| 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 | Y | 40.6 | Very low | 41.7 | Very low | 290 Ų | 290 | 167.8 Ų | 167.8 | 100% | 1.137 | 86% | 0.858 | S | S | * | * | 0 | 131.3 | 0 | -98.5 | -98.3 | 0 | 0 | 0 | 107.8 | |||||
| 2 | S | 39 | Very low | 41 | Very low | 114 Ų | 114 | 163 Ų | 163 | 80% | 0.797 | 85% | 0.85 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 148.3 | -158.5 | -43.5 | 0 | 0 | 0 | 0 | 116.6 | ||
| 3 | P | 52.4 | Low | 41.2 | Very low | 120 Ų | 120 | 159 Ų | 159 | 78% | 0.779 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -87.5 | 132.5 | 161.3 | 33.1 | -25.3 | 0 | 0 | 0 | 110.3 | M5 | P3-M5 PolarHBondContact O-N 3.47Š|
| 4 | S | 42.6 | Very low | 41.2 | Very low | 116 Ų | 116 | 163.6 Ų | 163.6 | 81% | 0.811 | 85% | 0.847 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 118.1 | 171.9 | -175 | 0 | 0 | 0 | 0 | 109.4 | ||
| 5 | M | 42.1 | Very low | 40.9 | Very low | 173 Ų | 173 | 168.2 Ų | 168.2 | 85% | 0.852 | 85% | 0.849 | S | S | * | * | trans | -85.8 | 115 | 171.2 | -69.6 | -160.2 | 121 | 0 | 0 | 109.8 | P3 | P3-M5 PolarHBondContact O-N 3.47Š| ||
| 6 | E | 43.2 | Very low | 40.7 | Very low | 186 Ų | 186 | 168.9 Ų | 168.9 | 87% | 0.869 | 85% | 0.845 | S | S | * | * | trans | -93.9 | 106.3 | 166.6 | -155 | 109 | -150.8 | 0 | 0 | 108.5 | Q8 | E6-Q8 PolarHBondContact O-N 3.28Š| ||
| 7 | S | 40.3 | Very low | 40.6 | Very low | 110 Ų | 110 | 171.9 Ų | 171.9 | 77% | 0.769 | 84% | 0.844 | S | S | * | * | trans | -78.6 | 108.7 | 176.5 | -77.7 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 8 | Q | 39.7 | Very low | 40.2 | Very low | 191 Ų | 191 | 173.1 Ų | 173.1 | 89% | 0.893 | 84% | 0.844 | S | S | * | * | trans | -93.1 | 104.9 | 165.7 | -137.9 | 169.4 | 10.2 | 0 | 0 | 109.5 | E6 V10 | E6-Q8 PolarHBondContact O-N 3.28Å; Q8-V10 PolarHBondContact O-N 3.32Å | ||
| 9 | R | 41.9 | Very low | 39.9 | Very low | 232 Ų | 232 | 168 Ų | 168 | 88% | 0.875 | 84% | 0.841 | S | S | * | * | trans | -66.8 | 112.5 | 173 | -72.7 | -177.3 | -175.9 | -170.2 | 1.7 | 109.7 | ||||
| 10 | V | 40.1 | Very low | 40.3 | Very low | 134 Ų | 134 | 165.7 Ų | 165.7 | 81% | 0.812 | 84% | 0.839 | S | S | * | * | trans | -91.7 | 111.7 | 160 | -179.9 | 0 | 0 | 0 | 0 | 107.4 | Q8 S12 | Q8-V10 PolarHBondContact O-N 3.32Å; V10-S12 PolarHBondContact O-N 3.4Å | ||
| 11 | Q | 37.3 | Very low | 40.1 | Very low | 180 Ų | 180 | 167.2 Ų | 167.2 | 84% | 0.841 | 84% | 0.843 | S | S | * | * | trans | -71.5 | 110.5 | 169.7 | -71.3 | -176.1 | -1.7 | 0 | 0 | 108.6 | ||||
| 12 | S | 32.3 | Very low | 39.6 | Very low | 110 Ų | 110 | 157.6 Ų | 157.6 | 77% | 0.769 | 83% | 0.831 | S | S | * | * | trans | -95.2 | 113.9 | 166.8 | 180 | 0 | 0 | 0 | 0 | 108.7 | V10 | V10-S12 PolarHBondContact O-N 3.4Š| ||
| 13 | S | 44.1 | Very low | 39.4 | Very low | 111 Ų | 111 | 157.4 Ų | 157.4 | 78% | 0.776 | 83% | 0.83 | S | S | * | * | trans | -97.8 | 86 | 174.3 | 39.5 | 0 | 0 | 0 | 0 | 110 | ||||
| 14 | Y | 41.8 | Very low | 38.5 | Very low | 224 Ų | 224 | 157.7 Ų | 157.7 | 88% | 0.878 | 84% | 0.835 | S | S | * | * | trans | -145.3 | 98.8 | 163.5 | -110.1 | -88.3 | 0 | 0 | 0 | 110.6 | ||||
| 15 | R | 36.5 | Very low | 38.1 | Very low | 232 Ų | 232 | 155.9 Ų | 155.9 | 88% | 0.875 | 83% | 0.834 | S | S | * | * | trans | -160.7 | 136.7 | 155.1 | -143.4 | 175.4 | -171.3 | -150.1 | -0.3 | 114.8 | ||||
| 16 | K | 36.6 | Very low | 37.7 | Very low | 180 Ų | 180 | 152 Ų | 152 | 78% | 0.783 | 83% | 0.83 | S | S | * | * | trans | 95.2 | 107.1 | 163.2 | -62.2 | -172.5 | 175.9 | -178.2 | 0 | 114.6 | ||||
| 17 | R | 39.2 | Very low | 37.1 | Very low | 220 Ų | 220 | 154.5 Ų | 154.5 | 83% | 0.83 | 83% | 0.832 | S | S | * | * | 69.1 | 107.7 | 53.6 | -68.9 | -163.3 | -179.5 | -128.9 | 1.3 | 114.7 | |||||
| 18 | F | 34.8 | Very low | 36.8 | Very low | 193 Ų | 193 | 157.3 Ų | 157.3 | 85% | 0.846 | 84% | 0.836 | S | S | * | * | trans | 54.2 | 117.5 | 138.5 | -67.3 | -80.3 | 0 | 0 | 0 | 122.4 | ||||
| 19 | G | 34 | Very low | 36.3 | Very low | 76 Ų | 76 | 152 Ų | 152 | 78% | 0.784 | 83% | 0.833 | S | S | * | * | trans | 67.3 | 163.1 | 134.7 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 20 | P | 48.2 | Very low | 35.8 | Very low | 122 Ų | 122 | 145.9 Ų | 145.9 | 79% | 0.792 | 83% | 0.826 | S | S | * | * | cis | -143.8 | 175.6 | 21.3 | 41.2 | -20.4 | 0 | 0 | 0 | 118.3 | ||||
| 21 | Q | 34.7 | Very low | 35.5 | Very low | 198 Ų | 198 | 147.1 Ų | 147.1 | 93% | 0.925 | 83% | 0.827 | S | S | * | * | trans | 48.7 | 127.5 | 145.7 | -85 | -176.7 | -4.6 | 0 | 0 | 123.8 | ||||
| 22 | G | 31.2 | Very low | 35.1 | Very low | 87 Ų | 87 | 143.9 Ų | 143.9 | 90% | 0.897 | 82% | 0.824 | S | S | * | * | trans | -167.5 | 88.6 | 151 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 23 | S | 34.8 | Very low | 35.2 | Very low | 110 Ų | 110 | 143.8 Ų | 143.8 | 77% | 0.769 | 82% | 0.824 | S | S | * | * | trans | -99.6 | 143.2 | 172.7 | 71.9 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 24 | S | 34 | Very low | 34.5 | Very low | 127 Ų | 127 | 144.6 Ų | 144.6 | 89% | 0.888 | 82% | 0.819 | S | S | * | * | trans | 149.9 | 137.5 | 142.2 | 46.5 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 25 | G | 32.4 | Very low | 34.2 | Very low | 77 Ų | 77 | 143.5 Ų | 143.5 | 79% | 0.794 | 81% | 0.813 | S | S | * | * | cis | 174 | 141.9 | 3.2 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 26 | A | 35.3 | Very low | 34 | Very low | 93 Ų | 93 | 139 Ų | 139 | 77% | 0.769 | 81% | 0.806 | S | S | * | * | trans | -74.6 | 160.9 | -174.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 27 | R | 30.6 | Very low | 33.8 | Very low | 238 Ų | 238 | 134.7 Ų | 134.7 | 90% | 0.898 | 80% | 0.798 | S | S | * | * | trans | -151.5 | 111.1 | 141.8 | -64.5 | -165.1 | 177.7 | -176.3 | -1.8 | 107.5 | ||||
| 28 | I | 34.3 | Very low | 33.5 | Very low | 169 Ų | 169 | 134.4 Ų | 134.4 | 87% | 0.867 | 80% | 0.797 | S | S | * | * | 64 | 118.6 | 80.6 | -61 | 173.6 | 0 | 0 | 0 | 113.4 | |||||
| 29 | G | 28.2 | Very low | 33.4 | Very low | 80 Ų | 80 | 133.2 Ų | 133.2 | 83% | 0.825 | 79% | 0.794 | S | S | * | * | trans | 171.6 | 87.3 | 162.4 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 30 | S | 30.9 | Very low | 33.2 | Very low | 103 Ų | 103 | 132.9 Ų | 132.9 | 72% | 0.72 | 79% | 0.791 | S | S | * | * | trans | -107.7 | 162.9 | 173 | 173.1 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 31 | L | 33.6 | Very low | 32.9 | Very low | 159 Ų | 159 | 133.6 Ų | 133.6 | 83% | 0.832 | 79% | 0.793 | S | S | * | * | trans | 87.3 | 139.2 | 168.6 | -48 | 177.6 | 0 | 0 | 0 | 114.2 | ||||
| 32 | S | 28.6 | Very low | 33.7 | Very low | 113 Ų | 113 | 129.6 Ų | 129.6 | 79% | 0.79 | 78% | 0.784 | S | S | * | * | cis | -173.7 | 159.4 | 14.2 | 28.9 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 33 | S | 34.4 | Very low | 34 | Very low | 108 Ų | 108 | 136.8 Ų | 136.8 | 76% | 0.755 | 78% | 0.784 | S | S | * | * | trans | -46.3 | 143 | 166.5 | -46.4 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 34 | N | 30.6 | Very low | 34.1 | Very low | 127 Ų | 127 | 135.8 Ų | 135.8 | 68% | 0.679 | 78% | 0.777 | S | S | * | * | 168.5 | 130.1 | 113.7 | -108 | -10 | 0 | 0 | 0 | 112.9 | |||||
| 35 | R | 34.7 | Very low | 34.3 | Very low | 201 Ų | 201 | 136 Ų | 136 | 76% | 0.758 | 77% | 0.767 | S | S | * | * | 60.9 | 129.6 | 129.4 | -75.2 | 179.7 | -144.4 | -114.7 | 0.1 | 123.4 | |||||
| 36 | L | 33.9 | Very low | 34.4 | Very low | 139 Ų | 139 | 138.2 Ų | 138.2 | 73% | 0.728 | 77% | 0.765 | S | S | * | * | 76.2 | 114.3 | 126.6 | -69.2 | 160.7 | 0 | 0 | 0 | 120.1 | |||||
| 37 | S | 30.7 | Very low | 34.5 | Very low | 88 Ų | 88 | 140.8 Ų | 140.8 | 62% | 0.615 | 77% | 0.766 | S | S | * | * | 85.3 | 121.3 | 120.5 | 78.9 | 0 | 0 | 0 | 0 | 120.5 | |||||
| 38 | W | 33.8 | Very low | 34.7 | Very low | 215 Ų | 215 | 135 Ų | 135 | 81% | 0.814 | 76% | 0.761 | S | S | * | * | 84.5 | 129.1 | 125.2 | -77.7 | 38.5 | 0 | 0 | 0 | 118.6 | |||||
| 39 | H | 31.7 | Very low | 34.8 | Very low | 168 Ų | 168 | 131.5 Ų | 131.5 | 78% | 0.778 | 75% | 0.752 | S | S | * | * | trans | 78.4 | 137.9 | 157.3 | -56.3 | -60.1 | 0 | 0 | 0 | 119.4 | ||||
| 40 | G | 29.9 | Very low | 35.6 | Very low | 69 Ų | 69 | 133.8 Ų | 133.8 | 71% | 0.711 | 75% | 0.752 | S | S | * | * | trans | 141.3 | 71.4 | 149.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 41 | T | 42.9 | Very low | 35.9 | Very low | 137 Ų | 137 | 135 Ų | 135 | 84% | 0.84 | 76% | 0.755 | S | S | * | * | trans | -62.7 | 144.5 | 149.7 | 38.8 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 42 | P | 50.9 | Low | 36.1 | Very low | 114 Ų | 114 | 132.8 Ų | 132.8 | 74% | 0.74 | 75% | 0.753 | S | S | * | * | trans | -109.2 | 122.5 | 143.2 | 28.3 | -15 | 0 | 0 | 0 | 107.8 | ||||
| 43 | R | 38.6 | Very low | 36.3 | Very low | 237 Ų | 237 | 138 Ų | 138 | 89% | 0.894 | 76% | 0.755 | S | S | * | * | 47.4 | 128.3 | 80.8 | -70.7 | -171.8 | 171.9 | -165.8 | -1 | 110.5 | |||||
| 44 | S | 36.6 | Very low | 36.4 | Very low | 89 Ų | 89 | 140.6 Ų | 140.6 | 62% | 0.622 | 76% | 0.76 | S | S | * | * | cis | -179.8 | 144.7 | 43.5 | 101 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 45 | I | 37.2 | Very low | 36.4 | Very low | 131 Ų | 131 | 140.1 Ų | 140.1 | 67% | 0.672 | 77% | 0.767 | S | S | * | * | 69 | 126.3 | 124.4 | -51.9 | 165.4 | 0 | 0 | 0 | 116.2 | L47 | I45-L47 HydrophobicContact CG2-CD1 3.84Š| |||
| 46 | T | 35.8 | Very low | 36.6 | Very low | 124 Ų | 124 | 138.8 Ų | 138.8 | 76% | 0.761 | 77% | 0.774 | S | S | * | * | -153.9 | 127.5 | 61 | 45.4 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 47 | L | 36.3 | Very low | 36.5 | Very low | 148 Ų | 148 | 135 Ų | 135 | 78% | 0.775 | 77% | 0.768 | S | S | * | * | 67.1 | 110.8 | 80.8 | -78.1 | 158.8 | 0 | 0 | 0 | 115.8 | I45 | I45-L47 HydrophobicContact CG2-CD1 3.84Š| |||
| 48 | S | 35 | Very low | 36.6 | Very low | 115 Ų | 115 | 136.5 Ų | 136.5 | 80% | 0.804 | 78% | 0.779 | S | S | * | * | -172.2 | 109.8 | 112.3 | 37.6 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 49 | S | 36.6 | Very low | 36.6 | Very low | 97 Ų | 97 | 131.1 Ų | 131.1 | 68% | 0.678 | 78% | 0.78 | S | S | * | * | trans | 10.9 | 139.6 | 148.1 | 56.3 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 50 | P | 44.5 | Very low | 36.7 | Very low | 127 Ų | 127 | 128.2 Ų | 128.2 | 83% | 0.825 | 78% | 0.778 | S | S | * | * | trans | -91.4 | 151.4 | 149.7 | 36.1 | -26.7 | 0 | 0 | 0 | 111.5 | ||||
| 51 | V | 38.7 | Very low | 37.1 | Very low | 129 Ų | 129 | 132 Ų | 132 | 78% | 0.782 | 79% | 0.788 | S | S | * | * | trans | -108.8 | 123.8 | 175.7 | -178.8 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 52 | S | 35.8 | Very low | 36.7 | Very low | 113 Ų | 113 | 129.9 Ų | 129.9 | 79% | 0.79 | 78% | 0.784 | S | S | * | * | trans | -92.1 | 144.4 | 163 | -51.3 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 53 | R | 34.8 | Very low | 36 | Very low | 223 Ų | 223 | 132.9 Ų | 132.9 | 84% | 0.842 | 79% | 0.793 | S | S | * | * | trans | -145.6 | 110.4 | 156.1 | -76.9 | -162.4 | 173.9 | 170.8 | -1.8 | 108.3 | ||||
| 54 | L | 35.3 | Very low | 35.8 | Very low | 161 Ų | 161 | 129.5 Ų | 129.5 | 84% | 0.843 | 79% | 0.792 | S | S | * | * | 88.4 | 105 | 83.3 | -77.1 | 169.2 | 0 | 0 | 0 | 112.4 | |||||
| 55 | S | 31.5 | Very low | 35.7 | Very low | 118 Ų | 118 | 133.6 Ų | 133.6 | 83% | 0.825 | 81% | 0.806 | S | S | * | * | trans | -70.3 | 141.8 | 158.1 | 164.2 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 56 | L | 38.2 | Very low | 35.4 | Very low | 173 Ų | 173 | 130.6 Ų | 130.6 | 91% | 0.906 | 81% | 0.807 | S | S | * | * | trans | -132.8 | 125.5 | 163.4 | -172.9 | 71.6 | 0 | 0 | 0 | 108.3 | ||||
| 57 | G | 31 | Very low | 35.5 | Very low | 59 Ų | 59 | 130.4 Ų | 130.4 | 61% | 0.608 | 81% | 0.811 | S | S | * | * | trans | -99.8 | 158.8 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 58 | S | 32.7 | Very low | 35.9 | Very low | 120 Ų | 120 | 129.1 Ų | 129.1 | 84% | 0.839 | 81% | 0.812 | S | S | * | * | trans | 69.3 | 120.3 | 146.1 | -155.3 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 59 | A | 35.2 | Very low | 35.9 | Very low | 101 Ų | 101 | 126.9 Ų | 126.9 | 84% | 0.835 | 81% | 0.806 | S | S | * | * | -160.5 | 137.4 | 117.8 | 0 | 0 | 0 | 0 | 0 | 111 | |||||
| 60 | S | 34.2 | Very low | 35.9 | Very low | 108 Ų | 108 | 129.7 Ų | 129.7 | 76% | 0.755 | 81% | 0.814 | S | S | * | * | trans | -80 | 148.2 | -179.1 | -42.8 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 61 | T | 36.9 | Very low | 35.5 | Very low | 149 Ų | 149 | 135.3 Ų | 135.3 | 91% | 0.914 | 82% | 0.819 | S | S | * | * | trans | -153 | 115.4 | 143.8 | 2.2 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 62 | A | 35.2 | Very low | 36.1 | Very low | 91 Ų | 91 | 136.3 Ų | 136.3 | 75% | 0.752 | 82% | 0.819 | S | S | * | * | trans | -100.5 | 136.5 | 166 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 63 | L | 36.8 | Very low | 36.4 | Very low | 177 Ų | 177 | 137.2 Ų | 137.2 | 93% | 0.927 | 82% | 0.815 | S | S | * | * | trans | -144.5 | 134.9 | 153.9 | -77.1 | -178.1 | 0 | 0 | 0 | 110 | ||||
| 64 | L | 34.6 | Very low | 36.9 | Very low | 167 Ų | 167 | 135.1 Ų | 135.1 | 87% | 0.874 | 81% | 0.812 | S | S | * | * | trans | -84.1 | 166.8 | -179.9 | -69 | 155.6 | 0 | 0 | 0 | 111.3 | ||||
| 65 | L | 32.8 | Very low | 37.9 | Very low | 174 Ų | 174 | 131.4 Ų | 131.4 | 91% | 0.911 | 80% | 0.8 | S | S | * | * | trans | 112.1 | 127.6 | 137.1 | -140.3 | 77 | 0 | 0 | 0 | 117.4 | ||||
| 66 | G | 32 | Very low | 39 | Very low | 69 Ų | 69 | 129 Ų | 129 | 71% | 0.711 | 79% | 0.786 | S | S | * | * | trans | 104 | 91.8 | 134.5 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 67 | S | 37.8 | Very low | 39.9 | Very low | 120 Ų | 120 | 125.7 Ų | 125.7 | 84% | 0.839 | 77% | 0.77 | S | S | * | * | trans | -69.2 | 141.6 | 139.3 | -162.5 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 68 | P | 44.9 | Very low | 41.2 | Very low | 121 Ų | 121 | 126.8 Ų | 126.8 | 79% | 0.786 | 77% | 0.768 | S | S | * | * | -148.5 | 164.6 | 80.5 | 36.8 | -17.6 | 0 | 0 | 0 | 115.6 | |||||
| 69 | G | 34.8 | Very low | 42.6 | Very low | 67 Ų | 67 | 127 Ų | 127 | 69% | 0.691 | 76% | 0.759 | S | S | * | * | trans | 81.9 | 94.6 | 135.1 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 70 | D | 37 | Very low | 44.1 | Very low | 156 Ų | 156 | 127.8 Ų | 127.8 | 83% | 0.834 | 75% | 0.747 | S | S | * | * | 53.7 | 101.8 | 122.5 | -145.7 | 16.3 | 0 | 0 | 0 | 118.2 | |||||
| 71 | R | 36.4 | Very low | 45.6 | Very low | 246 Ų | 246 | 129.1 Ų | 129.1 | 93% | 0.928 | 74% | 0.739 | S | S | * | * | -176.8 | 126 | 128.7 | -98 | 165 | 88.9 | 147.3 | 6.8 | 111.3 | |||||
| 72 | L | 50.9 | Low | 47.1 | Very low | 149 Ų | 149 | 124.6 Ų | 124.6 | 78% | 0.78 | 72% | 0.717 | S | S | * | * | trans | -44.8 | 125 | 177.8 | -62.8 | 157 | 0 | 0 | 0 | 114.4 | F74 | L72-F74 HydrophobicContact CD2-CD2 4.24Å; L72-F74 HydrophobicContact CD2-CE2 3.94Å | ||
| 73 | D | 41.4 | Very low | 48.7 | Very low | 133 Ų | 133 | 125.8 Ų | 125.8 | 71% | 0.711 | 71% | 0.707 | S | S | * | * | trans | -156.9 | 96.3 | 144.8 | -154.8 | -3.8 | 0 | 0 | 0 | 111.9 | S75 | D73-S75 VanDerWaalsContact C-N 3.33Å; D73-S75 PolarHBondContact O-N 3.15Å | ||
| 74 | F | 44.5 | Very low | 50.5 | Low | 178 Ų | 178 | 125.4 Ų | 125.4 | 78% | 0.781 | 69% | 0.694 | S | S | * | * | trans | -83.9 | 8 | -170.7 | -88.3 | -84.8 | 0 | 0 | 0 | 114.9 | L72 | L72-F74 HydrophobicContact CD2-CD2 4.24Å; L72-F74 HydrophobicContact CD2-CE2 3.94Å | ||
| 75 | S | 57.3 | Low | 52.4 | Low | 84 Ų | 84 | 124.8 Ų | 124.8 | 59% | 0.587 | 68% | 0.684 | S | S | * | * | S | Bend | trans | -99.9 | -25.7 | -172.6 | -156.5 | 0 | 0 | 0 | 0 | 115.5 | D73 | D73-S75 VanDerWaalsContact C-N 3.33Å; D73-S75 PolarHBondContact O-N 3.15Å |
| 76 | A | 54.8 | Low | 54.5 | Low | 66 Ų | 66 | 122.5 Ų | 122.5 | 55% | 0.545 | 67% | 0.669 | S | S | . | * | H | α-helix | trans | -85.1 | -31.5 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | M80 | A76-M80 WeakPolarHBondContact O-CG 3.14Å; A76-M80 PolarHBondContact O-N 3.48Å |
| 77 | D | 56.7 | Low | 56.7 | Low | 104 Ų | 104 | 123 Ų | 123 | 56% | 0.556 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -75.7 | -25.4 | -176.1 | -140.6 | 34.3 | 0 | 0 | 0 | 112.8 | K81 | D77-K81 PolarHBondContact O-N 3.26Å |
| 78 | S | 58.9 | Low | 58.8 | Low | 82 Ų | 82 | 126.5 Ų | 126.5 | 57% | 0.573 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -72.8 | -39.7 | 175.2 | -167 | 0 | 0 | 0 | 0 | 112.2 | A82 | S78-A82 WeakPolarHBondContact O-CB 3.31Å; S78-A82 PolarHBondContact O-N 3.35Å |
| 79 | L | 62.3 | Low | 60.4 | Low | 125 Ų | 125 | 124.9 Ų | 124.9 | 65% | 0.654 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -67.1 | -40.8 | 175.3 | -85.4 | 161.2 | 0 | 0 | 0 | 111.8 | A82 H83 | L79-A82 PolarHBondContact O-N 2.79Å; L79-H83 WeakPolarHBondContact O-CB 3.27Å; L79-H83 PolarHBondContact O-N 2.94Å |
| 80 | M | 66.1 | Low | 62.7 | Low | 117 Ų | 117 | 125.6 Ų | 125.6 | 58% | 0.576 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -66.4 | -39.4 | 177 | -68.5 | -65.9 | -80.4 | 0 | 0 | 112.6 | A76 H83 Y84 | A76-M80 WeakPolarHBondContact O-CG 3.14Å; A76-M80 PolarHBondContact O-N 3.48Å; M80-H83 PolarHBondContact O-N 2.91Å; M80-Y84 PolarHBondContact O-N 3Å |
| 81 | K | 65.1 | Low | 64.8 | Low | 136 Ų | 136 | 123.7 Ų | 123.7 | 59% | 0.591 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -67.9 | -34.5 | 173.8 | -82.3 | 176.4 | -177.6 | 163.8 | 0 | 113.2 | D77 K85 | D77-K81 PolarHBondContact O-N 3.26Å; K81-K85 WeakPolarHBondContact O-CG 3.2Å; K81-K85 PolarHBondContact O-N 2.86Å |
| 82 | A | 68.1 | Low | 67.1 | Low | 54 Ų | 54 | 118.3 Ų | 118.3 | 45% | 0.446 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -65.2 | -46.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | S78 L79 Y84 K85 E86 | S78-A82 WeakPolarHBondContact O-CB 3.31Å; S78-A82 PolarHBondContact O-N 3.35Å; L79-A82 PolarHBondContact O-N 2.79Å; A82-Y84 PolarHBondContact O-N 2.95Å; A82-K85 PolarHBondContact O-N 3.45Å; A82-E86 PolarHBondContact O-N 3.34Å |
| 83 | H | 69.8 | Low | 68.6 | Low | 117 Ų | 117 | 117.6 Ų | 117.6 | 54% | 0.542 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -63.1 | -38.5 | 177.3 | -140.5 | -69.2 | 0 | 0 | 0 | 112.4 | L79 M80 E86 I87 | L79-H83 WeakPolarHBondContact O-CB 3.27Å; L79-H83 PolarHBondContact O-N 2.94Å; M80-H83 PolarHBondContact O-N 2.91Å; H83-E86 PolarHBondContact O-N 3.28Å; H83-I87 WeakPolarHBondContact O-CD1 3.47Å; H83-I87 VanDerWaalsContact O-CG1 3.25Å; H83-I87 WeakPolarHBondContact O-CG1 3.43Å; H83-I87 PolarHBondContact O-N 3.49Å |
| 84 | Y | 73.8 | Confident | 70.6 | Confident | 168 Ų | 168 | 116.7 Ų | 116.7 | 66% | 0.659 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -67.3 | -37.6 | 173.6 | -105.1 | -82.1 | 0 | 0 | 0 | 113.4 | M80 A82 E86 R88 | M80-Y84 PolarHBondContact O-N 3Å; A82-Y84 PolarHBondContact O-N 2.95Å; Y84-E86 VanDerWaalsContact C-N 3.33Å; Y84-R88 VanDerWaalsContact O-CB 3.24Å; Y84-R88 WeakPolarHBondContact O-CB 3.46Å; Y84-R88 PolarHBondContact O-N 3.47Å |
| 85 | K | 75.7 | Confident | 72.6 | Confident | 154 Ų | 154 | 114.2 Ų | 114.2 | 67% | 0.67 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -65.3 | -40.5 | 173.9 | -82.2 | -178.7 | 176.9 | -178.5 | 0 | 110.9 | K81 A82 R88 T89 | K81-K85 WeakPolarHBondContact O-CG 3.2Å; K81-K85 PolarHBondContact O-N 2.86Å; A82-K85 PolarHBondContact O-N 3.45Å; K85-R88 PolarHBondContact O-N 3.48Å; K85-T89 WeakPolarHBondContact O-CB 3.2Å; K85-T89 WeakPolarHBondContact O-CG2 3.41Å; K85-T89 PolarHBondContact O-N 3.27Å; K85-T89 PolarHBondContact O-OG1 3.34Å; K85-T89 VanDerWaalsContact O-OG1 3.06Å |
| 86 | E | 75.4 | Confident | 73.9 | Confident | 126 Ų | 126 | 115.4 Ų | 115.4 | 59% | 0.589 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -64.2 | -47.7 | 177.3 | -168.4 | 169.6 | -165 | 0 | 0 | 111.8 | A82 H83 Y84 R88 T89 N90 | A82-E86 PolarHBondContact O-N 3.34Å; H83-E86 PolarHBondContact O-N 3.28Å; Y84-E86 VanDerWaalsContact C-N 3.33Å; E86-R88 PolarHBondContact O-N 2.84Å; E86-T89 VanDerWaalsContact CA-OG1 3.3Å; E86-T89 WeakPolarHBondContact CA-OG1 3.07Å; E86-T89 PolarHBondContact O-N 3.42Å; E86-T89 PolarHBondContact O-OG1 3.25Å; E86-N90 WeakPolarHBondContact O-CB 3.41Å; E86-N90 PolarHBondContact O-N 2.85Å |
| 87 | I | 78.7 | Confident | 75.4 | Confident | 81 Ų | 81 | 113.8 Ų | 113.8 | 42% | 0.415 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -59.8 | -45.4 | 174.4 | -66.5 | 163.4 | 0 | 0 | 0 | 110.8 | H83 T89 N90 E91 | H83-I87 WeakPolarHBondContact O-CD1 3.47Å; H83-I87 VanDerWaalsContact O-CG1 3.25Å; H83-I87 WeakPolarHBondContact O-CG1 3.43Å; H83-I87 PolarHBondContact O-N 3.49Å; I87-T89 VanDerWaalsContact C-N 3.33Å; I87-T89 PolarHBondContact O-N 2.97Å; I87-N90 PolarHBondContact O-N 2.79Å; I87-E91 PolarHBondContact O-N 2.85Å |
| 88 | R | 81.3 | Confident | 76.9 | Confident | 193 Ų | 193 | 112.7 Ų | 112.7 | 73% | 0.728 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -66.2 | -34.5 | 178.6 | -167.7 | -178 | -173.4 | 117 | 0.5 | 112.4 | Y84 K85 E86 K92 | Y84-R88 VanDerWaalsContact O-CB 3.24Å; Y84-R88 WeakPolarHBondContact O-CB 3.46Å; Y84-R88 PolarHBondContact O-N 3.47Å; K85-R88 PolarHBondContact O-N 3.48Å; E86-R88 PolarHBondContact O-N 2.84Å; R88-K92 WeakPolarHBondContact O-CB 3.28Å; R88-K92 PolarHBondContact O-N 2.9Å |
| 89 | T | 79.6 | Confident | 78.4 | Confident | 86 Ų | 86 | 114 Ų | 114 | 53% | 0.528 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -71.3 | -35.4 | 174.3 | 55.1 | 0 | 0 | 0 | 0 | 111.5 | K85 E86 I87 K92 M93 | K85-T89 WeakPolarHBondContact O-CB 3.2Å; K85-T89 WeakPolarHBondContact O-CG2 3.41Å; K85-T89 PolarHBondContact O-N 3.27Å; K85-T89 PolarHBondContact O-OG1 3.34Å; K85-T89 VanDerWaalsContact O-OG1 3.06Å; E86-T89 VanDerWaalsContact CA-OG1 3.3Å; E86-T89 WeakPolarHBondContact CA-OG1 3.07Å; E86-T89 PolarHBondContact O-N 3.42Å; E86-T89 PolarHBondContact O-OG1 3.25Å; I87-T89 VanDerWaalsContact C-N 3.33Å; I87-T89 PolarHBondContact O-N 2.97Å; T89-K92 PolarHBondContact O-N 3.34Å; T89-M93 WeakPolarHBondContact O-CB 3.25Å; T89-M93 PolarHBondContact O-N 2.97Å |
| 90 | N | 82.6 | Confident | 79.7 | Confident | 83 Ų | 83 | 113.3 Ų | 113.3 | 44% | 0.444 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -68.9 | -48 | 175.3 | -166.2 | 59.5 | 0 | 0 | 0 | 111.4 | E86 I87 K92 M93 E94 | E86-N90 WeakPolarHBondContact O-CB 3.41Å; E86-N90 PolarHBondContact O-N 2.85Å; I87-N90 PolarHBondContact O-N 2.79Å; N90-K92 VanDerWaalsContact C-N 3.29Å; N90-K92 PolarHBondContact O-N 3.26Å; N90-M93 WeakPolarHBondContact O-CB 3.49Å; N90-M93 PolarHBondContact O-N 3.36Å; N90-M93 VanDerWaalsContact O-N 3.07Å; N90-E94 PolarHBondContact ND2-OE1 3.25Å; N90-E94 WeakPolarHBondContact O-CG 3.41Å; N90-E94 PolarHBondContact O-N 3.42Å |
| 91 | E | 82.5 | Confident | 80.8 | Confident | 115 Ų | 115 | 116.7 Ų | 116.7 | 54% | 0.537 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -58 | -40.8 | 171.8 | -82.1 | -175.6 | 157.3 | 0 | 0 | 111.7 | I87 M93 E94 M95 | I87-E91 PolarHBondContact O-N 2.85Å; E91-M93 VanDerWaalsContact C-N 3.31Å; E91-M93 PolarHBondContact O-N 2.81Å; E91-E94 PolarHBondContact O-N 2.81Å; E91-M95 VanDerWaalsContact O-CB 3.3Å; E91-M95 WeakPolarHBondContact O-CB 3.45Å; E91-M95 WeakPolarHBondContact O-CG 3.24Å; E91-M95 PolarHBondContact O-N 2.96Å |
| 92 | K | 84.5 | Confident | 82 | Confident | 133 Ų | 133 | 116.3 Ų | 116.3 | 58% | 0.578 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -64.4 | -37.8 | 176.1 | -173.4 | 177.2 | 178.5 | -177 | 0 | 111.6 | R88 T89 N90 M96 | R88-K92 WeakPolarHBondContact O-CB 3.28Å; R88-K92 PolarHBondContact O-N 2.9Å; T89-K92 PolarHBondContact O-N 3.34Å; N90-K92 VanDerWaalsContact C-N 3.29Å; N90-K92 PolarHBondContact O-N 3.26Å; K92-M96 WeakPolarHBondContact O-CB 3.44Å; K92-M96 VanDerWaalsContact O-CG 3.31Å; K92-M96 WeakPolarHBondContact O-CG 3.25Å; K92-M96 PolarHBondContact O-N 3.45Å |
| 93 | M | 82.3 | Confident | 83.1 | Confident | 135 Ų | 135 | 116 Ų | 116 | 67% | 0.665 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -69.5 | -40.2 | 176.5 | -167.4 | 179.4 | -64.3 | 0 | 0 | 111.6 | T89 N90 E91 M96 G97 | T89-M93 WeakPolarHBondContact O-CB 3.25Å; T89-M93 PolarHBondContact O-N 2.97Å; N90-M93 WeakPolarHBondContact O-CB 3.49Å; N90-M93 PolarHBondContact O-N 3.36Å; N90-M93 VanDerWaalsContact O-N 3.07Å; E91-M93 VanDerWaalsContact C-N 3.31Å; E91-M93 PolarHBondContact O-N 2.81Å; M93-M96 PolarHBondContact O-N 3.37Å; M93-G97 PolarHBondContact O-N 3.43Å |
| 94 | E | 83.4 | Confident | 84.1 | Confident | 114 Ų | 114 | 114.3 Ų | 114.3 | 53% | 0.533 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -64.1 | -43.2 | 173 | -73.1 | 179.6 | -175.8 | 0 | 0 | 111.7 | N90 E91 M96 G97 L98 | N90-E94 PolarHBondContact ND2-OE1 3.25Å; N90-E94 WeakPolarHBondContact O-CG 3.41Å; N90-E94 PolarHBondContact O-N 3.42Å; E91-E94 PolarHBondContact O-N 2.81Å; E94-M96 VanDerWaalsContact C-N 3.33Å; E94-M96 PolarHBondContact O-N 2.84Å; E94-G97 PolarHBondContact O-N 2.81Å; E94-L98 WeakPolarHBondContact O-CB 3.37Å; E94-L98 WeakPolarHBondContact O-CG 3.47Å; E94-L98 PolarHBondContact O-N 3.24Å |
| 95 | M | 84.9 | Confident | 85.1 | Confident | 126 Ų | 126 | 113.5 Ų | 113.5 | 62% | 0.621 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -64.2 | -37.4 | 174.6 | -73.5 | -63.5 | -67.9 | 0 | 0 | 111.9 | E91 L98 N99 | E91-M95 VanDerWaalsContact O-CB 3.3Å; E91-M95 WeakPolarHBondContact O-CB 3.45Å; E91-M95 WeakPolarHBondContact O-CG 3.24Å; E91-M95 PolarHBondContact O-N 2.96Å; M95-L98 HydrophobicContact SD-CD1 4.35Å; M95-N99 VanDerWaalsContact O-CB 3.28Å; M95-N99 WeakPolarHBondContact O-CB 3.43Å; M95-N99 PolarHBondContact O-N 2.91Å |
| 96 | M | 84.6 | Confident | 85.9 | Confident | 109 Ų | 109 | 110.6 Ų | 110.6 | 54% | 0.537 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -64.4 | -45.7 | 171.6 | -80.3 | 177.3 | 155.1 | 0 | 0 | 111.4 | K92 M93 E94 L98 N99 D100 | K92-M96 WeakPolarHBondContact O-CB 3.44Å; K92-M96 VanDerWaalsContact O-CG 3.31Å; K92-M96 WeakPolarHBondContact O-CG 3.25Å; K92-M96 PolarHBondContact O-N 3.45Å; M93-M96 PolarHBondContact O-N 3.37Å; E94-M96 VanDerWaalsContact C-N 3.33Å; E94-M96 PolarHBondContact O-N 2.84Å; M96-L98 VanDerWaalsContact C-N 3.32Å; M96-L98 PolarHBondContact O-N 2.95Å; M96-N99 PolarHBondContact O-N 2.8Å; M96-N99 VanDerWaalsContact O-N 3.13Å; M96-D100 PolarHBondContact O-N 2.82Å |
| 97 | G | 87.8 | Confident | 86.7 | Confident | 31 Ų | 31 | 111 Ų | 111 | 32% | 0.32 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -63.5 | -35.3 | 177 | 0 | 0 | 0 | 0 | 0 | 113.5 | M93 E94 R101 | M93-G97 PolarHBondContact O-N 3.43Å; E94-G97 PolarHBondContact O-N 2.81Å; G97-R101 VanDerWaalsContact O-CG 3.26Å; G97-R101 WeakPolarHBondContact O-CG 3.27Å; G97-R101 PolarHBondContact O-N 2.7Å |
| 98 | L | 88.3 | Confident | 87.5 | Confident | 82 Ų | 82 | 113.6 Ų | 113.6 | 43% | 0.429 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -68 | -42.2 | 171.3 | -74.1 | 172.6 | 0 | 0 | 0 | 111.6 | E94 M95 M96 R101 F102 | E94-L98 WeakPolarHBondContact O-CB 3.37Å; E94-L98 WeakPolarHBondContact O-CG 3.47Å; E94-L98 PolarHBondContact O-N 3.24Å; M95-L98 HydrophobicContact SD-CD1 4.35Å; M96-L98 VanDerWaalsContact C-N 3.32Å; M96-L98 PolarHBondContact O-N 2.95Å; L98-R101 WeakPolarHBondContact O-CB 3.36Å; L98-R101 PolarHBondContact O-N 3Å; L98-F102 WeakPolarHBondContact O-CD2 3.19Å; L98-F102 PolarHBondContact O-N 2.99Å |
