 0 | 0 | 110.8 | ||||
| 50 | Q | 31.9 | Very low | 35.9 | Very low | 171 Ų | 171 | 148.7 Ų | 148.7 | 80% | 0.799 | 83% | 0.826 | S | S | * | * | trans | -65 | 150.1 | 171.9 | -74.3 | 162.5 | -61.9 | 0 | 0 | 111.3 | ||||
| 51 | D | 34.4 | Very low | 35.6 | Very low | 153 Ų | 153 | 149.2 Ų | 149.2 | 82% | 0.818 | 83% | 0.829 | S | S | * | * | 158 | 102.4 | 127 | -80.8 | -33.3 | 0 | 0 | 0 | 111.1 | |||||
| 52 | Q | 34 | Very low | 35.8 | Very low | 193 Ų | 193 | 147.9 Ų | 147.9 | 90% | 0.902 | 83% | 0.828 | S | S | * | * | trans | -156.2 | 142.3 | 145.2 | -76.2 | -153.2 | -11.9 | 0 | 0 | 111.8 | ||||
| 53 | P | 38 | Very low | 36.1 | Very low | 110 Ų | 110 | 147.6 Ų | 147.6 | 71% | 0.714 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -79.9 | 167.4 | -169.8 | 32.6 | -36.1 | 0 | 0 | 0 | 114.7 | ||
| 54 | P | 34.2 | Very low | 36.6 | Very low | 130 Ų | 130 | 147.5 Ų | 147.5 | 84% | 0.844 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -77.7 | 127.1 | -167.1 | 30.8 | -33.6 | 0 | 0 | 0 | 112.5 | ||
| 55 | V | 39.3 | Very low | 37.2 | Very low | 137 Ų | 137 | 143.7 Ų | 143.7 | 83% | 0.83 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -90.6 | 121.3 | 169.5 | -176.4 | 0 | 0 | 0 | 0 | 108.8 | ||
| 56 | M | 35.3 | Very low | 37.7 | Very low | 183 Ų | 183 | 139.3 Ų | 139.3 | 90% | 0.901 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -62 | 132.6 | 176.4 | -66.4 | -165.6 | -173.9 | 0 | 0 | 111.3 | ||
| 57 | Y | 36 | Very low | 38.2 | Very low | 232 Ų | 232 | 136.7 Ų | 136.7 | 91% | 0.91 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -73.6 | 123 | 168.4 | -105.1 | -98.4 | 0 | 0 | 0 | 110 | ||
| 58 | Q | 37.3 | Very low | 39 | Very low | 178 Ų | 178 | 140.3 Ų | 140.3 | 83% | 0.832 | 81% | 0.813 | S | S | * | * | trans | -105.6 | 125.4 | 164.4 | -168.1 | 171.1 | -11 | 0 | 0 | 108.5 | G60 | Q58-G60 PolarHBondContact O-N 3.31Š| ||
| 59 | P | 39.6 | Very low | 39.5 | Very low | 123 Ų | 123 | 142.5 Ų | 142.5 | 80% | 0.799 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 119.8 | 177.5 | -14.1 | 27.7 | 0 | 0 | 0 | 110.7 | ||
| 60 | G | 42.6 | Very low | 39.9 | Very low | 65 Ų | 65 | 136.4 Ų | 136.4 | 67% | 0.67 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -77.9 | 153.3 | 169.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q58 | Q58-G60 PolarHBondContact O-N 3.31Š|
| 61 | P | 39.7 | Very low | 40.3 | Very low | 129 Ų | 129 | 132.1 Ų | 132.1 | 84% | 0.838 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -71.2 | 136.6 | -174 | 27.3 | -31.6 | 0 | 0 | 0 | 112.3 | ||
| 62 | A | 48.3 | Very low | 40.7 | Very low | 96 Ų | 96 | 133.2 Ų | 133.2 | 79% | 0.793 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 134.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112 | ||
| 63 | P | 42.2 | Very low | 41.3 | Very low | 127 Ų | 127 | 129.8 Ų | 129.8 | 83% | 0.825 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 128.9 | 168.6 | -8.4 | 24.9 | 0 | 0 | 0 | 110.4 | ||
| 64 | G | 44.3 | Very low | 41.7 | Very low | 64 Ų | 64 | 133.5 Ų | 133.5 | 66% | 0.66 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 169.5 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | G66 | G64-G66 PolarHBondContact O-N 3.13Š|
| 65 | P | 42.2 | Very low | 42.3 | Very low | 141 Ų | 141 | 130.2 Ų | 130.2 | 92% | 0.916 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 118 | -171 | 27.5 | -31.3 | 0 | 0 | 0 | 111.7 | ||
| 66 | G | 42.6 | Very low | 42.6 | Very low | 64 Ų | 64 | 132.7 Ų | 132.7 | 66% | 0.66 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -83.9 | 157.3 | 167.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | G64 | G64-G66 PolarHBondContact O-N 3.13Š|
| 67 | P | 44.8 | Very low | 43.2 | Very low | 127 Ų | 127 | 129 Ų | 129 | 83% | 0.825 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -75.4 | 143 | -174 | 3.9 | 11.1 | 0 | 0 | 0 | 112.5 | Y69 | P67-Y69 PolarHBondContact O-N 3.39Š|
| 68 | D | 47.2 | Very low | 44 | Very low | 152 Ų | 152 | 123.7 Ų | 123.7 | 81% | 0.813 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 120.1 | 173.4 | -166.4 | 13.1 | 0 | 0 | 0 | 111.7 | ||
| 69 | Y | 42.6 | Very low | 45.1 | Very low | 222 Ų | 222 | 119.5 Ų | 119.5 | 87% | 0.871 | 79% | 0.788 | S | S | * | * | trans | -139.3 | 107.8 | 164.7 | -109.2 | -87 | 0 | 0 | 0 | 109 | P67 G71 | P67-Y69 PolarHBondContact O-N 3.39Å; Y69-G71 PolarHBondContact O-N 2.79Å | ||
| 70 | G | 42.3 | Very low | 45.9 | Very low | 68 Ų | 68 | 119.6 Ų | 119.6 | 70% | 0.701 | 79% | 0.789 | S | S | * | * | trans | -54.2 | 122 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q72 | G70-Q72 PolarHBondContact O-N 3.48Š| ||
| 71 | G | 38.6 | Very low | 46.9 | Very low | 80 Ų | 80 | 119.6 Ų | 119.6 | 83% | 0.825 | 78% | 0.783 | S | S | * | * | trans | -69.6 | 112.4 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | Y69 | Y69-G71 PolarHBondContact O-N 2.79Š| ||
| 72 | Q | 44.4 | Very low | 48.2 | Very low | 177 Ų | 177 | 116.3 Ų | 116.3 | 83% | 0.827 | 76% | 0.761 | S | S | * | * | trans | -69.7 | 147 | 156.3 | -68 | -104.4 | -54.9 | 0 | 0 | 108.6 | G70 M74 | G70-Q72 PolarHBondContact O-N 3.48Å; Q72-M74 PolarHBondContact O-N 3.28Å; Q72-M74 VanDerWaalsContact O-N 3.15Å | ||
| 73 | P | 46.7 | Very low | 49.5 | Very low | 121 Ų | 121 | 119.1 Ų | 119.1 | 79% | 0.786 | 77% | 0.768 | S | S | * | * | trans | -64 | 120.1 | 177.8 | -7.3 | 21.3 | 0 | 0 | 0 | 108.9 | G75 | P73-G75 PolarHBondContact O-N 3.21Š| ||
| 74 | M | 46.5 | Very low | 51.4 | Low | 187 Ų | 187 | 116.1 Ų | 116.1 | 92% | 0.921 | 76% | 0.761 | S | S | * | * | trans | -53.3 | 106.9 | 172.4 | -81.8 | -86 | -123.7 | 0 | 0 | 109.2 | Q72 M76 | Q72-M74 PolarHBondContact O-N 3.28Å; Q72-M74 VanDerWaalsContact O-N 3.15Å; M74-M76 PolarHBondContact O-N 3.27Å | ||
| 75 | G | 45.9 | Very low | 53.6 | Low | 61 Ų | 61 | 114.5 Ų | 114.5 | 63% | 0.629 | 74% | 0.738 | S | S | * | * | trans | -59.2 | 125.1 | 167.5 | 0 | 0 | 0 | 0 | 0 | 108.7 | P73 S77 | P73-G75 PolarHBondContact O-N 3.21Å; G75-S77 PolarHBondContact O-N 2.92Å | ||
| 76 | M | 45.6 | Very low | 56 | Low | 189 Ų | 189 | 108.4 Ų | 108.4 | 93% | 0.931 | 70% | 0.698 | S | S | * | * | trans | -50.7 | 109.9 | 170.1 | -133.6 | 83.9 | 179.2 | 0 | 0 | 107.6 | M74 | M74-M76 PolarHBondContact O-N 3.27Š| ||
| 77 | S | 47.8 | Very low | 58.3 | Low | 105 Ų | 105 | 109.4 Ų | 109.4 | 73% | 0.734 | 69% | 0.693 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 133.9 | 173 | -64.3 | 0 | 0 | 0 | 0 | 107.9 | G75 A79 | G75-S77 PolarHBondContact O-N 2.92Å; S77-A79 PolarHBondContact O-N 3.21Å |
| 78 | P | 53.9 | Low | 60.5 | Low | 122 Ų | 122 | 103.8 Ų | 103.8 | 79% | 0.792 | 66% | 0.658 | S | S | * | * | P | Polyproline II helix | trans | -58 | 137.9 | 176 | 22.4 | -30 | 0 | 0 | 0 | 109 | ||
| 79 | A | 58.9 | Low | 62.7 | Low | 89 Ų | 89 | 96.5 Ų | 96.5 | 74% | 0.736 | 62% | 0.619 | S | S | * | * | P | Polyproline II helix | trans | -51.3 | 140.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 110.3 | S77 A81 | S77-A79 PolarHBondContact O-N 3.21Å; A79-A81 PolarHBondContact O-N 2.89Å |
| 80 | P | 57.9 | Low | 65.2 | Low | 126 Ų | 126 | 88.8 Ų | 88.8 | 82% | 0.818 | 59% | 0.591 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 129.4 | 179.7 | 21.9 | -30.5 | 0 | 0 | 0 | 109.8 | ||
| 81 | A | 62.1 | Low | 67.6 | Low | 65 Ų | 65 | 89.4 Ų | 89.4 | 54% | 0.537 | 57% | 0.573 | S | S | . | * | P | Polyproline II helix | trans | -57.6 | 141.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 110.1 | A79 V83 | A79-A81 PolarHBondContact O-N 2.89Å; A81-V83 PolarHBondContact O-N 3.1Å |
| 82 | P | 68.5 | Low | 70.3 | Confident | 59 Ų | 59 | 85.6 Ų | 85.6 | 38% | 0.383 | 53% | 0.533 | S | S | . | . | P | Polyproline II helix | trans | -55.3 | 128.3 | 177.3 | -22.3 | 31.7 | 0 | 0 | 0 | 111 | G84 V85 | P82-G84 PolarHBondContact O-N 3.28Å; P82-V85 HydrophobicContact CB-CB 4.28Å; P82-V85 HydrophobicContact CB-CG2 3.81Å; P82-V85 PolarHBondContact O-N 2.98Å |
| 83 | V | 73.8 | Confident | 72.6 | Confident | 155 Ų | 155 | 79.5 Ų | 79.5 | 94% | 0.939 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.3 | 126.9 | -177.7 | -179.5 | 0 | 0 | 0 | 0 | 109.8 | A81 | A81-V83 PolarHBondContact O-N 3.1Š|
| 84 | G | 82.5 | Confident | 74.9 | Confident | 65 Ų | 65 | 80.5 Ų | 80.5 | 67% | 0.67 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 86.6 | -1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | P82 | P82-G84 PolarHBondContact O-N 3.28Š|
| 85 | V | 91 | Very high | 77.1 | Confident | 29 Ų | 29 | 72 Ų | 72 | 18% | 0.176 | 46% | 0.461 | C | S | . | . | P | Polyproline II helix | trans | -88.6 | 127.9 | 173.5 | 178 | 0 | 0 | 0 | 0 | 110 | P82 L89 E90 T93 V277 | P82-V85 HydrophobicContact CB-CB 4.28Å; P82-V85 HydrophobicContact CB-CG2 3.81Å; P82-V85 PolarHBondContact O-N 2.98Å; V85-L89 HydrophobicContact CG1-CB 4.25Å; V85-E90 HydrophobicContact CG1-CG 4.33Å; V85-T93 HydrophobicContact CG2-CG2 3.99Å; V85-V277 HydrophobicContact CG1-CB 4.42Å; V85-V277 HydrophobicContact CG1-CG1 3.95Å; V85-V277 HydrophobicContact CG1-CG2 4.45Å; V85-V277 HydrophobicContact CG2-CG2 4.24Å |
| 86 | P | 91.5 | Very high | 79.4 | Confident | 14 Ų | 14 | 72.9 Ų | 72.9 | 9% | 0.091 | 45% | 0.451 | C | S | . | . | P | Polyproline II helix | trans | -60.3 | 142.6 | 176 | -23.8 | 34 | 0 | 0 | 0 | 112 | G88 L89 A187 V193 K278 | P86-G88 PolarHBondContact O-N 2.83Å; P86-L89 HydrophobicContact CB-CD1 4.28Å; P86-L89 HydrophobicContact CB-CD2 4.16Å; P86-L89 HydrophobicContact CG-CD2 4.18Å; P86-L89 WeakPolarHBondContact O-CB 3.22Å; P86-L89 PolarHBondContact O-N 2.85Å; P86-L89 VanDerWaalsContact O-N 3.12Å; P86-A187 HydrophobicContact CB-CB 4.19Å; P86-A187 HydrophobicContact CG-CB 4.44Å; P86-V193 HydrophobicContact CG-CG1 4.43Å; P86-K278 HydrophobicContact CG-CG 4.07Å |
| 87 | P | 91.4 | Very high | 81.7 | Confident | 85 Ų | 85 | 66.4 Ų | 66.4 | 55% | 0.552 | 42% | 0.418 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.2 | 133.1 | -179.6 | -26 | 34.5 | 0 | 0 | 0 | 112.7 | L89 E90 | P87-L89 VanDerWaalsContact C-N 3.32Å; P87-E90 WeakPolarHBondContact CA-OE1 3.09Å |
| 88 | G | 91.1 | Very high | 83.9 | Confident | 8 Ų | 8 | 61.4 Ų | 61.4 | 8% | 0.082 | 38% | 0.383 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 85.1 | -1.3 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | P86 E90 Y130 | P86-G88 PolarHBondContact O-N 2.83Å; G88-E90 WeakPolarHBondContact CA-OE2 3.43Å; G88-E90 VanDerWaalsContact N-CD 3.29Å; G88-E90 PolarHBondContact N-OE1 3.34Å; G88-E90 PolarHBondContact N-OE2 2.93Å; G88-Y130 WeakPolarHBondContact O-CE1 3.34Å; G88-Y130 PolarHBondContact O-OH 2.83Å |
| 89 | L | 94.3 | Very high | 85.8 | Confident | 0 Ų | 0 | 57.5 Ų | 57.5 | 0% | 0 | 36% | 0.356 | C | S | . | . | trans | -104.6 | 4.4 | 174.8 | -75.6 | 64.5 | 0 | 0 | 0 | 112.3 | V85 P86 P87 Y91 L92 V162 I163 A187 V277 A281 | V85-L89 HydrophobicContact CG1-CB 4.25Å; P86-L89 HydrophobicContact CB-CD1 4.28Å; P86-L89 HydrophobicContact CB-CD2 4.16Å; P86-L89 HydrophobicContact CG-CD2 4.18Å; P86-L89 WeakPolarHBondContact O-CB 3.22Å; P86-L89 PolarHBondContact O-N 2.85Å; P86-L89 VanDerWaalsContact O-N 3.12Å; P87-L89 VanDerWaalsContact C-N 3.32Å; L89-Y91 PolarHBondContact O-N 3.28Å; L89-L92 HydrophobicContact CB-CD1 4.16Å; L89-L92 HydrophobicContact CD2-CD1 4.36Å; L89-L92 HydrophobicContact CG-CD1 4.09Å; L89-L92 VanDerWaalsContact O-CB 3.25Å; L89-L92 WeakPolarHBondContact O-CB 3.31Å; L89-L92 PolarHBondContact O-N 2.89Å; L89-V162 HydrophobicContact CD1-CB 4.03Å; L89-I163 HydrophobicContact CD1-CD1 4.42Å; L89-I163 HydrophobicContact CD1-CG1 4.01Å; L89-I163 HydrophobicContact CD2-CD1 4.29Å; L89-I163 HydrophobicContact CD2-CG1 4.32Å; L89-I163 HydrophobicContact CG-CD1 4.28Å; L89-I163 HydrophobicContact CG-CG1 4.35Å; L89-A187 HydrophobicContact CD1-CB 4.15Å; L89-A187 HydrophobicContact CD2-CB 3.79Å; L89-V277 HydrophobicContact CB-CG1 3.57Å; L89-V277 HydrophobicContact CD2-CG1 4.02Å; L89-V277 HydrophobicContact CG-CG1 4.38Å; L89-A281 HydrophobicContact CD2-CB 3.85Å | ||
| 90 | E | 94.1 | Very high | 87.3 | Confident | 60 Ų | 60 | 53.3 Ų | 53.3 | 28% | 0.28 | 32% | 0.321 | S | S | . | . | G | 310 helix | trans | -59 | -35.5 | -174.2 | -56.8 | 82.2 | 177.7 | 0 | 0 | 111.7 | V85 P87 G88 L92 T93 | V85-E90 HydrophobicContact CG1-CG 4.33Å; P87-E90 WeakPolarHBondContact CA-OE1 3.09Å; G88-E90 WeakPolarHBondContact CA-OE2 3.43Å; G88-E90 VanDerWaalsContact N-CD 3.29Å; G88-E90 PolarHBondContact N-OE1 3.34Å; G88-E90 PolarHBondContact N-OE2 2.93Å; E90-L92 PolarHBondContact O-N 3.31Å; E90-T93 WeakPolarHBondContact O-CB 3.34Å; E90-T93 WeakPolarHBondContact O-CG2 3.19Å; E90-T93 PolarHBondContact O-N 2.94Å; E90-T93 PolarHBondContact O-OG1 2.64Å |
| 91 | Y | 93.4 | Very high | 88.8 | Confident | 81 Ų | 81 | 48.9 Ų | 48.9 | 32% | 0.318 | 29% | 0.289 | S | S | . | . | G | 310 helix | trans | -60.5 | -28.7 | 177.1 | -167 | -92.4 | 0 | 0 | 0 | 112.7 | L89 T93 Q94 I95 N123 I129 | L89-Y91 PolarHBondContact O-N 3.28Å; Y91-T93 PolarHBondContact O-N 3.4Å; Y91-Q94 PolarHBondContact O-N 2.91Å; Y91-I95 HydrophobicContact CD1-CD1 4.23Å; Y91-I95 HydrophobicContact CD1-CG2 4.14Å; Y91-I95 HydrophobicContact CE1-CD1 4.27Å; Y91-I95 HydrophobicContact CE1-CG2 3.52Å; Y91-N123 HydrophobicContact CE1-CB 4.36Å; Y91-N123 PolarHBondContact OH-ND2 3.39Å; Y91-I129 HydrophobicContact CD1-CB 4.21Å; Y91-I129 HydrophobicContact CD1-CD1 4.35Å; Y91-I129 HydrophobicContact CD1-CG2 3.73Å; Y91-I129 HydrophobicContact CE1-CB 4.29Å; Y91-I129 HydrophobicContact CE1-CD1 4.47Å; Y91-I129 HydrophobicContact CE1-CG2 3.34Å |
| 92 | L | 94.4 | Very high | 89.7 | Confident | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 27% | 0.274 | C | S | . | . | G | 310 helix | trans | -67.2 | -16 | 177.9 | -58.8 | -177.7 | 0 | 0 | 0 | 112.9 | L89 E90 Q94 I95 I98 Y130 V277 K280 M284 | L89-L92 HydrophobicContact CB-CD1 4.16Å; L89-L92 HydrophobicContact CD2-CD1 4.36Å; L89-L92 HydrophobicContact CG-CD1 4.09Å; L89-L92 VanDerWaalsContact O-CB 3.25Å; L89-L92 WeakPolarHBondContact O-CB 3.31Å; L89-L92 PolarHBondContact O-N 2.89Å; E90-L92 PolarHBondContact O-N 3.31Å; L92-Q94 PolarHBondContact O-N 2.7Å; L92-I95 HydrophobicContact CD2-CD1 3.69Å; L92-I95 HydrophobicContact CD2-CG1 4.28Å; L92-I98 HydrophobicContact CD2-CD1 3.89Å; L92-Y130 HydrophobicContact CD2-CE2 3.89Å; L92-Y130 HydrophobicContact CG-CE2 4.39Å; L92-V277 HydrophobicContact CB-CG1 3.94Å; L92-V277 HydrophobicContact CB-CG2 4.41Å; L92-V277 HydrophobicContact CD1-CG1 4.16Å; L92-K280 HydrophobicContact CB-CD 4.26Å; L92-K280 HydrophobicContact CD1-CB 4.4Å; L92-K280 WeakPolarHBondContact O-CD 3.49Å; L92-K280 PolarHBondContact O-NZ 3.31Å; L92-M284 HydrophobicContact CD1-CE 3.69Å; L92-M284 HydrophobicContact CD2-CE 4.46Å |
| 93 | T | 94.2 | Very high | 90.2 | Very high | 49 Ų | 49 | 49.6 Ų | 49.6 | 30% | 0.301 | 28% | 0.275 | S | S | . | . | G | 310 helix | trans | -69.9 | -14.6 | 172.6 | 64.6 | 0 | 0 | 0 | 0 | 113 | V85 E90 Y91 M273 V277 | V85-T93 HydrophobicContact CG2-CG2 3.99Å; E90-T93 WeakPolarHBondContact O-CB 3.34Å; E90-T93 WeakPolarHBondContact O-CG2 3.19Å; E90-T93 PolarHBondContact O-N 2.94Å; E90-T93 PolarHBondContact O-OG1 2.64Å; Y91-T93 PolarHBondContact O-N 3.4Å; T93-M273 WeakPolarHBondContact O-CE 3.5Å; T93-V277 HydrophobicContact CG2-CG2 3.48Å; T93-V277 VanDerWaalsContact CG2-CG2 3.48Å |
| 94 | Q | 94.2 | Very high | 89.9 | Confident | 141 Ų | 141 | 47.2 Ų | 47.2 | 66% | 0.659 | 26% | 0.26 | S | S | * | . | G | 310 helix | trans | -115.9 | 3.6 | -171.6 | -57.6 | 179.3 | 13.2 | 0 | 0 | 113.7 | Y91 L92 M273 | Y91-Q94 PolarHBondContact O-N 2.91Å; L92-Q94 PolarHBondContact O-N 2.7Å; Q94-M273 VanDerWaalsContact C-CE 3.49Å |
| 95 | I | 93.2 | Very high | 88.8 | Confident | 9 Ų | 9 | 46.9 Ų | 46.9 | 5% | 0.046 | 24% | 0.242 | C | C | . | . | trans | -127.2 | 152.7 | 175.9 | 67.9 | -179.8 | 0 | 0 | 0 | 111.8 | Y91 L92 I98 N123 I129 F271 M273 K280 | Y91-I95 HydrophobicContact CD1-CD1 4.23Å; Y91-I95 HydrophobicContact CD1-CG2 4.14Å; Y91-I95 HydrophobicContact CE1-CD1 4.27Å; Y91-I95 HydrophobicContact CE1-CG2 3.52Å; L92-I95 HydrophobicContact CD2-CD1 3.69Å; L92-I95 HydrophobicContact CD2-CG1 4.28Å; I95-I98 HydrophobicContact CD1-CD1 4.27Å; I95-I98 HydrophobicContact CD1-CG1 3.71Å; I95-N123 HydrophobicContact CG2-CB 4.43Å; I95-I129 HydrophobicContact CD1-CD1 3.8Å; I95-F271 WeakPolarHBondContact O-CE2 3.07Å; I95-M273 VanDerWaalsContact C-CE 3.49Å; I95-M273 VanDerWaalsContact N-CE 3.32Å; I95-M273 WeakPolarHBondContact O-CE 3.43Å; I95-K280 PolarHBondContact O-NZ 3.2Å | ||
| 96 | D | 93.9 | Very high | 86.9 | Confident | 80 Ų | 80 | 51.7 Ų | 51.7 | 43% | 0.428 | 27% | 0.265 | S | S | . | . | S | Bend | trans | -115.3 | -6 | 173.3 | 60.4 | -9.1 | 0 | 0 | 0 | 112.1 | Q270 F271 M273 | D96-Q270 WeakPolarHBondContact O-CA 3.42Å; D96-F271 WeakPolarHBondContact CB-O 3.42Å; D96-F271 WeakPolarHBondContact O-CD2 3.18Å; D96-F271 PolarHBondContact O-N 3.27Å; D96-F271 VanDerWaalsContact O-O 3.08Å; D96-M273 HydrophobicContact CB-CB 4.34Å; D96-M273 HydrophobicContact CB-SD 4.44Å |
| 97 | Q | 93.9 | Very high | 84.7 | Confident | 52 Ų | 52 | 56 Ų | 56 | 24% | 0.243 | 29% | 0.287 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.8 | 139.3 | -177.9 | -172.3 | 178.3 | 44.8 | 0 | 0 | 112.5 | L99 I269 Q270 | Q97-L99 HydrophobicContact CG-CD2 4.36Å; Q97-I269 CarbonylContact C-O 3.54Å; Q97-I269 VanDerWaalsContact CA-O 3.26Å; Q97-I269 WeakPolarHBondContact CA-O 3.25Å; Q97-Q270 HydrophobicContact CG-CG 4.05Å |
| 98 | I | 94.3 | Very high | 82.8 | Confident | 0 Ų | 0 | 54.4 Ų | 54.4 | 0% | 0 | 27% | 0.272 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.5 | 138 | 174.2 | -63.1 | 176.3 | 0 | 0 | 0 | 108.9 | L92 I95 I100 I121 G268 I269 F271 M284 | L92-I98 HydrophobicContact CD2-CD1 3.89Å; I95-I98 HydrophobicContact CD1-CD1 4.27Å; I95-I98 HydrophobicContact CD1-CG1 3.71Å; I98-I100 HydrophobicContact CG2-CG1 4.17Å; I98-I121 HydrophobicContact CG2-CG2 3.32Å; I98-G268 WeakPolarHBondContact O-CA 3.22Å; I98-I269 HydrophobicContact CB-CB 4.3Å; I98-I269 PolarHBondContact N-O 3.02Å; I98-I269 PolarHBondContact O-N 2.85Å; I98-F271 HydrophobicContact CD1-CE1 3.93Å; I98-F271 HydrophobicContact CD1-CZ 3.81Å; I98-F271 HydrophobicContact CG1-CE1 4.22Å; I98-F271 HydrophobicContact CG1-CZ 3.95Å; I98-M284 HydrophobicContact CD1-CE 4.38Å; I98-M284 HydrophobicContact CD1-CG 3.66Å; I98-M284 HydrophobicContact CD1-SD 3.6Å |
| 99 | L | 92.8 | Very high | 80.8 | Confident | 40 Ų | 40 | 58 Ų | 58 | 21% | 0.209 | 30% | 0.301 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.2 | 129.5 | 173.3 | -54.3 | 178.3 | 0 | 0 | 0 | 108.9 | Q97 I121 K122 N123 F267 | Q97-L99 HydrophobicContact CG-CD2 4.36Å; L99-I121 CarbonylContact O-C 3.56Å; L99-I121 WeakPolarHBondContact O-CA 3.35Å; L99-K122 HydrophobicContact CB-CB 4.28Å; L99-K122 PolarHBondContact N-O 3.21Å; L99-K122 PolarHBondContact O-N 3.41Å; L99-N123 WeakPolarHBondContact CD1-O 3.47Å; L99-F267 CarbonylContact C-O 3.55Å; L99-F267 WeakPolarHBondContact CA-O 3.36Å |
