| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 35.5 | Very low | 33 | Very low | 235 Ų | 235 | 159.7 Ų | 159.7 | 100% | 1.158 | 84% | 0.84 | S | S | * | * | 0 | 126.5 | 0 | -94.6 | 177.3 | 159.1 | 0 | 0 | 108.9 | |||||
| 2 | T | 35.2 | Very low | 33.1 | Very low | 132 Ų | 132 | 160 Ų | 160 | 81% | 0.81 | 84% | 0.841 | S | S | * | * | trans | 63.1 | 93.3 | 153.1 | 51.3 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 3 | T | 31.5 | Very low | 33.2 | Very low | 125 Ų | 125 | 157.8 Ų | 157.8 | 77% | 0.767 | 84% | 0.839 | S | S | * | * | trans | -25.3 | 146.8 | 133.8 | 46.8 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 4 | K | 36.1 | Very low | 33.4 | Very low | 213 Ų | 213 | 155.1 Ų | 155.1 | 93% | 0.926 | 84% | 0.839 | S | S | * | * | trans | -145.8 | 105.9 | 141.9 | -96.8 | -177.3 | -176.2 | 178.8 | 0 | 110.2 | ||||
| 5 | N | 32.8 | Very low | 33.5 | Very low | 148 Ų | 148 | 151.7 Ų | 151.7 | 79% | 0.791 | 83% | 0.831 | S | S | * | * | trans | -67.5 | 145.8 | 159.2 | -77.2 | -39.4 | 0 | 0 | 0 | 109.6 | ||||
| 6 | L | 35.7 | Very low | 34.1 | Very low | 166 Ų | 166 | 150.3 Ų | 150.3 | 87% | 0.869 | 83% | 0.831 | S | S | * | * | trans | -141.8 | 97.1 | 153.1 | -155.2 | 74.7 | 0 | 0 | 0 | 108.8 | ||||
| 7 | E | 34.1 | Very low | 35 | Very low | 179 Ų | 179 | 151.2 Ų | 151.2 | 84% | 0.836 | 83% | 0.832 | S | S | * | * | trans | -71.9 | 133.8 | 159.8 | -70.3 | 173.5 | 140.9 | 0 | 0 | 108.5 | ||||
| 8 | T | 30.8 | Very low | 35.7 | Very low | 127 Ų | 127 | 154.9 Ų | 154.9 | 78% | 0.779 | 83% | 0.832 | S | S | * | * | trans | -162.7 | 122.3 | 140.2 | -3.5 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 9 | K | 30.4 | Very low | 36.5 | Very low | 190 Ų | 190 | 150.4 Ų | 150.4 | 83% | 0.826 | 83% | 0.826 | S | S | * | * | trans | 80.1 | 97.2 | 137.6 | -134.9 | 169.8 | -177 | -179.6 | 0 | 119.7 | ||||
| 10 | V | 30.6 | Very low | 36.9 | Very low | 125 Ų | 125 | 148.8 Ų | 148.8 | 76% | 0.758 | 83% | 0.833 | S | S | * | * | trans | -61.1 | 129.7 | 155.5 | 174.1 | 0 | 0 | 0 | 0 | 110.3 | L12 | V10-L12 HydrophobicContact CG1-CG 4.15Š| ||
| 11 | T | 29.9 | Very low | 37.4 | Very low | 117 Ų | 117 | 145.4 Ų | 145.4 | 72% | 0.718 | 83% | 0.832 | S | S | * | * | trans | -124.5 | 109.1 | 159.5 | -55.5 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 12 | L | 34.5 | Very low | 38.1 | Very low | 163 Ų | 163 | 139.8 Ų | 139.8 | 85% | 0.853 | 81% | 0.806 | S | S | * | * | trans | -72.3 | 122.8 | 172.9 | -76.4 | 155.2 | 0 | 0 | 0 | 109.2 | V10 | V10-L12 HydrophobicContact CG1-CG 4.15Š| ||
| 13 | T | 35 | Very low | 38.8 | Very low | 132 Ų | 132 | 137.2 Ų | 137.2 | 81% | 0.81 | 81% | 0.806 | S | S | * | * | trans | -104.4 | 120 | 165.5 | 41 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 14 | S | 36.1 | Very low | 39.2 | Very low | 120 Ų | 120 | 139 Ų | 139 | 84% | 0.839 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 130.8 | -179.8 | 53.2 | 0 | 0 | 0 | 0 | 112.2 | ||
| 15 | S | 35.2 | Very low | 39.7 | Very low | 103 Ų | 103 | 137.8 Ų | 137.8 | 72% | 0.72 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 141.3 | 164.9 | 45.5 | 0 | 0 | 0 | 0 | 111.3 | ||
| 16 | P | 42.4 | Very low | 40.3 | Very low | 129 Ų | 129 | 137 Ų | 137 | 84% | 0.838 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 135.1 | -178.8 | 30.7 | -31.4 | 0 | 0 | 0 | 111.4 | ||
| 17 | I | 49.1 | Very low | 40.3 | Very low | 166 Ų | 166 | 137.8 Ų | 137.8 | 85% | 0.851 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 124.2 | 176.1 | -65.2 | 162.6 | 0 | 0 | 0 | 108.3 | ||
| 18 | R | 48.4 | Very low | 40.6 | Very low | 219 Ų | 219 | 138.2 Ų | 138.2 | 83% | 0.826 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 128.3 | 171.5 | -84.8 | -176.2 | 178.5 | -143.8 | 1 | 109.8 | D22 | R18-D22 IonicContact NH1-OD2 2.63Å; R18-D22 PolarHBondContact NH1-OD2 3Å; R18-D22 VanDerWaalsContact NH1-OD2 3.09Å |
| 19 | G | 51.3 | Low | 40.8 | Very low | 69 Ų | 69 | 137.8 Ų | 137.8 | 71% | 0.711 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -90.4 | 156.1 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||
| 20 | A | 43 | Very low | 41 | Very low | 118 Ų | 118 | 134.6 Ų | 134.6 | 98% | 0.975 | 81% | 0.805 | S | S | * | * | S | Bend | trans | -66 | 135.7 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||
| 21 | G | 48.9 | Very low | 41.5 | Very low | 78 Ų | 78 | 138.9 Ų | 138.9 | 80% | 0.804 | 81% | 0.814 | S | S | * | * | trans | 141.7 | 4.5 | -179.6 | 0 | 0 | 0 | 0 | 0 | 115.9 | G23 | G21-G23 PolarHBondContact O-N 2.94Š| ||
| 22 | D | 48.7 | Very low | 41.5 | Very low | 117 Ų | 117 | 139.1 Ų | 139.1 | 63% | 0.626 | 82% | 0.82 | S | S | * | * | trans | -83.2 | 52.8 | -178.6 | -163.8 | 13.1 | 0 | 0 | 0 | 112.7 | R18 M24 | R18-D22 IonicContact NH1-OD2 2.63Å; R18-D22 PolarHBondContact NH1-OD2 3Å; R18-D22 VanDerWaalsContact NH1-OD2 3.09Å; D22-M24 PolarHBondContact O-N 3.03Å | ||
| 23 | G | 49.8 | Very low | 41.4 | Very low | 78 Ų | 78 | 137.8 Ų | 137.8 | 80% | 0.804 | 82% | 0.818 | S | S | * | * | trans | 38.9 | 19.8 | 150.4 | 0 | 0 | 0 | 0 | 0 | 121.8 | G21 | G21-G23 PolarHBondContact O-N 2.94Š| ||
| 24 | M | 41.6 | Very low | 41.1 | Very low | 161 Ų | 161 | 140.7 Ų | 140.7 | 79% | 0.793 | 82% | 0.823 | S | S | * | * | trans | -105.2 | 70 | 179.2 | -74.5 | -144 | 75.9 | 0 | 0 | 110.6 | D22 | D22-M24 PolarHBondContact O-N 3.03Š| ||
| 25 | E | 45.7 | Very low | 40.8 | Very low | 189 Ų | 189 | 141.3 Ų | 141.3 | 88% | 0.883 | 82% | 0.821 | S | S | * | * | trans | -114.3 | 100.1 | 162.6 | -60.1 | -168.2 | -154.7 | 0 | 0 | 107.2 | ||||
| 26 | T | 44.9 | Very low | 40.8 | Very low | 131 Ų | 131 | 142.7 Ų | 142.7 | 80% | 0.804 | 83% | 0.826 | S | S | * | * | trans | -91.9 | 107.2 | 170 | 37.2 | 0 | 0 | 0 | 0 | 109 | ||||
| 27 | E | 36.1 | Very low | 40.2 | Very low | 182 Ų | 182 | 142.7 Ų | 142.7 | 85% | 0.85 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -65 | 137.1 | 164.5 | -74.7 | -93 | 148.8 | 0 | 0 | 110.6 | ||
| 28 | E | 40.8 | Very low | 39.1 | Very low | 189 Ų | 189 | 138.1 Ų | 138.1 | 88% | 0.883 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -74.5 | 133.4 | 174.7 | -80.4 | -169.2 | 148 | 0 | 0 | 111.8 | ||
| 29 | P | 33.7 | Very low | 38.2 | Very low | 118 Ų | 118 | 134.2 Ų | 134.2 | 77% | 0.766 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -99.6 | 155.5 | 167.3 | 35.6 | -28.3 | 0 | 0 | 0 | 112.8 | ||
| 30 | P | 36.3 | Very low | 37.2 | Very low | 123 Ų | 123 | 140 Ų | 140 | 80% | 0.799 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -85.4 | 160.1 | -167.3 | 34.8 | -35.4 | 0 | 0 | 0 | 114.5 | ||
| 31 | K | 39.7 | Very low | 36.7 | Very low | 215 Ų | 215 | 139.3 Ų | 139.3 | 94% | 0.935 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -48.6 | 137.3 | 174.8 | -67.8 | 169.7 | 177.4 | 172.8 | 0 | 113.5 | ||
| 32 | S | 31.1 | Very low | 35.8 | Very low | 122 Ų | 122 | 148 Ų | 148 | 85% | 0.853 | 83% | 0.827 | S | S | * | * | trans | -144.8 | 157.3 | 158.2 | 58.2 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 33 | V | 32.3 | Very low | 34.9 | Very low | 134 Ų | 134 | 151 Ų | 151 | 81% | 0.812 | 84% | 0.835 | S | S | * | * | trans | -86.9 | 137.3 | -156 | 169 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 34 | E | 28.3 | Very low | 33.8 | Very low | 193 Ų | 193 | 156.1 Ų | 156.1 | 90% | 0.902 | 84% | 0.837 | S | S | * | * | trans | -84.2 | 131.3 | 167.9 | -76.6 | -174.8 | 159.6 | 0 | 0 | 111.4 | ||||
| 35 | V | 29.9 | Very low | 33.3 | Very low | 133 Ų | 133 | 157.1 Ų | 157.1 | 81% | 0.806 | 84% | 0.84 | S | S | * | * | trans | -108.9 | 131.8 | 166.3 | 172.4 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 36 | T | 34.1 | Very low | 32.5 | Very low | 133 Ų | 133 | 152.7 Ų | 152.7 | 82% | 0.816 | 83% | 0.83 | S | S | * | * | trans | -84.2 | 141.8 | -176.9 | 20.1 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 37 | S | 29.7 | Very low | 31.9 | Very low | 129 Ų | 129 | 155.2 Ų | 155.2 | 90% | 0.902 | 84% | 0.837 | S | S | * | * | trans | -176.7 | 136.4 | 154.2 | -70.8 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 38 | G | 27.7 | Very low | 31.6 | Very low | 69 Ų | 69 | 155.5 Ų | 155.5 | 71% | 0.711 | 84% | 0.839 | S | S | * | * | cis | 139.5 | 85.4 | 14.6 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 39 | V | 29.7 | Very low | 31.2 | Very low | 138 Ų | 138 | 150.8 Ų | 150.8 | 84% | 0.836 | 83% | 0.827 | S | S | * | * | trans | 53.6 | 124.8 | 144.4 | -159.4 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 40 | Q | 30 | Very low | 31.2 | Very low | 191 Ų | 191 | 151.6 Ų | 151.6 | 89% | 0.893 | 83% | 0.832 | S | S | * | * | 177.8 | 139.8 | 110.2 | -91.7 | -173.6 | 16.3 | 0 | 0 | 114.8 | |||||
| 41 | S | 31.9 | Very low | 31 | Very low | 103 Ų | 103 | 156.6 Ų | 156.6 | 72% | 0.72 | 84% | 0.835 | S | S | * | * | trans | -94.8 | 151.7 | -174.9 | 63.2 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 42 | R | 29.6 | Very low | 30.7 | Very low | 259 Ų | 259 | 156 Ų | 156 | 98% | 0.977 | 83% | 0.833 | S | S | * | * | trans | -146.4 | 135.3 | 146.1 | -111.4 | 179.7 | 178 | -161.7 | -0.8 | 111.9 | ||||
| 43 | K | 29.2 | Very low | 30.8 | Very low | 180 Ų | 180 | 159.8 Ų | 159.8 | 78% | 0.783 | 83% | 0.834 | S | S | * | * | trans | -87.7 | 145.9 | -165.7 | -63.4 | 170.4 | 174.9 | 176.2 | 0 | 112.3 | ||||
| 44 | H | 28.4 | Very low | 30.8 | Very low | 186 Ų | 186 | 157.7 Ų | 157.7 | 86% | 0.861 | 83% | 0.831 | S | S | * | * | trans | -145.1 | 155.3 | 146.6 | -86.7 | -75.4 | 0 | 0 | 0 | 110 | ||||
| 45 | H | 30 | Very low | 31.4 | Very low | 182 Ų | 182 | 154.4 Ų | 154.4 | 84% | 0.843 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -78.9 | 143.6 | -141.6 | -69.5 | -94.9 | 0 | 0 | 0 | 117.2 | ||
| 46 | S | 28.4 | Very low | 31.9 | Very low | 97 Ų | 97 | 153.5 Ų | 153.5 | 68% | 0.678 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -79.4 | 136.7 | 175.7 | 53.3 | 0 | 0 | 0 | 0 | 113.5 | ||
| 47 | L | 33.1 | Very low | 32.2 | Very low | 183 Ų | 183 | 153 Ų | 153 | 96% | 0.958 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -100.6 | 123 | 147.8 | -78 | 165.9 | 0 | 0 | 0 | 107.8 | ||
| 48 | Q | 30.7 | Very low | 32.8 | Very low | 188 Ų | 188 | 154.9 Ų | 154.9 | 88% | 0.879 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -77.9 | 133.8 | -169.8 | -78.1 | 172 | -31.5 | 0 | 0 | 112.8 | ||
| 49 | S | 31.9 | Very low | 33.3 | Very low | 90 Ų | 90 | 155.7 Ų | 155.7 | 63% | 0.629 | 81% | 0.811 | S | S | * | * | trans | -127.9 | 152.9 | 151.6 | 66.9 | 0 | 0 | 0 | 0 | 108.7 | W51 | S49-W51 PolarHBondContact O-N 3.46Š| ||
| 50 | P | 33.6 | Very low | 33.8 | Very low | 136 Ų | 136 | 155.9 Ų | 155.9 | 88% | 0.883 | 82% | 0.816 | S | S | * | * | trans | -74.6 | 105.9 | -161.2 | -12.3 | 28.1 | 0 | 0 | 0 | 111.8 | K52 | P50-K52 PolarHBondContact O-N 3.18Š| ||
| 51 | W | 31.4 | Very low | 34.3 | Very low | 227 Ų | 227 | 150.5 Ų | 150.5 | 86% | 0.86 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -70 | 118.7 | 171.9 | -83.7 | 31.6 | 0 | 0 | 0 | 110.9 | S49 | S49-W51 PolarHBondContact O-N 3.46Š|
| 52 | K | 33.5 | Very low | 34.9 | Very low | 203 Ų | 203 | 151 Ų | 151 | 88% | 0.883 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 129.1 | 149.4 | -72.5 | -175.7 | 178.3 | -179.4 | 0 | 107.3 | P50 A54 | P50-K52 PolarHBondContact O-N 3.18Å; K52-A54 PolarHBondContact O-N 3.4Å |
| 53 | K | 34.3 | Very low | 35.5 | Very low | 201 Ų | 201 | 146.6 Ų | 146.6 | 87% | 0.874 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 118.5 | -177 | -70.3 | 176.3 | 175.9 | 179.1 | 0 | 111.2 | ||
| 54 | A | 31.1 | Very low | 36.6 | Very low | 91 Ų | 91 | 146.5 Ų | 146.5 | 75% | 0.752 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -73.7 | 130.2 | 163.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | K52 | K52-A54 PolarHBondContact O-N 3.4Š|
| 55 | V | 40.8 | Very low | 37.8 | Very low | 124 Ų | 124 | 145.6 Ų | 145.6 | 75% | 0.752 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -87.4 | 145.7 | 170.6 | 174 | 0 | 0 | 0 | 0 | 107.6 | S57 | V55-S57 PolarHBondContact O-N 3.27Š|
| 56 | P | 40.1 | Very low | 39 | Very low | 113 Ų | 113 | 140 Ų | 140 | 73% | 0.734 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -64.2 | 136.7 | -176.8 | -11.3 | 26.1 | 0 | 0 | 0 | 110.7 | ||
| 57 | S | 40.1 | Very low | 40.5 | Very low | 124 Ų | 124 | 145.4 Ų | 145.4 | 87% | 0.867 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -74.4 | 119.9 | 169.4 | 168 | 0 | 0 | 0 | 0 | 108.8 | V55 | V55-S57 PolarHBondContact O-N 3.27Š|
| 58 | E | 43.5 | Very low | 41.5 | Very low | 168 Ų | 168 | 144.1 Ų | 144.1 | 79% | 0.785 | 80% | 0.801 | S | S | * | * | trans | -125.7 | 124.8 | 166.7 | -78 | -177.2 | 169.7 | 0 | 0 | 109.2 | ||||
| 59 | S | 38.8 | Very low | 42.6 | Very low | 85 Ų | 85 | 141.6 Ų | 141.6 | 59% | 0.594 | 79% | 0.793 | S | S | * | * | trans | 42.2 | 128.2 | 163.3 | 60.7 | 0 | 0 | 0 | 0 | 120.3 | G61 | S59-G61 PolarHBondContact O-N 3.42Š| ||
| 60 | P | 38.4 | Very low | 43.9 | Very low | 143 Ų | 143 | 143.3 Ų | 143.3 | 93% | 0.929 | 80% | 0.8 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.2 | 119.7 | 171 | 20.9 | -14.7 | 0 | 0 | 0 | 110.2 | ||
| 61 | G | 42.1 | Very low | 44.9 | Very low | 77 Ų | 77 | 145.3 Ų | 145.3 | 79% | 0.794 | 80% | 0.797 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 148.8 | -9.5 | 173.3 | 0 | 0 | 0 | 0 | 0 | 116.6 | S59 | S59-G61 PolarHBondContact O-N 3.42Š|
| 62 | V | 44.6 | Very low | 46 | Very low | 113 Ų | 113 | 144 Ų | 144 | 69% | 0.685 | 80% | 0.798 | S | S | * | * | trans | -105.3 | 110.6 | -177.8 | -176.5 | 0 | 0 | 0 | 0 | 110.8 | Q64 | V62-Q64 PolarHBondContact O-N 3.03Š| ||
| 63 | L | 41.3 | Very low | 46.8 | Very low | 167 Ų | 167 | 137.7 Ų | 137.7 | 87% | 0.874 | 78% | 0.783 | S | S | * | * | trans | -71.8 | 105.4 | 167 | -71.1 | 170 | 0 | 0 | 0 | 108.8 | L65 | L63-L65 PolarHBondContact O-N 3.43Š| ||
| 64 | Q | 52.7 | Low | 47.7 | Very low | 179 Ų | 179 | 136.3 Ų | 136.3 | 84% | 0.836 | 78% | 0.782 | S | S | * | * | trans | -75.8 | 106.1 | 168.5 | -77.2 | -175.5 | 7.2 | 0 | 0 | 109.3 | V62 G66 | V62-Q64 PolarHBondContact O-N 3.03Å; Q64-G66 PolarHBondContact O-N 3.36Å | ||
| 65 | L | 54 | Low | 48.7 | Very low | 167 Ų | 167 | 141.1 Ų | 141.1 | 87% | 0.874 | 79% | 0.789 | S | S | * | * | trans | -60 | 124.6 | 162.2 | -68.7 | 166.5 | 0 | 0 | 0 | 107.7 | L63 | L63-L65 PolarHBondContact O-N 3.43Š| ||
| 66 | G | 54.5 | Low | 49 | Very low | 63 Ų | 63 | 140.9 Ų | 140.9 | 65% | 0.649 | 79% | 0.787 | S | S | * | * | trans | -56.2 | 158 | -175.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | Q64 M68 | Q64-G66 PolarHBondContact O-N 3.36Å; G66-M68 PolarHBondContact O-N 2.96Å | ||
| 67 | K | 58.8 | Low | 49.6 | Very low | 212 Ų | 212 | 143.7 Ų | 143.7 | 92% | 0.922 | 79% | 0.791 | S | S | * | * | trans | -56.8 | 113 | 179 | -68.3 | 179.9 | 179.2 | -179.3 | 0 | 110.3 | ||||
| 68 | M | 55.6 | Low | 50.1 | Low | 156 Ų | 156 | 142.1 Ų | 142.1 | 77% | 0.768 | 79% | 0.786 | S | S | * | * | trans | -70.8 | 132.3 | 173.3 | -73.1 | -105.7 | 55 | 0 | 0 | 109.9 | G66 T70 | G66-M68 PolarHBondContact O-N 2.96Å; M68-T70 PolarHBondContact O-N 3.28Å | ||
| 69 | L | 53.3 | Low | 50.8 | Low | 134 Ų | 134 | 139.4 Ų | 139.4 | 70% | 0.702 | 78% | 0.78 | S | S | * | * | trans | -63.3 | 116 | 166.8 | -89.8 | 140.8 | 0 | 0 | 0 | 108.4 | E71 K72 | L69-E71 PolarHBondContact O-N 3.26Å; L69-K72 PolarHBondContact O-N 2.86Å | ||
| 70 | T | 58.6 | Low | 51.3 | Low | 126 Ų | 126 | 146.1 Ų | 146.1 | 77% | 0.773 | 79% | 0.792 | S | S | * | * | G | 310 helix | trans | -59.5 | -15.3 | -178.6 | 35.6 | 0 | 0 | 0 | 0 | 113.9 | M68 K72 | M68-T70 PolarHBondContact O-N 3.28Å; T70-K72 PolarHBondContact O-N 2.91Å |
| 71 | E | 56.3 | Low | 52.6 | Low | 178 Ų | 178 | 146.4 Ų | 146.4 | 83% | 0.832 | 79% | 0.785 | S | S | * | * | G | 310 helix | trans | -71.9 | -8.8 | 177 | -76.6 | -177.7 | 155.8 | 0 | 0 | 114.7 | L69 | L69-E71 PolarHBondContact O-N 3.26Š|
| 72 | K | 53.3 | Low | 53.2 | Low | 200 Ų | 200 | 150 Ų | 150 | 87% | 0.87 | 78% | 0.784 | S | S | * | * | G | 310 helix | trans | -125.7 | 8 | 175.6 | -68.7 | -172.3 | 178 | -177.8 | 0 | 114.1 | L69 T70 | L69-K72 PolarHBondContact O-N 2.86Å; T70-K72 PolarHBondContact O-N 2.91Å |
| 73 | A | 50.3 | Low | 53.9 | Low | 70 Ų | 70 | 148.6 Ų | 148.6 | 58% | 0.579 | 78% | 0.776 | S | S | * | * | trans | -85.8 | 113.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 74 | M | 53.7 | Low | 54.9 | Low | 173 Ų | 173 | 144.7 Ų | 144.7 | 85% | 0.852 | 76% | 0.761 | S | S | * | * | trans | -86.4 | 118.4 | 170.2 | -170.7 | 174.4 | -170.3 | 0 | 0 | 108.4 | V76 | M74-V76 PolarHBondContact O-N 2.92Š| ||
| 75 | E | 52 | Low | 55 | Low | 191 Ų | 191 | 145.3 Ų | 145.3 | 89% | 0.893 | 76% | 0.761 | S | S | * | * | trans | -72.4 | 117.6 | 172.2 | -166.1 | 169.7 | -161.7 | 0 | 0 | 108.3 | ||||
| 76 | V | 46.8 | Very low | 55.5 | Low | 119 Ų | 119 | 142.2 Ų | 142.2 | 72% | 0.721 | 76% | 0.759 | S | S | * | * | trans | -107.9 | 107.3 | 177.7 | -175 | 0 | 0 | 0 | 0 | 107.8 | M74 A78 | M74-V76 PolarHBondContact O-N 2.92Å; V76-A78 PolarHBondContact O-N 3.4Å | ||
| 77 | E | 53.1 | Low | 55.2 | Low | 172 Ų | 172 | 142.4 Ų | 142.4 | 80% | 0.804 | 76% | 0.755 | S | S | * | * | trans | -75.7 | 101.2 | 172.7 | -168 | 179.1 | 179.6 | 0 | 0 | 109.2 | V79 | E77-V79 HydrophobicContact CG-CG2 4.46Å; E77-V79 PolarHBondContact O-N 3.39Å; E77-V79 VanDerWaalsContact O-N 3.12Å | ||
| 78 | A | 49.3 | Very low | 54.9 | Low | 92 Ų | 92 | 136.2 Ų | 136.2 | 76% | 0.76 | 73% | 0.731 | S | S | * | * | trans | -78.5 | 94.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 110 | V76 R80 | V76-A78 PolarHBondContact O-N 3.4Å; A78-R80 PolarHBondContact O-N 2.85Å | ||
| 79 | V | 58.6 | Low | 54.8 | Low | 110 Ų | 110 | 135.1 Ų | 135.1 | 67% | 0.667 | 73% | 0.733 | S | S | * | * | trans | -72.7 | 117.7 | 172.3 | -178.2 | 0 | 0 | 0 | 0 | 109.1 | E77 I81 | E77-V79 HydrophobicContact CG-CG2 4.46Å; E77-V79 PolarHBondContact O-N 3.39Å; E77-V79 VanDerWaalsContact O-N 3.12Å; V79-I81 PolarHBondContact O-N 3.31Å; V79-I81 VanDerWaalsContact O-N 3.08Å | ||
| 80 | R | 48.9 | Very low | 54.6 | Low | 226 Ų | 226 | 136.1 Ų | 136.1 | 85% | 0.853 | 73% | 0.734 | S | S | * | * | trans | -68.6 | 105.6 | 168.7 | -80.5 | -174.3 | -178.5 | -123.8 | 1.6 | 108.8 | A78 L82 | A78-R80 PolarHBondContact O-N 2.85Å; R80-L82 PolarHBondContact O-N 2.83Å | ||
| 81 | I | 65.8 | Low | 53.7 | Low | 150 Ų | 150 | 137.7 Ų | 137.7 | 77% | 0.769 | 74% | 0.738 | S | S | * | * | trans | -70 | 99 | 168.8 | -57.5 | 174.6 | 0 | 0 | 0 | 107.6 | V79 V83 | V79-I81 PolarHBondContact O-N 3.31Å; V79-I81 VanDerWaalsContact O-N 3.08Å; I81-V83 HydrophobicContact CG2-CG2 4.13Å; I81-V83 PolarHBondContact O-N 3.49Å | ||
| 82 | L | 56 | Low | 53.3 | Low | 151 Ų | 151 | 135.4 Ų | 135.4 | 79% | 0.791 | 73% | 0.73 | S | S | * | * | trans | -81.3 | 103.4 | 169.4 | -116.1 | 114 | 0 | 0 | 0 | 108 | R80 P84 | R80-L82 PolarHBondContact O-N 2.83Å; L82-P84 VanDerWaalsContact O-CD 3.26Å; L82-P84 WeakPolarHBondContact O-CD 3.43Å | ||
| 83 | V | 59.2 | Low | 52.6 | Low | 84 Ų | 84 | 131.7 Ų | 131.7 | 51% | 0.509 | 73% | 0.726 | S | S | . | * | trans | -80 | 112.5 | 167.5 | -176.6 | 0 | 0 | 0 | 0 | 107.2 | I81 K85 A87 I88 | I81-V83 HydrophobicContact CG2-CG2 4.13Å; I81-V83 PolarHBondContact O-N 3.49Å; V83-K85 PolarHBondContact O-N 3.35Å; V83-A87 HydrophobicContact CG1-CB 4.24Å; V83-I88 HydrophobicContact CG1-CD1 4.37Å; V83-I88 HydrophobicContact CG1-CG1 3.87Å | ||
| 84 | P | 61.8 | Low | 52 | Low | 85 Ų | 85 | 136.1 Ų | 136.1 | 55% | 0.552 | 74% | 0.735 | S | S | * | * | trans | -58.4 | 135.5 | 176.3 | -21.3 | 33.9 | 0 | 0 | 0 | 109.2 | L82 A86 A87 | L82-P84 VanDerWaalsContact O-CD 3.26Å; L82-P84 WeakPolarHBondContact O-CD 3.43Å; P84-A86 PolarHBondContact O-N 2.92Å; P84-A87 WeakPolarHBondContact O-CB 3.47Å; P84-A87 PolarHBondContact O-N 3.35Å | ||
| 85 | K | 55.2 | Low | 51.7 | Low | 193 Ų | 193 | 136.9 Ų | 136.9 | 84% | 0.839 | 73% | 0.733 | S | S | * | * | G | 310 helix | trans | -54.8 | -24.7 | 179.9 | -78.4 | -175.6 | 173.5 | -179.3 | 0 | 113.4 | V83 A87 I88 | V83-K85 PolarHBondContact O-N 3.35Å; K85-A87 VanDerWaalsContact C-N 3.27Å; K85-A87 PolarHBondContact O-N 3.16Å; K85-I88 PolarHBondContact O-N 2.98Å |
| 86 | A | 63.4 | Low | 51.4 | Low | 102 Ų | 102 | 135 Ų | 135 | 84% | 0.843 | 73% | 0.73 | S | S | * | * | G | 310 helix | trans | -70.3 | -18.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | P84 | P84-A86 PolarHBondContact O-N 2.92Š|
| 87 | A | 49.1 | Very low | 50.9 | Low | 67 Ų | 67 | 135.5 Ų | 135.5 | 55% | 0.554 | 73% | 0.733 | S | S | * | * | G | 310 helix | trans | -92.1 | -1.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | V83 P84 K85 T89 | V83-A87 HydrophobicContact CG1-CB 4.24Å; P84-A87 WeakPolarHBondContact O-CB 3.47Å; P84-A87 PolarHBondContact O-N 3.35Å; K85-A87 VanDerWaalsContact C-N 3.27Å; K85-A87 PolarHBondContact O-N 3.16Å; A87-T89 PolarHBondContact O-N 2.89Å |
| 88 | I | 53.7 | Low | 50.2 | Low | 81 Ų | 81 | 136.7 Ų | 136.7 | 42% | 0.415 | 74% | 0.735 | S | S | . | * | trans | -96.7 | 89.1 | 177.3 | -52.1 | 176.1 | 0 | 0 | 0 | 108.2 | V83 K85 H90 | V83-I88 HydrophobicContact CG1-CD1 4.37Å; V83-I88 HydrophobicContact CG1-CG1 3.87Å; K85-I88 PolarHBondContact O-N 2.98Å; I88-H90 WeakPolarHBondContact CG2-NE2 3.03Å; I88-H90 PolarHBondContact O-N 2.68Å | ||
| 89 | T | 52.8 | Low | 49.6 | Very low | 133 Ų | 133 | 138.8 Ų | 138.8 | 82% | 0.816 | 74% | 0.738 | S | S | * | * | trans | -79.9 | 104.7 | 169.2 | 38.7 | 0 | 0 | 0 | 0 | 109.7 | A87 D91 | A87-T89 PolarHBondContact O-N 2.89Å; T89-D91 PolarHBondContact O-N 3.43Å | ||
| 90 | H | 49 | Very low | 48.5 | Very low | 156 Ų | 156 | 143.5 Ų | 143.5 | 72% | 0.722 | 75% | 0.75 | S | S | * | * | trans | -81.4 | 96.2 | 167.3 | -72.1 | -74.1 | 0 | 0 | 0 | 109.2 | I88 I92 | I88-H90 WeakPolarHBondContact CG2-NE2 3.03Å; I88-H90 PolarHBondContact O-N 2.68Å; H90-I92 PolarHBondContact O-N 3.48Å; H90-I92 VanDerWaalsContact O-N 3.16Å | ||
| 91 | D | 40 | Very low | 48 | Very low | 159 Ų | 159 | 137.8 Ų | 137.8 | 85% | 0.85 | 74% | 0.744 | S | S | * | * | trans | -81.8 | 90.5 | 171.3 | -133.2 | -3.1 | 0 | 0 | 0 | 108.4 | T89 P93 | T89-D91 PolarHBondContact O-N 3.43Å; D91-P93 WeakPolarHBondContact O-CD 3.45Å | ||