| 99 | N | 89.3 | Confident | 88.1 | Confident | 109 Ų | 109 | 106.7 Ų | 106.7 | 58% | 0.583 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -66.5 | -38.7 | 179.6 | -152 | 8.9 | 0 | 0 | 0 | 112 | M95 M96 R101 F102 A103 | M95-N99 VanDerWaalsContact O-CB 3.28Å; M95-N99 WeakPolarHBondContact O-CB 3.43Å; M95-N99 PolarHBondContact O-N 2.91Å; M96-N99 PolarHBondContact O-N 2.8Å; M96-N99 VanDerWaalsContact O-N 3.13Å; N99-R101 VanDerWaalsContact C-N 3.32Å; N99-R101 PolarHBondContact O-N 3.22Å; N99-F102 PolarHBondContact O-N 2.83Å; N99-A103 WeakPolarHBondContact O-CB 3.48Å; N99-A103 PolarHBondContact O-N 3.4Å |
| 100 | D | 89.4 | Confident | 88.8 | Confident | 110 Ų | 110 | 110.5 Ų | 110.5 | 59% | 0.588 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -64.6 | -37 | 173.8 | -75.6 | -14.4 | 0 | 0 | 0 | 112 | M96 S104 | M96-D100 PolarHBondContact O-N 2.82Å; D100-S104 WeakPolarHBondContact O-CB 3.36Å; D100-S104 PolarHBondContact O-N 3.44Å; D100-S104 PolarHBondContact O-OG 3.43Å |
| 101 | R | 90.6 | Very high | 89.4 | Confident | 189 Ų | 189 | 111 Ų | 111 | 71% | 0.713 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -66.7 | -39.5 | 172.1 | -72.1 | 172.7 | -175.4 | -176.8 | 3.6 | 111.8 | G97 L98 N99 S104 Y105 | G97-R101 VanDerWaalsContact O-CG 3.26Å; G97-R101 WeakPolarHBondContact O-CG 3.27Å; G97-R101 PolarHBondContact O-N 2.7Å; L98-R101 WeakPolarHBondContact O-CB 3.36Å; L98-R101 PolarHBondContact O-N 3Å; N99-R101 VanDerWaalsContact C-N 3.32Å; N99-R101 PolarHBondContact O-N 3.22Å; R101-S104 PolarHBondContact O-N 3.16Å; R101-Y105 WeakPolarHBondContact O-CB 3.41Å; R101-Y105 PolarHBondContact O-N 3.39Å |
| 102 | F | 90.5 | Very high | 89.9 | Confident | 128 Ų | 128 | 109.7 Ų | 109.7 | 56% | 0.561 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -66.5 | -42.6 | 174.5 | -80 | -57.5 | 0 | 0 | 0 | 112.3 | L98 N99 S104 Y105 I106 | L98-F102 WeakPolarHBondContact O-CD2 3.19Å; L98-F102 PolarHBondContact O-N 2.99Å; N99-F102 PolarHBondContact O-N 2.83Å; F102-S104 VanDerWaalsContact C-N 3.33Å; F102-S104 PolarHBondContact O-N 2.92Å; F102-Y105 PolarHBondContact O-N 2.9Å; F102-Y105 VanDerWaalsContact O-N 3.15Å; F102-I106 VanDerWaalsContact O-CG1 3.31Å; F102-I106 WeakPolarHBondContact O-CG1 3.4Å; F102-I106 PolarHBondContact O-N 3.36Å |
| 103 | A | 89.8 | Confident | 90.3 | Very high | 48 Ų | 48 | 108.4 Ų | 108.4 | 40% | 0.397 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -58.6 | -46.5 | 174 | 0 | 0 | 0 | 0 | 0 | 110.8 | N99 Y105 I106 E107 | N99-A103 WeakPolarHBondContact O-CB 3.48Å; N99-A103 PolarHBondContact O-N 3.4Å; A103-Y105 VanDerWaalsContact C-N 3.3Å; A103-Y105 PolarHBondContact O-N 2.83Å; A103-I106 PolarHBondContact O-N 2.86Å; A103-E107 WeakPolarHBondContact O-CB 3.17Å; A103-E107 PolarHBondContact O-N 3.39Å |
| 104 | S | 91.6 | Very high | 90.9 | Very high | 80 Ų | 80 | 107.7 Ų | 107.7 | 56% | 0.559 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -61.1 | -36.9 | 175.2 | -58 | 0 | 0 | 0 | 0 | 112.8 | D100 R101 F102 K108 | D100-S104 WeakPolarHBondContact O-CB 3.36Å; D100-S104 PolarHBondContact O-N 3.44Å; D100-S104 PolarHBondContact O-OG 3.43Å; R101-S104 PolarHBondContact O-N 3.16Å; F102-S104 VanDerWaalsContact C-N 3.33Å; F102-S104 PolarHBondContact O-N 2.92Å; S104-K108 WeakPolarHBondContact O-CB 3.4Å; S104-K108 PolarHBondContact O-N 2.91Å |
| 105 | Y | 94.7 | Very high | 91.5 | Very high | 151 Ų | 151 | 106.6 Ų | 106.6 | 59% | 0.592 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -69.3 | -42.2 | 175.8 | -174.2 | -100.3 | 0 | 0 | 0 | 112.1 | R101 F102 A103 K108 V109 | R101-Y105 WeakPolarHBondContact O-CB 3.41Å; R101-Y105 PolarHBondContact O-N 3.39Å; F102-Y105 PolarHBondContact O-N 2.9Å; F102-Y105 VanDerWaalsContact O-N 3.15Å; A103-Y105 VanDerWaalsContact C-N 3.3Å; A103-Y105 PolarHBondContact O-N 2.83Å; Y105-K108 PolarHBondContact O-N 3.32Å; Y105-V109 HydrophobicContact CD1-CG2 4.05Å; Y105-V109 HydrophobicContact CE1-CG2 3.68Å; Y105-V109 WeakPolarHBondContact O-CG2 3.26Å; Y105-V109 PolarHBondContact O-N 2.83Å |
| 106 | I | 92 | Very high | 91.8 | Very high | 94 Ų | 94 | 105.5 Ų | 105.5 | 48% | 0.482 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.5 | -42.7 | 176.2 | -68.3 | 166.7 | 0 | 0 | 0 | 110.7 | F102 A103 K108 V109 R110 | F102-I106 VanDerWaalsContact O-CG1 3.31Å; F102-I106 WeakPolarHBondContact O-CG1 3.4Å; F102-I106 PolarHBondContact O-N 3.36Å; A103-I106 PolarHBondContact O-N 2.86Å; I106-K108 VanDerWaalsContact C-N 3.3Å; I106-K108 PolarHBondContact O-N 2.92Å; I106-V109 PolarHBondContact O-N 2.88Å; I106-R110 PolarHBondContact O-N 3.48Å |
| 107 | E | 93.1 | Very high | 92.4 | Very high | 135 Ų | 135 | 107.6 Ų | 107.6 | 63% | 0.631 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -58.1 | -44.8 | 174.2 | -155.6 | 83.8 | -147.2 | 0 | 0 | 110.7 | A103 R110 L111 | A103-E107 WeakPolarHBondContact O-CB 3.17Å; A103-E107 PolarHBondContact O-N 3.39Å; E107-R110 PolarHBondContact O-N 2.76Å; E107-L111 WeakPolarHBondContact O-CB 3.46Å; E107-L111 PolarHBondContact O-N 3.47Å |
| 108 | K | 94.4 | Very high | 92.6 | Very high | 135 Ų | 135 | 111.4 Ų | 111.4 | 59% | 0.587 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -65.6 | -41.1 | 177.8 | -170 | 172 | -175.8 | 178.1 | 0 | 112.5 | S104 Y105 I106 L111 L112 | S104-K108 WeakPolarHBondContact O-CB 3.4Å; S104-K108 PolarHBondContact O-N 2.91Å; Y105-K108 PolarHBondContact O-N 3.32Å; I106-K108 VanDerWaalsContact C-N 3.3Å; I106-K108 PolarHBondContact O-N 2.92Å; K108-L111 PolarHBondContact O-N 3.47Å; K108-L112 HydrophobicContact CG-CD1 4.21Å; K108-L112 WeakPolarHBondContact O-CB 3.41Å; K108-L112 VanDerWaalsContact O-CG 3.26Å; K108-L112 WeakPolarHBondContact O-CG 3.17Å; K108-L112 PolarHBondContact O-N 3.1Å |
| 109 | V | 95 | Very high | 92.9 | Very high | 47 Ų | 47 | 112.3 Ų | 112.3 | 29% | 0.285 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -64.2 | -43.8 | 175.3 | 171.4 | 0 | 0 | 0 | 0 | 110.5 | Y105 I106 L111 L112 E113 | Y105-V109 HydrophobicContact CD1-CG2 4.05Å; Y105-V109 HydrophobicContact CE1-CG2 3.68Å; Y105-V109 WeakPolarHBondContact O-CG2 3.26Å; Y105-V109 PolarHBondContact O-N 2.83Å; I106-V109 PolarHBondContact O-N 2.88Å; V109-L111 PolarHBondContact O-N 2.72Å; V109-L112 PolarHBondContact O-N 2.92Å; V109-E113 HydrophobicContact CG1-CG 4.26Å; V109-E113 WeakPolarHBondContact O-CB 3.5Å; V109-E113 WeakPolarHBondContact O-CG 3.43Å; V109-E113 PolarHBondContact O-N 3.38Å |
| 110 | R | 93.1 | Very high | 93 | Very high | 166 Ų | 166 | 110.8 Ų | 110.8 | 63% | 0.626 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -60.9 | -43.5 | 175 | -85.7 | -176.2 | 171.4 | 159.4 | -1.3 | 112.7 | I106 E107 L112 E113 Q114 | I106-R110 PolarHBondContact O-N 3.48Å; E107-R110 PolarHBondContact O-N 2.76Å; R110-L112 VanDerWaalsContact C-N 3.34Å; R110-E113 PolarHBondContact O-N 2.85Å; R110-Q114 WeakPolarHBondContact O-CB 3.48Å; R110-Q114 PolarHBondContact O-N 3.21Å |
| 111 | L | 95.4 | Very high | 93 | Very high | 93 Ų | 93 | 107.8 Ų | 107.8 | 49% | 0.487 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -62 | -44.3 | 176.4 | -174.8 | 68.9 | 0 | 0 | 0 | 110.9 | E107 K108 V109 Q114 Q115 | E107-L111 WeakPolarHBondContact O-CB 3.46Å; E107-L111 PolarHBondContact O-N 3.47Å; K108-L111 PolarHBondContact O-N 3.47Å; V109-L111 PolarHBondContact O-N 2.72Å; L111-Q114 PolarHBondContact O-N 2.87Å; L111-Q115 WeakPolarHBondContact O-CB 3.28Å; L111-Q115 VanDerWaalsContact O-CG 3.27Å; L111-Q115 WeakPolarHBondContact O-CG 3.46Å; L111-Q115 PolarHBondContact O-N 3.44Å |
| 112 | L | 94.1 | Very high | 92.9 | Very high | 88 Ų | 88 | 103.9 Ų | 103.9 | 46% | 0.461 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -64.9 | -41.5 | 176.8 | -74 | 170.6 | 0 | 0 | 0 | 112 | K108 V109 R110 Q115 N116 | K108-L112 HydrophobicContact CG-CD1 4.21Å; K108-L112 WeakPolarHBondContact O-CB 3.41Å; K108-L112 VanDerWaalsContact O-CG 3.26Å; K108-L112 WeakPolarHBondContact O-CG 3.17Å; K108-L112 PolarHBondContact O-N 3.1Å; V109-L112 PolarHBondContact O-N 2.92Å; R110-L112 VanDerWaalsContact C-N 3.34Å; L112-Q115 PolarHBondContact O-N 2.83Å; L112-N116 WeakPolarHBondContact O-CB 3.24Å; L112-N116 PolarHBondContact O-N 3.16Å |
| 113 | E | 93 | Very high | 92.6 | Very high | 106 Ų | 106 | 101.9 Ų | 101.9 | 50% | 0.495 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.5 | -41.4 | 175 | -77.4 | 178 | 174.5 | 0 | 0 | 111.9 | V109 R110 N116 K117 | V109-E113 HydrophobicContact CG1-CG 4.26Å; V109-E113 WeakPolarHBondContact O-CB 3.5Å; V109-E113 WeakPolarHBondContact O-CG 3.43Å; V109-E113 PolarHBondContact O-N 3.38Å; R110-E113 PolarHBondContact O-N 2.85Å; E113-N116 PolarHBondContact O-N 3.18Å; E113-K117 WeakPolarHBondContact O-CB 3.06Å; E113-K117 WeakPolarHBondContact O-CG 3.29Å; E113-K117 PolarHBondContact O-N 3.44Å |
| 114 | Q | 94.9 | Very high | 92.3 | Very high | 121 Ų | 121 | 103.7 Ų | 103.7 | 57% | 0.565 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -64.8 | -44.5 | 175.8 | -173.9 | 176.3 | 11.5 | 0 | 0 | 111 | R110 L111 N116 K117 M118 | R110-Q114 WeakPolarHBondContact O-CB 3.48Å; R110-Q114 PolarHBondContact O-N 3.21Å; L111-Q114 PolarHBondContact O-N 2.87Å; Q114-N116 VanDerWaalsContact C-N 3.35Å; Q114-N116 PolarHBondContact O-N 2.9Å; Q114-K117 PolarHBondContact O-N 3.23Å; Q114-M118 WeakPolarHBondContact O-CG 3.09Å; Q114-M118 PolarHBondContact O-N 2.79Å |
| 115 | Q | 94.5 | Very high | 91.9 | Very high | 90 Ų | 90 | 105.7 Ų | 105.7 | 42% | 0.421 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61 | -43.4 | 174.3 | -75.2 | 175.8 | -14.2 | 0 | 0 | 111.5 | L111 L112 K117 M118 L119 | L111-Q115 WeakPolarHBondContact O-CB 3.28Å; L111-Q115 VanDerWaalsContact O-CG 3.27Å; L111-Q115 WeakPolarHBondContact O-CG 3.46Å; L111-Q115 PolarHBondContact O-N 3.44Å; L112-Q115 PolarHBondContact O-N 2.83Å; Q115-K117 VanDerWaalsContact C-N 3.34Å; Q115-K117 PolarHBondContact O-N 3.35Å; Q115-M118 PolarHBondContact O-N 2.84Å; Q115-L119 WeakPolarHBondContact O-CG 3.39Å; Q115-L119 PolarHBondContact O-N 3.48Å |
| 116 | N | 92.9 | Very high | 91.1 | Very high | 104 Ų | 104 | 103.8 Ų | 103.8 | 56% | 0.556 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -63.1 | -41.2 | 176.9 | -124.8 | -25.2 | 0 | 0 | 0 | 111.7 | L112 E113 Q114 M118 L119 V120 | L112-N116 WeakPolarHBondContact O-CB 3.24Å; L112-N116 PolarHBondContact O-N 3.16Å; E113-N116 PolarHBondContact O-N 3.18Å; Q114-N116 VanDerWaalsContact C-N 3.35Å; Q114-N116 PolarHBondContact O-N 2.9Å; N116-M118 VanDerWaalsContact C-N 3.33Å; N116-M118 PolarHBondContact O-N 2.87Å; N116-L119 PolarHBondContact O-N 3.41Å; N116-V120 WeakPolarHBondContact O-CB 3.33Å; N116-V120 VanDerWaalsContact O-CG2 3.25Å; N116-V120 WeakPolarHBondContact O-CG2 3.48Å; N116-V120 PolarHBondContact O-N 2.81Å |
| 117 | K | 95.3 | Very high | 90.2 | Very high | 153 Ų | 153 | 105.5 Ų | 105.5 | 67% | 0.665 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -60.9 | -42 | 174.5 | -77.7 | 174.9 | -178.3 | 173.6 | 0 | 111.9 | E113 Q114 Q115 A121 | E113-K117 WeakPolarHBondContact O-CB 3.06Å; E113-K117 WeakPolarHBondContact O-CG 3.29Å; E113-K117 PolarHBondContact O-N 3.44Å; Q114-K117 PolarHBondContact O-N 3.23Å; Q115-K117 VanDerWaalsContact C-N 3.34Å; Q115-K117 PolarHBondContact O-N 3.35Å; K117-A121 WeakPolarHBondContact O-CB 3.05Å; K117-A121 PolarHBondContact O-N 2.83Å |
| 118 | M | 93.8 | Very high | 88.9 | Confident | 111 Ų | 111 | 105.2 Ų | 105.2 | 55% | 0.547 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -65.9 | -45.3 | 176 | -65.7 | -149.8 | -55.9 | 0 | 0 | 111.7 | Q114 Q115 N116 V120 A121 E122 | Q114-M118 WeakPolarHBondContact O-CG 3.09Å; Q114-M118 PolarHBondContact O-N 2.79Å; Q115-M118 PolarHBondContact O-N 2.84Å; N116-M118 VanDerWaalsContact C-N 3.33Å; N116-M118 PolarHBondContact O-N 2.87Å; M118-V120 VanDerWaalsContact C-N 3.33Å; M118-V120 PolarHBondContact O-N 3.34Å; M118-A121 WeakPolarHBondContact O-CB 3.49Å; M118-A121 PolarHBondContact O-N 3.38Å; M118-A121 VanDerWaalsContact O-N 3.14Å; M118-E122 WeakPolarHBondContact O-CG 3.44Å; M118-E122 PolarHBondContact O-N 3.43Å |
| 119 | L | 92.6 | Very high | 87.4 | Confident | 101 Ų | 101 | 106.6 Ų | 106.6 | 53% | 0.529 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.3 | -39 | 177.2 | -71.5 | 171.4 | 0 | 0 | 0 | 112.4 | Q115 N116 E122 L123 | Q115-L119 WeakPolarHBondContact O-CG 3.39Å; Q115-L119 PolarHBondContact O-N 3.48Å; N116-L119 PolarHBondContact O-N 3.41Å; L119-E122 PolarHBondContact O-N 2.78Å; L119-L123 VanDerWaalsContact O-CB 3.23Å; L119-L123 WeakPolarHBondContact O-CB 3.4Å; L119-L123 PolarHBondContact O-N 3.47Å |
| 120 | V | 91.5 | Very high | 85.8 | Confident | 76 Ų | 76 | 110.7 Ų | 110.7 | 46% | 0.461 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -66.2 | -39.8 | 175 | 170.2 | 0 | 0 | 0 | 0 | 111.3 | N116 M118 L123 N124 | N116-V120 WeakPolarHBondContact O-CB 3.33Å; N116-V120 VanDerWaalsContact O-CG2 3.25Å; N116-V120 WeakPolarHBondContact O-CG2 3.48Å; N116-V120 PolarHBondContact O-N 2.81Å; M118-V120 VanDerWaalsContact C-N 3.33Å; M118-V120 PolarHBondContact O-N 3.34Å; V120-L123 PolarHBondContact O-N 2.8Å; V120-N124 WeakPolarHBondContact O-CB 3.21Å; V120-N124 VanDerWaalsContact O-CG 3.26Å; V120-N124 PolarHBondContact O-N 3.49Å; V120-N124 PolarHBondContact O-ND2 2.87Å |
| 121 | A | 89.4 | Confident | 84.3 | Confident | 47 Ų | 47 | 107 Ų | 107 | 39% | 0.388 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -65.9 | -43.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | K117 M118 N124 Q125 | K117-A121 WeakPolarHBondContact O-CB 3.05Å; K117-A121 PolarHBondContact O-N 2.83Å; M118-A121 WeakPolarHBondContact O-CB 3.49Å; M118-A121 PolarHBondContact O-N 3.38Å; M118-A121 VanDerWaalsContact O-N 3.14Å; A121-N124 PolarHBondContact O-N 3.28Å; A121-Q125 WeakPolarHBondContact O-CG 3.41Å; A121-Q125 PolarHBondContact O-N 3.36Å |
| 122 | E | 88.8 | Confident | 82.7 | Confident | 108 Ų | 108 | 106.4 Ų | 106.4 | 51% | 0.505 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -62.8 | -43.4 | 174.5 | -73.7 | 178.6 | -178.4 | 0 | 0 | 111.7 | M118 L119 N124 Q125 L126 | M118-E122 WeakPolarHBondContact O-CG 3.44Å; M118-E122 PolarHBondContact O-N 3.43Å; L119-E122 PolarHBondContact O-N 2.78Å; E122-N124 VanDerWaalsContact C-N 3.34Å; E122-N124 PolarHBondContact O-N 2.93Å; E122-Q125 PolarHBondContact O-N 3.45Å; E122-L126 WeakPolarHBondContact O-CB 3.36Å; E122-L126 WeakPolarHBondContact O-CG 3.24Å; E122-L126 PolarHBondContact O-N 3.17Å |
| 123 | L | 84.6 | Confident | 81.6 | Confident | 86 Ų | 86 | 112 Ų | 112 | 45% | 0.45 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -61.8 | -41.5 | 176.6 | -172 | 155.1 | 0 | 0 | 0 | 111.6 | L119 V120 L126 K127 | L119-L123 VanDerWaalsContact O-CB 3.23Å; L119-L123 WeakPolarHBondContact O-CB 3.4Å; L119-L123 PolarHBondContact O-N 3.47Å; V120-L123 PolarHBondContact O-N 2.8Å; L123-L126 PolarHBondContact O-N 2.87Å; L123-K127 HydrophobicContact CD2-CD 3.66Å; L123-K127 VanDerWaalsContact CD2-CE 3.47Å; L123-K127 HydrophobicContact CD2-CG 4.13Å; L123-K127 WeakPolarHBondContact O-CB 3.34Å; L123-K127 WeakPolarHBondContact O-CG 3.32Å; L123-K127 PolarHBondContact O-N 2.87Å |
| 124 | N | 83.7 | Confident | 80.9 | Confident | 85 Ų | 85 | 111 Ų | 111 | 46% | 0.455 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -67.1 | -39.4 | 175.9 | -73 | -25.7 | 0 | 0 | 0 | 112.1 | V120 A121 E122 L126 K127 V128 | V120-N124 WeakPolarHBondContact O-CB 3.21Å; V120-N124 VanDerWaalsContact O-CG 3.26Å; V120-N124 PolarHBondContact O-N 3.49Å; V120-N124 PolarHBondContact O-ND2 2.87Å; A121-N124 PolarHBondContact O-N 3.28Å; E122-N124 VanDerWaalsContact C-N 3.34Å; E122-N124 PolarHBondContact O-N 2.93Å; N124-L126 VanDerWaalsContact C-N 3.34Å; N124-K127 PolarHBondContact O-N 2.92Å; N124-V128 WeakPolarHBondContact O-CG2 3.41Å; N124-V128 PolarHBondContact O-N 2.9Å; N124-V128 VanDerWaalsContact O-N 3.11Å |
| 125 | Q | 83 | Confident | 80.4 | Confident | 123 Ų | 123 | 106.7 Ų | 106.7 | 58% | 0.575 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -65.6 | -36.9 | 174.4 | -74.3 | -176.2 | 17.7 | 0 | 0 | 112.5 | A121 E122 K129 | A121-Q125 WeakPolarHBondContact O-CG 3.41Å; A121-Q125 PolarHBondContact O-N 3.36Å; E122-Q125 PolarHBondContact O-N 3.45Å; Q125-K129 WeakPolarHBondContact O-CG 3.4Å; Q125-K129 PolarHBondContact O-N 3.14Å |
| 126 | L | 77.4 | Confident | 80 | Confident | 110 Ų | 110 | 105.8 Ų | 105.8 | 58% | 0.576 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -70.8 | -41 | 176.2 | -73.2 | 171 | 0 | 0 | 0 | 111.7 | E122 L123 N124 V128 K129 E130 | E122-L126 WeakPolarHBondContact O-CB 3.36Å; E122-L126 WeakPolarHBondContact O-CG 3.24Å; E122-L126 PolarHBondContact O-N 3.17Å; L123-L126 PolarHBondContact O-N 2.87Å; N124-L126 VanDerWaalsContact C-N 3.34Å; L126-V128 VanDerWaalsContact C-N 3.31Å; L126-V128 PolarHBondContact O-N 2.87Å; L126-K129 CarbonylContact O-C 3.6Å; L126-K129 WeakPolarHBondContact O-CA 3.29Å; L126-K129 PolarHBondContact O-N 3.49Å; L126-E130 PolarHBondContact O-N 3.31Å |
| 127 | K | 73.3 | Confident | 79.7 | Confident | 130 Ų | 130 | 104.4 Ų | 104.4 | 57% | 0.565 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -61.5 | -35.7 | 174.3 | -81.8 | -175.1 | 173.9 | 174.7 | 0 | 113.6 | L123 N124 K129 E130 | L123-K127 HydrophobicContact CD2-CD 3.66Å; L123-K127 VanDerWaalsContact CD2-CE 3.47Å; L123-K127 HydrophobicContact CD2-CG 4.13Å; L123-K127 WeakPolarHBondContact O-CB 3.34Å; L123-K127 WeakPolarHBondContact O-CG 3.32Å; L123-K127 PolarHBondContact O-N 2.87Å; N124-K127 PolarHBondContact O-N 2.92Å; K127-K129 PolarHBondContact O-N 3Å; K127-E130 PolarHBondContact O-N 3.5Å |
| 128 | V | 66.6 | Low | 79.5 | Confident | 130 Ų | 130 | 103.7 Ų | 103.7 | 79% | 0.788 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -71.1 | -23.4 | 173.9 | 174.2 | 0 | 0 | 0 | 0 | 111.6 | N124 L126 | N124-V128 WeakPolarHBondContact O-CG2 3.41Å; N124-V128 PolarHBondContact O-N 2.9Å; N124-V128 VanDerWaalsContact O-N 3.11Å; L126-V128 VanDerWaalsContact C-N 3.31Å; L126-V128 PolarHBondContact O-N 2.87Å |
| 129 | K | 63.4 | Low | 79.4 | Confident | 163 Ų | 163 | 103.6 Ų | 103.6 | 71% | 0.709 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -92.3 | -11.3 | 175.1 | -71 | 175.4 | 179.9 | 175.8 | 0 | 113.8 | Q125 L126 K127 | Q125-K129 WeakPolarHBondContact O-CG 3.4Å; Q125-K129 PolarHBondContact O-N 3.14Å; L126-K129 CarbonylContact O-C 3.6Å; L126-K129 WeakPolarHBondContact O-CA 3.29Å; L126-K129 PolarHBondContact O-N 3.49Å; K127-K129 PolarHBondContact O-N 3Å |
| 130 | E | 60.8 | Low | 79.4 | Confident | 133 Ų | 133 | 102.9 Ų | 102.9 | 62% | 0.621 | 53% | 0.526 | S | S | * | . | S | Bend | trans | -65.3 | 150.7 | 171.3 | -82.9 | -172.5 | 164.1 | 0 | 0 | 110.8 | L126 K127 S132 | L126-E130 PolarHBondContact O-N 3.31Å; K127-E130 PolarHBondContact O-N 3.5Å; E130-S132 PolarHBondContact O-N 3.26Å |
| 131 | P | 60.2 | Low | 79.6 | Confident | 89 Ų | 89 | 104.3 Ų | 104.3 | 58% | 0.578 | 53% | 0.528 | S | S | * | . | S | Bend | trans | -90.3 | 74.3 | -136.7 | 36 | -36.3 | 0 | 0 | 0 | 112.7 | R133 L134 G135 | P131-R133 PolarHBondContact O-N 2.85Å; P131-L134 HydrophobicContact CB-CB 4.09Å; P131-L134 PolarHBondContact O-N 3.11Å; P131-G135 PolarHBondContact O-N 3.49Å |
| 132 | S | 62.8 | Low | 79.9 | Confident | 81 Ų | 81 | 106.2 Ų | 106.2 | 57% | 0.566 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -56.2 | -44.5 | 165.2 | -173.4 | 0 | 0 | 0 | 0 | 110.5 | E130 L134 G135 D136 | E130-S132 PolarHBondContact O-N 3.26Å; S132-L134 VanDerWaalsContact C-N 3.29Å; S132-L134 PolarHBondContact O-N 3.41Å; S132-G135 WeakPolarHBondContact O-CA 3.46Å; S132-G135 PolarHBondContact O-N 3Å; S132-D136 VanDerWaalsContact C-OD2 3.25Å; S132-D136 PolarHBondContact O-N 2.88Å; S132-D136 PolarHBondContact OG-OD2 2.81Å |
| 133 | R | 70.6 | Confident | 80.3 | Confident | 204 Ų | 204 | 108.1 Ų | 108.1 | 77% | 0.77 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -58.4 | -35.4 | -176 | -172.2 | 176.8 | 178.6 | -168.2 | -0.5 | 114 | P131 I137 | P131-R133 PolarHBondContact O-N 2.85Å; R133-I137 HydrophobicContact CG-CD1 4.24Å; R133-I137 WeakPolarHBondContact O-CD1 3.28Å; R133-I137 WeakPolarHBondContact O-CG1 3.36Å; R133-I137 PolarHBondContact O-N 2.88Å; R133-I137 VanDerWaalsContact O-N 3.14Å |
| 134 | L | 78.8 | Confident | 80.9 | Confident | 85 Ų | 85 | 107.5 Ų | 107.5 | 45% | 0.445 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -75.7 | -39.5 | 178.5 | -174.8 | 63.3 | 0 | 0 | 0 | 111 | P131 S132 D136 I137 Y138 | P131-L134 HydrophobicContact CB-CB 4.09Å; P131-L134 PolarHBondContact O-N 3.11Å; S132-L134 VanDerWaalsContact C-N 3.29Å; S132-L134 PolarHBondContact O-N 3.41Å; L134-D136 VanDerWaalsContact C-N 3.32Å; L134-I137 PolarHBondContact O-N 2.72Å; L134-Y138 HydrophobicContact CD1-CD2 4.14Å; L134-Y138 HydrophobicContact CD1-CE2 3.53Å; L134-Y138 HydrophobicContact CD2-CE2 3.97Å; L134-Y138 HydrophobicContact CG-CD2 3.9Å; L134-Y138 HydrophobicContact CG-CE2 3.47Å; L134-Y138 VanDerWaalsContact CG-CE2 3.47Å; L134-Y138 WeakPolarHBondContact O-CD2 3.28Å; L134-Y138 PolarHBondContact O-N 3.39Å; L134-Y138 VanDerWaalsContact O-N 3.08Å |
| 135 | G | 84.3 | Confident | 81.5 | Confident | 31 Ų | 31 | 108.2 Ų | 108.2 | 32% | 0.32 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -60.6 | -42 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | P131 S132 Y138 Q139 | P131-G135 PolarHBondContact O-N 3.49Å; S132-G135 WeakPolarHBondContact O-CA 3.46Å; S132-G135 PolarHBondContact O-N 3Å; G135-Y138 PolarHBondContact O-N 2.65Å; G135-Q139 WeakPolarHBondContact O-CB 3.44Å; G135-Q139 VanDerWaalsContact O-CG 3.25Å; G135-Q139 WeakPolarHBondContact O-CG 3.36Å; G135-Q139 PolarHBondContact O-N 3.08Å |
| 136 | D | 85.7 | Confident | 82.2 | Confident | 71 Ų | 71 | 109.9 Ų | 109.9 | 38% | 0.38 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -63.7 | -43.4 | 178.2 | -60.5 | -33.1 | 0 | 0 | 0 | 111.4 | S132 L134 Q139 D140 | S132-D136 VanDerWaalsContact C-OD2 3.25Å; S132-D136 PolarHBondContact O-N 2.88Å; S132-D136 PolarHBondContact OG-OD2 2.81Å; L134-D136 VanDerWaalsContact C-N 3.32Å; D136-Q139 PolarHBondContact O-N 2.9Å; D136-D140 WeakPolarHBondContact O-CB 3.34Å; D136-D140 VanDerWaalsContact O-CG 3.31Å; D136-D140 PolarHBondContact O-N 2.95Å |
| 137 | I | 87.8 | Confident | 83.1 | Confident | 75 Ų | 75 | 111.9 Ų | 111.9 | 39% | 0.385 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.7 | -46.6 | 175.6 | -67.7 | 162 | 0 | 0 | 0 | 111.1 | R133 L134 Q139 D140 E141 | R133-I137 HydrophobicContact CG-CD1 4.24Å; R133-I137 WeakPolarHBondContact O-CD1 3.28Å; R133-I137 WeakPolarHBondContact O-CG1 3.36Å; R133-I137 PolarHBondContact O-N 2.88Å; R133-I137 VanDerWaalsContact O-N 3.14Å; L134-I137 PolarHBondContact O-N 2.72Å; I137-Q139 VanDerWaalsContact C-N 3.31Å; I137-Q139 PolarHBondContact O-N 3.34Å; I137-D140 PolarHBondContact O-N 3.22Å; I137-E141 WeakPolarHBondContact O-CG 3.49Å; I137-E141 PolarHBondContact O-N 3.39Å |
| 138 | Y | 90 | Very high | 84.3 | Confident | 139 Ų | 139 | 110.1 Ų | 110.1 | 55% | 0.545 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -66.2 | -33.6 | 177.5 | -73.2 | -53.6 | 0 | 0 | 0 | 112.8 | L134 G135 L142 | L134-Y138 HydrophobicContact CD1-CD2 4.14Å; L134-Y138 HydrophobicContact CD1-CE2 3.53Å; L134-Y138 HydrophobicContact CD2-CE2 3.97Å; L134-Y138 HydrophobicContact CG-CD2 3.9Å; L134-Y138 HydrophobicContact CG-CE2 3.47Å; L134-Y138 VanDerWaalsContact CG-CE2 3.47Å; L134-Y138 WeakPolarHBondContact O-CD2 3.28Å; L134-Y138 PolarHBondContact O-N 3.39Å; L134-Y138 VanDerWaalsContact O-N 3.08Å; G135-Y138 PolarHBondContact O-N 2.65Å; Y138-L142 VanDerWaalsContact O-CB 3.25Å; Y138-L142 WeakPolarHBondContact O-CB 3.47Å; Y138-L142 PolarHBondContact O-N 2.98Å |
| 139 | Q | 92.1 | Very high | 85.8 | Confident | 109 Ų | 109 | 108 Ų | 108 | 51% | 0.509 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -67.3 | -38.9 | 173.8 | -76.5 | 179.2 | 23 | 0 | 0 | 111.8 | G135 D136 I137 L142 R143 | G135-Q139 WeakPolarHBondContact O-CB 3.44Å; G135-Q139 VanDerWaalsContact O-CG 3.25Å; G135-Q139 WeakPolarHBondContact O-CG 3.36Å; G135-Q139 PolarHBondContact O-N 3.08Å; D136-Q139 PolarHBondContact O-N 2.9Å; I137-Q139 VanDerWaalsContact C-N 3.31Å; I137-Q139 PolarHBondContact O-N 3.34Å; Q139-L142 PolarHBondContact O-N 2.93Å; Q139-R143 WeakPolarHBondContact O-CB 3.45Å; Q139-R143 PolarHBondContact O-N 3.45Å |
| 140 | D | 93.4 | Very high | 87.4 | Confident | 86 Ų | 86 | 104.8 Ų | 104.8 | 46% | 0.46 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.7 | -44.7 | 175.5 | -72.7 | -16 | 0 | 0 | 0 | 111.5 | D136 I137 L142 R143 E144 | D136-D140 WeakPolarHBondContact O-CB 3.34Å; D136-D140 VanDerWaalsContact O-CG 3.31Å; D136-D140 PolarHBondContact O-N 2.95Å; I137-D140 PolarHBondContact O-N 3.22Å; D140-L142 VanDerWaalsContact C-N 3.33Å; D140-L142 PolarHBondContact O-N 3.48Å; D140-R143 PolarHBondContact O-N 3.44Å; D140-R143 IonicContact OD1-CZ 3.53Å; D140-R143 IonicContact OD1-NH1 3.51Å; D140-R143 PolarHBondContact OD1-NH1 2.87Å; D140-R143 IonicContact OD1-NH2 3.6Å; D140-R143 PolarHBondContact OD1-NH2 2.83Å; D140-E144 PolarHBondContact O-N 2.97Å |
| 141 | E | 95 | Very high | 89.2 | Confident | 105 Ų | 105 | 100.4 Ų | 100.4 | 49% | 0.491 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -59.8 | -42.8 | 173.1 | -73.5 | -179.4 | 174 | 0 | 0 | 111.6 | I137 R143 E144 L145 | I137-E141 WeakPolarHBondContact O-CG 3.49Å; I137-E141 PolarHBondContact O-N 3.39Å; E141-R143 VanDerWaalsContact C-N 3.32Å; E141-R143 PolarHBondContact O-N 3.26Å; E141-E144 PolarHBondContact O-N 3.23Å; E141-L145 WeakPolarHBondContact O-CB 3.24Å; E141-L145 WeakPolarHBondContact O-CG 3.36Å; E141-L145 PolarHBondContact O-N 3.48Å |
| 142 | L | 95.7 | Very high | 91 | Very high | 87 Ų | 87 | 102.4 Ų | 102.4 | 46% | 0.455 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.1 | -37.8 | 176.4 | -175.2 | 66.4 | 0 | 0 | 0 | 111.8 | Y138 Q139 D140 R146 | Y138-L142 VanDerWaalsContact O-CB 3.25Å; Y138-L142 WeakPolarHBondContact O-CB 3.47Å; Y138-L142 PolarHBondContact O-N 2.98Å; Q139-L142 PolarHBondContact O-N 2.93Å; D140-L142 VanDerWaalsContact C-N 3.33Å; D140-L142 PolarHBondContact O-N 3.48Å; L142-R146 WeakPolarHBondContact O-CB 3.38Å; L142-R146 VanDerWaalsContact O-CG 3.24Å; L142-R146 WeakPolarHBondContact O-CG 3.48Å; L142-R146 PolarHBondContact O-N 2.9Å |
| 143 | R | 96.8 | Very high | 92.6 | Very high | 148 Ų | 148 | 102.3 Ų | 102.3 | 56% | 0.558 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -67.2 | -41.9 | 177 | -163.5 | -177.7 | -55.4 | 111.7 | 6.4 | 111.1 | Q139 D140 E141 R146 R147 | Q139-R143 WeakPolarHBondContact O-CB 3.45Å; Q139-R143 PolarHBondContact O-N 3.45Å; D140-R143 PolarHBondContact O-N 3.44Å; D140-R143 IonicContact OD1-CZ 3.53Å; D140-R143 IonicContact OD1-NH1 3.51Å; D140-R143 PolarHBondContact OD1-NH1 2.87Å; D140-R143 IonicContact OD1-NH2 3.6Å; D140-R143 PolarHBondContact OD1-NH2 2.83Å; E141-R143 VanDerWaalsContact C-N 3.32Å; E141-R143 PolarHBondContact O-N 3.26Å; R143-R146 PolarHBondContact O-N 3.18Å; R143-R147 PolarHBondContact O-N 3.33Å |
| 144 | E | 97.1 | Very high | 93.9 | Very high | 73 Ų | 73 | 98 Ų | 98 | 34% | 0.341 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -67.1 | -42.5 | 177.1 | -179.8 | 53.4 | -153.7 | 0 | 0 | 111.8 | D140 E141 R146 R147 Q148 | D140-E144 PolarHBondContact O-N 2.97Å; E141-E144 PolarHBondContact O-N 3.23Å; E144-R146 VanDerWaalsContact C-N 3.34Å; E144-R146 PolarHBondContact O-N 3.39Å; E144-R147 WeakPolarHBondContact O-CB 3.17Å; E144-R147 PolarHBondContact O-N 2.94Å; E144-R147 IonicContact OE1-CZ 2.98Å; E144-R147 IonicContact OE1-NE 3.48Å; E144-R147 PolarHBondContact OE1-NE 3.41Å; E144-R147 IonicContact OE1-NH2 3.63Å; E144-R147 PolarHBondContact OE1-NH2 3.13Å; E144-R147 IonicContact OE2-CZ 3.84Å; E144-R147 IonicContact OE2-NE 3.9Å; E144-R147 PolarHBondContact OE2-NE 2.91Å; E144-R147 IonicContact OE2-NH2 2.91Å; E144-Q148 WeakPolarHBondContact O-CG 3.28Å; E144-Q148 PolarHBondContact O-N 2.88Å; E144-Q148 PolarHBondContact OE1-NE2 2.9Å |