| 100 | I | 91.7 | Very high | 78.3 | Confident | 1 Ų | 1 | 66.3 Ų | 66.3 | 1% | 0.005 | 34% | 0.337 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.6 | 119.8 | 177.6 | -57.7 | 175.8 | 0 | 0 | 0 | 107.8 | I98 Y119 I121 N266 F267 I269 C287 F288 | I98-I100 HydrophobicContact CG2-CG1 4.17Å; I100-Y119 HydrophobicContact CG2-CD1 3.94Å; I100-Y119 HydrophobicContact CG2-CG 4.3Å; I100-I121 HydrophobicContact CG1-CG1 4.38Å; I100-I121 HydrophobicContact CG1-CG2 4.45Å; I100-N266 WeakPolarHBondContact O-CA 2.91Å; I100-F267 HydrophobicContact CB-CB 4.22Å; I100-F267 PolarHBondContact N-O 3.4Å; I100-F267 PolarHBondContact O-N 2.93Å; I100-I269 HydrophobicContact CD1-CD1 3.96Å; I100-C287 HydrophobicContact CD1-CB 4.15Å; I100-F288 HydrophobicContact CD1-CD2 4.44Å; I100-F288 HydrophobicContact CD1-CE2 3.88Å; I100-F288 HydrophobicContact CD1-CZ 3.98Å; I100-F288 HydrophobicContact CG2-CE1 3.93Å; I100-F288 HydrophobicContact CG2-CZ 3.77Å |
| 101 | H | 87.4 | Confident | 76 | Confident | 33 Ų | 33 | 68.4 Ų | 68.4 | 15% | 0.153 | 35% | 0.35 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.5 | 120.6 | -178.1 | -68.7 | -114.2 | 0 | 0 | 0 | 109.2 | Y119 E120 N266 | H101-Y119 CarbonylContact O-C 3.5Å; H101-Y119 VanDerWaalsContact O-CA 3.22Å; H101-Y119 WeakPolarHBondContact O-CA 3.48Å; H101-E120 HydrophobicContact CB-CB 4.48Å; H101-E120 PolarHBondContact N-O 3.36Å; H101-E120 PolarHBondContact O-N 2.86Å; H101-N266 PolarHBondContact CE1-OD1 3.31Å; H101-N266 PolarHBondContact ND1-OD1 2.95Å |
| 102 | Q | 82.9 | Confident | 73.9 | Confident | 47 Ų | 47 | 68 Ų | 68 | 22% | 0.22 | 37% | 0.37 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.2 | 134.6 | 172.2 | -169.2 | 173.9 | 6.7 | 0 | 0 | 110.5 | N117 Y119 T264 | Q102-N117 PolarHBondContact NE2-OD1 2.94Å; Q102-Y119 HydrophobicContact CB-CD1 3.76Å; Q102-Y119 HydrophobicContact CB-CE1 3.75Å; Q102-Y119 HydrophobicContact CG-CD1 4Å; Q102-Y119 HydrophobicContact CG-CE1 3.68Å; Q102-T264 WeakPolarHBondContact O-CG2 3.39Å |
| 103 | K | 78.3 | Confident | 71.6 | Confident | 93 Ų | 93 | 75.7 Ų | 75.7 | 40% | 0.404 | 40% | 0.404 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.8 | 110 | 169.1 | -76.5 | -175.4 | 158.2 | 165.2 | 0 | 108.7 | E105 Q118 E120 | K103-E105 PolarHBondContact O-N 3.12Å; K103-Q118 HydrophobicContact CB-CB 4.27Å; K103-Q118 WeakPolarHBondContact CB-O 3.21Å; K103-Q118 PolarHBondContact N-O 3.17Å; K103-E120 HydrophobicContact CD-CG 4.15Å; K103-E120 VanDerWaalsContact CE-CG 3.46Å; K103-E120 WeakPolarHBondContact CE-OE1 3.43Å; K103-E120 HydrophobicContact CG-CG 4.32Å; K103-E120 IonicContact NZ-OE1 3.66Å; K103-E120 PolarHBondContact NZ-OE1 3.45Å |
| 104 | V | 66.4 | Low | 69.6 | Low | 104 Ų | 104 | 78.1 Ų | 78.1 | 63% | 0.63 | 41% | 0.412 | S | S | * | . | trans | -77 | 107.9 | 166.9 | -173.4 | 0 | 0 | 0 | 0 | 107.3 | L106 | V104-L106 PolarHBondContact O-N 3.19Š| ||
| 105 | E | 59.5 | Low | 67.8 | Low | 59 Ų | 59 | 73.3 Ų | 73.3 | 28% | 0.276 | 39% | 0.392 | S | S | . | . | trans | -78 | 112.9 | 173.7 | -71.5 | -169.1 | 162.9 | 0 | 0 | 108.7 | K103 L107 E108 T115 Q118 | K103-E105 PolarHBondContact O-N 3.12Å; E105-L107 PolarHBondContact O-N 2.61Å; E105-E108 PolarHBondContact O-N 3.19Å; E105-T115 VanDerWaalsContact OE2-CB 3.26Å; E105-T115 WeakPolarHBondContact OE2-CB 3.39Å; E105-T115 PolarHBondContact OE2-OG1 3.04Å; E105-Q118 PolarHBondContact OE1-NE2 2.98Å | ||
| 106 | L | 51.1 | Low | 66.6 | Low | 129 Ų | 129 | 75.2 Ų | 75.2 | 68% | 0.675 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -52.5 | -23.4 | 179.5 | -74.1 | 158.6 | 0 | 0 | 0 | 113.4 | V104 E108 A109 F110 | V104-L106 PolarHBondContact O-N 3.19Å; L106-E108 VanDerWaalsContact C-N 3.31Å; L106-E108 PolarHBondContact O-N 2.64Å; L106-A109 PolarHBondContact O-N 3.2Å; L106-F110 HydrophobicContact CB-CD2 4.47Å; L106-F110 HydrophobicContact CB-CE2 4.44Å; L106-F110 WeakPolarHBondContact O-CD2 3.43Å; L106-F110 PolarHBondContact O-N 2.88Å |
| 107 | L | 46.8 | Very low | 65.8 | Low | 105 Ų | 105 | 72.2 Ų | 72.2 | 55% | 0.55 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -61.9 | -32.4 | 175.6 | -81.5 | 150.1 | 0 | 0 | 0 | 113.2 | E105 A109 F110 I111 | E105-L107 PolarHBondContact O-N 2.61Å; L107-A109 VanDerWaalsContact C-N 3.3Å; L107-A109 PolarHBondContact O-N 2.93Å; L107-F110 PolarHBondContact O-N 2.92Å; L107-I111 HydrophobicContact CB-CD1 4.01Å; L107-I111 HydrophobicContact CD2-CD1 3.29Å; L107-I111 HydrophobicContact CD2-CG1 4.1Å; L107-I111 HydrophobicContact CG-CD1 4.26Å; L107-I111 WeakPolarHBondContact O-CG1 3.41Å; L107-I111 PolarHBondContact O-N 3.18Å |
| 108 | E | 51.3 | Low | 65.4 | Low | 52 Ų | 52 | 71.9 Ų | 71.9 | 24% | 0.243 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -63.7 | -39 | 174.7 | -59.5 | -172.3 | 133 | 0 | 0 | 111.4 | E105 L106 F110 G112 T115 | E105-E108 PolarHBondContact O-N 3.19Å; L106-E108 VanDerWaalsContact C-N 3.31Å; L106-E108 PolarHBondContact O-N 2.64Å; E108-F110 VanDerWaalsContact C-N 3.34Å; E108-F110 PolarHBondContact O-N 3.45Å; E108-G112 PolarHBondContact O-N 2.77Å; E108-T115 HydrophobicContact CG-CG2 4.14Å; E108-T115 WeakPolarHBondContact CG-OG1 3.37Å; E108-T115 WeakPolarHBondContact OE1-CA 3.38Å; E108-T115 PolarHBondContact OE1-N 3.47Å; E108-T115 VanDerWaalsContact OE1-O 3.07Å; E108-T115 PolarHBondContact OE1-OG1 3.36Å |
| 109 | A | 49.3 | Very low | 65.1 | Low | 82 Ų | 82 | 72.1 Ų | 72.1 | 68% | 0.678 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -71.7 | -26 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | L106 L107 | L106-A109 PolarHBondContact O-N 3.2Å; L107-A109 VanDerWaalsContact C-N 3.3Å; L107-A109 PolarHBondContact O-N 2.93Å |
| 110 | F | 41.4 | Very low | 65.1 | Low | 175 Ų | 175 | 71.9 Ų | 71.9 | 77% | 0.768 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -97.5 | -25.7 | -177.7 | -76.1 | -70.6 | 0 | 0 | 0 | 114.5 | L106 L107 E108 | L106-F110 HydrophobicContact CB-CD2 4.47Å; L106-F110 HydrophobicContact CB-CE2 4.44Å; L106-F110 WeakPolarHBondContact O-CD2 3.43Å; L106-F110 PolarHBondContact O-N 2.88Å; L107-F110 PolarHBondContact O-N 2.92Å; E108-F110 VanDerWaalsContact C-N 3.34Å; E108-F110 PolarHBondContact O-N 3.45Å |
| 111 | I | 46.7 | Very low | 65.2 | Low | 105 Ų | 105 | 71.9 Ų | 71.9 | 54% | 0.538 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -118.9 | -6 | -171.9 | -24.1 | 156.7 | 0 | 0 | 0 | 113.5 | L107 F113 | L107-I111 HydrophobicContact CB-CD1 4.01Å; L107-I111 HydrophobicContact CD2-CD1 3.29Å; L107-I111 HydrophobicContact CD2-CG1 4.1Å; L107-I111 HydrophobicContact CG-CD1 4.26Å; L107-I111 WeakPolarHBondContact O-CG1 3.41Å; L107-I111 PolarHBondContact O-N 3.18Å; I111-F113 PolarHBondContact O-N 3.01Å; I111-F113 VanDerWaalsContact O-N 3.11Å |
| 112 | G | 47.7 | Very low | 65.5 | Low | 73 Ų | 73 | 72.1 Ų | 72.1 | 75% | 0.753 | 38% | 0.384 | S | S | * | . | trans | 64.1 | 14.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | E108 | E108-G112 PolarHBondContact O-N 2.77Š| ||
| 113 | F | 46.8 | Very low | 65.9 | Low | 160 Ų | 160 | 70 Ų | 70 | 70% | 0.702 | 38% | 0.375 | S | S | * | . | P | Polyproline II helix | trans | -102.2 | 119.9 | 171.1 | -98 | -91.3 | 0 | 0 | 0 | 108.5 | I111 T115 | I111-F113 PolarHBondContact O-N 3.01Å; I111-F113 VanDerWaalsContact O-N 3.11Å; F113-T115 PolarHBondContact O-N 2.79Å |
| 114 | E | 52.1 | Low | 66.3 | Low | 101 Ų | 101 | 68.6 Ų | 68.6 | 47% | 0.472 | 38% | 0.376 | S | S | . | . | P | Polyproline II helix | trans | -62.3 | 117.1 | 170.4 | -83 | 160.3 | 154.8 | 0 | 0 | 110 | R141 | E114-R141 IonicContact OE1-CZ 2.62Å; E114-R141 IonicContact OE1-NE 3.01Å; E114-R141 PolarHBondContact OE1-NE 3.47Å; E114-R141 IonicContact OE1-NH1 3.12Å; E114-R141 IonicContact OE1-NH2 2.6Å; E114-R141 PolarHBondContact OE1-NH2 3.29Å; E114-R141 WeakPolarHBondContact OE2-CD 3.32Å; E114-R141 WeakPolarHBondContact OE2-CG 3.25Å; E114-R141 IonicContact OE2-CZ 2.71Å; E114-R141 VanDerWaalsContact OE2-CZ 3.26Å; E114-R141 IonicContact OE2-NE 2.98Å; E114-R141 PolarHBondContact OE2-NE 3.31Å; E114-R141 IonicContact OE2-NH1 3.9Å; E114-R141 IonicContact OE2-NH2 3.86Å |
| 115 | T | 56.4 | Low | 67.3 | Low | 39 Ų | 39 | 70 Ų | 70 | 24% | 0.239 | 38% | 0.379 | C | S | . | . | P | Polyproline II helix | trans | -84.4 | 171.8 | 165.8 | 61.5 | 0 | 0 | 0 | 0 | 109.5 | E105 E108 F113 | E105-T115 VanDerWaalsContact OE2-CB 3.26Å; E105-T115 WeakPolarHBondContact OE2-CB 3.39Å; E105-T115 PolarHBondContact OE2-OG1 3.04Å; E108-T115 HydrophobicContact CG-CG2 4.14Å; E108-T115 WeakPolarHBondContact CG-OG1 3.37Å; E108-T115 WeakPolarHBondContact OE1-CA 3.38Å; E108-T115 PolarHBondContact OE1-N 3.47Å; E108-T115 VanDerWaalsContact OE1-O 3.07Å; E108-T115 PolarHBondContact OE1-OG1 3.36Å; F113-T115 PolarHBondContact O-N 2.79Å |
| 116 | N | 67.4 | Low | 68.5 | Low | 50 Ų | 50 | 69 Ų | 69 | 27% | 0.267 | 39% | 0.386 | S | S | . | . | P | Polyproline II helix | trans | -78.3 | 135.1 | -177.6 | -66.7 | -10.6 | 0 | 0 | 0 | 109.9 | Q118 E134 N136 | N116-Q118 PolarHBondContact O-N 2.83Å; N116-E134 WeakPolarHBondContact CB-O 3.45Å; N116-E134 PolarHBondContact ND2-O 2.8Å; N116-N136 WeakPolarHBondContact OD1-CB 3.17Å; N116-N136 PolarHBondContact OD1-ND2 3.48Å |
| 117 | N | 77.1 | Confident | 70.4 | Confident | 16 Ų | 16 | 68 Ų | 68 | 9% | 0.086 | 38% | 0.377 | C | S | . | . | P | Polyproline II helix | trans | -55.3 | 126.3 | 175.3 | -69.6 | -49 | 0 | 0 | 0 | 110.8 | Q102 Y119 E134 E296 | Q102-N117 PolarHBondContact NE2-OD1 2.94Å; N117-Y119 HydrophobicContact CB-CE2 3.59Å; N117-E134 HydrophobicContact CB-CB 4.2Å; N117-E134 WeakPolarHBondContact CB-OE2 3.34Å; N117-E134 PolarHBondContact ND2-OE2 3.41Å; N117-E134 PolarHBondContact O-N 3.49Å; N117-E296 PolarHBondContact ND2-OE1 3.03Å; N117-E296 VanDerWaalsContact ND2-OE1 3.15Å |
| 118 | Q | 85.3 | Confident | 72.6 | Confident | 46 Ų | 46 | 67.3 Ų | 67.3 | 22% | 0.215 | 37% | 0.37 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.7 | 140.7 | 178 | -77 | 177 | 71.9 | 0 | 0 | 109.4 | K103 E105 N116 A132 K133 | K103-Q118 HydrophobicContact CB-CB 4.27Å; K103-Q118 WeakPolarHBondContact CB-O 3.21Å; K103-Q118 PolarHBondContact N-O 3.17Å; E105-Q118 PolarHBondContact OE1-NE2 2.98Å; N116-Q118 PolarHBondContact O-N 2.83Å; Q118-A132 WeakPolarHBondContact CA-O 3.41Å; Q118-K133 HydrophobicContact CG-CB 4.31Å; Q118-K133 HydrophobicContact CG-CD 4.08Å; Q118-K133 HydrophobicContact CG-CG 3.94Å |
| 119 | Y | 89.4 | Confident | 74.6 | Confident | 4 Ų | 4 | 65.5 Ų | 65.5 | 2% | 0.016 | 36% | 0.362 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.4 | 144.1 | -177.6 | -52.3 | -103 | 0 | 0 | 0 | 110.7 | I100 H101 Q102 N117 K131 A132 M152 F288 D291 | I100-Y119 HydrophobicContact CG2-CD1 3.94Å; I100-Y119 HydrophobicContact CG2-CG 4.3Å; H101-Y119 CarbonylContact O-C 3.5Å; H101-Y119 VanDerWaalsContact O-CA 3.22Å; H101-Y119 WeakPolarHBondContact O-CA 3.48Å; Q102-Y119 HydrophobicContact CB-CD1 3.76Å; Q102-Y119 HydrophobicContact CB-CE1 3.75Å; Q102-Y119 HydrophobicContact CG-CD1 4Å; Q102-Y119 HydrophobicContact CG-CE1 3.68Å; N117-Y119 HydrophobicContact CB-CE2 3.59Å; Y119-K131 WeakPolarHBondContact O-CA 3.32Å; Y119-A132 HydrophobicContact CD2-CB 4.43Å; Y119-A132 PolarHBondContact N-O 2.8Å; Y119-A132 PolarHBondContact O-N 2.83Å; Y119-M152 HydrophobicContact CD2-CE 3.98Å; Y119-M152 HydrophobicContact CE2-CE 3.59Å; Y119-F288 AromaticContact CD1-CE1 3.97Å; Y119-F288 HydrophobicContact CD1-CE1 3.97Å; Y119-F288 AromaticContact CD2-CE1 3.74Å; Y119-F288 HydrophobicContact CD2-CE1 3.74Å; Y119-F288 HydrophobicContact CD2-CZ 4.44Å; Y119-F288 HydrophobicContact CE1-CE1 4.2Å; Y119-F288 HydrophobicContact CE2-CE1 4.01Å; Y119-F288 AromaticContact CG-CE1 3.72Å; Y119-F288 HydrophobicContact CG-CE1 3.72Å; Y119-F288 HydrophobicContact CG-CZ 4.28Å; Y119-D291 PolarHBondContact OH-OD2 3.11Å; Y119-D291 VanDerWaalsContact OH-OD2 3.12Å |
| 120 | E | 92.7 | Very high | 76.9 | Confident | 36 Ų | 36 | 61.9 Ų | 61.9 | 17% | 0.168 | 33% | 0.331 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.9 | 127.8 | 165.9 | -64.9 | -169.2 | 152 | 0 | 0 | 109.6 | H101 K103 K122 K128 | H101-E120 HydrophobicContact CB-CB 4.48Å; H101-E120 PolarHBondContact N-O 3.36Å; H101-E120 PolarHBondContact O-N 2.86Å; K103-E120 HydrophobicContact CD-CG 4.15Å; K103-E120 VanDerWaalsContact CE-CG 3.46Å; K103-E120 WeakPolarHBondContact CE-OE1 3.43Å; K103-E120 HydrophobicContact CG-CG 4.32Å; K103-E120 IonicContact NZ-OE1 3.66Å; K103-E120 PolarHBondContact NZ-OE1 3.45Å; E120-K122 HydrophobicContact CB-CG 4.5Å; E120-K122 WeakPolarHBondContact OE2-CE 3.39Å; E120-K122 IonicContact OE2-NZ 3.1Å; E120-K122 PolarHBondContact OE2-NZ 2.98Å; E120-K128 HydrophobicContact CG-CD 4.31Å |
| 121 | I | 94.3 | Very high | 79.5 | Confident | 0 Ų | 0 | 57.5 Ų | 57.5 | 0% | 0 | 31% | 0.311 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.9 | 121.9 | 173.7 | -51.9 | -174 | 0 | 0 | 0 | 106.9 | I98 L99 I100 I129 Y130 A132 I154 M284 F288 | I98-I121 HydrophobicContact CG2-CG2 3.32Å; L99-I121 CarbonylContact O-C 3.56Å; L99-I121 WeakPolarHBondContact O-CA 3.35Å; I100-I121 HydrophobicContact CG1-CG1 4.38Å; I100-I121 HydrophobicContact CG1-CG2 4.45Å; I121-I129 HydrophobicContact CB-CG1 4.43Å; I121-I129 HydrophobicContact CG2-CD1 4.11Å; I121-I129 HydrophobicContact CG2-CG1 4.02Å; I121-I129 VanDerWaalsContact O-CG1 3.22Å; I121-I129 WeakPolarHBondContact O-CG1 3.33Å; I121-I129 PolarHBondContact O-N 2.82Å; I121-Y130 HydrophobicContact CB-CD2 4.43Å; I121-Y130 HydrophobicContact CG2-CD2 4.17Å; I121-Y130 PolarHBondContact N-O 2.82Å; I121-Y130 PolarHBondContact O-N 3.31Å; I121-Y130 VanDerWaalsContact O-N 3.14Å; I121-A132 HydrophobicContact CD1-CB 4.33Å; I121-I154 HydrophobicContact CD1-CD1 4.1Å; I121-I154 HydrophobicContact CD1-CG1 4.33Å; I121-I154 HydrophobicContact CD1-CG2 3.86Å; I121-M284 HydrophobicContact CD1-SD 4.32Å; I121-M284 HydrophobicContact CG2-SD 4.39Å; I121-F288 HydrophobicContact CD1-CE2 4.24Å; I121-F288 HydrophobicContact CD1-CZ 4.38Å |
| 122 | K | 93.1 | Very high | 81.6 | Confident | 39 Ų | 39 | 52.6 Ų | 52.6 | 17% | 0.17 | 29% | 0.287 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.6 | 156.6 | -173.1 | -63.7 | 173.5 | -178.6 | 171.5 | 0 | 110.8 | L99 E120 G126 Q127 | L99-K122 HydrophobicContact CB-CB 4.28Å; L99-K122 PolarHBondContact N-O 3.21Å; L99-K122 PolarHBondContact O-N 3.41Å; E120-K122 HydrophobicContact CB-CG 4.5Å; E120-K122 WeakPolarHBondContact OE2-CE 3.39Å; E120-K122 IonicContact OE2-NZ 3.1Å; E120-K122 PolarHBondContact OE2-NZ 2.98Å; K122-G126 WeakPolarHBondContact CD-O 3.29Å; K122-Q127 CarbonylContact C-O 3.54Å; K122-Q127 WeakPolarHBondContact CA-O 3.25Å; K122-Q127 WeakPolarHBondContact CB-O 3.32Å |
| 123 | N | 91.4 | Very high | 83.6 | Confident | 3 Ų | 3 | 54 Ų | 54 | 2% | 0.016 | 27% | 0.272 | C | S | . | . | trans | -82 | -179.6 | 166.3 | 67.8 | 8.8 | 0 | 0 | 0 | 111 | Y91 I95 L99 L125 G126 Q127 I129 | Y91-N123 HydrophobicContact CE1-CB 4.36Å; Y91-N123 PolarHBondContact OH-ND2 3.39Å; I95-N123 HydrophobicContact CG2-CB 4.43Å; L99-N123 WeakPolarHBondContact CD1-O 3.47Å; N123-L125 PolarHBondContact O-N 2.96Å; N123-L125 WeakPolarHBondContact OD1-CA 3.42Å; N123-L125 WeakPolarHBondContact OD1-CB 3Å; N123-L125 PolarHBondContact OD1-N 2.74Å; N123-G126 PolarHBondContact O-N 2.88Å; N123-G126 PolarHBondContact OD1-N 2.85Å; N123-Q127 PolarHBondContact N-O 2.86Å; N123-Q127 PolarHBondContact ND2-OE1 3.13Å; N123-Q127 WeakPolarHBondContact OD1-CB 3.17Å; N123-Q127 PolarHBondContact OD1-N 2.75Å; N123-Q127 PolarHBondContact OD1-O 2.77Å; N123-I129 HydrophobicContact CB-CG2 4.2Å | ||
| 124 | S | 85.9 | Confident | 85.2 | Confident | 62 Ų | 62 | 46.4 Ų | 46.4 | 43% | 0.434 | 24% | 0.238 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -60 | -23.1 | 176.4 | 55.5 | 0 | 0 | 0 | 0 | 114.5 | G126 | S124-G126 VanDerWaalsContact C-N 3.28Š|
| 125 | L | 86.9 | Confident | 86.3 | Confident | 133 Ų | 133 | 47.6 Ų | 47.6 | 70% | 0.696 | 24% | 0.242 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -84.7 | 1.7 | 175.2 | -57.2 | 176.5 | 0 | 0 | 0 | 113 | N123 Q127 | N123-L125 PolarHBondContact O-N 2.96Å; N123-L125 WeakPolarHBondContact OD1-CA 3.42Å; N123-L125 WeakPolarHBondContact OD1-CB 3Å; N123-L125 PolarHBondContact OD1-N 2.74Å; L125-Q127 HydrophobicContact CB-CG 4.2Å; L125-Q127 PolarHBondContact O-N 2.83Å |
| 126 | G | 86.1 | Confident | 86.5 | Confident | 40 Ų | 40 | 48.1 Ų | 48.1 | 41% | 0.412 | 24% | 0.243 | S | C | . | . | trans | 75.5 | 7.4 | -176.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | K122 N123 S124 | K122-G126 WeakPolarHBondContact CD-O 3.29Å; N123-G126 PolarHBondContact O-N 2.88Å; N123-G126 PolarHBondContact OD1-N 2.85Å; S124-G126 VanDerWaalsContact C-N 3.28Å | ||
| 127 | Q | 89.8 | Confident | 85.5 | Confident | 108 Ų | 108 | 52.4 Ų | 52.4 | 51% | 0.505 | 27% | 0.267 | S | S | . | . | trans | -77 | 132.5 | 177 | -58.6 | 172.4 | -39.6 | 0 | 0 | 109.7 | K122 N123 L125 I129 | K122-Q127 CarbonylContact C-O 3.54Å; K122-Q127 WeakPolarHBondContact CA-O 3.25Å; K122-Q127 WeakPolarHBondContact CB-O 3.32Å; N123-Q127 PolarHBondContact N-O 2.86Å; N123-Q127 PolarHBondContact ND2-OE1 3.13Å; N123-Q127 WeakPolarHBondContact OD1-CB 3.17Å; N123-Q127 PolarHBondContact OD1-N 2.75Å; N123-Q127 PolarHBondContact OD1-O 2.77Å; L125-Q127 HydrophobicContact CB-CG 4.2Å; L125-Q127 PolarHBondContact O-N 2.83Å; Q127-I129 PolarHBondContact O-N 2.98Å | ||
| 128 | K | 93.2 | Very high | 83.8 | Confident | 90 Ų | 90 | 58.2 Ų | 58.2 | 39% | 0.391 | 31% | 0.307 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -70.9 | 120.8 | 177.9 | -174.7 | -177.5 | 69 | -168.8 | 0 | 110.9 | E120 Y130 N157 | E120-K128 HydrophobicContact CG-CD 4.31Å; K128-Y130 WeakPolarHBondContact CG-O 3.33Å; K128-N157 WeakPolarHBondContact CE-OD1 3.36Å; K128-N157 PolarHBondContact O-ND2 3.13Å |
| 129 | I | 94.8 | Very high | 81.9 | Confident | 14 Ų | 14 | 61.7 Ų | 61.7 | 7% | 0.072 | 34% | 0.335 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.2 | -35.7 | 179.8 | 57 | 169.6 | 0 | 0 | 0 | 111.4 | Y91 I95 I121 N123 Q127 | Y91-I129 HydrophobicContact CD1-CB 4.21Å; Y91-I129 HydrophobicContact CD1-CD1 4.35Å; Y91-I129 HydrophobicContact CD1-CG2 3.73Å; Y91-I129 HydrophobicContact CE1-CB 4.29Å; Y91-I129 HydrophobicContact CE1-CD1 4.47Å; Y91-I129 HydrophobicContact CE1-CG2 3.34Å; I95-I129 HydrophobicContact CD1-CD1 3.8Å; I121-I129 HydrophobicContact CB-CG1 4.43Å; I121-I129 HydrophobicContact CG2-CD1 4.11Å; I121-I129 HydrophobicContact CG2-CG1 4.02Å; I121-I129 VanDerWaalsContact O-CG1 3.22Å; I121-I129 WeakPolarHBondContact O-CG1 3.33Å; I121-I129 PolarHBondContact O-N 2.82Å; N123-I129 HydrophobicContact CB-CG2 4.2Å; Q127-I129 PolarHBondContact O-N 2.98Å |