| 92 | I | 46.7 | Very low | 46.5 | Very low | 129 Ų | 129 | 139.3 Ų | 139.3 | 66% | 0.662 | 75% | 0.753 | S | S | * | * | trans | -88.2 | 113.9 | 169.1 | -58.3 | 172.5 | 0 | 0 | 0 | 106.1 | H90 Q94 | H90-I92 PolarHBondContact O-N 3.48Å; H90-I92 VanDerWaalsContact O-N 3.16Å; I92-Q94 VanDerWaalsContact C-N 3.33Å; I92-Q94 PolarHBondContact O-N 2.86Å | ||
| 93 | P | 40 | Very low | 45.3 | Very low | 122 Ų | 122 | 134.4 Ų | 134.4 | 79% | 0.792 | 74% | 0.739 | S | S | * | * | trans | -71.2 | 89.9 | 178.8 | 27.1 | -31.5 | 0 | 0 | 0 | 109.7 | D91 K95 | D91-P93 WeakPolarHBondContact O-CD 3.45Å; P93-K95 PolarHBondContact O-N 2.79Å | ||
| 94 | Q | 36.7 | Very low | 44 | Very low | 163 Ų | 163 | 139.7 Ų | 139.7 | 76% | 0.762 | 76% | 0.758 | S | S | * | * | trans | -76 | 104.3 | 165.4 | -82.7 | -161.2 | -19.5 | 0 | 0 | 109.3 | I92 N96 | I92-Q94 VanDerWaalsContact C-N 3.33Å; I92-Q94 PolarHBondContact O-N 2.86Å; Q94-N96 PolarHBondContact O-N 3.38Å | ||
| 95 | K | 47.5 | Very low | 42.7 | Very low | 189 Ų | 189 | 144.8 Ų | 144.8 | 82% | 0.822 | 77% | 0.774 | S | S | * | * | trans | -56.4 | 131.3 | 156.5 | -89.1 | 176.6 | 173.2 | 174.5 | 0 | 108.8 | P93 | P93-K95 PolarHBondContact O-N 2.79Š| ||
| 96 | N | 45.8 | Very low | 41.7 | Very low | 153 Ų | 153 | 144.4 Ų | 144.4 | 82% | 0.818 | 77% | 0.773 | S | S | * | * | trans | 80.3 | 84.7 | 166 | -47.9 | -34.9 | 0 | 0 | 0 | 115.6 | Q94 | Q94-N96 PolarHBondContact O-N 3.38Š| ||
| 97 | T | 36.1 | Very low | 40.3 | Very low | 128 Ų | 128 | 143.3 Ų | 143.3 | 79% | 0.785 | 77% | 0.771 | S | S | * | * | trans | -132 | 124.4 | 145.5 | -16.7 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 98 | K | 37.9 | Very low | 39.4 | Very low | 198 Ų | 198 | 148 Ų | 148 | 86% | 0.861 | 78% | 0.781 | S | S | * | * | trans | -55.6 | 133.1 | -175.8 | -71 | 166.3 | 172.8 | 175.1 | 0 | 111 | K100 | K98-K100 PolarHBondContact O-N 3.44Š| ||
| 99 | V | 37.3 | Very low | 38.2 | Very low | 136 Ų | 136 | 153 Ų | 153 | 82% | 0.824 | 80% | 0.8 | S | S | * | * | trans | -15.7 | 109.5 | 149.7 | 179.7 | 0 | 0 | 0 | 0 | 112 | ||||
| 100 | K | 35.7 | Very low | 37.2 | Very low | 209 Ų | 209 | 154.2 Ų | 154.2 | 91% | 0.909 | 80% | 0.801 | S | S | * | * | trans | -96.9 | 104.1 | 155.1 | -86.1 | -177.8 | 176.1 | 178.7 | 0 | 107.1 | K98 | K98-K100 PolarHBondContact O-N 3.44Š| ||
| 101 | S | 37.6 | Very low | 36.4 | Very low | 105 Ų | 105 | 150.4 Ų | 150.4 | 73% | 0.734 | 80% | 0.804 | S | S | * | * | trans | -64.5 | 131.6 | 164.5 | 45.1 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 102 | L | 34.3 | Very low | 36.1 | Very low | 182 Ų | 182 | 151.9 Ų | 151.9 | 95% | 0.953 | 81% | 0.806 | S | S | * | * | trans | -144.8 | 128.2 | 159.8 | -147.9 | 85.9 | 0 | 0 | 0 | 108.6 | ||||
| 103 | G | 31 | Very low | 35.3 | Very low | 49 Ų | 49 | 149.9 Ų | 149.9 | 51% | 0.505 | 80% | 0.803 | S | S | . | * | trans | 110.7 | 61.4 | 161.7 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 104 | H | 31.6 | Very low | 34.8 | Very low | 195 Ų | 195 | 152.8 Ų | 152.8 | 90% | 0.903 | 81% | 0.806 | S | S | * | * | trans | -123.7 | 106.4 | 146.6 | -95 | 57.6 | 0 | 0 | 0 | 107.5 | K106 | H104-K106 PolarHBondContact O-N 3.33Š| ||
| 105 | H | 36.3 | Very low | 34.8 | Very low | 191 Ų | 191 | 148.4 Ų | 148.4 | 88% | 0.884 | 81% | 0.805 | S | S | * | * | trans | -77.2 | 107.2 | 171.9 | -52.7 | -80.8 | 0 | 0 | 0 | 107.5 | ||||
| 106 | K | 33.9 | Very low | 34.7 | Very low | 186 Ų | 186 | 146.4 Ų | 146.4 | 81% | 0.809 | 81% | 0.808 | S | S | * | * | trans | -115.2 | 101.1 | 168.5 | -158.7 | -179.9 | -176.2 | -168.9 | 0 | 106.7 | H104 | H104-K106 PolarHBondContact O-N 3.33Š| ||
| 107 | G | 32.7 | Very low | 34.6 | Very low | 78 Ų | 78 | 146.2 Ų | 146.2 | 80% | 0.804 | 81% | 0.805 | S | S | * | * | trans | -84.9 | 128.2 | 169.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 108 | E | 30.2 | Very low | 35.1 | Very low | 166 Ų | 166 | 146.3 Ų | 146.3 | 78% | 0.776 | 80% | 0.797 | S | S | * | * | trans | -96.2 | 120.3 | 173.3 | -85.1 | 179.2 | 161.8 | 0 | 0 | 110.5 | ||||
| 109 | F | 28.5 | Very low | 36 | Very low | 185 Ų | 185 | 141.7 Ų | 141.7 | 81% | 0.811 | 79% | 0.787 | S | S | * | * | 55.6 | 129.9 | 125.2 | -86.8 | -78.9 | 0 | 0 | 0 | 123 | |||||
| 110 | L | 32.6 | Very low | 37 | Very low | 159 Ų | 159 | 141.2 Ų | 141.2 | 83% | 0.832 | 78% | 0.78 | S | S | * | * | trans | 111.5 | 104.9 | 133.3 | -75.2 | 152.5 | 0 | 0 | 0 | 117.3 | ||||
| 111 | G | 32.1 | Very low | 38.1 | Very low | 76 Ų | 76 | 138.1 Ų | 138.1 | 78% | 0.784 | 77% | 0.766 | S | S | * | * | trans | -156.1 | 111 | 156.2 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 112 | Q | 33.2 | Very low | 39.4 | Very low | 190 Ų | 190 | 139.6 Ų | 139.6 | 89% | 0.888 | 76% | 0.762 | S | S | * | * | trans | -57.9 | 173.9 | 173.9 | -61 | 165.7 | -22.9 | 0 | 0 | 111.5 | ||||
| 113 | S | 30 | Very low | 41 | Very low | 87 Ų | 87 | 136 Ų | 136 | 61% | 0.608 | 74% | 0.743 | S | S | * | * | cis | -160.5 | 157.8 | 1.9 | 114.5 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 114 | E | 30.4 | Very low | 43 | Very low | 184 Ų | 184 | 136.6 Ų | 136.6 | 86% | 0.86 | 74% | 0.739 | S | S | * | * | trans | 41.1 | 119.2 | 151.8 | -72.8 | 149.9 | 137.2 | 0 | 0 | 122.2 | ||||
| 115 | G | 35.3 | Very low | 45.3 | Very low | 71 Ų | 71 | 132.8 Ų | 132.8 | 73% | 0.732 | 72% | 0.722 | S | S | * | * | trans | -173.5 | 80.6 | 156.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | I117 | G115-I117 PolarHBondContact O-N 3.5Š| ||
| 116 | V | 45.8 | Very low | 47.3 | Very low | 147 Ų | 147 | 128.2 Ų | 128.2 | 89% | 0.891 | 71% | 0.707 | S | S | * | * | trans | -55.9 | 100.8 | 175.6 | 173.2 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 117 | I | 44.1 | Very low | 49.6 | Very low | 148 Ų | 148 | 126 Ų | 126 | 76% | 0.759 | 70% | 0.698 | S | S | * | * | trans | -146.7 | 110.4 | 158.1 | -56 | -176.4 | 0 | 0 | 0 | 110 | G115 | G115-I117 PolarHBondContact O-N 3.5Š| ||
| 118 | E | 47.7 | Very low | 52.1 | Low | 131 Ų | 131 | 126.2 Ų | 126.2 | 61% | 0.612 | 68% | 0.68 | S | S | * | * | trans | 53.3 | 100.8 | 162.6 | -66.7 | -167.5 | 159.6 | 0 | 0 | 120.7 | N120 K121 | E118-N120 PolarHBondContact O-N 3.38Å; E118-K121 PolarHBondContact O-N 3.17Å | ||
| 119 | P | 55.1 | Low | 54.8 | Low | 101 Ų | 101 | 122.1 Ų | 122.1 | 66% | 0.656 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -63.5 | -9.2 | 175 | 27.7 | -35.1 | 0 | 0 | 0 | 114 | L123 | P119-L123 WeakPolarHBondContact O-CB 3.33Å; P119-L123 PolarHBondContact O-N 2.83Å |
| 120 | N | 58.3 | Low | 57.5 | Low | 125 Ų | 125 | 118.4 Ų | 118.4 | 67% | 0.668 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -79.1 | -28.2 | -177.4 | -84.5 | -36.6 | 0 | 0 | 0 | 114.1 | E118 S124 | E118-N120 PolarHBondContact O-N 3.38Å; N120-S124 WeakPolarHBondContact O-CB 3.17Å; N120-S124 PolarHBondContact O-N 3.24Å |
| 121 | K | 60.1 | Low | 60.2 | Low | 144 Ų | 144 | 116.1 Ų | 116.1 | 63% | 0.626 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -83.2 | -45.9 | -175.9 | -161.7 | 175.3 | 179.9 | -176.1 | 0 | 112.2 | E118 L123 S124 E125 | E118-K121 PolarHBondContact O-N 3.17Å; K121-L123 VanDerWaalsContact C-N 3.32Å; K121-L123 PolarHBondContact O-N 3.07Å; K121-S124 WeakPolarHBondContact O-CB 3.27Å; K121-S124 PolarHBondContact O-N 2.82Å; K121-E125 PolarHBondContact O-N 3Å |
| 122 | E | 63.4 | Low | 62.9 | Low | 137 Ų | 137 | 119.7 Ų | 119.7 | 64% | 0.64 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -62.3 | -38.9 | 172.7 | -65.6 | -176.6 | 167.1 | 0 | 0 | 111.8 | S124 E125 V126 | E122-S124 VanDerWaalsContact C-N 3.29Å; E122-S124 PolarHBondContact O-N 3Å; E122-E125 PolarHBondContact O-N 3.46Å; E122-V126 WeakPolarHBondContact O-CB 3.3Å; E122-V126 VanDerWaalsContact O-CG2 3.27Å; E122-V126 WeakPolarHBondContact O-CG2 3.5Å; E122-V126 PolarHBondContact O-N 3.33Å |
| 123 | L | 69.5 | Low | 65.5 | Low | 106 Ų | 106 | 115.6 Ų | 115.6 | 56% | 0.555 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -65.4 | -34.2 | 176.8 | -164.6 | 154.4 | 0 | 0 | 0 | 111.4 | P119 K121 K127 | P119-L123 WeakPolarHBondContact O-CB 3.33Å; P119-L123 PolarHBondContact O-N 2.83Å; K121-L123 VanDerWaalsContact C-N 3.32Å; K121-L123 PolarHBondContact O-N 3.07Å; L123-K127 WeakPolarHBondContact O-CB 3.44Å; L123-K127 PolarHBondContact O-N 2.85Å |
| 124 | S | 72.4 | Confident | 68.4 | Low | 61 Ų | 61 | 117.2 Ų | 117.2 | 43% | 0.427 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -70.3 | -39.8 | 173.8 | -164 | 0 | 0 | 0 | 0 | 112.4 | N120 K121 E122 K127 N128 | N120-S124 WeakPolarHBondContact O-CB 3.17Å; N120-S124 PolarHBondContact O-N 3.24Å; K121-S124 WeakPolarHBondContact O-CB 3.27Å; K121-S124 PolarHBondContact O-N 2.82Å; E122-S124 VanDerWaalsContact C-N 3.29Å; E122-S124 PolarHBondContact O-N 3Å; S124-K127 PolarHBondContact O-N 2.83Å; S124-N128 WeakPolarHBondContact O-CB 3.38Å; S124-N128 VanDerWaalsContact O-CG 3.28Å; S124-N128 PolarHBondContact O-N 2.81Å; S124-N128 PolarHBondContact O-ND2 2.8Å |
| 125 | E | 78.9 | Confident | 71.3 | Confident | 116 Ų | 116 | 111.3 Ų | 111.3 | 54% | 0.542 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -66.4 | -44.7 | 175.2 | -71.4 | 175.5 | -167.2 | 0 | 0 | 112.2 | K121 E122 K127 N128 V129 | K121-E125 PolarHBondContact O-N 3Å; E122-E125 PolarHBondContact O-N 3.46Å; E125-K127 VanDerWaalsContact C-N 3.3Å; E125-K127 PolarHBondContact O-N 3.3Å; E125-N128 PolarHBondContact O-N 3.07Å; E125-V129 WeakPolarHBondContact O-CG2 3.34Å; E125-V129 PolarHBondContact O-N 3.09Å |
| 126 | V | 79.6 | Confident | 74 | Confident | 94 Ų | 94 | 109.9 Ų | 109.9 | 57% | 0.57 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -61 | -40.5 | 172.9 | 172.1 | 0 | 0 | 0 | 0 | 110.8 | E122 V129 L130 | E122-V126 WeakPolarHBondContact O-CB 3.3Å; E122-V126 VanDerWaalsContact O-CG2 3.27Å; E122-V126 WeakPolarHBondContact O-CG2 3.5Å; E122-V126 PolarHBondContact O-N 3.33Å; V126-V129 PolarHBondContact O-N 3.5Å; V126-L130 VanDerWaalsContact O-CB 3.24Å; V126-L130 WeakPolarHBondContact O-CB 3.39Å; V126-L130 PolarHBondContact O-N 2.86Å |
| 127 | K | 82.8 | Confident | 76.2 | Confident | 141 Ų | 141 | 108.5 Ų | 108.5 | 61% | 0.613 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -64.9 | -41.7 | 177.1 | -159.2 | 178.3 | -171.5 | -175.3 | 0 | 111.9 | L123 S124 E125 L130 E131 | L123-K127 WeakPolarHBondContact O-CB 3.44Å; L123-K127 PolarHBondContact O-N 2.85Å; S124-K127 PolarHBondContact O-N 2.83Å; E125-K127 VanDerWaalsContact C-N 3.3Å; E125-K127 PolarHBondContact O-N 3.3Å; K127-L130 PolarHBondContact O-N 2.96Å; K127-E131 WeakPolarHBondContact O-CB 3.41Å; K127-E131 PolarHBondContact O-N 3.44Å |
| 128 | N | 84.3 | Confident | 78.6 | Confident | 81 Ų | 81 | 107.9 Ų | 107.9 | 43% | 0.433 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -65.1 | -39.8 | 174.4 | -75.4 | -41.3 | 0 | 0 | 0 | 112.6 | S124 E125 K132 | S124-N128 WeakPolarHBondContact O-CB 3.38Å; S124-N128 VanDerWaalsContact O-CG 3.28Å; S124-N128 PolarHBondContact O-N 2.81Å; S124-N128 PolarHBondContact O-ND2 2.8Å; E125-N128 PolarHBondContact O-N 3.07Å; N128-K132 WeakPolarHBondContact O-CB 3.4Å; N128-K132 VanDerWaalsContact O-CG 3.3Å; N128-K132 WeakPolarHBondContact O-CG 3.42Å; N128-K132 PolarHBondContact O-N 3.21Å |
| 129 | V | 87.6 | Confident | 80.7 | Confident | 80 Ų | 80 | 109 Ų | 109 | 49% | 0.485 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -67.2 | -41.5 | 175.5 | 171 | 0 | 0 | 0 | 0 | 110.9 | E125 V126 E131 K132 L133 | E125-V129 WeakPolarHBondContact O-CG2 3.34Å; E125-V129 PolarHBondContact O-N 3.09Å; V126-V129 PolarHBondContact O-N 3.5Å; V129-E131 VanDerWaalsContact C-N 3.34Å; V129-E131 PolarHBondContact O-N 3.29Å; V129-K132 PolarHBondContact O-N 2.83Å; V129-L133 HydrophobicContact CG1-CD1 3.94Å; V129-L133 WeakPolarHBondContact O-CB 3.24Å; V129-L133 PolarHBondContact O-N 3.38Å |
| 130 | L | 85.3 | Confident | 82.5 | Confident | 107 Ų | 107 | 109.7 Ų | 109.7 | 56% | 0.56 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -64.8 | -38.8 | 177 | -163.9 | 150.2 | 0 | 0 | 0 | 111.4 | V126 K127 L133 K134 | V126-L130 VanDerWaalsContact O-CB 3.24Å; V126-L130 WeakPolarHBondContact O-CB 3.39Å; V126-L130 PolarHBondContact O-N 2.86Å; K127-L130 PolarHBondContact O-N 2.96Å; L130-L133 PolarHBondContact O-N 3.35Å; L130-K134 VanDerWaalsContact O-CB 3.27Å; L130-K134 WeakPolarHBondContact O-CB 3.4Å; L130-K134 PolarHBondContact O-N 2.9Å |
| 131 | E | 88.4 | Confident | 84.2 | Confident | 112 Ų | 112 | 108.6 Ų | 108.6 | 52% | 0.523 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -68.6 | -39.5 | 174.8 | -167.8 | 164.5 | -160.9 | 0 | 0 | 112.4 | K127 V129 K134 N135 | K127-E131 WeakPolarHBondContact O-CB 3.41Å; K127-E131 PolarHBondContact O-N 3.44Å; V129-E131 VanDerWaalsContact C-N 3.34Å; V129-E131 PolarHBondContact O-N 3.29Å; E131-K134 PolarHBondContact O-N 2.89Å; E131-N135 WeakPolarHBondContact O-CB 3.35Å; E131-N135 PolarHBondContact O-N 2.93Å; E131-N135 PolarHBondContact O-ND2 3.07Å; E131-N135 VanDerWaalsContact O-ND2 3.16Å |
| 132 | K | 89.4 | Confident | 85.8 | Confident | 150 Ų | 150 | 108.2 Ų | 108.2 | 65% | 0.652 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -62.9 | -43.8 | 171.4 | -74.6 | 173.6 | -176.2 | 178.1 | 0 | 112.1 | N128 V129 N135 S136 | N128-K132 WeakPolarHBondContact O-CB 3.4Å; N128-K132 VanDerWaalsContact O-CG 3.3Å; N128-K132 WeakPolarHBondContact O-CG 3.42Å; N128-K132 PolarHBondContact O-N 3.21Å; V129-K132 PolarHBondContact O-N 2.83Å; K132-N135 PolarHBondContact O-N 3.31Å; K132-S136 WeakPolarHBondContact O-CB 3.47Å; K132-S136 PolarHBondContact O-N 3.41Å; K132-S136 PolarHBondContact O-OG 2.82Å |
| 133 | L | 88.4 | Confident | 87.3 | Confident | 105 Ų | 105 | 106.2 Ų | 106.2 | 55% | 0.55 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -60.4 | -48.3 | 175 | -90.5 | 159.1 | 0 | 0 | 0 | 110.7 | V129 L130 N135 S136 E137 | V129-L133 HydrophobicContact CG1-CD1 3.94Å; V129-L133 WeakPolarHBondContact O-CB 3.24Å; V129-L133 PolarHBondContact O-N 3.38Å; L130-L133 PolarHBondContact O-N 3.35Å; L133-N135 VanDerWaalsContact C-N 3.32Å; L133-N135 PolarHBondContact O-N 3.49Å; L133-S136 WeakPolarHBondContact CA-OG 3.47Å; L133-S136 CarbonylContact O-C 3.57Å; L133-S136 PolarHBondContact O-N 2.98Å; L133-S136 VanDerWaalsContact O-N 3.07Å; L133-S136 PolarHBondContact O-OG 2.97Å; L133-E137 WeakPolarHBondContact O-CB 3.27Å; L133-E137 PolarHBondContact O-N 2.92Å |
| 134 | K | 90.9 | Very high | 88.5 | Confident | 120 Ų | 120 | 108.1 Ų | 108.1 | 52% | 0.522 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61 | -39 | 176.7 | -169.2 | 174.9 | -174.3 | 174.7 | 0 | 112.5 | L130 E131 R138 | L130-K134 VanDerWaalsContact O-CB 3.27Å; L130-K134 WeakPolarHBondContact O-CB 3.4Å; L130-K134 PolarHBondContact O-N 2.9Å; E131-K134 PolarHBondContact O-N 2.89Å; K134-R138 WeakPolarHBondContact O-CB 3.4Å; K134-R138 PolarHBondContact O-N 3.39Å |
| 135 | N | 91.2 | Very high | 89.5 | Confident | 60 Ų | 60 | 110.5 Ų | 110.5 | 32% | 0.321 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -72 | -30.7 | 174.6 | -70.9 | -27.8 | 0 | 0 | 0 | 112.5 | E131 K132 L133 R138 R139 | E131-N135 WeakPolarHBondContact O-CB 3.35Å; E131-N135 PolarHBondContact O-N 2.93Å; E131-N135 PolarHBondContact O-ND2 3.07Å; E131-N135 VanDerWaalsContact O-ND2 3.16Å; K132-N135 PolarHBondContact O-N 3.31Å; L133-N135 VanDerWaalsContact C-N 3.32Å; L133-N135 PolarHBondContact O-N 3.49Å; N135-R138 PolarHBondContact OD1-NH1 3.46Å; N135-R139 PolarHBondContact O-N 2.87Å; N135-R139 VanDerWaalsContact O-N 3.17Å; N135-R139 PolarHBondContact O-NE 3.03Å |
| 136 | S | 91.7 | Very high | 90.3 | Very high | 41 Ų | 41 | 106.5 Ų | 106.5 | 29% | 0.287 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -73.2 | -39.4 | 173.4 | 74.6 | 0 | 0 | 0 | 0 | 112.1 | K132 L133 R139 L140 | K132-S136 WeakPolarHBondContact O-CB 3.47Å; K132-S136 PolarHBondContact O-N 3.41Å; K132-S136 PolarHBondContact O-OG 2.82Å; L133-S136 WeakPolarHBondContact CA-OG 3.47Å; L133-S136 CarbonylContact O-C 3.57Å; L133-S136 PolarHBondContact O-N 2.98Å; L133-S136 VanDerWaalsContact O-N 3.07Å; L133-S136 PolarHBondContact O-OG 2.97Å; S136-R139 PolarHBondContact O-N 3.42Å; S136-L140 WeakPolarHBondContact O-CB 3.39Å; S136-L140 WeakPolarHBondContact O-CG 3.16Å; S136-L140 PolarHBondContact O-N 3.44Å |
| 137 | E | 91.5 | Very high | 91 | Very high | 119 Ų | 119 | 107.3 Ų | 107.3 | 56% | 0.556 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -62.8 | -44.6 | 173.8 | -179 | -177.8 | -158.3 | 0 | 0 | 110.4 | L133 R139 L140 L141 | L133-E137 WeakPolarHBondContact O-CB 3.27Å; L133-E137 PolarHBondContact O-N 2.92Å; E137-R139 VanDerWaalsContact C-N 3.3Å; E137-R139 PolarHBondContact O-N 3.39Å; E137-L140 PolarHBondContact O-N 3.36Å; E137-L141 HydrophobicContact CG-CD1 4.23Å; E137-L141 WeakPolarHBondContact O-CB 3.23Å; E137-L141 VanDerWaalsContact O-CG 3.3Å; E137-L141 WeakPolarHBondContact O-CG 3.3Å; E137-L141 PolarHBondContact O-N 2.88Å |
| 138 | R | 93.4 | Very high | 91.6 | Very high | 135 Ų | 135 | 103.6 Ų | 103.6 | 51% | 0.509 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.8 | -39.2 | 175.4 | -163.6 | -176.7 | -66.6 | 130.5 | -2.9 | 112.1 | K134 N135 Q142 | K134-R138 WeakPolarHBondContact O-CB 3.4Å; K134-R138 PolarHBondContact O-N 3.39Å; N135-R138 PolarHBondContact OD1-NH1 3.46Å; R138-Q142 PolarHBondContact O-N 3.36Å; R138-Q142 VanDerWaalsContact O-N 3.09Å |
| 139 | R | 93 | Very high | 92.2 | Very high | 155 Ų | 155 | 102 Ų | 102 | 59% | 0.585 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -67.5 | -47.1 | 174.2 | -82.2 | -174 | -77.7 | -172.4 | -1.7 | 112.4 | N135 S136 E137 L141 Q142 D143 | N135-R139 PolarHBondContact O-N 2.87Å; N135-R139 VanDerWaalsContact O-N 3.17Å; N135-R139 PolarHBondContact O-NE 3.03Å; S136-R139 PolarHBondContact O-N 3.42Å; E137-R139 VanDerWaalsContact C-N 3.3Å; E137-R139 PolarHBondContact O-N 3.39Å; R139-L141 VanDerWaalsContact C-N 3.27Å; R139-L141 PolarHBondContact O-N 3.26Å; R139-Q142 CarbonylContact O-C 3.57Å; R139-Q142 WeakPolarHBondContact O-CA 3.25Å; R139-Q142 WeakPolarHBondContact O-CB 3.32Å; R139-Q142 PolarHBondContact O-N 2.69Å; R139-Q142 VanDerWaalsContact O-N 3.07Å; R139-D143 PolarHBondContact O-N 2.91Å |
| 140 | L | 92.9 | Very high | 92.5 | Very high | 115 Ų | 115 | 104.4 Ų | 104.4 | 60% | 0.602 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -61.9 | -35.1 | 177.2 | -73.6 | 171.5 | 0 | 0 | 0 | 112.4 | S136 E137 D143 K144 | S136-L140 WeakPolarHBondContact O-CB 3.39Å; S136-L140 WeakPolarHBondContact O-CG 3.16Å; S136-L140 PolarHBondContact O-N 3.44Å; E137-L140 PolarHBondContact O-N 3.36Å; L140-D143 PolarHBondContact O-N 3.03Å; L140-K144 VanDerWaalsContact O-CB 3.23Å; L140-K144 WeakPolarHBondContact O-CB 3.34Å; L140-K144 PolarHBondContact O-N 2.74Å |
| 141 | L | 92.9 | Very high | 93 | Very high | 102 Ų | 102 | 104.6 Ų | 104.6 | 53% | 0.534 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -67.8 | -40.3 | 173 | -73.7 | 174.1 | 0 | 0 | 0 | 111.8 | E137 R139 E145 | E137-L141 HydrophobicContact CG-CD1 4.23Å; E137-L141 WeakPolarHBondContact O-CB 3.23Å; E137-L141 VanDerWaalsContact O-CG 3.3Å; E137-L141 WeakPolarHBondContact O-CG 3.3Å; E137-L141 PolarHBondContact O-N 2.88Å; R139-L141 VanDerWaalsContact C-N 3.27Å; R139-L141 PolarHBondContact O-N 3.26Å; L141-E145 WeakPolarHBondContact O-CB 3.42Å; L141-E145 PolarHBondContact O-N 3.31Å |
| 142 | Q | 93.9 | Very high | 93.4 | Very high | 135 Ų | 135 | 106.6 Ų | 106.6 | 63% | 0.631 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -62.8 | -42.9 | 171.6 | -85.1 | -178.3 | -24.8 | 0 | 0 | 112.2 | R138 R139 E145 G146 | R138-Q142 PolarHBondContact O-N 3.36Å; R138-Q142 VanDerWaalsContact O-N 3.09Å; R139-Q142 CarbonylContact O-C 3.57Å; R139-Q142 WeakPolarHBondContact O-CA 3.25Å; R139-Q142 WeakPolarHBondContact O-CB 3.32Å; R139-Q142 PolarHBondContact O-N 2.69Å; R139-Q142 VanDerWaalsContact O-N 3.07Å; Q142-E145 PolarHBondContact O-N 3.34Å; Q142-G146 PolarHBondContact O-N 2.82Å |
| 143 | D | 94.9 | Very high | 93.8 | Very high | 95 Ų | 95 | 103.6 Ų | 103.6 | 51% | 0.508 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -67.6 | -41 | 178.6 | -67.2 | -21 | 0 | 0 | 0 | 111.3 | R139 L140 E145 G146 L147 | R139-D143 PolarHBondContact O-N 2.91Å; L140-D143 PolarHBondContact O-N 3.03Å; D143-E145 PolarHBondContact O-N 3.38Å; D143-G146 PolarHBondContact O-N 3.5Å; D143-L147 WeakPolarHBondContact O-CB 3.45Å; D143-L147 VanDerWaalsContact O-CG 3.25Å; D143-L147 WeakPolarHBondContact O-CG 3.47Å; D143-L147 PolarHBondContact O-N 3.23Å |
| 144 | K | 94.5 | Very high | 94.2 | Very high | 147 Ų | 147 | 104.4 Ų | 104.4 | 64% | 0.639 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -60.2 | -45.8 | 173.7 | 178.9 | -174.4 | 174.4 | -178 | 0 | 111.3 | L140 S148 | L140-K144 VanDerWaalsContact O-CB 3.23Å; L140-K144 WeakPolarHBondContact O-CB 3.34Å; L140-K144 PolarHBondContact O-N 2.74Å; K144-S148 WeakPolarHBondContact O-CB 3.34Å; K144-S148 PolarHBondContact O-N 3.34Å |
| 145 | E | 94.8 | Very high | 94.5 | Very high | 110 Ų | 110 | 102.7 Ų | 102.7 | 51% | 0.514 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.9 | -44.7 | 176.5 | -173.2 | 63.1 | -136.5 | 0 | 0 | 110.4 | L141 Q142 D143 S148 N149 | L141-E145 WeakPolarHBondContact O-CB 3.42Å; L141-E145 PolarHBondContact O-N 3.31Å; Q142-E145 PolarHBondContact O-N 3.34Å; D143-E145 PolarHBondContact O-N 3.38Å; E145-S148 PolarHBondContact O-N 3.16Å; E145-N149 WeakPolarHBondContact O-CB 3.4Å; E145-N149 PolarHBondContact O-N 3.08Å; E145-N149 PolarHBondContact O-ND2 3.32Å; E145-N149 PolarHBondContact OE1-ND2 3.4Å; E145-N149 VanDerWaalsContact OE1-ND2 3.07Å |
| 146 | G | 94.5 | Very high | 94.7 | Very high | 33 Ų | 33 | 104.1 Ų | 104.1 | 34% | 0.34 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59.3 | -48.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | Q142 D143 N149 Q150 | Q142-G146 PolarHBondContact O-N 2.82Å; D143-G146 PolarHBondContact O-N 3.5Å; G146-N149 PolarHBondContact O-N 2.91Å; G146-Q150 WeakPolarHBondContact O-CG 3.26Å; G146-Q150 PolarHBondContact O-N 2.89Å |
| 147 | L | 95.4 | Very high | 95 | Very high | 111 Ų | 111 | 105.8 Ų | 105.8 | 58% | 0.581 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -66.4 | -40.4 | 177.7 | -71.4 | 170.9 | 0 | 0 | 0 | 112.2 | D143 N149 Q150 L151 | D143-L147 WeakPolarHBondContact O-CB 3.45Å; D143-L147 VanDerWaalsContact O-CG 3.25Å; D143-L147 WeakPolarHBondContact O-CG 3.47Å; D143-L147 PolarHBondContact O-N 3.23Å; L147-N149 VanDerWaalsContact C-N 3.32Å; L147-N149 PolarHBondContact O-N 3.46Å; L147-Q150 PolarHBondContact O-N 2.94Å; L147-L151 WeakPolarHBondContact O-CB 3.41Å; L147-L151 PolarHBondContact O-N 3.4Å |