| 145 | L | 96.8 | Very high | 94.8 | Very high | 100 Ų | 100 | 95.5 Ų | 95.5 | 52% | 0.524 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -60.7 | -42.2 | 173.7 | -75.2 | 171.2 | 0 | 0 | 0 | 111.9 | E141 Q148 V149 | E141-L145 WeakPolarHBondContact O-CB 3.24Å; E141-L145 WeakPolarHBondContact O-CG 3.36Å; E141-L145 PolarHBondContact O-N 3.48Å; L145-Q148 PolarHBondContact O-N 3.01Å; L145-V149 WeakPolarHBondContact O-CG2 3.42Å; L145-V149 PolarHBondContact O-N 3.43Å |
| 146 | R | 97.3 | Very high | 95.5 | Very high | 159 Ų | 159 | 100 Ų | 100 | 60% | 0.6 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -60.8 | -46.1 | 174.2 | -75.2 | 169.7 | -176.8 | -112.2 | 2.7 | 111.4 | L142 R143 E144 Q148 V149 D150 | L142-R146 WeakPolarHBondContact O-CB 3.38Å; L142-R146 VanDerWaalsContact O-CG 3.24Å; L142-R146 WeakPolarHBondContact O-CG 3.48Å; L142-R146 PolarHBondContact O-N 2.9Å; R143-R146 PolarHBondContact O-N 3.18Å; E144-R146 VanDerWaalsContact C-N 3.34Å; E144-R146 PolarHBondContact O-N 3.39Å; R146-Q148 VanDerWaalsContact C-N 3.28Å; R146-Q148 PolarHBondContact O-N 2.94Å; R146-V149 PolarHBondContact O-N 2.88Å; R146-V149 VanDerWaalsContact O-N 3.14Å; R146-D150 VanDerWaalsContact O-CG 3.26Å; R146-D150 PolarHBondContact O-N 3.4Å |
| 147 | R | 97.5 | Very high | 95.9 | Very high | 151 Ų | 151 | 98.9 Ų | 98.9 | 57% | 0.57 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -59.2 | -39.3 | 176.3 | -167.4 | -168.5 | 70.7 | 76.9 | 2 | 112.1 | R143 E144 G151 | R143-R147 PolarHBondContact O-N 3.33Å; E144-R147 WeakPolarHBondContact O-CB 3.17Å; E144-R147 PolarHBondContact O-N 2.94Å; E144-R147 IonicContact OE1-CZ 2.98Å; E144-R147 IonicContact OE1-NE 3.48Å; E144-R147 PolarHBondContact OE1-NE 3.41Å; E144-R147 IonicContact OE1-NH2 3.63Å; E144-R147 PolarHBondContact OE1-NH2 3.13Å; E144-R147 IonicContact OE2-CZ 3.84Å; E144-R147 IonicContact OE2-NE 3.9Å; E144-R147 PolarHBondContact OE2-NE 2.91Å; E144-R147 IonicContact OE2-NH2 2.91Å; R147-G151 PolarHBondContact O-N 3.4Å |
| 148 | Q | 97.8 | Very high | 96.4 | Very high | 93 Ų | 93 | 103.5 Ų | 103.5 | 44% | 0.435 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -67.1 | -42.8 | 175.5 | -71.7 | 175.9 | 20 | 0 | 0 | 111.8 | E144 L145 R146 G151 L152 | E144-Q148 WeakPolarHBondContact O-CG 3.28Å; E144-Q148 PolarHBondContact O-N 2.88Å; E144-Q148 PolarHBondContact OE1-NE2 2.9Å; L145-Q148 PolarHBondContact O-N 3.01Å; R146-Q148 VanDerWaalsContact C-N 3.28Å; R146-Q148 PolarHBondContact O-N 2.94Å; Q148-G151 PolarHBondContact O-N 3.43Å; Q148-L152 WeakPolarHBondContact O-CB 3.38Å; Q148-L152 WeakPolarHBondContact O-CG 3.36Å; Q148-L152 PolarHBondContact O-N 2.97Å |
| 149 | V | 97.9 | Very high | 96.7 | Very high | 85 Ų | 85 | 102.2 Ų | 102.2 | 52% | 0.515 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.9 | -45.6 | 174.9 | 169.8 | 0 | 0 | 0 | 0 | 110.9 | L145 R146 G151 L152 T153 | L145-V149 WeakPolarHBondContact O-CG2 3.42Å; L145-V149 PolarHBondContact O-N 3.43Å; R146-V149 PolarHBondContact O-N 2.88Å; R146-V149 VanDerWaalsContact O-N 3.14Å; V149-G151 VanDerWaalsContact C-N 3.34Å; V149-G151 PolarHBondContact O-N 2.98Å; V149-L152 PolarHBondContact O-N 3.27Å; V149-T153 VanDerWaalsContact O-CB 3.31Å; V149-T153 WeakPolarHBondContact O-CB 3.44Å; V149-T153 PolarHBondContact O-N 3.19Å; V149-T153 PolarHBondContact O-OG1 3.39Å |
| 150 | D | 97.6 | Very high | 97 | Very high | 96 Ų | 96 | 100.8 Ų | 100.8 | 51% | 0.513 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.3 | -42.6 | 177.6 | -64.6 | -23.2 | 0 | 0 | 0 | 110.9 | R146 T153 N154 | R146-D150 VanDerWaalsContact O-CG 3.26Å; R146-D150 PolarHBondContact O-N 3.4Å; D150-T153 PolarHBondContact O-N 3.06Å; D150-N154 WeakPolarHBondContact O-CB 3.32Å; D150-N154 PolarHBondContact O-N 2.86Å; D150-N154 PolarHBondContact O-ND2 2.9Å |
| 151 | G | 97.9 | Very high | 97.1 | Very high | 42 Ų | 42 | 100.6 Ų | 100.6 | 43% | 0.433 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61 | -45.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | R147 Q148 V149 G155 | R147-G151 PolarHBondContact O-N 3.4Å; Q148-G151 PolarHBondContact O-N 3.43Å; V149-G151 VanDerWaalsContact C-N 3.34Å; V149-G151 PolarHBondContact O-N 2.98Å; G151-G155 PolarHBondContact O-N 3.28Å |
| 152 | L | 97.6 | Very high | 97.2 | Very high | 131 Ų | 131 | 99.3 Ų | 99.3 | 69% | 0.686 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -66.7 | -37.1 | 175.8 | -72.6 | 173.8 | 0 | 0 | 0 | 112 | Q148 V149 G155 K156 | Q148-L152 WeakPolarHBondContact O-CB 3.38Å; Q148-L152 WeakPolarHBondContact O-CG 3.36Å; Q148-L152 PolarHBondContact O-N 2.97Å; V149-L152 PolarHBondContact O-N 3.27Å; L152-G155 PolarHBondContact O-N 3.35Å; L152-K156 VanDerWaalsContact O-CB 3.24Å; L152-K156 WeakPolarHBondContact O-CB 3.31Å; L152-K156 PolarHBondContact O-N 2.95Å |
| 153 | T | 97.6 | Very high | 97.2 | Very high | 78 Ų | 78 | 102.2 Ų | 102.2 | 48% | 0.479 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -67.1 | -44.9 | 178.4 | -56.6 | 0 | 0 | 0 | 0 | 110.7 | V149 D150 K156 A157 | V149-T153 VanDerWaalsContact O-CB 3.31Å; V149-T153 WeakPolarHBondContact O-CB 3.44Å; V149-T153 PolarHBondContact O-N 3.19Å; V149-T153 PolarHBondContact O-OG1 3.39Å; D150-T153 PolarHBondContact O-N 3.06Å; T153-K156 PolarHBondContact O-N 3.03Å; T153-A157 WeakPolarHBondContact O-CB 3.35Å; T153-A157 PolarHBondContact O-N 3.41Å |
| 154 | N | 97.8 | Very high | 97.2 | Very high | 114 Ų | 114 | 98.9 Ų | 98.9 | 61% | 0.61 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -64.4 | -42 | 174.5 | -68.7 | -20.3 | 0 | 0 | 0 | 111.7 | D150 A157 R158 | D150-N154 WeakPolarHBondContact O-CB 3.32Å; D150-N154 PolarHBondContact O-N 2.86Å; D150-N154 PolarHBondContact O-ND2 2.9Å; N154-A157 PolarHBondContact O-N 3.47Å; N154-R158 WeakPolarHBondContact O-CB 3.48Å; N154-R158 PolarHBondContact O-N 2.9Å |
| 155 | G | 97.9 | Very high | 97.1 | Very high | 33 Ų | 33 | 99.8 Ų | 99.8 | 34% | 0.34 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.6 | -43 | 175 | 0 | 0 | 0 | 0 | 0 | 112.3 | G151 L152 R158 L159 | G151-G155 PolarHBondContact O-N 3.28Å; L152-G155 PolarHBondContact O-N 3.35Å; G155-R158 PolarHBondContact O-N 3.29Å; G155-L159 WeakPolarHBondContact O-CG 3.42Å; G155-L159 PolarHBondContact O-N 2.89Å |
| 156 | K | 97.3 | Very high | 96.9 | Very high | 126 Ų | 126 | 100.3 Ų | 100.3 | 55% | 0.548 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.3 | -48.6 | 174.8 | 179.7 | -178.4 | 167.9 | -174.3 | 0 | 111.4 | L152 T153 R158 L159 E160 | L152-K156 VanDerWaalsContact O-CB 3.24Å; L152-K156 WeakPolarHBondContact O-CB 3.31Å; L152-K156 PolarHBondContact O-N 2.95Å; T153-K156 PolarHBondContact O-N 3.03Å; K156-R158 VanDerWaalsContact C-N 3.29Å; K156-R158 PolarHBondContact O-N 3.49Å; K156-L159 PolarHBondContact O-N 2.92Å; K156-L159 VanDerWaalsContact O-N 3.16Å; K156-E160 WeakPolarHBondContact CE-OE1 3.41Å; K156-E160 HydrophobicContact CG-CG 4.42Å; K156-E160 IonicContact NZ-OE1 2.9Å; K156-E160 WeakPolarHBondContact O-CG 3.43Å; K156-E160 PolarHBondContact O-N 3.1Å |
| 157 | A | 96.1 | Very high | 96.7 | Very high | 46 Ų | 46 | 94.9 Ų | 94.9 | 38% | 0.38 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -59 | -41.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | T153 N154 E160 V161 | T153-A157 WeakPolarHBondContact O-CB 3.35Å; T153-A157 PolarHBondContact O-N 3.41Å; N154-A157 PolarHBondContact O-N 3.47Å; A157-E160 PolarHBondContact O-N 2.87Å; A157-V161 WeakPolarHBondContact O-CG2 3.49Å; A157-V161 PolarHBondContact O-N 2.95Å |
| 158 | R | 97.8 | Very high | 96.6 | Very high | 172 Ų | 172 | 90.1 Ų | 90.1 | 65% | 0.649 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -61.7 | -46.8 | 174.6 | -178.3 | 179.7 | 170 | 166.8 | 2.7 | 112.2 | N154 G155 K156 E160 V161 E162 | N154-R158 WeakPolarHBondContact O-CB 3.48Å; N154-R158 PolarHBondContact O-N 2.9Å; G155-R158 PolarHBondContact O-N 3.29Å; K156-R158 VanDerWaalsContact C-N 3.29Å; K156-R158 PolarHBondContact O-N 3.49Å; R158-E160 VanDerWaalsContact C-N 3.31Å; R158-E160 PolarHBondContact O-N 3.35Å; R158-V161 PolarHBondContact O-N 3.29Å; R158-E162 IonicContact CZ-OE1 2.64Å; R158-E162 IonicContact NE-OE1 3.79Å; R158-E162 PolarHBondContact NE-OE1 2.89Å; R158-E162 IonicContact NH2-OE1 2.69Å; R158-E162 WeakPolarHBondContact O-CG 3.38Å; R158-E162 PolarHBondContact O-N 3.27Å |
| 159 | L | 96.4 | Very high | 96.3 | Very high | 112 Ų | 112 | 90.6 Ų | 90.6 | 59% | 0.586 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -65.3 | -33.8 | 178.1 | -72.6 | 173.1 | 0 | 0 | 0 | 112.5 | G155 K156 E162 R163 | G155-L159 WeakPolarHBondContact O-CG 3.42Å; G155-L159 PolarHBondContact O-N 2.89Å; K156-L159 PolarHBondContact O-N 2.92Å; K156-L159 VanDerWaalsContact O-N 3.16Å; L159-E162 PolarHBondContact O-N 2.85Å; L159-R163 VanDerWaalsContact O-CB 3.29Å; L159-R163 WeakPolarHBondContact O-CB 3.29Å; L159-R163 PolarHBondContact O-N 3.31Å |
| 160 | E | 96.9 | Very high | 95.9 | Very high | 80 Ų | 80 | 91.3 Ų | 91.3 | 37% | 0.374 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.2 | -43.1 | 174.4 | -75.6 | 174.7 | 164.9 | 0 | 0 | 111.2 | K156 A157 R158 R163 D164 | K156-E160 WeakPolarHBondContact CE-OE1 3.41Å; K156-E160 HydrophobicContact CG-CG 4.42Å; K156-E160 IonicContact NZ-OE1 2.9Å; K156-E160 WeakPolarHBondContact O-CG 3.43Å; K156-E160 PolarHBondContact O-N 3.1Å; A157-E160 PolarHBondContact O-N 2.87Å; R158-E160 VanDerWaalsContact C-N 3.31Å; R158-E160 PolarHBondContact O-N 3.35Å; E160-R163 WeakPolarHBondContact O-CB 3.45Å; E160-R163 PolarHBondContact O-N 3.25Å; E160-D164 VanDerWaalsContact O-CG 3.28Å; E160-D164 PolarHBondContact O-N 3.31Å |
| 161 | V | 97.4 | Very high | 95.7 | Very high | 82 Ų | 82 | 91 Ų | 91 | 50% | 0.497 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.7 | -45.8 | 173.8 | 173 | 0 | 0 | 0 | 0 | 111.5 | A157 R158 R163 D164 N165 | A157-V161 WeakPolarHBondContact O-CG2 3.49Å; A157-V161 PolarHBondContact O-N 2.95Å; R158-V161 PolarHBondContact O-N 3.29Å; V161-R163 VanDerWaalsContact C-N 3.31Å; V161-R163 PolarHBondContact O-N 2.87Å; V161-D164 PolarHBondContact O-N 3.13Å; V161-N165 WeakPolarHBondContact O-CB 3.48Å; V161-N165 VanDerWaalsContact O-CG 3.23Å; V161-N165 PolarHBondContact O-N 3.47Å; V161-N165 PolarHBondContact O-ND2 3.13Å |
| 162 | E | 96.5 | Very high | 95.5 | Very high | 77 Ų | 77 | 94.7 Ų | 94.7 | 36% | 0.36 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61 | -40.7 | 176.8 | -73.4 | 174 | -169.4 | 0 | 0 | 111.5 | R158 L159 L166 | R158-E162 IonicContact CZ-OE1 2.64Å; R158-E162 IonicContact NE-OE1 3.79Å; R158-E162 PolarHBondContact NE-OE1 2.89Å; R158-E162 IonicContact NH2-OE1 2.69Å; R158-E162 WeakPolarHBondContact O-CG 3.38Å; R158-E162 PolarHBondContact O-N 3.27Å; L159-E162 PolarHBondContact O-N 2.85Å; E162-L166 WeakPolarHBondContact O-CB 3.38Å; E162-L166 VanDerWaalsContact O-CG 3.29Å; E162-L166 WeakPolarHBondContact O-CG 3.37Å; E162-L166 PolarHBondContact O-N 2.91Å |
| 163 | R | 95.9 | Very high | 95.1 | Very high | 148 Ų | 148 | 93.7 Ų | 93.7 | 56% | 0.558 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -60.3 | -46.2 | 173.4 | -179.9 | -149.6 | 67.2 | -172.8 | -8.3 | 111.4 | L159 E160 V161 L166 A167 | L159-R163 VanDerWaalsContact O-CB 3.29Å; L159-R163 WeakPolarHBondContact O-CB 3.29Å; L159-R163 PolarHBondContact O-N 3.31Å; E160-R163 WeakPolarHBondContact O-CB 3.45Å; E160-R163 PolarHBondContact O-N 3.25Å; V161-R163 VanDerWaalsContact C-N 3.31Å; V161-R163 PolarHBondContact O-N 2.87Å; R163-L166 PolarHBondContact O-N 3.32Å; R163-A167 WeakPolarHBondContact O-CB 3.43Å; R163-A167 PolarHBondContact O-N 2.95Å |
| 164 | D | 95.3 | Very high | 94.7 | Very high | 78 Ų | 78 | 96.8 Ų | 96.8 | 42% | 0.417 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -68.1 | -38.8 | -177.1 | -71.9 | -16.8 | 0 | 0 | 0 | 112.2 | E160 V161 A167 A168 | E160-D164 VanDerWaalsContact O-CG 3.28Å; E160-D164 PolarHBondContact O-N 3.31Å; V161-D164 PolarHBondContact O-N 3.13Å; D164-A167 PolarHBondContact O-N 3.1Å; D164-A168 WeakPolarHBondContact O-CB 3.37Å; D164-A168 PolarHBondContact O-N 3Å |
| 165 | N | 95.1 | Very high | 94.3 | Very high | 92 Ų | 92 | 96.4 Ų | 96.4 | 49% | 0.492 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.5 | -49.3 | 172.2 | -68.2 | -16 | 0 | 0 | 0 | 111.1 | V161 A167 A168 D169 | V161-N165 WeakPolarHBondContact O-CB 3.48Å; V161-N165 VanDerWaalsContact O-CG 3.23Å; V161-N165 PolarHBondContact O-N 3.47Å; V161-N165 PolarHBondContact O-ND2 3.13Å; N165-A167 VanDerWaalsContact C-N 3.29Å; N165-A167 PolarHBondContact O-N 2.98Å; N165-A168 WeakPolarHBondContact O-CB 3.41Å; N165-A168 PolarHBondContact O-N 3.16Å; N165-A168 VanDerWaalsContact O-N 3.16Å; N165-D169 PolarHBondContact O-N 3.4Å |
| 166 | L | 92.6 | Very high | 93.8 | Very high | 111 Ų | 111 | 97.8 Ų | 97.8 | 58% | 0.581 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -62.5 | -35.8 | 177.1 | -71.5 | 173.8 | 0 | 0 | 0 | 112.5 | E162 R163 L170 | E162-L166 WeakPolarHBondContact O-CB 3.38Å; E162-L166 VanDerWaalsContact O-CG 3.29Å; E162-L166 WeakPolarHBondContact O-CG 3.37Å; E162-L166 PolarHBondContact O-N 2.91Å; R163-L166 PolarHBondContact O-N 3.32Å; L166-L170 WeakPolarHBondContact O-CB 3.46Å; L166-L170 VanDerWaalsContact O-CG 3.26Å; L166-L170 WeakPolarHBondContact O-CG 3.26Å; L166-L170 PolarHBondContact O-N 2.83Å |
| 167 | A | 94.1 | Very high | 93.4 | Very high | 46 Ų | 46 | 100.3 Ų | 100.3 | 38% | 0.38 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.6 | -42.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | R163 D164 N165 L170 V171 | R163-A167 WeakPolarHBondContact O-CB 3.43Å; R163-A167 PolarHBondContact O-N 2.95Å; D164-A167 PolarHBondContact O-N 3.1Å; N165-A167 VanDerWaalsContact C-N 3.29Å; N165-A167 PolarHBondContact O-N 2.98Å; A167-L170 PolarHBondContact O-N 3.45Å; A167-V171 WeakPolarHBondContact O-CG2 3.46Å; A167-V171 PolarHBondContact O-N 3.29Å |
| 168 | A | 94.4 | Very high | 93 | Very high | 51 Ų | 51 | 103.6 Ų | 103.6 | 42% | 0.421 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.6 | -46.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | D164 N165 L170 V171 M172 | D164-A168 WeakPolarHBondContact O-CB 3.37Å; D164-A168 PolarHBondContact O-N 3Å; N165-A168 WeakPolarHBondContact O-CB 3.41Å; N165-A168 PolarHBondContact O-N 3.16Å; N165-A168 VanDerWaalsContact O-N 3.16Å; A168-L170 VanDerWaalsContact C-N 3.33Å; A168-L170 PolarHBondContact O-N 3.13Å; A168-V171 PolarHBondContact O-N 2.87Å; A168-V171 VanDerWaalsContact O-N 3.16Å; A168-M172 WeakPolarHBondContact O-CG 3.45Å; A168-M172 PolarHBondContact O-N 3.13Å |
| 169 | D | 91.4 | Very high | 92.6 | Very high | 102 Ų | 102 | 101 Ų | 101 | 55% | 0.545 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -60.8 | -41.4 | 177.1 | -70.5 | -17.6 | 0 | 0 | 0 | 111.9 | N165 V171 M172 L173 | N165-D169 PolarHBondContact O-N 3.4Å; D169-V171 PolarHBondContact O-N 3.32Å; D169-M172 PolarHBondContact O-N 3.07Å; D169-L173 VanDerWaalsContact O-CB 3.28Å; D169-L173 WeakPolarHBondContact O-CB 3.49Å; D169-L173 PolarHBondContact O-N 3.48Å |
| 170 | L | 90.8 | Very high | 92.3 | Very high | 100 Ų | 100 | 100.1 Ų | 100.1 | 52% | 0.524 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.3 | -38.9 | 175.9 | -78.3 | 174.8 | 0 | 0 | 0 | 112.5 | L166 A167 A168 K174 | L166-L170 WeakPolarHBondContact O-CB 3.46Å; L166-L170 VanDerWaalsContact O-CG 3.26Å; L166-L170 WeakPolarHBondContact O-CG 3.26Å; L166-L170 PolarHBondContact O-N 2.83Å; A167-L170 PolarHBondContact O-N 3.45Å; A168-L170 VanDerWaalsContact C-N 3.33Å; A168-L170 PolarHBondContact O-N 3.13Å; L170-K174 WeakPolarHBondContact O-CB 3.32Å; L170-K174 VanDerWaalsContact O-CG 3.25Å; L170-K174 WeakPolarHBondContact O-CG 3.39Å; L170-K174 PolarHBondContact O-N 2.77Å |
| 171 | V | 93.1 | Very high | 91.9 | Very high | 89 Ų | 89 | 102.1 Ų | 102.1 | 54% | 0.539 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -66.4 | -47.5 | 175.7 | 170.5 | 0 | 0 | 0 | 0 | 110.1 | A167 A168 D169 L173 K174 Q175 | A167-V171 WeakPolarHBondContact O-CG2 3.46Å; A167-V171 PolarHBondContact O-N 3.29Å; A168-V171 PolarHBondContact O-N 2.87Å; A168-V171 VanDerWaalsContact O-N 3.16Å; D169-V171 PolarHBondContact O-N 3.32Å; V171-L173 PolarHBondContact O-N 3Å; V171-K174 PolarHBondContact O-N 2.9Å; V171-Q175 WeakPolarHBondContact O-CB 3.01Å; V171-Q175 PolarHBondContact O-N 3.24Å |
| 172 | M | 93.7 | Very high | 91.3 | Very high | 121 Ų | 121 | 104.8 Ų | 104.8 | 60% | 0.596 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -58.8 | -46 | 177.1 | -75.4 | -60.8 | -60.1 | 0 | 0 | 112 | A168 D169 K174 Q175 S176 | A168-M172 WeakPolarHBondContact O-CG 3.45Å; A168-M172 PolarHBondContact O-N 3.13Å; D169-M172 PolarHBondContact O-N 3.07Å; M172-K174 PolarHBondContact O-N 3.26Å; M172-Q175 PolarHBondContact O-N 2.9Å; M172-S176 WeakPolarHBondContact O-CB 3.35Å; M172-S176 PolarHBondContact O-N 3.01Å |
| 173 | L | 89.1 | Confident | 91 | Very high | 110 Ų | 110 | 104.3 Ų | 104.3 | 58% | 0.576 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -64.4 | -41.7 | 178.7 | -174.4 | 68.9 | 0 | 0 | 0 | 111.8 | D169 V171 R177 | D169-L173 VanDerWaalsContact O-CB 3.28Å; D169-L173 WeakPolarHBondContact O-CB 3.49Å; D169-L173 PolarHBondContact O-N 3.48Å; V171-L173 PolarHBondContact O-N 3Å; L173-R177 WeakPolarHBondContact O-CB 3.34Å; L173-R177 PolarHBondContact O-N 3.38Å |
| 174 | K | 90.1 | Very high | 90.7 | Very high | 142 Ų | 142 | 102.2 Ų | 102.2 | 62% | 0.617 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -63.6 | -42.5 | 175.3 | -78.6 | 176.3 | 179.8 | 178.1 | 0 | 111.5 | L170 V171 M172 L178 | L170-K174 WeakPolarHBondContact O-CB 3.32Å; L170-K174 VanDerWaalsContact O-CG 3.25Å; L170-K174 WeakPolarHBondContact O-CG 3.39Å; L170-K174 PolarHBondContact O-N 2.77Å; V171-K174 PolarHBondContact O-N 2.9Å; M172-K174 PolarHBondContact O-N 3.26Å; K174-L178 WeakPolarHBondContact O-CB 3.38Å; K174-L178 VanDerWaalsContact O-CG 3.31Å; K174-L178 WeakPolarHBondContact O-CG 3.35Å; K174-L178 PolarHBondContact O-N 3.39Å |
| 175 | Q | 87.6 | Confident | 90.4 | Very high | 106 Ų | 106 | 106.5 Ų | 106.5 | 50% | 0.495 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -65.3 | -45.7 | 178.1 | -174.1 | 171.9 | -4.7 | 0 | 0 | 111.3 | V171 M172 L178 Q179 | V171-Q175 WeakPolarHBondContact O-CB 3.01Å; V171-Q175 PolarHBondContact O-N 3.24Å; M172-Q175 PolarHBondContact O-N 2.9Å; Q175-L178 PolarHBondContact O-N 3.11Å; Q175-Q179 WeakPolarHBondContact O-CB 3.3Å; Q175-Q179 PolarHBondContact O-N 3.4Å |
| 176 | S | 89 | Confident | 90.1 | Very high | 62 Ų | 62 | 106.7 Ų | 106.7 | 43% | 0.434 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -57.7 | -50.6 | 174.8 | -171.8 | 0 | 0 | 0 | 0 | 111.2 | M172 L178 Q179 D180 | M172-S176 WeakPolarHBondContact O-CB 3.35Å; M172-S176 PolarHBondContact O-N 3.01Å; S176-L178 PolarHBondContact O-N 3.01Å; S176-Q179 PolarHBondContact O-N 2.89Å; S176-Q179 VanDerWaalsContact O-N 3.15Å; S176-D180 VanDerWaalsContact O-CG 3.25Å; S176-D180 PolarHBondContact O-N 3.49Å |
| 177 | R | 88.7 | Confident | 90 | Very high | 179 Ų | 179 | 107 Ų | 107 | 68% | 0.675 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -61.1 | -42.1 | 178.4 | -96.3 | -153.3 | 177.4 | -165.2 | 0.5 | 113.1 | L173 Q179 D180 E181 | L173-R177 WeakPolarHBondContact O-CB 3.34Å; L173-R177 PolarHBondContact O-N 3.38Å; R177-Q179 VanDerWaalsContact C-N 3.28Å; R177-Q179 PolarHBondContact O-N 3.3Å; R177-D180 PolarHBondContact O-N 2.89Å; R177-E181 WeakPolarHBondContact O-CB 3.49Å; R177-E181 WeakPolarHBondContact O-CG 3.34Å; R177-E181 PolarHBondContact O-N 3.28Å |
| 178 | L | 86.7 | Confident | 89.5 | Confident | 115 Ų | 115 | 107.6 Ų | 107.6 | 60% | 0.602 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -63.2 | -39.5 | 176.9 | -78.2 | 173.5 | 0 | 0 | 0 | 111.1 | K174 Q175 S176 E181 M182 | K174-L178 WeakPolarHBondContact O-CB 3.38Å; K174-L178 VanDerWaalsContact O-CG 3.31Å; K174-L178 WeakPolarHBondContact O-CG 3.35Å; K174-L178 PolarHBondContact O-N 3.39Å; Q175-L178 PolarHBondContact O-N 3.11Å; S176-L178 PolarHBondContact O-N 3.01Å; L178-E181 PolarHBondContact O-N 2.91Å; L178-M182 WeakPolarHBondContact O-CB 3.25Å; L178-M182 VanDerWaalsContact O-CG 3.23Å; L178-M182 WeakPolarHBondContact O-CG 3.39Å; L178-M182 PolarHBondContact O-N 3.36Å |
| 179 | Q | 90 | Very high | 89.3 | Confident | 119 Ų | 119 | 108.3 Ų | 108.3 | 56% | 0.556 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -66.7 | -41.9 | 177.7 | -169 | 146.6 | -10.5 | 0 | 0 | 111.9 | Q175 S176 R177 M182 T183 | Q175-Q179 WeakPolarHBondContact O-CB 3.3Å; Q175-Q179 PolarHBondContact O-N 3.4Å; S176-Q179 PolarHBondContact O-N 2.89Å; S176-Q179 VanDerWaalsContact O-N 3.15Å; R177-Q179 VanDerWaalsContact C-N 3.28Å; R177-Q179 PolarHBondContact O-N 3.3Å; Q179-M182 WeakPolarHBondContact O-CB 3.44Å; Q179-M182 PolarHBondContact O-N 3.44Å; Q179-T183 WeakPolarHBondContact O-CG2 3.43Å; Q179-T183 PolarHBondContact O-N 3.4Å; Q179-T183 PolarHBondContact O-OG1 2.83Å |
| 180 | D | 89.5 | Confident | 89.3 | Confident | 92 Ų | 92 | 107.2 Ų | 107.2 | 49% | 0.492 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.6 | -40.7 | 174.7 | -63.8 | -25 | 0 | 0 | 0 | 112.2 | S176 R177 M182 T183 L184 | S176-D180 VanDerWaalsContact O-CG 3.25Å; S176-D180 PolarHBondContact O-N 3.49Å; R177-D180 PolarHBondContact O-N 2.89Å; D180-M182 VanDerWaalsContact C-N 3.33Å; D180-T183 WeakPolarHBondContact CA-OG1 3.44Å; D180-T183 PolarHBondContact O-N 2.87Å; D180-T183 PolarHBondContact O-OG1 2.94Å; D180-L184 WeakPolarHBondContact O-CB 3.41Å; D180-L184 PolarHBondContact O-N 2.94Å |
| 181 | E | 88.5 | Confident | 89.4 | Confident | 123 Ų | 123 | 105.2 Ų | 105.2 | 58% | 0.575 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -67 | -35.9 | 174.9 | -73.3 | -69.2 | 166.5 | 0 | 0 | 111.7 | R177 L178 R185 | R177-E181 WeakPolarHBondContact O-CB 3.49Å; R177-E181 WeakPolarHBondContact O-CG 3.34Å; R177-E181 PolarHBondContact O-N 3.28Å; L178-E181 PolarHBondContact O-N 2.91Å; E181-R185 VanDerWaalsContact O-CB 3.26Å; E181-R185 WeakPolarHBondContact O-CB 3.32Å; E181-R185 PolarHBondContact O-N 3.3Å |
| 182 | M | 84.4 | Confident | 89.2 | Confident | 137 Ų | 137 | 105.1 Ų | 105.1 | 68% | 0.675 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -65.9 | -42.5 | 174.5 | -76.5 | 177.9 | 69.1 | 0 | 0 | 112 | L178 Q179 D180 Q186 | L178-M182 WeakPolarHBondContact O-CB 3.25Å; L178-M182 VanDerWaalsContact O-CG 3.23Å; L178-M182 WeakPolarHBondContact O-CG 3.39Å; L178-M182 PolarHBondContact O-N 3.36Å; Q179-M182 WeakPolarHBondContact O-CB 3.44Å; Q179-M182 PolarHBondContact O-N 3.44Å; D180-M182 VanDerWaalsContact C-N 3.33Å; M182-Q186 WeakPolarHBondContact O-CB 3.34Å; M182-Q186 PolarHBondContact O-N 3.46Å |
| 183 | T | 90.3 | Very high | 89.1 | Confident | 68 Ų | 68 | 103 Ų | 103 | 42% | 0.417 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -66.3 | -44.8 | 176.5 | 54.5 | 0 | 0 | 0 | 0 | 111 | Q179 D180 R185 Q186 E187 | Q179-T183 WeakPolarHBondContact O-CG2 3.43Å; Q179-T183 PolarHBondContact O-N 3.4Å; Q179-T183 PolarHBondContact O-OG1 2.83Å; D180-T183 WeakPolarHBondContact CA-OG1 3.44Å; D180-T183 PolarHBondContact O-N 2.87Å; D180-T183 PolarHBondContact O-OG1 2.94Å; T183-R185 VanDerWaalsContact C-N 3.32Å; T183-R185 PolarHBondContact O-N 2.93Å; T183-Q186 WeakPolarHBondContact O-CB 3.31Å; T183-Q186 PolarHBondContact O-N 3.16Å; T183-Q186 VanDerWaalsContact O-N 3.11Å; T183-E187 WeakPolarHBondContact O-CG 3.46Å; T183-E187 PolarHBondContact O-N 2.9Å |
| 184 | L | 89.6 | Confident | 89.3 | Confident | 103 Ų | 103 | 100.9 Ų | 100.9 | 54% | 0.539 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.5 | -41.3 | 177.8 | -160.4 | 82.2 | 0 | 0 | 0 | 111.7 | D180 E187 A188 | D180-L184 WeakPolarHBondContact O-CB 3.41Å; D180-L184 PolarHBondContact O-N 2.94Å; L184-E187 PolarHBondContact O-N 3.13Å; L184-A188 WeakPolarHBondContact O-CB 3.33Å; L184-A188 PolarHBondContact O-N 2.93Å |
| 185 | R | 89.7 | Confident | 89.4 | Confident | 168 Ų | 168 | 100.3 Ų | 100.3 | 63% | 0.634 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -61.1 | -46.6 | 173.1 | -177.8 | -169 | 167.6 | 103.5 | 9.8 | 111.1 | E181 T183 E187 A188 E189 | E181-R185 VanDerWaalsContact O-CB 3.26Å; E181-R185 WeakPolarHBondContact O-CB 3.32Å; E181-R185 PolarHBondContact O-N 3.3Å; T183-R185 VanDerWaalsContact C-N 3.32Å; T183-R185 PolarHBondContact O-N 2.93Å; R185-E187 VanDerWaalsContact C-N 3.33Å; R185-E187 PolarHBondContact O-N 3.34Å; R185-A188 PolarHBondContact O-N 3.27Å; R185-E189 IonicContact CZ-OE1 3.81Å; R185-E189 IonicContact NE-OE1 2.87Å; R185-E189 PolarHBondContact NE-OE1 2.9Å; R185-E189 IonicContact NH2-OE1 3.05Å; R185-E189 PolarHBondContact NH2-OE1 3.08Å; R185-E189 WeakPolarHBondContact O-CB 3.5Å; R185-E189 WeakPolarHBondContact O-CG 3.4Å; R185-E189 PolarHBondContact O-N 3.3Å |
| 186 | Q | 88.6 | Confident | 89.7 | Confident | 97 Ų | 97 | 102.5 Ų | 102.5 | 45% | 0.453 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.8 | -41.3 | 179.8 | -174.7 | 62.8 | 56 | 0 | 0 | 111.6 | M182 T183 E189 N190 | M182-Q186 WeakPolarHBondContact O-CB 3.34Å; M182-Q186 PolarHBondContact O-N 3.46Å; T183-Q186 WeakPolarHBondContact O-CB 3.31Å; T183-Q186 PolarHBondContact O-N 3.16Å; T183-Q186 VanDerWaalsContact O-N 3.11Å; Q186-E189 PolarHBondContact O-N 3.11Å; Q186-N190 PolarHBondContact NE2-OD1 2.9Å; Q186-N190 WeakPolarHBondContact O-CB 3.36Å; Q186-N190 PolarHBondContact O-N 3.06Å; Q186-N190 PolarHBondContact O-ND2 3.5Å; Q186-N190 PolarHBondContact O-OD1 3.22Å |
| 187 | E | 91.1 | Very high | 89.9 | Confident | 116 Ų | 116 | 105.9 Ų | 105.9 | 54% | 0.542 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.4 | -46.1 | 174.6 | -73.5 | 174.4 | -175 | 0 | 0 | 111.3 | T183 L184 R185 E189 N190 S191 | T183-E187 WeakPolarHBondContact O-CG 3.46Å; T183-E187 PolarHBondContact O-N 2.9Å; L184-E187 PolarHBondContact O-N 3.13Å; R185-E187 VanDerWaalsContact C-N 3.33Å; R185-E187 PolarHBondContact O-N 3.34Å; E187-E189 PolarHBondContact O-N 3.41Å; E187-N190 WeakPolarHBondContact O-CB 3.36Å; E187-N190 PolarHBondContact O-N 3.29Å; E187-S191 PolarHBondContact O-N 3.46Å; E187-S191 PolarHBondContact O-OG 3.41Å |
| 188 | A | 83.6 | Confident | 90.2 | Very high | 60 Ų | 60 | 101.4 Ų | 101.4 | 50% | 0.496 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.4 | -40.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | L184 R185 S191 L192 | L184-A188 WeakPolarHBondContact O-CB 3.33Å; L184-A188 PolarHBondContact O-N 2.93Å; R185-A188 PolarHBondContact O-N 3.27Å; A188-S191 PolarHBondContact O-N 2.97Å; A188-L192 WeakPolarHBondContact O-CB 3.38Å; A188-L192 PolarHBondContact O-N 2.87Å |
| 189 | E | 90.8 | Very high | 90.7 | Very high | 66 Ų | 66 | 100.5 Ų | 100.5 | 31% | 0.308 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.4 | -41 | 174 | -76.2 | -178.9 | -176.5 | 0 | 0 | 111.7 | R185 Q186 E187 L192 N193 | R185-E189 IonicContact CZ-OE1 3.81Å; R185-E189 IonicContact NE-OE1 2.87Å; R185-E189 PolarHBondContact NE-OE1 2.9Å; R185-E189 IonicContact NH2-OE1 3.05Å; R185-E189 PolarHBondContact NH2-OE1 3.08Å; R185-E189 WeakPolarHBondContact O-CB 3.5Å; R185-E189 WeakPolarHBondContact O-CG 3.4Å; R185-E189 PolarHBondContact O-N 3.3Å; Q186-E189 PolarHBondContact O-N 3.11Å; E187-E189 PolarHBondContact O-N 3.41Å; E189-L192 PolarHBondContact O-N 2.65Å; E189-N193 WeakPolarHBondContact O-CB 3.46Å; E189-N193 VanDerWaalsContact O-CG 3.3Å; E189-N193 PolarHBondContact O-N 2.94Å; E189-N193 PolarHBondContact O-ND2 3.38Å |