| 130 | Y | 96.5 | Very high | 79.7 | Confident | 6 Ų | 6 | 64 Ų | 64 | 2% | 0.024 | 35% | 0.349 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.7 | 169.1 | 174.4 | -50.7 | -76.7 | 0 | 0 | 0 | 111.3 | G88 L92 I121 K128 I154 K155 D156 V162 | G88-Y130 WeakPolarHBondContact O-CE1 3.34Å; G88-Y130 PolarHBondContact O-OH 2.83Å; L92-Y130 HydrophobicContact CD2-CE2 3.89Å; L92-Y130 HydrophobicContact CG-CE2 4.39Å; I121-Y130 HydrophobicContact CB-CD2 4.43Å; I121-Y130 HydrophobicContact CG2-CD2 4.17Å; I121-Y130 PolarHBondContact N-O 2.82Å; I121-Y130 PolarHBondContact O-N 3.31Å; I121-Y130 VanDerWaalsContact O-N 3.14Å; K128-Y130 WeakPolarHBondContact CG-O 3.33Å; Y130-I154 HydrophobicContact CD1-CG2 4.38Å; Y130-I154 HydrophobicContact CG-CG2 4Å; Y130-K155 CarbonylContact C-O 3.43Å; Y130-K155 VanDerWaalsContact CA-O 3.25Å; Y130-K155 WeakPolarHBondContact CA-O 3.38Å; Y130-K155 WeakPolarHBondContact CB-O 3.17Å; Y130-D156 HydrophobicContact CD1-CB 4.26Å; Y130-D156 HydrophobicContact CE1-CB 4.39Å; Y130-V162 HydrophobicContact CD1-CG2 3.81Å; Y130-V162 HydrophobicContact CE1-CG2 3.87Å |
| 131 | K | 95.1 | Very high | 77.7 | Confident | 82 Ų | 82 | 66.6 Ų | 66.6 | 36% | 0.357 | 36% | 0.358 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.5 | 135.5 | 166.7 | 62.3 | -173.4 | 179.2 | -177.5 | 0 | 109.5 | Y119 I154 K155 D159 | Y119-K131 WeakPolarHBondContact O-CA 3.32Å; K131-I154 CarbonylContact O-C 3.51Å; K131-I154 WeakPolarHBondContact O-CA 3.21Å; K131-K155 HydrophobicContact CG-CB 3.92Å; K131-K155 PolarHBondContact N-O 2.96Å; K131-K155 PolarHBondContact O-N 3.06Å; K131-D159 WeakPolarHBondContact CE-OD1 3.42Å; K131-D159 IonicContact NZ-OD1 3.97Å; K131-D159 PolarHBondContact NZ-OD1 3.31Å |
| 132 | A | 92.7 | Very high | 75.1 | Confident | 3 Ų | 3 | 74.6 Ų | 74.6 | 3% | 0.025 | 40% | 0.4 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.4 | 138.5 | 173 | 0 | 0 | 0 | 0 | 0 | 109.6 | Q118 Y119 I121 M152 K153 I154 F288 | Q118-A132 WeakPolarHBondContact CA-O 3.41Å; Y119-A132 HydrophobicContact CD2-CB 4.43Å; Y119-A132 PolarHBondContact N-O 2.8Å; Y119-A132 PolarHBondContact O-N 2.83Å; I121-A132 HydrophobicContact CD1-CB 4.33Å; A132-M152 HydrophobicContact CB-CG 4.2Å; A132-M152 HydrophobicContact CB-SD 3.82Å; A132-K153 WeakPolarHBondContact CA-O 3.42Å; A132-I154 HydrophobicContact CB-CG1 3.94Å; A132-F288 HydrophobicContact CB-CE1 4.41Å; A132-F288 HydrophobicContact CB-CE2 4.29Å; A132-F288 HydrophobicContact CB-CZ 3.72Å |
| 133 | K | 88.3 | Confident | 72.6 | Confident | 102 Ų | 102 | 78.1 Ų | 78.1 | 44% | 0.443 | 43% | 0.429 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.6 | 127.6 | 173.7 | -178.1 | 164.8 | -177.9 | 161.6 | 0 | 109.4 | Q118 K153 | Q118-K133 HydrophobicContact CG-CB 4.31Å; Q118-K133 HydrophobicContact CG-CD 4.08Å; Q118-K133 HydrophobicContact CG-CG 3.94Å; K133-K153 PolarHBondContact N-O 3.23Å; K133-K153 PolarHBondContact O-N 3.38Å |
| 134 | E | 81.3 | Confident | 70.4 | Confident | 0 Ų | 0 | 80.3 Ų | 80.3 | 0% | 0 | 44% | 0.444 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.2 | 138 | 170.9 | -178.6 | 163 | -134.4 | 0 | 0 | 110.8 | N116 N117 R148 F150 M152 | N116-E134 WeakPolarHBondContact CB-O 3.45Å; N116-E134 PolarHBondContact ND2-O 2.8Å; N117-E134 HydrophobicContact CB-CB 4.2Å; N117-E134 WeakPolarHBondContact CB-OE2 3.34Å; N117-E134 PolarHBondContact ND2-OE2 3.41Å; N117-E134 PolarHBondContact O-N 3.49Å; E134-R148 IonicContact OE1-CZ 2.65Å; E134-R148 IonicContact OE1-NH1 2.8Å; E134-R148 PolarHBondContact OE1-NH1 2.59Å; E134-R148 IonicContact OE1-NH2 3.26Å; E134-R148 PolarHBondContact OE1-NH2 2.77Å; E134-R148 IonicContact OE2-NH1 2.89Å; E134-R148 IonicContact OE2-NH2 3.71Å; E134-R148 PolarHBondContact OE2-NH2 2.82Å; E134-F150 WeakPolarHBondContact OE1-CD2 3.3Å; E134-M152 HydrophobicContact CB-CE 4.07Å |
| 135 | K | 74.3 | Confident | 69.1 | Low | 127 Ų | 127 | 78.9 Ų | 78.9 | 55% | 0.552 | 44% | 0.438 | S | S | * | . | trans | -96.6 | 122.3 | 171.3 | -173.5 | -173.1 | 176.1 | -165.2 | 0 | 108.6 | D151 | K135-D151 PolarHBondContact N-O 3.31Š| ||
| 136 | N | 60.9 | Low | 67.4 | Low | 49 Ų | 49 | 73.9 Ų | 73.9 | 26% | 0.262 | 42% | 0.415 | S | S | . | . | trans | -104.4 | 137.4 | 172.3 | -76.3 | -31.4 | 0 | 0 | 0 | 112.8 | N116 | N116-N136 WeakPolarHBondContact OD1-CB 3.17Å; N116-N136 PolarHBondContact OD1-ND2 3.48Å | ||
| 137 | D | 47.3 | Very low | 65.9 | Low | 141 Ų | 141 | 73.8 Ų | 73.8 | 75% | 0.754 | 40% | 0.404 | S | S | * | . | trans | -85.7 | 130.3 | 156.1 | -108.6 | -33.1 | 0 | 0 | 0 | 108.2 | C139 | D137-C139 PolarHBondContact O-N 2.86Š| ||
| 138 | C | 40.7 | Very low | 64.7 | Low | 137 Ų | 137 | 69.5 Ų | 69.5 | 93% | 0.926 | 38% | 0.384 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.1 | -4.7 | -166.5 | -171 | 0 | 0 | 0 | 0 | 115.5 | ||
| 139 | C | 45.1 | Very low | 63.6 | Low | 119 Ų | 119 | 67.3 Ų | 67.3 | 80% | 0.804 | 38% | 0.38 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -121.7 | 14.3 | -161.1 | -133.7 | 0 | 0 | 0 | 0 | 118.2 | D137 | D137-C139 PolarHBondContact O-N 2.86Š|
| 140 | T | 44.3 | Very low | 62.7 | Low | 53 Ų | 53 | 66.9 Ų | 66.9 | 33% | 0.325 | 38% | 0.378 | S | S | . | . | trans | -139.7 | 28.5 | -176.8 | 44.7 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 141 | R | 49 | Very low | 62.2 | Low | 91 Ų | 91 | 67.9 Ų | 67.9 | 34% | 0.343 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -79.2 | -33.7 | 169.4 | -158.9 | 127.8 | 175.1 | -171 | -3.7 | 112.2 | E114 | E114-R141 IonicContact OE1-CZ 2.62Å; E114-R141 IonicContact OE1-NE 3.01Å; E114-R141 PolarHBondContact OE1-NE 3.47Å; E114-R141 IonicContact OE1-NH1 3.12Å; E114-R141 IonicContact OE1-NH2 2.6Å; E114-R141 PolarHBondContact OE1-NH2 3.29Å; E114-R141 WeakPolarHBondContact OE2-CD 3.32Å; E114-R141 WeakPolarHBondContact OE2-CG 3.25Å; E114-R141 IonicContact OE2-CZ 2.71Å; E114-R141 VanDerWaalsContact OE2-CZ 3.26Å; E114-R141 IonicContact OE2-NE 2.98Å; E114-R141 PolarHBondContact OE2-NE 3.31Å; E114-R141 IonicContact OE2-NH1 3.9Å; E114-R141 IonicContact OE2-NH2 3.86Å |
| 142 | N | 40 | Very low | 62 | Low | 167 Ų | 167 | 64 Ų | 64 | 89% | 0.893 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -87.5 | -11.7 | -175.2 | -110.7 | -41.8 | 0 | 0 | 0 | 116.4 | ||
| 143 | C | 40.7 | Very low | 62.1 | Low | 114 Ų | 114 | 66.9 Ų | 66.9 | 77% | 0.77 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -114.4 | -12.3 | -176.8 | -77.2 | 0 | 0 | 0 | 0 | 114.9 | ||
| 144 | C | 45 | Very low | 62.5 | Low | 49 Ų | 49 | 62 Ų | 62 | 33% | 0.331 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -144.8 | -10.7 | -162.1 | -84.6 | 0 | 0 | 0 | 0 | 116.9 | S146 L147 | C144-S146 PolarHBondContact O-N 3.32Å; C144-S146 VanDerWaalsContact O-N 3.14Å; C144-L147 HydrophobicContact CB-CB 3.9Å; C144-L147 HydrophobicContact CB-CD1 4.36Å; C144-L147 WeakPolarHBondContact O-CA 3.16Å; C144-L147 WeakPolarHBondContact O-CB 3.45Å; C144-L147 WeakPolarHBondContact O-CD1 3.49Å; C144-L147 WeakPolarHBondContact O-CG 3.33Å; C144-L147 PolarHBondContact O-N 3.37Å |
| 145 | G | 58.4 | Low | 63.2 | Low | 31 Ų | 31 | 64.7 Ų | 64.7 | 32% | 0.32 | 37% | 0.369 | S | S | . | . | G | 310 helix | trans | 43.9 | -121.9 | 178 | 0 | 0 | 0 | 0 | 0 | 113.4 | L147 | G145-L147 PolarHBondContact O-N 3.28Š|
| 146 | S | 52.5 | Low | 64.1 | Low | 29 Ų | 29 | 59.2 Ų | 59.2 | 20% | 0.203 | 35% | 0.346 | C | S | . | . | G | 310 helix | trans | -67.3 | 1.5 | 177.7 | 66.1 | 0 | 0 | 0 | 0 | 116.4 | C144 R167 F292 K297 | C144-S146 PolarHBondContact O-N 3.32Å; C144-S146 VanDerWaalsContact O-N 3.14Å; S146-R167 PolarHBondContact O-NH2 3.13Å; S146-F292 WeakPolarHBondContact O-CE1 3.26Å; S146-K297 WeakPolarHBondContact OG-CE 3.48Å; S146-K297 PolarHBondContact OG-NZ 2.98Å |
| 147 | L | 54 | Low | 65.5 | Low | 37 Ų | 37 | 62 Ų | 62 | 19% | 0.194 | 36% | 0.36 | C | S | . | . | G | 310 helix | trans | -87.2 | -7.5 | -178.3 | -55 | 164.8 | 0 | 0 | 0 | 112.9 | C144 G145 F169 V172 | C144-L147 HydrophobicContact CB-CB 3.9Å; C144-L147 HydrophobicContact CB-CD1 4.36Å; C144-L147 WeakPolarHBondContact O-CA 3.16Å; C144-L147 WeakPolarHBondContact O-CB 3.45Å; C144-L147 WeakPolarHBondContact O-CD1 3.49Å; C144-L147 WeakPolarHBondContact O-CG 3.33Å; C144-L147 PolarHBondContact O-N 3.37Å; G145-L147 PolarHBondContact O-N 3.28Å; L147-F169 WeakPolarHBondContact O-CD1 3.26Å; L147-V172 HydrophobicContact CD1-CB 4.23Å; L147-V172 HydrophobicContact CD1-CG1 3.74Å; L147-V172 HydrophobicContact CD1-CG2 3.52Å; L147-V172 HydrophobicContact CD2-CB 4.14Å; L147-V172 HydrophobicContact CD2-CG1 3.59Å; L147-V172 HydrophobicContact CD2-CG2 4.03Å; L147-V172 HydrophobicContact CG-CG1 4.16Å; L147-V172 HydrophobicContact CG-CG2 4.41Å |
| 148 | R | 64.3 | Low | 67.6 | Low | 18 Ų | 18 | 62 Ų | 62 | 7% | 0.068 | 36% | 0.358 | C | S | . | . | S | Bend | trans | -66.1 | 146 | 176.8 | 66.5 | -168.8 | -176.6 | 84.1 | 0.7 | 111.6 | E134 R167 F292 E296 | E134-R148 IonicContact OE1-CZ 2.65Å; E134-R148 IonicContact OE1-NH1 2.8Å; E134-R148 PolarHBondContact OE1-NH1 2.59Å; E134-R148 IonicContact OE1-NH2 3.26Å; E134-R148 PolarHBondContact OE1-NH2 2.77Å; E134-R148 IonicContact OE2-NH1 2.89Å; E134-R148 IonicContact OE2-NH2 3.71Å; E134-R148 PolarHBondContact OE2-NH2 2.82Å; R148-R167 PolarHBondContact O-NH1 2.83Å; R148-F292 HydrophobicContact CG-CE2 4.03Å; R148-F292 HydrophobicContact CG-CZ 3.98Å; R148-E296 IonicContact CZ-OE2 2.87Å; R148-E296 IonicContact NH2-OE1 2.94Å; R148-E296 PolarHBondContact NH2-OE1 3.15Å; R148-E296 VanDerWaalsContact NH2-OE1 3.12Å; R148-E296 IonicContact NH2-OE2 2.62Å; R148-E296 PolarHBondContact NH2-OE2 2.95Å |
| 149 | S | 69.7 | Low | 70 | Confident | 45 Ų | 45 | 59.3 Ų | 59.3 | 32% | 0.315 | 33% | 0.334 | S | S | . | . | trans | -58.4 | 142.2 | 161.7 | 53.9 | 0 | 0 | 0 | 0 | 109.3 | R167 F169 | S149-R167 WeakPolarHBondContact CA-O 3.48Å; S149-F169 VanDerWaalsContact N-CE1 3.32Å; S149-F169 WeakPolarHBondContact OG-CE2 3.49Å; S149-F169 VanDerWaalsContact OG-CZ 3.24Å; S149-F169 WeakPolarHBondContact OG-CZ 3.41Å | ||
| 150 | F | 76.9 | Confident | 72.3 | Confident | 5 Ų | 5 | 60 Ų | 60 | 2% | 0.022 | 32% | 0.32 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.4 | 121.3 | 176 | 168.3 | -85 | 0 | 0 | 0 | 108.1 | E134 M152 L165 R167 M183 F288 F292 | E134-F150 WeakPolarHBondContact OE1-CD2 3.3Å; F150-M152 HydrophobicContact CD1-CB 4.42Å; F150-M152 HydrophobicContact CE1-CB 3.61Å; F150-M152 HydrophobicContact CE1-SD 4.49Å; F150-M152 HydrophobicContact CE2-CB 4.26Å; F150-M152 HydrophobicContact CE2-CE 3.57Å; F150-M152 HydrophobicContact CE2-SD 4.49Å; F150-M152 HydrophobicContact CZ-CB 3.53Å; F150-M152 HydrophobicContact CZ-CE 3.38Å; F150-M152 HydrophobicContact CZ-CG 4.22Å; F150-M152 HydrophobicContact CZ-SD 3.71Å; F150-L165 HydrophobicContact CE1-CB 4Å; F150-L165 HydrophobicContact CE1-CD1 4.29Å; F150-R167 HydrophobicContact CB-CB 4.03Å; F150-R167 PolarHBondContact N-O 3.4Å; F150-R167 PolarHBondContact O-N 2.91Å; F150-M183 HydrophobicContact CD1-SD 4.3Å; F150-M183 HydrophobicContact CE1-SD 4.11Å; F150-F288 HydrophobicContact CZ-CB 4.07Å; F150-F292 HydrophobicContact CB-CE2 4.31Å; F150-F292 AromaticContact CD2-CD2 3.81Å; F150-F292 HydrophobicContact CD2-CD2 3.81Å; F150-F292 HydrophobicContact CD2-CE2 4.23Å; F150-F292 HydrophobicContact CD2-CG 4.48Å; F150-F292 HydrophobicContact CE2-CD2 4.42Å; F150-F292 HydrophobicContact CG-CD2 4.47Å |
| 151 | D | 86.7 | Confident | 74.7 | Confident | 27 Ų | 27 | 60 Ų | 60 | 14% | 0.144 | 32% | 0.316 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.5 | 108.3 | 176.9 | -174.7 | -7.3 | 0 | 0 | 0 | 107.6 | K135 R164 L165 | K135-D151 PolarHBondContact N-O 3.31Å; D151-R164 IonicContact OD1-CZ 3.88Å; D151-R164 IonicContact OD1-NE 3.69Å; D151-R164 PolarHBondContact OD1-NE 2.94Å; D151-R164 IonicContact OD1-NH2 3.79Å; D151-R164 IonicContact OD2-CZ 2.71Å; D151-R164 IonicContact OD2-NE 2.71Å; D151-R164 IonicContact OD2-NH2 3.55Å; D151-R164 PolarHBondContact OD2-NH2 3.12Å; D151-L165 WeakPolarHBondContact CA-O 3.32Å |
| 152 | M | 90.6 | Very high | 77 | Confident | 0 Ų | 0 | 55.9 Ų | 55.9 | 0% | 0 | 30% | 0.301 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.6 | 132.7 | -177.7 | -178.5 | 175.9 | -76.2 | 0 | 0 | 110.4 | Y119 A132 E134 F150 L165 F288 | Y119-M152 HydrophobicContact CD2-CE 3.98Å; Y119-M152 HydrophobicContact CE2-CE 3.59Å; A132-M152 HydrophobicContact CB-CG 4.2Å; A132-M152 HydrophobicContact CB-SD 3.82Å; E134-M152 HydrophobicContact CB-CE 4.07Å; F150-M152 HydrophobicContact CD1-CB 4.42Å; F150-M152 HydrophobicContact CE1-CB 3.61Å; F150-M152 HydrophobicContact CE1-SD 4.49Å; F150-M152 HydrophobicContact CE2-CB 4.26Å; F150-M152 HydrophobicContact CE2-CE 3.57Å; F150-M152 HydrophobicContact CE2-SD 4.49Å; F150-M152 HydrophobicContact CZ-CB 3.53Å; F150-M152 HydrophobicContact CZ-CE 3.38Å; F150-M152 HydrophobicContact CZ-CG 4.22Å; F150-M152 HydrophobicContact CZ-SD 3.71Å; M152-L165 HydrophobicContact CB-CB 4.23Å; M152-L165 HydrophobicContact CB-CD1 4.4Å; M152-L165 PolarHBondContact N-O 2.88Å; M152-L165 PolarHBondContact O-N 2.89Å; M152-L165 HydrophobicContact SD-CD1 4.26Å; M152-F288 HydrophobicContact CE-CD1 3.85Å; M152-F288 HydrophobicContact CE-CE1 4.01Å; M152-F288 HydrophobicContact CE-CG 4.47Å; M152-F288 HydrophobicContact SD-CB 4.5Å; M152-F288 HydrophobicContact SD-CD1 3.55Å; M152-F288 VanDerWaalsContact SD-CD1 3.55Å; M152-F288 HydrophobicContact SD-CD2 3.95Å; M152-F288 HydrophobicContact SD-CE1 3.58Å; M152-F288 VanDerWaalsContact SD-CE1 3.58Å; M152-F288 HydrophobicContact SD-CE2 3.97Å; M152-F288 HydrophobicContact SD-CG 3.74Å; M152-F288 HydrophobicContact SD-CZ 3.79Å |
| 153 | K | 94.3 | Very high | 79.8 | Confident | 64 Ų | 64 | 47.9 Ų | 47.9 | 28% | 0.278 | 26% | 0.258 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.8 | 124.4 | 178.8 | -64.9 | 173.4 | 173.4 | -112.6 | 0 | 109 | A132 K133 E161 | A132-K153 WeakPolarHBondContact CA-O 3.42Å; K133-K153 PolarHBondContact N-O 3.23Å; K133-K153 PolarHBondContact O-N 3.38Å; K153-E161 HydrophobicContact CB-CG 4.3Å; K153-E161 WeakPolarHBondContact CD-OE2 3.47Å; K153-E161 HydrophobicContact CG-CG 4.44Å; K153-E161 IonicContact NZ-OE1 2.77Å; K153-E161 IonicContact NZ-OE2 3.95Å; K153-E161 PolarHBondContact NZ-OE2 3.04Å |
| 154 | I | 96 | Very high | 82.4 | Confident | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 24% | 0.235 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -104.2 | 124.5 | 170.6 | -57.5 | 173.7 | 0 | 0 | 0 | 107.6 | I121 Y130 K131 A132 V162 I163 L165 F288 | I121-I154 HydrophobicContact CD1-CD1 4.1Å; I121-I154 HydrophobicContact CD1-CG1 4.33Å; I121-I154 HydrophobicContact CD1-CG2 3.86Å; Y130-I154 HydrophobicContact CD1-CG2 4.38Å; Y130-I154 HydrophobicContact CG-CG2 4Å; K131-I154 CarbonylContact O-C 3.51Å; K131-I154 WeakPolarHBondContact O-CA 3.21Å; A132-I154 HydrophobicContact CB-CG1 3.94Å; I154-V162 HydrophobicContact CG2-CG2 4.28Å; I154-V162 WeakPolarHBondContact O-CG2 2.95Å; I154-V162 PolarHBondContact O-N 3.33Å; I154-I163 HydrophobicContact CB-CB 4.03Å; I154-I163 HydrophobicContact CD1-CB 4.19Å; I154-I163 HydrophobicContact CD1-CG2 4.14Å; I154-I163 PolarHBondContact N-O 3.14Å; I154-I163 PolarHBondContact O-N 2.92Å; I154-L165 HydrophobicContact CD1-CD1 4.17Å; I154-L165 HydrophobicContact CD1-CG 4.35Å; I154-F288 HydrophobicContact CD1-CE2 4.14Å |
| 155 | K | 95.5 | Very high | 84.8 | Confident | 56 Ų | 56 | 43.6 Ų | 43.6 | 24% | 0.243 | 22% | 0.219 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -118.8 | 147.6 | -177 | -59.9 | -174.7 | 170.2 | -158.7 | 0 | 111.7 | Y130 K131 D159 R160 E161 | Y130-K155 CarbonylContact C-O 3.43Å; Y130-K155 VanDerWaalsContact CA-O 3.25Å; Y130-K155 WeakPolarHBondContact CA-O 3.38Å; Y130-K155 WeakPolarHBondContact CB-O 3.17Å; K131-K155 HydrophobicContact CG-CB 3.92Å; K131-K155 PolarHBondContact N-O 2.96Å; K131-K155 PolarHBondContact O-N 3.06Å; K155-D159 WeakPolarHBondContact CD-OD1 3.07Å; K155-D159 IonicContact NZ-OD1 3.02Å; K155-D159 PolarHBondContact NZ-OD1 2.88Å; K155-D159 IonicContact NZ-OD2 3.55Å; K155-D159 PolarHBondContact NZ-OD2 2.84Å; K155-R160 CarbonylContact C-O 3.59Å; K155-R160 WeakPolarHBondContact CA-O 3.34Å; K155-R160 WeakPolarHBondContact CB-O 3.24Å; K155-E161 HydrophobicContact CG-CB 4.48Å |
| 156 | D | 93.9 | Very high | 86.4 | Confident | 12 Ų | 12 | 44.1 Ų | 44.1 | 6% | 0.064 | 21% | 0.214 | C | C | . | . | trans | -74.3 | 179.4 | 171.1 | 72.7 | 8.6 | 0 | 0 | 0 | 112.5 | Y130 M158 D159 R160 V162 | Y130-D156 HydrophobicContact CD1-CB 4.26Å; Y130-D156 HydrophobicContact CE1-CB 4.39Å; D156-M158 PolarHBondContact O-N 3.09Å; D156-M158 VanDerWaalsContact OD1-C 3.3Å; D156-M158 VanDerWaalsContact OD1-CA 3.29Å; D156-M158 WeakPolarHBondContact OD1-CA 3.45Å; D156-M158 WeakPolarHBondContact OD1-CB 3.38Å; D156-M158 PolarHBondContact OD1-N 2.8Å; D156-D159 PolarHBondContact O-N 2.84Å; D156-D159 PolarHBondContact OD1-N 2.93Å; D156-D159 VanDerWaalsContact OD1-N 3.15Å; D156-R160 PolarHBondContact N-O 2.94Å; D156-R160 WeakPolarHBondContact OD1-CB 3.37Å; D156-R160 PolarHBondContact OD1-N 3.07Å; D156-R160 IonicContact OD1-NE 3.23Å; D156-R160 IonicContact OD2-CZ 2.74Å; D156-R160 VanDerWaalsContact OD2-CZ 3.23Å; D156-R160 IonicContact OD2-NE 3.83Å; D156-R160 PolarHBondContact OD2-NE 3.27Å; D156-R160 IonicContact OD2-NH2 2.82Å; D156-R160 PolarHBondContact OD2-NH2 2.99Å; D156-V162 HydrophobicContact CB-CG1 3.96Å | ||
| 157 | N | 90.3 | Very high | 88.1 | Confident | 107 Ų | 107 | 42.9 Ų | 42.9 | 57% | 0.572 | 21% | 0.205 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -66.5 | -14.4 | 177.9 | -74.5 | -34 | 0 | 0 | 0 | 113.6 | K128 D159 | K128-N157 WeakPolarHBondContact CE-OD1 3.36Å; K128-N157 PolarHBondContact O-ND2 3.13Å; N157-D159 VanDerWaalsContact C-N 3.33Å |
| 158 | M | 91.6 | Very high | 89.1 | Confident | 142 Ų | 142 | 44.2 Ų | 44.2 | 70% | 0.7 | 22% | 0.216 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -92.7 | 9.8 | 173.4 | -60.4 | -178.1 | 68.2 | 0 | 0 | 112.7 | D156 R160 | D156-M158 PolarHBondContact O-N 3.09Å; D156-M158 VanDerWaalsContact OD1-C 3.3Å; D156-M158 VanDerWaalsContact OD1-CA 3.29Å; D156-M158 WeakPolarHBondContact OD1-CA 3.45Å; D156-M158 WeakPolarHBondContact OD1-CB 3.38Å; D156-M158 PolarHBondContact OD1-N 2.8Å; M158-R160 HydrophobicContact CB-CG 4.18Å; M158-R160 PolarHBondContact O-N 3.41Å |
| 159 | D | 91.8 | Very high | 89.1 | Confident | 79 Ų | 79 | 50.1 Ų | 50.1 | 42% | 0.422 | 24% | 0.242 | S | C | . | . | S | Bend | trans | 63.6 | 16.9 | -175.9 | -159.4 | 54.4 | 0 | 0 | 0 | 114.9 | K131 K155 D156 N157 | K131-D159 WeakPolarHBondContact CE-OD1 3.42Å; K131-D159 IonicContact NZ-OD1 3.97Å; K131-D159 PolarHBondContact NZ-OD1 3.31Å; K155-D159 WeakPolarHBondContact CD-OD1 3.07Å; K155-D159 IonicContact NZ-OD1 3.02Å; K155-D159 PolarHBondContact NZ-OD1 2.88Å; K155-D159 IonicContact NZ-OD2 3.55Å; K155-D159 PolarHBondContact NZ-OD2 2.84Å; D156-D159 PolarHBondContact O-N 2.84Å; D156-D159 PolarHBondContact OD1-N 2.93Å; D156-D159 VanDerWaalsContact OD1-N 3.15Å; N157-D159 VanDerWaalsContact C-N 3.33Å |