| 148 | S | 95.1 | Very high | 95.3 | Very high | 63 Ų | 63 | 104.9 Ų | 104.9 | 44% | 0.441 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -60.8 | -43.4 | 174.6 | -178.5 | 0 | 0 | 0 | 0 | 111.2 | K144 E145 L151 R152 | K144-S148 WeakPolarHBondContact O-CB 3.34Å; K144-S148 PolarHBondContact O-N 3.34Å; E145-S148 PolarHBondContact O-N 3.16Å; S148-L151 PolarHBondContact O-N 2.95Å; S148-R152 WeakPolarHBondContact O-CB 3.41Å; S148-R152 PolarHBondContact O-N 3Å |
| 149 | N | 95.6 | Very high | 95.5 | Very high | 46 Ų | 46 | 104.1 Ų | 104.1 | 25% | 0.246 | 52% | 0.518 | C | S | . | . | H | α-helix | trans | -66.2 | -41.1 | 176.4 | -72.9 | -42.9 | 0 | 0 | 0 | 112 | E145 G146 L147 R152 V153 | E145-N149 WeakPolarHBondContact O-CB 3.4Å; E145-N149 PolarHBondContact O-N 3.08Å; E145-N149 PolarHBondContact O-ND2 3.32Å; E145-N149 PolarHBondContact OE1-ND2 3.4Å; E145-N149 VanDerWaalsContact OE1-ND2 3.07Å; G146-N149 PolarHBondContact O-N 2.91Å; L147-N149 VanDerWaalsContact C-N 3.32Å; L147-N149 PolarHBondContact O-N 3.46Å; N149-R152 PolarHBondContact O-N 2.83Å; N149-R152 PolarHBondContact OD1-NH1 3.48Å; N149-R152 PolarHBondContact OD1-NH2 3.34Å; N149-V153 WeakPolarHBondContact O-CG2 3.37Å; N149-V153 PolarHBondContact O-N 3.41Å |
| 150 | Q | 95.7 | Very high | 95.6 | Very high | 132 Ų | 132 | 100.1 Ų | 100.1 | 62% | 0.617 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.6 | -46.5 | 173.7 | -77.7 | 179.3 | -2.9 | 0 | 0 | 112.3 | G146 L147 R152 V153 Q154 | G146-Q150 WeakPolarHBondContact O-CG 3.26Å; G146-Q150 PolarHBondContact O-N 2.89Å; L147-Q150 PolarHBondContact O-N 2.94Å; Q150-R152 VanDerWaalsContact C-N 3.29Å; Q150-R152 PolarHBondContact O-N 3.18Å; Q150-V153 PolarHBondContact O-N 3.22Å; Q150-Q154 WeakPolarHBondContact O-CB 3.42Å; Q150-Q154 PolarHBondContact O-N 2.86Å |
| 151 | L | 95.9 | Very high | 95.8 | Very high | 110 Ų | 110 | 99.2 Ų | 99.2 | 58% | 0.576 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -60.3 | -41 | 177.5 | -178.1 | 63.8 | 0 | 0 | 0 | 111.3 | L147 S148 Q154 T155 | L147-L151 WeakPolarHBondContact O-CB 3.41Å; L147-L151 PolarHBondContact O-N 3.4Å; S148-L151 PolarHBondContact O-N 2.95Å; L151-Q154 PolarHBondContact O-N 3.33Å; L151-T155 WeakPolarHBondContact O-CB 3.39Å; L151-T155 PolarHBondContact O-N 3.27Å; L151-T155 PolarHBondContact O-OG1 2.88Å |
| 152 | R | 96.8 | Very high | 96 | Very high | 154 Ų | 154 | 101.7 Ų | 101.7 | 58% | 0.581 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61.2 | -48.5 | 176.3 | -173.7 | 176.8 | 67.6 | -131.3 | -5 | 111.6 | S148 N149 Q150 T155 E156 | S148-R152 WeakPolarHBondContact O-CB 3.41Å; S148-R152 PolarHBondContact O-N 3Å; N149-R152 PolarHBondContact O-N 2.83Å; N149-R152 PolarHBondContact OD1-NH1 3.48Å; N149-R152 PolarHBondContact OD1-NH2 3.34Å; Q150-R152 VanDerWaalsContact C-N 3.29Å; Q150-R152 PolarHBondContact O-N 3.18Å; R152-T155 PolarHBondContact O-N 3.06Å; R152-E156 PolarHBondContact O-N 3.12Å |
| 153 | V | 97.3 | Very high | 96 | Very high | 88 Ų | 88 | 99.7 Ų | 99.7 | 53% | 0.533 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.2 | -45.1 | 177.8 | 172.7 | 0 | 0 | 0 | 0 | 110.8 | N149 Q150 T155 E156 V157 | N149-V153 WeakPolarHBondContact O-CG2 3.37Å; N149-V153 PolarHBondContact O-N 3.41Å; Q150-V153 PolarHBondContact O-N 3.22Å; V153-T155 VanDerWaalsContact C-N 3.31Å; V153-T155 PolarHBondContact O-N 3.47Å; V153-E156 PolarHBondContact O-N 2.93Å; V153-V157 HydrophobicContact CG1-CG2 4.28Å; V153-V157 WeakPolarHBondContact O-CG2 3.39Å; V153-V157 PolarHBondContact O-N 3.18Å |
| 154 | Q | 96.8 | Very high | 96 | Very high | 122 Ų | 122 | 100.6 Ų | 100.6 | 57% | 0.57 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -62.5 | -39.6 | 179 | -171.4 | 178.1 | 7.4 | 0 | 0 | 112.1 | Q150 L151 E156 V157 N158 | Q150-Q154 WeakPolarHBondContact O-CB 3.42Å; Q150-Q154 PolarHBondContact O-N 2.86Å; L151-Q154 PolarHBondContact O-N 3.33Å; Q154-E156 VanDerWaalsContact C-N 3.34Å; Q154-V157 PolarHBondContact O-N 3.47Å; Q154-N158 WeakPolarHBondContact O-CB 3.25Å; Q154-N158 PolarHBondContact O-N 3.43Å |
| 155 | T | 96.3 | Very high | 96 | Very high | 84 Ų | 84 | 99.2 Ų | 99.2 | 52% | 0.515 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.1 | -40.8 | 177.3 | -52.2 | 0 | 0 | 0 | 0 | 111 | L151 R152 V153 R159 | L151-T155 WeakPolarHBondContact O-CB 3.39Å; L151-T155 PolarHBondContact O-N 3.27Å; L151-T155 PolarHBondContact O-OG1 2.88Å; R152-T155 PolarHBondContact O-N 3.06Å; V153-T155 VanDerWaalsContact C-N 3.31Å; V153-T155 PolarHBondContact O-N 3.47Å; T155-R159 WeakPolarHBondContact O-CB 3.35Å; T155-R159 PolarHBondContact O-N 2.84Å |
| 156 | E | 96.9 | Very high | 96 | Very high | 89 Ų | 89 | 98.3 Ų | 98.3 | 42% | 0.416 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67.2 | -45.2 | 177.4 | -167.9 | 56.7 | -142.3 | 0 | 0 | 111.7 | R152 V153 Q154 N158 R159 E160 | R152-E156 PolarHBondContact O-N 3.12Å; V153-E156 PolarHBondContact O-N 2.93Å; Q154-E156 VanDerWaalsContact C-N 3.34Å; E156-N158 PolarHBondContact O-N 3.46Å; E156-R159 WeakPolarHBondContact O-CB 3.35Å; E156-R159 PolarHBondContact O-N 2.72Å; E156-R159 IonicContact OE1-CZ 3.09Å; E156-R159 IonicContact OE1-NE 3.46Å; E156-R159 PolarHBondContact OE1-NE 2.96Å; E156-R159 IonicContact OE1-NH2 2.76Å; E156-R159 PolarHBondContact OE1-NH2 3.49Å; E156-R159 IonicContact OE2-NE 2.72Å; E156-R159 PolarHBondContact OE2-NE 3.29Å; E156-E160 PolarHBondContact O-N 2.67Å |
| 157 | V | 97.5 | Very high | 95.7 | Very high | 77 Ų | 77 | 99.5 Ų | 99.5 | 47% | 0.467 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.1 | -45 | 175.9 | 171.6 | 0 | 0 | 0 | 0 | 110.9 | V153 Q154 R159 E160 L161 | V153-V157 HydrophobicContact CG1-CG2 4.28Å; V153-V157 WeakPolarHBondContact O-CG2 3.39Å; V153-V157 PolarHBondContact O-N 3.18Å; Q154-V157 PolarHBondContact O-N 3.47Å; V157-R159 VanDerWaalsContact C-N 3.3Å; V157-R159 PolarHBondContact O-N 3.39Å; V157-E160 PolarHBondContact O-N 3.01Å; V157-L161 HydrophobicContact CG1-CD1 3.75Å; V157-L161 HydrophobicContact CG1-CG 4.18Å; V157-L161 WeakPolarHBondContact O-CB 3.38Å; V157-L161 VanDerWaalsContact O-CG 3.25Å; V157-L161 WeakPolarHBondContact O-CG 3.3Å; V157-L161 PolarHBondContact O-N 3.28Å |
| 158 | N | 96.5 | Very high | 95.4 | Very high | 99 Ų | 99 | 98.6 Ų | 98.6 | 53% | 0.529 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.3 | -36.4 | 176.3 | -101.9 | -26.4 | 0 | 0 | 0 | 112.6 | Q154 E156 K162 | Q154-N158 WeakPolarHBondContact O-CB 3.25Å; Q154-N158 PolarHBondContact O-N 3.43Å; E156-N158 PolarHBondContact O-N 3.46Å; N158-K162 VanDerWaalsContact O-CB 3.3Å; N158-K162 WeakPolarHBondContact O-CB 3.34Å; N158-K162 PolarHBondContact O-N 2.92Å |
| 159 | R | 97.3 | Very high | 95.3 | Very high | 120 Ų | 120 | 98.7 Ų | 98.7 | 45% | 0.453 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.4 | -48 | 175.8 | -170.8 | -173.1 | 79 | 109.2 | -2.5 | 110.9 | T155 E156 V157 K162 K163 | T155-R159 WeakPolarHBondContact O-CB 3.35Å; T155-R159 PolarHBondContact O-N 2.84Å; E156-R159 WeakPolarHBondContact O-CB 3.35Å; E156-R159 PolarHBondContact O-N 2.72Å; E156-R159 IonicContact OE1-CZ 3.09Å; E156-R159 IonicContact OE1-NE 3.46Å; E156-R159 PolarHBondContact OE1-NE 2.96Å; E156-R159 IonicContact OE1-NH2 2.76Å; E156-R159 PolarHBondContact OE1-NH2 3.49Å; E156-R159 IonicContact OE2-NE 2.72Å; E156-R159 PolarHBondContact OE2-NE 3.29Å; V157-R159 VanDerWaalsContact C-N 3.3Å; V157-R159 PolarHBondContact O-N 3.39Å; R159-K162 PolarHBondContact O-N 3.05Å; R159-K163 WeakPolarHBondContact O-CG 3.36Å; R159-K163 PolarHBondContact O-N 3.23Å |
| 160 | E | 96.3 | Very high | 95.2 | Very high | 71 Ų | 71 | 97.9 Ų | 97.9 | 33% | 0.332 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -68.3 | -39.5 | 178.9 | -68.1 | -53.7 | 121.9 | 0 | 0 | 112.2 | E156 V157 K162 K163 L164 | E156-E160 PolarHBondContact O-N 2.67Å; V157-E160 PolarHBondContact O-N 3.01Å; E160-K162 PolarHBondContact O-N 3.3Å; E160-K163 PolarHBondContact O-N 3.23Å; E160-K163 IonicContact OE1-NZ 2.9Å; E160-K163 PolarHBondContact OE1-NZ 3.45Å; E160-K163 IonicContact OE2-NZ 3.36Å; E160-L164 WeakPolarHBondContact O-CB 3.2Å; E160-L164 WeakPolarHBondContact O-CG 3.45Å; E160-L164 PolarHBondContact O-N 2.96Å |
| 161 | L | 96.4 | Very high | 94.9 | Very high | 96 Ų | 96 | 97.2 Ų | 97.2 | 50% | 0.503 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.6 | -43.1 | 173.5 | -74.1 | 173.4 | 0 | 0 | 0 | 111.9 | V157 K163 L164 L165 | V157-L161 HydrophobicContact CG1-CD1 3.75Å; V157-L161 HydrophobicContact CG1-CG 4.18Å; V157-L161 WeakPolarHBondContact O-CB 3.38Å; V157-L161 VanDerWaalsContact O-CG 3.25Å; V157-L161 WeakPolarHBondContact O-CG 3.3Å; V157-L161 PolarHBondContact O-N 3.28Å; L161-K163 VanDerWaalsContact C-N 3.33Å; L161-K163 PolarHBondContact O-N 2.83Å; L161-L164 PolarHBondContact O-N 3.11Å; L161-L165 WeakPolarHBondContact O-CB 3.47Å; L161-L165 PolarHBondContact O-N 2.82Å |
| 162 | K | 96.8 | Very high | 94.9 | Very high | 153 Ų | 153 | 96.2 Ų | 96.2 | 67% | 0.665 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -63.7 | -40 | 177 | -171.8 | 175.3 | -178.1 | 176.5 | 0 | 111.6 | N158 R159 E160 V166 | N158-K162 VanDerWaalsContact O-CB 3.3Å; N158-K162 WeakPolarHBondContact O-CB 3.34Å; N158-K162 PolarHBondContact O-N 2.92Å; R159-K162 PolarHBondContact O-N 3.05Å; E160-K162 PolarHBondContact O-N 3.3Å; K162-V166 WeakPolarHBondContact O-CB 3.31Å; K162-V166 VanDerWaalsContact O-CG2 3.24Å; K162-V166 WeakPolarHBondContact O-CG2 3.24Å; K162-V166 PolarHBondContact O-N 3.29Å |
| 163 | K | 95.1 | Very high | 94.8 | Very high | 93 Ų | 93 | 93 Ų | 93 | 40% | 0.404 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.9 | -46.9 | 174.1 | -73.1 | 176.3 | -176.5 | 173.4 | 0 | 112.1 | R159 E160 L161 L165 V166 A167 | R159-K163 WeakPolarHBondContact O-CG 3.36Å; R159-K163 PolarHBondContact O-N 3.23Å; E160-K163 PolarHBondContact O-N 3.23Å; E160-K163 IonicContact OE1-NZ 2.9Å; E160-K163 PolarHBondContact OE1-NZ 3.45Å; E160-K163 IonicContact OE2-NZ 3.36Å; L161-K163 VanDerWaalsContact C-N 3.33Å; L161-K163 PolarHBondContact O-N 2.83Å; K163-L165 VanDerWaalsContact C-N 3.31Å; K163-L165 PolarHBondContact O-N 3.09Å; K163-V166 PolarHBondContact O-N 3.45Å; K163-A167 WeakPolarHBondContact O-CB 3.4Å; K163-A167 PolarHBondContact O-N 2.95Å |
| 164 | L | 93.8 | Very high | 94.7 | Very high | 114 Ų | 114 | 94.2 Ų | 94.2 | 60% | 0.597 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -61.3 | -41.1 | 178.1 | -78.8 | 168.9 | 0 | 0 | 0 | 111.4 | E160 L161 A167 S168 | E160-L164 WeakPolarHBondContact O-CB 3.2Å; E160-L164 WeakPolarHBondContact O-CG 3.45Å; E160-L164 PolarHBondContact O-N 2.96Å; L161-L164 PolarHBondContact O-N 3.11Å; L164-A167 PolarHBondContact O-N 3.44Å; L164-S168 WeakPolarHBondContact O-CB 3.45Å; L164-S168 PolarHBondContact O-N 3.04Å |
| 165 | L | 94.4 | Very high | 94.6 | Very high | 118 Ų | 118 | 94.5 Ų | 94.5 | 62% | 0.618 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.1 | -48.7 | 175.3 | -167.6 | 98 | 0 | 0 | 0 | 111.3 | L161 K163 A167 S168 V169 | L161-L165 WeakPolarHBondContact O-CB 3.47Å; L161-L165 PolarHBondContact O-N 2.82Å; K163-L165 VanDerWaalsContact C-N 3.31Å; K163-L165 PolarHBondContact O-N 3.09Å; L165-A167 VanDerWaalsContact C-N 3.32Å; L165-A167 PolarHBondContact O-N 2.95Å; L165-S168 PolarHBondContact O-N 3.45Å; L165-V169 HydrophobicContact CG-CG2 4.42Å; L165-V169 VanDerWaalsContact O-CG2 3.31Å; L165-V169 WeakPolarHBondContact O-CG2 3.41Å; L165-V169 PolarHBondContact O-N 3.24Å |
| 166 | V | 94.8 | Very high | 94.7 | Very high | 91 Ų | 91 | 94.3 Ų | 94.3 | 55% | 0.552 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -62 | -41.5 | 178.8 | 170.7 | 0 | 0 | 0 | 0 | 111 | K162 K163 G170 | K162-V166 WeakPolarHBondContact O-CB 3.31Å; K162-V166 VanDerWaalsContact O-CG2 3.24Å; K162-V166 WeakPolarHBondContact O-CG2 3.24Å; K162-V166 PolarHBondContact O-N 3.29Å; K163-V166 PolarHBondContact O-N 3.45Å; V166-G170 VanDerWaalsContact O-CA 3.22Å; V166-G170 WeakPolarHBondContact O-CA 3.32Å; V166-G170 PolarHBondContact O-N 3.21Å |
| 167 | A | 89.4 | Confident | 94.7 | Very high | 58 Ų | 58 | 97 Ų | 97 | 48% | 0.479 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67.2 | -40.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | K163 L164 L165 | K163-A167 WeakPolarHBondContact O-CB 3.4Å; K163-A167 PolarHBondContact O-N 2.95Å; L164-A167 PolarHBondContact O-N 3.44Å; L165-A167 VanDerWaalsContact C-N 3.32Å; L165-A167 PolarHBondContact O-N 2.95Å |
| 168 | S | 87.9 | Confident | 94.7 | Very high | 92 Ų | 92 | 97.7 Ų | 97.7 | 64% | 0.643 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -72.5 | -32.2 | -177.4 | -177.7 | 0 | 0 | 0 | 0 | 113.4 | L164 L165 | L164-S168 WeakPolarHBondContact O-CB 3.45Å; L164-S168 PolarHBondContact O-N 3.04Å; L165-S168 PolarHBondContact O-N 3.45Å |
| 169 | V | 94.3 | Very high | 94.8 | Very high | 65 Ų | 65 | 98.1 Ų | 98.1 | 39% | 0.394 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -113 | -25.6 | -171.2 | -160 | 0 | 0 | 0 | 0 | 112 | L165 L173 | L165-V169 HydrophobicContact CG-CG2 4.42Å; L165-V169 VanDerWaalsContact O-CG2 3.31Å; L165-V169 WeakPolarHBondContact O-CG2 3.41Å; L165-V169 PolarHBondContact O-N 3.24Å; V169-L173 HydrophobicContact CG1-CD1 3.99Å; V169-L173 HydrophobicContact CG1-CG 4.27Å; V169-L173 WeakPolarHBondContact O-CB 3.31Å; V169-L173 VanDerWaalsContact O-CG 3.31Å; V169-L173 WeakPolarHBondContact O-CG 3.11Å; V169-L173 PolarHBondContact O-N 3.45Å; V169-L173 VanDerWaalsContact O-N 3.11Å |
| 170 | G | 92.1 | Very high | 94.8 | Very high | 30 Ų | 30 | 97.1 Ų | 97.1 | 31% | 0.309 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.9 | -46.7 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | V166 Q174 | V166-G170 VanDerWaalsContact O-CA 3.22Å; V166-G170 WeakPolarHBondContact O-CA 3.32Å; V166-G170 PolarHBondContact O-N 3.21Å; G170-Q174 WeakPolarHBondContact O-CB 3.22Å; G170-Q174 PolarHBondContact O-N 3.24Å |
| 171 | D | 90.6 | Very high | 94.9 | Very high | 118 Ų | 118 | 96 Ų | 96 | 63% | 0.631 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -66.8 | -40 | -177.9 | -68.5 | -5.9 | 0 | 0 | 0 | 111.8 | Q174 Y175 | D171-Q174 PolarHBondContact O-N 3.32Å; D171-Y175 WeakPolarHBondContact O-CB 3.45Å; D171-Y175 PolarHBondContact O-N 2.91Å |
| 172 | D | 95.2 | Very high | 95 | Very high | 88 Ų | 88 | 97.6 Ų | 97.6 | 47% | 0.471 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -66.6 | -46.7 | 178.5 | -171.3 | 58 | 0 | 0 | 0 | 111.6 | Q174 Y175 H176 | D172-Q174 PolarHBondContact O-N 2.94Å; D172-Y175 PolarHBondContact O-N 3.41Å; D172-H176 PolarHBondContact O-CD2 2.86Å; D172-H176 PolarHBondContact O-N 3.15Å; D172-H176 IonicContact OD1-CD2 2.63Å; D172-H176 IonicContact OD1-NE2 3.22Å; D172-H176 IonicContact OD2-CD2 3.13Å; D172-H176 IonicContact OD2-NE2 3.28Å |
| 173 | L | 95.4 | Very high | 95.1 | Very high | 88 Ų | 88 | 94.2 Ų | 94.2 | 46% | 0.461 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61 | -44.6 | 174.6 | -74.6 | 172.6 | 0 | 0 | 0 | 111.5 | V169 Y175 H176 F177 | V169-L173 HydrophobicContact CG1-CD1 3.99Å; V169-L173 HydrophobicContact CG1-CG 4.27Å; V169-L173 WeakPolarHBondContact O-CB 3.31Å; V169-L173 VanDerWaalsContact O-CG 3.31Å; V169-L173 WeakPolarHBondContact O-CG 3.11Å; V169-L173 PolarHBondContact O-N 3.45Å; V169-L173 VanDerWaalsContact O-N 3.11Å; L173-Y175 VanDerWaalsContact C-N 3.33Å; L173-Y175 PolarHBondContact O-N 3.28Å; L173-H176 PolarHBondContact O-N 2.9Å; L173-F177 HydrophobicContact CB-CE2 4.5Å; L173-F177 WeakPolarHBondContact O-CD2 3.38Å; L173-F177 PolarHBondContact O-N 3.46Å |
| 174 | Q | 94.6 | Very high | 95.3 | Very high | 113 Ų | 113 | 96.3 Ų | 96.3 | 53% | 0.528 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -59.4 | -45.5 | 177.8 | -178.7 | 170.5 | -13.1 | 0 | 0 | 111.2 | G170 D171 D172 H176 F177 E178 | G170-Q174 WeakPolarHBondContact O-CB 3.22Å; G170-Q174 PolarHBondContact O-N 3.24Å; D171-Q174 PolarHBondContact O-N 3.32Å; D172-Q174 PolarHBondContact O-N 2.94Å; Q174-H176 PolarHBondContact O-N 3.38Å; Q174-F177 PolarHBondContact O-N 3.45Å; Q174-E178 PolarHBondContact NE2-OE1 3.06Å; Q174-E178 WeakPolarHBondContact O-CG 3.33Å; Q174-E178 PolarHBondContact O-N 2.96Å |
| 175 | Y | 95.9 | Very high | 95.5 | Very high | 127 Ų | 127 | 95.3 Ų | 95.3 | 50% | 0.498 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -58.9 | -46 | 175.5 | 174.7 | -99.2 | 0 | 0 | 0 | 112.1 | D171 D172 L173 F177 E178 R179 | D171-Y175 WeakPolarHBondContact O-CB 3.45Å; D171-Y175 PolarHBondContact O-N 2.91Å; D172-Y175 PolarHBondContact O-N 3.41Å; L173-Y175 VanDerWaalsContact C-N 3.33Å; L173-Y175 PolarHBondContact O-N 3.28Å; Y175-F177 PolarHBondContact O-N 3.23Å; Y175-E178 PolarHBondContact O-N 3.49Å; Y175-R179 WeakPolarHBondContact O-CB 3.44Å; Y175-R179 PolarHBondContact O-N 3.31Å |
| 176 | H | 97.1 | Very high | 95.7 | Very high | 81 Ų | 81 | 94.4 Ų | 94.4 | 38% | 0.375 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.8 | -43.2 | 178 | -79.3 | -61.6 | 0 | 0 | 0 | 112.5 | D172 L173 Q174 R179 L180 | D172-H176 PolarHBondContact O-CD2 2.86Å; D172-H176 PolarHBondContact O-N 3.15Å; D172-H176 IonicContact OD1-CD2 2.63Å; D172-H176 IonicContact OD1-NE2 3.22Å; D172-H176 IonicContact OD2-CD2 3.13Å; D172-H176 IonicContact OD2-NE2 3.28Å; L173-H176 PolarHBondContact O-N 2.9Å; Q174-H176 PolarHBondContact O-N 3.38Å; H176-R179 PolarHBondContact O-N 2.92Å; H176-L180 WeakPolarHBondContact O-CB 3.39Å; H176-L180 WeakPolarHBondContact O-CG 3.48Å; H176-L180 PolarHBondContact O-N 3.5Å |
| 177 | F | 97.9 | Very high | 95.8 | Very high | 144 Ų | 144 | 95.3 Ų | 95.3 | 63% | 0.632 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -63.3 | -45.8 | 175.8 | -82.4 | -65.3 | 0 | 0 | 0 | 112.3 | L173 Q174 Y175 R179 L180 A181 | L173-F177 HydrophobicContact CB-CE2 4.5Å; L173-F177 WeakPolarHBondContact O-CD2 3.38Å; L173-F177 PolarHBondContact O-N 3.46Å; Q174-F177 PolarHBondContact O-N 3.45Å; Y175-F177 PolarHBondContact O-N 3.23Å; F177-R179 VanDerWaalsContact C-N 3.32Å; F177-R179 PolarHBondContact O-N 3.07Å; F177-L180 PolarHBondContact O-N 3.49Å; F177-A181 VanDerWaalsContact O-CB 3.29Å; F177-A181 WeakPolarHBondContact O-CB 3.35Å; F177-A181 PolarHBondContact O-N 3.4Å |
| 178 | E | 97.5 | Very high | 96.3 | Very high | 92 Ų | 92 | 96 Ų | 96 | 43% | 0.43 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -63.9 | -38.4 | 178.1 | -74.3 | 178.8 | -166.8 | 0 | 0 | 111.9 | Q174 Y175 A181 R182 | Q174-E178 PolarHBondContact NE2-OE1 3.06Å; Q174-E178 WeakPolarHBondContact O-CG 3.33Å; Q174-E178 PolarHBondContact O-N 2.96Å; Y175-E178 PolarHBondContact O-N 3.49Å; E178-A181 PolarHBondContact O-N 2.94Å; E178-R182 WeakPolarHBondContact O-CG 3.44Å; E178-R182 PolarHBondContact O-N 3.03Å; E178-R182 PolarHBondContact O-NE 3.22Å |
| 179 | R | 97.9 | Very high | 96.8 | Very high | 108 Ų | 108 | 96.5 Ų | 96.5 | 41% | 0.408 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -64.8 | -49.1 | 176 | -162.5 | -172.5 | 94.9 | 153.7 | 9.3 | 111.5 | Y175 H176 F177 A181 R182 E183 | Y175-R179 WeakPolarHBondContact O-CB 3.44Å; Y175-R179 PolarHBondContact O-N 3.31Å; H176-R179 PolarHBondContact O-N 2.92Å; F177-R179 VanDerWaalsContact C-N 3.32Å; F177-R179 PolarHBondContact O-N 3.07Å; R179-A181 VanDerWaalsContact C-N 3.3Å; R179-A181 PolarHBondContact O-N 3.45Å; R179-R182 PolarHBondContact O-N 3.4Å; R179-E183 IonicContact CZ-OE1 3.47Å; R179-E183 IonicContact NE-OE1 3.06Å; R179-E183 PolarHBondContact NE-OE1 3.05Å; R179-E183 IonicContact NH2-OE1 3.32Å; R179-E183 PolarHBondContact NH2-OE1 3.39Å; R179-E183 VanDerWaalsContact NH2-OE1 3.15Å; R179-E183 IonicContact NH2-OE2 3.64Å; R179-E183 WeakPolarHBondContact O-CG 3.29Å; R179-E183 PolarHBondContact O-N 3.42Å |
| 180 | L | 98.4 | Very high | 97 | Very high | 99 Ų | 99 | 97.8 Ų | 97.8 | 52% | 0.518 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -61.5 | -38.8 | 177.1 | -77.3 | 168 | 0 | 0 | 0 | 112 | H176 F177 E183 K184 | H176-L180 WeakPolarHBondContact O-CB 3.39Å; H176-L180 WeakPolarHBondContact O-CG 3.48Å; H176-L180 PolarHBondContact O-N 3.5Å; F177-L180 PolarHBondContact O-N 3.49Å; L180-E183 PolarHBondContact O-N 2.86Å; L180-K184 VanDerWaalsContact O-CB 3.27Å; L180-K184 WeakPolarHBondContact O-CB 3.27Å; L180-K184 PolarHBondContact O-N 3.27Å |
| 181 | A | 98.4 | Very high | 97.3 | Very high | 48 Ų | 48 | 101.8 Ų | 101.8 | 40% | 0.397 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.1 | -42.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | F177 E178 R179 N185 | F177-A181 VanDerWaalsContact O-CB 3.29Å; F177-A181 WeakPolarHBondContact O-CB 3.35Å; F177-A181 PolarHBondContact O-N 3.4Å; E178-A181 PolarHBondContact O-N 2.94Å; R179-A181 VanDerWaalsContact C-N 3.3Å; R179-A181 PolarHBondContact O-N 3.45Å; A181-N185 VanDerWaalsContact O-CG 3.23Å; A181-N185 PolarHBondContact O-N 3.38Å; A181-N185 PolarHBondContact O-ND2 3.32Å |
| 182 | R | 98.3 | Very high | 97.7 | Very high | 130 Ų | 130 | 101.3 Ų | 101.3 | 49% | 0.491 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -64.6 | -47.7 | 175 | -77.9 | -178.8 | -94.3 | 105.6 | -3 | 112.3 | E178 R179 K184 N185 Q186 | E178-R182 WeakPolarHBondContact O-CG 3.44Å; E178-R182 PolarHBondContact O-N 3.03Å; E178-R182 PolarHBondContact O-NE 3.22Å; R179-R182 PolarHBondContact O-N 3.4Å; R182-K184 VanDerWaalsContact C-N 3.34Å; R182-K184 PolarHBondContact O-N 2.93Å; R182-N185 PolarHBondContact O-N 3.09Å; R182-Q186 PolarHBondContact O-N 2.96Å |
| 183 | E | 98.3 | Very high | 97.8 | Very high | 81 Ų | 81 | 98.8 Ų | 98.8 | 38% | 0.379 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -59.7 | -43.9 | 176.8 | -72.8 | 171.4 | -170 | 0 | 0 | 111.4 | R179 L180 N185 Q186 L187 | R179-E183 IonicContact CZ-OE1 3.47Å; R179-E183 IonicContact NE-OE1 3.06Å; R179-E183 PolarHBondContact NE-OE1 3.05Å; R179-E183 IonicContact NH2-OE1 3.32Å; R179-E183 PolarHBondContact NH2-OE1 3.39Å; R179-E183 VanDerWaalsContact NH2-OE1 3.15Å; R179-E183 IonicContact NH2-OE2 3.64Å; R179-E183 WeakPolarHBondContact O-CG 3.29Å; R179-E183 PolarHBondContact O-N 3.42Å; L180-E183 PolarHBondContact O-N 2.86Å; E183-N185 PolarHBondContact O-N 3.47Å; E183-Q186 WeakPolarHBondContact O-CB 3.48Å; E183-Q186 PolarHBondContact O-N 3.45Å; E183-L187 WeakPolarHBondContact O-CG 3.26Å; E183-L187 PolarHBondContact O-N 3.22Å |