| 190 | N | 90.4 | Very high | 91 | Very high | 79 Ų | 79 | 99.8 Ų | 99.8 | 42% | 0.422 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.3 | -46.4 | 175.3 | -69.2 | -16.2 | 0 | 0 | 0 | 111 | Q186 E187 L192 N193 T194 | Q186-N190 PolarHBondContact NE2-OD1 2.9Å; Q186-N190 WeakPolarHBondContact O-CB 3.36Å; Q186-N190 PolarHBondContact O-N 3.06Å; Q186-N190 PolarHBondContact O-ND2 3.5Å; Q186-N190 PolarHBondContact O-OD1 3.22Å; E187-N190 WeakPolarHBondContact O-CB 3.36Å; E187-N190 PolarHBondContact O-N 3.29Å; N190-L192 VanDerWaalsContact C-N 3.33Å; N190-L192 PolarHBondContact O-N 2.92Å; N190-N193 WeakPolarHBondContact O-CB 3.38Å; N190-N193 PolarHBondContact O-N 2.96Å; N190-T194 PolarHBondContact O-N 2.87Å |
| 191 | S | 92.1 | Very high | 91.4 | Very high | 57 Ų | 57 | 101.9 Ų | 101.9 | 40% | 0.399 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.4 | -38.2 | 175.3 | -61.3 | 0 | 0 | 0 | 0 | 112.7 | E187 A188 N193 T194 F195 | E187-S191 PolarHBondContact O-N 3.46Å; E187-S191 PolarHBondContact O-OG 3.41Å; A188-S191 PolarHBondContact O-N 2.97Å; S191-N193 VanDerWaalsContact C-N 3.32Å; S191-N193 PolarHBondContact O-N 2.9Å; S191-T194 WeakPolarHBondContact CA-OG1 3.46Å; S191-T194 PolarHBondContact O-N 3.49Å; S191-T194 PolarHBondContact O-OG1 3.44Å; S191-F195 WeakPolarHBondContact O-CD2 3.36Å; S191-F195 WeakPolarHBondContact O-CG 3.24Å; S191-F195 PolarHBondContact O-N 3.49Å |
| 192 | L | 90.1 | Very high | 91.7 | Very high | 88 Ų | 88 | 98.6 Ų | 98.6 | 46% | 0.461 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.9 | -41.7 | 174.2 | -176.3 | 73.3 | 0 | 0 | 0 | 111.1 | A188 E189 N190 F195 R196 | A188-L192 WeakPolarHBondContact O-CB 3.38Å; A188-L192 PolarHBondContact O-N 2.87Å; E189-L192 PolarHBondContact O-N 2.65Å; N190-L192 VanDerWaalsContact C-N 3.33Å; N190-L192 PolarHBondContact O-N 2.92Å; L192-F195 PolarHBondContact O-N 3.34Å; L192-R196 WeakPolarHBondContact O-CG 3.46Å; L192-R196 PolarHBondContact O-N 3.4Å |
| 193 | N | 91 | Very high | 92.3 | Very high | 75 Ų | 75 | 93.8 Ų | 93.8 | 40% | 0.401 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -66 | -39.8 | 178.1 | -74.1 | -24.6 | 0 | 0 | 0 | 112 | E189 N190 S191 R196 Q197 | E189-N193 WeakPolarHBondContact O-CB 3.46Å; E189-N193 VanDerWaalsContact O-CG 3.3Å; E189-N193 PolarHBondContact O-N 2.94Å; E189-N193 PolarHBondContact O-ND2 3.38Å; N190-N193 WeakPolarHBondContact O-CB 3.38Å; N190-N193 PolarHBondContact O-N 2.96Å; S191-N193 VanDerWaalsContact C-N 3.32Å; S191-N193 PolarHBondContact O-N 2.9Å; N193-R196 PolarHBondContact O-N 3.3Å; N193-Q197 WeakPolarHBondContact O-CG 3.03Å; N193-Q197 PolarHBondContact O-N 2.91Å |
| 194 | T | 92.8 | Very high | 92.6 | Very high | 67 Ų | 67 | 95.9 Ų | 95.9 | 41% | 0.411 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64 | -45.3 | 174 | 56.4 | 0 | 0 | 0 | 0 | 111 | N190 S191 R196 Q197 D198 | N190-T194 PolarHBondContact O-N 2.87Å; S191-T194 WeakPolarHBondContact CA-OG1 3.46Å; S191-T194 PolarHBondContact O-N 3.49Å; S191-T194 PolarHBondContact O-OG1 3.44Å; T194-R196 VanDerWaalsContact C-N 3.28Å; T194-R196 PolarHBondContact O-N 2.98Å; T194-Q197 WeakPolarHBondContact O-CB 3.25Å; T194-Q197 PolarHBondContact O-N 2.7Å; T194-Q197 VanDerWaalsContact O-N 3.08Å; T194-D198 VanDerWaalsContact O-CG 3.28Å; T194-D198 PolarHBondContact O-N 3.35Å |
| 195 | F | 93.6 | Very high | 93 | Very high | 130 Ų | 130 | 93.6 Ų | 93.6 | 57% | 0.57 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -62.5 | -33.9 | 176.6 | -68.3 | -41.8 | 0 | 0 | 0 | 113.2 | S191 L192 D198 V199 | S191-F195 WeakPolarHBondContact O-CD2 3.36Å; S191-F195 WeakPolarHBondContact O-CG 3.24Å; S191-F195 PolarHBondContact O-N 3.49Å; L192-F195 PolarHBondContact O-N 3.34Å; F195-D198 PolarHBondContact O-N 3.17Å; F195-V199 WeakPolarHBondContact O-CB 3.45Å; F195-V199 VanDerWaalsContact O-CG2 3.24Å; F195-V199 WeakPolarHBondContact O-CG2 3.47Å; F195-V199 PolarHBondContact O-N 3.32Å |
| 196 | R | 92.6 | Very high | 93.4 | Very high | 152 Ų | 152 | 92.3 Ų | 92.3 | 57% | 0.574 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -63.5 | -44.8 | 172.4 | -78 | 176.7 | 171.7 | 177.1 | -2.4 | 111.7 | L192 N193 T194 D198 V199 D200 | L192-R196 WeakPolarHBondContact O-CG 3.46Å; L192-R196 PolarHBondContact O-N 3.4Å; N193-R196 PolarHBondContact O-N 3.3Å; T194-R196 VanDerWaalsContact C-N 3.28Å; T194-R196 PolarHBondContact O-N 2.98Å; R196-D198 VanDerWaalsContact C-N 3.35Å; R196-V199 PolarHBondContact O-N 2.86Å; R196-D200 PolarHBondContact O-N 3.34Å |
| 197 | Q | 95.1 | Very high | 93.8 | Very high | 132 Ų | 132 | 90 Ų | 90 | 62% | 0.617 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -60.8 | -44.6 | 175.4 | -70.1 | 175.8 | 6.1 | 0 | 0 | 111.4 | N193 T194 V199 D200 E201 | N193-Q197 WeakPolarHBondContact O-CG 3.03Å; N193-Q197 PolarHBondContact O-N 2.91Å; T194-Q197 WeakPolarHBondContact O-CB 3.25Å; T194-Q197 PolarHBondContact O-N 2.7Å; T194-Q197 VanDerWaalsContact O-N 3.08Å; Q197-V199 VanDerWaalsContact C-N 3.32Å; Q197-V199 PolarHBondContact O-N 2.76Å; Q197-D200 PolarHBondContact O-N 3.45Å; Q197-E201 WeakPolarHBondContact O-CB 3.39Å; Q197-E201 PolarHBondContact O-N 3.29Å |
| 198 | D | 94.8 | Very high | 94.1 | Very high | 86 Ų | 86 | 90.6 Ų | 90.6 | 46% | 0.46 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -61.2 | -40.6 | 177.3 | -62.9 | -21.1 | 0 | 0 | 0 | 111.7 | T194 F195 R196 E201 A202 | T194-D198 VanDerWaalsContact O-CG 3.28Å; T194-D198 PolarHBondContact O-N 3.35Å; F195-D198 PolarHBondContact O-N 3.17Å; R196-D198 VanDerWaalsContact C-N 3.35Å; D198-E201 PolarHBondContact O-N 3.41Å; D198-A202 VanDerWaalsContact O-CB 3.25Å; D198-A202 WeakPolarHBondContact O-CB 3.43Å; D198-A202 PolarHBondContact O-N 3.39Å |
| 199 | V | 97.2 | Very high | 94.8 | Very high | 96 Ų | 96 | 92.9 Ų | 92.9 | 58% | 0.582 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -66.1 | -42.7 | 176.2 | 168.1 | 0 | 0 | 0 | 0 | 111.3 | F195 R196 Q197 A202 A203 | F195-V199 WeakPolarHBondContact O-CB 3.45Å; F195-V199 VanDerWaalsContact O-CG2 3.24Å; F195-V199 WeakPolarHBondContact O-CG2 3.47Å; F195-V199 PolarHBondContact O-N 3.32Å; R196-V199 PolarHBondContact O-N 2.86Å; Q197-V199 VanDerWaalsContact C-N 3.32Å; Q197-V199 PolarHBondContact O-N 2.76Å; V199-A202 PolarHBondContact O-N 2.96Å; V199-A203 WeakPolarHBondContact O-CB 3.42Å; V199-A203 PolarHBondContact O-N 3.49Å |
| 200 | D | 95.8 | Very high | 95.1 | Very high | 104 Ų | 104 | 93.3 Ų | 93.3 | 56% | 0.556 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -64.5 | -41.9 | 177.3 | -71.8 | -21.9 | 0 | 0 | 0 | 111 | R196 Q197 A203 L204 | R196-D200 PolarHBondContact O-N 3.34Å; Q197-D200 PolarHBondContact O-N 3.45Å; D200-A203 PolarHBondContact O-N 2.96Å; D200-L204 WeakPolarHBondContact O-CG 3.5Å; D200-L204 PolarHBondContact O-N 3.36Å |
| 201 | E | 96.8 | Very high | 95.5 | Very high | 136 Ų | 136 | 97.5 Ų | 97.5 | 64% | 0.636 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -64.7 | -43.7 | 174.9 | -175.3 | 171.1 | -166.9 | 0 | 0 | 111.8 | Q197 D198 A203 L204 S205 | Q197-E201 WeakPolarHBondContact O-CB 3.39Å; Q197-E201 PolarHBondContact O-N 3.29Å; D198-E201 PolarHBondContact O-N 3.41Å; E201-A203 VanDerWaalsContact C-N 3.32Å; E201-A203 PolarHBondContact O-N 2.89Å; E201-L204 PolarHBondContact O-N 2.88Å; E201-S205 PolarHBondContact O-N 3.44Å; E201-S205 PolarHBondContact O-OG 3.34Å |
| 202 | A | 95.3 | Very high | 95.7 | Very high | 54 Ų | 54 | 101.3 Ų | 101.3 | 45% | 0.446 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.7 | -39.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | D198 V199 S205 R206 | D198-A202 VanDerWaalsContact O-CB 3.25Å; D198-A202 WeakPolarHBondContact O-CB 3.43Å; D198-A202 PolarHBondContact O-N 3.39Å; V199-A202 PolarHBondContact O-N 2.96Å; A202-S205 WeakPolarHBondContact CA-OG 3.43Å; A202-S205 PolarHBondContact O-N 2.98Å; A202-S205 PolarHBondContact O-OG 2.87Å; A202-R206 WeakPolarHBondContact O-CB 3.31Å; A202-R206 PolarHBondContact O-N 3.48Å |
| 203 | A | 97.1 | Very high | 96.1 | Very high | 36 Ų | 36 | 101.4 Ų | 101.4 | 30% | 0.298 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.7 | -42.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | V199 D200 E201 R206 V207 | V199-A203 WeakPolarHBondContact O-CB 3.42Å; V199-A203 PolarHBondContact O-N 3.49Å; D200-A203 PolarHBondContact O-N 2.96Å; E201-A203 VanDerWaalsContact C-N 3.32Å; E201-A203 PolarHBondContact O-N 2.89Å; A203-R206 WeakPolarHBondContact O-CB 3.5Å; A203-R206 PolarHBondContact O-N 3.24Å; A203-V207 WeakPolarHBondContact O-CG2 3.4Å; A203-V207 PolarHBondContact O-N 3.25Å |
| 204 | L | 97 | Very high | 96.4 | Very high | 112 Ų | 112 | 103.3 Ų | 103.3 | 59% | 0.586 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -62.3 | -46.4 | 175.4 | -74.2 | 173.2 | 0 | 0 | 0 | 111.8 | D200 E201 R206 V207 Q208 | D200-L204 WeakPolarHBondContact O-CG 3.5Å; D200-L204 PolarHBondContact O-N 3.36Å; E201-L204 PolarHBondContact O-N 2.88Å; L204-R206 VanDerWaalsContact C-N 3.32Å; L204-R206 PolarHBondContact O-N 2.82Å; L204-V207 PolarHBondContact O-N 3.47Å; L204-Q208 VanDerWaalsContact O-CG 3.31Å; L204-Q208 WeakPolarHBondContact O-CG 3.49Å; L204-Q208 PolarHBondContact O-N 3.11Å |
| 205 | S | 97.3 | Very high | 96.7 | Very high | 54 Ų | 54 | 102.9 Ų | 102.9 | 38% | 0.378 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63 | -38.9 | 176.9 | 66.7 | 0 | 0 | 0 | 0 | 111.9 | E201 A202 Q208 L209 | E201-S205 PolarHBondContact O-N 3.44Å; E201-S205 PolarHBondContact O-OG 3.34Å; A202-S205 WeakPolarHBondContact CA-OG 3.43Å; A202-S205 PolarHBondContact O-N 2.98Å; A202-S205 PolarHBondContact O-OG 2.87Å; S205-Q208 PolarHBondContact O-N 2.95Å; S205-L209 WeakPolarHBondContact O-CG 3.43Å; S205-L209 PolarHBondContact O-N 2.87Å |
| 206 | R | 98.1 | Very high | 96.9 | Very high | 142 Ų | 142 | 101.4 Ų | 101.4 | 54% | 0.536 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -58.6 | -50.1 | 173.3 | -163.3 | -168.3 | 87.6 | -137 | -1.4 | 111.4 | A202 A203 L204 Q208 L209 E210 | A202-R206 WeakPolarHBondContact O-CB 3.31Å; A202-R206 PolarHBondContact O-N 3.48Å; A203-R206 WeakPolarHBondContact O-CB 3.5Å; A203-R206 PolarHBondContact O-N 3.24Å; L204-R206 VanDerWaalsContact C-N 3.32Å; L204-R206 PolarHBondContact O-N 2.82Å; R206-Q208 VanDerWaalsContact C-N 3.31Å; R206-Q208 PolarHBondContact O-N 2.94Å; R206-L209 PolarHBondContact O-N 3.39Å; R206-L209 VanDerWaalsContact O-N 3.16Å; R206-E210 IonicContact CZ-OE1 2.87Å; R206-E210 IonicContact NE-OE1 3.86Å; R206-E210 PolarHBondContact NE-OE1 3.1Å; R206-E210 IonicContact NE-OE2 3.92Å; R206-E210 IonicContact NH2-OE1 3.26Å; R206-E210 IonicContact NH2-OE2 2.67Å; R206-E210 WeakPolarHBondContact O-CG 3.34Å; R206-E210 PolarHBondContact O-N 3.23Å |
| 207 | V | 97.8 | Very high | 97.1 | Very high | 48 Ų | 48 | 99 Ų | 99 | 29% | 0.291 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.3 | -38.4 | 178.7 | 171.3 | 0 | 0 | 0 | 0 | 111.6 | A203 L204 E210 R211 | A203-V207 WeakPolarHBondContact O-CG2 3.4Å; A203-V207 PolarHBondContact O-N 3.25Å; L204-V207 PolarHBondContact O-N 3.47Å; V207-E210 PolarHBondContact O-N 2.93Å; V207-R211 WeakPolarHBondContact O-CG 3.42Å; V207-R211 PolarHBondContact O-N 3.47Å |
| 208 | Q | 97.6 | Very high | 97.3 | Very high | 129 Ų | 129 | 97.9 Ų | 97.9 | 60% | 0.603 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.7 | -41.1 | 175 | -72.6 | 174 | 3.9 | 0 | 0 | 112.1 | L204 S205 R206 K212 | L204-Q208 VanDerWaalsContact O-CG 3.31Å; L204-Q208 WeakPolarHBondContact O-CG 3.49Å; L204-Q208 PolarHBondContact O-N 3.11Å; S205-Q208 PolarHBondContact O-N 2.95Å; R206-Q208 VanDerWaalsContact C-N 3.31Å; R206-Q208 PolarHBondContact O-N 2.94Å; Q208-K212 PolarHBondContact O-N 2.86Å |
| 209 | L | 97.4 | Very high | 97.4 | Very high | 107 Ų | 107 | 98.3 Ų | 98.3 | 56% | 0.56 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -68.4 | -41.7 | 175.7 | -71 | 172.4 | 0 | 0 | 0 | 111.9 | S205 R206 R211 K212 I213 | S205-L209 WeakPolarHBondContact O-CG 3.43Å; S205-L209 PolarHBondContact O-N 2.87Å; R206-L209 PolarHBondContact O-N 3.39Å; R206-L209 VanDerWaalsContact O-N 3.16Å; L209-R211 PolarHBondContact O-N 2.72Å; L209-K212 WeakPolarHBondContact O-CB 3.4Å; L209-K212 PolarHBondContact O-N 2.99Å; L209-K212 VanDerWaalsContact O-N 3.13Å; L209-I213 WeakPolarHBondContact O-CG1 3.41Å; L209-I213 PolarHBondContact O-N 3.31Å |
| 210 | E | 97.7 | Very high | 97.4 | Very high | 76 Ų | 76 | 97.9 Ų | 97.9 | 36% | 0.355 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -56.1 | -49.1 | 173.7 | -74.9 | 167.9 | 177.4 | 0 | 0 | 110.6 | R206 V207 K212 I213 E214 | R206-E210 IonicContact CZ-OE1 2.87Å; R206-E210 IonicContact NE-OE1 3.86Å; R206-E210 PolarHBondContact NE-OE1 3.1Å; R206-E210 IonicContact NE-OE2 3.92Å; R206-E210 IonicContact NH2-OE1 3.26Å; R206-E210 IonicContact NH2-OE2 2.67Å; R206-E210 WeakPolarHBondContact O-CG 3.34Å; R206-E210 PolarHBondContact O-N 3.23Å; V207-E210 PolarHBondContact O-N 2.93Å; E210-K212 VanDerWaalsContact C-N 3.29Å; E210-K212 PolarHBondContact O-N 3.4Å; E210-I213 WeakPolarHBondContact O-CB 3.49Å; E210-I213 PolarHBondContact O-N 3.25Å; E210-I213 VanDerWaalsContact O-N 3.13Å; E210-E214 WeakPolarHBondContact O-CG 3.45Å; E210-E214 PolarHBondContact O-N 2.95Å |
| 211 | R | 97.6 | Very high | 97.5 | Very high | 167 Ų | 167 | 96.7 Ų | 96.7 | 63% | 0.63 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -60 | -37.2 | 175 | -72.8 | 176.3 | -177.2 | 175.5 | 2.3 | 113.2 | V207 L209 A215 | V207-R211 WeakPolarHBondContact O-CG 3.42Å; V207-R211 PolarHBondContact O-N 3.47Å; L209-R211 PolarHBondContact O-N 2.72Å; R211-A215 WeakPolarHBondContact O-CB 3.09Å; R211-A215 PolarHBondContact O-N 2.92Å |
| 212 | K | 98 | Very high | 97.6 | Very high | 136 Ų | 136 | 95.9 Ų | 95.9 | 59% | 0.591 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -69.1 | -37.8 | 177.1 | -171.1 | 173.8 | -177.8 | 177.4 | 0 | 111.3 | Q208 L209 E210 L216 | Q208-K212 PolarHBondContact O-N 2.86Å; L209-K212 WeakPolarHBondContact O-CB 3.4Å; L209-K212 PolarHBondContact O-N 2.99Å; L209-K212 VanDerWaalsContact O-N 3.13Å; E210-K212 VanDerWaalsContact C-N 3.29Å; E210-K212 PolarHBondContact O-N 3.4Å; K212-L216 HydrophobicContact CG-CD1 4.34Å; K212-L216 WeakPolarHBondContact O-CB 3.45Å; K212-L216 VanDerWaalsContact O-CG 3.25Å; K212-L216 WeakPolarHBondContact O-CG 3.4Å; K212-L216 PolarHBondContact O-N 3.28Å |
| 213 | I | 98.2 | Very high | 97.7 | Very high | 91 Ų | 91 | 97.3 Ų | 97.3 | 47% | 0.467 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.6 | -48.3 | 174.1 | -71.3 | 166.6 | 0 | 0 | 0 | 110 | L209 E210 A215 L216 Q217 | L209-I213 WeakPolarHBondContact O-CG1 3.41Å; L209-I213 PolarHBondContact O-N 3.31Å; E210-I213 WeakPolarHBondContact O-CB 3.49Å; E210-I213 PolarHBondContact O-N 3.25Å; E210-I213 VanDerWaalsContact O-N 3.13Å; I213-A215 PolarHBondContact O-N 3.4Å; I213-L216 PolarHBondContact O-N 2.93Å; I213-Q217 WeakPolarHBondContact O-CB 3.39Å; I213-Q217 WeakPolarHBondContact O-CG 3.29Å; I213-Q217 PolarHBondContact O-N 2.96Å; I213-Q217 PolarHBondContact O-OE1 2.85Å |
| 214 | E | 97.8 | Very high | 97.7 | Very high | 114 Ų | 114 | 101.3 Ų | 101.3 | 53% | 0.533 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -57.4 | -49.3 | 176 | -72 | 172.3 | 178.2 | 0 | 0 | 111.1 | E210 L216 Q217 D218 | E210-E214 WeakPolarHBondContact O-CG 3.45Å; E210-E214 PolarHBondContact O-N 2.95Å; E214-L216 VanDerWaalsContact C-N 3.33Å; E214-L216 PolarHBondContact O-N 3.11Å; E214-Q217 WeakPolarHBondContact O-CB 3.47Å; E214-Q217 PolarHBondContact O-N 3.48Å; E214-Q217 VanDerWaalsContact O-N 3.1Å; E214-D218 PolarHBondContact O-N 3.45Å |
| 215 | A | 97.8 | Very high | 97.7 | Very high | 59 Ų | 59 | 102.3 Ų | 102.3 | 49% | 0.488 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.2 | -40.1 | 178 | 0 | 0 | 0 | 0 | 0 | 113 | R211 I213 E219 | R211-A215 WeakPolarHBondContact O-CB 3.09Å; R211-A215 PolarHBondContact O-N 2.92Å; I213-A215 PolarHBondContact O-N 3.4Å; A215-E219 PolarHBondContact O-N 2.95Å |
| 216 | L | 97.6 | Very high | 97.7 | Very high | 99 Ų | 99 | 102.1 Ų | 102.1 | 52% | 0.518 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -69.9 | -34 | 175.6 | -72.5 | 172 | 0 | 0 | 0 | 112.2 | K212 I213 E214 E219 I220 | K212-L216 HydrophobicContact CG-CD1 4.34Å; K212-L216 WeakPolarHBondContact O-CB 3.45Å; K212-L216 VanDerWaalsContact O-CG 3.25Å; K212-L216 WeakPolarHBondContact O-CG 3.4Å; K212-L216 PolarHBondContact O-N 3.28Å; I213-L216 PolarHBondContact O-N 2.93Å; E214-L216 VanDerWaalsContact C-N 3.33Å; E214-L216 PolarHBondContact O-N 3.11Å; L216-E219 PolarHBondContact O-N 2.87Å; L216-I220 VanDerWaalsContact O-CG1 3.26Å; L216-I220 WeakPolarHBondContact O-CG1 3.4Å; L216-I220 PolarHBondContact O-N 3.23Å |
| 217 | Q | 98.1 | Very high | 97.6 | Very high | 101 Ų | 101 | 100.8 Ų | 100.8 | 47% | 0.472 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -68.9 | -40.9 | 174.9 | -79.7 | 160 | -25.3 | 0 | 0 | 111.5 | I213 E214 E219 I220 N221 | I213-Q217 WeakPolarHBondContact O-CB 3.39Å; I213-Q217 WeakPolarHBondContact O-CG 3.29Å; I213-Q217 PolarHBondContact O-N 2.96Å; I213-Q217 PolarHBondContact O-OE1 2.85Å; E214-Q217 WeakPolarHBondContact O-CB 3.47Å; E214-Q217 PolarHBondContact O-N 3.48Å; E214-Q217 VanDerWaalsContact O-N 3.1Å; Q217-E219 VanDerWaalsContact C-N 3.32Å; Q217-I220 PolarHBondContact O-N 2.99Å; Q217-N221 WeakPolarHBondContact O-CB 3.5Å; Q217-N221 PolarHBondContact O-N 3.26Å; Q217-N221 PolarHBondContact O-ND2 2.91Å; Q217-N221 VanDerWaalsContact O-ND2 3.13Å |
| 218 | D | 97.7 | Very high | 97.5 | Very high | 108 Ų | 108 | 104 Ų | 104 | 58% | 0.578 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -60.4 | -43.1 | 172.8 | -74.4 | -18.4 | 0 | 0 | 0 | 111.2 | E214 N221 F222 | E214-D218 PolarHBondContact O-N 3.45Å; D218-N221 PolarHBondContact O-N 3.17Å; D218-F222 VanDerWaalsContact O-CB 3.31Å; D218-F222 WeakPolarHBondContact O-CB 3.38Å; D218-F222 PolarHBondContact O-N 3.14Å |
| 219 | E | 97.7 | Very high | 97.4 | Very high | 95 Ų | 95 | 102.7 Ų | 102.7 | 44% | 0.444 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62 | -45.5 | 174.7 | -174.7 | 61.7 | -156 | 0 | 0 | 112.1 | A215 L216 Q217 N221 F222 L223 | A215-E219 PolarHBondContact O-N 2.95Å; L216-E219 PolarHBondContact O-N 2.87Å; Q217-E219 VanDerWaalsContact C-N 3.32Å; E219-N221 VanDerWaalsContact C-N 3.31Å; E219-N221 PolarHBondContact O-N 3.23Å; E219-F222 WeakPolarHBondContact O-CB 3.31Å; E219-F222 PolarHBondContact O-N 2.86Å; E219-L223 HydrophobicContact CG-CD1 4.27Å; E219-L223 WeakPolarHBondContact O-CG 3.48Å; E219-L223 PolarHBondContact O-N 2.87Å |
| 220 | I | 97.3 | Very high | 97.2 | Very high | 88 Ų | 88 | 101.9 Ų | 101.9 | 45% | 0.451 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -60.2 | -43.7 | 175.7 | -72.1 | 165.2 | 0 | 0 | 0 | 110.7 | L216 Q217 F222 L223 K224 | L216-I220 VanDerWaalsContact O-CG1 3.26Å; L216-I220 WeakPolarHBondContact O-CG1 3.4Å; L216-I220 PolarHBondContact O-N 3.23Å; Q217-I220 PolarHBondContact O-N 2.99Å; I220-F222 VanDerWaalsContact C-N 3.33Å; I220-L223 PolarHBondContact O-N 3.08Å; I220-K224 HydrophobicContact CG2-CD 4.15Å; I220-K224 HydrophobicContact CG2-CG 4.5Å; I220-K224 WeakPolarHBondContact O-CB 3.23Å; I220-K224 VanDerWaalsContact O-CG 3.29Å; I220-K224 WeakPolarHBondContact O-CG 3.47Å; I220-K224 PolarHBondContact O-N 3Å |
| 221 | N | 97.8 | Very high | 96.9 | Very high | 78 Ų | 78 | 103.3 Ų | 103.3 | 42% | 0.417 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -66.6 | -37.9 | 179.6 | -70 | -27.4 | 0 | 0 | 0 | 111.4 | Q217 D218 E219 K225 | Q217-N221 WeakPolarHBondContact O-CB 3.5Å; Q217-N221 PolarHBondContact O-N 3.26Å; Q217-N221 PolarHBondContact O-ND2 2.91Å; Q217-N221 VanDerWaalsContact O-ND2 3.13Å; D218-N221 PolarHBondContact O-N 3.17Å; E219-N221 VanDerWaalsContact C-N 3.31Å; E219-N221 PolarHBondContact O-N 3.23Å; N221-K225 WeakPolarHBondContact O-CG 3.43Å; N221-K225 PolarHBondContact O-N 3.42Å |
| 222 | F | 97.9 | Very high | 96.8 | Very high | 119 Ų | 119 | 102 Ų | 102 | 52% | 0.522 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.6 | -50.9 | 174.5 | 177.6 | -108.5 | 0 | 0 | 0 | 111.5 | D218 E219 I220 K224 K225 I226 | D218-F222 VanDerWaalsContact O-CB 3.31Å; D218-F222 WeakPolarHBondContact O-CB 3.38Å; D218-F222 PolarHBondContact O-N 3.14Å; E219-F222 WeakPolarHBondContact O-CB 3.31Å; E219-F222 PolarHBondContact O-N 2.86Å; I220-F222 VanDerWaalsContact C-N 3.33Å; F222-K224 VanDerWaalsContact C-N 3.32Å; F222-K224 PolarHBondContact O-N 3.25Å; F222-K225 PolarHBondContact O-N 3.47Å; F222-I226 HydrophobicContact CD1-CD1 3.81Å; F222-I226 HydrophobicContact CD2-CD1 4.37Å; F222-I226 HydrophobicContact CE1-CD1 3.28Å; F222-I226 HydrophobicContact CE1-CG1 4.48Å; F222-I226 HydrophobicContact CE2-CD1 3.9Å; F222-I226 HydrophobicContact CE2-CG1 4.44Å; F222-I226 HydrophobicContact CG-CD1 4.34Å; F222-I226 HydrophobicContact CZ-CD1 3.35Å; F222-I226 HydrophobicContact CZ-CG1 4.33Å; F222-I226 PolarHBondContact O-N 2.92Å |
| 223 | L | 97.6 | Very high | 96.5 | Very high | 85 Ų | 85 | 101 Ų | 101 | 45% | 0.445 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -60.9 | -39.8 | 177 | -69.9 | 172.4 | 0 | 0 | 0 | 112.4 | E219 I220 I226 H227 | E219-L223 HydrophobicContact CG-CD1 4.27Å; E219-L223 WeakPolarHBondContact O-CG 3.48Å; E219-L223 PolarHBondContact O-N 2.87Å; I220-L223 PolarHBondContact O-N 3.08Å; L223-I226 PolarHBondContact O-N 3.38Å; L223-H227 PolarHBondContact O-N 3.49Å |
| 224 | K | 97.3 | Very high | 96 | Very high | 119 Ų | 119 | 101.4 Ų | 101.4 | 52% | 0.517 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.4 | -45.5 | 174.3 | -78.3 | 177.7 | 179.6 | 179.8 | 0 | 112.2 | I220 F222 H227 E228 | I220-K224 HydrophobicContact CG2-CD 4.15Å; I220-K224 HydrophobicContact CG2-CG 4.5Å; I220-K224 WeakPolarHBondContact O-CB 3.23Å; I220-K224 VanDerWaalsContact O-CG 3.29Å; I220-K224 WeakPolarHBondContact O-CG 3.47Å; I220-K224 PolarHBondContact O-N 3Å; F222-K224 VanDerWaalsContact C-N 3.32Å; F222-K224 PolarHBondContact O-N 3.25Å; K224-H227 PolarHBondContact O-N 3.15Å; K224-E228 WeakPolarHBondContact O-CB 3.48Å; K224-E228 WeakPolarHBondContact O-CG 3.35Å; K224-E228 PolarHBondContact O-N 2.83Å |
| 225 | K | 97.5 | Very high | 95.4 | Very high | 134 Ų | 134 | 102.3 Ų | 102.3 | 58% | 0.583 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -60.8 | -45.1 | 177 | -76.6 | 176.8 | 179.8 | -179.8 | 0 | 111.4 | N221 F222 H227 E228 E229 | N221-K225 WeakPolarHBondContact O-CG 3.43Å; N221-K225 PolarHBondContact O-N 3.42Å; F222-K225 PolarHBondContact O-N 3.47Å; K225-H227 PolarHBondContact O-N 3.02Å; K225-E228 PolarHBondContact O-N 3.33Å; K225-E229 WeakPolarHBondContact O-CB 3.44Å; K225-E229 WeakPolarHBondContact O-CG 3.45Å; K225-E229 PolarHBondContact O-N 2.94Å |
| 226 | I | 97.1 | Very high | 94.9 | Very high | 49 Ų | 49 | 104.1 Ų | 104.1 | 25% | 0.251 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -59.2 | -49.2 | 175.9 | -71 | 172.9 | 0 | 0 | 0 | 110.6 | F222 L223 E228 E229 E230 | F222-I226 HydrophobicContact CD1-CD1 3.81Å; F222-I226 HydrophobicContact CD2-CD1 4.37Å; F222-I226 HydrophobicContact CE1-CD1 3.28Å; F222-I226 HydrophobicContact CE1-CG1 4.48Å; F222-I226 HydrophobicContact CE2-CD1 3.9Å; F222-I226 HydrophobicContact CE2-CG1 4.44Å; F222-I226 HydrophobicContact CG-CD1 4.34Å; F222-I226 HydrophobicContact CZ-CD1 3.35Å; F222-I226 HydrophobicContact CZ-CG1 4.33Å; F222-I226 PolarHBondContact O-N 2.92Å; L223-I226 PolarHBondContact O-N 3.38Å; I226-E228 VanDerWaalsContact C-N 3.33Å; I226-E228 PolarHBondContact O-N 2.93Å; I226-E229 WeakPolarHBondContact O-CB 3.35Å; I226-E229 PolarHBondContact O-N 3.41Å; I226-E229 VanDerWaalsContact O-N 3.14Å; I226-E230 HydrophobicContact CG2-CG 4.17Å; I226-E230 WeakPolarHBondContact O-CG 3.26Å; I226-E230 PolarHBondContact O-N 2.87Å |
| 227 | H | 95.4 | Very high | 94.1 | Very high | 115 Ų | 115 | 104.4 Ų | 104.4 | 53% | 0.532 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.2 | -37.5 | 178.2 | -82.8 | 5 | 0 | 0 | 0 | 112.9 | L223 K224 K225 E229 E230 L231 | L223-H227 PolarHBondContact O-N 3.49Å; K224-H227 PolarHBondContact O-N 3.15Å; K225-H227 PolarHBondContact O-N 3.02Å; H227-E229 VanDerWaalsContact C-N 3.32Å; H227-E230 IonicContact CE1-OE2 2.86Å; H227-E230 IonicContact CG-OE2 3.49Å; H227-E230 IonicContact ND1-OE2 3.47Å; H227-E230 PolarHBondContact ND1-OE2 3.28Å; H227-L231 VanDerWaalsContact O-CB 3.28Å; H227-L231 WeakPolarHBondContact O-CB 3.38Å; H227-L231 WeakPolarHBondContact O-CG 3.33Å; H227-L231 PolarHBondContact O-N 3.45Å |
| 228 | E | 96.3 | Very high | 93 | Very high | 114 Ų | 114 | 104.7 Ų | 104.7 | 53% | 0.533 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.7 | -38.3 | 173.7 | -76.5 | 176.3 | -167.5 | 0 | 0 | 112.1 | K224 K225 I226 R232 | K224-E228 WeakPolarHBondContact O-CB 3.48Å; K224-E228 WeakPolarHBondContact O-CG 3.35Å; K224-E228 PolarHBondContact O-N 2.83Å; K225-E228 PolarHBondContact O-N 3.33Å; I226-E228 VanDerWaalsContact C-N 3.33Å; I226-E228 PolarHBondContact O-N 2.93Å; E228-R232 WeakPolarHBondContact O-CB 3.39Å; E228-R232 PolarHBondContact O-N 3.42Å |
| 229 | E | 95.1 | Very high | 92 | Very high | 103 Ų | 103 | 103.3 Ų | 103.3 | 48% | 0.481 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -67.3 | -48 | 174.4 | -73.3 | 169.6 | -174.1 | 0 | 0 | 111.4 | K225 I226 H227 L231 R232 E233 | K225-E229 WeakPolarHBondContact O-CB 3.44Å; K225-E229 WeakPolarHBondContact O-CG 3.45Å; K225-E229 PolarHBondContact O-N 2.94Å; I226-E229 WeakPolarHBondContact O-CB 3.35Å; I226-E229 PolarHBondContact O-N 3.41Å; I226-E229 VanDerWaalsContact O-N 3.14Å; H227-E229 VanDerWaalsContact C-N 3.32Å; E229-L231 VanDerWaalsContact C-N 3.34Å; E229-L231 PolarHBondContact O-N 2.93Å; E229-R232 CarbonylContact O-C 3.37Å; E229-R232 WeakPolarHBondContact O-CB 3.39Å; E229-R232 PolarHBondContact O-N 3.29Å; E229-R232 VanDerWaalsContact O-N 3.11Å; E229-E233 WeakPolarHBondContact O-CG 3.44Å; E229-E233 PolarHBondContact O-N 2.9Å |
| 230 | E | 93.4 | Very high | 90.5 | Very high | 90 Ų | 90 | 102.1 Ų | 102.1 | 42% | 0.421 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59.5 | -42.4 | 175.6 | -71.1 | 172.7 | 153 | 0 | 0 | 111.7 | I226 H227 R232 E233 L234 | I226-E230 HydrophobicContact CG2-CG 4.17Å; I226-E230 WeakPolarHBondContact O-CG 3.26Å; I226-E230 PolarHBondContact O-N 2.87Å; H227-E230 IonicContact CE1-OE2 2.86Å; H227-E230 IonicContact CG-OE2 3.49Å; H227-E230 IonicContact ND1-OE2 3.47Å; H227-E230 PolarHBondContact ND1-OE2 3.28Å; E230-R232 VanDerWaalsContact C-N 3.33Å; E230-E233 PolarHBondContact O-N 3.16Å; E230-L234 WeakPolarHBondContact O-CB 3.43Å; E230-L234 VanDerWaalsContact O-CG 3.24Å; E230-L234 WeakPolarHBondContact O-CG 3.36Å; E230-L234 PolarHBondContact O-N 3.49Å |
| 231 | L | 92.8 | Very high | 88.6 | Confident | 106 Ų | 106 | 105.9 Ų | 105.9 | 56% | 0.555 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -64.8 | -38.3 | 175.4 | -75.5 | 172.4 | 0 | 0 | 0 | 111.9 | H227 E229 L234 Q235 | H227-L231 VanDerWaalsContact O-CB 3.28Å; H227-L231 WeakPolarHBondContact O-CB 3.38Å; H227-L231 WeakPolarHBondContact O-CG 3.33Å; H227-L231 PolarHBondContact O-N 3.45Å; E229-L231 VanDerWaalsContact C-N 3.34Å; E229-L231 PolarHBondContact O-N 2.93Å; L231-L234 PolarHBondContact O-N 3.11Å; L231-Q235 WeakPolarHBondContact O-CB 3.25Å; L231-Q235 WeakPolarHBondContact O-CG 3.36Å; L231-Q235 PolarHBondContact O-N 3.31Å |
| 232 | R | 94.2 | Very high | 86.1 | Confident | 139 Ų | 139 | 109.3 Ų | 109.3 | 53% | 0.525 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -66.3 | -45.6 | 175.4 | -170.1 | 178.9 | -62.8 | 130.8 | 6 | 110.7 | E228 E229 E230 L234 Q235 D236 | E228-R232 WeakPolarHBondContact O-CB 3.39Å; E228-R232 PolarHBondContact O-N 3.42Å; E229-R232 CarbonylContact O-C 3.37Å; E229-R232 WeakPolarHBondContact O-CB 3.39Å; E229-R232 PolarHBondContact O-N 3.29Å; E229-R232 VanDerWaalsContact O-N 3.11Å; E230-R232 VanDerWaalsContact C-N 3.33Å; R232-L234 VanDerWaalsContact C-N 3.34Å; R232-L234 PolarHBondContact O-N 3.03Å; R232-Q235 WeakPolarHBondContact O-CB 3.39Å; R232-Q235 PolarHBondContact O-N 2.95Å; R232-D236 WeakPolarHBondContact O-CB 3.38Å; R232-D236 VanDerWaalsContact O-CG 3.24Å; R232-D236 PolarHBondContact O-N 3.42Å |