| 160 | R | 93.4 | Very high | 88.8 | Confident | 134 Ų | 134 | 51.7 Ų | 51.7 | 51% | 0.506 | 24% | 0.241 | S | C | . | . | trans | -81.3 | 134.1 | 173.8 | -57.4 | -178.1 | -60.9 | 173.1 | 4.1 | 109.3 | K155 D156 M158 V162 | K155-R160 CarbonylContact C-O 3.59Å; K155-R160 WeakPolarHBondContact CA-O 3.34Å; K155-R160 WeakPolarHBondContact CB-O 3.24Å; D156-R160 PolarHBondContact N-O 2.94Å; D156-R160 WeakPolarHBondContact OD1-CB 3.37Å; D156-R160 PolarHBondContact OD1-N 3.07Å; D156-R160 IonicContact OD1-NE 3.23Å; D156-R160 IonicContact OD2-CZ 2.74Å; D156-R160 VanDerWaalsContact OD2-CZ 3.23Å; D156-R160 IonicContact OD2-NE 3.83Å; D156-R160 PolarHBondContact OD2-NE 3.27Å; D156-R160 IonicContact OD2-NH2 2.82Å; D156-R160 PolarHBondContact OD2-NH2 2.99Å; M158-R160 HydrophobicContact CB-CG 4.18Å; M158-R160 PolarHBondContact O-N 3.41Å; R160-V162 PolarHBondContact O-N 3.46Å | ||
| 161 | E | 95.1 | Very high | 87.4 | Confident | 52 Ų | 52 | 56 Ų | 56 | 24% | 0.243 | 27% | 0.271 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.4 | 116.7 | 175.2 | -166.1 | 179.7 | 142.8 | 0 | 0 | 109.4 | K153 K155 R164 P189 | K153-E161 HydrophobicContact CB-CG 4.3Å; K153-E161 WeakPolarHBondContact CD-OE2 3.47Å; K153-E161 HydrophobicContact CG-CG 4.44Å; K153-E161 IonicContact NZ-OE1 2.77Å; K153-E161 IonicContact NZ-OE2 3.95Å; K153-E161 PolarHBondContact NZ-OE2 3.04Å; K155-E161 HydrophobicContact CG-CB 4.48Å; E161-R164 WeakPolarHBondContact OE1-CD 3.49Å; E161-P189 HydrophobicContact CB-CG 4Å; E161-P189 HydrophobicContact CG-CG 3.53Å; E161-P189 WeakPolarHBondContact O-CD 3.45Å; E161-P189 WeakPolarHBondContact OE1-CG 3.15Å |
| 162 | V | 96.7 | Very high | 85.5 | Confident | 5 Ų | 5 | 59.4 Ų | 59.4 | 3% | 0.03 | 29% | 0.293 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.3 | -35 | -174.9 | -65.5 | 0 | 0 | 0 | 0 | 112.1 | L89 Y130 I154 D156 R160 | L89-V162 HydrophobicContact CD1-CB 4.03Å; Y130-V162 HydrophobicContact CD1-CG2 3.81Å; Y130-V162 HydrophobicContact CE1-CG2 3.87Å; I154-V162 HydrophobicContact CG2-CG2 4.28Å; I154-V162 WeakPolarHBondContact O-CG2 2.95Å; I154-V162 PolarHBondContact O-N 3.33Å; D156-V162 HydrophobicContact CB-CG1 3.96Å; R160-V162 PolarHBondContact O-N 3.46Å |
| 163 | I | 97.4 | Very high | 83.2 | Confident | 0 Ų | 0 | 64 Ų | 64 | 0% | 0 | 33% | 0.325 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.1 | 138.7 | 176.4 | -58.2 | 163.2 | 0 | 0 | 0 | 108.7 | L89 I154 L165 V185 Q186 A187 A281 M284 | L89-I163 HydrophobicContact CD1-CD1 4.42Å; L89-I163 HydrophobicContact CD1-CG1 4.01Å; L89-I163 HydrophobicContact CD2-CD1 4.29Å; L89-I163 HydrophobicContact CD2-CG1 4.32Å; L89-I163 HydrophobicContact CG-CD1 4.28Å; L89-I163 HydrophobicContact CG-CG1 4.35Å; I154-I163 HydrophobicContact CB-CB 4.03Å; I154-I163 HydrophobicContact CD1-CB 4.19Å; I154-I163 HydrophobicContact CD1-CG2 4.14Å; I154-I163 PolarHBondContact N-O 3.14Å; I154-I163 PolarHBondContact O-N 2.92Å; I163-L165 HydrophobicContact CG2-CD2 3.81Å; I163-L165 HydrophobicContact CG2-CG 4.5Å; I163-V185 HydrophobicContact CG2-CG1 3.78Å; I163-Q186 CarbonylContact C-O 3.59Å; I163-Q186 VanDerWaalsContact CA-O 3.24Å; I163-Q186 WeakPolarHBondContact CA-O 3.45Å; I163-A187 HydrophobicContact CG1-CB 4.06Å; I163-A281 HydrophobicContact CD1-CB 3.78Å; I163-A281 HydrophobicContact CG1-CB 4.43Å; I163-M284 HydrophobicContact CD1-CE 3.35Å |
| 164 | R | 96.3 | Very high | 80.8 | Confident | 73 Ų | 73 | 65.1 Ų | 65.1 | 28% | 0.275 | 34% | 0.339 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.3 | 128.8 | 169.9 | -168.3 | 177.1 | -179.8 | -167.9 | -1.9 | 109.9 | D151 E161 I166 Q186 P189 | D151-R164 IonicContact OD1-CZ 3.88Å; D151-R164 IonicContact OD1-NE 3.69Å; D151-R164 PolarHBondContact OD1-NE 2.94Å; D151-R164 IonicContact OD1-NH2 3.79Å; D151-R164 IonicContact OD2-CZ 2.71Å; D151-R164 IonicContact OD2-NE 2.71Å; D151-R164 IonicContact OD2-NH2 3.55Å; D151-R164 PolarHBondContact OD2-NH2 3.12Å; E161-R164 WeakPolarHBondContact OE1-CD 3.49Å; R164-I166 HydrophobicContact CG-CD1 4.3Å; R164-I166 HydrophobicContact CG-CG1 3.97Å; R164-Q186 HydrophobicContact CB-CB 4.38Å; R164-Q186 PolarHBondContact N-O 2.93Å; R164-Q186 PolarHBondContact O-N 2.71Å; R164-P189 HydrophobicContact CB-CB 4.32Å; R164-P189 HydrophobicContact CB-CG 4.41Å |
| 165 | L | 95.4 | Very high | 78.1 | Confident | 0 Ų | 0 | 77.2 Ų | 77.2 | 0% | 0 | 39% | 0.385 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.2 | 124.6 | 176.8 | -51.8 | -178.6 | 0 | 0 | 0 | 108.4 | F150 D151 M152 I154 I163 M183 V185 F288 | F150-L165 HydrophobicContact CE1-CB 4Å; F150-L165 HydrophobicContact CE1-CD1 4.29Å; D151-L165 WeakPolarHBondContact CA-O 3.32Å; M152-L165 HydrophobicContact CB-CB 4.23Å; M152-L165 HydrophobicContact CB-CD1 4.4Å; M152-L165 PolarHBondContact N-O 2.88Å; M152-L165 PolarHBondContact O-N 2.89Å; M152-L165 HydrophobicContact SD-CD1 4.26Å; I154-L165 HydrophobicContact CD1-CD1 4.17Å; I154-L165 HydrophobicContact CD1-CG 4.35Å; I163-L165 HydrophobicContact CG2-CD2 3.81Å; I163-L165 HydrophobicContact CG2-CG 4.5Å; L165-M183 HydrophobicContact CB-SD 4Å; L165-M183 HydrophobicContact CD1-SD 4.48Å; L165-M183 HydrophobicContact CD2-CE 4.28Å; L165-V185 HydrophobicContact CD2-CB 4.25Å; L165-V185 HydrophobicContact CD2-CG1 3.85Å; L165-V185 HydrophobicContact CD2-CG2 3.78Å; L165-F288 HydrophobicContact CD1-CB 4.04Å; L165-F288 HydrophobicContact CD1-CD2 3.58Å; L165-F288 HydrophobicContact CD1-CE2 4.39Å; L165-F288 HydrophobicContact CD1-CG 4.09Å |
| 166 | I | 92.4 | Very high | 75.5 | Confident | 41 Ų | 41 | 79.1 Ų | 79.1 | 21% | 0.21 | 40% | 0.404 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.3 | 120.8 | -176.2 | -53.3 | 176.7 | 0 | 0 | 0 | 108.9 | R164 M183 E184 | R164-I166 HydrophobicContact CG-CD1 4.3Å; R164-I166 HydrophobicContact CG-CG1 3.97Å; I166-M183 WeakPolarHBondContact O-CA 3.34Å; I166-M183 WeakPolarHBondContact O-CG 3.45Å; I166-E184 HydrophobicContact CB-CB 4.41Å; I166-E184 PolarHBondContact N-O 3.15Å; I166-E184 PolarHBondContact O-N 2.8Å |
| 167 | R | 87.6 | Confident | 73.5 | Confident | 4 Ų | 4 | 82.1 Ų | 82.1 | 2% | 0.015 | 43% | 0.425 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.2 | 119.9 | 170.8 | 169.8 | 172.4 | 168.7 | -80.3 | 0.3 | 109.7 | S146 R148 S149 F150 E182 M183 F292 | S146-R167 PolarHBondContact O-NH2 3.13Å; R148-R167 PolarHBondContact O-NH1 2.83Å; S149-R167 WeakPolarHBondContact CA-O 3.48Å; F150-R167 HydrophobicContact CB-CB 4.03Å; F150-R167 PolarHBondContact N-O 3.4Å; F150-R167 PolarHBondContact O-N 2.91Å; R167-E182 WeakPolarHBondContact CG-O 3.44Å; R167-M183 HydrophobicContact CB-CB 4.41Å; R167-M183 HydrophobicContact CB-CG 4.16Å; R167-F292 VanDerWaalsContact NH1-CE1 3.34Å |
| 168 | P | 74.9 | Confident | 71.6 | Confident | 65 Ų | 65 | 81.3 Ų | 81.3 | 42% | 0.422 | 43% | 0.427 | S | S | . | . | trans | -70.4 | 159.9 | 177.4 | 30.1 | -34.5 | 0 | 0 | 0 | 111.8 | R170 | P168-R170 PolarHBondContact O-N 3.33Š| ||
| 169 | F | 64.8 | Low | 70.2 | Confident | 142 Ų | 142 | 76 Ų | 76 | 62% | 0.623 | 40% | 0.403 | S | S | * | . | trans | -59 | 132.7 | 171.9 | -71.3 | -84.8 | 0 | 0 | 0 | 110.9 | L147 S149 | L147-F169 WeakPolarHBondContact O-CD1 3.26Å; S149-F169 VanDerWaalsContact N-CE1 3.32Å; S149-F169 WeakPolarHBondContact OG-CE2 3.49Å; S149-F169 VanDerWaalsContact OG-CZ 3.24Å; S149-F169 WeakPolarHBondContact OG-CZ 3.41Å | ||
| 170 | R | 62.7 | Low | 69.6 | Low | 77 Ų | 77 | 74.6 Ų | 74.6 | 29% | 0.291 | 40% | 0.395 | S | S | . | . | trans | -131.1 | 143.3 | 175.5 | -65.7 | -108.6 | 176.7 | 153 | -5.7 | 109.9 | P168 L180 E182 | P168-R170 PolarHBondContact O-N 3.33Å; R170-L180 PolarHBondContact NH1-O 3.43Å; R170-E182 IonicContact CZ-OE2 3.36Å; R170-E182 IonicContact NH2-OE2 2.67Å; R170-E182 PolarHBondContact NH2-OE2 2.77Å | ||
| 171 | C | 47.3 | Very low | 69.3 | Low | 96 Ų | 96 | 69.5 Ų | 69.5 | 65% | 0.649 | 38% | 0.377 | S | S | * | . | trans | -81.5 | 164 | -167.5 | -162.2 | 0 | 0 | 0 | 0 | 114.6 | C179 | C171-C179 PolarHBondContact O-SG 3.35Š| ||
| 172 | V | 48 | Very low | 69 | Low | 99 Ų | 99 | 69 Ų | 69 | 60% | 0.6 | 38% | 0.375 | S | S | * | . | trans | -101.6 | -10.1 | -176.8 | -118.2 | 0 | 0 | 0 | 0 | 116.2 | L147 C174 | L147-V172 HydrophobicContact CD1-CB 4.23Å; L147-V172 HydrophobicContact CD1-CG1 3.74Å; L147-V172 HydrophobicContact CD1-CG2 3.52Å; L147-V172 HydrophobicContact CD2-CB 4.14Å; L147-V172 HydrophobicContact CD2-CG1 3.59Å; L147-V172 HydrophobicContact CD2-CG2 4.03Å; L147-V172 HydrophobicContact CG-CG1 4.16Å; L147-V172 HydrophobicContact CG-CG2 4.41Å; V172-C174 PolarHBondContact O-N 2.94Å | ||
| 173 | S | 42.6 | Very low | 68.9 | Low | 96 Ų | 96 | 68.7 Ų | 68.7 | 67% | 0.671 | 37% | 0.373 | S | S | * | . | trans | -76.8 | 91 | -171.8 | -166.3 | 0 | 0 | 0 | 0 | 110.7 | C178 | S173-C178 PolarHBondContact O-SG 2.99Š| ||
| 174 | C | 43.1 | Very low | 68.8 | Low | 87 Ų | 87 | 70.9 Ų | 70.9 | 59% | 0.588 | 38% | 0.383 | S | S | * | . | trans | -106.1 | 105 | -170.4 | -167.6 | 0 | 0 | 0 | 0 | 110.6 | V172 | V172-C174 PolarHBondContact O-N 2.94Š| ||
| 175 | W | 39.8 | Very low | 68.9 | Low | 254 Ų | 254 | 67.4 Ų | 67.4 | 96% | 0.962 | 37% | 0.37 | S | S | * | . | S | Bend | trans | -132.8 | 6.6 | 155 | -113.1 | -78.1 | 0 | 0 | 0 | 112.6 | ||
| 176 | C | 40.9 | Very low | 69 | Low | 96 Ų | 96 | 68.4 Ų | 68.4 | 65% | 0.649 | 38% | 0.375 | S | S | * | . | S | Bend | trans | -167.7 | 172 | 175.9 | -129.1 | 0 | 0 | 0 | 0 | 109.5 | C178 | C176-C178 VanDerWaalsContact C-N 3.26Å; C176-C178 PolarHBondContact O-N 2.82Å; C176-C178 PolarHBondContact O-SG 2.82Å; C176-C178 VanDerWaalsContact O-SG 3.33Å |
| 177 | P | 52 | Low | 69.2 | Low | 76 Ų | 76 | 66.5 Ų | 66.5 | 49% | 0.494 | 37% | 0.365 | S | S | . | . | S | Bend | trans | -73.4 | 38.4 | -154.1 | 34.8 | -39.9 | 0 | 0 | 0 | 117.1 | W200 | P177-W200 HydrophobicContact CB-CG 4.03Š|
| 178 | C | 49.3 | Very low | 69.5 | Low | 90 Ų | 90 | 68.6 Ų | 68.6 | 61% | 0.608 | 38% | 0.379 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.5 | -0.9 | -170.8 | 56.9 | 0 | 0 | 0 | 0 | 116 | S173 C176 | S173-C178 PolarHBondContact O-SG 2.99Å; C176-C178 VanDerWaalsContact C-N 3.26Å; C176-C178 PolarHBondContact O-N 2.82Å; C176-C178 PolarHBondContact O-SG 2.82Å; C176-C178 VanDerWaalsContact O-SG 3.33Å |
| 179 | C | 63.6 | Low | 70.4 | Confident | 31 Ų | 31 | 67.7 Ų | 67.7 | 21% | 0.209 | 37% | 0.374 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -110.3 | 19.2 | -171.7 | -56.6 | 0 | 0 | 0 | 0 | 114.9 | C171 Q181 | C171-C179 PolarHBondContact O-SG 3.35Å; C179-Q181 PolarHBondContact O-N 2.94Å; C179-Q181 PolarHBondContact O-NE2 2.9Å |
| 180 | L | 79.2 | Confident | 71.8 | Confident | 48 Ų | 48 | 63.9 Ų | 63.9 | 25% | 0.251 | 37% | 0.374 | S | S | . | . | trans | -58 | 135.1 | 179.2 | -65.7 | 174.1 | 0 | 0 | 0 | 110.8 | R170 Q198 W200 | R170-L180 PolarHBondContact NH1-O 3.43Å; L180-Q198 HydrophobicContact CB-CB 4.4Å; L180-Q198 HydrophobicContact CD2-CB 4.29Å; L180-Q198 HydrophobicContact CD2-CG 3.97Å; L180-W200 HydrophobicContact CD1-CB 4.08Å; L180-W200 HydrophobicContact CD2-CB 3.98Å | ||
| 181 | Q | 85.4 | Confident | 73.3 | Confident | 27 Ų | 27 | 64 Ų | 64 | 13% | 0.126 | 38% | 0.383 | C | S | . | . | trans | -81.5 | 146.8 | -177.9 | -58.2 | -54.5 | -39.6 | 0 | 0 | 111.7 | C179 Q198 L289 M293 | C179-Q181 PolarHBondContact O-N 2.94Å; C179-Q181 PolarHBondContact O-NE2 2.9Å; Q181-Q198 HydrophobicContact CB-CB 4.26Å; Q181-Q198 VanDerWaalsContact N-OE1 3.09Å; Q181-Q198 WeakPolarHBondContact O-CB 3.22Å; Q181-Q198 PolarHBondContact O-N 2.81Å; Q181-L289 HydrophobicContact CB-CD1 4.32Å; Q181-L289 HydrophobicContact CB-CD2 4.5Å; Q181-M293 HydrophobicContact CB-CE 4.12Å; Q181-M293 HydrophobicContact CB-SD 3.64Å; Q181-M293 HydrophobicContact CG-CE 3.64Å; Q181-M293 HydrophobicContact CG-CG 4.06Å; Q181-M293 HydrophobicContact CG-SD 3.56Å; Q181-M293 VanDerWaalsContact CG-SD 3.56Å | ||
| 182 | E | 90.1 | Very high | 75.7 | Confident | 41 Ų | 41 | 61.7 Ų | 61.7 | 19% | 0.192 | 37% | 0.366 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.5 | 143.2 | 175.7 | 179.1 | 170.8 | 176.2 | 0 | 0 | 109.4 | R167 R170 V196 K197 | R167-E182 WeakPolarHBondContact CG-O 3.44Å; R170-E182 IonicContact CZ-OE2 3.36Å; R170-E182 IonicContact NH2-OE2 2.67Å; R170-E182 PolarHBondContact NH2-OE2 2.77Å; E182-V196 CarbonylContact C-O 3.45Å; E182-V196 VanDerWaalsContact CA-O 3.25Å; E182-V196 WeakPolarHBondContact CA-O 3.12Å; E182-K197 HydrophobicContact CB-CG 4.24Å; E182-K197 HydrophobicContact CG-CG 3.77Å; E182-K197 WeakPolarHBondContact OE1-CE 3.29Å; E182-K197 IonicContact OE1-NZ 3.72Å; E182-K197 WeakPolarHBondContact OE2-CE 3.47Å |
| 183 | M | 93.5 | Very high | 78 | Confident | 0 Ų | 0 | 57.2 Ų | 57.2 | 0% | 0 | 34% | 0.339 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.3 | 130.2 | 176 | -170.2 | -177.2 | 68.3 | 0 | 0 | 110.6 | F150 L165 I166 R167 V185 F195 V196 G285 L289 | F150-M183 HydrophobicContact CD1-SD 4.3Å; F150-M183 HydrophobicContact CE1-SD 4.11Å; L165-M183 HydrophobicContact CB-SD 4Å; L165-M183 HydrophobicContact CD1-SD 4.48Å; L165-M183 HydrophobicContact CD2-CE 4.28Å; I166-M183 WeakPolarHBondContact O-CA 3.34Å; I166-M183 WeakPolarHBondContact O-CG 3.45Å; R167-M183 HydrophobicContact CB-CB 4.41Å; R167-M183 HydrophobicContact CB-CG 4.16Å; M183-V185 HydrophobicContact CE-CG2 4.06Å; M183-F195 CarbonylContact O-C 3.48Å; M183-F195 WeakPolarHBondContact O-CA 3.41Å; M183-V196 HydrophobicContact CE-CG2 4.07Å; M183-V196 PolarHBondContact N-O 3.25Å; M183-V196 PolarHBondContact O-N 3.23Å; M183-G285 WeakPolarHBondContact CE-O 3.44Å; M183-L289 HydrophobicContact CB-CD1 4.46Å; M183-L289 HydrophobicContact CB-CD2 4.06Å; M183-L289 HydrophobicContact CE-CB 4.2Å; M183-L289 HydrophobicContact SD-CB 4.15Å |
| 184 | E | 96.3 | Very high | 80.6 | Confident | 46 Ų | 46 | 52.6 Ų | 52.6 | 22% | 0.215 | 31% | 0.307 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.3 | 138.2 | 173.7 | -175.3 | -173.2 | 166.7 | 0 | 0 | 110.2 | I166 Q186 T192 F195 | I166-E184 HydrophobicContact CB-CB 4.41Å; I166-E184 PolarHBondContact N-O 3.15Å; I166-E184 PolarHBondContact O-N 2.8Å; E184-Q186 HydrophobicContact CG-CG 4.22Å; E184-Q186 WeakPolarHBondContact OE1-CG 3.5Å; E184-Q186 PolarHBondContact OE1-NE2 2.8Å; E184-T192 HydrophobicContact CG-CG2 3.67Å; E184-T192 PolarHBondContact OE1-OG1 3.01Å; E184-F195 HydrophobicContact CB-CD1 3.96Å; E184-F195 HydrophobicContact CB-CE1 3.86Å; E184-F195 HydrophobicContact CG-CD1 4.11Å; E184-F195 HydrophobicContact CG-CE1 3.66Å; E184-F195 HydrophobicContact CG-CZ 4.36Å |
| 185 | V | 97.7 | Very high | 83.2 | Confident | 0 Ų | 0 | 50.3 Ų | 50.3 | 0% | 0 | 29% | 0.287 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.8 | 121.7 | 174.9 | -175.8 | 0 | 0 | 0 | 0 | 109 | I163 L165 M183 V193 G194 A281 V282 | I163-V185 HydrophobicContact CG2-CG1 3.78Å; L165-V185 HydrophobicContact CD2-CB 4.25Å; L165-V185 HydrophobicContact CD2-CG1 3.85Å; L165-V185 HydrophobicContact CD2-CG2 3.78Å; M183-V185 HydrophobicContact CE-CG2 4.06Å; V185-V193 HydrophobicContact CB-CG2 4.27Å; V185-V193 HydrophobicContact CG1-CG2 3.91Å; V185-V193 VanDerWaalsContact O-CG2 3.29Å; V185-V193 WeakPolarHBondContact O-CG2 3.13Å; V185-V193 PolarHBondContact O-N 2.85Å; V185-G194 PolarHBondContact N-O 2.98Å; V185-G194 PolarHBondContact O-N 2.88Å; V185-A281 HydrophobicContact CG1-CB 4.43Å; V185-V282 HydrophobicContact CB-CG2 4.18Å; V185-V282 HydrophobicContact CG1-CG2 4.46Å; V185-V282 HydrophobicContact CG2-CG1 4.35Å; V185-V282 HydrophobicContact CG2-CG2 4.47Å |
| 186 | Q | 97.6 | Very high | 85.9 | Confident | 20 Ų | 20 | 38.2 Ų | 38.2 | 9% | 0.093 | 24% | 0.242 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -111.9 | 133.1 | 179.3 | -61.1 | 179.6 | -5.7 | 0 | 0 | 110.7 | I163 R164 E184 T191 | I163-Q186 CarbonylContact C-O 3.59Å; I163-Q186 VanDerWaalsContact CA-O 3.24Å; I163-Q186 WeakPolarHBondContact CA-O 3.45Å; R164-Q186 HydrophobicContact CB-CB 4.38Å; R164-Q186 PolarHBondContact N-O 2.93Å; R164-Q186 PolarHBondContact O-N 2.71Å; E184-Q186 HydrophobicContact CG-CG 4.22Å; E184-Q186 WeakPolarHBondContact OE1-CG 3.5Å; E184-Q186 PolarHBondContact OE1-NE2 2.8Å; Q186-T191 CarbonylContact C-O 3.55Å; Q186-T191 WeakPolarHBondContact CA-O 3.32Å |
| 187 | A | 96 | Very high | 88.4 | Confident | 1 Ų | 1 | 36.6 Ų | 36.6 | 1% | 0.008 | 22% | 0.223 | C | C | . | . | S | Bend | trans | -153.4 | 116.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | P86 L89 I163 T191 V193 | P86-A187 HydrophobicContact CB-CB 4.19Å; P86-A187 HydrophobicContact CG-CB 4.44Å; L89-A187 HydrophobicContact CD1-CB 4.15Å; L89-A187 HydrophobicContact CD2-CB 3.79Å; I163-A187 HydrophobicContact CG1-CB 4.06Å; A187-T191 PolarHBondContact N-O 3.02Å; A187-V193 HydrophobicContact CB-CG1 3.9Å; A187-V193 HydrophobicContact CB-CG2 4.08Å; A187-V193 WeakPolarHBondContact O-CG1 3.36Å |
| 188 | P | 94.8 | Very high | 90.3 | Very high | 48 Ų | 48 | 34.9 Ų | 34.9 | 31% | 0.312 | 21% | 0.209 | S | C | . | . | S | Bend | cis | -61 | 169.9 | -13.7 | 30.8 | -36.1 | 0 | 0 | 0 | 111.3 | G190 T191 | P188-G190 PolarHBondContact O-N 2.86Å; P188-T191 PolarHBondContact O-N 2.71Å |
| 189 | P | 94.3 | Very high | 92.2 | Very high | 47 Ų | 47 | 33.3 Ų | 33.3 | 31% | 0.305 | 19% | 0.194 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -50.8 | 132.4 | 176.7 | -27.2 | 35.2 | 0 | 0 | 0 | 112.2 | E161 R164 | E161-P189 HydrophobicContact CB-CG 4Å; E161-P189 HydrophobicContact CG-CG 3.53Å; E161-P189 WeakPolarHBondContact O-CD 3.45Å; E161-P189 WeakPolarHBondContact OE1-CG 3.15Å; R164-P189 HydrophobicContact CB-CB 4.32Å; R164-P189 HydrophobicContact CB-CG 4.41Å |
| 190 | G | 92.9 | Very high | 93.3 | Very high | 61 Ų | 61 | 39.8 Ų | 39.8 | 63% | 0.629 | 22% | 0.215 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 92 | -10.4 | -172.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | P188 | P188-G190 PolarHBondContact O-N 2.86Š|
| 191 | T | 95.5 | Very high | 93.5 | Very high | 80 Ų | 80 | 40.6 Ų | 40.6 | 49% | 0.491 | 22% | 0.217 | S | C | . | . | S | Bend | trans | -115.1 | 108.3 | 173.9 | -56.5 | 0 | 0 | 0 | 0 | 110.2 | Q186 A187 P188 V193 | Q186-T191 CarbonylContact C-O 3.55Å; Q186-T191 WeakPolarHBondContact CA-O 3.32Å; A187-T191 PolarHBondContact N-O 3.02Å; P188-T191 PolarHBondContact O-N 2.71Å; T191-V193 PolarHBondContact O-N 3.03Å |
| 192 | T | 96.9 | Very high | 93 | Very high | 47 Ų | 47 | 42.7 Ų | 42.7 | 29% | 0.288 | 23% | 0.233 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -68.1 | 126 | 178.7 | -45 | 0 | 0 | 0 | 0 | 111 | E184 F195 | E184-T192 HydrophobicContact CG-CG2 3.67Å; E184-T192 PolarHBondContact OE1-OG1 3.01Å; T192-F195 HydrophobicContact CG2-CD2 4.49Å; T192-F195 HydrophobicContact CG2-CE1 4.09Å; T192-F195 HydrophobicContact CG2-CE2 3.76Å; T192-F195 HydrophobicContact CG2-CZ 3.53Å |