| 184 | K | 98.4 | Very high | 98 | Very high | 137 Ų | 137 | 99.8 Ų | 99.8 | 60% | 0.596 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -59 | -47 | 175 | -179.3 | -172.3 | 173.2 | -176.6 | 0 | 111.8 | L180 R182 Q186 L187 I188 | L180-K184 VanDerWaalsContact O-CB 3.27Å; L180-K184 WeakPolarHBondContact O-CB 3.27Å; L180-K184 PolarHBondContact O-N 3.27Å; R182-K184 VanDerWaalsContact C-N 3.34Å; R182-K184 PolarHBondContact O-N 2.93Å; K184-Q186 VanDerWaalsContact C-N 3.3Å; K184-Q186 PolarHBondContact O-N 3.47Å; K184-L187 PolarHBondContact O-N 3.32Å; K184-I188 HydrophobicContact CG-CD1 4.13Å; K184-I188 WeakPolarHBondContact O-CG1 3.39Å; K184-I188 PolarHBondContact O-N 2.9Å |
| 185 | N | 98.4 | Very high | 98.1 | Very high | 94 Ų | 94 | 96.2 Ų | 96.2 | 50% | 0.503 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -63.1 | -39.3 | 179.3 | -71.4 | -19.2 | 0 | 0 | 0 | 111.6 | A181 R182 E183 I188 L189 | A181-N185 VanDerWaalsContact O-CG 3.23Å; A181-N185 PolarHBondContact O-N 3.38Å; A181-N185 PolarHBondContact O-ND2 3.32Å; R182-N185 PolarHBondContact O-N 3.09Å; E183-N185 PolarHBondContact O-N 3.47Å; N185-I188 PolarHBondContact O-N 3.18Å; N185-L189 WeakPolarHBondContact O-CG 3.39Å; N185-L189 PolarHBondContact O-N 3.28Å |
| 186 | Q | 98.3 | Very high | 98.3 | Very high | 99 Ų | 99 | 98.4 Ų | 98.4 | 46% | 0.463 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -61.5 | -46.6 | 174.4 | -178 | 60.3 | 27.6 | 0 | 0 | 111.6 | R182 E183 K184 I188 L189 E190 | R182-Q186 PolarHBondContact O-N 2.96Å; E183-Q186 WeakPolarHBondContact O-CB 3.48Å; E183-Q186 PolarHBondContact O-N 3.45Å; K184-Q186 VanDerWaalsContact C-N 3.3Å; K184-Q186 PolarHBondContact O-N 3.47Å; Q186-I188 VanDerWaalsContact C-N 3.29Å; Q186-I188 PolarHBondContact O-N 3.25Å; Q186-L189 PolarHBondContact O-N 3.42Å; Q186-E190 WeakPolarHBondContact CG-OE1 3.09Å; Q186-E190 PolarHBondContact NE2-OE1 2.88Å; Q186-E190 WeakPolarHBondContact O-CG 3.43Å; Q186-E190 PolarHBondContact O-N 2.91Å |
| 187 | L | 98.6 | Very high | 98.3 | Very high | 110 Ų | 110 | 98.7 Ų | 98.7 | 58% | 0.576 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -62.6 | -34.4 | 177.2 | -71.9 | 173.8 | 0 | 0 | 0 | 112.7 | E183 K184 E190 N191 | E183-L187 WeakPolarHBondContact O-CG 3.26Å; E183-L187 PolarHBondContact O-N 3.22Å; K184-L187 PolarHBondContact O-N 3.32Å; L187-E190 PolarHBondContact O-N 2.97Å; L187-N191 VanDerWaalsContact O-CB 3.26Å; L187-N191 WeakPolarHBondContact O-CB 3.29Å; L187-N191 PolarHBondContact O-N 3.49Å |
| 188 | I | 98.4 | Very high | 98.4 | Very high | 72 Ų | 72 | 96.3 Ų | 96.3 | 37% | 0.369 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.8 | -49 | 174.5 | -71 | 164.9 | 0 | 0 | 0 | 110.2 | K184 N185 Q186 E190 N191 E192 | K184-I188 HydrophobicContact CG-CD1 4.13Å; K184-I188 WeakPolarHBondContact O-CG1 3.39Å; K184-I188 PolarHBondContact O-N 2.9Å; N185-I188 PolarHBondContact O-N 3.18Å; Q186-I188 VanDerWaalsContact C-N 3.29Å; Q186-I188 PolarHBondContact O-N 3.25Å; I188-E190 VanDerWaalsContact C-N 3.33Å; I188-E190 PolarHBondContact O-N 2.81Å; I188-N191 PolarHBondContact O-N 3.23Å; I188-E192 WeakPolarHBondContact O-CG 3.33Å; I188-E192 PolarHBondContact O-N 3.11Å |
| 189 | L | 98.6 | Very high | 98.4 | Very high | 102 Ų | 102 | 94.6 Ų | 94.6 | 53% | 0.534 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.8 | -40.1 | 179.5 | -66.3 | 174.1 | 0 | 0 | 0 | 112.2 | N185 Q186 E192 A193 | N185-L189 WeakPolarHBondContact O-CG 3.39Å; N185-L189 PolarHBondContact O-N 3.28Å; Q186-L189 PolarHBondContact O-N 3.42Å; L189-E192 PolarHBondContact O-N 3.06Å; L189-A193 WeakPolarHBondContact O-CB 3.48Å; L189-A193 PolarHBondContact O-N 3.48Å |
| 190 | E | 98.4 | Very high | 98.4 | Very high | 92 Ų | 92 | 94.5 Ų | 94.5 | 43% | 0.43 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.9 | -42.2 | 175.4 | -73.4 | 174.3 | -166.9 | 0 | 0 | 111.7 | Q186 L187 I188 A193 L194 | Q186-E190 WeakPolarHBondContact CG-OE1 3.09Å; Q186-E190 PolarHBondContact NE2-OE1 2.88Å; Q186-E190 WeakPolarHBondContact O-CG 3.43Å; Q186-E190 PolarHBondContact O-N 2.91Å; L187-E190 PolarHBondContact O-N 2.97Å; I188-E190 VanDerWaalsContact C-N 3.33Å; I188-E190 PolarHBondContact O-N 2.81Å; E190-A193 PolarHBondContact O-N 3.46Å; E190-L194 WeakPolarHBondContact O-CG 3.34Å; E190-L194 PolarHBondContact O-N 2.85Å |
| 191 | N | 98.3 | Very high | 98.4 | Very high | 115 Ų | 115 | 95.1 Ų | 95.1 | 62% | 0.615 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -64 | -43 | 176.9 | -162.1 | -45 | 0 | 0 | 0 | 111.4 | L187 I188 A193 L194 G195 | L187-N191 VanDerWaalsContact O-CB 3.26Å; L187-N191 WeakPolarHBondContact O-CB 3.29Å; L187-N191 PolarHBondContact O-N 3.49Å; I188-N191 PolarHBondContact O-N 3.23Å; N191-A193 VanDerWaalsContact C-N 3.32Å; N191-A193 PolarHBondContact O-N 2.66Å; N191-L194 PolarHBondContact O-N 3Å; N191-G195 PolarHBondContact O-N 2.76Å |
| 192 | E | 98.4 | Very high | 98.4 | Very high | 108 Ų | 108 | 95.5 Ų | 95.5 | 51% | 0.505 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.2 | -39.1 | 173.9 | -73.2 | 176.3 | -179.8 | 0 | 0 | 112.5 | I188 L189 G195 R196 | I188-E192 WeakPolarHBondContact O-CG 3.33Å; I188-E192 PolarHBondContact O-N 3.11Å; L189-E192 PolarHBondContact O-N 3.06Å; E192-G195 PolarHBondContact O-N 3.5Å; E192-R196 WeakPolarHBondContact O-CG 3.33Å; E192-R196 PolarHBondContact O-N 2.88Å |
| 193 | A | 98.4 | Very high | 98.4 | Very high | 34 Ų | 34 | 93.6 Ų | 93.6 | 28% | 0.281 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -66 | -43.9 | 175 | 0 | 0 | 0 | 0 | 0 | 111.8 | L189 E190 N191 G195 R196 N197 | L189-A193 WeakPolarHBondContact O-CB 3.48Å; L189-A193 PolarHBondContact O-N 3.48Å; E190-A193 PolarHBondContact O-N 3.46Å; N191-A193 VanDerWaalsContact C-N 3.32Å; N191-A193 PolarHBondContact O-N 2.66Å; A193-G195 VanDerWaalsContact C-N 3.35Å; A193-R196 PolarHBondContact O-N 2.99Å; A193-N197 PolarHBondContact O-N 3.37Å; A193-N197 PolarHBondContact O-ND2 2.9Å |
| 194 | L | 98.4 | Very high | 98.5 | Very high | 109 Ų | 109 | 94.3 Ų | 94.3 | 57% | 0.571 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -63.7 | -39.6 | 175.5 | -71.3 | 173.6 | 0 | 0 | 0 | 112 | E190 N191 N197 T198 | E190-L194 WeakPolarHBondContact O-CG 3.34Å; E190-L194 PolarHBondContact O-N 2.85Å; N191-L194 PolarHBondContact O-N 3Å; L194-N197 PolarHBondContact O-N 3.21Å; L194-T198 WeakPolarHBondContact O-CB 3.47Å; L194-T198 PolarHBondContact O-N 3.37Å; L194-T198 PolarHBondContact O-OG1 3.21Å |
| 195 | G | 98.4 | Very high | 98.5 | Very high | 39 Ų | 39 | 93.6 Ų | 93.6 | 40% | 0.402 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.3 | -46.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112 | N191 E192 A193 T198 A199 | N191-G195 PolarHBondContact O-N 2.76Å; E192-G195 PolarHBondContact O-N 3.5Å; A193-G195 VanDerWaalsContact C-N 3.35Å; G195-T198 PolarHBondContact O-N 3.41Å; G195-A199 WeakPolarHBondContact O-CB 3.46Å; G195-A199 PolarHBondContact O-N 2.81Å |
| 196 | R | 98.5 | Very high | 98.5 | Very high | 173 Ų | 173 | 94.8 Ų | 94.8 | 65% | 0.653 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -61.6 | -45.3 | 175.2 | -74.8 | -175.1 | -72.4 | 151.7 | -6.4 | 112.5 | E192 A193 T198 A199 Q200 | E192-R196 WeakPolarHBondContact O-CG 3.33Å; E192-R196 PolarHBondContact O-N 2.88Å; A193-R196 PolarHBondContact O-N 2.99Å; R196-T198 VanDerWaalsContact C-N 3.32Å; R196-T198 PolarHBondContact O-N 3.25Å; R196-A199 PolarHBondContact O-N 3.06Å; R196-Q200 PolarHBondContact O-N 2.99Å |
| 197 | N | 98.6 | Very high | 98.5 | Very high | 87 Ų | 87 | 96.1 Ų | 96.1 | 47% | 0.465 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62 | -41.5 | 177.6 | -75 | -25.5 | 0 | 0 | 0 | 111.9 | A193 L194 Q200 L201 | A193-N197 PolarHBondContact O-N 3.37Å; A193-N197 PolarHBondContact O-ND2 2.9Å; L194-N197 PolarHBondContact O-N 3.21Å; N197-Q200 PolarHBondContact O-N 3.24Å; N197-L201 WeakPolarHBondContact O-CB 3.48Å; N197-L201 WeakPolarHBondContact O-CG 3.5Å; N197-L201 PolarHBondContact O-N 3.09Å |
| 198 | T | 98.4 | Very high | 98.4 | Very high | 93 Ų | 93 | 97.1 Ų | 97.1 | 57% | 0.571 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -64.2 | -44.8 | 178.6 | -55.4 | 0 | 0 | 0 | 0 | 111 | L194 G195 R196 Q200 L201 S202 | L194-T198 WeakPolarHBondContact O-CB 3.47Å; L194-T198 PolarHBondContact O-N 3.37Å; L194-T198 PolarHBondContact O-OG1 3.21Å; G195-T198 PolarHBondContact O-N 3.41Å; R196-T198 VanDerWaalsContact C-N 3.32Å; R196-T198 PolarHBondContact O-N 3.25Å; T198-Q200 PolarHBondContact O-N 3Å; T198-L201 PolarHBondContact O-N 2.93Å; T198-S202 PolarHBondContact O-N 3.48Å; T198-S202 PolarHBondContact O-OG 3.18Å |
| 199 | A | 98.3 | Very high | 98.4 | Very high | 57 Ų | 57 | 96.6 Ų | 96.6 | 47% | 0.471 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.1 | -39.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | G195 R196 S202 E203 | G195-A199 WeakPolarHBondContact O-CB 3.46Å; G195-A199 PolarHBondContact O-N 2.81Å; R196-A199 PolarHBondContact O-N 3.06Å; A199-S202 WeakPolarHBondContact CA-OG 3.44Å; A199-S202 PolarHBondContact O-OG 2.89Å; A199-E203 WeakPolarHBondContact O-CB 3.39Å; A199-E203 PolarHBondContact O-N 3.48Å; A199-E203 VanDerWaalsContact O-N 3.09Å |
| 200 | Q | 98.6 | Very high | 98.4 | Very high | 106 Ų | 106 | 96.6 Ų | 96.6 | 50% | 0.495 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -65.7 | -44 | 175.7 | -176.8 | 179.9 | -14.7 | 0 | 0 | 111.6 | R196 N197 T198 E203 Q204 | R196-Q200 PolarHBondContact O-N 2.99Å; N197-Q200 PolarHBondContact O-N 3.24Å; T198-Q200 PolarHBondContact O-N 3Å; Q200-E203 PolarHBondContact O-N 3.36Å; Q200-Q204 WeakPolarHBondContact O-CG 3.39Å; Q200-Q204 PolarHBondContact O-N 3.45Å |
| 201 | L | 98.4 | Very high | 98.4 | Very high | 112 Ų | 112 | 97.3 Ų | 97.3 | 59% | 0.586 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -66.3 | -38.4 | 178.3 | -73.5 | 172.2 | 0 | 0 | 0 | 112 | N197 T198 Q204 L205 | N197-L201 WeakPolarHBondContact O-CB 3.48Å; N197-L201 WeakPolarHBondContact O-CG 3.5Å; N197-L201 PolarHBondContact O-N 3.09Å; T198-L201 PolarHBondContact O-N 2.93Å; L201-Q204 PolarHBondContact O-N 3.36Å; L201-L205 WeakPolarHBondContact O-CB 3.34Å; L201-L205 PolarHBondContact O-N 3.32Å |
| 202 | S | 98.4 | Very high | 98.4 | Very high | 56 Ų | 56 | 95.4 Ų | 95.4 | 39% | 0.392 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.2 | -43.5 | 175.4 | 64.9 | 0 | 0 | 0 | 0 | 111.2 | T198 A199 Q204 L205 E206 | T198-S202 PolarHBondContact O-N 3.48Å; T198-S202 PolarHBondContact O-OG 3.18Å; A199-S202 WeakPolarHBondContact CA-OG 3.44Å; A199-S202 PolarHBondContact O-OG 2.89Å; S202-Q204 PolarHBondContact O-N 2.94Å; S202-L205 PolarHBondContact O-N 3.38Å; S202-E206 WeakPolarHBondContact O-CG 3.43Å; S202-E206 PolarHBondContact O-N 3.34Å |
| 203 | E | 98.5 | Very high | 98.4 | Very high | 90 Ų | 90 | 95 Ų | 95 | 42% | 0.421 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -65.6 | -37.9 | 177.6 | -160 | -163.1 | -172 | 0 | 0 | 112.1 | A199 Q200 R207 | A199-E203 WeakPolarHBondContact O-CB 3.39Å; A199-E203 PolarHBondContact O-N 3.48Å; A199-E203 VanDerWaalsContact O-N 3.09Å; Q200-E203 PolarHBondContact O-N 3.36Å; E203-R207 VanDerWaalsContact O-CG 3.31Å; E203-R207 WeakPolarHBondContact O-CG 3.46Å; E203-R207 PolarHBondContact O-N 3.38Å; E203-R207 IonicContact OE1-CZ 3.92Å; E203-R207 VanDerWaalsContact OE1-CZ 3.28Å; E203-R207 IonicContact OE1-NH1 2.96Å; E203-R207 PolarHBondContact OE1-NH1 3.37Å; E203-R207 IonicContact OE1-NH2 3.54Å; E203-R207 PolarHBondContact OE1-NH2 2.91Å; E203-R207 IonicContact OE2-CZ 3.49Å; E203-R207 IonicContact OE2-NH1 2.67Å; E203-R207 PolarHBondContact OE2-NH1 3.18Å; E203-R207 IonicContact OE2-NH2 3.62Å; E203-R207 PolarHBondContact OE2-NH2 3.4Å; E203-R207 VanDerWaalsContact OE2-NH2 3.13Å |
| 204 | Q | 98.6 | Very high | 98.4 | Very high | 95 Ų | 95 | 96 Ų | 96 | 44% | 0.444 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.5 | -40.1 | 173.1 | -75.8 | -174.6 | -23.8 | 0 | 0 | 112.2 | Q200 L201 S202 R207 M208 | Q200-Q204 WeakPolarHBondContact O-CG 3.39Å; Q200-Q204 PolarHBondContact O-N 3.45Å; L201-Q204 PolarHBondContact O-N 3.36Å; S202-Q204 PolarHBondContact O-N 2.94Å; Q204-R207 PolarHBondContact O-N 2.99Å; Q204-M208 WeakPolarHBondContact O-CB 3.46Å; Q204-M208 PolarHBondContact O-N 3.09Å |
| 205 | L | 98.5 | Very high | 98.4 | Very high | 122 Ų | 122 | 98.5 Ų | 98.5 | 64% | 0.639 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -65.3 | -43.2 | 177.2 | -172.2 | 146.3 | 0 | 0 | 0 | 111.3 | L201 S202 M208 S209 | L201-L205 WeakPolarHBondContact O-CB 3.34Å; L201-L205 PolarHBondContact O-N 3.32Å; S202-L205 PolarHBondContact O-N 3.38Å; L205-M208 PolarHBondContact O-N 3.2Å; L205-S209 WeakPolarHBondContact O-CB 3.45Å; L205-S209 PolarHBondContact O-N 3.36Å |
| 206 | E | 98.3 | Very high | 98.5 | Very high | 119 Ų | 119 | 105.1 Ų | 105.1 | 56% | 0.556 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -61.1 | -46.4 | 174.7 | -74.3 | 175.6 | -169.6 | 0 | 0 | 111.8 | S202 M208 S209 I210 | S202-E206 WeakPolarHBondContact O-CG 3.43Å; S202-E206 PolarHBondContact O-N 3.34Å; E206-M208 VanDerWaalsContact C-N 3.29Å; E206-M208 PolarHBondContact O-N 3.46Å; E206-S209 WeakPolarHBondContact O-CB 3.3Å; E206-S209 PolarHBondContact O-N 3.12Å; E206-I210 WeakPolarHBondContact O-CG1 3.46Å; E206-I210 PolarHBondContact O-N 2.77Å |
| 207 | R | 98.6 | Very high | 98.5 | Very high | 128 Ų | 128 | 100.5 Ų | 100.5 | 48% | 0.483 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -56.9 | -44.3 | 174.3 | -74.1 | 179.9 | -176.2 | 106.8 | -4.3 | 111.8 | E203 Q204 I210 Q211 | E203-R207 VanDerWaalsContact O-CG 3.31Å; E203-R207 WeakPolarHBondContact O-CG 3.46Å; E203-R207 PolarHBondContact O-N 3.38Å; E203-R207 IonicContact OE1-CZ 3.92Å; E203-R207 VanDerWaalsContact OE1-CZ 3.28Å; E203-R207 IonicContact OE1-NH1 2.96Å; E203-R207 PolarHBondContact OE1-NH1 3.37Å; E203-R207 IonicContact OE1-NH2 3.54Å; E203-R207 PolarHBondContact OE1-NH2 2.91Å; E203-R207 IonicContact OE2-CZ 3.49Å; E203-R207 IonicContact OE2-NH1 2.67Å; E203-R207 PolarHBondContact OE2-NH1 3.18Å; E203-R207 IonicContact OE2-NH2 3.62Å; E203-R207 PolarHBondContact OE2-NH2 3.4Å; E203-R207 VanDerWaalsContact OE2-NH2 3.13Å; Q204-R207 PolarHBondContact O-N 2.99Å; R207-I210 PolarHBondContact O-N 3.2Å; R207-Q211 WeakPolarHBondContact O-CG 3.37Å; R207-Q211 PolarHBondContact O-N 3.05Å; R207-Q211 VanDerWaalsContact O-N 3.13Å |
| 208 | M | 98.1 | Very high | 98.4 | Very high | 131 Ų | 131 | 102 Ų | 102 | 65% | 0.645 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -69.4 | -36 | 179.5 | -170.1 | 136.8 | 61.5 | 0 | 0 | 112.2 | Q204 L205 E206 Q211 C212 | Q204-M208 WeakPolarHBondContact O-CB 3.46Å; Q204-M208 PolarHBondContact O-N 3.09Å; L205-M208 PolarHBondContact O-N 3.2Å; E206-M208 VanDerWaalsContact C-N 3.29Å; E206-M208 PolarHBondContact O-N 3.46Å; M208-Q211 PolarHBondContact O-N 2.86Å; M208-C212 PolarHBondContact O-N 2.97Å; M208-C212 PolarHBondContact O-SG 3.47Å |
| 209 | S | 98.4 | Very high | 98.5 | Very high | 60 Ų | 60 | 104.1 Ų | 104.1 | 42% | 0.42 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.2 | -47.6 | 173.7 | -170.5 | 0 | 0 | 0 | 0 | 111.3 | L205 E206 Q211 C212 D213 | L205-S209 WeakPolarHBondContact O-CB 3.45Å; L205-S209 PolarHBondContact O-N 3.36Å; E206-S209 WeakPolarHBondContact O-CB 3.3Å; E206-S209 PolarHBondContact O-N 3.12Å; S209-Q211 VanDerWaalsContact C-N 3.3Å; S209-Q211 PolarHBondContact O-N 2.86Å; S209-C212 WeakPolarHBondContact O-CB 3.43Å; S209-C212 PolarHBondContact O-N 3.31Å; S209-C212 VanDerWaalsContact O-N 3.1Å; S209-D213 PolarHBondContact O-N 2.98Å |
| 210 | I | 98.4 | Very high | 98.5 | Very high | 103 Ų | 103 | 104 Ų | 104 | 53% | 0.528 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -59.8 | -42.8 | 177.2 | -65.6 | 164 | 0 | 0 | 0 | 110.6 | E206 R207 C212 D213 V214 | E206-I210 WeakPolarHBondContact O-CG1 3.46Å; E206-I210 PolarHBondContact O-N 2.77Å; R207-I210 PolarHBondContact O-N 3.2Å; I210-C212 VanDerWaalsContact C-N 3.33Å; I210-C212 PolarHBondContact O-N 3.24Å; I210-D213 PolarHBondContact O-N 3.1Å; I210-V214 WeakPolarHBondContact O-CG2 3.31Å; I210-V214 PolarHBondContact O-N 3.2Å |
| 211 | Q | 98.5 | Very high | 98.4 | Very high | 106 Ų | 106 | 101.4 Ų | 101.4 | 50% | 0.495 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.3 | -41.9 | 176 | -69.5 | -64.8 | -35.5 | 0 | 0 | 111.8 | R207 M208 S209 D213 V214 W215 | R207-Q211 WeakPolarHBondContact O-CG 3.37Å; R207-Q211 PolarHBondContact O-N 3.05Å; R207-Q211 VanDerWaalsContact O-N 3.13Å; M208-Q211 PolarHBondContact O-N 2.86Å; S209-Q211 VanDerWaalsContact C-N 3.3Å; S209-Q211 PolarHBondContact O-N 2.86Å; Q211-D213 VanDerWaalsContact C-N 3.3Å; Q211-D213 PolarHBondContact O-N 3.37Å; Q211-V214 PolarHBondContact O-N 3.41Å; Q211-W215 PolarHBondContact O-N 2.81Å |
| 212 | C | 98.4 | Very high | 98.4 | Very high | 75 Ų | 75 | 99.2 Ų | 99.2 | 51% | 0.507 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -58.9 | -42.5 | 175.9 | -67.4 | 0 | 0 | 0 | 0 | 111.7 | M208 S209 I210 W215 R216 | M208-C212 PolarHBondContact O-N 2.97Å; M208-C212 PolarHBondContact O-SG 3.47Å; S209-C212 WeakPolarHBondContact O-CB 3.43Å; S209-C212 PolarHBondContact O-N 3.31Å; S209-C212 VanDerWaalsContact O-N 3.1Å; I210-C212 VanDerWaalsContact C-N 3.33Å; I210-C212 PolarHBondContact O-N 3.24Å; C212-W215 PolarHBondContact O-N 2.96Å; C212-R216 VanDerWaalsContact O-CB 3.3Å; C212-R216 WeakPolarHBondContact O-CB 3.4Å; C212-R216 PolarHBondContact O-N 2.97Å |
| 213 | D | 98.3 | Very high | 98.4 | Very high | 99 Ų | 99 | 102.7 Ų | 102.7 | 53% | 0.529 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -66.5 | -41.4 | 177.8 | -71.7 | -25.6 | 0 | 0 | 0 | 112.5 | S209 I210 Q211 W215 R216 S217 | S209-D213 PolarHBondContact O-N 2.98Å; I210-D213 PolarHBondContact O-N 3.1Å; Q211-D213 VanDerWaalsContact C-N 3.3Å; Q211-D213 PolarHBondContact O-N 3.37Å; D213-W215 PolarHBondContact O-N 3.29Å; D213-R216 PolarHBondContact O-N 3.44Å; D213-S217 WeakPolarHBondContact O-CB 3.42Å; D213-S217 PolarHBondContact O-N 2.98Å |
| 214 | V | 98.6 | Very high | 98.4 | Very high | 55 Ų | 55 | 101.7 Ų | 101.7 | 33% | 0.333 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60 | -47 | 174.4 | 170.5 | 0 | 0 | 0 | 0 | 110.6 | I210 Q211 S217 K218 | I210-V214 WeakPolarHBondContact O-CG2 3.31Å; I210-V214 PolarHBondContact O-N 3.2Å; Q211-V214 PolarHBondContact O-N 3.41Å; V214-S217 PolarHBondContact O-N 2.76Å; V214-K218 HydrophobicContact CG1-CD 4.04Å; V214-K218 HydrophobicContact CG1-CG 4.48Å; V214-K218 WeakPolarHBondContact O-CB 3.27Å; V214-K218 WeakPolarHBondContact O-CG 3.35Å; V214-K218 PolarHBondContact O-N 3.13Å |
| 215 | W | 98.6 | Very high | 98.3 | Very high | 162 Ų | 162 | 102.8 Ų | 102.8 | 61% | 0.614 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -65.2 | -41.1 | 178.2 | -80 | 113.6 | 0 | 0 | 0 | 112.4 | Q211 C212 D213 S217 K218 F219 | Q211-W215 PolarHBondContact O-N 2.81Å; C212-W215 PolarHBondContact O-N 2.96Å; D213-W215 PolarHBondContact O-N 3.29Å; W215-S217 VanDerWaalsContact C-N 3.34Å; W215-S217 PolarHBondContact O-N 3.46Å; W215-K218 HydrophobicContact CE3-CD 4.41Å; W215-K218 PolarHBondContact O-N 3.36Å; W215-F219 VanDerWaalsContact O-CB 3.31Å; W215-F219 WeakPolarHBondContact O-CB 3.47Å; W215-F219 PolarHBondContact O-N 3.25Å |
| 216 | R | 98.6 | Very high | 98.3 | Very high | 178 Ų | 178 | 99.3 Ų | 99.3 | 67% | 0.672 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -59.2 | -46.4 | 174.7 | -171.5 | -176.9 | -174.4 | 98.5 | 0.1 | 111 | C212 D213 F219 L220 | C212-R216 VanDerWaalsContact O-CB 3.3Å; C212-R216 WeakPolarHBondContact O-CB 3.4Å; C212-R216 PolarHBondContact O-N 2.97Å; D213-R216 PolarHBondContact O-N 3.44Å; R216-F219 PolarHBondContact O-N 3.01Å; R216-L220 HydrophobicContact CG-CD1 4.26Å; R216-L220 WeakPolarHBondContact O-CB 3.31Å; R216-L220 VanDerWaalsContact O-CG 3.27Å; R216-L220 WeakPolarHBondContact O-CG 3.37Å; R216-L220 PolarHBondContact O-N 2.81Å |
| 217 | S | 98.4 | Very high | 98.3 | Very high | 77 Ų | 77 | 97.8 Ų | 97.8 | 54% | 0.538 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.3 | -47.6 | 178.1 | -174.7 | 0 | 0 | 0 | 0 | 112.1 | D213 V214 W215 F219 L220 A221 | D213-S217 WeakPolarHBondContact O-CB 3.42Å; D213-S217 PolarHBondContact O-N 2.98Å; V214-S217 PolarHBondContact O-N 2.76Å; W215-S217 VanDerWaalsContact C-N 3.34Å; W215-S217 PolarHBondContact O-N 3.46Å; S217-F219 PolarHBondContact O-N 3.32Å; S217-L220 PolarHBondContact O-N 3.05Å; S217-A221 WeakPolarHBondContact O-CB 3.41Å; S217-A221 PolarHBondContact O-N 3.25Å |
| 218 | K | 98.5 | Very high | 98.2 | Very high | 118 Ų | 118 | 97.3 Ų | 97.3 | 51% | 0.513 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -58.9 | -45 | 176.5 | -75.4 | 176.7 | 178.8 | 177.7 | 0 | 112.2 | V214 W215 A221 S222 | V214-K218 HydrophobicContact CG1-CD 4.04Å; V214-K218 HydrophobicContact CG1-CG 4.48Å; V214-K218 WeakPolarHBondContact O-CB 3.27Å; V214-K218 WeakPolarHBondContact O-CG 3.35Å; V214-K218 PolarHBondContact O-N 3.13Å; W215-K218 HydrophobicContact CE3-CD 4.41Å; W215-K218 PolarHBondContact O-N 3.36Å; K218-A221 PolarHBondContact O-N 2.63Å; K218-S222 VanDerWaalsContact O-CB 3.29Å; K218-S222 WeakPolarHBondContact O-CB 3.49Å; K218-S222 PolarHBondContact O-N 3.47Å |
| 219 | F | 98.6 | Very high | 98.2 | Very high | 137 Ų | 137 | 96.9 Ų | 96.9 | 60% | 0.601 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -62.4 | -44.8 | 177.7 | 178.2 | -99.2 | 0 | 0 | 0 | 111.6 | W215 R216 S217 S222 R223 | W215-F219 VanDerWaalsContact O-CB 3.31Å; W215-F219 WeakPolarHBondContact O-CB 3.47Å; W215-F219 PolarHBondContact O-N 3.25Å; R216-F219 PolarHBondContact O-N 3.01Å; S217-F219 PolarHBondContact O-N 3.32Å; F219-S222 PolarHBondContact O-N 3.47Å; F219-R223 WeakPolarHBondContact O-CB 3.38Å; F219-R223 PolarHBondContact O-N 3.34Å |
| 220 | L | 98.4 | Very high | 98.2 | Very high | 55 Ų | 55 | 98.2 Ų | 98.2 | 29% | 0.288 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.2 | -43.3 | 178.4 | -72.6 | 173 | 0 | 0 | 0 | 112.2 | R216 S217 R223 V224 | R216-L220 HydrophobicContact CG-CD1 4.26Å; R216-L220 WeakPolarHBondContact O-CB 3.31Å; R216-L220 VanDerWaalsContact O-CG 3.27Å; R216-L220 WeakPolarHBondContact O-CG 3.37Å; R216-L220 PolarHBondContact O-N 2.81Å; S217-L220 PolarHBondContact O-N 3.05Å; L220-R223 PolarHBondContact O-N 3.35Å; L220-V224 WeakPolarHBondContact O-CG2 3.39Å; L220-V224 PolarHBondContact O-N 3Å |
| 221 | A | 98.1 | Very high | 98.1 | Very high | 51 Ų | 51 | 98.4 Ų | 98.4 | 42% | 0.421 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.6 | -45.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | S217 K218 R223 V224 M225 | S217-A221 WeakPolarHBondContact O-CB 3.41Å; S217-A221 PolarHBondContact O-N 3.25Å; K218-A221 PolarHBondContact O-N 2.63Å; A221-R223 VanDerWaalsContact C-N 3.3Å; A221-R223 PolarHBondContact O-N 2.85Å; A221-V224 PolarHBondContact O-N 3.49Å; A221-M225 WeakPolarHBondContact O-CG 3.5Å; A221-M225 PolarHBondContact O-N 3.38Å |