| 233 | E | 91.5 | Very high | 83.7 | Confident | 116 Ų | 116 | 108.2 Ų | 108.2 | 54% | 0.542 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -61.2 | -40.9 | 174.7 | -73.2 | -177.2 | -178.8 | 0 | 0 | 112.1 | E229 E230 D236 Q237 | E229-E233 WeakPolarHBondContact O-CG 3.44Å; E229-E233 PolarHBondContact O-N 2.9Å; E230-E233 PolarHBondContact O-N 3.16Å; E233-D236 PolarHBondContact O-N 3.49Å; E233-Q237 WeakPolarHBondContact O-CB 3.47Å; E233-Q237 WeakPolarHBondContact O-CG 3.41Å; E233-Q237 PolarHBondContact O-N 2.94Å |
| 234 | L | 87.4 | Confident | 81 | Confident | 99 Ų | 99 | 112.3 Ų | 112.3 | 52% | 0.518 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -67.8 | -38.4 | 175.5 | -73.6 | 172.2 | 0 | 0 | 0 | 112.1 | E230 L231 R232 Q237 L238 | E230-L234 WeakPolarHBondContact O-CB 3.43Å; E230-L234 VanDerWaalsContact O-CG 3.24Å; E230-L234 WeakPolarHBondContact O-CG 3.36Å; E230-L234 PolarHBondContact O-N 3.49Å; L231-L234 PolarHBondContact O-N 3.11Å; R232-L234 VanDerWaalsContact C-N 3.34Å; R232-L234 PolarHBondContact O-N 3.03Å; L234-Q237 PolarHBondContact O-N 2.88Å; L234-L238 VanDerWaalsContact O-CB 3.29Å; L234-L238 WeakPolarHBondContact O-CB 3.44Å; L234-L238 PolarHBondContact O-N 2.98Å |
| 235 | Q | 86.6 | Confident | 78.3 | Confident | 132 Ų | 132 | 112 Ų | 112 | 62% | 0.617 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -62.4 | -45 | 170.9 | -83.3 | 178.3 | 4 | 0 | 0 | 111 | L231 R232 Q237 L238 V239 | L231-Q235 WeakPolarHBondContact O-CB 3.25Å; L231-Q235 WeakPolarHBondContact O-CG 3.36Å; L231-Q235 PolarHBondContact O-N 3.31Å; R232-Q235 WeakPolarHBondContact O-CB 3.39Å; R232-Q235 PolarHBondContact O-N 2.95Å; Q235-Q237 VanDerWaalsContact C-N 3.33Å; Q235-Q237 PolarHBondContact O-N 3.4Å; Q235-L238 PolarHBondContact O-N 3.41Å; Q235-V239 WeakPolarHBondContact O-CB 3.47Å; Q235-V239 VanDerWaalsContact O-CG2 3.28Å; Q235-V239 WeakPolarHBondContact O-CG2 3.38Å; Q235-V239 PolarHBondContact O-N 3.45Å |
| 236 | D | 86.7 | Confident | 75.4 | Confident | 98 Ų | 98 | 112.8 Ų | 112.8 | 52% | 0.524 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -64 | -39 | 177.2 | -71.5 | -19.7 | 0 | 0 | 0 | 111.1 | R232 E233 A240 | R232-D236 WeakPolarHBondContact O-CB 3.38Å; R232-D236 VanDerWaalsContact O-CG 3.24Å; R232-D236 PolarHBondContact O-N 3.42Å; E233-D236 PolarHBondContact O-N 3.49Å; D236-A240 WeakPolarHBondContact O-CB 3.4Å; D236-A240 PolarHBondContact O-N 3.04Å |
| 237 | Q | 80.8 | Confident | 72.8 | Confident | 104 Ų | 104 | 118.2 Ų | 118.2 | 49% | 0.486 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -65.9 | -38 | 173 | -74.9 | 173.1 | 26.6 | 0 | 0 | 112 | E233 L234 Q235 A240 Q241 | E233-Q237 WeakPolarHBondContact O-CB 3.47Å; E233-Q237 WeakPolarHBondContact O-CG 3.41Å; E233-Q237 PolarHBondContact O-N 2.94Å; L234-Q237 PolarHBondContact O-N 2.88Å; Q235-Q237 VanDerWaalsContact C-N 3.33Å; Q235-Q237 PolarHBondContact O-N 3.4Å; Q237-A240 PolarHBondContact O-N 3.37Å; Q237-Q241 VanDerWaalsContact O-CB 3.32Å; Q237-Q241 WeakPolarHBondContact O-CB 3.34Å; Q237-Q241 VanDerWaalsContact O-CG 3.24Å; Q237-Q241 WeakPolarHBondContact O-CG 3.35Å; Q237-Q241 PolarHBondContact O-N 3.16Å |
| 238 | L | 74.9 | Confident | 70.1 | Confident | 107 Ų | 107 | 120.6 Ų | 120.6 | 56% | 0.56 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -71.2 | -40 | 177.8 | -163.7 | 145.5 | 0 | 0 | 0 | 111.2 | L234 Q235 Q241 Q242 | L234-L238 VanDerWaalsContact O-CB 3.29Å; L234-L238 WeakPolarHBondContact O-CB 3.44Å; L234-L238 PolarHBondContact O-N 2.98Å; Q235-L238 PolarHBondContact O-N 3.41Å; L238-Q241 PolarHBondContact O-N 2.91Å; L238-Q242 VanDerWaalsContact O-CB 3.24Å; L238-Q242 WeakPolarHBondContact O-CB 3.25Å; L238-Q242 PolarHBondContact O-N 3.04Å |
| 239 | V | 76.3 | Confident | 67.4 | Low | 80 Ų | 80 | 120.5 Ų | 120.5 | 49% | 0.485 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -66.8 | -41.3 | 172.1 | 172.6 | 0 | 0 | 0 | 0 | 110.7 | Q235 Q241 Q242 V243 | Q235-V239 WeakPolarHBondContact O-CB 3.47Å; Q235-V239 VanDerWaalsContact O-CG2 3.28Å; Q235-V239 WeakPolarHBondContact O-CG2 3.38Å; Q235-V239 PolarHBondContact O-N 3.45Å; V239-Q241 VanDerWaalsContact C-N 3.32Å; V239-Q241 PolarHBondContact O-N 3.32Å; V239-Q242 CarbonylContact O-C 3.49Å; V239-Q242 PolarHBondContact O-N 3.42Å; V239-Q242 VanDerWaalsContact O-N 3.1Å; V239-V243 HydrophobicContact CG1-CG2 4.41Å; V239-V243 WeakPolarHBondContact O-CB 3.38Å; V239-V243 WeakPolarHBondContact O-CG2 3.34Å; V239-V243 PolarHBondContact O-N 3.35Å |
| 240 | A | 67.3 | Low | 65.4 | Low | 69 Ų | 69 | 120.8 Ų | 120.8 | 57% | 0.57 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -66.1 | -33.3 | 175 | 0 | 0 | 0 | 0 | 0 | 112.3 | D236 Q237 | D236-A240 WeakPolarHBondContact O-CB 3.4Å; D236-A240 PolarHBondContact O-N 3.04Å; Q237-A240 PolarHBondContact O-N 3.37Å |
| 241 | Q | 55.8 | Low | 63.6 | Low | 168 Ų | 168 | 126.2 Ų | 126.2 | 79% | 0.785 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -73.6 | -27.3 | 170.4 | -76.6 | -179.9 | 2.5 | 0 | 0 | 112.7 | Q237 L238 V239 | Q237-Q241 VanDerWaalsContact O-CB 3.32Å; Q237-Q241 WeakPolarHBondContact O-CB 3.34Å; Q237-Q241 VanDerWaalsContact O-CG 3.24Å; Q237-Q241 WeakPolarHBondContact O-CG 3.35Å; Q237-Q241 PolarHBondContact O-N 3.16Å; L238-Q241 PolarHBondContact O-N 2.91Å; V239-Q241 VanDerWaalsContact C-N 3.32Å; V239-Q241 PolarHBondContact O-N 3.32Å |
| 242 | Q | 45.5 | Very low | 62.2 | Low | 149 Ų | 149 | 125.7 Ų | 125.7 | 70% | 0.696 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -88.5 | -8.3 | 178.7 | -158.8 | 164.4 | 17.8 | 0 | 0 | 113.6 | L238 V239 | L238-Q242 VanDerWaalsContact O-CB 3.24Å; L238-Q242 WeakPolarHBondContact O-CB 3.25Å; L238-Q242 PolarHBondContact O-N 3.04Å; V239-Q242 CarbonylContact O-C 3.49Å; V239-Q242 PolarHBondContact O-N 3.42Å; V239-Q242 VanDerWaalsContact O-N 3.1Å |
| 243 | V | 47.6 | Very low | 60.8 | Low | 97 Ų | 97 | 124.6 Ų | 124.6 | 59% | 0.588 | 66% | 0.664 | S | S | * | * | trans | -125.5 | 72.2 | 178.5 | -173.4 | 0 | 0 | 0 | 0 | 109.8 | V239 | V239-V243 HydrophobicContact CG1-CG2 4.41Å; V239-V243 WeakPolarHBondContact O-CB 3.38Å; V239-V243 WeakPolarHBondContact O-CG2 3.34Å; V239-V243 PolarHBondContact O-N 3.35Å | ||
| 244 | H | 42.5 | Very low | 59.6 | Low | 170 Ų | 170 | 124.3 Ų | 124.3 | 79% | 0.787 | 67% | 0.666 | S | S | * | * | trans | -102.6 | 83.9 | 146.4 | -176 | 71.6 | 0 | 0 | 0 | 107.7 | ||||
| 245 | V | 39 | Very low | 58.9 | Low | 114 Ų | 114 | 124 Ų | 124 | 69% | 0.691 | 67% | 0.668 | S | S | * | * | trans | -144.5 | 128.3 | 170 | 179.2 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 246 | D | 38.1 | Very low | 58.3 | Low | 149 Ų | 149 | 119.6 Ų | 119.6 | 80% | 0.797 | 65% | 0.654 | S | S | * | * | trans | -48.8 | 128.5 | -179.4 | -66.1 | -53.4 | 0 | 0 | 0 | 113.9 | ||||
| 247 | L | 42.2 | Very low | 57.9 | Low | 164 Ų | 164 | 117.2 Ų | 117.2 | 86% | 0.859 | 65% | 0.649 | S | S | * | * | trans | -96.3 | 98.1 | 169.9 | -77.2 | 164.7 | 0 | 0 | 0 | 109.4 | V249 | L247-V249 PolarHBondContact O-N 3.33Š| ||
| 248 | D | 38.8 | Very low | 58 | Low | 164 Ų | 164 | 117 Ų | 117 | 88% | 0.877 | 65% | 0.65 | S | S | * | * | trans | -77.9 | 104 | 166.3 | -163.4 | 10.1 | 0 | 0 | 0 | 109.1 | S250 | D248-S250 PolarHBondContact O-N 2.86Š| ||
| 249 | V | 39.1 | Very low | 58.6 | Low | 112 Ų | 112 | 119 Ų | 119 | 68% | 0.679 | 65% | 0.651 | S | S | * | * | trans | -80.6 | 104.1 | -175.2 | 177.1 | 0 | 0 | 0 | 0 | 109.3 | L247 K251 | L247-V249 PolarHBondContact O-N 3.33Å; V249-K251 PolarHBondContact O-N 3.45Å | ||
| 250 | S | 52.6 | Low | 59.1 | Low | 109 Ų | 109 | 120 Ų | 120 | 76% | 0.762 | 65% | 0.653 | S | S | * | * | trans | -72 | 123 | 165.4 | 49.8 | 0 | 0 | 0 | 0 | 109.8 | D248 P252 | D248-S250 PolarHBondContact O-N 2.86Å; S250-P252 WeakPolarHBondContact O-CD 3.35Å | ||
| 251 | K | 55.5 | Low | 60.1 | Low | 204 Ų | 204 | 121 Ų | 121 | 89% | 0.887 | 65% | 0.648 | S | S | * | * | trans | -58 | 112.6 | -174.2 | -70.6 | 176.4 | 177.5 | 173.8 | 0 | 113 | V249 | V249-K251 PolarHBondContact O-N 3.45Š| ||
| 252 | P | 64.5 | Low | 61.8 | Low | 95 Ų | 95 | 120.9 Ų | 120.9 | 62% | 0.617 | 64% | 0.64 | S | S | * | * | trans | -92.1 | 168.9 | 152.7 | 14 | 10.5 | 0 | 0 | 0 | 108.2 | S250 L254 | S250-P252 WeakPolarHBondContact O-CD 3.35Å; P252-L254 PolarHBondContact O-N 3.39Å | ||
| 253 | D | 64.1 | Low | 64 | Low | 116 Ų | 116 | 116.9 Ų | 116.9 | 62% | 0.62 | 63% | 0.626 | S | S | * | * | trans | -64.4 | 93.6 | -178.5 | -177.2 | 11.6 | 0 | 0 | 0 | 112.3 | T255 A256 A257 | D253-T255 PolarHBondContact O-N 2.88Å; D253-T255 VanDerWaalsContact O-N 3.15Å; D253-A256 PolarHBondContact O-N 3.16Å; D253-A257 PolarHBondContact O-N 2.83Å | ||
| 254 | L | 66.1 | Low | 66.1 | Low | 111 Ų | 111 | 118.6 Ų | 118.6 | 58% | 0.581 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -61.1 | -25.8 | -171.3 | -155.8 | 77.6 | 0 | 0 | 0 | 112.6 | P252 L258 | P252-L254 PolarHBondContact O-N 3.39Å; L254-L258 HydrophobicContact CD2-CD1 3.97Å; L254-L258 HydrophobicContact CG-CD1 3.79Å; L254-L258 HydrophobicContact CG-CG 4.21Å; L254-L258 WeakPolarHBondContact O-CB 3.43Å; L254-L258 WeakPolarHBondContact O-CD1 3.28Å; L254-L258 WeakPolarHBondContact O-CG 3.44Å; L254-L258 PolarHBondContact O-N 2.95Å |
| 255 | T | 73.5 | Confident | 68.5 | Low | 91 Ų | 91 | 117.8 Ų | 117.8 | 56% | 0.558 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -76.2 | -33.1 | -174.1 | -45.8 | 0 | 0 | 0 | 0 | 111.8 | D253 R259 | D253-T255 PolarHBondContact O-N 2.88Å; D253-T255 VanDerWaalsContact O-N 3.15Å; T255-R259 PolarHBondContact O-N 3.49Å; T255-R259 PolarHBondContact O-NE 2.91Å; T255-R259 PolarHBondContact O-NH2 3.27Å |
| 256 | A | 72.9 | Confident | 71.1 | Confident | 40 Ų | 40 | 116.7 Ų | 116.7 | 33% | 0.331 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -75.9 | -46.3 | 175 | 0 | 0 | 0 | 0 | 0 | 111.1 | D253 R259 D260 | D253-A256 PolarHBondContact O-N 3.16Å; A256-R259 PolarHBondContact O-N 2.91Å; A256-D260 WeakPolarHBondContact O-CB 3.49Å; A256-D260 PolarHBondContact O-N 3.28Å |
| 257 | A | 79.5 | Confident | 73.7 | Confident | 49 Ų | 49 | 114.2 Ų | 114.2 | 41% | 0.405 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -63.9 | -41.2 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | D253 R259 D260 I261 | D253-A257 PolarHBondContact O-N 2.83Å; A257-R259 PolarHBondContact O-N 3.29Å; A257-D260 PolarHBondContact O-N 3.43Å; A257-I261 WeakPolarHBondContact O-CB 3.42Å; A257-I261 WeakPolarHBondContact O-CD1 3.38Å; A257-I261 WeakPolarHBondContact O-CG1 3.26Å; A257-I261 PolarHBondContact O-N 3.4Å |
| 258 | L | 82.9 | Confident | 76.1 | Confident | 100 Ų | 100 | 111.9 Ų | 111.9 | 52% | 0.524 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -66.4 | -35.9 | 175.8 | -74.1 | 171.4 | 0 | 0 | 0 | 112.6 | L254 R262 | L254-L258 HydrophobicContact CD2-CD1 3.97Å; L254-L258 HydrophobicContact CG-CD1 3.79Å; L254-L258 HydrophobicContact CG-CG 4.21Å; L254-L258 WeakPolarHBondContact O-CB 3.43Å; L254-L258 WeakPolarHBondContact O-CD1 3.28Å; L254-L258 WeakPolarHBondContact O-CG 3.44Å; L254-L258 PolarHBondContact O-N 2.95Å; L258-R262 VanDerWaalsContact O-CB 3.27Å; L258-R262 WeakPolarHBondContact O-CB 3.27Å; L258-R262 PolarHBondContact O-N 2.84Å |
| 259 | R | 85.8 | Confident | 78.7 | Confident | 149 Ų | 149 | 107 Ų | 107 | 56% | 0.562 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -64.7 | -42.8 | 171.8 | -93.8 | -174.9 | -73.2 | 102.8 | -2 | 111.3 | T255 A256 A257 R262 V263 | T255-R259 PolarHBondContact O-N 3.49Å; T255-R259 PolarHBondContact O-NE 2.91Å; T255-R259 PolarHBondContact O-NH2 3.27Å; A256-R259 PolarHBondContact O-N 2.91Å; A257-R259 PolarHBondContact O-N 3.29Å; R259-R262 PolarHBondContact O-N 3.26Å; R259-V263 VanDerWaalsContact O-CG2 3.31Å; R259-V263 WeakPolarHBondContact O-CG2 3.36Å; R259-V263 PolarHBondContact O-N 3.43Å |
| 260 | D | 87 | Confident | 81.3 | Confident | 101 Ų | 101 | 105.9 Ų | 105.9 | 54% | 0.54 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -68.2 | -44 | -178.5 | -148.2 | 34.2 | 0 | 0 | 0 | 111.5 | A256 A257 R262 V263 Q264 | A256-D260 WeakPolarHBondContact O-CB 3.49Å; A256-D260 PolarHBondContact O-N 3.28Å; A257-D260 PolarHBondContact O-N 3.43Å; D260-R262 VanDerWaalsContact C-N 3.32Å; D260-R262 PolarHBondContact O-N 2.85Å; D260-V263 PolarHBondContact O-N 3.36Å; D260-Q264 WeakPolarHBondContact O-CB 3.41Å; D260-Q264 VanDerWaalsContact O-CG 3.25Å; D260-Q264 WeakPolarHBondContact O-CG 2.86Å; D260-Q264 PolarHBondContact O-N 3.19Å |
| 261 | I | 90.1 | Very high | 83.3 | Confident | 89 Ų | 89 | 103.3 Ų | 103.3 | 46% | 0.456 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -58.3 | -45.5 | 172.1 | -69.3 | 164.6 | 0 | 0 | 0 | 110.5 | A257 Q264 Y265 | A257-I261 WeakPolarHBondContact O-CB 3.42Å; A257-I261 WeakPolarHBondContact O-CD1 3.38Å; A257-I261 WeakPolarHBondContact O-CG1 3.26Å; A257-I261 PolarHBondContact O-N 3.4Å; I261-Q264 PolarHBondContact O-N 2.89Å; I261-Y265 HydrophobicContact CG2-CD2 3.62Å; I261-Y265 HydrophobicContact CG2-CE2 3.63Å; I261-Y265 VanDerWaalsContact O-CD2 3.25Å; I261-Y265 WeakPolarHBondContact O-CD2 3.43Å; I261-Y265 PolarHBondContact O-N 3.31Å |
| 262 | R | 89.8 | Confident | 85.2 | Confident | 166 Ų | 166 | 98 Ų | 98 | 63% | 0.626 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -61.2 | -46 | 177.5 | -179.4 | 176.7 | 172.7 | -171 | -3.9 | 111.9 | L258 R259 D260 Q264 Y265 E266 | L258-R262 VanDerWaalsContact O-CB 3.27Å; L258-R262 WeakPolarHBondContact O-CB 3.27Å; L258-R262 PolarHBondContact O-N 2.84Å; R259-R262 PolarHBondContact O-N 3.26Å; D260-R262 VanDerWaalsContact C-N 3.32Å; D260-R262 PolarHBondContact O-N 2.85Å; R262-Q264 VanDerWaalsContact C-N 3.31Å; R262-Q264 PolarHBondContact O-N 3.45Å; R262-Y265 PolarHBondContact O-N 2.84Å; R262-E266 HydrophobicContact CG-CG 4.44Å; R262-E266 IonicContact CZ-OE1 3.53Å; R262-E266 VanDerWaalsContact CZ-OE1 3.31Å; R262-E266 IonicContact NE-OE1 3.46Å; R262-E266 PolarHBondContact NE-OE1 2.86Å; R262-E266 IonicContact NH2-OE1 3.48Å; R262-E266 PolarHBondContact NH2-OE1 3.49Å; R262-E266 WeakPolarHBondContact O-CB 3.46Å; R262-E266 WeakPolarHBondContact O-CG 3.46Å; R262-E266 PolarHBondContact O-N 3.23Å |
| 263 | V | 92.2 | Very high | 86.7 | Confident | 65 Ų | 65 | 99 Ų | 99 | 39% | 0.394 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.1 | -39.2 | 176.8 | 169.2 | 0 | 0 | 0 | 0 | 110.8 | R259 D260 E266 N267 | R259-V263 VanDerWaalsContact O-CG2 3.31Å; R259-V263 WeakPolarHBondContact O-CG2 3.36Å; R259-V263 PolarHBondContact O-N 3.43Å; D260-V263 PolarHBondContact O-N 3.36Å; V263-E266 PolarHBondContact O-N 2.94Å; V263-N267 VanDerWaalsContact O-CB 3.28Å; V263-N267 WeakPolarHBondContact O-CB 3.37Å; V263-N267 PolarHBondContact O-N 2.87Å; V263-N267 PolarHBondContact O-ND2 2.91Å |
| 264 | Q | 91.6 | Very high | 88.2 | Confident | 133 Ų | 133 | 98.9 Ų | 98.9 | 62% | 0.621 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -63.2 | -42.8 | 174.2 | -70 | -132.6 | -5.3 | 0 | 0 | 112.4 | D260 I261 R262 N267 M268 | D260-Q264 WeakPolarHBondContact O-CB 3.41Å; D260-Q264 VanDerWaalsContact O-CG 3.25Å; D260-Q264 WeakPolarHBondContact O-CG 2.86Å; D260-Q264 PolarHBondContact O-N 3.19Å; I261-Q264 PolarHBondContact O-N 2.89Å; R262-Q264 VanDerWaalsContact C-N 3.31Å; R262-Q264 PolarHBondContact O-N 3.45Å; Q264-N267 PolarHBondContact O-N 3.38Å; Q264-M268 WeakPolarHBondContact O-CB 3.29Å; Q264-M268 PolarHBondContact O-N 3.38Å |
| 265 | Y | 93.8 | Very high | 89.6 | Confident | 153 Ų | 153 | 99 Ų | 99 | 60% | 0.6 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -67.4 | -40.7 | 175.6 | -86.9 | -72.6 | 0 | 0 | 0 | 112.6 | I261 R262 M268 A269 | I261-Y265 HydrophobicContact CG2-CD2 3.62Å; I261-Y265 HydrophobicContact CG2-CE2 3.63Å; I261-Y265 VanDerWaalsContact O-CD2 3.25Å; I261-Y265 WeakPolarHBondContact O-CD2 3.43Å; I261-Y265 PolarHBondContact O-N 3.31Å; R262-Y265 PolarHBondContact O-N 2.84Å; Y265-M268 HydrophobicContact CD1-CE 3.59Å; Y265-M268 HydrophobicContact CE1-CE 3.64Å; Y265-M268 PolarHBondContact O-N 2.9Å; Y265-A269 VanDerWaalsContact O-CB 3.24Å; Y265-A269 WeakPolarHBondContact O-CB 3.29Å; Y265-A269 PolarHBondContact O-N 3.42Å |
| 266 | E | 92.1 | Very high | 90.6 | Very high | 90 Ų | 90 | 97.1 Ų | 97.1 | 42% | 0.421 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.2 | -46 | 174.9 | -75.9 | 175.1 | -179.5 | 0 | 0 | 110.3 | R262 V263 A269 T270 | R262-E266 HydrophobicContact CG-CG 4.44Å; R262-E266 IonicContact CZ-OE1 3.53Å; R262-E266 VanDerWaalsContact CZ-OE1 3.31Å; R262-E266 IonicContact NE-OE1 3.46Å; R262-E266 PolarHBondContact NE-OE1 2.86Å; R262-E266 IonicContact NH2-OE1 3.48Å; R262-E266 PolarHBondContact NH2-OE1 3.49Å; R262-E266 WeakPolarHBondContact O-CB 3.46Å; R262-E266 WeakPolarHBondContact O-CG 3.46Å; R262-E266 PolarHBondContact O-N 3.23Å; V263-E266 PolarHBondContact O-N 2.94Å; E266-A269 PolarHBondContact O-N 3.36Å; E266-T270 WeakPolarHBondContact O-CG2 3.46Å; E266-T270 PolarHBondContact O-N 2.92Å; E266-T270 PolarHBondContact O-OG1 2.87Å |
| 267 | N | 93.8 | Very high | 91.7 | Very high | 97 Ų | 97 | 99 Ų | 99 | 52% | 0.519 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.4 | -46.1 | 175.3 | -71.5 | -17.1 | 0 | 0 | 0 | 111.9 | V263 Q264 A269 T270 S271 | V263-N267 VanDerWaalsContact O-CB 3.28Å; V263-N267 WeakPolarHBondContact O-CB 3.37Å; V263-N267 PolarHBondContact O-N 2.87Å; V263-N267 PolarHBondContact O-ND2 2.91Å; Q264-N267 PolarHBondContact O-N 3.38Å; N267-A269 VanDerWaalsContact C-N 3.34Å; N267-A269 PolarHBondContact O-N 2.99Å; N267-T270 WeakPolarHBondContact CA-OG1 3.47Å; N267-T270 PolarHBondContact O-N 2.9Å; N267-T270 PolarHBondContact O-OG1 2.88Å; N267-S271 WeakPolarHBondContact O-CB 3.24Å; N267-S271 PolarHBondContact O-N 3.44Å |
| 268 | M | 93.2 | Very high | 92.5 | Very high | 115 Ų | 115 | 102.1 Ų | 102.1 | 57% | 0.567 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -63.7 | -38.8 | 178.7 | -171.9 | 172.8 | 67.1 | 0 | 0 | 111.7 | Q264 Y265 N272 | Q264-M268 WeakPolarHBondContact O-CB 3.29Å; Q264-M268 PolarHBondContact O-N 3.38Å; Y265-M268 HydrophobicContact CD1-CE 3.59Å; Y265-M268 HydrophobicContact CE1-CE 3.64Å; Y265-M268 PolarHBondContact O-N 2.9Å; M268-N272 WeakPolarHBondContact O-CB 3.37Å; M268-N272 PolarHBondContact O-N 2.82Å |
| 269 | A | 93 | Very high | 93.1 | Very high | 62 Ų | 62 | 104.7 Ų | 104.7 | 51% | 0.512 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.7 | -42.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y265 E266 N267 M273 | Y265-A269 VanDerWaalsContact O-CB 3.24Å; Y265-A269 WeakPolarHBondContact O-CB 3.29Å; Y265-A269 PolarHBondContact O-N 3.42Å; E266-A269 PolarHBondContact O-N 3.36Å; N267-A269 VanDerWaalsContact C-N 3.34Å; N267-A269 PolarHBondContact O-N 2.99Å; A269-M273 WeakPolarHBondContact O-CB 3.48Å; A269-M273 PolarHBondContact O-N 3.34Å |
| 270 | T | 93.9 | Very high | 93.7 | Very high | 89 Ų | 89 | 103.8 Ų | 103.8 | 55% | 0.546 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -67.9 | -40.2 | 175.6 | 58.2 | 0 | 0 | 0 | 0 | 112.8 | E266 N267 M273 H274 | E266-T270 WeakPolarHBondContact O-CG2 3.46Å; E266-T270 PolarHBondContact O-N 2.92Å; E266-T270 PolarHBondContact O-OG1 2.87Å; N267-T270 WeakPolarHBondContact CA-OG1 3.47Å; N267-T270 PolarHBondContact O-N 2.9Å; N267-T270 PolarHBondContact O-OG1 2.88Å; T270-M273 PolarHBondContact O-N 3.45Å; T270-H274 PolarHBondContact O-N 3.37Å |
| 271 | S | 94.9 | Very high | 94.2 | Very high | 54 Ų | 54 | 106.1 Ų | 106.1 | 38% | 0.378 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.5 | -48.1 | 175.6 | -159.7 | 0 | 0 | 0 | 0 | 110.5 | N267 M273 H274 E275 | N267-S271 WeakPolarHBondContact O-CB 3.24Å; N267-S271 PolarHBondContact O-N 3.44Å; S271-M273 VanDerWaalsContact C-N 3.33Å; S271-M273 PolarHBondContact O-N 3.42Å; S271-H274 PolarHBondContact O-N 3.16Å; S271-H274 VanDerWaalsContact O-N 3.16Å; S271-E275 WeakPolarHBondContact O-CB 3.36Å; S271-E275 VanDerWaalsContact O-CG 3.27Å; S271-E275 WeakPolarHBondContact O-CG 3.32Å; S271-E275 PolarHBondContact O-N 2.96Å; S271-E275 PolarHBondContact OG-OE1 2.69Å |
| 272 | N | 94.6 | Very high | 94.5 | Very high | 92 Ų | 92 | 105 Ų | 105 | 49% | 0.492 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.3 | -40.8 | 177.5 | -170.6 | -21.8 | 0 | 0 | 0 | 111.6 | M268 T276 | M268-N272 WeakPolarHBondContact O-CB 3.37Å; M268-N272 PolarHBondContact O-N 2.82Å; N272-T276 WeakPolarHBondContact O-CB 3.05Å; N272-T276 VanDerWaalsContact O-CG2 3.26Å; N272-T276 WeakPolarHBondContact O-CG2 3.3Å; N272-T276 PolarHBondContact O-N 3.3Å; N272-T276 PolarHBondContact O-OG1 3.48Å; N272-T276 WeakPolarHBondContact OD1-CG2 3.31Å |
| 273 | M | 95.1 | Very high | 94.9 | Very high | 117 Ų | 117 | 102.2 Ų | 102.2 | 58% | 0.576 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -61.9 | -44.6 | 174.2 | -168.3 | 66.3 | 63.4 | 0 | 0 | 112.1 | A269 T270 S271 T276 E277 | A269-M273 WeakPolarHBondContact O-CB 3.48Å; A269-M273 PolarHBondContact O-N 3.34Å; T270-M273 PolarHBondContact O-N 3.45Å; S271-M273 VanDerWaalsContact C-N 3.33Å; S271-M273 PolarHBondContact O-N 3.42Å; M273-T276 WeakPolarHBondContact CA-OG1 3.39Å; M273-T276 PolarHBondContact O-OG1 3.4Å; M273-E277 WeakPolarHBondContact O-CG 3.45Å; M273-E277 PolarHBondContact O-N 2.89Å |
| 274 | H | 96.3 | Very high | 95.2 | Very high | 113 Ų | 113 | 105.5 Ų | 105.5 | 52% | 0.523 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -68.1 | -44 | 177.5 | -102.3 | -7.2 | 0 | 0 | 0 | 112.8 | T270 S271 T276 E277 E278 | T270-H274 PolarHBondContact O-N 3.37Å; S271-H274 PolarHBondContact O-N 3.16Å; S271-H274 VanDerWaalsContact O-N 3.16Å; H274-T276 VanDerWaalsContact C-N 3.3Å; H274-T276 PolarHBondContact O-N 3.37Å; H274-E277 IonicContact ND1-OE2 2.6Å; H274-E277 PolarHBondContact O-N 3.34Å; H274-E278 WeakPolarHBondContact O-CB 3.45Å; H274-E278 WeakPolarHBondContact O-CG 3.34Å; H274-E278 PolarHBondContact O-N 2.81Å |
| 275 | E | 95.6 | Very high | 95.5 | Very high | 114 Ų | 114 | 101.7 Ų | 101.7 | 53% | 0.533 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.2 | -41.1 | 177.1 | -74.1 | 166.2 | -145.4 | 0 | 0 | 111.2 | S271 W279 | S271-E275 WeakPolarHBondContact O-CB 3.36Å; S271-E275 VanDerWaalsContact O-CG 3.27Å; S271-E275 WeakPolarHBondContact O-CG 3.32Å; S271-E275 PolarHBondContact O-N 2.96Å; S271-E275 PolarHBondContact OG-OE1 2.69Å; E275-W279 WeakPolarHBondContact O-CB 3.32Å; E275-W279 PolarHBondContact O-N 2.98Å |
| 276 | T | 94 | Very high | 95.6 | Very high | 52 Ų | 52 | 98.7 Ų | 98.7 | 32% | 0.319 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -67.9 | -43 | 175.3 | 52.5 | 0 | 0 | 0 | 0 | 111.9 | N272 M273 H274 W279 Y280 | N272-T276 WeakPolarHBondContact O-CB 3.05Å; N272-T276 VanDerWaalsContact O-CG2 3.26Å; N272-T276 WeakPolarHBondContact O-CG2 3.3Å; N272-T276 PolarHBondContact O-N 3.3Å; N272-T276 PolarHBondContact O-OG1 3.48Å; N272-T276 WeakPolarHBondContact OD1-CG2 3.31Å; M273-T276 WeakPolarHBondContact CA-OG1 3.39Å; M273-T276 PolarHBondContact O-OG1 3.4Å; H274-T276 VanDerWaalsContact C-N 3.3Å; H274-T276 PolarHBondContact O-N 3.37Å; T276-W279 PolarHBondContact O-N 2.93Å; T276-Y280 WeakPolarHBondContact O-CD2 3.43Å; T276-Y280 PolarHBondContact O-N 3.29Å |
| 277 | E | 96.1 | Very high | 95.9 | Very high | 78 Ų | 78 | 99.3 Ų | 99.3 | 36% | 0.364 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60 | -46 | 173.8 | -81.5 | -170 | -172.4 | 0 | 0 | 112.8 | M273 H274 W279 Y280 R281 | M273-E277 WeakPolarHBondContact O-CG 3.45Å; M273-E277 PolarHBondContact O-N 2.89Å; H274-E277 IonicContact ND1-OE2 2.6Å; H274-E277 PolarHBondContact O-N 3.34Å; E277-W279 VanDerWaalsContact C-N 3.35Å; E277-Y280 PolarHBondContact O-N 3.05Å; E277-R281 WeakPolarHBondContact O-CB 3.33Å; E277-R281 WeakPolarHBondContact O-CG 3.36Å; E277-R281 PolarHBondContact O-N 3.41Å; E277-R281 IonicContact OE2-CZ 3.31Å; E277-R281 IonicContact OE2-NH1 2.79Å; E277-R281 IonicContact OE2-NH2 2.97Å; E277-R281 PolarHBondContact OE2-NH2 3.32Å |
| 278 | E | 96.1 | Very high | 96.1 | Very high | 115 Ų | 115 | 98.4 Ų | 98.4 | 54% | 0.537 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.6 | -40.9 | 177.6 | -74 | -179.8 | -179.8 | 0 | 0 | 111.1 | H274 R281 S282 | H274-E278 WeakPolarHBondContact O-CB 3.45Å; H274-E278 WeakPolarHBondContact O-CG 3.34Å; H274-E278 PolarHBondContact O-N 2.81Å; E278-R281 PolarHBondContact O-N 3.43Å; E278-S282 WeakPolarHBondContact O-CB 3.44Å; E278-S282 PolarHBondContact O-N 2.91Å |
| 279 | W | 96.7 | Very high | 96.3 | Very high | 154 Ų | 154 | 96.3 Ų | 96.3 | 58% | 0.583 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -60.2 | -47.2 | 174.3 | -175.4 | 86.4 | 0 | 0 | 0 | 111.6 | E275 T276 E277 S282 K283 | E275-W279 WeakPolarHBondContact O-CB 3.32Å; E275-W279 PolarHBondContact O-N 2.98Å; T276-W279 PolarHBondContact O-N 2.93Å; E277-W279 VanDerWaalsContact C-N 3.35Å; W279-S282 PolarHBondContact O-N 2.9Å; W279-K283 WeakPolarHBondContact O-CB 3.46Å; W279-K283 PolarHBondContact O-N 3.44Å |
| 280 | Y | 97.2 | Very high | 96.5 | Very high | 130 Ų | 130 | 95.8 Ų | 95.8 | 51% | 0.51 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -64.2 | -44.6 | 175.4 | -78.1 | -64.4 | 0 | 0 | 0 | 111.7 | T276 E277 S282 K283 F284 | T276-Y280 WeakPolarHBondContact O-CD2 3.43Å; T276-Y280 PolarHBondContact O-N 3.29Å; E277-Y280 PolarHBondContact O-N 3.05Å; Y280-S282 PolarHBondContact O-N 3.05Å; Y280-K283 PolarHBondContact O-N 3.2Å; Y280-F284 WeakPolarHBondContact O-CD2 3.38Å; Y280-F284 PolarHBondContact O-N 3.17Å |
| 281 | R | 97.9 | Very high | 96.6 | Very high | 151 Ų | 151 | 94 Ų | 94 | 57% | 0.57 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -57.9 | -46.7 | 176 | -81.2 | -169.7 | -160.5 | 108.9 | 15.1 | 111.6 | E277 E278 K283 F284 A285 | E277-R281 WeakPolarHBondContact O-CB 3.33Å; E277-R281 WeakPolarHBondContact O-CG 3.36Å; E277-R281 PolarHBondContact O-N 3.41Å; E277-R281 IonicContact OE2-CZ 3.31Å; E277-R281 IonicContact OE2-NH1 2.79Å; E277-R281 IonicContact OE2-NH2 2.97Å; E277-R281 PolarHBondContact OE2-NH2 3.32Å; E278-R281 PolarHBondContact O-N 3.43Å; R281-K283 VanDerWaalsContact C-N 3.32Å; R281-K283 PolarHBondContact O-N 2.85Å; R281-F284 PolarHBondContact O-N 2.86Å; R281-A285 WeakPolarHBondContact O-CB 3.44Å; R281-A285 PolarHBondContact O-N 3.45Å |
| 282 | S | 97.7 | Very high | 96.7 | Very high | 66 Ų | 66 | 95.7 Ų | 95.7 | 46% | 0.462 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.2 | -43.9 | 176.6 | -166.5 | 0 | 0 | 0 | 0 | 110.7 | E278 W279 Y280 F284 A285 D286 | E278-S282 WeakPolarHBondContact O-CB 3.44Å; E278-S282 PolarHBondContact O-N 2.91Å; W279-S282 PolarHBondContact O-N 2.9Å; Y280-S282 PolarHBondContact O-N 3.05Å; S282-F284 PolarHBondContact O-N 3.44Å; S282-A285 WeakPolarHBondContact O-CB 3.24Å; S282-A285 PolarHBondContact O-N 2.92Å; S282-D286 VanDerWaalsContact O-CG 3.26Å; S282-D286 PolarHBondContact O-N 3.33Å |
| 283 | K | 97.8 | Very high | 96.8 | Very high | 106 Ų | 106 | 98.8 Ų | 98.8 | 46% | 0.461 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.8 | -40.6 | 179 | -162.2 | 71 | -175.7 | 176.4 | 0 | 112.5 | W279 Y280 R281 L287 | W279-K283 WeakPolarHBondContact O-CB 3.46Å; W279-K283 PolarHBondContact O-N 3.44Å; Y280-K283 PolarHBondContact O-N 3.2Å; R281-K283 VanDerWaalsContact C-N 3.32Å; R281-K283 PolarHBondContact O-N 2.85Å; K283-L287 WeakPolarHBondContact O-CB 3.46Å; K283-L287 VanDerWaalsContact O-CG 3.28Å; K283-L287 WeakPolarHBondContact O-CG 3.43Å; K283-L287 PolarHBondContact O-N 2.89Å |