| 193 | V | 96.8 | Very high | 92.5 | Very high | 5 Ų | 5 | 47.4 Ų | 47.4 | 3% | 0.03 | 25% | 0.253 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.8 | -16.7 | 176.5 | -66 | 0 | 0 | 0 | 0 | 113.1 | P86 V185 A187 T191 P212 K278 V282 | P86-V193 HydrophobicContact CG-CG1 4.43Å; V185-V193 HydrophobicContact CB-CG2 4.27Å; V185-V193 HydrophobicContact CG1-CG2 3.91Å; V185-V193 VanDerWaalsContact O-CG2 3.29Å; V185-V193 WeakPolarHBondContact O-CG2 3.13Å; V185-V193 PolarHBondContact O-N 2.85Å; A187-V193 HydrophobicContact CB-CG1 3.9Å; A187-V193 HydrophobicContact CB-CG2 4.08Å; A187-V193 WeakPolarHBondContact O-CG1 3.36Å; T191-V193 PolarHBondContact O-N 3.03Å; V193-P212 WeakPolarHBondContact O-CD 3.31Å; V193-K278 HydrophobicContact CB-CB 4.15Å; V193-K278 HydrophobicContact CB-CD 4.37Å; V193-K278 HydrophobicContact CB-CG 4.1Å; V193-K278 HydrophobicContact CG1-CD 4.23Å; V193-K278 HydrophobicContact CG1-CG 4.05Å; V193-V282 HydrophobicContact CG2-CG2 4.33Å |
| 194 | G | 97.1 | Very high | 92 | Very high | 0 Ų | 0 | 49.4 Ų | 49.4 | 0% | 0 | 26% | 0.263 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 169.4 | -177.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | V185 Q210 | V185-G194 PolarHBondContact N-O 2.98Å; V185-G194 PolarHBondContact O-N 2.88Å; G194-Q210 CarbonylContact C-O 3.53Å; G194-Q210 WeakPolarHBondContact CA-O 3.06Å |
| 195 | F | 97.4 | Very high | 91.7 | Very high | 39 Ų | 39 | 47.7 Ų | 47.7 | 17% | 0.171 | 26% | 0.256 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.3 | 148.5 | -177.2 | -57.4 | -92.1 | 0 | 0 | 0 | 110.9 | M183 E184 T192 Q210 | M183-F195 CarbonylContact O-C 3.48Å; M183-F195 WeakPolarHBondContact O-CA 3.41Å; E184-F195 HydrophobicContact CB-CD1 3.96Å; E184-F195 HydrophobicContact CB-CE1 3.86Å; E184-F195 HydrophobicContact CG-CD1 4.11Å; E184-F195 HydrophobicContact CG-CE1 3.66Å; E184-F195 HydrophobicContact CG-CZ 4.36Å; T192-F195 HydrophobicContact CG2-CD2 4.49Å; T192-F195 HydrophobicContact CG2-CE1 4.09Å; T192-F195 HydrophobicContact CG2-CE2 3.76Å; T192-F195 HydrophobicContact CG2-CZ 3.53Å; F195-Q210 HydrophobicContact CB-CB 4.27Å; F195-Q210 PolarHBondContact N-O 3.27Å; F195-Q210 PolarHBondContact O-N 3.11Å |
| 196 | V | 96.8 | Very high | 91.4 | Very high | 0 Ų | 0 | 50.2 Ų | 50.2 | 0% | 0 | 27% | 0.267 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.5 | 119.7 | 166.1 | -173.9 | 0 | 0 | 0 | 0 | 107.1 | E182 M183 F207 I209 V282 A286 L289 | E182-V196 CarbonylContact C-O 3.45Å; E182-V196 VanDerWaalsContact CA-O 3.25Å; E182-V196 WeakPolarHBondContact CA-O 3.12Å; M183-V196 HydrophobicContact CE-CG2 4.07Å; M183-V196 PolarHBondContact N-O 3.25Å; M183-V196 PolarHBondContact O-N 3.23Å; V196-F207 HydrophobicContact CG1-CB 4.36Å; V196-F207 HydrophobicContact CG1-CD1 4.18Å; V196-I209 HydrophobicContact CG1-CD1 4.15Å; V196-I209 HydrophobicContact CG2-CD1 4.21Å; V196-V282 HydrophobicContact CG2-CG1 3.61Å; V196-V282 WeakPolarHBondContact CG2-O 3.48Å; V196-A286 HydrophobicContact CB-CB 4.5Å; V196-A286 HydrophobicContact CG1-CB 3.81Å; V196-A286 HydrophobicContact CG2-CB 3.84Å; V196-L289 HydrophobicContact CB-CD2 4.12Å; V196-L289 HydrophobicContact CG1-CD2 3.76Å |
| 197 | K | 93.9 | Very high | 91.3 | Very high | 61 Ų | 61 | 49.3 Ų | 49.3 | 27% | 0.265 | 26% | 0.263 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.7 | 131.3 | 177.1 | -75.5 | -175.9 | -177 | 149.9 | 0 | 110.4 | E182 F207 S208 | E182-K197 HydrophobicContact CB-CG 4.24Å; E182-K197 HydrophobicContact CG-CG 3.77Å; E182-K197 WeakPolarHBondContact OE1-CE 3.29Å; E182-K197 IonicContact OE1-NZ 3.72Å; E182-K197 WeakPolarHBondContact OE2-CE 3.47Å; K197-F207 CarbonylContact O-C 3.52Å; K197-F207 WeakPolarHBondContact O-CA 3.47Å; K197-S208 PolarHBondContact N-O 3.31Å; K197-S208 PolarHBondContact O-N 2.83Å |
| 198 | Q | 91 | Very high | 91.3 | Very high | 41 Ų | 41 | 49.6 Ų | 49.6 | 19% | 0.192 | 27% | 0.265 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.9 | 129.7 | 168.8 | -171.5 | -175.7 | 14.3 | 0 | 0 | 109.3 | L180 Q181 K206 F207 M293 | L180-Q198 HydrophobicContact CB-CB 4.4Å; L180-Q198 HydrophobicContact CD2-CB 4.29Å; L180-Q198 HydrophobicContact CD2-CG 3.97Å; Q181-Q198 HydrophobicContact CB-CB 4.26Å; Q181-Q198 VanDerWaalsContact N-OE1 3.09Å; Q181-Q198 WeakPolarHBondContact O-CB 3.22Å; Q181-Q198 PolarHBondContact O-N 2.81Å; Q198-K206 WeakPolarHBondContact CA-O 3.5Å; Q198-F207 HydrophobicContact CB-CD1 3.95Å; Q198-F207 HydrophobicContact CB-CE1 3.86Å; Q198-F207 HydrophobicContact CG-CD1 4.29Å; Q198-F207 HydrophobicContact CG-CE1 3.95Å; Q198-F207 HydrophobicContact CG-CZ 4.45Å; Q198-M293 VanDerWaalsContact CD-CE 3.46Å; Q198-M293 HydrophobicContact CG-CE 4.36Å |
| 199 | D | 89.9 | Confident | 91.4 | Very high | 56 Ų | 56 | 47.3 Ų | 47.3 | 30% | 0.299 | 25% | 0.25 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -95.9 | 136 | 173.8 | -62.8 | -47.2 | 0 | 0 | 0 | 109.4 | H201 K206 S208 | D199-H201 PolarHBondContact O-N 2.7Å; D199-K206 HydrophobicContact CB-CB 3.95Å; D199-K206 PolarHBondContact N-O 2.88Å; D199-S208 PolarHBondContact OD1-OG 3.3Å; D199-S208 WeakPolarHBondContact OD2-CB 3.4Å; D199-S208 PolarHBondContact OD2-N 3.36Å; D199-S208 VanDerWaalsContact OD2-N 3.13Å; D199-S208 PolarHBondContact OD2-OG 3.01Å |
| 200 | W | 85.9 | Confident | 91.6 | Very high | 168 Ų | 168 | 45.9 Ų | 45.9 | 64% | 0.636 | 24% | 0.239 | S | C | * | . | P | Polyproline II helix | trans | -69.2 | 130.7 | 177.1 | -174.8 | 86.7 | 0 | 0 | 0 | 110.4 | P177 L180 P202 | P177-W200 HydrophobicContact CB-CG 4.03Å; L180-W200 HydrophobicContact CD1-CB 4.08Å; L180-W200 HydrophobicContact CD2-CB 3.98Å; W200-P202 HydrophobicContact CH2-CB 4.41Å |
| 201 | H | 83.5 | Confident | 91.7 | Very high | 64 Ų | 64 | 43.1 Ų | 43.1 | 30% | 0.296 | 21% | 0.211 | S | C | . | . | trans | -154.9 | 143.1 | 174.5 | -178.3 | -84.2 | 0 | 0 | 0 | 109.3 | D199 F203 L204 K206 | D199-H201 PolarHBondContact O-N 2.7Å; H201-F203 VanDerWaalsContact C-N 3.34Å; H201-F203 PolarHBondContact ND1-N 3.39Å; H201-F203 PolarHBondContact O-N 3.49Å; H201-L204 WeakPolarHBondContact CB-O 3.38Å; H201-L204 WeakPolarHBondContact ND1-CB 3.38Å; H201-L204 PolarHBondContact ND1-N 2.95Å; H201-L204 PolarHBondContact ND1-O 2.96Å; H201-K206 HydrophobicContact CB-CD 4.2Å; H201-K206 HydrophobicContact CB-CG 4.17Å; H201-K206 WeakPolarHBondContact CD2-CE 3.24Å | ||
| 202 | P | 76.1 | Confident | 91.7 | Very high | 72 Ų | 72 | 42.8 Ų | 42.8 | 47% | 0.468 | 21% | 0.21 | S | C | . | . | S | Bend | trans | -67.9 | -25.7 | -168.3 | 22.8 | -35 | 0 | 0 | 0 | 115.3 | W200 | W200-P202 HydrophobicContact CH2-CB 4.41Š|
| 203 | F | 77.9 | Confident | 91.6 | Very high | 140 Ų | 140 | 46 Ų | 46 | 61% | 0.614 | 23% | 0.226 | S | C | * | . | S | Bend | trans | -134.1 | -39 | -171 | -53.8 | -64.7 | 0 | 0 | 0 | 114.4 | H201 | H201-F203 VanDerWaalsContact C-N 3.34Å; H201-F203 PolarHBondContact ND1-N 3.39Å; H201-F203 PolarHBondContact O-N 3.49Å |
| 204 | L | 84.5 | Confident | 91.4 | Very high | 41 Ų | 41 | 47.1 Ų | 47.1 | 22% | 0.215 | 24% | 0.238 | C | C | . | . | S | Bend | trans | -95.5 | 137.7 | 179.2 | -54.1 | 172.2 | 0 | 0 | 0 | 112.2 | H201 K206 E221 C224 | H201-L204 WeakPolarHBondContact CB-O 3.38Å; H201-L204 WeakPolarHBondContact ND1-CB 3.38Å; H201-L204 PolarHBondContact ND1-N 2.95Å; H201-L204 PolarHBondContact ND1-O 2.96Å; L204-K206 HydrophobicContact CB-CG 4.42Å; L204-K206 PolarHBondContact O-N 2.82Å; L204-E221 HydrophobicContact CD1-CG 4.3Å; L204-E221 WeakPolarHBondContact CD1-OE1 3.19Å; L204-C224 HydrophobicContact CD2-CB 3.68Å |
| 205 | P | 88.3 | Confident | 91.3 | Very high | 10 Ų | 10 | 52.4 Ų | 52.4 | 7% | 0.065 | 26% | 0.263 | C | S | . | . | trans | -72.6 | 121.5 | 165.9 | 34 | -36.6 | 0 | 0 | 0 | 109.4 | F207 G222 P223 F225 F235 F294 | P205-F207 HydrophobicContact CB-CE2 4.23Å; P205-G222 PolarHBondContact O-N 3.31Å; P205-P223 WeakPolarHBondContact CD-O 3.22Å; P205-F225 HydrophobicContact CB-CD2 4.28Å; P205-F225 HydrophobicContact CB-CE2 4.06Å; P205-F225 HydrophobicContact CG-CD2 3.76Å; P205-F225 HydrophobicContact CG-CE2 3.57Å; P205-F235 HydrophobicContact CB-CE1 4.19Å; P205-F235 HydrophobicContact CG-CE1 3.83Å; P205-F235 HydrophobicContact CG-CZ 4.5Å; P205-F294 HydrophobicContact CB-CE2 4.31Å; P205-F294 HydrophobicContact CB-CZ 3.78Å | ||
| 206 | K | 91.9 | Very high | 91.3 | Very high | 53 Ų | 53 | 52.3 Ų | 52.3 | 23% | 0.23 | 27% | 0.265 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.6 | 143.4 | 178 | -62 | -162.5 | -176.2 | -151.3 | 0 | 110.6 | Q198 D199 H201 L204 L220 E221 | Q198-K206 WeakPolarHBondContact CA-O 3.5Å; D199-K206 HydrophobicContact CB-CB 3.95Å; D199-K206 PolarHBondContact N-O 2.88Å; H201-K206 HydrophobicContact CB-CD 4.2Å; H201-K206 HydrophobicContact CB-CG 4.17Å; H201-K206 WeakPolarHBondContact CD2-CE 3.24Å; L204-K206 HydrophobicContact CB-CG 4.42Å; L204-K206 PolarHBondContact O-N 2.82Å; K206-L220 CarbonylContact C-O 3.49Å; K206-L220 WeakPolarHBondContact CA-O 3.45Å; K206-E221 WeakPolarHBondContact CE-OE2 3.45Å; K206-E221 HydrophobicContact CG-CG 4.4Å; K206-E221 IonicContact NZ-OE2 2.7Å; K206-E221 PolarHBondContact NZ-OE2 2.86Å |
| 207 | F | 95.1 | Very high | 91.2 | Very high | 1 Ų | 1 | 56 Ų | 56 | 0% | 0.004 | 28% | 0.284 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.6 | 137.4 | 175.5 | -55.6 | -95.3 | 0 | 0 | 0 | 111.5 | V196 K197 Q198 P205 K219 L220 F235 L289 I290 M293 F294 | V196-F207 HydrophobicContact CG1-CB 4.36Å; V196-F207 HydrophobicContact CG1-CD1 4.18Å; K197-F207 CarbonylContact O-C 3.52Å; K197-F207 WeakPolarHBondContact O-CA 3.47Å; Q198-F207 HydrophobicContact CB-CD1 3.95Å; Q198-F207 HydrophobicContact CB-CE1 3.86Å; Q198-F207 HydrophobicContact CG-CD1 4.29Å; Q198-F207 HydrophobicContact CG-CE1 3.95Å; Q198-F207 HydrophobicContact CG-CZ 4.45Å; P205-F207 HydrophobicContact CB-CE2 4.23Å; F207-K219 CarbonylContact O-C 3.56Å; F207-K219 WeakPolarHBondContact O-CA 3.28Å; F207-L220 HydrophobicContact CB-CB 4.19Å; F207-L220 PolarHBondContact N-O 3.04Å; F207-L220 PolarHBondContact O-N 2.93Å; F207-F235 HydrophobicContact CE2-CD1 4.37Å; F207-F235 AromaticContact CE2-CE1 3.98Å; F207-F235 HydrophobicContact CE2-CE1 3.98Å; F207-L289 HydrophobicContact CE1-CD2 4.33Å; F207-I290 HydrophobicContact CE2-CD1 4.39Å; F207-I290 HydrophobicContact CE2-CG1 3.98Å; F207-I290 HydrophobicContact CZ-CG1 4.1Å; F207-M293 HydrophobicContact CE1-CE 4.13Å; F207-M293 HydrophobicContact CE1-SD 3.8Å; F207-M293 HydrophobicContact CZ-CE 4.06Å; F207-M293 HydrophobicContact CZ-SD 4.02Å; F207-F294 HydrophobicContact CE2-CE2 4.3Å; F207-F294 AromaticContact CZ-CE2 3.94Å; F207-F294 HydrophobicContact CZ-CE2 3.94Å; F207-F294 HydrophobicContact CZ-CZ 4.49Å |
| 208 | S | 96.6 | Very high | 91.4 | Very high | 7 Ų | 7 | 53.6 Ų | 53.6 | 5% | 0.049 | 27% | 0.274 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.6 | 127.2 | 169.1 | -77.6 | 0 | 0 | 0 | 0 | 109.9 | K197 D199 | K197-S208 PolarHBondContact N-O 3.31Å; K197-S208 PolarHBondContact O-N 2.83Å; D199-S208 PolarHBondContact OD1-OG 3.3Å; D199-S208 WeakPolarHBondContact OD2-CB 3.4Å; D199-S208 PolarHBondContact OD2-N 3.36Å; D199-S208 VanDerWaalsContact OD2-N 3.13Å; D199-S208 PolarHBondContact OD2-OG 3.01Å |
| 209 | I | 97.8 | Very high | 91.6 | Very high | 0 Ų | 0 | 55.6 Ų | 55.6 | 0% | 0 | 28% | 0.281 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.6 | 110.6 | 172.1 | -54.8 | -55.7 | 0 | 0 | 0 | 107.4 | V196 M217 L218 L220 M279 V282 L283 A286 | V196-I209 HydrophobicContact CG1-CD1 4.15Å; V196-I209 HydrophobicContact CG2-CD1 4.21Å; I209-M217 PolarHBondContact O-N 2.94Å; I209-L218 HydrophobicContact CB-CB 3.9Å; I209-L218 HydrophobicContact CG1-CB 4.17Å; I209-L218 HydrophobicContact CG2-CB 4.42Å; I209-L218 HydrophobicContact CG2-CD1 4.31Å; I209-L218 PolarHBondContact N-O 2.77Å; I209-L218 PolarHBondContact O-N 2.85Å; I209-L220 HydrophobicContact CD1-CD1 3.91Å; I209-L220 HydrophobicContact CG1-CD1 4.35Å; I209-L220 HydrophobicContact CG1-CG 4.47Å; I209-M279 HydrophobicContact CG2-SD 4.23Å; I209-V282 HydrophobicContact CG2-CB 4.09Å; I209-V282 HydrophobicContact CG2-CG1 3.68Å; I209-L283 HydrophobicContact CD1-CD2 4.12Å; I209-L283 HydrophobicContact CG1-CD2 3.96Å; I209-A286 HydrophobicContact CD1-CB 3.83Å |
| 210 | Q | 97.6 | Very high | 91.9 | Very high | 18 Ų | 18 | 53 Ų | 53 | 8% | 0.084 | 27% | 0.268 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.3 | 144.6 | -171.7 | -60.5 | -173.2 | -14.9 | 0 | 0 | 111.7 | G194 F195 G214 Q215 | G194-Q210 CarbonylContact C-O 3.53Å; G194-Q210 WeakPolarHBondContact CA-O 3.06Å; F195-Q210 HydrophobicContact CB-CB 4.27Å; F195-Q210 PolarHBondContact N-O 3.27Å; F195-Q210 PolarHBondContact O-N 3.11Å; Q210-G214 VanDerWaalsContact CD-O 3.29Å; Q210-G214 PolarHBondContact OE1-O 3.45Å; Q210-Q215 CarbonylContact C-O 3.58Å; Q210-Q215 VanDerWaalsContact CA-O 3.22Å; Q210-Q215 WeakPolarHBondContact CA-O 3.5Å |
| 211 | G | 96 | Very high | 92.3 | Very high | 3 Ų | 3 | 48.8 Ų | 48.8 | 3% | 0.031 | 26% | 0.255 | C | S | . | . | trans | -67.1 | 178.7 | 165 | 0 | 0 | 0 | 0 | 0 | 112.6 | D213 G214 Q215 | G211-D213 PolarHBondContact O-N 2.86Å; G211-G214 PolarHBondContact O-N 3.27Å; G211-Q215 PolarHBondContact N-O 3.47Å | ||
| 212 | P | 95.1 | Very high | 92.5 | Very high | 73 Ų | 73 | 46 Ų | 46 | 47% | 0.474 | 24% | 0.243 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -68.1 | -20.7 | -179.2 | 29.5 | -34.4 | 0 | 0 | 0 | 113.2 | V193 G214 | V193-P212 WeakPolarHBondContact O-CD 3.31Å; P212-G214 VanDerWaalsContact C-N 3.29Å |
| 213 | D | 94.4 | Very high | 92.9 | Very high | 115 Ų | 115 | 44.2 Ų | 44.2 | 62% | 0.615 | 23% | 0.232 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -83.6 | -2 | 174.2 | 63.6 | -16.4 | 0 | 0 | 0 | 113.3 | G211 Q215 | G211-D213 PolarHBondContact O-N 2.86Å; D213-Q215 VanDerWaalsContact C-N 3.29Å; D213-Q215 WeakPolarHBondContact OD1-CB 3.27Å; D213-Q215 PolarHBondContact OD1-N 3.04Å; D213-Q215 WeakPolarHBondContact OD2-CB 3.4Å |
| 214 | G | 91.9 | Very high | 92.9 | Very high | 28 Ų | 28 | 39 Ų | 39 | 29% | 0.289 | 21% | 0.213 | S | C | . | . | S | Bend | trans | 80.2 | 5.1 | -175.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | Q210 G211 P212 | Q210-G214 VanDerWaalsContact CD-O 3.29Å; Q210-G214 PolarHBondContact OE1-O 3.45Å; G211-G214 PolarHBondContact O-N 3.27Å; P212-G214 VanDerWaalsContact C-N 3.29Å |
| 215 | Q | 95.4 | Very high | 92.1 | Very high | 111 Ų | 111 | 40.9 Ų | 40.9 | 52% | 0.519 | 22% | 0.219 | S | C | . | . | trans | -72.2 | 129 | 174.9 | -177.4 | 173.4 | 65.8 | 0 | 0 | 110.4 | Q210 G211 D213 M217 | Q210-Q215 CarbonylContact C-O 3.58Å; Q210-Q215 VanDerWaalsContact CA-O 3.22Å; Q210-Q215 WeakPolarHBondContact CA-O 3.5Å; G211-Q215 PolarHBondContact N-O 3.47Å; D213-Q215 VanDerWaalsContact C-N 3.29Å; D213-Q215 WeakPolarHBondContact OD1-CB 3.27Å; D213-Q215 PolarHBondContact OD1-N 3.04Å; D213-Q215 WeakPolarHBondContact OD2-CB 3.4Å; Q215-M217 HydrophobicContact CG-SD 4.33Å; Q215-M217 PolarHBondContact O-N 2.87Å | ||
| 216 | T | 96.7 | Very high | 90.6 | Very high | 37 Ų | 37 | 44.3 Ų | 44.3 | 23% | 0.227 | 25% | 0.249 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -70.2 | 119.4 | 174.3 | -60.8 | 0 | 0 | 0 | 0 | 110.6 | L218 K219 | T216-L218 WeakPolarHBondContact CG2-O 3.35Å; T216-K219 HydrophobicContact CG2-CG 4.16Å |
| 217 | M | 95.9 | Very high | 88.8 | Confident | 78 Ų | 78 | 45.5 Ų | 45.5 | 38% | 0.384 | 26% | 0.262 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.9 | -39.3 | 179.4 | -59.8 | -59.9 | -76.8 | 0 | 0 | 111.4 | I209 Q215 K240 M279 | I209-M217 PolarHBondContact O-N 2.94Å; Q215-M217 HydrophobicContact CG-SD 4.33Å; Q215-M217 PolarHBondContact O-N 2.87Å; M217-K240 PolarHBondContact O-N 2.62Å; M217-M279 HydrophobicContact CB-SD 3.99Å; M217-M279 HydrophobicContact CG-SD 3.98Å |
| 218 | L | 97.1 | Very high | 86.5 | Confident | 10 Ų | 10 | 53.1 Ų | 53.1 | 5% | 0.052 | 30% | 0.303 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.9 | 162.5 | -179.1 | -47.9 | 164.4 | 0 | 0 | 0 | 110.3 | I209 T216 L237 T238 I246 L275 M279 L283 | I209-L218 HydrophobicContact CB-CB 3.9Å; I209-L218 HydrophobicContact CG1-CB 4.17Å; I209-L218 HydrophobicContact CG2-CB 4.42Å; I209-L218 HydrophobicContact CG2-CD1 4.31Å; I209-L218 PolarHBondContact N-O 2.77Å; I209-L218 PolarHBondContact O-N 2.85Å; T216-L218 WeakPolarHBondContact CG2-O 3.35Å; L218-L237 HydrophobicContact CB-CD1 3.81Å; L218-L237 HydrophobicContact CD1-CD1 4.06Å; L218-L237 HydrophobicContact CD1-CD2 4.38Å; L218-L237 HydrophobicContact CG-CD1 4.46Å; L218-T238 WeakPolarHBondContact CA-O 3.32Å; L218-I246 HydrophobicContact CD2-CD1 3.94Å; L218-L275 HydrophobicContact CD1-CD1 4.06Å; L218-L275 HydrophobicContact CD1-CD2 4.08Å; L218-L275 HydrophobicContact CD2-CD1 4.47Å; L218-M279 HydrophobicContact CD1-CB 4.34Å; L218-L283 HydrophobicContact CD1-CD1 4.33Å |
| 219 | K | 96.9 | Very high | 84.3 | Confident | 82 Ų | 82 | 56.3 Ų | 56.3 | 36% | 0.357 | 33% | 0.325 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.9 | 138.3 | 175.4 | -71.1 | 171.7 | 174.9 | 164.5 | 0 | 110.2 | F207 T216 L237 T238 K240 | F207-K219 CarbonylContact O-C 3.56Å; F207-K219 WeakPolarHBondContact O-CA 3.28Å; T216-K219 HydrophobicContact CG2-CG 4.16Å; K219-L237 WeakPolarHBondContact O-CA 3.42Å; K219-T238 PolarHBondContact N-O 2.94Å; K219-T238 PolarHBondContact O-N 3.06Å; K219-T238 PolarHBondContact O-OG1 3.23Å; K219-K240 VanDerWaalsContact CE-O 3.31Å; K219-K240 WeakPolarHBondContact CE-O 3.38Å; K219-K240 PolarHBondContact NZ-O 3.46Å |
| 220 | L | 95.8 | Very high | 82.1 | Confident | 2 Ų | 2 | 62.2 Ų | 62.2 | 1% | 0.01 | 37% | 0.365 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.9 | 131.5 | 170.2 | -78.1 | 167.8 | 0 | 0 | 0 | 109.5 | K206 F207 I209 F235 E236 L237 I249 L283 A286 | K206-L220 CarbonylContact C-O 3.49Å; K206-L220 WeakPolarHBondContact CA-O 3.45Å; F207-L220 HydrophobicContact CB-CB 4.19Å; F207-L220 PolarHBondContact N-O 3.04Å; F207-L220 PolarHBondContact O-N 2.93Å; I209-L220 HydrophobicContact CD1-CD1 3.91Å; I209-L220 HydrophobicContact CG1-CD1 4.35Å; I209-L220 HydrophobicContact CG1-CG 4.47Å; L220-F235 HydrophobicContact CD2-CB 4.26Å; L220-E236 WeakPolarHBondContact CA-O 3.27Å; L220-L237 HydrophobicContact CD2-CB 3.91Å; L220-L237 HydrophobicContact CD2-CD1 3.77Å; L220-L237 HydrophobicContact CD2-CG 4.47Å; L220-L237 HydrophobicContact CG-CD1 3.93Å; L220-I249 HydrophobicContact CD1-CD1 3.65Å; L220-I249 HydrophobicContact CD2-CD1 4.23Å; L220-I249 HydrophobicContact CD2-CG1 4.24Å; L220-L283 HydrophobicContact CD1-CD2 4.16Å; L220-A286 HydrophobicContact CD1-CB 3.72Å |
| 221 | E | 93.4 | Very high | 80.6 | Confident | 79 Ų | 79 | 63 Ų | 63 | 37% | 0.369 | 38% | 0.377 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.7 | 118.6 | 176.4 | -174.7 | 165.9 | 131.5 | 0 | 0 | 109.4 | L204 K206 F235 E236 | L204-E221 HydrophobicContact CD1-CG 4.3Å; L204-E221 WeakPolarHBondContact CD1-OE1 3.19Å; K206-E221 WeakPolarHBondContact CE-OE2 3.45Å; K206-E221 HydrophobicContact CG-CG 4.4Å; K206-E221 IonicContact NZ-OE2 2.7Å; K206-E221 PolarHBondContact NZ-OE2 2.86Å; E221-F235 CarbonylContact O-C 3.56Å; E221-F235 VanDerWaalsContact O-CA 3.32Å; E221-F235 WeakPolarHBondContact O-CA 3.13Å; E221-E236 PolarHBondContact N-O 2.92Å; E221-E236 PolarHBondContact O-N 2.87Å |