| 222 | S | 98.2 | Very high | 98 | Very high | 67 Ų | 67 | 95.7 Ų | 95.7 | 47% | 0.469 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.7 | -38.5 | 176.3 | -178.3 | 0 | 0 | 0 | 0 | 112.4 | K218 F219 M225 A226 | K218-S222 VanDerWaalsContact O-CB 3.29Å; K218-S222 WeakPolarHBondContact O-CB 3.49Å; K218-S222 PolarHBondContact O-N 3.47Å; F219-S222 PolarHBondContact O-N 3.47Å; S222-M225 PolarHBondContact O-N 2.88Å; S222-A226 WeakPolarHBondContact O-CB 3.33Å; S222-A226 PolarHBondContact O-N 3.36Å |
| 223 | R | 98.1 | Very high | 98 | Very high | 128 Ų | 128 | 99.9 Ų | 99.9 | 48% | 0.483 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.7 | -45.5 | 175.7 | -171.8 | 179 | 71.7 | 174.1 | 3.1 | 111.8 | F219 L220 A221 M225 A226 D227 | F219-R223 WeakPolarHBondContact O-CB 3.38Å; F219-R223 PolarHBondContact O-N 3.34Å; L220-R223 PolarHBondContact O-N 3.35Å; A221-R223 VanDerWaalsContact C-N 3.3Å; A221-R223 PolarHBondContact O-N 2.85Å; R223-M225 VanDerWaalsContact C-N 3.34Å; R223-M225 PolarHBondContact O-N 2.88Å; R223-A226 WeakPolarHBondContact O-CB 3.45Å; R223-A226 PolarHBondContact O-N 3.4Å; R223-D227 VanDerWaalsContact O-CG 3.22Å; R223-D227 PolarHBondContact O-N 3.13Å |
| 224 | V | 97.9 | Very high | 97.9 | Very high | 70 Ų | 70 | 97.6 Ų | 97.6 | 42% | 0.424 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59.9 | -45.1 | 177 | 172.2 | 0 | 0 | 0 | 0 | 111 | L220 A221 A226 D227 E228 | L220-V224 WeakPolarHBondContact O-CG2 3.39Å; L220-V224 PolarHBondContact O-N 3Å; A221-V224 PolarHBondContact O-N 3.49Å; V224-A226 VanDerWaalsContact C-N 3.33Å; V224-A226 PolarHBondContact O-N 2.93Å; V224-D227 PolarHBondContact O-N 2.92Å; V224-E228 WeakPolarHBondContact O-CG 3.42Å; V224-E228 PolarHBondContact O-N 3.18Å |
| 225 | M | 97.6 | Very high | 97.7 | Very high | 118 Ų | 118 | 98.2 Ų | 98.2 | 58% | 0.581 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -62.1 | -40.1 | 176.1 | -69.5 | -172.3 | -67.4 | 0 | 0 | 112.3 | A221 S222 R223 E228 L229 | A221-M225 WeakPolarHBondContact O-CG 3.5Å; A221-M225 PolarHBondContact O-N 3.38Å; S222-M225 PolarHBondContact O-N 2.88Å; R223-M225 VanDerWaalsContact C-N 3.34Å; R223-M225 PolarHBondContact O-N 2.88Å; M225-E228 PolarHBondContact O-N 3.05Å; M225-L229 WeakPolarHBondContact O-CB 3.29Å; M225-L229 PolarHBondContact O-N 3.13Å |
| 226 | A | 98.1 | Very high | 97.5 | Very high | 48 Ų | 48 | 95.7 Ų | 95.7 | 40% | 0.397 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.8 | -44.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | S222 R223 V224 E228 L229 T230 | S222-A226 WeakPolarHBondContact O-CB 3.33Å; S222-A226 PolarHBondContact O-N 3.36Å; R223-A226 WeakPolarHBondContact O-CB 3.45Å; R223-A226 PolarHBondContact O-N 3.4Å; V224-A226 VanDerWaalsContact C-N 3.33Å; V224-A226 PolarHBondContact O-N 2.93Å; A226-E228 PolarHBondContact O-N 3.45Å; A226-L229 PolarHBondContact O-N 3.3Å; A226-T230 WeakPolarHBondContact O-CG2 3.42Å; A226-T230 PolarHBondContact O-N 2.8Å; A226-T230 PolarHBondContact O-OG1 3.27Å |
| 227 | D | 97.5 | Very high | 97.4 | Very high | 87 Ų | 87 | 92.4 Ų | 92.4 | 47% | 0.465 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.5 | -45.7 | 177.3 | -67.1 | -22 | 0 | 0 | 0 | 110.8 | R223 V224 L229 T230 N231 | R223-D227 VanDerWaalsContact O-CG 3.22Å; R223-D227 PolarHBondContact O-N 3.13Å; V224-D227 PolarHBondContact O-N 2.92Å; D227-L229 VanDerWaalsContact C-N 3.34Å; D227-L229 PolarHBondContact O-N 2.92Å; D227-T230 PolarHBondContact O-N 2.99Å; D227-T230 PolarHBondContact O-OG1 2.87Å; D227-N231 WeakPolarHBondContact O-CB 3.47Å; D227-N231 PolarHBondContact O-N 3.1Å |
| 228 | E | 97.4 | Very high | 97.3 | Very high | 119 Ų | 119 | 97.1 Ų | 97.1 | 56% | 0.556 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -60.6 | -41.3 | 175.6 | -73.7 | 175.1 | -178.5 | 0 | 0 | 112.4 | V224 M225 A226 N231 S232 | V224-E228 WeakPolarHBondContact O-CG 3.42Å; V224-E228 PolarHBondContact O-N 3.18Å; M225-E228 PolarHBondContact O-N 3.05Å; A226-E228 PolarHBondContact O-N 3.45Å; E228-N231 PolarHBondContact O-N 3.43Å; E228-S232 WeakPolarHBondContact O-CB 3.49Å; E228-S232 PolarHBondContact O-N 3.26Å; E228-S232 PolarHBondContact O-OG 3.19Å |
| 229 | L | 97.8 | Very high | 97.1 | Very high | 121 Ų | 121 | 93.5 Ų | 93.5 | 63% | 0.634 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -67.1 | -40.1 | 176.3 | -175.3 | 66.2 | 0 | 0 | 0 | 112.4 | M225 A226 D227 N231 S232 R233 | M225-L229 WeakPolarHBondContact O-CB 3.29Å; M225-L229 PolarHBondContact O-N 3.13Å; A226-L229 PolarHBondContact O-N 3.3Å; D227-L229 VanDerWaalsContact C-N 3.34Å; D227-L229 PolarHBondContact O-N 2.92Å; L229-N231 VanDerWaalsContact C-N 3.33Å; L229-S232 WeakPolarHBondContact CA-OG 3.42Å; L229-S232 PolarHBondContact O-OG 3.04Å; L229-R233 VanDerWaalsContact O-CB 3.3Å; L229-R233 WeakPolarHBondContact O-CB 3.46Å; L229-R233 PolarHBondContact O-N 2.94Å |
| 230 | T | 98 | Very high | 96.9 | Very high | 88 Ų | 88 | 91.4 Ų | 91.4 | 54% | 0.54 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -65.9 | -38.6 | 175.8 | 60.4 | 0 | 0 | 0 | 0 | 111.7 | A226 D227 A234 | A226-T230 WeakPolarHBondContact O-CG2 3.42Å; A226-T230 PolarHBondContact O-N 2.8Å; A226-T230 PolarHBondContact O-OG1 3.27Å; D227-T230 PolarHBondContact O-N 2.99Å; D227-T230 PolarHBondContact O-OG1 2.87Å; T230-A234 WeakPolarHBondContact O-CB 3.46Å; T230-A234 PolarHBondContact O-N 3.25Å |
| 231 | N | 97.3 | Very high | 96.8 | Very high | 107 Ų | 107 | 97.6 Ų | 97.6 | 57% | 0.572 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -67.2 | -46.3 | 177 | -172.7 | 55 | 0 | 0 | 0 | 111.7 | D227 E228 L229 R233 A234 V235 | D227-N231 WeakPolarHBondContact O-CB 3.47Å; D227-N231 PolarHBondContact O-N 3.1Å; E228-N231 PolarHBondContact O-N 3.43Å; L229-N231 VanDerWaalsContact C-N 3.33Å; N231-R233 VanDerWaalsContact C-N 3.32Å; N231-R233 PolarHBondContact O-N 2.85Å; N231-A234 PolarHBondContact O-N 3.39Å; N231-A234 VanDerWaalsContact O-N 3.16Å; N231-V235 WeakPolarHBondContact O-CG2 3.37Å; N231-V235 PolarHBondContact O-N 3.36Å |
| 232 | S | 96.1 | Very high | 96.7 | Very high | 50 Ų | 50 | 98.1 Ų | 98.1 | 35% | 0.35 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.9 | -41 | 176.8 | 66.8 | 0 | 0 | 0 | 0 | 111.7 | E228 L229 A234 V235 L236 | E228-S232 WeakPolarHBondContact O-CB 3.49Å; E228-S232 PolarHBondContact O-N 3.26Å; E228-S232 PolarHBondContact O-OG 3.19Å; L229-S232 WeakPolarHBondContact CA-OG 3.42Å; L229-S232 PolarHBondContact O-OG 3.04Å; S232-A234 PolarHBondContact O-N 2.86Å; S232-V235 PolarHBondContact O-N 2.88Å; S232-L236 WeakPolarHBondContact O-CB 3.41Å; S232-L236 WeakPolarHBondContact O-CG 3.5Å; S232-L236 PolarHBondContact O-N 3.44Å |
| 233 | R | 97.4 | Very high | 96.5 | Very high | 162 Ų | 162 | 96 Ų | 96 | 61% | 0.611 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -58.8 | -46.2 | 172.2 | 178 | 179.6 | 171.7 | 174.9 | 0.4 | 111.9 | L229 N231 V235 L236 Q237 | L229-R233 VanDerWaalsContact O-CB 3.3Å; L229-R233 WeakPolarHBondContact O-CB 3.46Å; L229-R233 PolarHBondContact O-N 2.94Å; N231-R233 VanDerWaalsContact C-N 3.32Å; N231-R233 PolarHBondContact O-N 2.85Å; R233-V235 VanDerWaalsContact C-N 3.33Å; R233-V235 PolarHBondContact O-N 3.43Å; R233-L236 PolarHBondContact O-N 3.45Å; R233-Q237 HydrophobicContact CG-CG 4.31Å; R233-Q237 WeakPolarHBondContact O-CB 3.4Å; R233-Q237 VanDerWaalsContact O-CG 3.25Å; R233-Q237 WeakPolarHBondContact O-CG 3.5Å; R233-Q237 PolarHBondContact O-N 3.48Å |
| 234 | A | 96.8 | Very high | 96.5 | Very high | 51 Ų | 51 | 95.3 Ų | 95.3 | 42% | 0.421 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -62.6 | -40.6 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112 | T230 N231 S232 Q237 R238 | T230-A234 WeakPolarHBondContact O-CB 3.46Å; T230-A234 PolarHBondContact O-N 3.25Å; N231-A234 PolarHBondContact O-N 3.39Å; N231-A234 VanDerWaalsContact O-N 3.16Å; S232-A234 PolarHBondContact O-N 2.86Å; A234-Q237 PolarHBondContact O-N 2.95Å; A234-R238 PolarHBondContact O-N 3.48Å |
| 235 | V | 94.7 | Very high | 96.4 | Very high | 69 Ų | 69 | 93.1 Ų | 93.1 | 42% | 0.418 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -62.8 | -50.8 | 174.8 | 172.2 | 0 | 0 | 0 | 0 | 111 | N231 S232 R233 Q237 R238 Q239 | N231-V235 WeakPolarHBondContact O-CG2 3.37Å; N231-V235 PolarHBondContact O-N 3.36Å; S232-V235 PolarHBondContact O-N 2.88Å; R233-V235 VanDerWaalsContact C-N 3.33Å; R233-V235 PolarHBondContact O-N 3.43Å; V235-Q237 VanDerWaalsContact C-N 3.31Å; V235-Q237 PolarHBondContact O-N 3.01Å; V235-R238 WeakPolarHBondContact O-CB 3.27Å; V235-R238 PolarHBondContact O-N 3.49Å; V235-R238 VanDerWaalsContact O-N 3.14Å; V235-Q239 HydrophobicContact CG1-CG 4.44Å; V235-Q239 WeakPolarHBondContact O-CG 3.5Å; V235-Q239 PolarHBondContact O-N 3.33Å |
| 236 | L | 94.4 | Very high | 96.3 | Very high | 108 Ų | 108 | 87.7 Ų | 87.7 | 57% | 0.565 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -60.8 | -39.4 | 178.5 | -73.2 | 171.1 | 0 | 0 | 0 | 112.1 | S232 R233 Q239 N240 | S232-L236 WeakPolarHBondContact O-CB 3.41Å; S232-L236 WeakPolarHBondContact O-CG 3.5Å; S232-L236 PolarHBondContact O-N 3.44Å; R233-L236 PolarHBondContact O-N 3.45Å; L236-Q239 PolarHBondContact O-N 3.16Å; L236-N240 WeakPolarHBondContact O-CB 3.3Å; L236-N240 PolarHBondContact O-N 2.93Å |
| 237 | Q | 96.6 | Very high | 96.3 | Very high | 109 Ų | 109 | 90.1 Ų | 90.1 | 51% | 0.509 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -64.6 | -39.1 | 175.9 | -77.4 | -179.8 | -35.8 | 0 | 0 | 112.1 | R233 A234 V235 R241 | R233-Q237 HydrophobicContact CG-CG 4.31Å; R233-Q237 WeakPolarHBondContact O-CB 3.4Å; R233-Q237 VanDerWaalsContact O-CG 3.25Å; R233-Q237 WeakPolarHBondContact O-CG 3.5Å; R233-Q237 PolarHBondContact O-N 3.48Å; A234-Q237 PolarHBondContact O-N 2.95Å; V235-Q237 VanDerWaalsContact C-N 3.31Å; V235-Q237 PolarHBondContact O-N 3.01Å; Q237-R241 PolarHBondContact O-N 3.03Å |
| 238 | R | 95.5 | Very high | 96.3 | Very high | 177 Ų | 177 | 92.6 Ų | 92.6 | 67% | 0.668 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -64.7 | -50.7 | 174.1 | -178.3 | 179.5 | -69.7 | 173.2 | -2.6 | 111 | A234 V235 N240 R241 D242 | A234-R238 PolarHBondContact O-N 3.48Å; V235-R238 WeakPolarHBondContact O-CB 3.27Å; V235-R238 PolarHBondContact O-N 3.49Å; V235-R238 VanDerWaalsContact O-N 3.14Å; R238-N240 VanDerWaalsContact C-N 3.25Å; R238-N240 PolarHBondContact O-N 2.98Å; R238-R241 WeakPolarHBondContact O-CA 3.41Å; R238-R241 WeakPolarHBondContact O-CB 3.21Å; R238-R241 PolarHBondContact O-N 3.47Å; R238-D242 PolarHBondContact O-N 3.41Å |
| 239 | Q | 94.4 | Very high | 96.2 | Very high | 42 Ų | 42 | 89.6 Ų | 89.6 | 20% | 0.196 | 45% | 0.45 | C | S | . | . | H | α-helix | trans | -56.8 | -40.9 | 177.1 | -71.6 | 176.3 | -24.1 | 0 | 0 | 112 | V235 L236 D242 A243 I343 L344 | V235-Q239 HydrophobicContact CG1-CG 4.44Å; V235-Q239 WeakPolarHBondContact O-CG 3.5Å; V235-Q239 PolarHBondContact O-N 3.33Å; L236-Q239 PolarHBondContact O-N 3.16Å; Q239-D242 PolarHBondContact O-N 3.42Å; Q239-A243 WeakPolarHBondContact O-CB 3.25Å; Q239-A243 PolarHBondContact O-N 2.98Å; Q239-I343 HydrophobicContact CG-CG2 4.04Å; Q239-L344 HydrophobicContact CB-CD2 3.93Å; Q239-L344 HydrophobicContact CG-CD2 4.43Å |
| 240 | N | 95.1 | Very high | 96.2 | Very high | 93 Ų | 93 | 86.7 Ų | 86.7 | 50% | 0.497 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -62.7 | -44.8 | 175.2 | -175 | -71.4 | 0 | 0 | 0 | 111.3 | L236 R238 D242 A243 H244 | L236-N240 WeakPolarHBondContact O-CB 3.3Å; L236-N240 PolarHBondContact O-N 2.93Å; R238-N240 VanDerWaalsContact C-N 3.25Å; R238-N240 PolarHBondContact O-N 2.98Å; N240-D242 VanDerWaalsContact C-N 3.35Å; N240-D242 PolarHBondContact O-N 2.86Å; N240-A243 PolarHBondContact O-N 2.99Å; N240-H244 PolarHBondContact O-N 3.48Å; N240-H244 PolarHBondContact O-ND1 3.48Å; N240-H244 PolarHBondContact OD1-CE1 3.43Å; N240-H244 PolarHBondContact OD1-ND1 2.96Å |
| 241 | R | 96.6 | Very high | 96.1 | Very high | 184 Ų | 184 | 86.9 Ų | 86.9 | 69% | 0.694 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -61.4 | -43.6 | 175.8 | -166.7 | -176.7 | 81.5 | 164.4 | 8.6 | 111.9 | Q237 R238 A243 H244 G245 | Q237-R241 PolarHBondContact O-N 3.03Å; R238-R241 WeakPolarHBondContact O-CA 3.41Å; R238-R241 WeakPolarHBondContact O-CB 3.21Å; R238-R241 PolarHBondContact O-N 3.47Å; R241-A243 VanDerWaalsContact C-N 3.34Å; R241-H244 PolarHBondContact O-N 3.44Å; R241-G245 PolarHBondContact O-N 3.32Å |
| 242 | D | 95.1 | Very high | 96.1 | Very high | 62 Ų | 62 | 84.9 Ų | 84.9 | 33% | 0.332 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -65.9 | -38.7 | -179.5 | -60.4 | -18.3 | 0 | 0 | 0 | 110.7 | R238 Q239 N240 G245 A246 V340 | R238-D242 PolarHBondContact O-N 3.41Å; Q239-D242 PolarHBondContact O-N 3.42Å; N240-D242 VanDerWaalsContact C-N 3.35Å; N240-D242 PolarHBondContact O-N 2.86Å; D242-G245 PolarHBondContact O-N 2.91Å; D242-A246 PolarHBondContact O-N 2.88Å; D242-V340 HydrophobicContact CB-CG2 4.2Å |
| 243 | A | 95.1 | Very high | 96 | Very high | 22 Ų | 22 | 84 Ų | 84 | 18% | 0.182 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -64.8 | -42 | 172.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | Q239 N240 R241 G245 A246 I247 V340 L344 | Q239-A243 WeakPolarHBondContact O-CB 3.25Å; Q239-A243 PolarHBondContact O-N 2.98Å; N240-A243 PolarHBondContact O-N 2.99Å; R241-A243 VanDerWaalsContact C-N 3.34Å; A243-G245 VanDerWaalsContact C-N 3.32Å; A243-G245 PolarHBondContact O-N 2.98Å; A243-A246 PolarHBondContact O-N 3.49Å; A243-I247 WeakPolarHBondContact O-CG1 3.35Å; A243-I247 PolarHBondContact O-N 3.23Å; A243-V340 HydrophobicContact CB-CG1 3.75Å; A243-L344 HydrophobicContact CB-CD1 4.48Å |
| 244 | H | 96.6 | Very high | 95.9 | Very high | 115 Ų | 115 | 82.3 Ų | 82.3 | 53% | 0.532 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -62.8 | -40.8 | 173.8 | -76.8 | 81.4 | 0 | 0 | 0 | 111.6 | N240 R241 I247 Q248 | N240-H244 PolarHBondContact O-N 3.48Å; N240-H244 PolarHBondContact O-ND1 3.48Å; N240-H244 PolarHBondContact OD1-CE1 3.43Å; N240-H244 PolarHBondContact OD1-ND1 2.96Å; R241-H244 PolarHBondContact O-N 3.44Å; H244-I247 PolarHBondContact O-N 3.38Å; H244-Q248 WeakPolarHBondContact O-CB 3.36Å; H244-Q248 PolarHBondContact O-N 3.03Å |
| 245 | G | 96.4 | Very high | 95.8 | Very high | 23 Ų | 23 | 82.8 Ų | 82.8 | 24% | 0.237 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -58.7 | -50.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112 | R241 D242 A243 I247 Q248 D249 | R241-G245 PolarHBondContact O-N 3.32Å; D242-G245 PolarHBondContact O-N 2.91Å; A243-G245 VanDerWaalsContact C-N 3.32Å; A243-G245 PolarHBondContact O-N 2.98Å; G245-I247 VanDerWaalsContact C-N 3.33Å; G245-I247 PolarHBondContact O-N 3.44Å; G245-Q248 WeakPolarHBondContact O-CB 3.47Å; G245-Q248 PolarHBondContact O-N 3.5Å; G245-Q248 VanDerWaalsContact O-N 3.1Å; G245-D249 PolarHBondContact O-N 2.98Å |
| 246 | A | 96.5 | Very high | 95.8 | Very high | 4 Ų | 4 | 84.6 Ų | 84.6 | 3% | 0.033 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -60.3 | -39.9 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113 | D242 A243 D249 L250 M336 A337 V340 | D242-A246 PolarHBondContact O-N 2.88Å; A243-A246 PolarHBondContact O-N 3.49Å; A246-D249 PolarHBondContact O-N 3.29Å; A246-L250 WeakPolarHBondContact O-CB 3.35Å; A246-L250 VanDerWaalsContact O-CG 3.32Å; A246-L250 WeakPolarHBondContact O-CG 3.34Å; A246-L250 PolarHBondContact O-N 3.44Å; A246-M336 HydrophobicContact CB-CG 4.18Å; A246-M336 HydrophobicContact CB-SD 4.29Å; A246-A337 HydrophobicContact CB-CB 4.21Å; A246-V340 HydrophobicContact CB-CG2 4.2Å |
| 247 | I | 96.6 | Very high | 95.7 | Very high | 99 Ų | 99 | 83.7 Ų | 83.7 | 51% | 0.508 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -64.2 | -43.6 | 174.8 | -68.6 | 167.6 | 0 | 0 | 0 | 110.7 | A243 H244 G245 D249 L250 L251 | A243-I247 WeakPolarHBondContact O-CG1 3.35Å; A243-I247 PolarHBondContact O-N 3.23Å; H244-I247 PolarHBondContact O-N 3.38Å; G245-I247 VanDerWaalsContact C-N 3.33Å; G245-I247 PolarHBondContact O-N 3.44Å; I247-D249 VanDerWaalsContact C-N 3.34Å; I247-L250 PolarHBondContact O-N 2.92Å; I247-L251 HydrophobicContact CG2-CD1 3.99Å; I247-L251 HydrophobicContact CG2-CG 4.37Å; I247-L251 WeakPolarHBondContact O-CB 3.41Å; I247-L251 VanDerWaalsContact O-CG 3.28Å; I247-L251 WeakPolarHBondContact O-CG 3.42Å; I247-L251 PolarHBondContact O-N 3Å |
| 248 | Q | 97.8 | Very high | 95.6 | Very high | 139 Ų | 139 | 81.9 Ų | 81.9 | 65% | 0.65 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -61.8 | -44.3 | 178.7 | -177.9 | 172 | -0.6 | 0 | 0 | 111.4 | H244 G245 L251 S252 | H244-Q248 WeakPolarHBondContact O-CB 3.36Å; H244-Q248 PolarHBondContact O-N 3.03Å; G245-Q248 WeakPolarHBondContact O-CB 3.47Å; G245-Q248 PolarHBondContact O-N 3.5Å; G245-Q248 VanDerWaalsContact O-N 3.1Å; Q248-L251 PolarHBondContact O-N 2.86Å; Q248-S252 WeakPolarHBondContact O-CB 3.31Å; Q248-S252 PolarHBondContact O-N 3.37Å |
| 249 | D | 96.7 | Very high | 95.5 | Very high | 57 Ų | 57 | 78.8 Ų | 78.8 | 31% | 0.305 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -63.2 | -45.5 | 178 | -68.5 | -13.8 | 0 | 0 | 0 | 110.8 | G245 A246 I247 L251 S252 E253 A333 M336 | G245-D249 PolarHBondContact O-N 2.98Å; A246-D249 PolarHBondContact O-N 3.29Å; I247-D249 VanDerWaalsContact C-N 3.34Å; D249-L251 VanDerWaalsContact C-N 3.34Å; D249-L251 PolarHBondContact O-N 2.87Å; D249-S252 PolarHBondContact O-N 3.39Å; D249-S252 VanDerWaalsContact O-N 3.1Å; D249-S252 PolarHBondContact O-OG 3.4Å; D249-E253 PolarHBondContact O-N 2.68Å; D249-A333 HydrophobicContact CB-CB 3.67Å; D249-M336 VanDerWaalsContact OD2-CE 3.27Å; D249-M336 WeakPolarHBondContact OD2-CE 3.32Å |
| 250 | L | 96.7 | Very high | 95.5 | Very high | 60 Ų | 60 | 81.4 Ų | 81.4 | 31% | 0.314 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -59.3 | -42.2 | 175.3 | -77.8 | 173.1 | 0 | 0 | 0 | 112.7 | A246 I247 S252 R254 A333 E334 A337 | A246-L250 WeakPolarHBondContact O-CB 3.35Å; A246-L250 VanDerWaalsContact O-CG 3.32Å; A246-L250 WeakPolarHBondContact O-CG 3.34Å; A246-L250 PolarHBondContact O-N 3.44Å; I247-L250 PolarHBondContact O-N 2.92Å; L250-S252 VanDerWaalsContact C-N 3.3Å; L250-R254 VanDerWaalsContact O-CB 3.25Å; L250-R254 WeakPolarHBondContact O-CB 3.4Å; L250-R254 PolarHBondContact O-N 3.14Å; L250-A333 HydrophobicContact CD2-CB 3.91Å; L250-A333 HydrophobicContact CG-CB 4.09Å; L250-E334 HydrophobicContact CD2-CG 3.81Å; L250-A337 HydrophobicContact CD1-CB 3.74Å; L250-A337 HydrophobicContact CG-CB 4.39Å |
| 251 | L | 96.4 | Very high | 95.4 | Very high | 91 Ų | 91 | 78.8 Ų | 78.8 | 48% | 0.476 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -66.5 | -35.3 | 177 | -71.2 | 175.4 | 0 | 0 | 0 | 111.6 | I247 Q248 D249 E255 | I247-L251 HydrophobicContact CG2-CD1 3.99Å; I247-L251 HydrophobicContact CG2-CG 4.37Å; I247-L251 WeakPolarHBondContact O-CB 3.41Å; I247-L251 VanDerWaalsContact O-CG 3.28Å; I247-L251 WeakPolarHBondContact O-CG 3.42Å; I247-L251 PolarHBondContact O-N 3Å; Q248-L251 PolarHBondContact O-N 2.86Å; D249-L251 VanDerWaalsContact C-N 3.34Å; D249-L251 PolarHBondContact O-N 2.87Å; L251-E255 WeakPolarHBondContact O-CB 3.23Å; L251-E255 PolarHBondContact O-N 3.41Å |
| 252 | S | 96.3 | Very high | 95.2 | Very high | 65 Ų | 65 | 72.5 Ų | 72.5 | 46% | 0.455 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -69.2 | -45.2 | 177.7 | 79 | 0 | 0 | 0 | 0 | 112.4 | Q248 D249 L250 E255 Q256 | Q248-S252 WeakPolarHBondContact O-CB 3.31Å; Q248-S252 PolarHBondContact O-N 3.37Å; D249-S252 PolarHBondContact O-N 3.39Å; D249-S252 VanDerWaalsContact O-N 3.1Å; D249-S252 PolarHBondContact O-OG 3.4Å; L250-S252 VanDerWaalsContact C-N 3.3Å; S252-E255 WeakPolarHBondContact O-CB 3.39Å; S252-E255 PolarHBondContact O-N 3.29Å; S252-Q256 PolarHBondContact O-N 3.02Å |
| 253 | E | 95.5 | Very high | 95.1 | Very high | 33 Ų | 33 | 71.9 Ų | 71.9 | 15% | 0.154 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -64.8 | -42.3 | 175.6 | -72.9 | -175.2 | 173.2 | 0 | 0 | 110.9 | D249 E255 Q256 F257 T331 P332 A333 | D249-E253 PolarHBondContact O-N 2.68Å; E253-E255 VanDerWaalsContact C-N 3.26Å; E253-E255 PolarHBondContact O-N 2.99Å; E253-Q256 WeakPolarHBondContact O-CB 3.03Å; E253-Q256 PolarHBondContact O-N 3.42Å; E253-Q256 VanDerWaalsContact O-N 3.16Å; E253-F257 HydrophobicContact CB-CE2 4.18Å; E253-F257 WeakPolarHBondContact O-CD2 3.5Å; E253-F257 WeakPolarHBondContact O-CG 3.31Å; E253-F257 PolarHBondContact O-N 3.49Å; E253-T331 WeakPolarHBondContact OE2-CB 3.26Å; E253-T331 PolarHBondContact OE2-OG1 3.08Å; E253-P332 WeakPolarHBondContact OE1-CD 3.35Å; E253-A333 HydrophobicContact CG-CB 4.08Å; E253-A333 WeakPolarHBondContact OE1-CB 3.33Å; E253-A333 PolarHBondContact OE1-N 3.4Å; E253-A333 VanDerWaalsContact OE2-CB 3.25Å; E253-A333 WeakPolarHBondContact OE2-CB 3.46Å |
| 254 | R | 94.8 | Very high | 95.1 | Very high | 125 Ų | 125 | 73.8 Ų | 73.8 | 47% | 0.472 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -57.9 | -40.2 | 173.8 | 175.7 | 179.8 | 145.7 | -102 | -4.3 | 112 | L250 R258 | L250-R254 VanDerWaalsContact O-CB 3.25Å; L250-R254 WeakPolarHBondContact O-CB 3.4Å; L250-R254 PolarHBondContact O-N 3.14Å; R254-R258 WeakPolarHBondContact O-CB 3.49Å; R254-R258 PolarHBondContact O-N 3.08Å |
| 255 | E | 94.9 | Very high | 94.8 | Very high | 62 Ų | 62 | 69 Ų | 69 | 29% | 0.29 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -67.5 | -41 | 177.6 | 177.2 | 53.6 | -152.2 | 0 | 0 | 111.5 | L251 S252 E253 R258 Q259 | L251-E255 WeakPolarHBondContact O-CB 3.23Å; L251-E255 PolarHBondContact O-N 3.41Å; S252-E255 WeakPolarHBondContact O-CB 3.39Å; S252-E255 PolarHBondContact O-N 3.29Å; E253-E255 VanDerWaalsContact C-N 3.26Å; E253-E255 PolarHBondContact O-N 2.99Å; E255-R258 WeakPolarHBondContact O-CB 3.43Å; E255-R258 PolarHBondContact O-N 3.32Å; E255-R258 IonicContact OE1-CZ 3.94Å; E255-R258 IonicContact OE1-NE 3.62Å; E255-R258 IonicContact OE1-NH2 3.21Å; E255-R258 PolarHBondContact OE1-NH2 3.35Å; E255-R258 IonicContact OE2-CZ 3.7Å; E255-R258 VanDerWaalsContact OE2-CZ 3.32Å; E255-R258 IonicContact OE2-NE 2.75Å; E255-R258 PolarHBondContact OE2-NE 2.92Å; E255-R258 IonicContact OE2-NH2 3.15Å; E255-R258 PolarHBondContact OE2-NH2 3.06Å; E255-Q259 WeakPolarHBondContact O-CG 3.22Å; E255-Q259 PolarHBondContact O-N 3.17Å; E255-Q259 PolarHBondContact OE1-NE2 2.98Å |