| 284 | F | 97.7 | Very high | 96.9 | Very high | 135 Ų | 135 | 98.3 Ų | 98.3 | 59% | 0.592 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -66.4 | -40.2 | 174.3 | -79.5 | -64.3 | 0 | 0 | 0 | 112.1 | Y280 R281 S282 L287 T288 | Y280-F284 WeakPolarHBondContact O-CD2 3.38Å; Y280-F284 PolarHBondContact O-N 3.17Å; R281-F284 PolarHBondContact O-N 2.86Å; S282-F284 PolarHBondContact O-N 3.44Å; F284-L287 PolarHBondContact O-N 2.68Å; F284-T288 WeakPolarHBondContact O-CB 3.46Å; F284-T288 PolarHBondContact O-N 3.16Å; F284-T288 PolarHBondContact O-OG1 3.4Å |
| 285 | A | 97.8 | Very high | 97 | Very high | 53 Ų | 53 | 97 Ų | 97 | 44% | 0.438 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -60.9 | -49.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | R281 S282 L287 T288 D289 | R281-A285 WeakPolarHBondContact O-CB 3.44Å; R281-A285 PolarHBondContact O-N 3.45Å; S282-A285 WeakPolarHBondContact O-CB 3.24Å; S282-A285 PolarHBondContact O-N 2.92Å; A285-L287 PolarHBondContact O-N 3.31Å; A285-T288 PolarHBondContact O-N 2.89Å; A285-T288 VanDerWaalsContact O-N 3.16Å; A285-D289 VanDerWaalsContact O-CB 3.29Å; A285-D289 WeakPolarHBondContact O-CB 3.41Å; A285-D289 PolarHBondContact O-N 2.86Å |
| 286 | D | 97.3 | Very high | 97.1 | Very high | 89 Ų | 89 | 96.2 Ų | 96.2 | 48% | 0.476 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -58.9 | -43.6 | 178.1 | -69.7 | -22.5 | 0 | 0 | 0 | 112.4 | S282 D289 A290 | S282-D286 VanDerWaalsContact O-CG 3.26Å; S282-D286 PolarHBondContact O-N 3.33Å; D286-D289 PolarHBondContact O-N 3.45Å; D286-A290 VanDerWaalsContact O-CB 3.28Å; D286-A290 WeakPolarHBondContact O-CB 3.25Å; D286-A290 PolarHBondContact O-N 2.88Å |
| 287 | L | 96.9 | Very high | 97.1 | Very high | 104 Ų | 104 | 96.7 Ų | 96.7 | 55% | 0.545 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65 | -41.5 | 176.6 | -74.8 | 174.1 | 0 | 0 | 0 | 111.9 | K283 F284 A285 A290 A291 | K283-L287 WeakPolarHBondContact O-CB 3.46Å; K283-L287 VanDerWaalsContact O-CG 3.28Å; K283-L287 WeakPolarHBondContact O-CG 3.43Å; K283-L287 PolarHBondContact O-N 2.89Å; F284-L287 PolarHBondContact O-N 2.68Å; A285-L287 PolarHBondContact O-N 3.31Å; L287-A290 PolarHBondContact O-N 3.14Å; L287-A291 WeakPolarHBondContact O-CB 3.36Å; L287-A291 PolarHBondContact O-N 3.37Å |
| 288 | T | 97.4 | Very high | 97.1 | Very high | 77 Ų | 77 | 97.1 Ų | 97.1 | 47% | 0.472 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.5 | -44 | 177.9 | -57.3 | 0 | 0 | 0 | 0 | 110.7 | F284 A285 A291 N292 | F284-T288 WeakPolarHBondContact O-CB 3.46Å; F284-T288 PolarHBondContact O-N 3.16Å; F284-T288 PolarHBondContact O-OG1 3.4Å; A285-T288 PolarHBondContact O-N 2.89Å; A285-T288 VanDerWaalsContact O-N 3.16Å; T288-A291 PolarHBondContact O-N 2.91Å; T288-N292 WeakPolarHBondContact O-CB 3.44Å; T288-N292 PolarHBondContact O-N 3.44Å; T288-N292 PolarHBondContact O-ND2 2.91Å |
| 289 | D | 97.9 | Very high | 97.2 | Very high | 71 Ų | 71 | 96.5 Ų | 96.5 | 38% | 0.38 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.4 | -44 | 175.8 | -103 | 26.7 | 0 | 0 | 0 | 112.2 | A285 D286 N292 R293 | A285-D289 VanDerWaalsContact O-CB 3.29Å; A285-D289 WeakPolarHBondContact O-CB 3.41Å; A285-D289 PolarHBondContact O-N 2.86Å; D286-D289 PolarHBondContact O-N 3.45Å; D289-N292 PolarHBondContact O-N 2.99Å; D289-R293 WeakPolarHBondContact O-CG 3.11Å; D289-R293 PolarHBondContact O-N 3.4Å; D289-R293 IonicContact OD2-CZ 3.19Å; D289-R293 IonicContact OD2-NH1 3.74Å; D289-R293 IonicContact OD2-NH2 3.64Å; D289-R293 PolarHBondContact OD2-NH2 3.44Å |
| 290 | A | 96.8 | Very high | 97.2 | Very high | 52 Ų | 52 | 92.8 Ų | 92.8 | 43% | 0.43 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63.3 | -42.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | D286 L287 R293 N294 | D286-A290 VanDerWaalsContact O-CB 3.28Å; D286-A290 WeakPolarHBondContact O-CB 3.25Å; D286-A290 PolarHBondContact O-N 2.88Å; L287-A290 PolarHBondContact O-N 3.14Å; A290-R293 PolarHBondContact O-N 3.33Å; A290-N294 WeakPolarHBondContact O-CB 3.44Å; A290-N294 PolarHBondContact O-N 2.93Å |
| 291 | A | 96.8 | Very high | 96.9 | Very high | 52 Ų | 52 | 89.4 Ų | 89.4 | 43% | 0.43 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -61.4 | -46.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | L287 T288 R293 N294 T295 | L287-A291 WeakPolarHBondContact O-CB 3.36Å; L287-A291 PolarHBondContact O-N 3.37Å; T288-A291 PolarHBondContact O-N 2.91Å; A291-R293 PolarHBondContact O-N 3.28Å; A291-N294 PolarHBondContact O-N 3.22Å; A291-T295 WeakPolarHBondContact O-CG2 3.37Å; A291-T295 PolarHBondContact O-N 3.34Å; A291-T295 PolarHBondContact O-OG1 2.6Å |
| 292 | N | 97.6 | Very high | 96.8 | Very high | 88 Ų | 88 | 88.3 Ų | 88.3 | 47% | 0.471 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -59.8 | -47.4 | 177.2 | -71.3 | -24.6 | 0 | 0 | 0 | 111.6 | T288 D289 N294 T295 E296 | T288-N292 WeakPolarHBondContact O-CB 3.44Å; T288-N292 PolarHBondContact O-N 3.44Å; T288-N292 PolarHBondContact O-ND2 2.91Å; D289-N292 PolarHBondContact O-N 2.99Å; N292-N294 VanDerWaalsContact C-N 3.32Å; N292-N294 PolarHBondContact O-N 2.96Å; N292-T295 WeakPolarHBondContact CA-OG1 3.25Å; N292-T295 PolarHBondContact O-N 3.02Å; N292-T295 PolarHBondContact O-OG1 3.19Å; N292-E296 PolarHBondContact O-N 2.92Å |
| 293 | R | 97.1 | Very high | 96.8 | Very high | 158 Ų | 158 | 89.5 Ų | 89.5 | 60% | 0.596 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -60.1 | -40.8 | 176.2 | -70.6 | -178 | -165.2 | 96.1 | 13.8 | 112.2 | D289 A290 A291 E296 A297 | D289-R293 WeakPolarHBondContact O-CG 3.11Å; D289-R293 PolarHBondContact O-N 3.4Å; D289-R293 IonicContact OD2-CZ 3.19Å; D289-R293 IonicContact OD2-NH1 3.74Å; D289-R293 IonicContact OD2-NH2 3.64Å; D289-R293 PolarHBondContact OD2-NH2 3.44Å; A290-R293 PolarHBondContact O-N 3.33Å; A291-R293 PolarHBondContact O-N 3.28Å; R293-E296 PolarHBondContact O-N 3.43Å; R293-A297 WeakPolarHBondContact O-CB 3.29Å; R293-A297 PolarHBondContact O-N 2.9Å |
| 294 | N | 96.9 | Very high | 96.6 | Very high | 107 Ų | 107 | 87.5 Ų | 87.5 | 57% | 0.572 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -64.2 | -46.3 | 175.8 | -171 | -45 | 0 | 0 | 0 | 111.3 | A290 A291 N292 E296 A297 L298 | A290-N294 WeakPolarHBondContact O-CB 3.44Å; A290-N294 PolarHBondContact O-N 2.93Å; A291-N294 PolarHBondContact O-N 3.22Å; N292-N294 VanDerWaalsContact C-N 3.32Å; N292-N294 PolarHBondContact O-N 2.96Å; N294-E296 VanDerWaalsContact C-N 3.29Å; N294-E296 PolarHBondContact O-N 3.1Å; N294-A297 PolarHBondContact O-N 3.42Å; N294-L298 WeakPolarHBondContact O-CB 3.41Å; N294-L298 PolarHBondContact O-N 3.36Å |
| 295 | T | 97.1 | Very high | 96.4 | Very high | 86 Ų | 86 | 83.9 Ų | 83.9 | 53% | 0.528 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -60.7 | -38.7 | 177.9 | 59.7 | 0 | 0 | 0 | 0 | 112.4 | A291 N292 L298 R299 | A291-T295 WeakPolarHBondContact O-CG2 3.37Å; A291-T295 PolarHBondContact O-N 3.34Å; A291-T295 PolarHBondContact O-OG1 2.6Å; N292-T295 WeakPolarHBondContact CA-OG1 3.25Å; N292-T295 PolarHBondContact O-N 3.02Å; N292-T295 PolarHBondContact O-OG1 3.19Å; T295-L298 PolarHBondContact O-N 2.7Å; T295-R299 WeakPolarHBondContact O-CB 3.46Å; T295-R299 PolarHBondContact O-N 3.46Å |
| 296 | E | 97.6 | Very high | 96.2 | Very high | 96 Ų | 96 | 85.5 Ų | 85.5 | 45% | 0.449 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -71.3 | -41.7 | 177.7 | -175.9 | 58.4 | -164.7 | 0 | 0 | 112 | N292 R293 N294 L298 R299 Q300 | N292-E296 PolarHBondContact O-N 2.92Å; R293-E296 PolarHBondContact O-N 3.43Å; N294-E296 VanDerWaalsContact C-N 3.29Å; N294-E296 PolarHBondContact O-N 3.1Å; E296-L298 VanDerWaalsContact C-N 3.28Å; E296-L298 PolarHBondContact O-N 3.25Å; E296-R299 VanDerWaalsContact CD-NE 3.32Å; E296-R299 WeakPolarHBondContact O-CB 3.49Å; E296-R299 PolarHBondContact O-N 2.85Å; E296-R299 IonicContact OE1-CZ 3.8Å; E296-R299 VanDerWaalsContact OE1-CZ 3.26Å; E296-R299 IonicContact OE1-NE 3.79Å; E296-R299 PolarHBondContact OE1-NE 3.16Å; E296-R299 VanDerWaalsContact OE1-NE 3.08Å; E296-R299 IonicContact OE1-NH2 3.89Å; E296-R299 PolarHBondContact OE1-NH2 2.88Å; E296-R299 IonicContact OE2-CZ 2.95Å; E296-R299 IonicContact OE2-NE 3.72Å; E296-R299 PolarHBondContact OE2-NE 3.19Å; E296-R299 IonicContact OE2-NH2 3.97Å; E296-Q300 WeakPolarHBondContact O-CB 3.49Å; E296-Q300 PolarHBondContact O-N 3.44Å |
| 297 | A | 95.3 | Very high | 96.2 | Very high | 62 Ų | 62 | 85.5 Ų | 85.5 | 51% | 0.512 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -59.6 | -40.6 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | R293 N294 Q300 A301 | R293-A297 WeakPolarHBondContact O-CB 3.29Å; R293-A297 PolarHBondContact O-N 2.9Å; N294-A297 PolarHBondContact O-N 3.42Å; A297-Q300 PolarHBondContact O-N 3.27Å; A297-A301 WeakPolarHBondContact O-CB 3.41Å; A297-A301 PolarHBondContact O-N 3.06Å |
| 298 | L | 96.4 | Very high | 95.9 | Very high | 87 Ų | 87 | 87.6 Ų | 87.6 | 46% | 0.455 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -69.1 | -36.5 | 176.6 | -168.9 | 135.3 | 0 | 0 | 0 | 112.1 | N294 T295 E296 K302 | N294-L298 WeakPolarHBondContact O-CB 3.41Å; N294-L298 PolarHBondContact O-N 3.36Å; T295-L298 PolarHBondContact O-N 2.7Å; E296-L298 VanDerWaalsContact C-N 3.28Å; E296-L298 PolarHBondContact O-N 3.25Å; L298-K302 HydrophobicContact CD2-CD 3.99Å; L298-K302 WeakPolarHBondContact O-CB 3.3Å; L298-K302 WeakPolarHBondContact O-CG 3.38Å; L298-K302 PolarHBondContact O-N 2.86Å |
| 299 | R | 97.6 | Very high | 95.7 | Very high | 102 Ų | 102 | 91.1 Ų | 91.1 | 39% | 0.385 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -63.1 | -46 | 172.6 | -169.4 | -160.1 | 65.6 | 62.9 | 6.8 | 110.9 | T295 E296 K302 Q303 | T295-R299 WeakPolarHBondContact O-CB 3.46Å; T295-R299 PolarHBondContact O-N 3.46Å; E296-R299 VanDerWaalsContact CD-NE 3.32Å; E296-R299 WeakPolarHBondContact O-CB 3.49Å; E296-R299 PolarHBondContact O-N 2.85Å; E296-R299 IonicContact OE1-CZ 3.8Å; E296-R299 VanDerWaalsContact OE1-CZ 3.26Å; E296-R299 IonicContact OE1-NE 3.79Å; E296-R299 PolarHBondContact OE1-NE 3.16Å; E296-R299 VanDerWaalsContact OE1-NE 3.08Å; E296-R299 IonicContact OE1-NH2 3.89Å; E296-R299 PolarHBondContact OE1-NH2 2.88Å; E296-R299 IonicContact OE2-CZ 2.95Å; E296-R299 IonicContact OE2-NE 3.72Å; E296-R299 PolarHBondContact OE2-NE 3.19Å; E296-R299 IonicContact OE2-NH2 3.97Å; R299-K302 PolarHBondContact O-N 3.18Å; R299-Q303 PolarHBondContact O-N 3.19Å |
| 300 | Q | 95.8 | Very high | 95.6 | Very high | 76 Ų | 76 | 95.5 Ų | 95.5 | 36% | 0.355 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -63.9 | -47.8 | 178.6 | -170.8 | 60.6 | 34.2 | 0 | 0 | 111.4 | E296 A297 K302 Q303 D304 | E296-Q300 WeakPolarHBondContact O-CB 3.49Å; E296-Q300 PolarHBondContact O-N 3.44Å; A297-Q300 PolarHBondContact O-N 3.27Å; Q300-K302 VanDerWaalsContact C-N 3.27Å; Q300-K302 PolarHBondContact O-N 2.92Å; Q300-Q303 WeakPolarHBondContact O-CA 3.32Å; Q300-Q303 WeakPolarHBondContact O-CB 3.47Å; Q300-Q303 PolarHBondContact O-N 3.18Å; Q300-D304 PolarHBondContact NE2-OD1 3.34Å; Q300-D304 VanDerWaalsContact O-CG 3.32Å; Q300-D304 PolarHBondContact O-N 3.45Å |
| 301 | A | 92.3 | Very high | 95.5 | Very high | 60 Ų | 60 | 97.5 Ų | 97.5 | 50% | 0.496 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -58.4 | -38.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | A297 A305 | A297-A301 WeakPolarHBondContact O-CB 3.41Å; A297-A301 PolarHBondContact O-N 3.06Å; A301-A305 VanDerWaalsContact O-CB 3.3Å; A301-A305 WeakPolarHBondContact O-CB 3.19Å; A301-A305 PolarHBondContact O-N 3.37Å |
| 302 | K | 96.2 | Very high | 95.2 | Very high | 128 Ų | 128 | 99.3 Ų | 99.3 | 56% | 0.557 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -66.3 | -38.6 | 173.3 | -78.2 | 178.2 | 176 | 177.2 | 0 | 112.6 | L298 R299 Q300 N306 | L298-K302 HydrophobicContact CD2-CD 3.99Å; L298-K302 WeakPolarHBondContact O-CB 3.3Å; L298-K302 WeakPolarHBondContact O-CG 3.38Å; L298-K302 PolarHBondContact O-N 2.86Å; R299-K302 PolarHBondContact O-N 3.18Å; Q300-K302 VanDerWaalsContact C-N 3.27Å; Q300-K302 PolarHBondContact O-N 2.92Å; K302-N306 PolarHBondContact O-N 3.45Å; K302-N306 VanDerWaalsContact O-N 3.1Å; K302-N306 PolarHBondContact O-ND2 3.08Å |
| 303 | Q | 96.2 | Very high | 95 | Very high | 91 Ų | 91 | 99.5 Ų | 99.5 | 43% | 0.425 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -64.9 | -47.3 | 176.9 | -176.3 | 173.1 | -11.3 | 0 | 0 | 110.6 | R299 Q300 A305 N306 E307 | R299-Q303 PolarHBondContact O-N 3.19Å; Q300-Q303 WeakPolarHBondContact O-CA 3.32Å; Q300-Q303 WeakPolarHBondContact O-CB 3.47Å; Q300-Q303 PolarHBondContact O-N 3.18Å; Q303-A305 PolarHBondContact O-N 3.06Å; Q303-N306 WeakPolarHBondContact O-CB 3.35Å; Q303-N306 PolarHBondContact O-N 3.49Å; Q303-N306 VanDerWaalsContact O-N 3.13Å; Q303-E307 PolarHBondContact O-N 3.42Å |
| 304 | D | 93.9 | Very high | 94.7 | Very high | 63 Ų | 63 | 94.4 Ų | 94.4 | 34% | 0.337 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62.8 | -43.3 | 178.7 | -61 | -17.3 | 0 | 0 | 0 | 111.1 | Q300 N306 E307 Y308 | Q300-D304 PolarHBondContact NE2-OD1 3.34Å; Q300-D304 VanDerWaalsContact O-CG 3.32Å; Q300-D304 PolarHBondContact O-N 3.45Å; D304-N306 VanDerWaalsContact C-N 3.28Å; D304-N306 PolarHBondContact O-N 3.18Å; D304-E307 WeakPolarHBondContact O-CB 3.34Å; D304-E307 PolarHBondContact O-N 3.14Å; D304-E307 VanDerWaalsContact O-N 3.13Å; D304-Y308 HydrophobicContact CB-CD2 4.48Å; D304-Y308 HydrophobicContact CB-CE2 4.09Å; D304-Y308 WeakPolarHBondContact O-CD2 3.26Å; D304-Y308 PolarHBondContact O-N 3.44Å |
| 305 | A | 93.6 | Very high | 94.4 | Very high | 59 Ų | 59 | 94.5 Ų | 94.5 | 49% | 0.488 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -58.3 | -39.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | A301 Q303 R309 | A301-A305 VanDerWaalsContact O-CB 3.3Å; A301-A305 WeakPolarHBondContact O-CB 3.19Å; A301-A305 PolarHBondContact O-N 3.37Å; Q303-A305 PolarHBondContact O-N 3.06Å; A305-R309 WeakPolarHBondContact O-CB 3.39Å; A305-R309 PolarHBondContact O-N 3.24Å |
| 306 | N | 94.6 | Very high | 94.1 | Very high | 87 Ų | 87 | 93.5 Ų | 93.5 | 47% | 0.465 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -70.1 | -37.4 | 175.6 | -76.8 | -48.8 | 0 | 0 | 0 | 112.5 | K302 Q303 D304 R309 R310 | K302-N306 PolarHBondContact O-N 3.45Å; K302-N306 VanDerWaalsContact O-N 3.1Å; K302-N306 PolarHBondContact O-ND2 3.08Å; Q303-N306 WeakPolarHBondContact O-CB 3.35Å; Q303-N306 PolarHBondContact O-N 3.49Å; Q303-N306 VanDerWaalsContact O-N 3.13Å; D304-N306 VanDerWaalsContact C-N 3.28Å; D304-N306 PolarHBondContact O-N 3.18Å; N306-R309 PolarHBondContact O-N 2.9Å; N306-R310 WeakPolarHBondContact O-CG 3.36Å; N306-R310 PolarHBondContact O-N 2.92Å |
| 307 | E | 96.3 | Very high | 93.9 | Very high | 89 Ų | 89 | 92.9 Ų | 92.9 | 42% | 0.416 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -61.6 | -50.1 | 174.9 | -160.9 | 78.1 | -152.6 | 0 | 0 | 110.4 | Q303 D304 R309 R310 Q311 | Q303-E307 PolarHBondContact O-N 3.42Å; D304-E307 WeakPolarHBondContact O-CB 3.34Å; D304-E307 PolarHBondContact O-N 3.14Å; D304-E307 VanDerWaalsContact O-N 3.13Å; E307-R309 VanDerWaalsContact C-N 3.31Å; E307-R309 PolarHBondContact O-N 2.83Å; E307-R310 WeakPolarHBondContact O-CB 3.37Å; E307-R310 PolarHBondContact O-N 2.86Å; E307-R310 VanDerWaalsContact O-N 3.11Å; E307-Q311 WeakPolarHBondContact O-CG 3.45Å; E307-Q311 PolarHBondContact O-N 2.97Å |
| 308 | Y | 90.9 | Very high | 93.8 | Very high | 149 Ų | 149 | 94 Ų | 94 | 58% | 0.584 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -60.4 | -40.5 | 176 | -67 | -53.3 | 0 | 0 | 0 | 111.9 | D304 R310 Q311 V312 | D304-Y308 HydrophobicContact CB-CD2 4.48Å; D304-Y308 HydrophobicContact CB-CE2 4.09Å; D304-Y308 WeakPolarHBondContact O-CD2 3.26Å; D304-Y308 PolarHBondContact O-N 3.44Å; Y308-R310 VanDerWaalsContact C-N 3.32Å; Y308-R310 PolarHBondContact O-N 3.49Å; Y308-Q311 PolarHBondContact O-N 3.47Å; Y308-V312 WeakPolarHBondContact O-CG2 3.47Å; Y308-V312 PolarHBondContact O-N 2.91Å |
| 309 | R | 92.9 | Very high | 93.2 | Very high | 150 Ų | 150 | 94.5 Ų | 94.5 | 57% | 0.566 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -60.8 | -40.7 | 175.1 | -161.8 | -176.9 | 85.7 | 99.1 | 1.4 | 112.2 | A305 N306 E307 Q313 | A305-R309 WeakPolarHBondContact O-CB 3.39Å; A305-R309 PolarHBondContact O-N 3.24Å; N306-R309 PolarHBondContact O-N 2.9Å; E307-R309 VanDerWaalsContact C-N 3.31Å; E307-R309 PolarHBondContact O-N 2.83Å; R309-Q313 VanDerWaalsContact NH1-NE2 3.19Å; R309-Q313 WeakPolarHBondContact O-CG 3.41Å; R309-Q313 PolarHBondContact O-N 2.99Å; R309-Q313 VanDerWaalsContact O-N 3.11Å |
| 310 | R | 95.2 | Very high | 92.9 | Very high | 163 Ų | 163 | 93.5 Ų | 93.5 | 62% | 0.615 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -67.2 | -41.8 | 175.8 | -72.9 | 173.7 | -179.6 | 167.1 | 0 | 111.8 | N306 E307 Y308 Q313 A314 | N306-R310 WeakPolarHBondContact O-CG 3.36Å; N306-R310 PolarHBondContact O-N 2.92Å; E307-R310 WeakPolarHBondContact O-CB 3.37Å; E307-R310 PolarHBondContact O-N 2.86Å; E307-R310 VanDerWaalsContact O-N 3.11Å; Y308-R310 VanDerWaalsContact C-N 3.32Å; Y308-R310 PolarHBondContact O-N 3.49Å; R310-Q313 PolarHBondContact O-N 3.35Å; R310-A314 PolarHBondContact O-N 2.94Å |
| 311 | Q | 95.3 | Very high | 92.6 | Very high | 94 Ų | 94 | 92.7 Ų | 92.7 | 44% | 0.439 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61.5 | -44.7 | 176.5 | -71.3 | 176.2 | 28.2 | 0 | 0 | 111.6 | E307 Y308 Q313 A314 L315 | E307-Q311 WeakPolarHBondContact O-CG 3.45Å; E307-Q311 PolarHBondContact O-N 2.97Å; Y308-Q311 PolarHBondContact O-N 3.47Å; Q311-Q313 VanDerWaalsContact C-N 3.31Å; Q311-Q313 PolarHBondContact O-N 3.46Å; Q311-A314 PolarHBondContact O-N 2.9Å; Q311-L315 WeakPolarHBondContact O-CB 3.49Å; Q311-L315 WeakPolarHBondContact O-CG 3.41Å; Q311-L315 PolarHBondContact O-N 3.46Å |
| 312 | V | 91.4 | Very high | 92.3 | Very high | 91 Ų | 91 | 96.6 Ų | 96.6 | 55% | 0.552 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -59 | -44 | 174.9 | 171.1 | 0 | 0 | 0 | 0 | 110.8 | Y308 T316 | Y308-V312 WeakPolarHBondContact O-CG2 3.47Å; Y308-V312 PolarHBondContact O-N 2.91Å; V312-T316 WeakPolarHBondContact O-CB 3.31Å; V312-T316 PolarHBondContact O-N 3.5Å; V312-T316 PolarHBondContact O-OG1 3.37Å |
| 313 | Q | 93.2 | Very high | 92 | Very high | 91 Ų | 91 | 97.8 Ų | 97.8 | 43% | 0.425 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.5 | -43.7 | 177.2 | -74 | 176.7 | -6.9 | 0 | 0 | 112.5 | R309 R310 Q311 T316 C317 | R309-Q313 VanDerWaalsContact NH1-NE2 3.19Å; R309-Q313 WeakPolarHBondContact O-CG 3.41Å; R309-Q313 PolarHBondContact O-N 2.99Å; R309-Q313 VanDerWaalsContact O-N 3.11Å; R310-Q313 PolarHBondContact O-N 3.35Å; Q311-Q313 VanDerWaalsContact C-N 3.31Å; Q311-Q313 PolarHBondContact O-N 3.46Å; Q313-T316 PolarHBondContact O-N 2.91Å; Q313-C317 PolarHBondContact O-N 3.27Å; Q313-C317 PolarHBondContact O-SG 3.38Å |
| 314 | A | 91 | Very high | 91.7 | Very high | 52 Ų | 52 | 95 Ų | 95 | 43% | 0.43 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.7 | -49.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | R310 Q311 T316 C317 D318 | R310-A314 PolarHBondContact O-N 2.94Å; Q311-A314 PolarHBondContact O-N 2.9Å; A314-T316 VanDerWaalsContact C-N 3.27Å; A314-T316 PolarHBondContact O-N 3.47Å; A314-C317 WeakPolarHBondContact O-CB 3.39Å; A314-C317 PolarHBondContact O-N 3.01Å; A314-C317 VanDerWaalsContact O-N 3.13Å; A314-D318 PolarHBondContact O-N 3.08Å |
| 315 | L | 89.3 | Confident | 91.5 | Very high | 109 Ų | 109 | 95.7 Ų | 95.7 | 57% | 0.571 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -61.2 | -36.1 | 176.2 | -71 | 173.3 | 0 | 0 | 0 | 112.3 | Q311 D318 L319 | Q311-L315 WeakPolarHBondContact O-CB 3.49Å; Q311-L315 WeakPolarHBondContact O-CG 3.41Å; Q311-L315 PolarHBondContact O-N 3.46Å; L315-D318 PolarHBondContact O-N 2.97Å; L315-L319 WeakPolarHBondContact O-CB 3.4Å; L315-L319 VanDerWaalsContact O-CG 3.31Å; L315-L319 WeakPolarHBondContact O-CG 3.31Å; L315-L319 PolarHBondContact O-N 2.91Å |
| 316 | T | 90.4 | Very high | 90.9 | Very high | 64 Ų | 64 | 96.8 Ų | 96.8 | 39% | 0.393 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63.9 | -44.7 | 174.8 | -54.1 | 0 | 0 | 0 | 0 | 111 | V312 Q313 A314 D318 L319 D320 | V312-T316 WeakPolarHBondContact O-CB 3.31Å; V312-T316 PolarHBondContact O-N 3.5Å; V312-T316 PolarHBondContact O-OG1 3.37Å; Q313-T316 PolarHBondContact O-N 2.91Å; A314-T316 VanDerWaalsContact C-N 3.27Å; A314-T316 PolarHBondContact O-N 3.47Å; T316-D318 PolarHBondContact O-N 2.83Å; T316-L319 PolarHBondContact O-N 2.88Å; T316-D320 PolarHBondContact O-N 3.4Å |
| 317 | C | 94.4 | Very high | 90.8 | Very high | 84 Ų | 84 | 97.6 Ų | 97.6 | 57% | 0.568 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63.3 | -41.9 | 177 | -64.4 | 0 | 0 | 0 | 0 | 111.9 | Q313 A314 D320 A321 | Q313-C317 PolarHBondContact O-N 3.27Å; Q313-C317 PolarHBondContact O-SG 3.38Å; A314-C317 WeakPolarHBondContact O-CB 3.39Å; A314-C317 PolarHBondContact O-N 3.01Å; A314-C317 VanDerWaalsContact O-N 3.13Å; C317-D320 PolarHBondContact O-N 3.47Å; C317-A321 WeakPolarHBondContact O-CB 3.45Å; C317-A321 PolarHBondContact O-N 3.27Å |
| 318 | D | 92 | Very high | 90.5 | Very high | 86 Ų | 86 | 95.5 Ų | 95.5 | 46% | 0.46 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64 | -42.6 | 176.6 | -70.8 | -17.9 | 0 | 0 | 0 | 111.1 | A314 L315 T316 D320 A321 F322 | A314-D318 PolarHBondContact O-N 3.08Å; L315-D318 PolarHBondContact O-N 2.97Å; T316-D318 PolarHBondContact O-N 2.83Å; D318-D320 PolarHBondContact O-N 3.01Å; D318-A321 PolarHBondContact O-N 3.48Å; D318-F322 HydrophobicContact CB-CE2 4.27Å; D318-F322 WeakPolarHBondContact O-CD2 3.41Å; D318-F322 WeakPolarHBondContact O-CG 3.26Å; D318-F322 PolarHBondContact O-N 3.45Å |
| 319 | L | 84.5 | Confident | 90.4 | Very high | 97 Ų | 97 | 93.3 Ų | 93.3 | 51% | 0.508 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -59.6 | -45.5 | 174.6 | -78.9 | 172.5 | 0 | 0 | 0 | 112.1 | L315 T316 A321 F322 R323 | L315-L319 WeakPolarHBondContact O-CB 3.4Å; L315-L319 VanDerWaalsContact O-CG 3.31Å; L315-L319 WeakPolarHBondContact O-CG 3.31Å; L315-L319 PolarHBondContact O-N 2.91Å; T316-L319 PolarHBondContact O-N 2.88Å; L319-A321 VanDerWaalsContact C-N 3.34Å; L319-F322 PolarHBondContact O-N 2.88Å; L319-R323 WeakPolarHBondContact O-CB 3.39Å; L319-R323 VanDerWaalsContact O-CG 3.29Å; L319-R323 WeakPolarHBondContact O-CG 3.35Å; L319-R323 PolarHBondContact O-N 3.02Å |
| 320 | D | 91.7 | Very high | 90.2 | Very high | 81 Ų | 81 | 90.1 Ų | 90.1 | 43% | 0.433 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -68.4 | -34.9 | 178.6 | -69.6 | -23.7 | 0 | 0 | 0 | 111.9 | T316 C317 D318 R323 G324 | T316-D320 PolarHBondContact O-N 3.4Å; C317-D320 PolarHBondContact O-N 3.47Å; D318-D320 PolarHBondContact O-N 3.01Å; D320-R323 PolarHBondContact O-N 2.67Å; D320-R323 IonicContact OD1-NH1 2.65Å; D320-R323 PolarHBondContact OD1-NH1 3.22Å; D320-R323 VanDerWaalsContact OD1-NH1 3.11Å; D320-G324 PolarHBondContact O-N 2.92Å |
| 321 | A | 89.9 | Confident | 90.2 | Very high | 59 Ų | 59 | 87.6 Ų | 87.6 | 49% | 0.488 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -63 | -47.1 | 171.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | C317 D318 L319 G324 T325 | C317-A321 WeakPolarHBondContact O-CB 3.45Å; C317-A321 PolarHBondContact O-N 3.27Å; D318-A321 PolarHBondContact O-N 3.48Å; L319-A321 VanDerWaalsContact C-N 3.34Å; A321-G324 PolarHBondContact O-N 3.23Å; A321-T325 WeakPolarHBondContact O-CG2 3.37Å; A321-T325 PolarHBondContact O-N 2.87Å |
| 322 | F | 85.6 | Confident | 90 | Very high | 142 Ų | 142 | 87.8 Ų | 87.8 | 62% | 0.623 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -63.8 | -41 | 176.9 | -71.4 | -52.4 | 0 | 0 | 0 | 112.1 | D318 L319 G324 T325 N326 | D318-F322 HydrophobicContact CB-CE2 4.27Å; D318-F322 WeakPolarHBondContact O-CD2 3.41Å; D318-F322 WeakPolarHBondContact O-CG 3.26Å; D318-F322 PolarHBondContact O-N 3.45Å; L319-F322 PolarHBondContact O-N 2.88Å; F322-G324 PolarHBondContact O-N 2.98Å; F322-T325 WeakPolarHBondContact CA-OG1 3.23Å; F322-T325 PolarHBondContact O-N 2.69Å; F322-T325 PolarHBondContact O-OG1 3.38Å; F322-N326 WeakPolarHBondContact O-CB 3.25Å; F322-N326 PolarHBondContact O-N 2.82Å |
| 323 | R | 90 | Very high | 90 | Very high | 152 Ų | 152 | 88 Ų | 88 | 57% | 0.574 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -56.7 | -48.4 | 171.9 | -76.7 | 171.4 | 175.1 | 165.7 | -4.6 | 111.5 | L319 D320 T325 N326 E327 | L319-R323 WeakPolarHBondContact O-CB 3.39Å; L319-R323 VanDerWaalsContact O-CG 3.29Å; L319-R323 WeakPolarHBondContact O-CG 3.35Å; L319-R323 PolarHBondContact O-N 3.02Å; D320-R323 PolarHBondContact O-N 2.67Å; D320-R323 IonicContact OD1-NH1 2.65Å; D320-R323 PolarHBondContact OD1-NH1 3.22Å; D320-R323 VanDerWaalsContact OD1-NH1 3.11Å; R323-T325 VanDerWaalsContact C-N 3.33Å; R323-T325 PolarHBondContact O-N 2.64Å; R323-N326 PolarHBondContact O-N 3.25Å; R323-N326 VanDerWaalsContact O-N 3.14Å; R323-E327 WeakPolarHBondContact O-CG 3.33Å; R323-E327 PolarHBondContact O-N 2.83Å |
| 324 | G | 89.1 | Confident | 90 | Very high | 34 Ų | 34 | 89.6 Ų | 89.6 | 35% | 0.351 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -60.2 | -39.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | D320 A321 F322 S328 | D320-G324 PolarHBondContact O-N 2.92Å; A321-G324 PolarHBondContact O-N 3.23Å; F322-G324 PolarHBondContact O-N 2.98Å; G324-S328 WeakPolarHBondContact O-CB 3.45Å; G324-S328 PolarHBondContact O-N 3.03Å; G324-S328 VanDerWaalsContact O-N 3.1Å |
| 325 | T | 89.2 | Confident | 90.2 | Very high | 77 Ų | 77 | 92.5 Ų | 92.5 | 47% | 0.472 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -66.3 | -40.3 | 174 | 59.9 | 0 | 0 | 0 | 0 | 112.3 | A321 F322 R323 S328 L329 | A321-T325 WeakPolarHBondContact O-CG2 3.37Å; A321-T325 PolarHBondContact O-N 2.87Å; F322-T325 WeakPolarHBondContact CA-OG1 3.23Å; F322-T325 PolarHBondContact O-N 2.69Å; F322-T325 PolarHBondContact O-OG1 3.38Å; R323-T325 VanDerWaalsContact C-N 3.33Å; R323-T325 PolarHBondContact O-N 2.64Å; T325-S328 WeakPolarHBondContact O-CB 3.48Å; T325-S328 PolarHBondContact O-N 3.34Å; T325-L329 WeakPolarHBondContact O-CG 3.45Å; T325-L329 PolarHBondContact O-N 3.27Å |
| 326 | N | 81.6 | Confident | 90.4 | Very high | 82 Ų | 82 | 91.5 Ų | 91.5 | 44% | 0.439 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -65.5 | -47.4 | 179.4 | -168.3 | 42.9 | 0 | 0 | 0 | 111.1 | F322 R323 S328 L329 E330 | F322-N326 WeakPolarHBondContact O-CB 3.25Å; F322-N326 PolarHBondContact O-N 2.82Å; R323-N326 PolarHBondContact O-N 3.25Å; R323-N326 VanDerWaalsContact O-N 3.14Å; N326-S328 PolarHBondContact O-N 3.5Å; N326-L329 PolarHBondContact O-N 3.45Å; N326-L329 VanDerWaalsContact O-N 3.08Å; N326-E330 PolarHBondContact ND2-OE1 3.46Å; N326-E330 WeakPolarHBondContact O-CG 3.45Å; N326-E330 PolarHBondContact O-N 2.87Å |
| 327 | E | 92.4 | Very high | 90.5 | Very high | 103 Ų | 103 | 93.8 Ų | 93.8 | 48% | 0.481 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -58.6 | -34.9 | 174.4 | -68.7 | 177.2 | -170.1 | 0 | 0 | 112.4 | R323 R331 | R323-E327 WeakPolarHBondContact O-CG 3.33Å; R323-E327 PolarHBondContact O-N 2.83Å; E327-R331 VanDerWaalsContact CB-NH2 3.32Å; E327-R331 WeakPolarHBondContact O-CB 3.46Å; E327-R331 WeakPolarHBondContact O-CG 3.43Å; E327-R331 PolarHBondContact O-N 2.88Å; E327-R331 IonicContact OE2-NH2 3.97Å; E327-R331 PolarHBondContact OE2-NH2 3.23Å |
| 328 | S | 91.4 | Very high | 90.5 | Very high | 46 Ų | 46 | 94.7 Ų | 94.7 | 32% | 0.322 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -67.7 | -41.9 | 174.9 | -170.8 | 0 | 0 | 0 | 0 | 112.8 | G324 T325 N326 R331 Q332 | G324-S328 WeakPolarHBondContact O-CB 3.45Å; G324-S328 PolarHBondContact O-N 3.03Å; G324-S328 VanDerWaalsContact O-N 3.1Å; T325-S328 WeakPolarHBondContact O-CB 3.48Å; T325-S328 PolarHBondContact O-N 3.34Å; N326-S328 PolarHBondContact O-N 3.5Å; S328-R331 VanDerWaalsContact CA-NH1 3.32Å; S328-R331 PolarHBondContact O-N 3.39Å; S328-Q332 WeakPolarHBondContact O-CG 3.44Å; S328-Q332 PolarHBondContact O-N 3.21Å |