| 222 | G | 88.9 | Confident | 79.2 | Confident | 5 Ų | 5 | 66.5 Ų | 66.5 | 5% | 0.052 | 40% | 0.395 | C | S | . | . | trans | -94.4 | 176.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | P205 | P205-G222 PolarHBondContact O-N 3.31Š| ||
| 223 | P | 84.7 | Confident | 78.7 | Confident | 36 Ų | 36 | 63.4 Ų | 63.4 | 23% | 0.234 | 38% | 0.375 | C | S | . | . | trans | -73.1 | 158.8 | -177.5 | 31.7 | -29.1 | 0 | 0 | 0 | 110.6 | P205 F225 V233 N234 | P205-P223 WeakPolarHBondContact CD-O 3.22Å; P223-F225 PolarHBondContact O-N 3.04Å; P223-V233 HydrophobicContact CG-CG1 3.72Å; P223-N234 VanDerWaalsContact CD-O 3.31Å; P223-N234 WeakPolarHBondContact CD-O 3.46Å | ||
| 224 | C | 76.7 | Confident | 78.4 | Confident | 30 Ų | 30 | 60.5 Ų | 60.5 | 20% | 0.203 | 36% | 0.36 | C | S | . | . | trans | -67.1 | 103.1 | 174.7 | -172.5 | 0 | 0 | 0 | 0 | 110.2 | L204 A226 C227 | L204-C224 HydrophobicContact CD2-CB 3.68Å; C224-A226 PolarHBondContact O-N 2.84Å; C224-C227 HydrophobicContact CB-CB 4.2Å; C224-C227 WeakPolarHBondContact O-CB 3.32Å; C224-C227 PolarHBondContact O-N 3.35Å | ||
| 225 | F | 67.4 | Low | 78.4 | Confident | 80 Ų | 80 | 59.4 Ų | 59.4 | 35% | 0.351 | 35% | 0.347 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.5 | -19.3 | 177.6 | -75.5 | -66.8 | 0 | 0 | 0 | 113.5 | P205 P223 C227 V233 F235 F294 | P205-F225 HydrophobicContact CB-CD2 4.28Å; P205-F225 HydrophobicContact CB-CE2 4.06Å; P205-F225 HydrophobicContact CG-CD2 3.76Å; P205-F225 HydrophobicContact CG-CE2 3.57Å; P223-F225 PolarHBondContact O-N 3.04Å; F225-C227 PolarHBondContact O-N 3.14Å; F225-V233 HydrophobicContact CE1-CG1 4.34Å; F225-V233 HydrophobicContact CZ-CG1 4.23Å; F225-F235 HydrophobicContact CE2-CZ 4.19Å; F225-F235 HydrophobicContact CZ-CZ 4.03Å; F225-F294 HydrophobicContact CD2-CD1 4.06Å; F225-F294 AromaticContact CD2-CE1 3.71Å; F225-F294 HydrophobicContact CD2-CE1 3.71Å; F225-F294 HydrophobicContact CD2-CZ 4.22Å; F225-F294 HydrophobicContact CE1-CD1 4.43Å; F225-F294 AromaticContact CE2-CD1 3.49Å; F225-F294 HydrophobicContact CE2-CD1 3.49Å; F225-F294 VanDerWaalsContact CE2-CD1 3.49Å; F225-F294 HydrophobicContact CE2-CD2 4.11Å; F225-F294 AromaticContact CE2-CE1 3.33Å; F225-F294 HydrophobicContact CE2-CE1 3.33Å; F225-F294 AromaticContact CE2-CE2 3.96Å; F225-F294 HydrophobicContact CE2-CE2 3.96Å; F225-F294 AromaticContact CE2-CG 3.89Å; F225-F294 HydrophobicContact CE2-CG 3.89Å; F225-F294 AromaticContact CE2-CZ 3.59Å; F225-F294 HydrophobicContact CE2-CZ 3.59Å; F225-F294 HydrophobicContact CZ-CB 4.25Å; F225-F294 AromaticContact CZ-CD1 3.72Å; F225-F294 HydrophobicContact CZ-CD1 3.72Å; F225-F294 HydrophobicContact CZ-CD2 4.17Å; F225-F294 HydrophobicContact CZ-CE1 4.07Å; F225-F294 HydrophobicContact CZ-CE2 4.46Å; F225-F294 AromaticContact CZ-CG 3.78Å; F225-F294 HydrophobicContact CZ-CG 3.78Å; F225-F294 HydrophobicContact CZ-CZ 4.43Å |
| 226 | A | 56.7 | Low | 78.4 | Confident | 83 Ų | 83 | 57.4 Ų | 57.4 | 69% | 0.686 | 34% | 0.337 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.4 | -16.4 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | C224 | C224-A226 PolarHBondContact O-N 2.84Š|
| 227 | C | 54.5 | Low | 78.4 | Confident | 77 Ų | 77 | 55.7 Ų | 55.7 | 52% | 0.52 | 33% | 0.327 | S | S | . | . | S | Bend | trans | -91.7 | 119.5 | 171.2 | -60 | 0 | 0 | 0 | 0 | 107.5 | C224 F225 C229 | C224-C227 HydrophobicContact CB-CB 4.2Å; C224-C227 WeakPolarHBondContact O-CB 3.32Å; C224-C227 PolarHBondContact O-N 3.35Å; F225-C227 PolarHBondContact O-N 3.14Å; C227-C229 PolarHBondContact O-N 2.91Å; C227-C229 PolarHBondContact O-SG 2.99Å |
| 228 | N | 46 | Very low | 78.5 | Confident | 161 Ų | 161 | 53 Ų | 53 | 86% | 0.861 | 32% | 0.315 | S | S | * | . | trans | -54.7 | 94.1 | -171.3 | -154.7 | 33.1 | 0 | 0 | 0 | 112.8 | ||||
| 229 | C | 51.6 | Low | 78.3 | Confident | 75 Ų | 75 | 54.9 Ų | 54.9 | 51% | 0.507 | 33% | 0.329 | S | S | . | . | trans | -95.3 | 105.2 | -174.1 | -70.7 | 0 | 0 | 0 | 0 | 111.5 | C227 | C227-C229 PolarHBondContact O-N 2.91Å; C227-C229 PolarHBondContact O-SG 2.99Å | ||
| 230 | C | 52.1 | Low | 78 | Confident | 124 Ų | 124 | 55.8 Ų | 55.8 | 84% | 0.838 | 33% | 0.333 | S | S | * | . | trans | -96.4 | 101.1 | 159.5 | -58 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 231 | G | 65.3 | Low | 77.6 | Confident | 33 Ų | 33 | 62.1 Ų | 62.1 | 34% | 0.34 | 37% | 0.367 | S | S | . | . | S | Bend | trans | 155.3 | -170.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | W253 | G231-W253 VanDerWaalsContact O-CD1 3.22Š|
| 232 | D | 67.4 | Low | 76.9 | Confident | 77 Ų | 77 | 59.9 Ų | 59.9 | 41% | 0.412 | 37% | 0.365 | S | S | . | . | trans | -61.8 | 138.8 | 175.9 | -65.1 | -20.8 | 0 | 0 | 0 | 111.9 | K251 Q252 W253 | D232-K251 WeakPolarHBondContact CA-O 3.48Å; D232-Q252 WeakPolarHBondContact OD1-CA 3.46Å; D232-Q252 PolarHBondContact OD2-NE2 3.12Å; D232-Q252 PolarHBondContact OD2-OE1 2.98Å; D232-W253 PolarHBondContact OD1-N 3Å | ||
| 233 | V | 83.1 | Confident | 76.6 | Confident | 8 Ų | 8 | 62.8 Ų | 62.8 | 5% | 0.048 | 40% | 0.395 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.7 | 118.1 | 179.4 | -177.1 | 0 | 0 | 0 | 0 | 108.9 | P223 F225 F235 S250 K251 F295 | P223-V233 HydrophobicContact CG-CG1 3.72Å; F225-V233 HydrophobicContact CE1-CG1 4.34Å; F225-V233 HydrophobicContact CZ-CG1 4.23Å; V233-F235 HydrophobicContact CG1-CD2 4.16Å; V233-F235 HydrophobicContact CG1-CE2 3.5Å; V233-F235 HydrophobicContact CG1-CZ 4.2Å; V233-S250 CarbonylContact O-C 3.54Å; V233-S250 VanDerWaalsContact O-CA 3.27Å; V233-S250 WeakPolarHBondContact O-CA 3.42Å; V233-K251 HydrophobicContact CB-CB 4.4Å; V233-K251 PolarHBondContact N-O 2.81Å; V233-K251 PolarHBondContact O-N 2.86Å; V233-F295 HydrophobicContact CB-CZ 4.06Å; V233-F295 HydrophobicContact CG1-CZ 4.14Å; V233-F295 HydrophobicContact CG2-CE1 4.24Å; V233-F295 HydrophobicContact CG2-CZ 3.89Å |
| 234 | N | 88.7 | Confident | 76.8 | Confident | 55 Ų | 55 | 69.4 Ų | 69.4 | 29% | 0.294 | 42% | 0.423 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.3 | 124.9 | -178.2 | -63.3 | -44.9 | 0 | 0 | 0 | 111.4 | P223 S250 | P223-N234 VanDerWaalsContact CD-O 3.31Å; P223-N234 WeakPolarHBondContact CD-O 3.46Å; N234-S250 WeakPolarHBondContact OD1-CB 3.34Å |
| 235 | F | 92.9 | Very high | 77.6 | Confident | 4 Ų | 4 | 70.2 Ų | 70.2 | 2% | 0.018 | 43% | 0.429 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.7 | 113.7 | 169.3 | -65.3 | -102.8 | 0 | 0 | 0 | 108.8 | P205 F207 L220 E221 F225 V233 R248 I249 I290 F294 | P205-F235 HydrophobicContact CB-CE1 4.19Å; P205-F235 HydrophobicContact CG-CE1 3.83Å; P205-F235 HydrophobicContact CG-CZ 4.5Å; F207-F235 HydrophobicContact CE2-CD1 4.37Å; F207-F235 AromaticContact CE2-CE1 3.98Å; F207-F235 HydrophobicContact CE2-CE1 3.98Å; L220-F235 HydrophobicContact CD2-CB 4.26Å; E221-F235 CarbonylContact O-C 3.56Å; E221-F235 VanDerWaalsContact O-CA 3.32Å; E221-F235 WeakPolarHBondContact O-CA 3.13Å; F225-F235 HydrophobicContact CE2-CZ 4.19Å; F225-F235 HydrophobicContact CZ-CZ 4.03Å; V233-F235 HydrophobicContact CG1-CD2 4.16Å; V233-F235 HydrophobicContact CG1-CE2 3.5Å; V233-F235 HydrophobicContact CG1-CZ 4.2Å; F235-R248 CarbonylContact O-C 3.57Å; F235-R248 WeakPolarHBondContact O-CA 3.32Å; F235-R248 WeakPolarHBondContact O-CB 3.36Å; F235-I249 HydrophobicContact CB-CB 4.25Å; F235-I249 PolarHBondContact N-O 2.62Å; F235-I249 PolarHBondContact O-N 2.71Å; F235-I290 HydrophobicContact CD1-CD1 3.88Å; F235-I290 HydrophobicContact CD2-CD1 4.11Å; F235-I290 HydrophobicContact CD2-CG2 4.18Å; F235-I290 HydrophobicContact CE1-CD1 4.08Å; F235-I290 HydrophobicContact CE1-CG1 4.26Å; F235-I290 HydrophobicContact CE1-CG2 4.36Å; F235-I290 HydrophobicContact CE2-CD1 4.29Å; F235-I290 HydrophobicContact CE2-CG2 3.46Å; F235-I290 VanDerWaalsContact CE2-CG2 3.46Å; F235-I290 HydrophobicContact CG-CD1 3.91Å; F235-I290 HydrophobicContact CZ-CD1 4.29Å; F235-I290 HydrophobicContact CZ-CG1 4.29Å; F235-I290 HydrophobicContact CZ-CG2 3.58Å; F235-F294 HydrophobicContact CE1-CE2 4.45Å; F235-F294 HydrophobicContact CZ-CD2 4.28Å; F235-F294 HydrophobicContact CZ-CE2 4.24Å |
| 236 | E | 95.4 | Very high | 78.9 | Confident | 69 Ų | 69 | 69.7 Ų | 69.7 | 32% | 0.322 | 43% | 0.429 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.9 | 131.6 | -177.6 | -63.4 | -61.3 | 150.6 | 0 | 0 | 110.6 | L220 E221 S245 | L220-E236 WeakPolarHBondContact CA-O 3.27Å; E221-E236 PolarHBondContact N-O 2.92Å; E221-E236 PolarHBondContact O-N 2.87Å; E236-S245 WeakPolarHBondContact OE2-CB 3.04Å; E236-S245 PolarHBondContact OE2-OG 2.97Å |
| 237 | L | 96.7 | Very high | 80.8 | Confident | 2 Ų | 2 | 66.2 Ų | 66.2 | 1% | 0.01 | 40% | 0.401 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.2 | 124.7 | 178.2 | -176.7 | 67.2 | 0 | 0 | 0 | 109.7 | L218 K219 L220 S245 I246 G247 F271 L283 | L218-L237 HydrophobicContact CB-CD1 3.81Å; L218-L237 HydrophobicContact CD1-CD1 4.06Å; L218-L237 HydrophobicContact CD1-CD2 4.38Å; L218-L237 HydrophobicContact CG-CD1 4.46Å; K219-L237 WeakPolarHBondContact O-CA 3.42Å; L220-L237 HydrophobicContact CD2-CB 3.91Å; L220-L237 HydrophobicContact CD2-CD1 3.77Å; L220-L237 HydrophobicContact CD2-CG 4.47Å; L220-L237 HydrophobicContact CG-CD1 3.93Å; L237-S245 CarbonylContact O-C 3.44Å; L237-S245 WeakPolarHBondContact O-CA 3.44Å; L237-S245 PolarHBondContact O-OG 2.87Å; L237-I246 HydrophobicContact CD2-CD1 4.47Å; L237-I246 HydrophobicContact CD2-CG1 4.22Å; L237-I246 HydrophobicContact CG-CD1 4.46Å; L237-I246 HydrophobicContact CG-CG1 4.07Å; L237-I246 WeakPolarHBondContact O-CG1 2.95Å; L237-I246 PolarHBondContact O-N 2.88Å; L237-G247 VanDerWaalsContact CB-C 3.48Å; L237-G247 VanDerWaalsContact CB-O 3.3Å; L237-G247 WeakPolarHBondContact CB-O 3.25Å; L237-G247 PolarHBondContact N-O 3.03Å; L237-F271 HydrophobicContact CD2-CB 4.21Å; L237-L283 HydrophobicContact CD1-CD2 3.66Å; L237-L283 HydrophobicContact CD2-CD1 3.75Å; L237-L283 HydrophobicContact CD2-CD2 4.26Å |
| 238 | T | 96.4 | Very high | 82.7 | Confident | 22 Ų | 22 | 67.3 Ų | 67.3 | 14% | 0.135 | 39% | 0.394 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.5 | 160.6 | 179.1 | 57.6 | 0 | 0 | 0 | 0 | 111.1 | L218 K219 | L218-T238 WeakPolarHBondContact CA-O 3.32Å; K219-T238 PolarHBondContact N-O 2.94Å; K219-T238 PolarHBondContact O-N 3.06Å; K219-T238 PolarHBondContact O-OG1 3.23Å |
| 239 | S | 93.5 | Very high | 85 | Confident | 48 Ų | 48 | 59.8 Ų | 59.8 | 34% | 0.336 | 35% | 0.354 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -65.2 | 165 | 171.1 | -172.3 | 0 | 0 | 0 | 0 | 111.4 | D241 G242 | S239-D241 PolarHBondContact O-N 3.37Å; S239-D241 VanDerWaalsContact O-N 3.13Å; S239-G242 PolarHBondContact O-N 2.76Å |
| 240 | K | 89.8 | Confident | 86.8 | Confident | 101 Ų | 101 | 56.7 Ų | 56.7 | 44% | 0.439 | 33% | 0.333 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -51.7 | -36.1 | 178.4 | 70.6 | -176.8 | -174.3 | 177.8 | 0 | 113.7 | M217 K219 G242 | M217-K240 PolarHBondContact O-N 2.62Å; K219-K240 VanDerWaalsContact CE-O 3.31Å; K219-K240 WeakPolarHBondContact CE-O 3.38Å; K219-K240 PolarHBondContact NZ-O 3.46Å; K240-G242 PolarHBondContact O-N 2.88Å |
| 241 | D | 87.8 | Confident | 88.3 | Confident | 135 Ų | 135 | 51.3 Ų | 51.3 | 72% | 0.722 | 30% | 0.296 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.5 | -1.6 | -177 | -57.9 | -47.8 | 0 | 0 | 0 | 112.2 | S239 | S239-D241 PolarHBondContact O-N 3.37Å; S239-D241 VanDerWaalsContact O-N 3.13Å |
| 242 | G | 78.7 | Confident | 88.6 | Confident | 32 Ų | 32 | 54.3 Ų | 54.3 | 33% | 0.33 | 30% | 0.301 | S | S | . | . | trans | 76.1 | -167.8 | -170.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | S239 K240 | S239-G242 PolarHBondContact O-N 2.76Å; K240-G242 PolarHBondContact O-N 2.88Å | ||
| 243 | G | 83.6 | Confident | 88.1 | Confident | 66 Ų | 66 | 56.8 Ų | 56.8 | 68% | 0.68 | 30% | 0.304 | S | S | * | . | trans | 112 | -147.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 244 | Q | 88.5 | Confident | 86.5 | Confident | 176 Ų | 176 | 60.2 Ų | 60.2 | 82% | 0.822 | 33% | 0.329 | S | S | * | . | S | Bend | trans | -63.3 | 140.5 | -177.3 | -170.9 | -178.5 | 8 | 0 | 0 | 111 | I246 | Q244-I246 PolarHBondContact O-N 3.17Š|
| 245 | S | 93.8 | Very high | 84.5 | Confident | 47 Ų | 47 | 60.1 Ų | 60.1 | 33% | 0.329 | 34% | 0.341 | S | S | . | . | trans | -61.1 | 127.6 | 170.5 | -178.6 | 0 | 0 | 0 | 0 | 110.6 | E236 L237 G247 | E236-S245 WeakPolarHBondContact OE2-CB 3.04Å; E236-S245 PolarHBondContact OE2-OG 2.97Å; L237-S245 CarbonylContact O-C 3.44Å; L237-S245 WeakPolarHBondContact O-CA 3.44Å; L237-S245 PolarHBondContact O-OG 2.87Å; S245-G247 PolarHBondContact OG-O 3.2Å | ||
| 246 | I | 95.4 | Very high | 82.1 | Confident | 68 Ų | 68 | 67.5 Ų | 67.5 | 35% | 0.349 | 38% | 0.38 | S | S | . | . | trans | -103.9 | -1.2 | 177.2 | 63.2 | 169.9 | 0 | 0 | 0 | 112 | L218 L237 Q244 P272 | L218-I246 HydrophobicContact CD2-CD1 3.94Å; L237-I246 HydrophobicContact CD2-CD1 4.47Å; L237-I246 HydrophobicContact CD2-CG1 4.22Å; L237-I246 HydrophobicContact CG-CD1 4.46Å; L237-I246 HydrophobicContact CG-CG1 4.07Å; L237-I246 WeakPolarHBondContact O-CG1 2.95Å; L237-I246 PolarHBondContact O-N 2.88Å; Q244-I246 PolarHBondContact O-N 3.17Å; I246-P272 HydrophobicContact CB-CG 4.06Å; I246-P272 HydrophobicContact CD1-CG 4.16Å; I246-P272 HydrophobicContact CG1-CG 4.36Å; I246-P272 WeakPolarHBondContact O-CD 3.39Å | ||
| 247 | G | 95 | Very high | 79.4 | Confident | 11 Ų | 11 | 71.8 Ų | 71.8 | 11% | 0.113 | 40% | 0.404 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 173.2 | -177.8 | -173.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | L237 S245 Q270 | L237-G247 VanDerWaalsContact CB-C 3.48Å; L237-G247 VanDerWaalsContact CB-O 3.3Å; L237-G247 WeakPolarHBondContact CB-O 3.25Å; L237-G247 PolarHBondContact N-O 3.03Å; S245-G247 PolarHBondContact OG-O 3.2Å; G247-Q270 CarbonylContact C-O 3.6Å; G247-Q270 WeakPolarHBondContact CA-O 3.42Å |
| 248 | R | 94.9 | Very high | 76.4 | Confident | 100 Ų | 100 | 81 Ų | 81 | 38% | 0.377 | 44% | 0.444 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -161 | 157.3 | 179.5 | 57.4 | -176.5 | 155.6 | -176.7 | -6.9 | 112.7 | F235 I269 Q270 | F235-R248 CarbonylContact O-C 3.57Å; F235-R248 WeakPolarHBondContact O-CA 3.32Å; F235-R248 WeakPolarHBondContact O-CB 3.36Å; R248-I269 CarbonylContact O-C 3.52Å; R248-I269 WeakPolarHBondContact O-CA 3.46Å; R248-Q270 HydrophobicContact CG-CB 4.22Å; R248-Q270 PolarHBondContact N-O 3.01Å; R248-Q270 PolarHBondContact O-N 2.81Å |
| 249 | I | 94.3 | Very high | 74.1 | Confident | 3 Ų | 3 | 89.6 Ų | 89.6 | 2% | 0.015 | 48% | 0.483 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.1 | 122.5 | 162.7 | -58.3 | 179.9 | 0 | 0 | 0 | 107.3 | L220 F235 G268 I269 A286 C287 I290 | L220-I249 HydrophobicContact CD1-CD1 3.65Å; L220-I249 HydrophobicContact CD2-CD1 4.23Å; L220-I249 HydrophobicContact CD2-CG1 4.24Å; F235-I249 HydrophobicContact CB-CB 4.25Å; F235-I249 PolarHBondContact N-O 2.62Å; F235-I249 PolarHBondContact O-N 2.71Å; I249-G268 CarbonylContact C-O 3.53Å; I249-G268 VanDerWaalsContact CA-O 3.28Å; I249-G268 WeakPolarHBondContact CA-O 3.14Å; I249-I269 HydrophobicContact CG1-CG1 4.28Å; I249-I269 HydrophobicContact CG1-CG2 4.13Å; I249-I269 HydrophobicContact CG2-CG1 4.48Å; I249-A286 HydrophobicContact CD1-CB 4.11Å; I249-C287 HydrophobicContact CD1-CB 4.19Å; I249-C287 HydrophobicContact CG2-CB 4.11Å; I249-I290 HydrophobicContact CD1-CD1 4.29Å |
| 250 | S | 89.7 | Confident | 71.5 | Confident | 9 Ų | 9 | 92.8 Ų | 92.8 | 6% | 0.063 | 50% | 0.5 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.1 | 139.6 | -179.1 | 60 | 0 | 0 | 0 | 0 | 112 | V233 N234 F267 G268 | V233-S250 CarbonylContact O-C 3.54Å; V233-S250 VanDerWaalsContact O-CA 3.27Å; V233-S250 WeakPolarHBondContact O-CA 3.42Å; N234-S250 WeakPolarHBondContact OD1-CB 3.34Å; S250-F267 CarbonylContact O-C 3.56Å; S250-F267 VanDerWaalsContact O-CA 3.32Å; S250-F267 WeakPolarHBondContact O-CA 3.42Å; S250-G268 PolarHBondContact N-O 3.35Å; S250-G268 PolarHBondContact O-N 2.86Å |
| 251 | K | 83.8 | Confident | 68.8 | Low | 12 Ų | 12 | 96.5 Ų | 96.5 | 5% | 0.052 | 52% | 0.516 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.1 | 120.4 | 164.8 | -169.8 | -178.3 | -170.4 | -75.9 | 0 | 108.3 | D232 V233 D265 F267 F295 | D232-K251 WeakPolarHBondContact CA-O 3.48Å; V233-K251 HydrophobicContact CB-CB 4.4Å; V233-K251 PolarHBondContact N-O 2.81Å; V233-K251 PolarHBondContact O-N 2.86Å; K251-D265 IonicContact NZ-OD1 2.77Å; K251-D265 PolarHBondContact NZ-OD1 2.82Å; K251-F267 HydrophobicContact CB-CD1 3.88Å; K251-F267 HydrophobicContact CB-CE1 3.66Å; K251-F267 HydrophobicContact CB-CZ 4.37Å; K251-F267 HydrophobicContact CD-CE1 3.69Å; K251-F267 HydrophobicContact CD-CE2 4.45Å; K251-F267 HydrophobicContact CD-CZ 3.59Å; K251-F267 HydrophobicContact CG-CD1 4.1Å; K251-F267 HydrophobicContact CG-CE1 3.66Å; K251-F267 HydrophobicContact CG-CE2 4.47Å; K251-F267 HydrophobicContact CG-CZ 3.86Å; K251-F295 HydrophobicContact CB-CZ 4.33Å; K251-F295 HydrophobicContact CD-CD1 3.49Å; K251-F295 VanDerWaalsContact CD-CD1 3.49Å; K251-F295 HydrophobicContact CD-CD2 3.73Å; K251-F295 HydrophobicContact CD-CE1 3.38Å; K251-F295 HydrophobicContact CD-CE2 3.61Å; K251-F295 HydrophobicContact CD-CG 3.66Å; K251-F295 HydrophobicContact CD-CZ 3.42Å; K251-F295 VanDerWaalsContact CD-CZ 3.42Å |
| 252 | Q | 71.3 | Confident | 66.5 | Low | 96 Ų | 96 | 94.7 Ų | 94.7 | 45% | 0.449 | 51% | 0.51 | S | S | . | . | trans | -84.8 | 130.3 | 175.3 | -63.5 | -74.8 | -76.9 | 0 | 0 | 109.3 | D232 N266 | D232-Q252 WeakPolarHBondContact OD1-CA 3.46Å; D232-Q252 PolarHBondContact OD2-NE2 3.12Å; D232-Q252 PolarHBondContact OD2-OE1 2.98Å; Q252-N266 PolarHBondContact N-O 3.14Å | ||
| 253 | W | 56.6 | Low | 64.5 | Low | 128 Ų | 128 | 100.4 Ų | 100.4 | 49% | 0.485 | 53% | 0.533 | S | S | . | . | trans | -87.8 | 123.6 | 175.4 | -110.6 | 89.7 | 0 | 0 | 0 | 110 | G231 D232 G255 | G231-W253 VanDerWaalsContact O-CD1 3.22Å; D232-W253 PolarHBondContact OD1-N 3Å; W253-G255 PolarHBondContact O-N 3.12Å; W253-G255 VanDerWaalsContact O-N 3.1Å | ||
| 254 | S | 50.3 | Low | 62.9 | Low | 80 Ų | 80 | 99.3 Ų | 99.3 | 56% | 0.559 | 51% | 0.514 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68 | -4.6 | -179 | 46.1 | 0 | 0 | 0 | 0 | 115.1 | ||
| 255 | G | 46.6 | Very low | 61.4 | Low | 54 Ų | 54 | 93.8 Ų | 93.8 | 56% | 0.557 | 49% | 0.49 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.2 | -5 | -160.2 | 0 | 0 | 0 | 0 | 0 | 118.8 | W253 | W253-G255 PolarHBondContact O-N 3.12Å; W253-G255 VanDerWaalsContact O-N 3.1Å |
| 256 | L | 42.7 | Very low | 60.5 | Low | 158 Ų | 158 | 93 Ų | 93 | 83% | 0.827 | 48% | 0.482 | S | S | * | . | S | Bend | trans | -137.4 | 92.2 | 177.7 | -119 | 108.3 | 0 | 0 | 0 | 111.2 | ||
| 257 | L | 37.3 | Very low | 60.1 | Low | 160 Ų | 160 | 90.1 Ų | 90.1 | 84% | 0.838 | 47% | 0.467 | S | S | * | . | S | Bend | trans | 71.8 | 84.6 | 165.3 | -56.7 | 169.8 | 0 | 0 | 0 | 118 | ||