| 256 | Q | 94.6 | Very high | 94.6 | Very high | 106 Ų | 106 | 73.7 Ų | 73.7 | 50% | 0.495 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -59.2 | -50.4 | 172.3 | -176.1 | -177.4 | -15.5 | 0 | 0 | 111.5 | S252 E253 R258 Q259 E260 | S252-Q256 PolarHBondContact O-N 3.02Å; E253-Q256 WeakPolarHBondContact O-CB 3.03Å; E253-Q256 PolarHBondContact O-N 3.42Å; E253-Q256 VanDerWaalsContact O-N 3.16Å; Q256-R258 PolarHBondContact O-N 3.48Å; Q256-Q259 WeakPolarHBondContact O-CB 3.4Å; Q256-Q259 PolarHBondContact O-N 3.02Å; Q256-E260 PolarHBondContact NE2-OE1 3.45Å; Q256-E260 PolarHBondContact O-N 3.28Å |
| 257 | F | 92.5 | Very high | 94.4 | Very high | 90 Ų | 90 | 78.9 Ų | 78.9 | 40% | 0.395 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -59.3 | -36.8 | 177 | -67.9 | -46.7 | 0 | 0 | 0 | 112.5 | E253 E260 M261 T331 | E253-F257 HydrophobicContact CB-CE2 4.18Å; E253-F257 WeakPolarHBondContact O-CD2 3.5Å; E253-F257 WeakPolarHBondContact O-CG 3.31Å; E253-F257 PolarHBondContact O-N 3.49Å; F257-E260 PolarHBondContact O-N 3.16Å; F257-M261 WeakPolarHBondContact O-CB 3.37Å; F257-M261 WeakPolarHBondContact O-CG 3.45Å; F257-M261 PolarHBondContact O-N 3.31Å; F257-T331 HydrophobicContact CE2-CG2 4.1Å; F257-T331 HydrophobicContact CZ-CG2 3.93Å |
| 258 | R | 93.5 | Very high | 94.1 | Very high | 71 Ų | 71 | 75.9 Ų | 75.9 | 27% | 0.268 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -63.4 | -41.9 | 175.9 | -167.3 | -175.3 | 67.2 | 79.7 | -0 | 111.4 | R254 E255 Q256 M261 I262 L295 | R254-R258 WeakPolarHBondContact O-CB 3.49Å; R254-R258 PolarHBondContact O-N 3.08Å; E255-R258 WeakPolarHBondContact O-CB 3.43Å; E255-R258 PolarHBondContact O-N 3.32Å; E255-R258 IonicContact OE1-CZ 3.94Å; E255-R258 IonicContact OE1-NE 3.62Å; E255-R258 IonicContact OE1-NH2 3.21Å; E255-R258 PolarHBondContact OE1-NH2 3.35Å; E255-R258 IonicContact OE2-CZ 3.7Å; E255-R258 VanDerWaalsContact OE2-CZ 3.32Å; E255-R258 IonicContact OE2-NE 2.75Å; E255-R258 PolarHBondContact OE2-NE 2.92Å; E255-R258 IonicContact OE2-NH2 3.15Å; E255-R258 PolarHBondContact OE2-NH2 3.06Å; Q256-R258 PolarHBondContact O-N 3.48Å; R258-M261 PolarHBondContact O-N 3.43Å; R258-I262 HydrophobicContact CG-CD1 4.37Å; R258-I262 VanDerWaalsContact NH1-CD1 3.26Å; R258-I262 VanDerWaalsContact O-CG1 3.31Å; R258-I262 WeakPolarHBondContact O-CG1 3.25Å; R258-I262 PolarHBondContact O-N 3.34Å; R258-L295 HydrophobicContact CG-CD1 3.55Å |
| 259 | Q | 93.9 | Very high | 93.7 | Very high | 111 Ų | 111 | 70.6 Ų | 70.6 | 52% | 0.519 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -65.3 | -43.9 | 177.4 | -69.2 | 173.7 | 15.6 | 0 | 0 | 111.7 | E255 Q256 M261 I262 A263 | E255-Q259 WeakPolarHBondContact O-CG 3.22Å; E255-Q259 PolarHBondContact O-N 3.17Å; E255-Q259 PolarHBondContact OE1-NE2 2.98Å; Q256-Q259 WeakPolarHBondContact O-CB 3.4Å; Q256-Q259 PolarHBondContact O-N 3.02Å; Q259-M261 PolarHBondContact O-N 3.23Å; Q259-I262 PolarHBondContact O-N 2.9Å; Q259-A263 PolarHBondContact O-N 3.5Å |
| 260 | E | 94.1 | Very high | 93.3 | Very high | 98 Ų | 98 | 73.6 Ų | 73.6 | 46% | 0.458 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -60 | -45 | 174.8 | -70.3 | 174.9 | -168.6 | 0 | 0 | 111.2 | Q256 F257 I262 A263 T264 | Q256-E260 PolarHBondContact NE2-OE1 3.45Å; Q256-E260 PolarHBondContact O-N 3.28Å; F257-E260 PolarHBondContact O-N 3.16Å; E260-I262 VanDerWaalsContact C-N 3.33Å; E260-I262 PolarHBondContact O-N 3.32Å; E260-A263 WeakPolarHBondContact O-CB 3.21Å; E260-A263 PolarHBondContact O-N 2.91Å; E260-A263 VanDerWaalsContact O-N 3.12Å; E260-T264 WeakPolarHBondContact O-CG2 3.38Å; E260-T264 PolarHBondContact O-N 3.37Å |
| 261 | M | 92.7 | Very high | 93 | Very high | 38 Ų | 38 | 74.5 Ų | 74.5 | 19% | 0.187 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -65.3 | -32.4 | 177.4 | -78.8 | -156.1 | -77.1 | 0 | 0 | 114.2 | F257 R258 Q259 T264 Q265 T292 L295 A296 N299 | F257-M261 WeakPolarHBondContact O-CB 3.37Å; F257-M261 WeakPolarHBondContact O-CG 3.45Å; F257-M261 PolarHBondContact O-N 3.31Å; R258-M261 PolarHBondContact O-N 3.43Å; Q259-M261 PolarHBondContact O-N 3.23Å; M261-T264 WeakPolarHBondContact CA-OG1 3.28Å; M261-T264 PolarHBondContact O-OG1 2.94Å; M261-Q265 WeakPolarHBondContact O-CB 3.3Å; M261-Q265 PolarHBondContact O-N 3.41Å; M261-T292 HydrophobicContact CE-CG2 3.3Å; M261-T292 VanDerWaalsContact CE-O 3.23Å; M261-T292 WeakPolarHBondContact CE-O 3.39Å; M261-L295 HydrophobicContact CB-CB 4.13Å; M261-L295 HydrophobicContact CB-CD1 4.47Å; M261-L295 HydrophobicContact CE-CB 4.28Å; M261-L295 HydrophobicContact SD-CB 4.27Å; M261-A296 HydrophobicContact CE-CB 4.39Å; M261-A296 HydrophobicContact SD-CB 3.72Å; M261-N299 PolarHBondContact O-ND2 3.1Å |
| 262 | I | 92.5 | Very high | 92.5 | Very high | 52 Ų | 52 | 70.4 Ų | 70.4 | 27% | 0.267 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -67.8 | -41.2 | 172.2 | -71.6 | 166.3 | 0 | 0 | 0 | 110.2 | R258 Q259 E260 Q265 K266 L295 | R258-I262 HydrophobicContact CG-CD1 4.37Å; R258-I262 VanDerWaalsContact NH1-CD1 3.26Å; R258-I262 VanDerWaalsContact O-CG1 3.31Å; R258-I262 WeakPolarHBondContact O-CG1 3.25Å; R258-I262 PolarHBondContact O-N 3.34Å; Q259-I262 PolarHBondContact O-N 2.9Å; E260-I262 VanDerWaalsContact C-N 3.33Å; E260-I262 PolarHBondContact O-N 3.32Å; I262-Q265 PolarHBondContact O-N 2.75Å; I262-K266 WeakPolarHBondContact O-CG 3.25Å; I262-K266 PolarHBondContact O-N 3.02Å; I262-L295 HydrophobicContact CD1-CD1 4.25Å; I262-L295 HydrophobicContact CG1-CD1 3.8Å; I262-L295 HydrophobicContact CG1-CD2 3.91Å |
| 263 | A | 93.3 | Very high | 92 | Very high | 49 Ų | 49 | 69.9 Ų | 69.9 | 41% | 0.405 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -63.4 | -43.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | Q259 E260 Q265 K266 L267 | Q259-A263 PolarHBondContact O-N 3.5Å; E260-A263 WeakPolarHBondContact O-CB 3.21Å; E260-A263 PolarHBondContact O-N 2.91Å; E260-A263 VanDerWaalsContact O-N 3.12Å; A263-Q265 VanDerWaalsContact C-N 3.32Å; A263-Q265 PolarHBondContact O-N 3.3Å; A263-K266 PolarHBondContact O-N 2.96Å; A263-L267 WeakPolarHBondContact O-CG 3.49Å; A263-L267 PolarHBondContact O-N 3.03Å; A263-L267 VanDerWaalsContact O-N 3.09Å |
| 264 | T | 94 | Very high | 91.5 | Very high | 61 Ų | 61 | 72.2 Ų | 72.2 | 37% | 0.374 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -63.5 | -38.8 | 175.1 | 58.5 | 0 | 0 | 0 | 0 | 112 | E260 M261 L267 L268 N299 | E260-T264 WeakPolarHBondContact O-CG2 3.38Å; E260-T264 PolarHBondContact O-N 3.37Å; M261-T264 WeakPolarHBondContact CA-OG1 3.28Å; M261-T264 PolarHBondContact O-OG1 2.94Å; T264-L267 PolarHBondContact O-N 3.12Å; T264-L268 WeakPolarHBondContact O-CB 3.32Å; T264-L268 VanDerWaalsContact O-CG 3.31Å; T264-L268 WeakPolarHBondContact O-CG 3.45Å; T264-L268 PolarHBondContact O-N 3.24Å; T264-N299 PolarHBondContact OG1-ND2 2.75Å; T264-N299 PolarHBondContact OG1-OD1 2.92Å |
| 265 | Q | 91.6 | Very high | 91 | Very high | 15 Ų | 15 | 69.6 Ų | 69.6 | 7% | 0.07 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -59.6 | -50.7 | 176.7 | -178.1 | 178.2 | -22 | 0 | 0 | 110.5 | M261 I262 A263 L267 L268 E269 N299 L302 | M261-Q265 WeakPolarHBondContact O-CB 3.3Å; M261-Q265 PolarHBondContact O-N 3.41Å; I262-Q265 PolarHBondContact O-N 2.75Å; A263-Q265 VanDerWaalsContact C-N 3.32Å; A263-Q265 PolarHBondContact O-N 3.3Å; Q265-L267 VanDerWaalsContact C-N 3.34Å; Q265-L267 PolarHBondContact O-N 2.89Å; Q265-L268 PolarHBondContact O-N 3.27Å; Q265-E269 HydrophobicContact CG-CG 4.26Å; Q265-E269 WeakPolarHBondContact CG-OE1 3.48Å; Q265-E269 PolarHBondContact NE2-OE1 2.84Å; Q265-E269 WeakPolarHBondContact O-CB 3.45Å; Q265-E269 VanDerWaalsContact O-CG 3.3Å; Q265-E269 WeakPolarHBondContact O-CG 3.44Å; Q265-E269 PolarHBondContact O-N 2.92Å; Q265-N299 WeakPolarHBondContact CA-OD1 3.49Å; Q265-N299 VanDerWaalsContact CB-OD1 3.23Å; Q265-N299 WeakPolarHBondContact CB-OD1 3.42Å; Q265-N299 PolarHBondContact N-OD1 2.91Å; Q265-L302 HydrophobicContact CG-CD1 3.84Å |
| 266 | K | 90.9 | Very high | 90.3 | Very high | 121 Ų | 121 | 67.4 Ų | 67.4 | 53% | 0.526 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -56.3 | -46.5 | 178 | -71.7 | 178 | 179.9 | -178.4 | 0 | 112.1 | I262 A263 L268 E269 E270 | I262-K266 WeakPolarHBondContact O-CG 3.25Å; I262-K266 PolarHBondContact O-N 3.02Å; A263-K266 PolarHBondContact O-N 2.96Å; K266-L268 PolarHBondContact O-N 3.42Å; K266-E269 PolarHBondContact O-N 3.4Å; K266-E270 WeakPolarHBondContact O-CB 3.44Å; K266-E270 VanDerWaalsContact O-CG 3.31Å; K266-E270 WeakPolarHBondContact O-CG 3.41Å; K266-E270 PolarHBondContact O-N 2.53Å |
| 267 | L | 92.5 | Very high | 89 | Confident | 114 Ų | 114 | 73.8 Ų | 73.8 | 60% | 0.597 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -62.5 | -41.5 | 178.1 | -71.3 | 171.8 | 0 | 0 | 0 | 112.4 | A263 T264 Q265 L271 | A263-L267 WeakPolarHBondContact O-CG 3.49Å; A263-L267 PolarHBondContact O-N 3.03Å; A263-L267 VanDerWaalsContact O-N 3.09Å; T264-L267 PolarHBondContact O-N 3.12Å; Q265-L267 VanDerWaalsContact C-N 3.34Å; Q265-L267 PolarHBondContact O-N 2.89Å; L267-L271 VanDerWaalsContact O-CB 3.26Å; L267-L271 WeakPolarHBondContact O-CB 3.28Å; L267-L271 PolarHBondContact O-N 2.94Å |
| 268 | L | 91 | Very high | 87.5 | Confident | 36 Ų | 36 | 73.3 Ų | 73.3 | 19% | 0.188 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -68.9 | -37.8 | 177.5 | -72.2 | 173.4 | 0 | 0 | 0 | 112.2 | T264 Q265 K266 L272 N299 L302 A303 | T264-L268 WeakPolarHBondContact O-CB 3.32Å; T264-L268 VanDerWaalsContact O-CG 3.31Å; T264-L268 WeakPolarHBondContact O-CG 3.45Å; T264-L268 PolarHBondContact O-N 3.24Å; Q265-L268 PolarHBondContact O-N 3.27Å; K266-L268 PolarHBondContact O-N 3.42Å; L268-L272 VanDerWaalsContact O-CB 3.25Å; L268-L272 WeakPolarHBondContact O-CB 3.37Å; L268-L272 PolarHBondContact O-N 3.31Å; L268-N299 HydrophobicContact CD1-CB 4.44Å; L268-L302 HydrophobicContact CB-CB 3.93Å; L268-L302 HydrophobicContact CB-CD1 4.2Å; L268-L302 HydrophobicContact CD1-CB 4.11Å; L268-A303 HydrophobicContact CD1-CB 4.21Å |
| 269 | E | 89.3 | Confident | 86.2 | Confident | 27 Ų | 27 | 80.3 Ų | 80.3 | 13% | 0.126 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -63.6 | -48.8 | 173.6 | -71.4 | 179.3 | -177.7 | 0 | 0 | 111.1 | Q265 K266 L271 L272 V273 Y283 L302 | Q265-E269 HydrophobicContact CG-CG 4.26Å; Q265-E269 WeakPolarHBondContact CG-OE1 3.48Å; Q265-E269 PolarHBondContact NE2-OE1 2.84Å; Q265-E269 WeakPolarHBondContact O-CB 3.45Å; Q265-E269 VanDerWaalsContact O-CG 3.3Å; Q265-E269 WeakPolarHBondContact O-CG 3.44Å; Q265-E269 PolarHBondContact O-N 2.92Å; K266-E269 PolarHBondContact O-N 3.4Å; E269-L271 VanDerWaalsContact C-N 3.33Å; E269-L271 PolarHBondContact O-N 3.12Å; E269-L272 PolarHBondContact O-N 2.95Å; E269-V273 WeakPolarHBondContact O-CG2 3.47Å; E269-V273 PolarHBondContact O-N 3.42Å; E269-Y283 HydrophobicContact CB-CE1 4.13Å; E269-Y283 VanDerWaalsContact CD-OH 3.31Å; E269-Y283 HydrophobicContact CG-CE1 3.67Å; E269-Y283 WeakPolarHBondContact CG-OH 3.43Å; E269-Y283 PolarHBondContact OE1-OH 2.89Å; E269-L302 HydrophobicContact CG-CD1 3.69Å; E269-L302 HydrophobicContact CG-CD2 4.35Å |
| 270 | E | 88.9 | Confident | 84.9 | Confident | 120 Ų | 120 | 83.6 Ų | 83.6 | 56% | 0.561 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -58.7 | -43.9 | 176.3 | -75.7 | 173.5 | -165.5 | 0 | 0 | 111.8 | K266 V273 S274 | K266-E270 WeakPolarHBondContact O-CB 3.44Å; K266-E270 VanDerWaalsContact O-CG 3.31Å; K266-E270 WeakPolarHBondContact O-CG 3.41Å; K266-E270 PolarHBondContact O-N 2.53Å; E270-V273 PolarHBondContact O-N 3.28Å; E270-S274 WeakPolarHBondContact O-CB 3.13Å; E270-S274 PolarHBondContact O-N 2.96Å; E270-S274 PolarHBondContact O-OG 2.95Å |
| 271 | L | 89.1 | Confident | 83.7 | Confident | 79 Ų | 79 | 84.8 Ų | 84.8 | 41% | 0.414 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -64.1 | -45.7 | 176.6 | -177.2 | 64.9 | 0 | 0 | 0 | 111.4 | L267 E269 V273 S274 L275 V306 | L267-L271 VanDerWaalsContact O-CB 3.26Å; L267-L271 WeakPolarHBondContact O-CB 3.28Å; L267-L271 PolarHBondContact O-N 2.94Å; E269-L271 VanDerWaalsContact C-N 3.33Å; E269-L271 PolarHBondContact O-N 3.12Å; L271-V273 PolarHBondContact O-N 3.2Å; L271-S274 PolarHBondContact O-N 3.2Å; L271-L275 HydrophobicContact CD1-CD1 4.48Å; L271-L275 HydrophobicContact CG-CD1 4.19Å; L271-L275 VanDerWaalsContact O-CG 3.29Å; L271-L275 WeakPolarHBondContact O-CG 3.41Å; L271-L275 PolarHBondContact O-N 3.38Å; L271-V306 HydrophobicContact CD2-CG1 3.68Å; L271-V306 HydrophobicContact CD2-CG2 4.33Å; L271-V306 HydrophobicContact CG-CG1 4.34Å |
| 272 | L | 86.8 | Confident | 82.5 | Confident | 6 Ų | 6 | 88.5 Ų | 88.5 | 3% | 0.031 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -61.9 | -42.8 | 178.8 | -174.6 | 67.7 | 0 | 0 | 0 | 111.5 | L268 E269 L275 Q276 Y283 L302 A305 V306 | L268-L272 VanDerWaalsContact O-CB 3.25Å; L268-L272 WeakPolarHBondContact O-CB 3.37Å; L268-L272 PolarHBondContact O-N 3.31Å; E269-L272 PolarHBondContact O-N 2.95Å; L272-L275 PolarHBondContact O-N 3.32Å; L272-Q276 WeakPolarHBondContact O-CG 3.35Å; L272-Q276 PolarHBondContact O-N 2.76Å; L272-Y283 HydrophobicContact CD2-CD1 4.35Å; L272-Y283 HydrophobicContact CD2-CD2 3.87Å; L272-Y283 HydrophobicContact CD2-CE2 4.49Å; L272-Y283 HydrophobicContact CD2-CG 3.8Å; L272-L302 HydrophobicContact CD2-CD2 3.88Å; L272-A305 HydrophobicContact CD1-CB 4.19Å; L272-V306 HydrophobicContact CB-CG2 4.11Å; L272-V306 HydrophobicContact CD1-CG2 4.11Å |
| 273 | V | 86.1 | Confident | 81.5 | Confident | 53 Ų | 53 | 88.5 Ų | 88.5 | 32% | 0.321 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -63.2 | -44.4 | 175.1 | 171.1 | 0 | 0 | 0 | 0 | 110.9 | E269 E270 L271 L275 Q276 Y283 | E269-V273 WeakPolarHBondContact O-CG2 3.47Å; E269-V273 PolarHBondContact O-N 3.42Å; E270-V273 PolarHBondContact O-N 3.28Å; L271-V273 PolarHBondContact O-N 3.2Å; V273-L275 VanDerWaalsContact C-N 3.29Å; V273-L275 PolarHBondContact O-N 2.94Å; V273-Q276 PolarHBondContact O-N 2.68Å; V273-Q276 VanDerWaalsContact O-N 3.09Å; V273-Y283 HydrophobicContact CG2-CD1 4.48Å |
| 274 | S | 85.4 | Confident | 80.2 | Confident | 83 Ų | 83 | 90.9 Ų | 90.9 | 58% | 0.58 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -62 | -36 | 179 | -59.6 | 0 | 0 | 0 | 0 | 112.4 | E270 L271 Q276 | E270-S274 WeakPolarHBondContact O-CB 3.13Å; E270-S274 PolarHBondContact O-N 2.96Å; E270-S274 PolarHBondContact O-OG 2.95Å; L271-S274 PolarHBondContact O-N 3.2Å; S274-Q276 VanDerWaalsContact C-N 3.27Å; S274-Q276 PolarHBondContact O-N 3.1Å |
| 275 | L | 84.3 | Confident | 79 | Confident | 69 Ų | 69 | 92 Ų | 92 | 36% | 0.361 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -72.7 | -15.5 | 176.7 | -69.6 | 172 | 0 | 0 | 0 | 113.9 | L271 L272 V273 V306 L310 | L271-L275 HydrophobicContact CD1-CD1 4.48Å; L271-L275 HydrophobicContact CG-CD1 4.19Å; L271-L275 VanDerWaalsContact O-CG 3.29Å; L271-L275 WeakPolarHBondContact O-CG 3.41Å; L271-L275 PolarHBondContact O-N 3.38Å; L272-L275 PolarHBondContact O-N 3.32Å; V273-L275 VanDerWaalsContact C-N 3.29Å; V273-L275 PolarHBondContact O-N 2.94Å; L275-V306 HydrophobicContact CD1-CG1 4.15Å; L275-L310 HydrophobicContact CD1-CD2 3.93Å; L275-L310 HydrophobicContact CD1-CG 4.13Å; L275-L310 HydrophobicContact CD2-CD2 3.79Å |
| 276 | Q | 80.2 | Confident | 77.7 | Confident | 16 Ų | 16 | 94 Ų | 94 | 8% | 0.075 | 49% | 0.491 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -90.5 | 5.8 | 178.7 | -69.8 | -179.1 | 3 | 0 | 0 | 113.6 | L272 V273 S274 G278 R279 T282 | L272-Q276 WeakPolarHBondContact O-CG 3.35Å; L272-Q276 PolarHBondContact O-N 2.76Å; V273-Q276 PolarHBondContact O-N 2.68Å; V273-Q276 VanDerWaalsContact O-N 3.09Å; S274-Q276 VanDerWaalsContact C-N 3.27Å; S274-Q276 PolarHBondContact O-N 3.1Å; Q276-G278 PolarHBondContact O-N 2.99Å; Q276-R279 PolarHBondContact O-N 2.96Å; Q276-T282 PolarHBondContact NE2-OG1 2.97Å |
| 277 | W | 65.9 | Low | 76.4 | Confident | 240 Ų | 240 | 95.1 Ų | 95.1 | 91% | 0.909 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60 | 121.7 | -177.6 | -149.8 | 78.4 | 0 | 0 | 0 | 111.8 | ||
| 278 | G | 61.5 | Low | 75.2 | Confident | 80 Ų | 80 | 96.5 Ų | 96.5 | 83% | 0.825 | 51% | 0.511 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 88.9 | 3.9 | -176.1 | 0 | 0 | 0 | 0 | 0 | 116 | Q276 | Q276-G278 PolarHBondContact O-N 2.99Š|
| 279 | R | 66.1 | Low | 74.1 | Confident | 219 Ų | 219 | 100.7 Ų | 100.7 | 83% | 0.826 | 54% | 0.541 | S | S | * | . | S | Bend | trans | -121.8 | 167.6 | 171 | -64.6 | -174.1 | -177.9 | -119.5 | 1.4 | 110.9 | Q276 Q281 | Q276-R279 PolarHBondContact O-N 2.96Å; R279-Q281 PolarHBondContact O-N 3.4Å |
| 280 | Q | 66.5 | Low | 73.5 | Confident | 180 Ų | 180 | 101.5 Ų | 101.5 | 84% | 0.841 | 54% | 0.544 | S | S | * | . | trans | -64.7 | 123.1 | 174.5 | -171.8 | 169.7 | 5.3 | 0 | 0 | 109.9 | T282 | Q280-T282 PolarHBondContact O-N 3.47Š| ||
| 281 | Q | 68.4 | Low | 73.4 | Confident | 123 Ų | 123 | 98.2 Ų | 98.2 | 58% | 0.575 | 53% | 0.534 | S | S | * | . | trans | -66.4 | 119.8 | -179.7 | -167.6 | 168.4 | 23.3 | 0 | 0 | 109.9 | R279 | R279-Q281 PolarHBondContact O-N 3.4Š| ||
| 282 | T | 68.6 | Low | 73.5 | Confident | 116 Ų | 116 | 96.1 Ų | 96.1 | 71% | 0.712 | 53% | 0.525 | S | S | * | . | trans | -106 | -11.3 | -177.1 | 53.8 | 0 | 0 | 0 | 0 | 113.2 | Q276 Q280 | Q276-T282 PolarHBondContact NE2-OG1 2.97Å; Q280-T282 PolarHBondContact O-N 3.47Å | ||
| 283 | Y | 70.8 | Confident | 73.6 | Confident | 51 Ų | 51 | 99.3 Ų | 99.3 | 20% | 0.2 | 55% | 0.552 | C | S | . | * | trans | -102.6 | 132.8 | -177.7 | -174.5 | -100.8 | 0 | 0 | 0 | 111.7 | E269 L272 V273 P285 L302 | E269-Y283 HydrophobicContact CB-CE1 4.13Å; E269-Y283 VanDerWaalsContact CD-OH 3.31Å; E269-Y283 HydrophobicContact CG-CE1 3.67Å; E269-Y283 WeakPolarHBondContact CG-OH 3.43Å; E269-Y283 PolarHBondContact OE1-OH 2.89Å; L272-Y283 HydrophobicContact CD2-CD1 4.35Å; L272-Y283 HydrophobicContact CD2-CD2 3.87Å; L272-Y283 HydrophobicContact CD2-CE2 4.49Å; L272-Y283 HydrophobicContact CD2-CG 3.8Å; V273-Y283 HydrophobicContact CG2-CD1 4.48Å; Y283-P285 HydrophobicContact CE1-CG 4.25Å; Y283-L302 HydrophobicContact CD2-CD2 4.35Å; Y283-L302 HydrophobicContact CE2-CD2 3.65Å | ||
| 284 | S | 66.3 | Low | 73.8 | Confident | 99 Ų | 99 | 101.3 Ų | 101.3 | 69% | 0.692 | 56% | 0.558 | S | S | * | * | trans | -123.8 | 126.5 | 171.8 | 53.5 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 285 | P | 67.8 | Low | 74 | Confident | 84 Ų | 84 | 97.4 Ų | 97.4 | 55% | 0.545 | 53% | 0.531 | S | S | . | . | trans | -61 | 136.1 | 178.7 | -23.9 | 33.7 | 0 | 0 | 0 | 112 | Y283 | Y283-P285 HydrophobicContact CE1-CG 4.25Š| ||
| 286 | S | 66.3 | Low | 74.4 | Confident | 57 Ų | 57 | 96.3 Ų | 96.3 | 40% | 0.399 | 53% | 0.532 | S | S | . | . | trans | -85.4 | 129 | 175.1 | 173.2 | 0 | 0 | 0 | 0 | 110.7 | Q288 | S286-Q288 VanDerWaalsContact C-N 3.35Å; S286-Q288 PolarHBondContact OG-N 2.95Å | ||
| 287 | V | 63 | Low | 75 | Confident | 145 Ų | 145 | 100 Ų | 100 | 88% | 0.879 | 55% | 0.551 | S | S | * | * | trans | -90.9 | 4.2 | -179.3 | -172.4 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 288 | Q | 67.4 | Low | 76.1 | Confident | 144 Ų | 144 | 90 Ų | 90 | 67% | 0.673 | 52% | 0.517 | S | S | * | . | S | Bend | trans | -78 | 151 | -171.8 | -67.2 | -165.8 | -5 | 0 | 0 | 113.4 | S286 H290 | S286-Q288 VanDerWaalsContact C-N 3.35Å; S286-Q288 PolarHBondContact OG-N 2.95Å; Q288-H290 PolarHBondContact O-CE1 2.98Å; Q288-H290 PolarHBondContact O-N 3.4Å; Q288-H290 PolarHBondContact O-ND1 2.91Å |
| 289 | P | 66.5 | Low | 77.6 | Confident | 124 Ų | 124 | 86.9 Ų | 86.9 | 81% | 0.805 | 48% | 0.481 | S | S | * | . | P | Polyproline II helix | trans | -66.3 | 122.4 | 167.9 | 27.7 | -32.2 | 0 | 0 | 0 | 109 | ||
| 290 | H | 76.9 | Confident | 78.8 | Confident | 44 Ų | 44 | 82.6 Ų | 82.6 | 20% | 0.204 | 47% | 0.47 | C | S | . | . | P | Polyproline II helix | trans | -102.3 | 137.3 | -180 | -62.2 | 84.1 | 0 | 0 | 0 | 110.3 | Q288 E294 L295 | Q288-H290 PolarHBondContact O-CE1 2.98Å; Q288-H290 PolarHBondContact O-N 3.4Å; Q288-H290 PolarHBondContact O-ND1 2.91Å; H290-E294 WeakPolarHBondContact CA-OE2 3.39Å; H290-E294 HydrophobicContact CB-CB 4.11Å; H290-L295 HydrophobicContact CB-CD1 4.47Å; H290-L295 HydrophobicContact CB-CD2 3.58Å; H290-L295 HydrophobicContact CB-CG 3.57Å |
| 291 | S | 88.1 | Confident | 80 | Confident | 50 Ų | 50 | 80.4 Ų | 80.4 | 35% | 0.35 | 46% | 0.458 | S | S | . | . | P | Polyproline II helix | trans | -66.4 | 160.1 | 165.1 | 70.6 | 0 | 0 | 0 | 0 | 111 | A293 E294 L295 | S291-A293 PolarHBondContact O-N 3.27Å; S291-E294 PolarHBondContact N-OE2 3.27Å; S291-E294 PolarHBondContact O-N 2.98Å; S291-E294 VanDerWaalsContact O-N 3.08Å; S291-E294 WeakPolarHBondContact OG-CB 3.43Å; S291-E294 VanDerWaalsContact OG-CG 3.24Å; S291-E294 WeakPolarHBondContact OG-CG 3.42Å; S291-E294 PolarHBondContact OG-N 3.45Å; S291-E294 PolarHBondContact OG-OE1 3.02Å; S291-L295 PolarHBondContact O-N 2.88Å |
| 292 | T | 89.7 | Confident | 81 | Confident | 35 Ų | 35 | 75 Ų | 75 | 22% | 0.215 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -55.7 | -37.8 | 176.9 | -50.9 | 0 | 0 | 0 | 0 | 111.4 | M261 A296 | M261-T292 HydrophobicContact CE-CG2 3.3Å; M261-T292 VanDerWaalsContact CE-O 3.23Å; M261-T292 WeakPolarHBondContact CE-O 3.39Å; T292-A296 PolarHBondContact O-N 3.27Å; T292-A296 VanDerWaalsContact O-N 3.15Å |
| 293 | A | 90.3 | Very high | 82.1 | Confident | 74 Ų | 74 | 71.5 Ų | 71.5 | 61% | 0.612 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -69.9 | -39.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | S291 A296 L297 | S291-A293 PolarHBondContact O-N 3.27Å; A293-A296 PolarHBondContact O-N 3.16Å; A293-L297 WeakPolarHBondContact O-CB 3.31Å; A293-L297 PolarHBondContact O-N 3.02Å; A293-L297 VanDerWaalsContact O-N 3.08Å |
| 294 | E | 90.1 | Very high | 83 | Confident | 94 Ų | 94 | 76 Ų | 76 | 44% | 0.439 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -64.8 | -43.1 | 174.8 | -76.1 | 152.9 | -139.1 | 0 | 0 | 111.9 | H290 S291 A296 L297 T298 | H290-E294 WeakPolarHBondContact CA-OE2 3.39Å; H290-E294 HydrophobicContact CB-CB 4.11Å; S291-E294 PolarHBondContact N-OE2 3.27Å; S291-E294 PolarHBondContact O-N 2.98Å; S291-E294 VanDerWaalsContact O-N 3.08Å; S291-E294 WeakPolarHBondContact OG-CB 3.43Å; S291-E294 VanDerWaalsContact OG-CG 3.24Å; S291-E294 WeakPolarHBondContact OG-CG 3.42Å; S291-E294 PolarHBondContact OG-N 3.45Å; S291-E294 PolarHBondContact OG-OE1 3.02Å; E294-A296 VanDerWaalsContact C-N 3.32Å; E294-A296 PolarHBondContact O-N 3.32Å; E294-L297 CarbonylContact O-C 3.59Å; E294-L297 PolarHBondContact O-N 2.96Å; E294-L297 VanDerWaalsContact O-N 3.14Å; E294-T298 WeakPolarHBondContact O-CG2 3.47Å; E294-T298 PolarHBondContact O-N 2.92Å; E294-T298 PolarHBondContact O-OG1 2.78Å |