| 329 | L | 88.1 | Confident | 90.8 | Very high | 103 Ų | 103 | 96.6 Ų | 96.6 | 54% | 0.539 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -67.2 | -41 | 176.7 | -70.3 | 172.4 | 0 | 0 | 0 | 111.1 | T325 N326 R331 Q332 L333 | T325-L329 WeakPolarHBondContact O-CG 3.45Å; T325-L329 PolarHBondContact O-N 3.27Å; N326-L329 PolarHBondContact O-N 3.45Å; N326-L329 VanDerWaalsContact O-N 3.08Å; L329-R331 VanDerWaalsContact C-N 3.34Å; L329-R331 PolarHBondContact O-N 2.88Å; L329-Q332 PolarHBondContact O-N 3.38Å; L329-L333 WeakPolarHBondContact O-CB 3.5Å; L329-L333 PolarHBondContact O-N 3.47Å |
| 330 | E | 89.6 | Confident | 91.2 | Very high | 83 Ų | 83 | 95.7 Ų | 95.7 | 39% | 0.388 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -61.9 | -40.4 | 174.2 | -71.5 | 175.5 | -167.5 | 0 | 0 | 112.1 | N326 L333 R334 | N326-E330 PolarHBondContact ND2-OE1 3.46Å; N326-E330 WeakPolarHBondContact O-CG 3.45Å; N326-E330 PolarHBondContact O-N 2.87Å; E330-L333 PolarHBondContact O-N 3.37Å; E330-R334 WeakPolarHBondContact O-CG 3.45Å; E330-R334 PolarHBondContact O-N 3.37Å; E330-R334 IonicContact OE2-NH2 3.08Å; E330-R334 PolarHBondContact OE2-NH2 3.46Å |
| 331 | R | 93.3 | Very high | 91.3 | Very high | 109 Ų | 109 | 94.7 Ų | 94.7 | 41% | 0.411 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -62.1 | -46.3 | 173.1 | -79.8 | -177.3 | -112.7 | 103.7 | 0.5 | 111.6 | E327 S328 L329 L333 R334 E335 | E327-R331 VanDerWaalsContact CB-NH2 3.32Å; E327-R331 WeakPolarHBondContact O-CB 3.46Å; E327-R331 WeakPolarHBondContact O-CG 3.43Å; E327-R331 PolarHBondContact O-N 2.88Å; E327-R331 IonicContact OE2-NH2 3.97Å; E327-R331 PolarHBondContact OE2-NH2 3.23Å; S328-R331 VanDerWaalsContact CA-NH1 3.32Å; S328-R331 PolarHBondContact O-N 3.39Å; L329-R331 VanDerWaalsContact C-N 3.34Å; L329-R331 PolarHBondContact O-N 2.88Å; R331-L333 VanDerWaalsContact C-N 3.3Å; R331-L333 PolarHBondContact O-N 2.96Å; R331-R334 PolarHBondContact O-N 2.97Å; R331-E335 WeakPolarHBondContact O-CG 3.49Å; R331-E335 PolarHBondContact O-N 3.26Å |
| 332 | Q | 92.6 | Very high | 91.6 | Very high | 99 Ų | 99 | 97.9 Ų | 97.9 | 46% | 0.463 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -62.4 | -36.6 | 177.2 | -74.8 | 177.5 | -14.3 | 0 | 0 | 112.8 | S328 L329 E335 L336 | S328-Q332 WeakPolarHBondContact O-CG 3.44Å; S328-Q332 PolarHBondContact O-N 3.21Å; L329-Q332 PolarHBondContact O-N 3.38Å; Q332-E335 PolarHBondContact O-N 3.11Å; Q332-L336 WeakPolarHBondContact O-CB 3.26Å; Q332-L336 WeakPolarHBondContact O-CG 3.35Å; Q332-L336 PolarHBondContact O-N 2.87Å |
| 333 | L | 90.1 | Very high | 92.2 | Very high | 94 Ų | 94 | 96.5 Ų | 96.5 | 49% | 0.492 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -66.2 | -46.7 | 176.9 | -173.6 | 143.6 | 0 | 0 | 0 | 110.9 | L329 E330 R331 E335 L336 E337 | L329-L333 WeakPolarHBondContact O-CB 3.5Å; L329-L333 PolarHBondContact O-N 3.47Å; E330-L333 PolarHBondContact O-N 3.37Å; R331-L333 VanDerWaalsContact C-N 3.3Å; R331-L333 PolarHBondContact O-N 2.96Å; L333-E335 PolarHBondContact O-N 2.88Å; L333-L336 WeakPolarHBondContact O-CB 3.49Å; L333-L336 PolarHBondContact O-N 2.98Å; L333-L336 VanDerWaalsContact O-N 3.11Å; L333-E337 VanDerWaalsContact CD2-CD 3.42Å; L333-E337 HydrophobicContact CD2-CG 4.22Å; L333-E337 VanDerWaalsContact CD2-OE1 3.25Å; L333-E337 WeakPolarHBondContact CD2-OE1 3.38Å; L333-E337 WeakPolarHBondContact O-CG 3.45Å; L333-E337 PolarHBondContact O-N 3.44Å |
| 334 | R | 93.6 | Very high | 92.4 | Very high | 126 Ų | 126 | 92 Ų | 92 | 48% | 0.475 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -60 | -43.9 | 173.9 | -69.2 | 179.2 | -130.5 | 141.4 | 0.9 | 112.2 | E330 R331 L336 E337 D338 | E330-R334 WeakPolarHBondContact O-CG 3.45Å; E330-R334 PolarHBondContact O-N 3.37Å; E330-R334 IonicContact OE2-NH2 3.08Å; E330-R334 PolarHBondContact OE2-NH2 3.46Å; R331-R334 PolarHBondContact O-N 2.97Å; R334-L336 PolarHBondContact O-N 3.19Å; R334-E337 PolarHBondContact O-N 2.93Å; R334-D338 WeakPolarHBondContact O-CB 3.41Å; R334-D338 PolarHBondContact O-N 3.14Å |
| 335 | E | 96.5 | Very high | 92.7 | Very high | 112 Ų | 112 | 92.8 Ų | 92.8 | 52% | 0.523 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63.2 | -29.2 | 175.8 | -72.9 | 170.5 | -166.6 | 0 | 0 | 113.1 | R331 Q332 L333 R339 | R331-E335 WeakPolarHBondContact O-CG 3.49Å; R331-E335 PolarHBondContact O-N 3.26Å; Q332-E335 PolarHBondContact O-N 3.11Å; L333-E335 PolarHBondContact O-N 2.88Å; E335-R339 WeakPolarHBondContact O-CB 3.41Å; E335-R339 VanDerWaalsContact O-CG 3.27Å; E335-R339 WeakPolarHBondContact O-CG 3.5Å; E335-R339 PolarHBondContact O-N 2.94Å; E335-R339 PolarHBondContact O-NE 3.3Å; E335-R339 VanDerWaalsContact O-NE 3.16Å |
| 336 | L | 92.6 | Very high | 93.1 | Very high | 89 Ų | 89 | 90.7 Ų | 90.7 | 47% | 0.466 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -75.1 | -45.3 | 173 | -80.5 | 165.7 | 0 | 0 | 0 | 111.2 | Q332 L333 R334 R339 C340 | Q332-L336 WeakPolarHBondContact O-CB 3.26Å; Q332-L336 WeakPolarHBondContact O-CG 3.35Å; Q332-L336 PolarHBondContact O-N 2.87Å; L333-L336 WeakPolarHBondContact O-CB 3.49Å; L333-L336 PolarHBondContact O-N 2.98Å; L333-L336 VanDerWaalsContact O-N 3.11Å; R334-L336 PolarHBondContact O-N 3.19Å; L336-R339 PolarHBondContact O-N 3.27Å; L336-C340 WeakPolarHBondContact O-CB 3.46Å; L336-C340 PolarHBondContact O-N 3.21Å; L336-C340 PolarHBondContact O-SG 3.42Å |
| 337 | E | 92.8 | Very high | 93.8 | Very high | 112 Ų | 112 | 94.2 Ų | 94.2 | 52% | 0.523 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -58.3 | -47.3 | 175.8 | -71.5 | 173.6 | 156.4 | 0 | 0 | 111.3 | L333 R334 R339 C340 A341 | L333-E337 VanDerWaalsContact CD2-CD 3.42Å; L333-E337 HydrophobicContact CD2-CG 4.22Å; L333-E337 VanDerWaalsContact CD2-OE1 3.25Å; L333-E337 WeakPolarHBondContact CD2-OE1 3.38Å; L333-E337 WeakPolarHBondContact O-CG 3.45Å; L333-E337 PolarHBondContact O-N 3.44Å; R334-E337 PolarHBondContact O-N 2.93Å; E337-R339 VanDerWaalsContact C-N 3.34Å; E337-R339 PolarHBondContact O-N 3.47Å; E337-C340 PolarHBondContact O-N 3.18Å; E337-A341 WeakPolarHBondContact O-CB 3.33Å; E337-A341 PolarHBondContact O-N 3.33Å |
| 338 | D | 94.9 | Very high | 94.1 | Very high | 103 Ų | 103 | 94.7 Ų | 94.7 | 55% | 0.551 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -61 | -42.1 | 177.1 | -73.6 | -19.3 | 0 | 0 | 0 | 111.6 | R334 A341 M342 | R334-D338 WeakPolarHBondContact O-CB 3.41Å; R334-D338 PolarHBondContact O-N 3.14Å; D338-A341 PolarHBondContact O-N 2.93Å; D338-M342 VanDerWaalsContact O-CG 3.32Å; D338-M342 WeakPolarHBondContact O-CG 3.41Å; D338-M342 PolarHBondContact O-N 2.94Å |
| 339 | R | 97.4 | Very high | 94.4 | Very high | 125 Ų | 125 | 97.9 Ų | 97.9 | 47% | 0.472 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.7 | -46.7 | 175.8 | -80.4 | -173.8 | -68.1 | 156.4 | -11 | 112.3 | E335 L336 E337 A341 M342 E343 | E335-R339 WeakPolarHBondContact O-CB 3.41Å; E335-R339 VanDerWaalsContact O-CG 3.27Å; E335-R339 WeakPolarHBondContact O-CG 3.5Å; E335-R339 PolarHBondContact O-N 2.94Å; E335-R339 PolarHBondContact O-NE 3.3Å; E335-R339 VanDerWaalsContact O-NE 3.16Å; L336-R339 PolarHBondContact O-N 3.27Å; E337-R339 VanDerWaalsContact C-N 3.34Å; E337-R339 PolarHBondContact O-N 3.47Å; R339-A341 VanDerWaalsContact C-N 3.29Å; R339-A341 PolarHBondContact O-N 3.38Å; R339-M342 HydrophobicContact CB-CE 4.44Å; R339-M342 HydrophobicContact CG-CE 3.94Å; R339-M342 PolarHBondContact O-N 2.97Å; R339-E343 WeakPolarHBondContact O-CG 3.27Å; R339-E343 PolarHBondContact O-N 3.37Å |
| 340 | C | 93.3 | Very high | 94.9 | Very high | 78 Ų | 78 | 96.2 Ų | 96.2 | 53% | 0.527 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.4 | -40 | 176 | -70.6 | 0 | 0 | 0 | 0 | 111.5 | L336 E337 E343 A344 | L336-C340 WeakPolarHBondContact O-CB 3.46Å; L336-C340 PolarHBondContact O-N 3.21Å; L336-C340 PolarHBondContact O-SG 3.42Å; E337-C340 PolarHBondContact O-N 3.18Å; C340-E343 PolarHBondContact O-N 3.23Å; C340-A344 VanDerWaalsContact O-CB 3.3Å; C340-A344 WeakPolarHBondContact O-CB 3.35Å; C340-A344 PolarHBondContact O-N 3.27Å |
| 341 | A | 94.1 | Very high | 95.3 | Very high | 60 Ų | 60 | 95.1 Ų | 95.1 | 50% | 0.496 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64 | -42.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | E337 D338 R339 A344 A345 | E337-A341 WeakPolarHBondContact O-CB 3.33Å; E337-A341 PolarHBondContact O-N 3.33Å; D338-A341 PolarHBondContact O-N 2.93Å; R339-A341 VanDerWaalsContact C-N 3.29Å; R339-A341 PolarHBondContact O-N 3.38Å; A341-A344 PolarHBondContact O-N 2.87Å; A341-A345 WeakPolarHBondContact O-CB 3.48Å; A341-A345 PolarHBondContact O-N 3.45Å |
| 342 | M | 96.3 | Very high | 95.5 | Very high | 127 Ų | 127 | 91.8 Ų | 91.8 | 63% | 0.626 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -63.8 | -42.8 | 174.3 | -73.1 | -174.5 | -67.1 | 0 | 0 | 112.3 | D338 R339 A345 G346 | D338-M342 VanDerWaalsContact O-CG 3.32Å; D338-M342 WeakPolarHBondContact O-CG 3.41Å; D338-M342 PolarHBondContact O-N 2.94Å; R339-M342 HydrophobicContact CB-CE 4.44Å; R339-M342 HydrophobicContact CG-CE 3.94Å; R339-M342 PolarHBondContact O-N 2.97Å; M342-A345 PolarHBondContact O-N 2.86Å; M342-G346 PolarHBondContact O-N 3.24Å |
| 343 | E | 96.7 | Very high | 95.8 | Very high | 112 Ų | 112 | 92.8 Ų | 92.8 | 52% | 0.523 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.1 | -43.8 | 176.3 | -73.2 | 177.3 | -165.9 | 0 | 0 | 111.3 | R339 C340 G346 Y347 | R339-E343 WeakPolarHBondContact O-CG 3.27Å; R339-E343 PolarHBondContact O-N 3.37Å; C340-E343 PolarHBondContact O-N 3.23Å; E343-G346 PolarHBondContact O-N 2.82Å; E343-Y347 HydrophobicContact CB-CE2 4.23Å; E343-Y347 WeakPolarHBondContact O-CD2 3.42Å; E343-Y347 PolarHBondContact O-N 2.86Å |
| 344 | A | 94.3 | Very high | 96.2 | Very high | 57 Ų | 57 | 92.2 Ų | 92.2 | 47% | 0.471 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -61.3 | -43.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | C340 A341 G346 Y347 Q348 | C340-A344 VanDerWaalsContact O-CB 3.3Å; C340-A344 WeakPolarHBondContact O-CB 3.35Å; C340-A344 PolarHBondContact O-N 3.27Å; A341-A344 PolarHBondContact O-N 2.87Å; A344-G346 VanDerWaalsContact C-N 3.34Å; A344-Y347 PolarHBondContact O-N 3.44Å; A344-Q348 WeakPolarHBondContact O-CB 3.48Å; A344-Q348 PolarHBondContact O-N 3.42Å |
| 345 | A | 96.3 | Very high | 96.4 | Very high | 51 Ų | 51 | 91.6 Ų | 91.6 | 42% | 0.421 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61 | -43.6 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | A341 M342 Y347 Q348 D349 | A341-A345 WeakPolarHBondContact O-CB 3.48Å; A341-A345 PolarHBondContact O-N 3.45Å; M342-A345 PolarHBondContact O-N 2.86Å; A345-Y347 PolarHBondContact O-N 3.16Å; A345-Q348 WeakPolarHBondContact O-CB 3.34Å; A345-Q348 PolarHBondContact O-N 3.26Å; A345-Q348 VanDerWaalsContact O-N 3.17Å; A345-D349 PolarHBondContact O-N 3.4Å |
| 346 | G | 98.1 | Very high | 96.5 | Very high | 33 Ų | 33 | 92.7 Ų | 92.7 | 34% | 0.34 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60.2 | -42.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113 | M342 E343 A344 D349 T350 | M342-G346 PolarHBondContact O-N 3.24Å; E343-G346 PolarHBondContact O-N 2.82Å; A344-G346 VanDerWaalsContact C-N 3.34Å; G346-D349 PolarHBondContact O-N 2.97Å; G346-T350 WeakPolarHBondContact O-CG2 3.38Å; G346-T350 PolarHBondContact O-N 3.07Å |
| 347 | Y | 96.1 | Very high | 96.8 | Very high | 157 Ų | 157 | 92.7 Ų | 92.7 | 62% | 0.616 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -64.1 | -42.6 | 173.6 | -66.3 | -53.3 | 0 | 0 | 0 | 111.6 | E343 A344 A345 D349 T350 V351 | E343-Y347 HydrophobicContact CB-CE2 4.23Å; E343-Y347 WeakPolarHBondContact O-CD2 3.42Å; E343-Y347 PolarHBondContact O-N 2.86Å; A344-Y347 PolarHBondContact O-N 3.44Å; A345-Y347 PolarHBondContact O-N 3.16Å; Y347-D349 VanDerWaalsContact C-N 3.35Å; Y347-D349 PolarHBondContact O-N 2.92Å; Y347-T350 WeakPolarHBondContact CA-OG1 3.38Å; Y347-T350 PolarHBondContact O-N 2.89Å; Y347-T350 VanDerWaalsContact O-N 3.16Å; Y347-T350 PolarHBondContact O-OG1 2.93Å; Y347-V351 WeakPolarHBondContact O-CG2 3.48Å; Y347-V351 PolarHBondContact O-N 3.36Å |
| 348 | Q | 97.6 | Very high | 97 | Very high | 112 Ų | 112 | 91.6 Ų | 91.6 | 52% | 0.523 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -59.9 | -44.7 | 176.9 | -172 | 60.6 | 34.8 | 0 | 0 | 111.6 | A344 A345 T350 V351 S352 | A344-Q348 WeakPolarHBondContact O-CB 3.48Å; A344-Q348 PolarHBondContact O-N 3.42Å; A345-Q348 WeakPolarHBondContact O-CB 3.34Å; A345-Q348 PolarHBondContact O-N 3.26Å; A345-Q348 VanDerWaalsContact O-N 3.17Å; Q348-T350 VanDerWaalsContact C-N 3.31Å; Q348-T350 PolarHBondContact O-N 3.29Å; Q348-V351 PolarHBondContact O-N 2.88Å; Q348-S352 PolarHBondContact O-N 2.86Å; Q348-S352 PolarHBondContact O-OG 3.36Å |
| 349 | D | 98.3 | Very high | 97.2 | Very high | 114 Ų | 114 | 91 Ų | 91 | 61% | 0.61 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -60.1 | -41.3 | 175.3 | -70.6 | -15 | 0 | 0 | 0 | 111.5 | A345 G346 Y347 S352 R353 | A345-D349 PolarHBondContact O-N 3.4Å; G346-D349 PolarHBondContact O-N 2.97Å; Y347-D349 VanDerWaalsContact C-N 3.35Å; Y347-D349 PolarHBondContact O-N 2.92Å; D349-S352 PolarHBondContact O-N 3.46Å; D349-R353 WeakPolarHBondContact O-CB 3.44Å; D349-R353 PolarHBondContact O-N 3.36Å |
| 350 | T | 98.4 | Very high | 97.2 | Very high | 67 Ų | 67 | 87.2 Ų | 87.2 | 41% | 0.411 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -66.3 | -37.3 | 176.5 | 62 | 0 | 0 | 0 | 0 | 112.8 | G346 Y347 Q348 L354 | G346-T350 WeakPolarHBondContact O-CG2 3.38Å; G346-T350 PolarHBondContact O-N 3.07Å; Y347-T350 WeakPolarHBondContact CA-OG1 3.38Å; Y347-T350 PolarHBondContact O-N 2.89Å; Y347-T350 VanDerWaalsContact O-N 3.16Å; Y347-T350 PolarHBondContact O-OG1 2.93Å; Q348-T350 VanDerWaalsContact C-N 3.31Å; Q348-T350 PolarHBondContact O-N 3.29Å; T350-L354 VanDerWaalsContact O-CG 3.29Å; T350-L354 WeakPolarHBondContact O-CG 3.25Å; T350-L354 PolarHBondContact O-N 2.99Å; T350-L354 VanDerWaalsContact O-N 3.1Å |
| 351 | V | 97.9 | Very high | 97.5 | Very high | 61 Ų | 61 | 88.7 Ų | 88.7 | 37% | 0.37 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -64.4 | -50.2 | 174.5 | 171.1 | 0 | 0 | 0 | 0 | 109.5 | Y347 Q348 R353 L354 E355 | Y347-V351 WeakPolarHBondContact O-CG2 3.48Å; Y347-V351 PolarHBondContact O-N 3.36Å; Q348-V351 PolarHBondContact O-N 2.88Å; V351-R353 VanDerWaalsContact C-N 3.33Å; V351-R353 PolarHBondContact O-N 2.78Å; V351-L354 PolarHBondContact O-N 3.29Å; V351-E355 HydrophobicContact CG1-CG 4.24Å; V351-E355 WeakPolarHBondContact O-CG 3Å; V351-E355 PolarHBondContact O-N 3.37Å |
| 352 | S | 98.1 | Very high | 97.7 | Very high | 38 Ų | 38 | 91.9 Ų | 91.9 | 27% | 0.266 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -59 | -42.4 | 178.8 | -65.8 | 0 | 0 | 0 | 0 | 112.4 | Q348 D349 L354 E355 E356 | Q348-S352 PolarHBondContact O-N 2.86Å; Q348-S352 PolarHBondContact O-OG 3.36Å; D349-S352 PolarHBondContact O-N 3.46Å; S352-L354 VanDerWaalsContact C-N 3.35Å; S352-L354 PolarHBondContact O-N 2.9Å; S352-E355 PolarHBondContact O-N 3.05Å; S352-E356 WeakPolarHBondContact O-CG 3.38Å; S352-E356 PolarHBondContact O-N 3.43Å |
| 353 | R | 98.5 | Very high | 97.8 | Very high | 120 Ų | 120 | 91.4 Ų | 91.4 | 45% | 0.453 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -60.1 | -42.6 | 173.9 | -173.2 | -171.4 | 65.2 | 80.6 | 10.1 | 112.3 | D349 V351 E356 E357 | D349-R353 WeakPolarHBondContact O-CB 3.44Å; D349-R353 PolarHBondContact O-N 3.36Å; V351-R353 VanDerWaalsContact C-N 3.33Å; V351-R353 PolarHBondContact O-N 2.78Å; R353-E356 PolarHBondContact O-N 2.88Å; R353-E357 IonicContact CZ-OE1 3.52Å; R353-E357 IonicContact NH1-OE1 2.59Å; R353-E357 PolarHBondContact NH1-OE1 3.04Å; R353-E357 IonicContact NH1-OE2 3.92Å; R353-E357 PolarHBondContact NH1-OE2 3.25Å; R353-E357 WeakPolarHBondContact O-CG 3.41Å; R353-E357 PolarHBondContact O-N 3.24Å |
| 354 | L | 98.2 | Very high | 97.9 | Very high | 82 Ų | 82 | 90.3 Ų | 90.3 | 43% | 0.429 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -68.8 | -37 | 178.2 | -71.4 | 172.6 | 0 | 0 | 0 | 111.9 | T350 V351 S352 E357 I358 | T350-L354 VanDerWaalsContact O-CG 3.29Å; T350-L354 WeakPolarHBondContact O-CG 3.25Å; T350-L354 PolarHBondContact O-N 2.99Å; T350-L354 VanDerWaalsContact O-N 3.1Å; V351-L354 PolarHBondContact O-N 3.29Å; S352-L354 VanDerWaalsContact C-N 3.35Å; S352-L354 PolarHBondContact O-N 2.9Å; L354-E357 PolarHBondContact O-N 2.96Å; L354-I358 VanDerWaalsContact O-CG1 3.26Å; L354-I358 WeakPolarHBondContact O-CG1 3.49Å; L354-I358 PolarHBondContact O-N 3.47Å |
| 355 | E | 98.1 | Very high | 98 | Very high | 113 Ų | 113 | 93.3 Ų | 93.3 | 53% | 0.528 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -63 | -43.2 | 173.9 | -71.7 | 174.9 | 157 | 0 | 0 | 111.4 | V351 S352 I358 Q359 | V351-E355 HydrophobicContact CG1-CG 4.24Å; V351-E355 WeakPolarHBondContact O-CG 3Å; V351-E355 PolarHBondContact O-N 3.37Å; S352-E355 PolarHBondContact O-N 3.05Å; E355-I358 PolarHBondContact O-N 3.35Å; E355-Q359 WeakPolarHBondContact O-CB 3.5Å; E355-Q359 PolarHBondContact O-N 3.14Å |
| 356 | E | 98.3 | Very high | 98.1 | Very high | 135 Ų | 135 | 93.7 Ų | 93.7 | 63% | 0.631 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -61 | -44.3 | 173.4 | -73.9 | 174 | -173.7 | 0 | 0 | 111.9 | S352 R353 I358 Q359 A360 | S352-E356 WeakPolarHBondContact O-CG 3.38Å; S352-E356 PolarHBondContact O-N 3.43Å; R353-E356 PolarHBondContact O-N 2.88Å; E356-I358 PolarHBondContact O-N 2.83Å; E356-Q359 PolarHBondContact O-N 3.36Å; E356-A360 WeakPolarHBondContact O-CB 3.3Å; E356-A360 PolarHBondContact O-N 2.94Å |
| 357 | E | 98.5 | Very high | 98.1 | Very high | 89 Ų | 89 | 97 Ų | 97 | 42% | 0.416 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62.3 | -42.3 | 176.2 | -76.5 | 175.4 | 177.1 | 0 | 0 | 112 | R353 L354 Q359 A360 L361 | R353-E357 IonicContact CZ-OE1 3.52Å; R353-E357 IonicContact NH1-OE1 2.59Å; R353-E357 PolarHBondContact NH1-OE1 3.04Å; R353-E357 IonicContact NH1-OE2 3.92Å; R353-E357 PolarHBondContact NH1-OE2 3.25Å; R353-E357 WeakPolarHBondContact O-CG 3.41Å; R353-E357 PolarHBondContact O-N 3.24Å; L354-E357 PolarHBondContact O-N 2.96Å; E357-Q359 VanDerWaalsContact C-N 3.32Å; E357-Q359 PolarHBondContact O-N 2.99Å; E357-A360 PolarHBondContact O-N 3.38Å; E357-L361 WeakPolarHBondContact O-CB 3.45Å; E357-L361 VanDerWaalsContact O-CG 3.3Å; E357-L361 WeakPolarHBondContact O-CG 3.31Å; E357-L361 PolarHBondContact O-N 3.2Å |
| 358 | I | 98.3 | Very high | 98.2 | Very high | 90 Ų | 90 | 93.1 Ų | 93.1 | 46% | 0.462 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -62.3 | -43.1 | 174.8 | -71.8 | 165.7 | 0 | 0 | 0 | 110.4 | L354 E355 E356 L361 K362 | L354-I358 VanDerWaalsContact O-CG1 3.26Å; L354-I358 WeakPolarHBondContact O-CG1 3.49Å; L354-I358 PolarHBondContact O-N 3.47Å; E355-I358 PolarHBondContact O-N 3.35Å; E356-I358 PolarHBondContact O-N 2.83Å; I358-L361 PolarHBondContact O-N 3.23Å; I358-K362 HydrophobicContact CG2-CD 4.21Å; I358-K362 VanDerWaalsContact O-CG 3.31Å; I358-K362 WeakPolarHBondContact O-CG 3.43Å; I358-K362 PolarHBondContact O-N 3.32Å |
| 359 | Q | 98.3 | Very high | 98.2 | Very high | 91 Ų | 91 | 93 Ų | 93 | 43% | 0.425 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -65.9 | -44.4 | -179.9 | -175 | 58.3 | 23.5 | 0 | 0 | 111.4 | E355 E356 E357 L361 K362 E363 | E355-Q359 WeakPolarHBondContact O-CB 3.5Å; E355-Q359 PolarHBondContact O-N 3.14Å; E356-Q359 PolarHBondContact O-N 3.36Å; E357-Q359 VanDerWaalsContact C-N 3.32Å; E357-Q359 PolarHBondContact O-N 2.99Å; Q359-L361 PolarHBondContact O-N 2.87Å; Q359-K362 WeakPolarHBondContact O-CB 3.17Å; Q359-K362 PolarHBondContact O-N 2.89Å; Q359-E363 PolarHBondContact NE2-OE1 3.37Å; Q359-E363 VanDerWaalsContact NE2-OE1 3.14Å; Q359-E363 WeakPolarHBondContact O-CG 3.34Å; Q359-E363 PolarHBondContact O-N 3.07Å |
| 360 | A | 98.4 | Very high | 98.2 | Very high | 44 Ų | 44 | 92.9 Ų | 92.9 | 36% | 0.364 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -56.5 | -52.1 | 173.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | E356 E357 K362 E363 E364 | E356-A360 WeakPolarHBondContact O-CB 3.3Å; E356-A360 PolarHBondContact O-N 2.94Å; E357-A360 PolarHBondContact O-N 3.38Å; A360-K362 VanDerWaalsContact C-N 3.28Å; A360-K362 PolarHBondContact O-N 3.46Å; A360-E363 WeakPolarHBondContact O-CA 3.28Å; A360-E363 WeakPolarHBondContact O-CB 3.17Å; A360-E363 PolarHBondContact O-N 3.35Å; A360-E364 VanDerWaalsContact O-CG 3.31Å; A360-E364 WeakPolarHBondContact O-CG 3.34Å; A360-E364 PolarHBondContact O-N 2.85Å |
| 361 | L | 98.3 | Very high | 98.2 | Very high | 109 Ų | 109 | 94.2 Ų | 94.2 | 57% | 0.571 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -60.2 | -34.8 | 179.1 | -72.3 | 171.9 | 0 | 0 | 0 | 113.3 | E357 I358 Q359 E364 M365 | E357-L361 WeakPolarHBondContact O-CB 3.45Å; E357-L361 VanDerWaalsContact O-CG 3.3Å; E357-L361 WeakPolarHBondContact O-CG 3.31Å; E357-L361 PolarHBondContact O-N 3.2Å; I358-L361 PolarHBondContact O-N 3.23Å; Q359-L361 PolarHBondContact O-N 2.87Å; L361-E364 PolarHBondContact O-N 2.92Å; L361-M365 WeakPolarHBondContact O-CB 3.45Å; L361-M365 PolarHBondContact O-N 3.47Å |
| 362 | K | 98.4 | Very high | 98.2 | Very high | 128 Ų | 128 | 98.9 Ų | 98.9 | 56% | 0.557 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -64.5 | -42.6 | 173.3 | -76 | 171.9 | -178.9 | 172.4 | 0 | 111.7 | I358 Q359 A360 E364 M365 A366 | I358-K362 HydrophobicContact CG2-CD 4.21Å; I358-K362 VanDerWaalsContact O-CG 3.31Å; I358-K362 WeakPolarHBondContact O-CG 3.43Å; I358-K362 PolarHBondContact O-N 3.32Å; Q359-K362 WeakPolarHBondContact O-CB 3.17Å; Q359-K362 PolarHBondContact O-N 2.89Å; A360-K362 VanDerWaalsContact C-N 3.28Å; A360-K362 PolarHBondContact O-N 3.46Å; K362-E364 VanDerWaalsContact C-N 3.34Å; K362-M365 PolarHBondContact O-N 3.39Å; K362-A366 WeakPolarHBondContact O-CB 3.48Å; K362-A366 PolarHBondContact O-N 3.46Å |
| 363 | E | 98.3 | Very high | 98.2 | Very high | 117 Ų | 117 | 101.4 Ų | 101.4 | 55% | 0.547 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.2 | -39.8 | 175.8 | -69.8 | 169.2 | -166.4 | 0 | 0 | 111.2 | Q359 A360 A366 R367 | Q359-E363 PolarHBondContact NE2-OE1 3.37Å; Q359-E363 VanDerWaalsContact NE2-OE1 3.14Å; Q359-E363 WeakPolarHBondContact O-CG 3.34Å; Q359-E363 PolarHBondContact O-N 3.07Å; A360-E363 WeakPolarHBondContact O-CA 3.28Å; A360-E363 WeakPolarHBondContact O-CB 3.17Å; A360-E363 PolarHBondContact O-N 3.35Å; E363-A366 PolarHBondContact O-N 2.81Å; E363-R367 WeakPolarHBondContact O-CB 3.04Å; E363-R367 PolarHBondContact O-N 2.84Å |
| 364 | E | 98.4 | Very high | 98.2 | Very high | 89 Ų | 89 | 99.5 Ų | 99.5 | 42% | 0.416 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62.8 | -43.2 | 174.4 | -58.4 | -163.4 | 149.4 | 0 | 0 | 112.3 | A360 L361 K362 R367 H368 | A360-E364 VanDerWaalsContact O-CG 3.31Å; A360-E364 WeakPolarHBondContact O-CG 3.34Å; A360-E364 PolarHBondContact O-N 2.85Å; L361-E364 PolarHBondContact O-N 2.92Å; K362-E364 VanDerWaalsContact C-N 3.34Å; E364-R367 VanDerWaalsContact CA-NH2 3.27Å; E364-R367 PolarHBondContact O-N 3.13Å; E364-R367 IonicContact OE1-NH2 3.37Å; E364-H368 PolarHBondContact O-CD2 3.39Å; E364-H368 PolarHBondContact O-N 3.26Å |
| 365 | M | 98.1 | Very high | 98.2 | Very high | 120 Ų | 120 | 101 Ų | 101 | 59% | 0.591 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -61.6 | -45 | 175 | -177.2 | 64.3 | 68.9 | 0 | 0 | 111.6 | L361 K362 R367 H368 L369 | L361-M365 WeakPolarHBondContact O-CB 3.45Å; L361-M365 PolarHBondContact O-N 3.47Å; K362-M365 PolarHBondContact O-N 3.39Å; M365-R367 VanDerWaalsContact C-N 3.33Å; M365-R367 PolarHBondContact O-N 2.8Å; M365-H368 PolarHBondContact O-N 3.46Å; M365-L369 HydrophobicContact CG-CD1 4.31Å; M365-L369 WeakPolarHBondContact O-CG 3.37Å; M365-L369 PolarHBondContact O-N 3.15Å |
| 366 | A | 97.9 | Very high | 98.1 | Very high | 58 Ų | 58 | 100.2 Ų | 100.2 | 48% | 0.479 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61.3 | -42.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | K362 E363 L369 Q370 | K362-A366 WeakPolarHBondContact O-CB 3.48Å; K362-A366 PolarHBondContact O-N 3.46Å; E363-A366 PolarHBondContact O-N 2.81Å; A366-L369 PolarHBondContact O-N 2.92Å; A366-Q370 PolarHBondContact O-N 3.43Å |
| 367 | R | 98.4 | Very high | 98.1 | Very high | 103 Ų | 103 | 97.6 Ų | 97.6 | 39% | 0.389 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -61.2 | -45.6 | 174.4 | 173.8 | 176.7 | 38.1 | 60.7 | -2.6 | 111.9 | E363 E364 M365 L369 Q370 E371 | E363-R367 WeakPolarHBondContact O-CB 3.04Å; E363-R367 PolarHBondContact O-N 2.84Å; E364-R367 VanDerWaalsContact CA-NH2 3.27Å; E364-R367 PolarHBondContact O-N 3.13Å; E364-R367 IonicContact OE1-NH2 3.37Å; M365-R367 VanDerWaalsContact C-N 3.33Å; M365-R367 PolarHBondContact O-N 2.8Å; R367-L369 PolarHBondContact O-N 3.32Å; R367-Q370 WeakPolarHBondContact O-CB 3.49Å; R367-Q370 PolarHBondContact O-N 2.97Å; R367-E371 WeakPolarHBondContact CG-OE1 3.24Å; R367-E371 WeakPolarHBondContact O-CG 3.49Å; R367-E371 PolarHBondContact O-N 2.92Å |
| 368 | H | 97.9 | Very high | 98.1 | Very high | 76 Ų | 76 | 97.3 Ų | 97.3 | 35% | 0.352 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.1 | -41.9 | 176.4 | -73.4 | -43.7 | 0 | 0 | 0 | 112.5 | E364 M365 Q370 E371 Y372 | E364-H368 PolarHBondContact O-CD2 3.39Å; E364-H368 PolarHBondContact O-N 3.26Å; M365-H368 PolarHBondContact O-N 3.46Å; H368-Q370 VanDerWaalsContact C-N 3.28Å; H368-Q370 PolarHBondContact O-N 3.46Å; H368-E371 IonicContact CE1-OE2 3.11Å; H368-E371 IonicContact ND1-OE2 3.26Å; H368-E371 PolarHBondContact ND1-OE2 2.86Å; H368-E371 PolarHBondContact O-N 3.14Å; H368-Y372 HydrophobicContact CB-CD2 4.45Å; H368-Y372 HydrophobicContact CB-CE2 4.31Å; H368-Y372 WeakPolarHBondContact O-CD2 3.19Å; H368-Y372 PolarHBondContact O-N 2.9Å |
| 369 | L | 98.1 | Very high | 98.1 | Very high | 109 Ų | 109 | 98.3 Ų | 98.3 | 57% | 0.571 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -58.9 | -40.6 | 174.9 | -76 | 167.6 | 0 | 0 | 0 | 112 | M365 A366 R367 Y372 Q373 | M365-L369 HydrophobicContact CG-CD1 4.31Å; M365-L369 WeakPolarHBondContact O-CG 3.37Å; M365-L369 PolarHBondContact O-N 3.15Å; A366-L369 PolarHBondContact O-N 2.92Å; R367-L369 PolarHBondContact O-N 3.32Å; L369-Y372 PolarHBondContact O-N 3.3Å; L369-Q373 PolarHBondContact O-N 2.91Å |
| 370 | Q | 98.1 | Very high | 98 | Very high | 112 Ų | 112 | 98.6 Ų | 98.6 | 52% | 0.523 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64 | -47.5 | 175.1 | -173 | 63.7 | 24.5 | 0 | 0 | 111.7 | A366 R367 H368 Y372 Q373 D374 | A366-Q370 PolarHBondContact O-N 3.43Å; R367-Q370 WeakPolarHBondContact O-CB 3.49Å; R367-Q370 PolarHBondContact O-N 2.97Å; H368-Q370 VanDerWaalsContact C-N 3.28Å; H368-Q370 PolarHBondContact O-N 3.46Å; Q370-Y372 VanDerWaalsContact C-N 3.3Å; Q370-Y372 PolarHBondContact O-N 3.14Å; Q370-Q373 PolarHBondContact O-N 3.46Å; Q370-Q373 VanDerWaalsContact O-N 3.14Å; Q370-D374 PolarHBondContact O-N 2.99Å |
| 371 | E | 97.9 | Very high | 98 | Very high | 95 Ų | 95 | 98.7 Ų | 98.7 | 44% | 0.444 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -58.6 | -40.1 | 176.3 | -69.9 | 164.6 | -178 | 0 | 0 | 111.9 | R367 H368 D374 L375 | R367-E371 WeakPolarHBondContact CG-OE1 3.24Å; R367-E371 WeakPolarHBondContact O-CG 3.49Å; R367-E371 PolarHBondContact O-N 2.92Å; H368-E371 IonicContact CE1-OE2 3.11Å; H368-E371 IonicContact ND1-OE2 3.26Å; H368-E371 PolarHBondContact ND1-OE2 2.86Å; H368-E371 PolarHBondContact O-N 3.14Å; E371-D374 PolarHBondContact O-N 3.02Å; E371-L375 WeakPolarHBondContact O-CB 3.13Å; E371-L375 PolarHBondContact O-N 3.43Å |