| 258 | K | 35.6 | Very low | 60 | Low | 195 Ų | 195 | 89.9 Ų | 89.9 | 85% | 0.848 | 46% | 0.464 | S | S | * | . | 179.4 | 100.1 | 112.7 | -97.8 | 171.4 | -179.4 | 177.4 | 0 | 111.5 | V260 | K258-V260 PolarHBondContact O-N 2.94Š| |||
| 259 | E | 46.1 | Very low | 60 | Low | 202 Ų | 202 | 85.1 Ų | 85.1 | 94% | 0.944 | 45% | 0.447 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.7 | 39.4 | 178.2 | -61.7 | 175.2 | 138 | 0 | 0 | 115.7 | ||
| 260 | V | 39.8 | Very low | 60.1 | Low | 115 Ų | 115 | 87.3 Ų | 87.3 | 70% | 0.697 | 46% | 0.457 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -134.4 | -13.1 | 176.3 | -171 | 0 | 0 | 0 | 0 | 114.8 | K258 | K258-V260 PolarHBondContact O-N 2.94Š|
| 261 | F | 32.5 | Very low | 60.4 | Low | 179 Ų | 179 | 87.3 Ų | 87.3 | 79% | 0.785 | 46% | 0.455 | S | S | * | . | S | Bend | trans | -137.5 | 99.8 | 176 | -75.6 | -83.1 | 0 | 0 | 0 | 113.2 | ||
| 262 | T | 39.8 | Very low | 61 | Low | 97 Ų | 97 | 88.4 Ų | 88.4 | 60% | 0.595 | 46% | 0.464 | S | S | * | . | trans | 65.9 | 101 | 153.1 | 52 | 0 | 0 | 0 | 0 | 118.7 | T264 | T262-T264 VanDerWaalsContact C-N 3.27Å; T262-T264 PolarHBondContact O-N 3.4Å | ||
| 263 | D | 37.6 | Very low | 62.1 | Low | 152 Ų | 152 | 87.7 Ų | 87.7 | 81% | 0.813 | 46% | 0.462 | S | S | * | . | trans | -67.1 | 65.4 | 168.7 | -162.2 | 17.8 | 0 | 0 | 0 | 112.5 | ||||
| 264 | T | 48.5 | Very low | 63.9 | Low | 44 Ų | 44 | 88.5 Ų | 88.5 | 27% | 0.27 | 48% | 0.475 | S | S | . | . | S | Bend | trans | -148.2 | 135.4 | 178 | -53.2 | 0 | 0 | 0 | 0 | 110.4 | Q102 T262 N266 | Q102-T264 WeakPolarHBondContact O-CG2 3.39Å; T262-T264 VanDerWaalsContact C-N 3.27Å; T262-T264 PolarHBondContact O-N 3.4Å; T264-N266 PolarHBondContact O-N 3.02Å; T264-N266 PolarHBondContact O-ND2 2.99Å; T264-N266 VanDerWaalsContact O-ND2 3.12Å; T264-N266 PolarHBondContact O-OD1 3.13Å |
| 265 | D | 57 | Low | 66 | Low | 60 Ų | 60 | 86 Ų | 86 | 32% | 0.321 | 46% | 0.456 | S | S | . | . | trans | -58.1 | 97.6 | 168.4 | -75.8 | -61 | 0 | 0 | 0 | 109.3 | K251 | K251-D265 IonicContact NZ-OD1 2.77Å; K251-D265 PolarHBondContact NZ-OD1 2.82Å | ||
| 266 | N | 75.3 | Confident | 68.3 | Low | 31 Ų | 31 | 86.9 Ų | 86.9 | 17% | 0.166 | 45% | 0.448 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.8 | 120.1 | -177.3 | -61.8 | -39.8 | 0 | 0 | 0 | 108.9 | I100 H101 Q252 T264 | I100-N266 WeakPolarHBondContact O-CA 2.91Å; H101-N266 PolarHBondContact CE1-OD1 3.31Å; H101-N266 PolarHBondContact ND1-OD1 2.95Å; Q252-N266 PolarHBondContact N-O 3.14Å; T264-N266 PolarHBondContact O-N 3.02Å; T264-N266 PolarHBondContact O-ND2 2.99Å; T264-N266 VanDerWaalsContact O-ND2 3.12Å; T264-N266 PolarHBondContact O-OD1 3.13Å |
| 267 | F | 88.1 | Confident | 70.8 | Confident | 6 Ų | 6 | 79.9 Ų | 79.9 | 3% | 0.026 | 41% | 0.411 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.2 | 137.2 | 168.5 | -66.7 | -94.3 | 0 | 0 | 0 | 110 | L99 I100 S250 K251 C287 D291 F295 | L99-F267 CarbonylContact C-O 3.55Å; L99-F267 WeakPolarHBondContact CA-O 3.36Å; I100-F267 HydrophobicContact CB-CB 4.22Å; I100-F267 PolarHBondContact N-O 3.4Å; I100-F267 PolarHBondContact O-N 2.93Å; S250-F267 CarbonylContact O-C 3.56Å; S250-F267 VanDerWaalsContact O-CA 3.32Å; S250-F267 WeakPolarHBondContact O-CA 3.42Å; K251-F267 HydrophobicContact CB-CD1 3.88Å; K251-F267 HydrophobicContact CB-CE1 3.66Å; K251-F267 HydrophobicContact CB-CZ 4.37Å; K251-F267 HydrophobicContact CD-CE1 3.69Å; K251-F267 HydrophobicContact CD-CE2 4.45Å; K251-F267 HydrophobicContact CD-CZ 3.59Å; K251-F267 HydrophobicContact CG-CD1 4.1Å; K251-F267 HydrophobicContact CG-CE1 3.66Å; K251-F267 HydrophobicContact CG-CE2 4.47Å; K251-F267 HydrophobicContact CG-CZ 3.86Å; F267-C287 VanDerWaalsContact CB-SG 3.51Å; F267-D291 HydrophobicContact CE1-CB 4.3Å; F267-D291 HydrophobicContact CE2-CB 4.04Å; F267-D291 WeakPolarHBondContact CE2-OD1 3.48Å; F267-D291 HydrophobicContact CZ-CB 3.69Å; F267-D291 WeakPolarHBondContact CZ-OD1 3.37Å; F267-F295 HydrophobicContact CE1-CD2 4.22Å; F267-F295 HydrophobicContact CE1-CE2 4.27Å; F267-F295 HydrophobicContact CZ-CD2 4.1Å |
| 268 | G | 91.9 | Very high | 73.6 | Confident | 6 Ų | 6 | 75.5 Ų | 75.5 | 6% | 0.062 | 39% | 0.385 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.7 | 134.5 | 172.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | I98 I249 S250 | I98-G268 WeakPolarHBondContact O-CA 3.22Å; I249-G268 CarbonylContact C-O 3.53Å; I249-G268 VanDerWaalsContact CA-O 3.28Å; I249-G268 WeakPolarHBondContact CA-O 3.14Å; S250-G268 PolarHBondContact N-O 3.35Å; S250-G268 PolarHBondContact O-N 2.86Å |
| 269 | I | 95.5 | Very high | 76.6 | Confident | 1 Ų | 1 | 66.5 Ų | 66.5 | 1% | 0.005 | 35% | 0.347 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.2 | 126 | 172.2 | -50.6 | 175.1 | 0 | 0 | 0 | 107.3 | Q97 I98 I100 R248 I249 F271 L283 M284 C287 | Q97-I269 CarbonylContact C-O 3.54Å; Q97-I269 VanDerWaalsContact CA-O 3.26Å; Q97-I269 WeakPolarHBondContact CA-O 3.25Å; I98-I269 HydrophobicContact CB-CB 4.3Å; I98-I269 PolarHBondContact N-O 3.02Å; I98-I269 PolarHBondContact O-N 2.85Å; I100-I269 HydrophobicContact CD1-CD1 3.96Å; R248-I269 CarbonylContact O-C 3.52Å; R248-I269 WeakPolarHBondContact O-CA 3.46Å; I249-I269 HydrophobicContact CG1-CG1 4.28Å; I249-I269 HydrophobicContact CG1-CG2 4.13Å; I249-I269 HydrophobicContact CG2-CG1 4.48Å; I269-F271 HydrophobicContact CB-CE1 4.48Å; I269-F271 HydrophobicContact CG2-CD1 3.61Å; I269-F271 HydrophobicContact CG2-CE1 3.74Å; I269-L283 HydrophobicContact CG2-CB 4.28Å; I269-M284 HydrophobicContact CD1-CB 4.41Å; I269-M284 HydrophobicContact CD1-CG 4.07Å; I269-C287 HydrophobicContact CD1-CB 3.56Å; I269-C287 HydrophobicContact CG1-CB 4.05Å |
| 270 | Q | 95.8 | Very high | 79 | Confident | 49 Ų | 49 | 56.9 Ų | 56.9 | 23% | 0.229 | 30% | 0.302 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.1 | 132.9 | 177.2 | -70 | 156.4 | 43.5 | 0 | 0 | 108.6 | D96 Q97 G247 R248 | D96-Q270 WeakPolarHBondContact O-CA 3.42Å; Q97-Q270 HydrophobicContact CG-CG 4.05Å; G247-Q270 CarbonylContact C-O 3.6Å; G247-Q270 WeakPolarHBondContact CA-O 3.42Å; R248-Q270 HydrophobicContact CG-CB 4.22Å; R248-Q270 PolarHBondContact N-O 3.01Å; R248-Q270 PolarHBondContact O-N 2.81Å |
| 271 | F | 96.3 | Very high | 81.7 | Confident | 8 Ų | 8 | 51.4 Ų | 51.4 | 4% | 0.035 | 27% | 0.268 | C | S | . | . | trans | -151 | 164.6 | 178.9 | 42.6 | -112.6 | 0 | 0 | 0 | 110.3 | I95 D96 I98 L237 I269 L275 K280 L283 | I95-F271 WeakPolarHBondContact O-CE2 3.07Å; D96-F271 WeakPolarHBondContact CB-O 3.42Å; D96-F271 WeakPolarHBondContact O-CD2 3.18Å; D96-F271 PolarHBondContact O-N 3.27Å; D96-F271 VanDerWaalsContact O-O 3.08Å; I98-F271 HydrophobicContact CD1-CE1 3.93Å; I98-F271 HydrophobicContact CD1-CZ 3.81Å; I98-F271 HydrophobicContact CG1-CE1 4.22Å; I98-F271 HydrophobicContact CG1-CZ 3.95Å; L237-F271 HydrophobicContact CD2-CB 4.21Å; I269-F271 HydrophobicContact CB-CE1 4.48Å; I269-F271 HydrophobicContact CG2-CD1 3.61Å; I269-F271 HydrophobicContact CG2-CE1 3.74Å; F271-L275 HydrophobicContact CB-CD2 3.74Å; F271-L275 HydrophobicContact CG-CD2 4.18Å; F271-K280 HydrophobicContact CD1-CG 4.33Å; F271-K280 HydrophobicContact CD2-CD 3.83Å; F271-K280 VanDerWaalsContact CD2-CE 3.49Å; F271-K280 HydrophobicContact CD2-CG 3.82Å; F271-K280 HydrophobicContact CE1-CB 4.19Å; F271-K280 HydrophobicContact CE1-CG 4.15Å; F271-K280 HydrophobicContact CE2-CB 4.36Å; F271-K280 HydrophobicContact CE2-CD 3.3Å; F271-K280 HydrophobicContact CE2-CG 3.61Å; F271-K280 HydrophobicContact CG-CG 4.2Å; F271-K280 HydrophobicContact CZ-CB 4.03Å; F271-K280 HydrophobicContact CZ-CD 3.74Å; F271-K280 HydrophobicContact CZ-CG 3.79Å; F271-L283 HydrophobicContact CB-CD1 4.05Å; F271-L283 HydrophobicContact CD1-CD1 3.83Å; F271-L283 HydrophobicContact CG-CD1 4.28Å | ||
| 272 | P | 95.9 | Very high | 84.9 | Confident | 36 Ų | 36 | 42.9 Ų | 42.9 | 23% | 0.234 | 23% | 0.231 | C | C | . | . | trans | -59.4 | 142.8 | 176.3 | -24.2 | 35.7 | 0 | 0 | 0 | 112.4 | I246 D274 L275 | I246-P272 HydrophobicContact CB-CG 4.06Å; I246-P272 HydrophobicContact CD1-CG 4.16Å; I246-P272 HydrophobicContact CG1-CG 4.36Å; I246-P272 WeakPolarHBondContact O-CD 3.39Å; P272-D274 WeakPolarHBondContact CB-OD1 3.17Å; P272-D274 PolarHBondContact O-N 3.02Å; P272-L275 HydrophobicContact CB-CB 4.42Å; P272-L275 VanDerWaalsContact O-CB 3.25Å; P272-L275 WeakPolarHBondContact O-CB 3.35Å; P272-L275 PolarHBondContact O-N 3.42Å; P272-L275 VanDerWaalsContact O-N 3.1Å | ||
| 273 | M | 94.4 | Very high | 87.6 | Confident | 81 Ų | 81 | 38.3 Ų | 38.3 | 40% | 0.399 | 20% | 0.203 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -55.7 | -40.6 | 179.4 | -177.6 | 66.1 | -90.2 | 0 | 0 | 111.6 | T93 Q94 I95 D96 L275 K280 | T93-M273 WeakPolarHBondContact O-CE 3.5Å; Q94-M273 VanDerWaalsContact C-CE 3.49Å; I95-M273 VanDerWaalsContact C-CE 3.49Å; I95-M273 VanDerWaalsContact N-CE 3.32Å; I95-M273 WeakPolarHBondContact O-CE 3.43Å; D96-M273 HydrophobicContact CB-CB 4.34Å; D96-M273 HydrophobicContact CB-SD 4.44Å; M273-L275 VanDerWaalsContact C-N 3.34Å; M273-L275 PolarHBondContact O-N 2.97Å; M273-K280 PolarHBondContact O-NZ 2.8Å |
| 274 | D | 94 | Very high | 90.4 | Very high | 145 Ų | 145 | 31.1 Ų | 31.1 | 78% | 0.775 | 16% | 0.164 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -84.8 | 2.5 | -178.6 | 64.4 | -31 | 0 | 0 | 0 | 114.6 | P272 | P272-D274 WeakPolarHBondContact CB-OD1 3.17Å; P272-D274 PolarHBondContact O-N 3.02Å |
| 275 | L | 95.3 | Very high | 92.7 | Very high | 28 Ų | 28 | 29 Ų | 29 | 15% | 0.147 | 15% | 0.151 | C | C | . | . | S | Bend | trans | -60.5 | 139.5 | 176.7 | -176.8 | 65 | 0 | 0 | 0 | 111 | L218 F271 P272 M273 V277 M279 K280 L283 | L218-L275 HydrophobicContact CD1-CD1 4.06Å; L218-L275 HydrophobicContact CD1-CD2 4.08Å; L218-L275 HydrophobicContact CD2-CD1 4.47Å; F271-L275 HydrophobicContact CB-CD2 3.74Å; F271-L275 HydrophobicContact CG-CD2 4.18Å; P272-L275 HydrophobicContact CB-CB 4.42Å; P272-L275 VanDerWaalsContact O-CB 3.25Å; P272-L275 WeakPolarHBondContact O-CB 3.35Å; P272-L275 PolarHBondContact O-N 3.42Å; P272-L275 VanDerWaalsContact O-N 3.1Å; M273-L275 VanDerWaalsContact C-N 3.34Å; M273-L275 PolarHBondContact O-N 2.97Å; L275-V277 PolarHBondContact O-N 3.01Å; L275-M279 HydrophobicContact CD1-CB 4.2Å; L275-M279 HydrophobicContact CD2-CB 4.27Å; L275-M279 HydrophobicContact CG-CB 4.15Å; L275-K280 HydrophobicContact CB-CG 4.33Å; L275-K280 HydrophobicContact CD2-CG 4.08Å; L275-K280 HydrophobicContact CG-CG 4.28Å; L275-K280 WeakPolarHBondContact O-CE 3.32Å; L275-L283 HydrophobicContact CD2-CD1 3.66Å |
| 276 | D | 94.8 | Very high | 94.5 | Very high | 72 Ų | 72 | 26.1 Ų | 26.1 | 39% | 0.385 | 14% | 0.136 | S | C | . | . | trans | -50.8 | 127 | 175.5 | -177.1 | -11.6 | 0 | 0 | 0 | 110.2 | K278 M279 K280 | D276-K278 PolarHBondContact O-N 3.36Å; D276-K278 WeakPolarHBondContact OD1-CE 3.36Å; D276-K278 PolarHBondContact OD1-N 2.82Å; D276-K278 WeakPolarHBondContact OD2-CE 3.11Å; D276-K278 IonicContact OD2-NZ 3.69Å; D276-M279 HydrophobicContact CB-CB 4.42Å; D276-M279 HydrophobicContact CB-CG 4.09Å; D276-M279 WeakPolarHBondContact O-CA 3.06Å; D276-M279 WeakPolarHBondContact O-CB 3.46Å; D276-M279 PolarHBondContact O-N 3.24Å; D276-K280 PolarHBondContact O-N 2.8Å | ||
| 277 | V | 95.8 | Very high | 95.4 | Very high | 10 Ų | 10 | 24.8 Ų | 24.8 | 6% | 0.061 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -54.3 | -35.5 | 179.5 | 171.1 | 0 | 0 | 0 | 0 | 112 | V85 L89 L92 T93 L275 M279 K280 A281 | V85-V277 HydrophobicContact CG1-CB 4.42Å; V85-V277 HydrophobicContact CG1-CG1 3.95Å; V85-V277 HydrophobicContact CG1-CG2 4.45Å; V85-V277 HydrophobicContact CG2-CG2 4.24Å; L89-V277 HydrophobicContact CB-CG1 3.57Å; L89-V277 HydrophobicContact CD2-CG1 4.02Å; L89-V277 HydrophobicContact CG-CG1 4.38Å; L92-V277 HydrophobicContact CB-CG1 3.94Å; L92-V277 HydrophobicContact CB-CG2 4.41Å; L92-V277 HydrophobicContact CD1-CG1 4.16Å; T93-V277 HydrophobicContact CG2-CG2 3.48Å; T93-V277 VanDerWaalsContact CG2-CG2 3.48Å; L275-V277 PolarHBondContact O-N 3.01Å; V277-M279 VanDerWaalsContact C-N 3.32Å; V277-M279 PolarHBondContact O-N 2.67Å; V277-K280 WeakPolarHBondContact O-CB 3.49Å; V277-K280 PolarHBondContact O-N 2.97Å; V277-A281 PolarHBondContact O-N 2.87Å |
| 278 | K | 96.4 | Very high | 95.6 | Very high | 68 Ų | 68 | 24.7 Ų | 24.7 | 30% | 0.296 | 13% | 0.128 | S | C | . | . | H | α-helix | trans | -61.9 | -41.9 | 174.3 | -70.2 | 176 | -68.3 | 179.4 | 0 | 111 | P86 V193 D276 A281 V282 | P86-K278 HydrophobicContact CG-CG 4.07Å; V193-K278 HydrophobicContact CB-CB 4.15Å; V193-K278 HydrophobicContact CB-CD 4.37Å; V193-K278 HydrophobicContact CB-CG 4.1Å; V193-K278 HydrophobicContact CG1-CD 4.23Å; V193-K278 HydrophobicContact CG1-CG 4.05Å; D276-K278 PolarHBondContact O-N 3.36Å; D276-K278 WeakPolarHBondContact OD1-CE 3.36Å; D276-K278 PolarHBondContact OD1-N 2.82Å; D276-K278 WeakPolarHBondContact OD2-CE 3.11Å; D276-K278 IonicContact OD2-NZ 3.69Å; K278-A281 WeakPolarHBondContact O-CB 3.1Å; K278-A281 PolarHBondContact O-N 3.15Å; K278-V282 WeakPolarHBondContact O-CG2 3.42Å; K278-V282 PolarHBondContact O-N 3.12Å |
| 279 | M | 96.9 | Very high | 95.5 | Very high | 7 Ų | 7 | 24.4 Ų | 24.4 | 3% | 0.034 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -70.9 | -34.2 | 178 | -61.1 | -59.8 | 98.6 | 0 | 0 | 111.7 | I209 M217 L218 L275 D276 V277 A281 V282 L283 | I209-M279 HydrophobicContact CG2-SD 4.23Å; M217-M279 HydrophobicContact CB-SD 3.99Å; M217-M279 HydrophobicContact CG-SD 3.98Å; L218-M279 HydrophobicContact CD1-CB 4.34Å; L275-M279 HydrophobicContact CD1-CB 4.2Å; L275-M279 HydrophobicContact CD2-CB 4.27Å; L275-M279 HydrophobicContact CG-CB 4.15Å; D276-M279 HydrophobicContact CB-CB 4.42Å; D276-M279 HydrophobicContact CB-CG 4.09Å; D276-M279 WeakPolarHBondContact O-CA 3.06Å; D276-M279 WeakPolarHBondContact O-CB 3.46Å; D276-M279 PolarHBondContact O-N 3.24Å; V277-M279 VanDerWaalsContact C-N 3.32Å; V277-M279 PolarHBondContact O-N 2.67Å; M279-A281 VanDerWaalsContact C-N 3.28Å; M279-A281 PolarHBondContact O-N 3.31Å; M279-V282 HydrophobicContact CE-CG2 4.04Å; M279-V282 PolarHBondContact O-N 2.87Å; M279-L283 WeakPolarHBondContact O-CG 2.95Å; M279-L283 PolarHBondContact O-N 3.45Å |
| 280 | K | 97.4 | Very high | 95.1 | Very high | 0 Ų | 0 | 24.4 Ų | 24.4 | 0% | 0 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -58.4 | -40.9 | 169.4 | -63.1 | -179.4 | 178.4 | -174.9 | 0 | 111.4 | L92 I95 F271 M273 L275 D276 V277 L283 M284 | L92-K280 HydrophobicContact CB-CD 4.26Å; L92-K280 HydrophobicContact CD1-CB 4.4Å; L92-K280 WeakPolarHBondContact O-CD 3.49Å; L92-K280 PolarHBondContact O-NZ 3.31Å; I95-K280 PolarHBondContact O-NZ 3.2Å; F271-K280 HydrophobicContact CD1-CG 4.33Å; F271-K280 HydrophobicContact CD2-CD 3.83Å; F271-K280 VanDerWaalsContact CD2-CE 3.49Å; F271-K280 HydrophobicContact CD2-CG 3.82Å; F271-K280 HydrophobicContact CE1-CB 4.19Å; F271-K280 HydrophobicContact CE1-CG 4.15Å; F271-K280 HydrophobicContact CE2-CB 4.36Å; F271-K280 HydrophobicContact CE2-CD 3.3Å; F271-K280 HydrophobicContact CE2-CG 3.61Å; F271-K280 HydrophobicContact CG-CG 4.2Å; F271-K280 HydrophobicContact CZ-CB 4.03Å; F271-K280 HydrophobicContact CZ-CD 3.74Å; F271-K280 HydrophobicContact CZ-CG 3.79Å; M273-K280 PolarHBondContact O-NZ 2.8Å; L275-K280 HydrophobicContact CB-CG 4.33Å; L275-K280 HydrophobicContact CD2-CG 4.08Å; L275-K280 HydrophobicContact CG-CG 4.28Å; L275-K280 WeakPolarHBondContact O-CE 3.32Å; D276-K280 PolarHBondContact O-N 2.8Å; V277-K280 WeakPolarHBondContact O-CB 3.49Å; V277-K280 PolarHBondContact O-N 2.97Å; K280-L283 PolarHBondContact O-N 3.19Å; K280-M284 PolarHBondContact O-N 3.1Å |
| 281 | A | 97.4 | Very high | 94.6 | Very high | 0 Ų | 0 | 22.5 Ų | 22.5 | 0% | 0 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -64.7 | -42 | 174 | 0 | 0 | 0 | 0 | 0 | 112.6 | L89 I163 V185 V277 K278 M279 L283 M284 G285 | L89-A281 HydrophobicContact CD2-CB 3.85Å; I163-A281 HydrophobicContact CD1-CB 3.78Å; I163-A281 HydrophobicContact CG1-CB 4.43Å; V185-A281 HydrophobicContact CG1-CB 4.43Å; V277-A281 PolarHBondContact O-N 2.87Å; K278-A281 WeakPolarHBondContact O-CB 3.1Å; K278-A281 PolarHBondContact O-N 3.15Å; M279-A281 VanDerWaalsContact C-N 3.28Å; M279-A281 PolarHBondContact O-N 3.31Å; A281-L283 VanDerWaalsContact C-N 3.31Å; A281-L283 PolarHBondContact O-N 2.65Å; A281-M284 HydrophobicContact CB-CE 4.21Å; A281-M284 WeakPolarHBondContact O-CB 3.32Å; A281-M284 PolarHBondContact O-N 3.4Å; A281-G285 PolarHBondContact O-N 2.7Å; A281-G285 VanDerWaalsContact O-N 3.09Å |
| 282 | V | 97.9 | Very high | 93.7 | Very high | 0 Ų | 0 | 22.3 Ų | 22.3 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -64.6 | -35.9 | 176 | -175.9 | 0 | 0 | 0 | 0 | 111.5 | V185 V193 V196 I209 K278 M279 G285 A286 | V185-V282 HydrophobicContact CB-CG2 4.18Å; V185-V282 HydrophobicContact CG1-CG2 4.46Å; V185-V282 HydrophobicContact CG2-CG1 4.35Å; V185-V282 HydrophobicContact CG2-CG2 4.47Å; V193-V282 HydrophobicContact CG2-CG2 4.33Å; V196-V282 HydrophobicContact CG2-CG1 3.61Å; V196-V282 WeakPolarHBondContact CG2-O 3.48Å; I209-V282 HydrophobicContact CG2-CB 4.09Å; I209-V282 HydrophobicContact CG2-CG1 3.68Å; K278-V282 WeakPolarHBondContact O-CG2 3.42Å; K278-V282 PolarHBondContact O-N 3.12Å; M279-V282 HydrophobicContact CE-CG2 4.04Å; M279-V282 PolarHBondContact O-N 2.87Å; V282-G285 CarbonylContact O-C 3.53Å; V282-G285 WeakPolarHBondContact O-CA 3.46Å; V282-G285 PolarHBondContact O-N 3.17Å; V282-G285 VanDerWaalsContact O-N 3.13Å; V282-A286 PolarHBondContact O-N 3.26Å |
| 283 | L | 97.9 | Very high | 92.8 | Very high | 1 Ų | 1 | 21.8 Ų | 21.8 | 1% | 0.005 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -66.9 | -38.4 | 174.9 | -71.4 | 171.9 | 0 | 0 | 0 | 113.1 | I209 L218 L220 L237 I269 F271 L275 M279 K280 A281 G285 A286 C287 | I209-L283 HydrophobicContact CD1-CD2 4.12Å; I209-L283 HydrophobicContact CG1-CD2 3.96Å; L218-L283 HydrophobicContact CD1-CD1 4.33Å; L220-L283 HydrophobicContact CD1-CD2 4.16Å; L237-L283 HydrophobicContact CD1-CD2 3.66Å; L237-L283 HydrophobicContact CD2-CD1 3.75Å; L237-L283 HydrophobicContact CD2-CD2 4.26Å; I269-L283 HydrophobicContact CG2-CB 4.28Å; F271-L283 HydrophobicContact CB-CD1 4.05Å; F271-L283 HydrophobicContact CD1-CD1 3.83Å; F271-L283 HydrophobicContact CG-CD1 4.28Å; L275-L283 HydrophobicContact CD2-CD1 3.66Å; M279-L283 WeakPolarHBondContact O-CG 2.95Å; M279-L283 PolarHBondContact O-N 3.45Å; K280-L283 PolarHBondContact O-N 3.19Å; A281-L283 VanDerWaalsContact C-N 3.31Å; A281-L283 PolarHBondContact O-N 2.65Å; L283-G285 PolarHBondContact O-N 2.72Å; L283-A286 WeakPolarHBondContact O-CB 2.97Å; L283-A286 PolarHBondContact O-N 2.89Å; L283-A286 VanDerWaalsContact O-N 3.14Å; L283-C287 PolarHBondContact O-N 2.97Å |