| 295 | L | 89.5 | Confident | 83.9 | Confident | 2 Ų | 2 | 72.7 Ų | 72.7 | 1% | 0.01 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -58.7 | -42.7 | 174.9 | -73.1 | 170.8 | 0 | 0 | 0 | 111.9 | R258 M261 I262 H290 S291 L297 T298 N299 | R258-L295 HydrophobicContact CG-CD1 3.55Å; M261-L295 HydrophobicContact CB-CB 4.13Å; M261-L295 HydrophobicContact CB-CD1 4.47Å; M261-L295 HydrophobicContact CE-CB 4.28Å; M261-L295 HydrophobicContact SD-CB 4.27Å; I262-L295 HydrophobicContact CD1-CD1 4.25Å; I262-L295 HydrophobicContact CG1-CD1 3.8Å; I262-L295 HydrophobicContact CG1-CD2 3.91Å; H290-L295 HydrophobicContact CB-CD1 4.47Å; H290-L295 HydrophobicContact CB-CD2 3.58Å; H290-L295 HydrophobicContact CB-CG 3.57Å; S291-L295 PolarHBondContact O-N 2.88Å; L295-L297 VanDerWaalsContact C-N 3.3Å; L295-L297 PolarHBondContact O-N 3.07Å; L295-T298 WeakPolarHBondContact CA-OG1 3.23Å; L295-T298 PolarHBondContact O-N 3.04Å; L295-T298 PolarHBondContact O-OG1 2.99Å; L295-N299 VanDerWaalsContact O-CB 3.26Å; L295-N299 WeakPolarHBondContact O-CB 3.31Å; L295-N299 VanDerWaalsContact O-CG 3.26Å; L295-N299 PolarHBondContact O-N 3.11Å; L295-N299 PolarHBondContact O-ND2 3.09Å; L295-N299 VanDerWaalsContact O-ND2 3.12Å |
| 296 | A | 92.6 | Very high | 84.9 | Confident | 46 Ų | 46 | 69.2 Ų | 69.2 | 38% | 0.38 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -61.5 | -42.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | M261 T292 A293 E294 H300 | M261-A296 HydrophobicContact CE-CB 4.39Å; M261-A296 HydrophobicContact SD-CB 3.72Å; T292-A296 PolarHBondContact O-N 3.27Å; T292-A296 VanDerWaalsContact O-N 3.15Å; A293-A296 PolarHBondContact O-N 3.16Å; E294-A296 VanDerWaalsContact C-N 3.32Å; E294-A296 PolarHBondContact O-N 3.32Å; A296-H300 WeakPolarHBondContact O-CB 3.44Å; A296-H300 PolarHBondContact O-N 3.37Å |
| 297 | L | 91.7 | Very high | 86 | Confident | 92 Ų | 92 | 70.6 Ų | 70.6 | 48% | 0.482 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -72.1 | -38.1 | -179.2 | -174 | 141.7 | 0 | 0 | 0 | 112.8 | A293 E294 L295 H300 K301 | A293-L297 WeakPolarHBondContact O-CB 3.31Å; A293-L297 PolarHBondContact O-N 3.02Å; A293-L297 VanDerWaalsContact O-N 3.08Å; E294-L297 CarbonylContact O-C 3.59Å; E294-L297 PolarHBondContact O-N 2.96Å; E294-L297 VanDerWaalsContact O-N 3.14Å; L295-L297 VanDerWaalsContact C-N 3.3Å; L295-L297 PolarHBondContact O-N 3.07Å; L297-H300 PolarHBondContact O-N 3.46Å; L297-K301 HydrophobicContact CD2-CD 3.86Å; L297-K301 VanDerWaalsContact CD2-NZ 3.3Å; L297-K301 WeakPolarHBondContact O-CG 3.33Å; L297-K301 PolarHBondContact O-N 3.12Å |
| 298 | T | 89.8 | Confident | 87 | Confident | 30 Ų | 30 | 66.4 Ų | 66.4 | 18% | 0.184 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -66 | -45.6 | 173.6 | 55.7 | 0 | 0 | 0 | 0 | 110.6 | E294 L295 H300 K301 L302 | E294-T298 WeakPolarHBondContact O-CG2 3.47Å; E294-T298 PolarHBondContact O-N 2.92Å; E294-T298 PolarHBondContact O-OG1 2.78Å; L295-T298 WeakPolarHBondContact CA-OG1 3.23Å; L295-T298 PolarHBondContact O-N 3.04Å; L295-T298 PolarHBondContact O-OG1 2.99Å; T298-H300 VanDerWaalsContact C-N 3.32Å; T298-H300 PolarHBondContact O-N 2.89Å; T298-K301 PolarHBondContact O-N 3.01Å; T298-K301 VanDerWaalsContact O-N 3.15Å; T298-L302 WeakPolarHBondContact O-CB 3.26Å; T298-L302 WeakPolarHBondContact O-CG 3.3Å; T298-L302 PolarHBondContact O-N 3.39Å |
| 299 | N | 92.7 | Very high | 87.8 | Confident | 15 Ų | 15 | 64.4 Ų | 64.4 | 8% | 0.08 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -56 | -46.1 | 173.5 | -80.4 | -34.5 | 0 | 0 | 0 | 111.8 | M261 T264 Q265 L268 L295 K301 L302 A303 | M261-N299 PolarHBondContact O-ND2 3.1Å; T264-N299 PolarHBondContact OG1-ND2 2.75Å; T264-N299 PolarHBondContact OG1-OD1 2.92Å; Q265-N299 WeakPolarHBondContact CA-OD1 3.49Å; Q265-N299 VanDerWaalsContact CB-OD1 3.23Å; Q265-N299 WeakPolarHBondContact CB-OD1 3.42Å; Q265-N299 PolarHBondContact N-OD1 2.91Å; L268-N299 HydrophobicContact CD1-CB 4.44Å; L295-N299 VanDerWaalsContact O-CB 3.26Å; L295-N299 WeakPolarHBondContact O-CB 3.31Å; L295-N299 VanDerWaalsContact O-CG 3.26Å; L295-N299 PolarHBondContact O-N 3.11Å; L295-N299 PolarHBondContact O-ND2 3.09Å; L295-N299 VanDerWaalsContact O-ND2 3.12Å; N299-K301 PolarHBondContact O-N 3.06Å; N299-L302 PolarHBondContact O-N 2.63Å; N299-A303 VanDerWaalsContact O-CB 3.26Å; N299-A303 WeakPolarHBondContact O-CB 3.48Å; N299-A303 PolarHBondContact O-N 3.27Å |
| 300 | H | 92.4 | Very high | 88.7 | Confident | 130 Ų | 130 | 63.7 Ų | 63.7 | 60% | 0.602 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -61.5 | -43.4 | 176.6 | -175.2 | 78.7 | 0 | 0 | 0 | 112.3 | A296 L297 T298 K304 | A296-H300 WeakPolarHBondContact O-CB 3.44Å; A296-H300 PolarHBondContact O-N 3.37Å; L297-H300 PolarHBondContact O-N 3.46Å; T298-H300 VanDerWaalsContact C-N 3.32Å; T298-H300 PolarHBondContact O-N 2.89Å; H300-K304 WeakPolarHBondContact O-CB 3.42Å; H300-K304 PolarHBondContact O-N 3.02Å |
| 301 | K | 90.6 | Very high | 89 | Confident | 134 Ų | 134 | 67.3 Ų | 67.3 | 58% | 0.583 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -63 | -45.6 | 176.6 | -76.4 | 174.6 | 176.9 | 173.5 | 0 | 112.1 | L297 T298 N299 K304 A305 | L297-K301 HydrophobicContact CD2-CD 3.86Å; L297-K301 VanDerWaalsContact CD2-NZ 3.3Å; L297-K301 WeakPolarHBondContact O-CG 3.33Å; L297-K301 PolarHBondContact O-N 3.12Å; T298-K301 PolarHBondContact O-N 3.01Å; T298-K301 VanDerWaalsContact O-N 3.15Å; N299-K301 PolarHBondContact O-N 3.06Å; K301-K304 PolarHBondContact O-N 2.98Å; K301-A305 WeakPolarHBondContact O-CB 3.23Å; K301-A305 PolarHBondContact O-N 2.85Å |
| 302 | L | 89.5 | Confident | 88 | Confident | 9 Ų | 9 | 66.7 Ų | 66.7 | 5% | 0.047 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -64 | -46 | 177.9 | -72.8 | 171.8 | 0 | 0 | 0 | 111.2 | Q265 L268 E269 L272 Y283 T298 N299 K304 A305 V306 | Q265-L302 HydrophobicContact CG-CD1 3.84Å; L268-L302 HydrophobicContact CB-CB 3.93Å; L268-L302 HydrophobicContact CB-CD1 4.2Å; L268-L302 HydrophobicContact CD1-CB 4.11Å; E269-L302 HydrophobicContact CG-CD1 3.69Å; E269-L302 HydrophobicContact CG-CD2 4.35Å; L272-L302 HydrophobicContact CD2-CD2 3.88Å; Y283-L302 HydrophobicContact CD2-CD2 4.35Å; Y283-L302 HydrophobicContact CE2-CD2 3.65Å; T298-L302 WeakPolarHBondContact O-CB 3.26Å; T298-L302 WeakPolarHBondContact O-CG 3.3Å; T298-L302 PolarHBondContact O-N 3.39Å; N299-L302 PolarHBondContact O-N 2.63Å; L302-K304 VanDerWaalsContact C-N 3.29Å; L302-K304 PolarHBondContact O-N 2.92Å; L302-A305 WeakPolarHBondContact O-CB 2.99Å; L302-A305 PolarHBondContact O-N 3.49Å; L302-A305 VanDerWaalsContact O-N 3.13Å; L302-V306 WeakPolarHBondContact O-CG2 3.31Å; L302-V306 PolarHBondContact O-N 3.15Å |
| 303 | A | 92.1 | Very high | 86.7 | Confident | 42 Ų | 42 | 72.8 Ų | 72.8 | 35% | 0.347 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -58.8 | -41.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | L268 N299 N307 | L268-A303 HydrophobicContact CD1-CB 4.21Å; N299-A303 VanDerWaalsContact O-CB 3.26Å; N299-A303 WeakPolarHBondContact O-CB 3.48Å; N299-A303 PolarHBondContact O-N 3.27Å; A303-N307 VanDerWaalsContact O-CB 3.25Å; A303-N307 WeakPolarHBondContact O-CB 3.35Å; A303-N307 PolarHBondContact O-N 3.43Å |
| 304 | K | 89.1 | Confident | 85.2 | Confident | 146 Ų | 146 | 74.4 Ų | 74.4 | 64% | 0.635 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -64.9 | -40.4 | 175 | -170.4 | 176.3 | -177.6 | 177.4 | 0 | 112.4 | H300 K301 L302 N307 S308 | H300-K304 WeakPolarHBondContact O-CB 3.42Å; H300-K304 PolarHBondContact O-N 3.02Å; K301-K304 PolarHBondContact O-N 2.98Å; L302-K304 VanDerWaalsContact C-N 3.29Å; L302-K304 PolarHBondContact O-N 2.92Å; K304-N307 PolarHBondContact O-N 3.46Å; K304-S308 WeakPolarHBondContact O-CB 3.45Å; K304-S308 PolarHBondContact O-N 2.94Å; K304-S308 PolarHBondContact O-OG 3.38Å |
| 305 | A | 86.9 | Confident | 83.5 | Confident | 30 Ų | 30 | 72.4 Ų | 72.4 | 25% | 0.248 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -63.5 | -49.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | L272 K301 L302 N307 S308 H309 | L272-A305 HydrophobicContact CD1-CB 4.19Å; K301-A305 WeakPolarHBondContact O-CB 3.23Å; K301-A305 PolarHBondContact O-N 2.85Å; L302-A305 WeakPolarHBondContact O-CB 2.99Å; L302-A305 PolarHBondContact O-N 3.49Å; L302-A305 VanDerWaalsContact O-N 3.13Å; A305-N307 VanDerWaalsContact C-N 3.31Å; A305-N307 PolarHBondContact O-N 3.17Å; A305-S308 PolarHBondContact O-N 3.43Å; A305-S308 PolarHBondContact O-OG 2.99Å; A305-H309 PolarHBondContact O-CD2 3.37Å; A305-H309 VanDerWaalsContact O-CD2 3.25Å; A305-H309 PolarHBondContact O-N 3.12Å |
| 306 | V | 88.1 | Confident | 81.7 | Confident | 10 Ų | 10 | 78.5 Ų | 78.5 | 6% | 0.061 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -56.4 | -46.7 | 174.1 | 170.3 | 0 | 0 | 0 | 0 | 110.6 | L271 L272 L275 L302 S308 H309 L310 | L271-V306 HydrophobicContact CD2-CG1 3.68Å; L271-V306 HydrophobicContact CD2-CG2 4.33Å; L271-V306 HydrophobicContact CG-CG1 4.34Å; L272-V306 HydrophobicContact CB-CG2 4.11Å; L272-V306 HydrophobicContact CD1-CG2 4.11Å; L275-V306 HydrophobicContact CD1-CG1 4.15Å; L302-V306 WeakPolarHBondContact O-CG2 3.31Å; L302-V306 PolarHBondContact O-N 3.15Å; V306-S308 PolarHBondContact O-N 3.26Å; V306-H309 WeakPolarHBondContact O-CB 3.26Å; V306-H309 PolarHBondContact O-N 2.93Å; V306-H309 VanDerWaalsContact O-N 3.14Å; V306-L310 HydrophobicContact CG1-CD1 3.83Å; V306-L310 HydrophobicContact CG1-CG 4.34Å; V306-L310 WeakPolarHBondContact O-CG 3.39Å; V306-L310 PolarHBondContact O-N 3.32Å |
| 307 | N | 88.2 | Confident | 79.6 | Confident | 86 Ų | 86 | 83.2 Ų | 83.2 | 46% | 0.46 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -59.7 | -45.4 | 178.5 | -168.3 | 6.3 | 0 | 0 | 0 | 111.8 | A303 K304 A305 H309 L310 L311 | A303-N307 VanDerWaalsContact O-CB 3.25Å; A303-N307 WeakPolarHBondContact O-CB 3.35Å; A303-N307 PolarHBondContact O-N 3.43Å; K304-N307 PolarHBondContact O-N 3.46Å; A305-N307 VanDerWaalsContact C-N 3.31Å; A305-N307 PolarHBondContact O-N 3.17Å; N307-H309 VanDerWaalsContact C-N 3.28Å; N307-H309 PolarHBondContact O-N 3.37Å; N307-L310 PolarHBondContact O-N 2.87Å; N307-L311 PolarHBondContact O-N 3.03Å; N307-L311 WeakPolarHBondContact OD1-CD1 3.24Å; N307-L311 WeakPolarHBondContact OD1-CG 3.37Å |
| 308 | S | 85.9 | Confident | 77.7 | Confident | 58 Ų | 58 | 86.4 Ų | 86.4 | 41% | 0.406 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -64.5 | -30.8 | 176.6 | 70.8 | 0 | 0 | 0 | 0 | 113.5 | K304 A305 V306 G312 | K304-S308 WeakPolarHBondContact O-CB 3.45Å; K304-S308 PolarHBondContact O-N 2.94Å; K304-S308 PolarHBondContact O-OG 3.38Å; A305-S308 PolarHBondContact O-N 3.43Å; A305-S308 PolarHBondContact O-OG 2.99Å; V306-S308 PolarHBondContact O-N 3.26Å; S308-G312 CarbonylContact O-C 3.39Å; S308-G312 WeakPolarHBondContact O-CA 3.46Å; S308-G312 PolarHBondContact O-N 2.84Å |
| 309 | H | 83.6 | Confident | 75.9 | Confident | 102 Ų | 102 | 93.7 Ų | 93.7 | 47% | 0.472 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -72.9 | -40.5 | 175.3 | -88 | -72.4 | 0 | 0 | 0 | 112.2 | A305 V306 N307 | A305-H309 PolarHBondContact O-CD2 3.37Å; A305-H309 VanDerWaalsContact O-CD2 3.25Å; A305-H309 PolarHBondContact O-N 3.12Å; V306-H309 WeakPolarHBondContact O-CB 3.26Å; V306-H309 PolarHBondContact O-N 2.93Å; V306-H309 VanDerWaalsContact O-N 3.14Å; N307-H309 VanDerWaalsContact C-N 3.28Å; N307-H309 PolarHBondContact O-N 3.37Å |
| 310 | L | 85.3 | Confident | 73.8 | Confident | 108 Ų | 108 | 102.1 Ų | 102.1 | 57% | 0.565 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -78 | -43.4 | -177.2 | -68.4 | 176 | 0 | 0 | 0 | 113 | L275 V306 N307 | L275-L310 HydrophobicContact CD1-CD2 3.93Å; L275-L310 HydrophobicContact CD1-CG 4.13Å; L275-L310 HydrophobicContact CD2-CD2 3.79Å; V306-L310 HydrophobicContact CG1-CD1 3.83Å; V306-L310 HydrophobicContact CG1-CG 4.34Å; V306-L310 WeakPolarHBondContact O-CG 3.39Å; V306-L310 PolarHBondContact O-N 3.32Å; N307-L310 PolarHBondContact O-N 2.87Å |
| 311 | L | 82.8 | Confident | 71.8 | Confident | 120 Ų | 120 | 105.5 Ų | 105.5 | 63% | 0.628 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -94.7 | -11.5 | -177 | -58.7 | -174 | 0 | 0 | 0 | 113 | N307 V314 | N307-L311 PolarHBondContact O-N 3.03Å; N307-L311 WeakPolarHBondContact OD1-CD1 3.24Å; N307-L311 WeakPolarHBondContact OD1-CG 3.37Å; L311-V314 HydrophobicContact CB-CG2 4.34Å; L311-V314 WeakPolarHBondContact O-CG2 3.43Å |
| 312 | G | 68.1 | Low | 69.9 | Low | 38 Ų | 38 | 106.1 Ų | 106.1 | 39% | 0.392 | 57% | 0.574 | S | S | . | * | trans | 74.8 | 176.6 | -170.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | S308 V314 | S308-G312 CarbonylContact O-C 3.39Å; S308-G312 WeakPolarHBondContact O-CA 3.46Å; S308-G312 PolarHBondContact O-N 2.84Å; G312-V314 PolarHBondContact O-N 3.04Å | ||
| 313 | N | 62.4 | Low | 67.9 | Low | 163 Ų | 163 | 110.4 Ų | 110.4 | 87% | 0.872 | 61% | 0.605 | S | S | * | * | trans | -74.7 | 64.8 | 175.4 | -158.6 | 39.7 | 0 | 0 | 0 | 109.9 | G315 | N313-G315 VanDerWaalsContact C-N 3.34Å; N313-G315 PolarHBondContact O-N 3.32Å | ||
| 314 | V | 58.7 | Low | 66.2 | Low | 107 Ų | 107 | 112.3 Ų | 112.3 | 65% | 0.648 | 62% | 0.616 | S | S | * | * | trans | -66.7 | 100.8 | 170.8 | -168.6 | 0 | 0 | 0 | 0 | 105.4 | L311 G312 T316 | L311-V314 HydrophobicContact CB-CG2 4.34Å; L311-V314 WeakPolarHBondContact O-CG2 3.43Å; G312-V314 PolarHBondContact O-N 3.04Å; V314-T316 PolarHBondContact O-N 2.94Å | ||
| 315 | G | 52.9 | Low | 64.3 | Low | 52 Ų | 52 | 111.4 Ų | 111.4 | 54% | 0.536 | 62% | 0.623 | S | S | . | * | trans | -45.2 | 128.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 108.6 | N313 N317 | N313-G315 VanDerWaalsContact C-N 3.34Å; N313-G315 PolarHBondContact O-N 3.32Å; G315-N317 PolarHBondContact O-N 2.95Å | ||
| 316 | T | 52.3 | Low | 63.3 | Low | 131 Ų | 131 | 114.5 Ų | 114.5 | 80% | 0.804 | 64% | 0.638 | S | S | * | * | trans | -68 | 50.8 | -178.3 | 51.3 | 0 | 0 | 0 | 0 | 111.9 | V314 | V314-T316 PolarHBondContact O-N 2.94Š| ||
| 317 | N | 49 | Very low | 62.7 | Low | 144 Ų | 144 | 122.2 Ų | 122.2 | 77% | 0.77 | 67% | 0.674 | S | S | * | * | trans | -99.5 | 111.1 | 168.7 | -85.6 | -11.2 | 0 | 0 | 0 | 107 | G315 | G315-N317 PolarHBondContact O-N 2.95Š| ||
| 318 | N | 51.1 | Low | 62 | Low | 160 Ų | 160 | 127.1 Ų | 127.1 | 86% | 0.856 | 69% | 0.691 | S | S | * | * | trans | 95.7 | 49.6 | 175.1 | -45.9 | -28.5 | 0 | 0 | 0 | 116.4 | K320 | N318-K320 PolarHBondContact O-N 3.24Š| ||
| 319 | Q | 53.5 | Low | 61.7 | Low | 183 Ų | 183 | 129.8 Ų | 129.8 | 86% | 0.855 | 71% | 0.709 | S | S | * | * | trans | -77.7 | 98.2 | 146 | -76.9 | -166 | -14.7 | 0 | 0 | 108.4 | K321 | Q319-K321 PolarHBondContact O-N 3.41Å; Q319-K321 VanDerWaalsContact O-N 3.11Å | ||
| 320 | K | 48.1 | Very low | 61.9 | Low | 192 Ų | 192 | 127 Ų | 127 | 84% | 0.835 | 70% | 0.7 | S | S | * | * | trans | -50.3 | 118.3 | 156.5 | -100.1 | 177.8 | 175 | 176.1 | 0 | 106.6 | N318 I322 | N318-K320 PolarHBondContact O-N 3.24Å; K320-I322 PolarHBondContact O-N 3.44Å | ||
| 321 | K | 50.3 | Low | 62.2 | Low | 201 Ų | 201 | 122.8 Ų | 122.8 | 87% | 0.874 | 68% | 0.68 | S | S | * | * | trans | -64.1 | 82 | -179.6 | -153 | 179.8 | -169.5 | -175.7 | 0 | 108.8 | Q319 S323 | Q319-K321 PolarHBondContact O-N 3.41Å; Q319-K321 VanDerWaalsContact O-N 3.11Å; K321-S323 PolarHBondContact O-N 3.5Å | ||
| 322 | I | 50 | Low | 62.6 | Low | 146 Ų | 146 | 121.9 Ų | 121.9 | 75% | 0.749 | 68% | 0.681 | S | S | * | * | trans | -75.6 | 86.3 | 165.2 | -57.7 | 171.9 | 0 | 0 | 0 | 104.7 | K320 S324 | K320-I322 PolarHBondContact O-N 3.44Å; I322-S324 PolarHBondContact O-N 2.89Å | ||
| 323 | S | 48.8 | Very low | 63.8 | Low | 99 Ų | 99 | 120.1 Ų | 120.1 | 69% | 0.692 | 66% | 0.663 | S | S | * | * | trans | -75.1 | 71.9 | 166.3 | -173 | 0 | 0 | 0 | 0 | 107.3 | K321 T325 | K321-S323 PolarHBondContact O-N 3.5Å; S323-T325 PolarHBondContact O-N 3.44Å | ||
| 324 | S | 54.5 | Low | 65.3 | Low | 83 Ų | 83 | 116.4 Ų | 116.4 | 58% | 0.58 | 64% | 0.64 | S | S | * | * | trans | -72.4 | 109.8 | 161.8 | 56.9 | 0 | 0 | 0 | 0 | 106.2 | I322 V326 | I322-S324 PolarHBondContact O-N 2.89Å; S324-V326 PolarHBondContact O-N 2.8Å | ||
| 325 | T | 51 | Low | 66.9 | Low | 127 Ų | 127 | 117 Ų | 117 | 78% | 0.779 | 63% | 0.634 | S | S | * | * | trans | -59.7 | 101.2 | 169.4 | -41.7 | 0 | 0 | 0 | 0 | 106.9 | S323 E327 | S323-T325 PolarHBondContact O-N 3.44Å; T325-E327 PolarHBondContact O-N 3.14Å | ||
| 326 | V | 65.8 | Low | 68.8 | Low | 94 Ų | 94 | 118.3 Ų | 118.3 | 57% | 0.57 | 63% | 0.627 | S | S | * | * | trans | -76.4 | 109.7 | 174.1 | 178.5 | 0 | 0 | 0 | 0 | 106 | S324 F328 | S324-V326 PolarHBondContact O-N 2.8Å; V326-F328 PolarHBondContact O-N 3.23Å | ||
| 327 | E | 74.3 | Confident | 70.8 | Confident | 172 Ų | 172 | 112.9 Ų | 112.9 | 80% | 0.804 | 60% | 0.596 | S | S | * | * | trans | -69.6 | 115.9 | 170.4 | -73.8 | -179.4 | 172.4 | 0 | 0 | 108.6 | T325 | T325-E327 PolarHBondContact O-N 3.14Š| ||
| 328 | F | 74.3 | Confident | 72.9 | Confident | 189 Ų | 189 | 109.8 Ų | 109.8 | 83% | 0.829 | 58% | 0.576 | S | S | * | * | P | Polyproline II helix | trans | -78.8 | 122.4 | 171.9 | -65.9 | -82.9 | 0 | 0 | 0 | 108.5 | V326 | V326-F328 PolarHBondContact O-N 3.23Š|
| 329 | C | 80.2 | Confident | 74.8 | Confident | 114 Ų | 114 | 105.4 Ų | 105.4 | 77% | 0.77 | 56% | 0.556 | S | S | * | * | P | Polyproline II helix | trans | -90.5 | 123.9 | 172.1 | -68.4 | 0 | 0 | 0 | 0 | 109 | ||
| 330 | S | 86.9 | Confident | 76.7 | Confident | 43 Ų | 43 | 97.3 Ų | 97.3 | 30% | 0.301 | 52% | 0.519 | S | S | . | . | P | Polyproline II helix | trans | -62.5 | 142.1 | 174 | -42.1 | 0 | 0 | 0 | 0 | 111.1 | E334 K335 | S330-E334 WeakPolarHBondContact CA-OE2 3.25Å; S330-K335 WeakPolarHBondContact O-CE 3.35Å |
| 331 | T | 91.5 | Very high | 78.7 | Confident | 21 Ų | 21 | 93.8 Ų | 93.8 | 13% | 0.129 | 51% | 0.509 | C | S | . | . | P | Polyproline II helix | trans | -67.7 | 162.3 | 175.2 | 72.4 | 0 | 0 | 0 | 0 | 111.5 | E253 F257 A333 E334 K335 | E253-T331 WeakPolarHBondContact OE2-CB 3.26Å; E253-T331 PolarHBondContact OE2-OG1 3.08Å; F257-T331 HydrophobicContact CE2-CG2 4.1Å; F257-T331 HydrophobicContact CZ-CG2 3.93Å; T331-A333 VanDerWaalsContact C-N 3.31Å; T331-A333 PolarHBondContact O-N 3.4Å; T331-E334 PolarHBondContact N-OE2 2.84Å; T331-E334 PolarHBondContact O-N 2.94Å; T331-E334 WeakPolarHBondContact OG1-CB 3.35Å; T331-E334 VanDerWaalsContact OG1-CG 3.23Å; T331-E334 WeakPolarHBondContact OG1-CG 3.43Å; T331-E334 PolarHBondContact OG1-N 2.98Å; T331-E334 VanDerWaalsContact OG1-N 3.12Å; T331-K335 WeakPolarHBondContact O-CG 3.45Å; T331-K335 PolarHBondContact O-N 3.2Å |
| 332 | P | 91.4 | Very high | 80.6 | Confident | 100 Ų | 100 | 92.1 Ų | 92.1 | 65% | 0.649 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -54.3 | -42.6 | 172.7 | -27 | 36.4 | 0 | 0 | 0 | 113.6 | E253 K335 M336 | E253-P332 WeakPolarHBondContact OE1-CD 3.35Å; P332-K335 PolarHBondContact O-N 2.88Å; P332-M336 PolarHBondContact O-N 3.38Å |
| 333 | A | 93.6 | Very high | 82.3 | Confident | 2 Ų | 2 | 90 Ų | 90 | 2% | 0.017 | 49% | 0.486 | C | S | . | . | H | α-helix | trans | -69 | -36.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | D249 L250 E253 T331 M336 A337 | D249-A333 HydrophobicContact CB-CB 3.67Å; L250-A333 HydrophobicContact CD2-CB 3.91Å; L250-A333 HydrophobicContact CG-CB 4.09Å; E253-A333 HydrophobicContact CG-CB 4.08Å; E253-A333 WeakPolarHBondContact OE1-CB 3.33Å; E253-A333 PolarHBondContact OE1-N 3.4Å; E253-A333 VanDerWaalsContact OE2-CB 3.25Å; E253-A333 WeakPolarHBondContact OE2-CB 3.46Å; T331-A333 VanDerWaalsContact C-N 3.31Å; T331-A333 PolarHBondContact O-N 3.4Å; A333-M336 PolarHBondContact O-N 3.46Å; A333-A337 WeakPolarHBondContact O-CB 3.09Å; A333-A337 PolarHBondContact O-N 3.4Å |
| 334 | E | 93.4 | Very high | 84 | Confident | 84 Ų | 84 | 89.2 Ų | 89.2 | 39% | 0.393 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -62 | -45 | 173.3 | -73.9 | 171.1 | 166 | 0 | 0 | 111.3 | L250 S330 T331 M336 A337 E338 | L250-E334 HydrophobicContact CD2-CG 3.81Å; S330-E334 WeakPolarHBondContact CA-OE2 3.25Å; T331-E334 PolarHBondContact N-OE2 2.84Å; T331-E334 PolarHBondContact O-N 2.94Å; T331-E334 WeakPolarHBondContact OG1-CB 3.35Å; T331-E334 VanDerWaalsContact OG1-CG 3.23Å; T331-E334 WeakPolarHBondContact OG1-CG 3.43Å; T331-E334 PolarHBondContact OG1-N 2.98Å; T331-E334 VanDerWaalsContact OG1-N 3.12Å; E334-M336 VanDerWaalsContact C-N 3.32Å; E334-M336 PolarHBondContact O-N 2.99Å; E334-A337 PolarHBondContact O-N 3.08Å; E334-E338 WeakPolarHBondContact O-CG 3.39Å; E334-E338 PolarHBondContact O-N 3.36Å |
| 335 | K | 93.1 | Very high | 85.2 | Confident | 120 Ų | 120 | 88.4 Ų | 88.4 | 52% | 0.522 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -60.1 | -42.2 | 174.8 | -71 | 176.1 | -177.6 | 174.8 | 0 | 111.7 | S330 T331 P332 E338 T339 | S330-K335 WeakPolarHBondContact O-CE 3.35Å; T331-K335 WeakPolarHBondContact O-CG 3.45Å; T331-K335 PolarHBondContact O-N 3.2Å; P332-K335 PolarHBondContact O-N 2.88Å; K335-E338 PolarHBondContact O-N 3.32Å; K335-T339 WeakPolarHBondContact O-CG2 3.39Å; K335-T339 PolarHBondContact O-N 2.85Å |
| 336 | M | 92.4 | Very high | 85.7 | Confident | 79 Ų | 79 | 87.8 Ų | 87.8 | 39% | 0.389 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -63.3 | -46.1 | 176.5 | -169 | -175 | -59.1 | 0 | 0 | 111.3 | A246 D249 P332 A333 E334 E338 T339 V340 | A246-M336 HydrophobicContact CB-CG 4.18Å; A246-M336 HydrophobicContact CB-SD 4.29Å; D249-M336 VanDerWaalsContact OD2-CE 3.27Å; D249-M336 WeakPolarHBondContact OD2-CE 3.32Å; P332-M336 PolarHBondContact O-N 3.38Å; A333-M336 PolarHBondContact O-N 3.46Å; E334-M336 VanDerWaalsContact C-N 3.32Å; E334-M336 PolarHBondContact O-N 2.99Å; M336-E338 VanDerWaalsContact C-N 3.34Å; M336-E338 PolarHBondContact O-N 3.15Å; M336-T339 PolarHBondContact O-N 3.46Å; M336-T339 VanDerWaalsContact O-N 3.17Å; M336-T339 PolarHBondContact O-OG1 3.47Å; M336-V340 WeakPolarHBondContact O-CG2 3.39Å; M336-V340 PolarHBondContact O-N 2.96Å |
| 337 | A | 94.2 | Very high | 85.3 | Confident | 18 Ų | 18 | 88.9 Ų | 88.9 | 15% | 0.149 | 47% | 0.467 | C | S | . | . | H | α-helix | trans | -60 | -42.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | A246 L250 A333 E334 T339 V340 L341 | A246-A337 HydrophobicContact CB-CB 4.21Å; L250-A337 HydrophobicContact CD1-CB 3.74Å; L250-A337 HydrophobicContact CG-CB 4.39Å; A333-A337 WeakPolarHBondContact O-CB 3.09Å; A333-A337 PolarHBondContact O-N 3.4Å; E334-A337 PolarHBondContact O-N 3.08Å; A337-T339 PolarHBondContact O-N 2.92Å; A337-V340 PolarHBondContact O-N 3.25Å; A337-L341 VanDerWaalsContact O-CG 3.3Å; A337-L341 WeakPolarHBondContact O-CG 3.48Å; A337-L341 PolarHBondContact O-N 2.76Å |
| 338 | E | 92.2 | Very high | 84.2 | Confident | 78 Ų | 78 | 84.6 Ų | 84.6 | 36% | 0.364 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -60 | -43.9 | 173.8 | -73.9 | 176.3 | -156.4 | 0 | 0 | 112.2 | E334 K335 M336 V340 L341 R342 | E334-E338 WeakPolarHBondContact O-CG 3.39Å; E334-E338 PolarHBondContact O-N 3.36Å; K335-E338 PolarHBondContact O-N 3.32Å; M336-E338 VanDerWaalsContact C-N 3.34Å; M336-E338 PolarHBondContact O-N 3.15Å; E338-V340 PolarHBondContact O-N 2.76Å; E338-L341 PolarHBondContact O-N 3.41Å; E338-R342 WeakPolarHBondContact O-CG 3.38Å; E338-R342 PolarHBondContact O-N 3.26Å; E338-R342 IonicContact OE2-NH2 3.54Å |
| 339 | T | 91.5 | Very high | 82.9 | Confident | 69 Ų | 69 | 81.1 Ų | 81.1 | 42% | 0.423 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -63.7 | -40.8 | 177.6 | 60.7 | 0 | 0 | 0 | 0 | 112.1 | K335 M336 A337 R342 I343 | K335-T339 WeakPolarHBondContact O-CG2 3.39Å; K335-T339 PolarHBondContact O-N 2.85Å; M336-T339 PolarHBondContact O-N 3.46Å; M336-T339 VanDerWaalsContact O-N 3.17Å; M336-T339 PolarHBondContact O-OG1 3.47Å; A337-T339 PolarHBondContact O-N 2.92Å; T339-R342 PolarHBondContact O-N 3.48Å; T339-I343 VanDerWaalsContact O-CG1 3.31Å; T339-I343 WeakPolarHBondContact O-CG1 3.29Å; T339-I343 PolarHBondContact O-N 2.9Å; T339-I343 VanDerWaalsContact O-N 3.08Å |
| 340 | V | 92.9 | Very high | 81.2 | Confident | 13 Ų | 13 | 81.2 Ų | 81.2 | 8% | 0.079 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -64.1 | -42.8 | 176.7 | 171.2 | 0 | 0 | 0 | 0 | 111 | D242 A243 A246 M336 A337 E338 R342 I343 L344 | D242-V340 HydrophobicContact CB-CG2 4.2Å; A243-V340 HydrophobicContact CB-CG1 3.75Å; A246-V340 HydrophobicContact CB-CG2 4.2Å; M336-V340 WeakPolarHBondContact O-CG2 3.39Å; M336-V340 PolarHBondContact O-N 2.96Å; A337-V340 PolarHBondContact O-N 3.25Å; E338-V340 PolarHBondContact O-N 2.76Å; V340-R342 VanDerWaalsContact C-N 3.32Å; V340-R342 PolarHBondContact O-N 3.14Å; V340-I343 PolarHBondContact O-N 2.78Å; V340-I343 VanDerWaalsContact O-N 3.16Å; V340-L344 HydrophobicContact CG1-CD1 3.71Å; V340-L344 HydrophobicContact CG1-CG 4.26Å; V340-L344 WeakPolarHBondContact O-CB 3.38Å; V340-L344 VanDerWaalsContact O-CG 3.31Å; V340-L344 WeakPolarHBondContact O-CG 3.25Å; V340-L344 PolarHBondContact O-N 2.97Å |
| 341 | L | 90.6 | Very high | 79 | Confident | 118 Ų | 118 | 88.4 Ų | 88.4 | 62% | 0.618 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -60.6 | -41.1 | 176.5 | -73 | 170.4 | 0 | 0 | 0 | 112 | A337 E338 I343 L344 D345 | A337-L341 VanDerWaalsContact O-CG 3.3Å; A337-L341 WeakPolarHBondContact O-CG 3.48Å; A337-L341 PolarHBondContact O-N 2.76Å; E338-L341 PolarHBondContact O-N 3.41Å; L341-I343 VanDerWaalsContact C-N 3.32Å; L341-I343 PolarHBondContact O-N 3.32Å; L341-L344 PolarHBondContact O-N 3.41Å; L341-D345 PolarHBondContact O-N 2.92Å; L341-D345 VanDerWaalsContact O-N 3.12Å |
| 342 | R | 89.7 | Confident | 76.4 | Confident | 166 Ų | 166 | 93 Ų | 93 | 63% | 0.626 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -65 | -34.1 | 175 | -67.7 | -179.6 | -152.1 | -177.5 | 6.8 | 113 | E338 T339 V340 | E338-R342 WeakPolarHBondContact O-CG 3.38Å; E338-R342 PolarHBondContact O-N 3.26Å; E338-R342 IonicContact OE2-NH2 3.54Å; T339-R342 PolarHBondContact O-N 3.48Å; V340-R342 VanDerWaalsContact C-N 3.32Å; V340-R342 PolarHBondContact O-N 3.14Å |
| 343 | I | 86.4 | Confident | 73.9 | Confident | 101 Ų | 101 | 93.2 Ų | 93.2 | 52% | 0.518 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -73.1 | -31.6 | 177.3 | -68.3 | 163.5 | 0 | 0 | 0 | 111.5 | Q239 T339 V340 L341 | Q239-I343 HydrophobicContact CG-CG2 4.04Å; T339-I343 VanDerWaalsContact O-CG1 3.31Å; T339-I343 WeakPolarHBondContact O-CG1 3.29Å; T339-I343 PolarHBondContact O-N 2.9Å; T339-I343 VanDerWaalsContact O-N 3.08Å; V340-I343 PolarHBondContact O-N 2.78Å; V340-I343 VanDerWaalsContact O-N 3.16Å; L341-I343 VanDerWaalsContact C-N 3.32Å; L341-I343 PolarHBondContact O-N 3.32Å |
| 344 | L | 83 | Confident | 71.6 | Confident | 82 Ų | 82 | 98.1 Ų | 98.1 | 43% | 0.429 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -81.7 | -18.7 | -179.7 | -71.7 | 172.2 | 0 | 0 | 0 | 113.5 | Q239 A243 V340 L341 P346 | Q239-L344 HydrophobicContact CB-CD2 3.93Å; Q239-L344 HydrophobicContact CG-CD2 4.43Å; A243-L344 HydrophobicContact CB-CD1 4.48Å; V340-L344 HydrophobicContact CG1-CD1 3.71Å; V340-L344 HydrophobicContact CG1-CG 4.26Å; V340-L344 WeakPolarHBondContact O-CB 3.38Å; V340-L344 VanDerWaalsContact O-CG 3.31Å; V340-L344 WeakPolarHBondContact O-CG 3.25Å; V340-L344 PolarHBondContact O-N 2.97Å; L341-L344 PolarHBondContact O-N 3.41Å; L344-P346 WeakPolarHBondContact O-CD 3.49Å |
| 345 | D | 80.9 | Confident | 69 | Low | 66 Ų | 66 | 101.3 Ų | 101.3 | 35% | 0.353 | 57% | 0.565 | S | S | . | * | trans | -101.3 | 98.4 | 178.1 | -170.2 | 10 | 0 | 0 | 0 | 111.7 | L341 V347 T348 | L341-D345 PolarHBondContact O-N 2.92Å; L341-D345 VanDerWaalsContact O-N 3.12Å; D345-V347 PolarHBondContact O-N 3.38Å; D345-V347 PolarHBondContact OD1-N 2.9Å; D345-T348 VanDerWaalsContact CG-OG1 3.25Å; D345-T348 VanDerWaalsContact OD2-CG2 3.28Å; D345-T348 WeakPolarHBondContact OD2-CG2 3.46Å; D345-T348 PolarHBondContact OD2-OG1 3.29Å | ||
| 346 | P | 62.1 | Low | 66.3 | Low | 114 Ų | 114 | 102.3 Ų | 102.3 | 74% | 0.74 | 58% | 0.576 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72 | -8.8 | -176.7 | 27.3 | -33.5 | 0 | 0 | 0 | 114.3 | L344 | L344-P346 WeakPolarHBondContact O-CD 3.49Š|
| 347 | V | 57.6 | Low | 64 | Low | 118 Ų | 118 | 104.4 Ų | 104.4 | 72% | 0.715 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97 | -17.1 | -171.4 | -177.7 | 0 | 0 | 0 | 0 | 113.2 | D345 | D345-V347 PolarHBondContact O-N 3.38Å; D345-V347 PolarHBondContact OD1-N 2.9Å |
| 348 | T | 49.7 | Very low | 61.4 | Low | 82 Ų | 82 | 112.1 Ų | 112.1 | 50% | 0.503 | 63% | 0.626 | S | S | . | * | trans | -101.4 | 13.1 | -173.4 | 44.5 | 0 | 0 | 0 | 0 | 114.9 | D345 T350 | D345-T348 VanDerWaalsContact CG-OG1 3.25Å; D345-T348 VanDerWaalsContact OD2-CG2 3.28Å; D345-T348 WeakPolarHBondContact OD2-CG2 3.46Å; D345-T348 PolarHBondContact OD2-OG1 3.29Å; T348-T350 PolarHBondContact O-N 2.95Å | ||
| 349 | C | 46.7 | Very low | 58.6 | Low | 115 Ų | 115 | 117.3 Ų | 117.3 | 78% | 0.777 | 65% | 0.648 | S | S | * | * | trans | -72.4 | 19.2 | 173.5 | -86.8 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 350 | T | 45.1 | Very low | 56.1 | Low | 116 Ų | 116 | 123.5 Ų | 123.5 | 71% | 0.712 | 67% | 0.672 | S | S | * | * | S | Bend | trans | -129.7 | 102.2 | 164.4 | 40.9 | 0 | 0 | 0 | 0 | 105.9 | T348 | T348-T350 PolarHBondContact O-N 2.95Š|
| 351 | E | 40.3 | Very low | 53.4 | Low | 194 Ų | 194 | 127.2 Ų | 127.2 | 91% | 0.907 | 70% | 0.699 | S | S | * | * | trans | 159.2 | 65.7 | 154.6 | -76.2 | -104.3 | 157.8 | 0 | 0 | 107.4 | S353 | E351-S353 PolarHBondContact O-N 3.43Š| ||
| 352 | S | 38.2 | Very low | 50.8 | Low | 118 Ų | 118 | 126.1 Ų | 126.1 | 83% | 0.825 | 70% | 0.701 | S | S | * | * | trans | -80.1 | 113.2 | 158.7 | 55.9 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 353 | S | 37.9 | Very low | 48.3 | Very low | 104 Ų | 104 | 124 Ų | 124 | 73% | 0.727 | 71% | 0.711 | S | S | * | * | trans | -42.3 | 140.8 | 157.5 | 176.2 | 0 | 0 | 0 | 0 | 111 | E351 D355 | E351-S353 PolarHBondContact O-N 3.43Å; S353-D355 PolarHBondContact O-N 3.14Å | ||
| 354 | P | 46.7 | Very low | 45.9 | Very low | 105 Ų | 105 | 124.5 Ų | 124.5 | 68% | 0.682 | 72% | 0.719 | S | S | * | * | S | Bend | trans | -77.4 | 122.1 | 172 | 33 | -27.7 | 0 | 0 | 0 | 107.6 | ||
| 355 | D | 37.3 | Very low | 43.9 | Very low | 152 Ų | 152 | 125.8 Ų | 125.8 | 81% | 0.813 | 73% | 0.731 | S | S | * | * | trans | 154.5 | 76 | 147.9 | -75.3 | -18.9 | 0 | 0 | 0 | 109.8 | S353 | S353-D355 PolarHBondContact O-N 3.14Š| ||
| 356 | N | 36.4 | Very low | 42 | Very low | 141 Ų | 141 | 130.9 Ų | 130.9 | 75% | 0.754 | 76% | 0.757 | S | S | * | * | trans | -157.8 | 110.2 | 152.4 | -128.2 | -14.4 | 0 | 0 | 0 | 110.5 | F358 | N356-F358 PolarHBondContact O-N 2.86Š| ||
| 357 | P | 44.3 | Very low | 41.2 | Very low | 123 Ų | 123 | 133.4 Ų | 133.4 | 80% | 0.799 | 76% | 0.764 | S | S | * | * | trans | -86 | 26.9 | -173.2 | 33.6 | -33.9 | 0 | 0 | 0 | 114.2 | ||||
| 358 | F | 38.9 | Very low | 40.6 | Very low | 180 Ų | 180 | 131.8 Ų | 131.8 | 79% | 0.789 | 76% | 0.763 | S | S | * | * | trans | -146.1 | 67.2 | -177.3 | -111.1 | -86.5 | 0 | 0 | 0 | 112.9 | N356 | N356-F358 PolarHBondContact O-N 2.86Š| ||
| 359 | F | 34.2 | Very low | 40.2 | Very low | 187 Ų | 187 | 132.6 Ų | 132.6 | 82% | 0.82 | 78% | 0.778 | S | S | * | * | trans | -147.1 | 89.2 | 151.2 | -93.1 | -76.3 | 0 | 0 | 0 | 108.9 | S361 | F359-S361 PolarHBondContact O-N 3.25Š| ||
| 360 | E | 39.3 | Very low | 39.9 | Very low | 198 Ų | 198 | 136.5 Ų | 136.5 | 93% | 0.925 | 78% | 0.781 | S | S | * | * | trans | -75.7 | 82.3 | 164.2 | -146.3 | 175.7 | -153.7 | 0 | 0 | 107.5 | ||||
| 361 | S | 36.4 | Very low | 40 | Very low | 91 Ų | 91 | 140.2 Ų | 140.2 | 64% | 0.636 | 79% | 0.787 | S | S | * | * | trans | -126.5 | 88.5 | 163 | 56.4 | 0 | 0 | 0 | 0 | 107.2 | F359 S363 | F359-S361 PolarHBondContact O-N 3.25Å; S361-S363 PolarHBondContact O-N 2.71Å; S361-S363 VanDerWaalsContact O-N 3.13Å | ||
| 362 | S | 35.8 | Very low | 40.1 | Very low | 95 Ų | 95 | 138.7 Ų | 138.7 | 66% | 0.664 | 79% | 0.786 | S | S | * | * | trans | -46.9 | 116.1 | 174.5 | -50.3 | 0 | 0 | 0 | 0 | 110.3 | T364 | S362-T364 PolarHBondContact O-N 3.21Š| ||
| 363 | S | 37.6 | Very low | 40.3 | Very low | 121 Ų | 121 | 139.7 Ų | 139.7 | 85% | 0.846 | 78% | 0.78 | S | S | * | * | trans | -69.5 | 74.8 | 161.5 | 27.6 | 0 | 0 | 0 | 0 | 108.6 | S361 T365 | S361-S363 PolarHBondContact O-N 2.71Å; S361-S363 VanDerWaalsContact O-N 3.13Å; S363-T365 PolarHBondContact O-N 2.96Å | ||
| 364 | T | 35.8 | Very low | 40.7 | Very low | 112 Ų | 112 | 138.1 Ų | 138.1 | 69% | 0.687 | 78% | 0.78 | S | S | * | * | trans | -72.5 | 95.9 | 167.3 | 37.6 | 0 | 0 | 0 | 0 | 109 | S362 L366 | S362-T364 PolarHBondContact O-N 3.21Å; T364-L366 PolarHBondContact O-N 2.85Å; T364-L366 VanDerWaalsContact O-N 3.1Å | ||
| 365 | T | 40.4 | Very low | 40.7 | Very low | 109 Ų | 109 | 142.8 Ų | 142.8 | 67% | 0.669 | 78% | 0.784 | S | S | * | * | trans | 13.1 | 88.7 | 134.3 | -20.6 | 0 | 0 | 0 | 0 | 114.3 | S363 L367 A368 | S363-T365 PolarHBondContact O-N 2.96Å; T365-L367 PolarHBondContact O-N 3.13Å; T365-A368 PolarHBondContact O-N 2.9Å | ||
| 366 | L | 41.6 | Very low | 41.2 | Very low | 174 Ų | 174 | 142 Ų | 142 | 91% | 0.911 | 77% | 0.774 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72 | 38.7 | 176.4 | -105.3 | 173.8 | 0 | 0 | 0 | 113.2 | T364 | T364-L366 PolarHBondContact O-N 2.85Å; T364-L366 VanDerWaalsContact O-N 3.1Å |
| 367 | L | 46 | Very low | 41.6 | Very low | 167 Ų | 167 | 141.3 Ų | 141.3 | 87% | 0.874 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -124.7 | -3.8 | 169.1 | -71.3 | 175.7 | 0 | 0 | 0 | 112.7 | T365 | T365-L367 PolarHBondContact O-N 3.13Š|
| 368 | A | 44.3 | Very low | 42 | Very low | 84 Ų | 84 | 141 Ų | 141 | 69% | 0.694 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -92.3 | 128.6 | 171.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | T365 | T365-A368 PolarHBondContact O-N 2.9Š|
| 369 | A | 41.2 | Very low | 42.4 | Very low | 99 Ų | 99 | 141.8 Ų | 141.8 | 82% | 0.818 | 76% | 0.763 | S | S | * | * | trans | 82.5 | 45.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 117.8 | K371 | A369-K371 PolarHBondContact O-N 3.04Š| ||
| 370 | K | 40.3 | Very low | 43.3 | Very low | 196 Ų | 196 | 135.9 Ų | 135.9 | 85% | 0.852 | 74% | 0.742 | S | S | * | * | trans | -76.9 | 103.2 | 142 | -95.4 | -178.1 | 176.5 | 174.7 | 0 | 107.4 | N372 | K370-N372 PolarHBondContact O-N 3.36Å; K370-N372 VanDerWaalsContact O-N 3.12Å | ||
| 371 | K | 47.4 | Very low | 43.9 | Very low | 194 Ų | 194 | 136.5 Ų | 136.5 | 84% | 0.843 | 74% | 0.736 | S | S | * | * | trans | -43.5 | 120.7 | 164.1 | -74.1 | 175.4 | 175.9 | 177 | 0 | 107.7 | A369 I373 | A369-K371 PolarHBondContact O-N 3.04Å; K371-I373 PolarHBondContact O-N 2.92Å | ||
| 372 | N | 41.5 | Very low | 45 | Very low | 162 Ų | 162 | 137.7 Ų | 137.7 | 87% | 0.866 | 73% | 0.728 | S | S | * | * | trans | -48.5 | 105.3 | 177.2 | -73.7 | -50.3 | 0 | 0 | 0 | 108.9 | K370 G374 | K370-N372 PolarHBondContact O-N 3.36Å; K370-N372 VanDerWaalsContact O-N 3.12Å; N372-G374 PolarHBondContact O-N 2.92Å | ||
| 373 | I | 43.5 | Very low | 45.7 | Very low | 139 Ų | 139 | 140.2 Ų | 140.2 | 71% | 0.713 | 73% | 0.729 | S | S | * | * | trans | -65.9 | 117.8 | 171.2 | -141.4 | 78.6 | 0 | 0 | 0 | 104.8 | K371 R375 | K371-I373 PolarHBondContact O-N 2.92Å; I373-R375 VanDerWaalsContact C-N 3.32Å; I373-R375 HydrophobicContact CG2-CG 4.25Å; I373-R375 PolarHBondContact O-N 3.43Å | ||
| 374 | G | 45 | Very low | 46.2 | Very low | 71 Ų | 71 | 141.9 Ų | 141.9 | 73% | 0.732 | 73% | 0.728 | S | S | * | * | trans | -57.3 | 95.1 | 179.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | N372 | N372-G374 PolarHBondContact O-N 2.92Š| ||
| 375 | R | 48.4 | Very low | 47.1 | Very low | 203 Ų | 203 | 140.2 Ų | 140.2 | 77% | 0.766 | 71% | 0.714 | S | S | * | * | trans | -101.5 | 73.2 | 163.3 | -81.9 | -171.9 | 175.8 | -164.6 | 0.4 | 107 | I373 | I373-R375 VanDerWaalsContact C-N 3.32Å; I373-R375 HydrophobicContact CG2-CG 4.25Å; I373-R375 PolarHBondContact O-N 3.43Å | ||
| 376 | F | 47.6 | Very low | 47.4 | Very low | 136 Ų | 136 | 141 Ų | 141 | 60% | 0.596 | 72% | 0.719 | S | S | * | * | trans | -133.8 | 135 | 170.3 | -62.8 | -74 | 0 | 0 | 0 | 111.7 | Y382 | F376-Y382 WeakPolarHBondContact CB-OH 3.49Å; F376-Y382 AromaticContact CD1-CE1 3.87Å; F376-Y382 HydrophobicContact CD1-CE1 3.87Å; F376-Y382 HydrophobicContact CE1-CE1 4.32Å; F376-Y382 HydrophobicContact CG-CE1 4.27Å; F376-Y382 WeakPolarHBondContact CG-OH 3.11Å | ||
| 377 | H | 44.3 | Very low | 48.2 | Very low | 127 Ų | 127 | 139 Ų | 139 | 59% | 0.588 | 70% | 0.703 | S | S | * | * | trans | -79.6 | 143.8 | 178 | -170 | -93.7 | 0 | 0 | 0 | 108.2 | Y379 T380 | H377-Y379 AromaticContact CE1-CD2 3.64Å; H377-Y379 AromaticContact ND1-CD2 3.77Å; H377-Y379 PolarHBondContact O-N 2.7Å; H377-T380 PolarHBondContact O-N 2.78Å; H377-T380 PolarHBondContact O-OG1 2.94Å | ||
| 378 | P | 52.6 | Low | 48.4 | Very low | 116 Ų | 116 | 138.8 Ų | 138.8 | 75% | 0.753 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.6 | -3.2 | -174.6 | -23 | 32.6 | 0 | 0 | 0 | 116.6 | ||
| 379 | Y | 47.6 | Very low | 49.1 | Very low | 196 Ų | 196 | 138.5 Ų | 138.5 | 77% | 0.769 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -123.2 | 11.4 | -174.4 | -63.7 | -79.6 | 0 | 0 | 0 | 113.6 | H377 R381 | H377-Y379 AromaticContact CE1-CD2 3.64Å; H377-Y379 AromaticContact ND1-CD2 3.77Å; H377-Y379 PolarHBondContact O-N 2.7Å; Y379-R381 PolarHBondContact O-N 3.18Å |
| 380 | T | 53.4 | Low | 50 | Low | 63 Ų | 63 | 137.6 Ų | 137.6 | 39% | 0.387 | 68% | 0.682 | S | S | . | * | trans | -74.1 | 111.6 | 176.1 | -43.5 | 0 | 0 | 0 | 0 | 109 | H377 Y382 | H377-T380 PolarHBondContact O-N 2.78Å; H377-T380 PolarHBondContact O-OG1 2.94Å; T380-Y382 HydrophobicContact CG2-CD1 4.23Å; T380-Y382 HydrophobicContact CG2-CE1 3.93Å; T380-Y382 WeakPolarHBondContact O-CD2 3.5Å; T380-Y382 VanDerWaalsContact O-CE2 3.29Å; T380-Y382 WeakPolarHBondContact O-CE2 3.12Å | ||
| 381 | R | 52.1 | Low | 50.8 | Low | 211 Ų | 211 | 136 Ų | 136 | 80% | 0.796 | 68% | 0.683 | S | S | * | * | trans | -74.1 | 126.4 | 170.8 | -66.6 | -168 | -168.9 | -173.1 | 4.5 | 109.2 | Y379 E383 | Y379-R381 PolarHBondContact O-N 3.18Å; R381-E383 PolarHBondContact O-N 3.37Å | ||
| 382 | Y | 58.2 | Low | 51.1 | Low | 117 Ų | 117 | 134.7 Ų | 134.7 | 46% | 0.459 | 68% | 0.679 | S | S | . | * | trans | -100 | 36.8 | -169.7 | -59.7 | -63.1 | 0 | 0 | 0 | 113.6 | F376 T380 N384 I385 | F376-Y382 WeakPolarHBondContact CB-OH 3.49Å; F376-Y382 AromaticContact CD1-CE1 3.87Å; F376-Y382 HydrophobicContact CD1-CE1 3.87Å; F376-Y382 HydrophobicContact CE1-CE1 4.32Å; F376-Y382 HydrophobicContact CG-CE1 4.27Å; F376-Y382 WeakPolarHBondContact CG-OH 3.11Å; T380-Y382 HydrophobicContact CG2-CD1 4.23Å; T380-Y382 HydrophobicContact CG2-CE1 3.93Å; T380-Y382 WeakPolarHBondContact O-CD2 3.5Å; T380-Y382 VanDerWaalsContact O-CE2 3.29Å; T380-Y382 WeakPolarHBondContact O-CE2 3.12Å; Y382-N384 PolarHBondContact O-N 3.09Å; Y382-N384 VanDerWaalsContact O-N 3.09Å; Y382-I385 HydrophobicContact CD1-CD1 3.2Å; Y382-I385 HydrophobicContact CD1-CG1 4.02Å; Y382-I385 HydrophobicContact CE1-CD1 3.83Å; Y382-I385 HydrophobicContact CG-CD1 3.83Å | ||
| 383 | E | 51.7 | Low | 52.3 | Low | 147 Ų | 147 | 130.9 Ų | 130.9 | 69% | 0.687 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.8 | -8.1 | -172.6 | -68.9 | 166 | -157 | 0 | 0 | 113 | R381 | R381-E383 PolarHBondContact O-N 3.37Š|
| 384 | N | 46.4 | Very low | 53.1 | Low | 156 Ų | 156 | 133.3 Ų | 133.3 | 83% | 0.834 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -143.1 | 42.5 | -178.4 | -64 | -60.8 | 0 | 0 | 0 | 114.4 | Y382 T386 | Y382-N384 PolarHBondContact O-N 3.09Å; Y382-N384 VanDerWaalsContact O-N 3.09Å; N384-T386 PolarHBondContact O-N 3.47Å |
| 385 | I | 55 | Low | 53.8 | Low | 77 Ų | 77 | 133.5 Ų | 133.5 | 40% | 0.395 | 67% | 0.674 | S | S | . | * | trans | -80.6 | 115.4 | 169.5 | -66.6 | -176.7 | 0 | 0 | 0 | 109.5 | Y382 F387 | Y382-I385 HydrophobicContact CD1-CD1 3.2Å; Y382-I385 HydrophobicContact CD1-CG1 4.02Å; Y382-I385 HydrophobicContact CE1-CD1 3.83Å; Y382-I385 HydrophobicContact CG-CD1 3.83Å; I385-F387 HydrophobicContact CB-CE2 4.39Å; I385-F387 HydrophobicContact CG2-CD1 4.38Å; I385-F387 HydrophobicContact CG2-CD2 4.26Å; I385-F387 HydrophobicContact CG2-CE1 4.08Å; I385-F387 HydrophobicContact CG2-CE2 3.94Å; I385-F387 HydrophobicContact CG2-CG 4.48Å; I385-F387 HydrophobicContact CG2-CZ 3.84Å | ||
| 386 | T | 48 | Very low | 54.1 | Low | 125 Ų | 125 | 132.7 Ų | 132.7 | 77% | 0.767 | 68% | 0.679 | S | S | * | * | trans | -84.2 | 114.7 | 168.5 | 37.5 | 0 | 0 | 0 | 0 | 110.3 | N384 N388 | N384-T386 PolarHBondContact O-N 3.47Å; T386-N388 PolarHBondContact O-N 3.04Å | ||
| 387 | F | 57.2 | Low | 54.4 | Low | 132 Ų | 132 | 132.1 Ų | 132.1 | 58% | 0.579 | 68% | 0.682 | S | S | * | * | trans | -84.1 | 111.6 | 173.6 | -65.1 | -84.5 | 0 | 0 | 0 | 109.7 | I385 C389 L397 | I385-F387 HydrophobicContact CB-CE2 4.39Å; I385-F387 HydrophobicContact CG2-CD1 4.38Å; I385-F387 HydrophobicContact CG2-CD2 4.26Å; I385-F387 HydrophobicContact CG2-CE1 4.08Å; I385-F387 HydrophobicContact CG2-CE2 3.94Å; I385-F387 HydrophobicContact CG2-CG 4.48Å; I385-F387 HydrophobicContact CG2-CZ 3.84Å; F387-C389 PolarHBondContact O-N 3.21Å; F387-L397 HydrophobicContact CB-CD1 4.2Å; F387-L397 HydrophobicContact CD2-CD1 4.2Å; F387-L397 HydrophobicContact CG-CD1 4.06Å | ||
| 388 | N | 50.7 | Low | 54.7 | Low | 164 Ų | 164 | 132.9 Ų | 132.9 | 88% | 0.877 | 69% | 0.689 | S | S | * | * | trans | -72.9 | 97.8 | 170.8 | -72.4 | -44.1 | 0 | 0 | 0 | 109.3 | T386 | T386-N388 PolarHBondContact O-N 3.04Š| ||
| 389 | C | 58.5 | Low | 54.5 | Low | 77 Ų | 77 | 131.9 Ų | 131.9 | 52% | 0.52 | 69% | 0.69 | S | S | . | * | trans | -94.4 | 142.7 | 174.2 | -62.1 | 0 | 0 | 0 | 0 | 110.4 | F387 C393 | F387-C389 PolarHBondContact O-N 3.21Å; C389-C393 HydrophobicContact CB-CB 4.1Å | ||
| 390 | C | 59.7 | Low | 54.2 | Low | 80 Ų | 80 | 133.8 Ų | 133.8 | 54% | 0.541 | 71% | 0.713 | S | S | . | * | trans | -83.1 | 166.3 | 171 | 80 | 0 | 0 | 0 | 0 | 111.1 | H392 C393 | C390-H392 PolarHBondContact O-N 3.23Å; C390-C393 PolarHBondContact O-N 3.31Å; C390-C393 VanDerWaalsContact O-N 3.11Å | ||
| 391 | N | 57.1 | Low | 54.2 | Low | 162 Ų | 162 | 137.4 Ų | 137.4 | 87% | 0.866 | 73% | 0.729 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.2 | -3.6 | -175.2 | -61.4 | -14.6 | 0 | 0 | 0 | 115.4 | ||
| 392 | H | 54.1 | Low | 54.3 | Low | 168 Ų | 168 | 133.5 Ų | 133.5 | 78% | 0.778 | 73% | 0.725 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.2 | -1.6 | -179.6 | -62.5 | -70.7 | 0 | 0 | 0 | 114 | C390 Q394 | C390-H392 PolarHBondContact O-N 3.23Å; H392-Q394 PolarHBondContact O-N 3.32Å |
| 393 | C | 67.7 | Low | 54.1 | Low | 81 Ų | 81 | 134.4 Ų | 134.4 | 55% | 0.547 | 74% | 0.74 | S | S | . | * | trans | -79.5 | 115.5 | 177.7 | -64.4 | 0 | 0 | 0 | 0 | 110.4 | C389 C390 | C389-C393 HydrophobicContact CB-CB 4.1Å; C390-C393 PolarHBondContact O-N 3.31Å; C390-C393 VanDerWaalsContact O-N 3.11Å | ||
| 394 | Q | 60.2 | Low | 54.2 | Low | 191 Ų | 191 | 133.6 Ų | 133.6 | 89% | 0.893 | 74% | 0.743 | S | S | * | * | trans | -127.3 | 113.2 | 170.8 | -64.4 | -178.4 | 0.3 | 0 | 0 | 108.5 | H392 | H392-Q394 PolarHBondContact O-N 3.32Š| ||
| 395 | G | 59.1 | Low | 54.7 | Low | 74 Ų | 74 | 132.3 Ų | 132.3 | 76% | 0.763 | 74% | 0.738 | S | S | * | * | S | Bend | trans | 162.5 | 155 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 396 | E | 54.1 | Low | 54.7 | Low | 186 Ų | 186 | 135.9 Ų | 135.9 | 87% | 0.869 | 76% | 0.761 | S | S | * | * | trans | -76.1 | 132.1 | 175.7 | -74.5 | -179.2 | 162.8 | 0 | 0 | 111.2 | ||||
| 397 | L | 55.4 | Low | 55.2 | Low | 125 Ų | 125 | 136.7 Ų | 136.7 | 65% | 0.654 | 76% | 0.76 | S | S | * | * | trans | -93 | 116.6 | 174.3 | -68.4 | 170.1 | 0 | 0 | 0 | 109 | F387 | F387-L397 HydrophobicContact CB-CD1 4.2Å; F387-L397 HydrophobicContact CD2-CD1 4.2Å; F387-L397 HydrophobicContact CG-CD1 4.06Å | ||
| 398 | I | 50.4 | Low | 55 | Low | 142 Ų | 142 | 137.1 Ų | 137.1 | 73% | 0.728 | 77% | 0.774 | S | S | * | * | trans | -105.5 | 118.5 | 175.5 | -55 | 173.9 | 0 | 0 | 0 | 107.8 | ||||
| 399 | A | 47.5 | Very low | 55.4 | Low | 95 Ų | 95 | 134.8 Ų | 134.8 | 79% | 0.785 | 77% | 0.765 | S | S | * | * | trans | -90.8 | 124.8 | 169.8 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 400 | L | 40.9 | Very low | 55.1 | Low | 237 Ų | 237 | 140.1 Ų | 140.1 | 100% | 1.241 | 79% | 0.788 | S | S | * | * | trans | -97.8 | 0 | 174 | -79.8 | 167.5 | 0 | 0 | 0 | 111 |
Retrieved 400 of 400 residues in 710.7 ms
(Link to these results)