| 284 | M | 96.7 | Very high | 91.8 | Very high | 0 Ų | 0 | 20.3 Ų | 20.3 | 0% | 0 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -57.2 | -43.2 | 168.5 | -73.7 | -171.7 | -75 | 0 | 0 | 110.6 | L92 I98 I121 I163 I269 K280 A281 C287 F288 | L92-M284 HydrophobicContact CD1-CE 3.69Å; L92-M284 HydrophobicContact CD2-CE 4.46Å; I98-M284 HydrophobicContact CD1-CE 4.38Å; I98-M284 HydrophobicContact CD1-CG 3.66Å; I98-M284 HydrophobicContact CD1-SD 3.6Å; I121-M284 HydrophobicContact CD1-SD 4.32Å; I121-M284 HydrophobicContact CG2-SD 4.39Å; I163-M284 HydrophobicContact CD1-CE 3.35Å; I269-M284 HydrophobicContact CD1-CB 4.41Å; I269-M284 HydrophobicContact CD1-CG 4.07Å; K280-M284 PolarHBondContact O-N 3.1Å; A281-M284 HydrophobicContact CB-CE 4.21Å; A281-M284 WeakPolarHBondContact O-CB 3.32Å; A281-M284 PolarHBondContact O-N 3.4Å; M284-C287 WeakPolarHBondContact O-CB 3.39Å; M284-C287 PolarHBondContact O-N 3.3Å; M284-F288 VanDerWaalsContact O-CD2 3.27Å; M284-F288 WeakPolarHBondContact O-CD2 3.22Å; M284-F288 PolarHBondContact O-N 2.77Å |
| 285 | G | 95.7 | Very high | 90.6 | Very high | 0 Ų | 0 | 14.9 Ų | 14.9 | 0% | 0 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -56.3 | -49.9 | 171.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | M183 A281 V282 L283 C287 F288 L289 | M183-G285 WeakPolarHBondContact CE-O 3.44Å; A281-G285 PolarHBondContact O-N 2.7Å; A281-G285 VanDerWaalsContact O-N 3.09Å; V282-G285 CarbonylContact O-C 3.53Å; V282-G285 WeakPolarHBondContact O-CA 3.46Å; V282-G285 PolarHBondContact O-N 3.17Å; V282-G285 VanDerWaalsContact O-N 3.13Å; L283-G285 PolarHBondContact O-N 2.72Å; G285-C287 PolarHBondContact O-N 2.8Å; G285-F288 PolarHBondContact O-N 3.26Å; G285-F288 VanDerWaalsContact O-N 3.12Å; G285-L289 PolarHBondContact O-N 3.31Å |
| 286 | A | 96.1 | Very high | 89.1 | Confident | 0 Ų | 0 | 15.9 Ų | 15.9 | 0% | 0 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -58.2 | -38.2 | -179.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | V196 I209 L220 I249 V282 L283 L289 I290 | V196-A286 HydrophobicContact CB-CB 4.5Å; V196-A286 HydrophobicContact CG1-CB 3.81Å; V196-A286 HydrophobicContact CG2-CB 3.84Å; I209-A286 HydrophobicContact CD1-CB 3.83Å; L220-A286 HydrophobicContact CD1-CB 3.72Å; I249-A286 HydrophobicContact CD1-CB 4.11Å; V282-A286 PolarHBondContact O-N 3.26Å; L283-A286 WeakPolarHBondContact O-CB 2.97Å; L283-A286 PolarHBondContact O-N 2.89Å; L283-A286 VanDerWaalsContact O-N 3.14Å; A286-L289 PolarHBondContact O-N 2.77Å; A286-I290 WeakPolarHBondContact O-CB 3.43Å; A286-I290 WeakPolarHBondContact O-CD1 3.48Å; A286-I290 VanDerWaalsContact O-CG1 3.22Å; A286-I290 WeakPolarHBondContact O-CG1 2.99Å; A286-I290 PolarHBondContact O-N 2.6Å |
| 287 | C | 94.3 | Very high | 86.8 | Confident | 2 Ų | 2 | 17.9 Ų | 17.9 | 1% | 0.014 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -59.5 | -48.6 | 175 | -169.4 | 0 | 0 | 0 | 0 | 112.3 | I100 I249 F267 I269 L283 M284 G285 L289 I290 D291 | I100-C287 HydrophobicContact CD1-CB 4.15Å; I249-C287 HydrophobicContact CD1-CB 4.19Å; I249-C287 HydrophobicContact CG2-CB 4.11Å; F267-C287 VanDerWaalsContact CB-SG 3.51Å; I269-C287 HydrophobicContact CD1-CB 3.56Å; I269-C287 HydrophobicContact CG1-CB 4.05Å; L283-C287 PolarHBondContact O-N 2.97Å; M284-C287 WeakPolarHBondContact O-CB 3.39Å; M284-C287 PolarHBondContact O-N 3.3Å; G285-C287 PolarHBondContact O-N 2.8Å; C287-L289 VanDerWaalsContact C-N 3.35Å; C287-L289 PolarHBondContact O-N 3.4Å; C287-I290 PolarHBondContact O-N 3.08Å; C287-D291 PolarHBondContact O-N 3.34Å |
| 288 | F | 91.9 | Very high | 84.4 | Confident | 4 Ų | 4 | 20.5 Ų | 20.5 | 2% | 0.018 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -66.3 | -35.8 | 177.2 | -76.2 | -67 | 0 | 0 | 0 | 112.7 | I100 Y119 I121 A132 F150 M152 I154 L165 M284 G285 I290 D291 F292 | I100-F288 HydrophobicContact CD1-CD2 4.44Å; I100-F288 HydrophobicContact CD1-CE2 3.88Å; I100-F288 HydrophobicContact CD1-CZ 3.98Å; I100-F288 HydrophobicContact CG2-CE1 3.93Å; I100-F288 HydrophobicContact CG2-CZ 3.77Å; Y119-F288 AromaticContact CD1-CE1 3.97Å; Y119-F288 HydrophobicContact CD1-CE1 3.97Å; Y119-F288 AromaticContact CD2-CE1 3.74Å; Y119-F288 HydrophobicContact CD2-CE1 3.74Å; Y119-F288 HydrophobicContact CD2-CZ 4.44Å; Y119-F288 HydrophobicContact CE1-CE1 4.2Å; Y119-F288 HydrophobicContact CE2-CE1 4.01Å; Y119-F288 AromaticContact CG-CE1 3.72Å; Y119-F288 HydrophobicContact CG-CE1 3.72Å; Y119-F288 HydrophobicContact CG-CZ 4.28Å; I121-F288 HydrophobicContact CD1-CE2 4.24Å; I121-F288 HydrophobicContact CD1-CZ 4.38Å; A132-F288 HydrophobicContact CB-CE1 4.41Å; A132-F288 HydrophobicContact CB-CE2 4.29Å; A132-F288 HydrophobicContact CB-CZ 3.72Å; F150-F288 HydrophobicContact CZ-CB 4.07Å; M152-F288 HydrophobicContact CE-CD1 3.85Å; M152-F288 HydrophobicContact CE-CE1 4.01Å; M152-F288 HydrophobicContact CE-CG 4.47Å; M152-F288 HydrophobicContact SD-CB 4.5Å; M152-F288 HydrophobicContact SD-CD1 3.55Å; M152-F288 VanDerWaalsContact SD-CD1 3.55Å; M152-F288 HydrophobicContact SD-CD2 3.95Å; M152-F288 HydrophobicContact SD-CE1 3.58Å; M152-F288 VanDerWaalsContact SD-CE1 3.58Å; M152-F288 HydrophobicContact SD-CE2 3.97Å; M152-F288 HydrophobicContact SD-CG 3.74Å; M152-F288 HydrophobicContact SD-CZ 3.79Å; I154-F288 HydrophobicContact CD1-CE2 4.14Å; L165-F288 HydrophobicContact CD1-CB 4.04Å; L165-F288 HydrophobicContact CD1-CD2 3.58Å; L165-F288 HydrophobicContact CD1-CE2 4.39Å; L165-F288 HydrophobicContact CD1-CG 4.09Å; M284-F288 VanDerWaalsContact O-CD2 3.27Å; M284-F288 WeakPolarHBondContact O-CD2 3.22Å; M284-F288 PolarHBondContact O-N 2.77Å; G285-F288 PolarHBondContact O-N 3.26Å; G285-F288 VanDerWaalsContact O-N 3.12Å; F288-I290 VanDerWaalsContact C-N 3.35Å; F288-D291 PolarHBondContact O-N 3.47Å; F288-F292 WeakPolarHBondContact O-CB 3.47Å; F288-F292 PolarHBondContact O-N 3.32Å |
| 289 | L | 89.4 | Confident | 81.7 | Confident | 1 Ų | 1 | 19.3 Ų | 19.3 | 1% | 0.005 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -64.5 | -40.8 | 174.9 | -177.6 | 61.1 | 0 | 0 | 0 | 111.6 | Q181 M183 V196 F207 G285 A286 C287 M293 | Q181-L289 HydrophobicContact CB-CD1 4.32Å; Q181-L289 HydrophobicContact CB-CD2 4.5Å; M183-L289 HydrophobicContact CB-CD1 4.46Å; M183-L289 HydrophobicContact CB-CD2 4.06Å; M183-L289 HydrophobicContact CE-CB 4.2Å; M183-L289 HydrophobicContact SD-CB 4.15Å; V196-L289 HydrophobicContact CB-CD2 4.12Å; V196-L289 HydrophobicContact CG1-CD2 3.76Å; F207-L289 HydrophobicContact CE1-CD2 4.33Å; G285-L289 PolarHBondContact O-N 3.31Å; A286-L289 PolarHBondContact O-N 2.77Å; C287-L289 VanDerWaalsContact C-N 3.35Å; C287-L289 PolarHBondContact O-N 3.4Å; L289-M293 HydrophobicContact CD1-CG 4.15Å; L289-M293 HydrophobicContact CD1-SD 3.96Å; L289-M293 HydrophobicContact CD2-SD 4.36Å; L289-M293 HydrophobicContact CG-CG 4.41Å; L289-M293 HydrophobicContact CG-SD 3.79Å; L289-M293 WeakPolarHBondContact O-CB 3.4Å; L289-M293 WeakPolarHBondContact O-CG 2.94Å; L289-M293 PolarHBondContact O-N 3.41Å |
| 290 | I | 87.6 | Confident | 79 | Confident | 1 Ų | 1 | 23.9 Ų | 23.9 | 1% | 0.005 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -63.1 | -46.2 | 175.2 | -72.7 | 163.9 | 0 | 0 | 0 | 110.6 | F207 F235 I249 A286 C287 F288 M293 F294 F295 | F207-I290 HydrophobicContact CE2-CD1 4.39Å; F207-I290 HydrophobicContact CE2-CG1 3.98Å; F207-I290 HydrophobicContact CZ-CG1 4.1Å; F235-I290 HydrophobicContact CD1-CD1 3.88Å; F235-I290 HydrophobicContact CD2-CD1 4.11Å; F235-I290 HydrophobicContact CD2-CG2 4.18Å; F235-I290 HydrophobicContact CE1-CD1 4.08Å; F235-I290 HydrophobicContact CE1-CG1 4.26Å; F235-I290 HydrophobicContact CE1-CG2 4.36Å; F235-I290 HydrophobicContact CE2-CD1 4.29Å; F235-I290 HydrophobicContact CE2-CG2 3.46Å; F235-I290 VanDerWaalsContact CE2-CG2 3.46Å; F235-I290 HydrophobicContact CG-CD1 3.91Å; F235-I290 HydrophobicContact CZ-CD1 4.29Å; F235-I290 HydrophobicContact CZ-CG1 4.29Å; F235-I290 HydrophobicContact CZ-CG2 3.58Å; I249-I290 HydrophobicContact CD1-CD1 4.29Å; A286-I290 WeakPolarHBondContact O-CB 3.43Å; A286-I290 WeakPolarHBondContact O-CD1 3.48Å; A286-I290 VanDerWaalsContact O-CG1 3.22Å; A286-I290 WeakPolarHBondContact O-CG1 2.99Å; A286-I290 PolarHBondContact O-N 2.6Å; C287-I290 PolarHBondContact O-N 3.08Å; F288-I290 VanDerWaalsContact C-N 3.35Å; I290-M293 PolarHBondContact O-N 2.97Å; I290-F294 HydrophobicContact CG2-CD2 4.1Å; I290-F294 WeakPolarHBondContact O-CD2 3.16Å; I290-F294 PolarHBondContact O-N 3.35Å; I290-F295 HydrophobicContact CG2-CE2 4.11Å |
| 291 | D | 83.8 | Confident | 76.1 | Confident | 9 Ų | 9 | 27 Ų | 27 | 5% | 0.048 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -54.5 | -53.4 | 175.4 | -171.9 | 36.6 | 0 | 0 | 0 | 111.4 | Y119 F267 C287 F288 M293 F295 E296 | Y119-D291 PolarHBondContact OH-OD2 3.11Å; Y119-D291 VanDerWaalsContact OH-OD2 3.12Å; F267-D291 HydrophobicContact CE1-CB 4.3Å; F267-D291 HydrophobicContact CE2-CB 4.04Å; F267-D291 WeakPolarHBondContact CE2-OD1 3.48Å; F267-D291 HydrophobicContact CZ-CB 3.69Å; F267-D291 WeakPolarHBondContact CZ-OD1 3.37Å; C287-D291 PolarHBondContact O-N 3.34Å; F288-D291 PolarHBondContact O-N 3.47Å; D291-M293 PolarHBondContact O-N 2.93Å; D291-F295 WeakPolarHBondContact O-CA 3.5Å; D291-F295 PolarHBondContact O-N 3.35Å; D291-E296 PolarHBondContact O-N 3.13Å; D291-E296 VanDerWaalsContact O-N 3.13Å |
| 292 | F | 79.1 | Confident | 72.9 | Confident | 3 Ų | 3 | 32.7 Ų | 32.7 | 1% | 0.013 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -58.8 | -41.8 | 177.8 | -179.4 | -89.2 | 0 | 0 | 0 | 113.2 | S146 R148 F150 R167 F288 E296 | S146-F292 WeakPolarHBondContact O-CE1 3.26Å; R148-F292 HydrophobicContact CG-CE2 4.03Å; R148-F292 HydrophobicContact CG-CZ 3.98Å; F150-F292 HydrophobicContact CB-CE2 4.31Å; F150-F292 AromaticContact CD2-CD2 3.81Å; F150-F292 HydrophobicContact CD2-CD2 3.81Å; F150-F292 HydrophobicContact CD2-CE2 4.23Å; F150-F292 HydrophobicContact CD2-CG 4.48Å; F150-F292 HydrophobicContact CE2-CD2 4.42Å; F150-F292 HydrophobicContact CG-CD2 4.47Å; R167-F292 VanDerWaalsContact NH1-CE1 3.34Å; F288-F292 WeakPolarHBondContact O-CB 3.47Å; F288-F292 PolarHBondContact O-N 3.32Å; F292-E296 WeakPolarHBondContact CD2-OE2 3.18Å; F292-E296 WeakPolarHBondContact CE2-OE2 3.16Å |
| 293 | M | 76.9 | Confident | 69.8 | Low | 26 Ų | 26 | 40.4 Ų | 40.4 | 13% | 0.128 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -75.1 | -41.4 | -175.3 | -76.7 | 175.6 | 63.8 | 0 | 0 | 113.6 | Q181 Q198 F207 L289 I290 D291 | Q181-M293 HydrophobicContact CB-CE 4.12Å; Q181-M293 HydrophobicContact CB-SD 3.64Å; Q181-M293 HydrophobicContact CG-CE 3.64Å; Q181-M293 HydrophobicContact CG-CG 4.06Å; Q181-M293 HydrophobicContact CG-SD 3.56Å; Q181-M293 VanDerWaalsContact CG-SD 3.56Å; Q198-M293 VanDerWaalsContact CD-CE 3.46Å; Q198-M293 HydrophobicContact CG-CE 4.36Å; F207-M293 HydrophobicContact CE1-CE 4.13Å; F207-M293 HydrophobicContact CE1-SD 3.8Å; F207-M293 HydrophobicContact CZ-CE 4.06Å; F207-M293 HydrophobicContact CZ-SD 4.02Å; L289-M293 HydrophobicContact CD1-CG 4.15Å; L289-M293 HydrophobicContact CD1-SD 3.96Å; L289-M293 HydrophobicContact CD2-SD 4.36Å; L289-M293 HydrophobicContact CG-CG 4.41Å; L289-M293 HydrophobicContact CG-SD 3.79Å; L289-M293 WeakPolarHBondContact O-CB 3.4Å; L289-M293 WeakPolarHBondContact O-CG 2.94Å; L289-M293 PolarHBondContact O-N 3.41Å; I290-M293 PolarHBondContact O-N 2.97Å; D291-M293 PolarHBondContact O-N 2.93Å |
| 294 | F | 73.1 | Confident | 66.6 | Low | 49 Ų | 49 | 51.2 Ų | 51.2 | 22% | 0.215 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -110.6 | -25.2 | -167.1 | -63.7 | -70.8 | 0 | 0 | 0 | 114.2 | P205 F207 F225 F235 I290 V298 | P205-F294 HydrophobicContact CB-CE2 4.31Å; P205-F294 HydrophobicContact CB-CZ 3.78Å; F207-F294 HydrophobicContact CE2-CE2 4.3Å; F207-F294 AromaticContact CZ-CE2 3.94Å; F207-F294 HydrophobicContact CZ-CE2 3.94Å; F207-F294 HydrophobicContact CZ-CZ 4.49Å; F225-F294 HydrophobicContact CD2-CD1 4.06Å; F225-F294 AromaticContact CD2-CE1 3.71Å; F225-F294 HydrophobicContact CD2-CE1 3.71Å; F225-F294 HydrophobicContact CD2-CZ 4.22Å; F225-F294 HydrophobicContact CE1-CD1 4.43Å; F225-F294 AromaticContact CE2-CD1 3.49Å; F225-F294 HydrophobicContact CE2-CD1 3.49Å; F225-F294 VanDerWaalsContact CE2-CD1 3.49Å; F225-F294 HydrophobicContact CE2-CD2 4.11Å; F225-F294 AromaticContact CE2-CE1 3.33Å; F225-F294 HydrophobicContact CE2-CE1 3.33Å; F225-F294 AromaticContact CE2-CE2 3.96Å; F225-F294 HydrophobicContact CE2-CE2 3.96Å; F225-F294 AromaticContact CE2-CG 3.89Å; F225-F294 HydrophobicContact CE2-CG 3.89Å; F225-F294 AromaticContact CE2-CZ 3.59Å; F225-F294 HydrophobicContact CE2-CZ 3.59Å; F225-F294 HydrophobicContact CZ-CB 4.25Å; F225-F294 AromaticContact CZ-CD1 3.72Å; F225-F294 HydrophobicContact CZ-CD1 3.72Å; F225-F294 HydrophobicContact CZ-CD2 4.17Å; F225-F294 HydrophobicContact CZ-CE1 4.07Å; F225-F294 HydrophobicContact CZ-CE2 4.46Å; F225-F294 AromaticContact CZ-CG 3.78Å; F225-F294 HydrophobicContact CZ-CG 3.78Å; F225-F294 HydrophobicContact CZ-CZ 4.43Å; F235-F294 HydrophobicContact CE1-CE2 4.45Å; F235-F294 HydrophobicContact CZ-CD2 4.28Å; F235-F294 HydrophobicContact CZ-CE2 4.24Å; I290-F294 HydrophobicContact CG2-CD2 4.1Å; I290-F294 WeakPolarHBondContact O-CD2 3.16Å; I290-F294 PolarHBondContact O-N 3.35Å; F294-V298 WeakPolarHBondContact O-CG2 3.38Å |
| 295 | F | 68.8 | Low | 63.3 | Low | 32 Ų | 32 | 55.4 Ų | 55.4 | 14% | 0.14 | 29% | 0.288 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -115.2 | -30.8 | -168.9 | -60.1 | -73.1 | 0 | 0 | 0 | 113.8 | V233 K251 F267 I290 D291 K297 V298 | V233-F295 HydrophobicContact CB-CZ 4.06Å; V233-F295 HydrophobicContact CG1-CZ 4.14Å; V233-F295 HydrophobicContact CG2-CE1 4.24Å; V233-F295 HydrophobicContact CG2-CZ 3.89Å; K251-F295 HydrophobicContact CB-CZ 4.33Å; K251-F295 HydrophobicContact CD-CD1 3.49Å; K251-F295 VanDerWaalsContact CD-CD1 3.49Å; K251-F295 HydrophobicContact CD-CD2 3.73Å; K251-F295 HydrophobicContact CD-CE1 3.38Å; K251-F295 HydrophobicContact CD-CE2 3.61Å; K251-F295 HydrophobicContact CD-CG 3.66Å; K251-F295 HydrophobicContact CD-CZ 3.42Å; K251-F295 VanDerWaalsContact CD-CZ 3.42Å; F267-F295 HydrophobicContact CE1-CD2 4.22Å; F267-F295 HydrophobicContact CE1-CE2 4.27Å; F267-F295 HydrophobicContact CZ-CD2 4.1Å; I290-F295 HydrophobicContact CG2-CE2 4.11Å; D291-F295 WeakPolarHBondContact O-CA 3.5Å; D291-F295 PolarHBondContact O-N 3.35Å; F295-K297 PolarHBondContact O-N 3.34Å; F295-V298 PolarHBondContact O-N 3.2Å |
| 296 | E | 62.3 | Low | 60.6 | Low | 48 Ų | 48 | 60.7 Ų | 60.7 | 22% | 0.224 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -58.9 | -34.3 | 172.1 | -79.4 | -162.1 | 163.3 | 0 | 0 | 112.6 | N117 R148 D291 F292 V298 | N117-E296 PolarHBondContact ND2-OE1 3.03Å; N117-E296 VanDerWaalsContact ND2-OE1 3.15Å; R148-E296 IonicContact CZ-OE2 2.87Å; R148-E296 IonicContact NH2-OE1 2.94Å; R148-E296 PolarHBondContact NH2-OE1 3.15Å; R148-E296 VanDerWaalsContact NH2-OE1 3.12Å; R148-E296 IonicContact NH2-OE2 2.62Å; R148-E296 PolarHBondContact NH2-OE2 2.95Å; D291-E296 PolarHBondContact O-N 3.13Å; D291-E296 VanDerWaalsContact O-N 3.13Å; F292-E296 WeakPolarHBondContact CD2-OE2 3.18Å; F292-E296 WeakPolarHBondContact CE2-OE2 3.16Å; E296-V298 PolarHBondContact O-N 3.26Å |
| 297 | K | 47.9 | Very low | 57.5 | Low | 114 Ų | 114 | 66.2 Ų | 66.2 | 50% | 0.496 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -71.4 | -25.6 | 179.4 | -69.5 | -173 | -179.5 | -179.2 | 0 | 114.5 | S146 F295 | S146-K297 WeakPolarHBondContact OG-CE 3.48Å; S146-K297 PolarHBondContact OG-NZ 2.98Å; F295-K297 PolarHBondContact O-N 3.34Å |
| 298 | V | 43.9 | Very low | 54.4 | Low | 65 Ų | 65 | 75.4 Ų | 75.4 | 39% | 0.394 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -81.8 | -27.4 | -175.4 | -176.7 | 0 | 0 | 0 | 0 | 110.7 | F294 F295 E296 E300 A301 N302 | F294-V298 WeakPolarHBondContact O-CG2 3.38Å; F295-V298 PolarHBondContact O-N 3.2Å; E296-V298 PolarHBondContact O-N 3.26Å; V298-E300 VanDerWaalsContact C-N 3.34Å; V298-E300 PolarHBondContact O-N 3.28Å; V298-A301 PolarHBondContact O-N 3.44Å; V298-N302 PolarHBondContact O-N 3.2Å; V298-N302 VanDerWaalsContact O-N 3.08Å |
| 299 | G | 40.1 | Very low | 51.6 | Low | 43 Ų | 43 | 84.8 Ų | 84.8 | 44% | 0.443 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -62.2 | -36.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | Q303 | G299-Q303 WeakPolarHBondContact O-CG 3.13Å; G299-Q303 PolarHBondContact O-N 3.47Å |
| 300 | E | 40.3 | Very low | 49.7 | Very low | 103 Ų | 103 | 89 Ų | 89 | 48% | 0.481 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -72.2 | -33.3 | 176.8 | -69.5 | -174.3 | 163.8 | 0 | 0 | 112.8 | V298 | V298-E300 VanDerWaalsContact C-N 3.34Å; V298-E300 PolarHBondContact O-N 3.28Å |
| 301 | A | 35.9 | Very low | 47.7 | Very low | 67 Ų | 67 | 93.6 Ų | 93.6 | 55% | 0.554 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -77.8 | -35.3 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | V298 | V298-A301 PolarHBondContact O-N 3.44Å |
| 302 | N | 32.1 | Very low | 45.7 | Very low | 118 Ų | 118 | 98.3 Ų | 98.3 | 63% | 0.631 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -85.9 | -0.9 | 178.9 | -84.9 | -18.7 | 0 | 0 | 0 | 114.5 | V298 R304 | V298-N302 PolarHBondContact O-N 3.2Å; V298-N302 VanDerWaalsContact O-N 3.08Å; N302-R304 VanDerWaalsContact C-N 3.31Å |
| 303 | Q | 32.8 | Very low | 43.7 | Very low | 162 Ų | 162 | 103.9 Ų | 103.9 | 76% | 0.757 | 57% | 0.569 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.4 | 5 | 166 | -83.9 | -171.3 | -1.1 | 0 | 0 | 114 | G299 S305 | G299-Q303 WeakPolarHBondContact O-CG 3.13Å; G299-Q303 PolarHBondContact O-N 3.47Å; Q303-S305 PolarHBondContact O-N 3.44Å; Q303-S305 VanDerWaalsContact O-N 3.13Å |
| 304 | R | 29.1 | Very low | 41.6 | Very low | 228 Ų | 228 | 108.8 Ų | 108.8 | 86% | 0.86 | 60% | 0.597 | S | S | * | * | trans | -85.7 | 61.7 | 165.3 | -72.9 | -172.9 | 176.4 | 176.2 | 0 | 111.2 | N302 S306 | N302-R304 VanDerWaalsContact C-N 3.31Å; R304-S306 PolarHBondContact O-N 3.42Å | ||
| 305 | S | 28.2 | Very low | 39.5 | Very low | 89 Ų | 89 | 112.7 Ų | 112.7 | 62% | 0.622 | 62% | 0.622 | S | S | * | * | trans | -68.9 | 111.7 | 158.7 | -44 | 0 | 0 | 0 | 0 | 108.1 | Q303 V307 | Q303-S305 PolarHBondContact O-N 3.44Å; Q303-S305 VanDerWaalsContact O-N 3.13Å; S305-V307 PolarHBondContact O-N 3.46Å | ||
| 306 | S | 37.9 | Very low | 37.4 | Very low | 111 Ų | 111 | 118.5 Ų | 118.5 | 78% | 0.776 | 66% | 0.657 | S | S | * | * | trans | 23.8 | 96.1 | 145.4 | 61.4 | 0 | 0 | 0 | 0 | 117.2 | R304 | R304-S306 PolarHBondContact O-N 3.42Š| ||
| 307 | V | 31.8 | Very low | 35.5 | Very low | 115 Ų | 115 | 123.9 Ų | 123.9 | 70% | 0.697 | 69% | 0.69 | S | S | * | * | trans | -150.7 | 118.6 | 141.6 | -141.5 | 0 | 0 | 0 | 0 | 110.7 | S305 | S305-V307 PolarHBondContact O-N 3.46Š| ||
| 308 | F | 30 | Very low | 34.5 | Very low | 195 Ų | 195 | 124.8 Ų | 124.8 | 86% | 0.855 | 71% | 0.706 | S | S | * | * | trans | 66.7 | 100.9 | 168.5 | -52.6 | -65.3 | 0 | 0 | 0 | 118.9 | ||||
| 309 | S | 31.9 | Very low | 33.6 | Very low | 201 Ų | 201 | 130.2 Ų | 130.2 | 100% | 1.406 | 74% | 0.735 | S | S | * | * | -159.9 | 0 | 85.3 | -107.8 | 0 | 0 | 0 | 0 | 111.1 |
Retrieved 309 of 309 residues in 306.9 ms
(Link to these results)