| 372 | Y | 98.1 | Very high | 98 | Very high | 158 Ų | 158 | 97.6 Ų | 97.6 | 62% | 0.62 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -65.4 | -41.9 | 175 | -79.9 | -62.9 | 0 | 0 | 0 | 112.3 | H368 L369 Q370 D374 L375 L376 | H368-Y372 HydrophobicContact CB-CD2 4.45Å; H368-Y372 HydrophobicContact CB-CE2 4.31Å; H368-Y372 WeakPolarHBondContact O-CD2 3.19Å; H368-Y372 PolarHBondContact O-N 2.9Å; L369-Y372 PolarHBondContact O-N 3.3Å; Q370-Y372 VanDerWaalsContact C-N 3.3Å; Q370-Y372 PolarHBondContact O-N 3.14Å; Y372-D374 VanDerWaalsContact C-N 3.35Å; Y372-L375 PolarHBondContact O-N 3.39Å; Y372-L376 WeakPolarHBondContact O-CB 3.41Å; Y372-L376 PolarHBondContact O-N 2.95Å |
| 373 | Q | 97.9 | Very high | 97.9 | Very high | 92 Ų | 92 | 94.5 Ų | 94.5 | 43% | 0.43 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -64.1 | -42 | 176.8 | -174.6 | 60.7 | 44.8 | 0 | 0 | 111.2 | L369 Q370 L376 N377 | L369-Q373 PolarHBondContact O-N 2.91Å; Q370-Q373 PolarHBondContact O-N 3.46Å; Q370-Q373 VanDerWaalsContact O-N 3.14Å; Q373-L376 WeakPolarHBondContact O-CB 3.2Å; Q373-L376 PolarHBondContact O-N 3.43Å; Q373-N377 PolarHBondContact NE2-OD1 3.33Å; Q373-N377 VanDerWaalsContact NE2-OD1 3.14Å; Q373-N377 PolarHBondContact O-N 3.41Å; Q373-N377 PolarHBondContact O-ND2 3.27Å; Q373-N377 PolarHBondContact O-OD1 2.92Å |
| 374 | D | 97.8 | Very high | 97.8 | Very high | 79 Ų | 79 | 93.8 Ų | 93.8 | 42% | 0.422 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -64.2 | -43 | 177.1 | -69.2 | -21.2 | 0 | 0 | 0 | 111.4 | Q370 E371 Y372 L376 N377 V378 | Q370-D374 PolarHBondContact O-N 2.99Å; E371-D374 PolarHBondContact O-N 3.02Å; Y372-D374 VanDerWaalsContact C-N 3.35Å; D374-L376 VanDerWaalsContact C-N 3.35Å; D374-L376 PolarHBondContact O-N 3.19Å; D374-N377 WeakPolarHBondContact O-CB 3.3Å; D374-N377 PolarHBondContact O-N 2.96Å; D374-V378 WeakPolarHBondContact O-CG2 3.41Å; D374-V378 PolarHBondContact O-N 3.43Å |
| 375 | L | 98.1 | Very high | 97.8 | Very high | 114 Ų | 114 | 94 Ų | 94 | 60% | 0.597 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -63.7 | -39.9 | 174.6 | -177.2 | 66.4 | 0 | 0 | 0 | 112.2 | E371 Y372 N377 V378 K379 | E371-L375 WeakPolarHBondContact O-CB 3.13Å; E371-L375 PolarHBondContact O-N 3.43Å; Y372-L375 PolarHBondContact O-N 3.39Å; L375-N377 VanDerWaalsContact C-N 3.33Å; L375-V378 PolarHBondContact O-N 2.95Å; L375-K379 PolarHBondContact O-N 3.44Å |
| 376 | L | 97.8 | Very high | 97.6 | Very high | 96 Ų | 96 | 91.9 Ų | 91.9 | 50% | 0.503 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -61.7 | -42.5 | 174.5 | 177.6 | 63.3 | 0 | 0 | 0 | 111.2 | Y372 Q373 D374 V378 K379 L380 | Y372-L376 WeakPolarHBondContact O-CB 3.41Å; Y372-L376 PolarHBondContact O-N 2.95Å; Q373-L376 WeakPolarHBondContact O-CB 3.2Å; Q373-L376 PolarHBondContact O-N 3.43Å; D374-L376 VanDerWaalsContact C-N 3.35Å; D374-L376 PolarHBondContact O-N 3.19Å; L376-V378 PolarHBondContact O-N 3.19Å; L376-K379 PolarHBondContact O-N 2.73Å; L376-L380 PolarHBondContact O-N 2.83Å |
| 377 | N | 97.8 | Very high | 97.5 | Very high | 80 Ų | 80 | 91.3 Ų | 91.3 | 43% | 0.428 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -60.7 | -44.2 | 176.2 | -66.3 | -23.1 | 0 | 0 | 0 | 111.2 | Q373 D374 L375 L380 A381 | Q373-N377 PolarHBondContact NE2-OD1 3.33Å; Q373-N377 VanDerWaalsContact NE2-OD1 3.14Å; Q373-N377 PolarHBondContact O-N 3.41Å; Q373-N377 PolarHBondContact O-ND2 3.27Å; Q373-N377 PolarHBondContact O-OD1 2.92Å; D374-N377 WeakPolarHBondContact O-CB 3.3Å; D374-N377 PolarHBondContact O-N 2.96Å; L375-N377 VanDerWaalsContact C-N 3.33Å; N377-L380 PolarHBondContact O-N 3.45Å; N377-A381 PolarHBondContact O-N 3.41Å |
| 378 | V | 97.9 | Very high | 97.3 | Very high | 83 Ų | 83 | 90 Ų | 90 | 50% | 0.503 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -61.4 | -44.1 | 174.5 | 173.2 | 0 | 0 | 0 | 0 | 111.2 | D374 L375 L376 L380 A381 L382 | D374-V378 WeakPolarHBondContact O-CG2 3.41Å; D374-V378 PolarHBondContact O-N 3.43Å; L375-V378 PolarHBondContact O-N 2.95Å; L376-V378 PolarHBondContact O-N 3.19Å; V378-L380 VanDerWaalsContact C-N 3.32Å; V378-L380 PolarHBondContact O-N 2.8Å; V378-A381 WeakPolarHBondContact O-CB 3.31Å; V378-A381 PolarHBondContact O-N 3.02Å; V378-L382 HydrophobicContact CG1-CD1 4.24Å; V378-L382 WeakPolarHBondContact O-CG 3.47Å; V378-L382 PolarHBondContact O-N 2.93Å |
| 379 | K | 97.6 | Very high | 97.3 | Very high | 111 Ų | 111 | 93.4 Ų | 93.4 | 48% | 0.483 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -60.1 | -42.8 | 177 | -174.3 | -91.2 | 175.4 | 178.2 | 0 | 111.7 | L375 L376 A381 L382 D383 | L375-K379 PolarHBondContact O-N 3.44Å; L376-K379 PolarHBondContact O-N 2.73Å; K379-A381 VanDerWaalsContact C-N 3.34Å; K379-L382 PolarHBondContact O-N 3.06Å; K379-D383 WeakPolarHBondContact CD-OD2 3.41Å; K379-D383 WeakPolarHBondContact CE-OD1 3.47Å; K379-D383 WeakPolarHBondContact CE-OD2 3.45Å; K379-D383 IonicContact NZ-OD1 2.92Å; K379-D383 PolarHBondContact NZ-OD1 3.42Å; K379-D383 IonicContact NZ-OD2 3.58Å; K379-D383 PolarHBondContact NZ-OD2 3.23Å; K379-D383 PolarHBondContact O-N 3.21Å |
| 380 | L | 97.8 | Very high | 97.1 | Very high | 98 Ų | 98 | 95.9 Ų | 95.9 | 51% | 0.513 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -63.6 | -41.2 | 177.6 | -174.4 | 68 | 0 | 0 | 0 | 111.4 | L376 N377 V378 D383 I384 | L376-L380 PolarHBondContact O-N 2.83Å; N377-L380 PolarHBondContact O-N 3.45Å; V378-L380 VanDerWaalsContact C-N 3.32Å; V378-L380 PolarHBondContact O-N 2.8Å; L380-D383 PolarHBondContact O-N 3.23Å; L380-I384 HydrophobicContact CG-CD1 4.41Å; L380-I384 WeakPolarHBondContact O-CG1 3.44Å; L380-I384 PolarHBondContact O-N 3.02Å; L380-I384 VanDerWaalsContact O-N 3.07Å |
| 381 | A | 97.9 | Very high | 96.9 | Very high | 46 Ų | 46 | 98 Ų | 98 | 38% | 0.38 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60.2 | -45.4 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | N377 V378 K379 D383 I384 E385 | N377-A381 PolarHBondContact O-N 3.41Å; V378-A381 WeakPolarHBondContact O-CB 3.31Å; V378-A381 PolarHBondContact O-N 3.02Å; K379-A381 VanDerWaalsContact C-N 3.34Å; A381-D383 PolarHBondContact O-N 2.97Å; A381-I384 WeakPolarHBondContact O-CB 3.43Å; A381-I384 PolarHBondContact O-N 3.49Å; A381-E385 WeakPolarHBondContact O-CG 3.27Å; A381-E385 PolarHBondContact O-N 3.25Å |
| 382 | L | 97.3 | Very high | 96.5 | Very high | 86 Ų | 86 | 99.2 Ų | 99.2 | 45% | 0.45 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.1 | -38.9 | 176 | -68.7 | 174.7 | 0 | 0 | 0 | 112.7 | V378 K379 I384 E385 I386 | V378-L382 HydrophobicContact CG1-CD1 4.24Å; V378-L382 WeakPolarHBondContact O-CG 3.47Å; V378-L382 PolarHBondContact O-N 2.93Å; K379-L382 PolarHBondContact O-N 3.06Å; L382-I384 VanDerWaalsContact C-N 3.3Å; L382-I384 PolarHBondContact O-N 2.96Å; L382-E385 PolarHBondContact O-N 3.43Å; L382-I386 VanDerWaalsContact O-CG1 3.27Å; L382-I386 WeakPolarHBondContact O-CG1 3.27Å; L382-I386 PolarHBondContact O-N 3.48Å |
| 383 | D | 97.3 | Very high | 96 | Very high | 63 Ų | 63 | 96.9 Ų | 96.9 | 34% | 0.337 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.2 | -39.9 | 174.8 | -72.1 | -27.7 | 0 | 0 | 0 | 111.8 | K379 L380 A381 I386 A387 | K379-D383 WeakPolarHBondContact CD-OD2 3.41Å; K379-D383 WeakPolarHBondContact CE-OD1 3.47Å; K379-D383 WeakPolarHBondContact CE-OD2 3.45Å; K379-D383 IonicContact NZ-OD1 2.92Å; K379-D383 PolarHBondContact NZ-OD1 3.42Å; K379-D383 IonicContact NZ-OD2 3.58Å; K379-D383 PolarHBondContact NZ-OD2 3.23Å; K379-D383 PolarHBondContact O-N 3.21Å; L380-D383 PolarHBondContact O-N 3.23Å; A381-D383 PolarHBondContact O-N 2.97Å; D383-I386 PolarHBondContact O-N 3.48Å; D383-A387 WeakPolarHBondContact O-CB 3.45Å; D383-A387 PolarHBondContact O-N 2.9Å |
| 384 | I | 96.3 | Very high | 95.3 | Very high | 102 Ų | 102 | 97.9 Ų | 97.9 | 52% | 0.523 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.2 | -46.5 | 175.5 | -66.4 | 165 | 0 | 0 | 0 | 109.5 | L380 A381 L382 A387 T388 | L380-I384 HydrophobicContact CG-CD1 4.41Å; L380-I384 WeakPolarHBondContact O-CG1 3.44Å; L380-I384 PolarHBondContact O-N 3.02Å; L380-I384 VanDerWaalsContact O-N 3.07Å; A381-I384 WeakPolarHBondContact O-CB 3.43Å; A381-I384 PolarHBondContact O-N 3.49Å; L382-I384 VanDerWaalsContact C-N 3.3Å; L382-I384 PolarHBondContact O-N 2.96Å; I384-A387 PolarHBondContact O-N 2.92Å; I384-T388 HydrophobicContact CG2-CG2 4.47Å; I384-T388 WeakPolarHBondContact O-CG2 3.34Å; I384-T388 PolarHBondContact O-N 3.02Å; I384-T388 PolarHBondContact O-OG1 2.96Å |
| 385 | E | 97.1 | Very high | 94.2 | Very high | 92 Ų | 92 | 95.3 Ų | 95.3 | 43% | 0.43 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -58.9 | -46.3 | 175.3 | -71.5 | 177.7 | -167.9 | 0 | 0 | 112.1 | A381 L382 A387 T388 Y389 | A381-E385 WeakPolarHBondContact O-CG 3.27Å; A381-E385 PolarHBondContact O-N 3.25Å; L382-E385 PolarHBondContact O-N 3.43Å; E385-A387 VanDerWaalsContact C-N 3.29Å; E385-A387 PolarHBondContact O-N 3.3Å; E385-T388 WeakPolarHBondContact CA-OG1 3.45Å; E385-T388 PolarHBondContact O-N 3.31Å; E385-T388 PolarHBondContact O-OG1 3.2Å; E385-Y389 HydrophobicContact CB-CD2 4.31Å; E385-Y389 HydrophobicContact CB-CE2 4.03Å; E385-Y389 WeakPolarHBondContact O-CB 3.32Å; E385-Y389 WeakPolarHBondContact O-CD2 3.26Å; E385-Y389 PolarHBondContact O-N 3.21Å |
| 386 | I | 95.4 | Very high | 92.8 | Very high | 77 Ų | 77 | 94 Ų | 94 | 40% | 0.395 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -60.7 | -41.7 | 176.6 | -69.2 | 165.8 | 0 | 0 | 0 | 110.5 | L382 D383 Y389 R390 | L382-I386 VanDerWaalsContact O-CG1 3.27Å; L382-I386 WeakPolarHBondContact O-CG1 3.27Å; L382-I386 PolarHBondContact O-N 3.48Å; D383-I386 PolarHBondContact O-N 3.48Å; I386-Y389 PolarHBondContact O-N 2.59Å; I386-R390 HydrophobicContact CG2-CG 4.46Å; I386-R390 WeakPolarHBondContact O-CB 3.4Å; I386-R390 VanDerWaalsContact O-CG 3.27Å; I386-R390 WeakPolarHBondContact O-CG 2.95Å; I386-R390 PolarHBondContact O-N 3.31Å |
| 387 | A | 96 | Very high | 91.1 | Very high | 46 Ų | 46 | 95.4 Ų | 95.4 | 38% | 0.38 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -65.7 | -38.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | D383 I384 E385 K391 | D383-A387 WeakPolarHBondContact O-CB 3.45Å; D383-A387 PolarHBondContact O-N 2.9Å; I384-A387 PolarHBondContact O-N 2.92Å; E385-A387 VanDerWaalsContact C-N 3.29Å; E385-A387 PolarHBondContact O-N 3.3Å; A387-K391 WeakPolarHBondContact O-CG 3.48Å; A387-K391 PolarHBondContact O-N 3.17Å |
| 388 | T | 94.2 | Very high | 89.2 | Confident | 76 Ų | 76 | 96 Ų | 96 | 47% | 0.466 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -69.5 | -43.3 | 175.4 | 57.8 | 0 | 0 | 0 | 0 | 111.5 | I384 E385 R390 K391 L392 | I384-T388 HydrophobicContact CG2-CG2 4.47Å; I384-T388 WeakPolarHBondContact O-CG2 3.34Å; I384-T388 PolarHBondContact O-N 3.02Å; I384-T388 PolarHBondContact O-OG1 2.96Å; E385-T388 WeakPolarHBondContact CA-OG1 3.45Å; E385-T388 PolarHBondContact O-N 3.31Å; E385-T388 PolarHBondContact O-OG1 3.2Å; T388-R390 VanDerWaalsContact C-N 3.35Å; T388-R390 PolarHBondContact O-N 3.25Å; T388-K391 PolarHBondContact O-N 3.04Å; T388-L392 PolarHBondContact O-N 3.18Å |
| 389 | Y | 96.2 | Very high | 87.5 | Confident | 147 Ų | 147 | 99.7 Ų | 99.7 | 58% | 0.576 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -59 | -44.1 | 173.8 | -71.9 | -55.1 | 0 | 0 | 0 | 111.7 | E385 I386 L392 L393 | E385-Y389 HydrophobicContact CB-CD2 4.31Å; E385-Y389 HydrophobicContact CB-CE2 4.03Å; E385-Y389 WeakPolarHBondContact O-CB 3.32Å; E385-Y389 WeakPolarHBondContact O-CD2 3.26Å; E385-Y389 PolarHBondContact O-N 3.21Å; I386-Y389 PolarHBondContact O-N 2.59Å; Y389-L392 PolarHBondContact O-N 2.89Å; Y389-L393 WeakPolarHBondContact O-CD1 3.47Å; Y389-L393 WeakPolarHBondContact O-CG 3.47Å; Y389-L393 PolarHBondContact O-N 2.83Å |
| 390 | R | 94.6 | Very high | 85.6 | Confident | 161 Ų | 161 | 101 Ų | 101 | 61% | 0.608 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -58.5 | -48.1 | 174.6 | -77.8 | 175.4 | -179.2 | 169.3 | 2.5 | 112.3 | I386 T388 L392 L393 E394 | I386-R390 HydrophobicContact CG2-CG 4.46Å; I386-R390 WeakPolarHBondContact O-CB 3.4Å; I386-R390 VanDerWaalsContact O-CG 3.27Å; I386-R390 WeakPolarHBondContact O-CG 2.95Å; I386-R390 PolarHBondContact O-N 3.31Å; T388-R390 VanDerWaalsContact C-N 3.35Å; T388-R390 PolarHBondContact O-N 3.25Å; R390-L392 VanDerWaalsContact C-N 3.29Å; R390-L392 PolarHBondContact O-N 2.9Å; R390-L393 PolarHBondContact O-N 3.37Å; R390-E394 WeakPolarHBondContact O-CG 3.39Å; R390-E394 PolarHBondContact O-N 3.01Å |
| 391 | K | 93.2 | Very high | 83.1 | Confident | 155 Ų | 155 | 100.9 Ų | 100.9 | 67% | 0.674 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -60.1 | -38.1 | 176.8 | -77.6 | -178 | 178.2 | -178.1 | 0 | 112.8 | A387 T388 G395 | A387-K391 WeakPolarHBondContact O-CG 3.48Å; A387-K391 PolarHBondContact O-N 3.17Å; T388-K391 PolarHBondContact O-N 3.04Å; K391-G395 PolarHBondContact O-N 3.45Å |
| 392 | L | 91.1 | Very high | 80.5 | Confident | 121 Ų | 121 | 106.4 Ų | 106.4 | 63% | 0.634 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -68.8 | -40.3 | 178.8 | -157 | 74 | 0 | 0 | 0 | 111.4 | T388 Y389 R390 G395 E396 | T388-L392 PolarHBondContact O-N 3.18Å; Y389-L392 PolarHBondContact O-N 2.89Å; R390-L392 VanDerWaalsContact C-N 3.29Å; R390-L392 PolarHBondContact O-N 2.9Å; L392-G395 PolarHBondContact O-N 3.48Å; L392-E396 PolarHBondContact O-N 2.91Å |
| 393 | L | 86.7 | Confident | 78.4 | Confident | 109 Ų | 109 | 107.2 Ų | 107.2 | 57% | 0.571 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -64 | -47 | 174.1 | -78 | 156 | 0 | 0 | 0 | 111.9 | Y389 R390 G395 E396 E397 | Y389-L393 WeakPolarHBondContact O-CD1 3.47Å; Y389-L393 WeakPolarHBondContact O-CG 3.47Å; Y389-L393 PolarHBondContact O-N 2.83Å; R390-L393 PolarHBondContact O-N 3.37Å; L393-G395 PolarHBondContact O-N 3.21Å; L393-E396 PolarHBondContact O-N 3.44Å; L393-E397 WeakPolarHBondContact O-CG 3.45Å; L393-E397 PolarHBondContact O-N 2.84Å |
| 394 | E | 82.9 | Confident | 75.6 | Confident | 113 Ų | 113 | 111.2 Ų | 111.2 | 53% | 0.528 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -58.5 | -36.4 | 173.6 | -71.9 | 168.5 | -170.3 | 0 | 0 | 111.6 | R390 S398 | R390-E394 WeakPolarHBondContact O-CG 3.39Å; R390-E394 PolarHBondContact O-N 3.01Å; E394-S398 WeakPolarHBondContact O-CB 3.43Å; E394-S398 PolarHBondContact O-N 3.46Å; E394-S398 PolarHBondContact O-OG 3.28Å |
| 395 | G | 75 | Confident | 73.1 | Confident | 26 Ų | 26 | 113.6 Ų | 113.6 | 27% | 0.268 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -68.9 | -29.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | K391 L392 L393 R399 | K391-G395 PolarHBondContact O-N 3.45Å; L392-G395 PolarHBondContact O-N 3.48Å; L393-G395 PolarHBondContact O-N 3.21Å; G395-R399 PolarHBondContact O-NH1 3.22Å |
| 396 | E | 68.1 | Low | 70.1 | Confident | 87 Ų | 87 | 115 Ų | 115 | 41% | 0.407 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -78.1 | -41 | 171.2 | -77.4 | -68.6 | 170.9 | 0 | 0 | 112 | L392 L393 S398 R399 I400 | L392-E396 PolarHBondContact O-N 2.91Å; L393-E396 PolarHBondContact O-N 3.44Å; E396-S398 PolarHBondContact O-N 3.31Å; E396-R399 WeakPolarHBondContact O-CA 3.38Å; E396-R399 WeakPolarHBondContact O-CB 3.44Å; E396-R399 PolarHBondContact O-N 3.37Å; E396-R399 IonicContact OE1-CZ 3.74Å; E396-R399 IonicContact OE1-NE 2.7Å; E396-R399 IonicContact OE1-NH2 3.65Å; E396-R399 PolarHBondContact OE1-NH2 3.27Å; E396-R399 IonicContact OE2-CZ 3.37Å; E396-R399 IonicContact OE2-NE 2.9Å; E396-R399 PolarHBondContact OE2-NE 3.13Å; E396-R399 IonicContact OE2-NH2 3.51Å; E396-R399 PolarHBondContact OE2-NH2 3.4Å; E396-I400 WeakPolarHBondContact O-CG1 3.46Å; E396-I400 PolarHBondContact O-N 3.26Å |
| 397 | E | 62.3 | Low | 67.6 | Low | 124 Ų | 124 | 119.3 Ų | 119.3 | 58% | 0.579 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -60.1 | -34.6 | 173.3 | -71.1 | 179.7 | 173.4 | 0 | 0 | 111.5 | L393 R399 I400 T401 | L393-E397 WeakPolarHBondContact O-CG 3.45Å; L393-E397 PolarHBondContact O-N 2.84Å; E397-R399 VanDerWaalsContact C-N 3.28Å; E397-R399 PolarHBondContact O-N 2.96Å; E397-I400 PolarHBondContact O-N 3.2Å; E397-T401 WeakPolarHBondContact O-CB 3.37Å; E397-T401 PolarHBondContact O-N 3.07Å; E397-T401 PolarHBondContact O-OG1 3.45Å |
| 398 | S | 57.8 | Low | 64.8 | Low | 93 Ų | 93 | 123 Ų | 123 | 65% | 0.65 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -66.1 | -24.4 | 172.5 | -57.4 | 0 | 0 | 0 | 0 | 113.7 | E394 E396 | E394-S398 WeakPolarHBondContact O-CB 3.43Å; E394-S398 PolarHBondContact O-N 3.46Å; E394-S398 PolarHBondContact O-OG 3.28Å; E396-S398 PolarHBondContact O-N 3.31Å |
| 399 | R | 61.9 | Low | 62.2 | Low | 161 Ų | 161 | 126.2 Ų | 126.2 | 61% | 0.608 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -85.1 | -31.6 | 173.7 | -72.8 | -173 | -82.2 | -91.3 | 15 | 112.6 | G395 E396 E397 | G395-R399 PolarHBondContact O-NH1 3.22Å; E396-R399 WeakPolarHBondContact O-CA 3.38Å; E396-R399 WeakPolarHBondContact O-CB 3.44Å; E396-R399 PolarHBondContact O-N 3.37Å; E396-R399 IonicContact OE1-CZ 3.74Å; E396-R399 IonicContact OE1-NE 2.7Å; E396-R399 IonicContact OE1-NH2 3.65Å; E396-R399 PolarHBondContact OE1-NH2 3.27Å; E396-R399 IonicContact OE2-CZ 3.37Å; E396-R399 IonicContact OE2-NE 2.9Å; E396-R399 PolarHBondContact OE2-NE 3.13Å; E396-R399 IonicContact OE2-NH2 3.51Å; E396-R399 PolarHBondContact OE2-NH2 3.4Å; E397-R399 VanDerWaalsContact C-N 3.28Å; E397-R399 PolarHBondContact O-N 2.96Å |
| 400 | I | 57.9 | Low | 59.4 | Low | 139 Ų | 139 | 127.5 Ų | 127.5 | 71% | 0.713 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -86.1 | -18.3 | -176.1 | -64.9 | 169.9 | 0 | 0 | 0 | 111.8 | E396 E397 | E396-I400 WeakPolarHBondContact O-CG1 3.46Å; E396-I400 PolarHBondContact O-N 3.26Å; E397-I400 PolarHBondContact O-N 3.2Å |
| 401 | T | 46.8 | Very low | 56.7 | Low | 94 Ų | 94 | 129 Ų | 129 | 58% | 0.577 | 68% | 0.682 | S | S | * | * | trans | -115.7 | 109.4 | -174.7 | -30.4 | 0 | 0 | 0 | 0 | 113 | E397 | E397-T401 WeakPolarHBondContact O-CB 3.37Å; E397-T401 PolarHBondContact O-N 3.07Å; E397-T401 PolarHBondContact O-OG1 3.45Å | ||
| 402 | I | 42.6 | Very low | 53.8 | Low | 163 Ų | 163 | 130.7 Ų | 130.7 | 84% | 0.836 | 69% | 0.69 | S | S | * | * | trans | -82.8 | 147.9 | 158.8 | -68.8 | 175 | 0 | 0 | 0 | 107.7 | ||||
| 403 | P | 52.2 | Low | 51.2 | Low | 102 Ų | 102 | 135.6 Ų | 135.6 | 66% | 0.662 | 70% | 0.7 | S | S | * | * | trans | -92.6 | 151.1 | -131.1 | 35.9 | -36 | 0 | 0 | 0 | 115.4 | ||||
| 404 | V | 39.3 | Very low | 48.8 | Very low | 147 Ų | 147 | 137.9 Ų | 137.9 | 89% | 0.891 | 71% | 0.708 | S | S | * | * | trans | -134.7 | 122 | 140.5 | 179.2 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 405 | Q | 44 | Very low | 46.6 | Very low | 153 Ų | 153 | 138 Ų | 138 | 72% | 0.715 | 72% | 0.717 | S | S | * | * | trans | -67.8 | 138.7 | -180 | -63 | 171.9 | -25.2 | 0 | 0 | 112 | ||||
| 406 | S | 34.3 | Very low | 44.7 | Very low | 120 Ų | 120 | 143.5 Ų | 143.5 | 84% | 0.839 | 74% | 0.74 | S | S | * | * | -169.8 | 138.5 | 121.4 | -93.3 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 407 | F | 41.6 | Very low | 43.3 | Very low | 168 Ų | 168 | 146.6 Ų | 146.6 | 74% | 0.737 | 76% | 0.759 | S | S | * | * | trans | -74.9 | 151 | -169.4 | -65.6 | -100 | 0 | 0 | 0 | 113.5 | ||||
| 408 | S | 37.3 | Very low | 41.9 | Very low | 123 Ų | 123 | 146.2 Ų | 146.2 | 86% | 0.86 | 76% | 0.76 | S | S | * | * | trans | -160.8 | 116.7 | 133.4 | -77 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 409 | N | 39.6 | Very low | 40.9 | Very low | 144 Ų | 144 | 147.3 Ų | 147.3 | 77% | 0.77 | 76% | 0.763 | S | S | * | * | trans | -52.6 | 135 | -179.7 | -68.5 | -31.7 | 0 | 0 | 0 | 114.2 | ||||
| 410 | L | 38.8 | Very low | 39.6 | Very low | 174 Ų | 174 | 147.5 Ų | 147.5 | 91% | 0.911 | 77% | 0.769 | S | S | * | * | trans | -112.8 | 109.3 | 153.6 | -75 | 172.1 | 0 | 0 | 0 | 108.5 | F412 | L410-F412 PolarHBondContact O-N 3Å; L410-F412 VanDerWaalsContact O-N 3.13Å | ||
| 411 | Q | 36.5 | Very low | 38.8 | Very low | 192 Ų | 192 | 146.9 Ų | 146.9 | 90% | 0.897 | 77% | 0.771 | S | S | * | * | trans | -67.3 | 103.6 | 171.4 | -76.4 | 171.4 | -30.5 | 0 | 0 | 109.1 | R413 | Q411-R413 PolarHBondContact O-N 2.85Š| ||
| 412 | F | 32.8 | Very low | 38.5 | Very low | 191 Ų | 191 | 148 Ų | 148 | 84% | 0.838 | 78% | 0.781 | S | S | * | * | trans | -76.8 | 99 | 163.9 | -170.9 | -96.6 | 0 | 0 | 0 | 107.8 | L410 E414 | L410-F412 PolarHBondContact O-N 3Å; L410-F412 VanDerWaalsContact O-N 3.13Å; F412-E414 HydrophobicContact CD1-CG 4.35Å; F412-E414 HydrophobicContact CE1-CG 4.26Å; F412-E414 PolarHBondContact O-N 3.27Å | ||
| 413 | R | 37.9 | Very low | 38.5 | Very low | 224 Ų | 224 | 148.2 Ų | 148.2 | 85% | 0.845 | 78% | 0.778 | S | S | * | * | trans | -82.5 | 105.5 | 172.5 | -170.7 | 176.8 | -178.2 | 165.8 | -0.3 | 107.7 | Q411 T415 | Q411-R413 PolarHBondContact O-N 2.85Å; R413-T415 PolarHBondContact O-N 2.82Å | ||
| 414 | E | 36.2 | Very low | 37.8 | Very low | 157 Ų | 157 | 147 Ų | 147 | 73% | 0.734 | 78% | 0.776 | S | S | * | * | trans | -53.4 | 119.6 | 165.4 | -73.7 | 175.3 | 151 | 0 | 0 | 109.8 | F412 | F412-E414 HydrophobicContact CD1-CG 4.35Å; F412-E414 HydrophobicContact CE1-CG 4.26Å; F412-E414 PolarHBondContact O-N 3.27Å | ||
| 415 | T | 36.1 | Very low | 38.2 | Very low | 117 Ų | 117 | 147.8 Ų | 147.8 | 72% | 0.718 | 77% | 0.77 | S | S | * | * | trans | -103.2 | 100.3 | 160.4 | 52.6 | 0 | 0 | 0 | 0 | 107.7 | R413 L417 | R413-T415 PolarHBondContact O-N 2.82Å; T415-L417 PolarHBondContact O-N 3.36Å | ||
| 416 | N | 34.3 | Very low | 38.2 | Very low | 141 Ų | 141 | 145.9 Ų | 145.9 | 75% | 0.754 | 77% | 0.769 | S | S | * | * | trans | -48.1 | 116.2 | 159 | -102 | -92.1 | 0 | 0 | 0 | 109.2 | ||||
| 417 | L | 38.9 | Very low | 39.2 | Very low | 152 Ų | 152 | 149.1 Ų | 149.1 | 80% | 0.796 | 77% | 0.768 | S | S | * | * | trans | -96.7 | 81.8 | 162.4 | -106.2 | 149.3 | 0 | 0 | 0 | 106.6 | T415 T419 | T415-L417 PolarHBondContact O-N 3.36Å; L417-T419 VanDerWaalsContact C-N 3.32Å; L417-T419 HydrophobicContact CD2-CG2 4.31Å; L417-T419 PolarHBondContact O-N 2.99Å | ||
| 418 | D | 32.3 | Very low | 40.2 | Very low | 115 Ų | 115 | 151.2 Ų | 151.2 | 62% | 0.615 | 77% | 0.771 | S | S | * | * | trans | -84.1 | 81 | 171.6 | -151.8 | 29.1 | 0 | 0 | 0 | 107.1 | K420 | D418-K420 PolarHBondContact O-N 3.27Å; D418-K420 VanDerWaalsContact OD2-CE 3.26Å; D418-K420 WeakPolarHBondContact OD2-CE 3.39Å | ||
| 419 | T | 37.3 | Very low | 41.1 | Very low | 116 Ų | 116 | 148.8 Ų | 148.8 | 71% | 0.712 | 75% | 0.754 | S | S | * | * | trans | -73.1 | 81.6 | 167.3 | 43.8 | 0 | 0 | 0 | 0 | 108.5 | L417 T421 | L417-T419 VanDerWaalsContact C-N 3.32Å; L417-T419 HydrophobicContact CD2-CG2 4.31Å; L417-T419 PolarHBondContact O-N 2.99Å; T419-T421 PolarHBondContact O-N 3.23Å | ||
| 420 | K | 33.9 | Very low | 42.3 | Very low | 166 Ų | 166 | 146.7 Ų | 146.7 | 72% | 0.722 | 74% | 0.741 | S | S | * | * | trans | -68.6 | 108.5 | 163 | -72.4 | -174.9 | 179 | 175 | 0 | 108.7 | D418 P422 | D418-K420 PolarHBondContact O-N 3.27Å; D418-K420 VanDerWaalsContact OD2-CE 3.26Å; D418-K420 WeakPolarHBondContact OD2-CE 3.39Å; K420-P422 WeakPolarHBondContact O-CD 3.47Å | ||
| 421 | T | 42.7 | Very low | 43.5 | Very low | 125 Ų | 125 | 143.3 Ų | 143.3 | 77% | 0.767 | 72% | 0.723 | S | S | * | * | trans | -56.5 | 125.4 | 156.4 | 46.1 | 0 | 0 | 0 | 0 | 109.6 | T419 | T419-T421 PolarHBondContact O-N 3.23Š| ||
| 422 | P | 40.2 | Very low | 45.1 | Very low | 119 Ų | 119 | 137.6 Ų | 137.6 | 77% | 0.773 | 70% | 0.702 | S | S | * | * | trans | -91.7 | 97.9 | 155.3 | 28.9 | -16.2 | 0 | 0 | 0 | 107.7 | K420 A424 | K420-P422 WeakPolarHBondContact O-CD 3.47Å; P422-A424 PolarHBondContact O-N 2.89Å | ||
| 423 | E | 42.1 | Very low | 47.1 | Very low | 166 Ų | 166 | 135.7 Ų | 135.7 | 78% | 0.776 | 69% | 0.689 | S | S | * | * | trans | -62.3 | 85.9 | 151.3 | -87.6 | -178.2 | 143.6 | 0 | 0 | 107.5 | H425 | E423-H425 PolarHBondContact O-N 2.9Š| ||
| 424 | A | 38.1 | Very low | 48.9 | Very low | 77 Ų | 77 | 128.7 Ų | 128.7 | 64% | 0.636 | 67% | 0.671 | S | S | * | * | trans | -77.4 | 100.7 | 162.9 | 0 | 0 | 0 | 0 | 0 | 106.9 | P422 V426 | P422-A424 PolarHBondContact O-N 2.89Å; A424-V426 VanDerWaalsContact C-N 3.28Å; A424-V426 PolarHBondContact O-N 3.06Å | ||
| 425 | H | 47 | Very low | 50.8 | Low | 164 Ų | 164 | 124.2 Ų | 124.2 | 76% | 0.759 | 66% | 0.655 | S | S | * | * | trans | -58.3 | 95.9 | 163.7 | -71 | -45 | 0 | 0 | 0 | 108.8 | E423 K427 | E423-H425 PolarHBondContact O-N 2.9Å; H425-K427 PolarHBondContact O-N 3.06Å | ||
| 426 | V | 44.2 | Very low | 52.6 | Low | 113 Ų | 113 | 124.9 Ų | 124.9 | 69% | 0.685 | 65% | 0.65 | S | S | * | * | trans | -70 | 98.1 | 172.3 | -180 | 0 | 0 | 0 | 0 | 107.1 | A424 R428 | A424-V426 VanDerWaalsContact C-N 3.28Å; A424-V426 PolarHBondContact O-N 3.06Å; V426-R428 HydrophobicContact CG1-CG 4.03Å; V426-R428 PolarHBondContact O-N 2.88Å | ||
| 427 | K | 55.5 | Low | 54.8 | Low | 188 Ų | 188 | 122.5 Ų | 122.5 | 82% | 0.817 | 64% | 0.64 | S | S | * | * | trans | -63.2 | 102 | 162 | -71 | -177.1 | 177.9 | -177.3 | 0 | 107.2 | H425 S429 | H425-K427 PolarHBondContact O-N 3.06Å; K427-S429 PolarHBondContact O-N 3.3Å | ||
| 428 | R | 62 | Low | 56 | Low | 212 Ų | 212 | 123.7 Ų | 123.7 | 80% | 0.8 | 63% | 0.634 | S | S | * | * | trans | -78 | 113.1 | 173 | -72.2 | -173.2 | -119 | 112.1 | -1.5 | 108 | V426 | V426-R428 HydrophobicContact CG1-CG 4.03Å; V426-R428 PolarHBondContact O-N 2.88Å | ||
| 429 | S | 56.7 | Low | 57.7 | Low | 72 Ų | 72 | 125.5 Ų | 125.5 | 50% | 0.503 | 64% | 0.643 | S | S | . | * | trans | -87.5 | 135.6 | 162.1 | 50.9 | 0 | 0 | 0 | 0 | 108.8 | K427 | K427-S429 PolarHBondContact O-N 3.3Š| ||
| 430 | I | 65.4 | Low | 59.5 | Low | 99 Ų | 99 | 123.5 Ų | 123.5 | 51% | 0.508 | 65% | 0.646 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -96.4 | 116.3 | 176.8 | -61.2 | 173.6 | 0 | 0 | 0 | 107 | V432 H450 | I430-V432 HydrophobicContact CG2-CG2 4.02Å; I430-H450 PolarHBondContact O-N 3.24Å |
| 431 | L | 63.1 | Low | 61.1 | Low | 103 Ų | 103 | 122.8 Ų | 122.8 | 54% | 0.539 | 65% | 0.645 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -96.7 | 110.1 | 174.9 | -156.8 | 88 | 0 | 0 | 0 | 108.1 | T447 E449 | L431-T447 HydrophobicContact CD1-CG2 3.87Å; L431-T447 HydrophobicContact CD2-CG2 3.63Å; L431-T447 HydrophobicContact CG-CG2 3.61Å; L431-E449 HydrophobicContact CD1-CB 4.07Å; L431-E449 HydrophobicContact CD1-CG 4.09Å |
| 432 | V | 69.9 | Low | 62.9 | Low | 73 Ų | 73 | 122 Ų | 122 | 44% | 0.442 | 64% | 0.635 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -94.3 | 118.3 | 176.1 | -177 | 0 | 0 | 0 | 0 | 108.1 | I430 T448 | I430-V432 HydrophobicContact CG2-CG2 4.02Å; V432-T448 PolarHBondContact N-O 2.94Å; V432-T448 PolarHBondContact O-N 3.02Å |
| 433 | R | 75.6 | Confident | 64.7 | Low | 151 Ų | 151 | 121.9 Ų | 121.9 | 57% | 0.57 | 63% | 0.627 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -108.3 | 112.4 | 178.3 | -164.4 | 175.4 | -174.8 | 140 | 0.5 | 108.2 | V435 E445 | R433-V435 HydrophobicContact CG-CG2 4.21Å; R433-E445 IonicContact CZ-OE1 3.11Å; R433-E445 IonicContact CZ-OE2 2.77Å; R433-E445 IonicContact NE-OE1 2.66Å; R433-E445 PolarHBondContact NE-OE1 2.67Å; R433-E445 IonicContact NH2-OE1 2.76Å; R433-E445 PolarHBondContact NH2-OE1 3.06Å; R433-E445 IonicContact NH2-OE2 2.7Å; R433-E445 PolarHBondContact NH2-OE2 3.31Å |
| 434 | T | 74.9 | Confident | 66.1 | Low | 76 Ų | 76 | 120.5 Ų | 120.5 | 47% | 0.466 | 62% | 0.618 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -101.5 | 121.7 | 175.3 | 19.2 | 0 | 0 | 0 | 0 | 109 | S446 | T434-S446 PolarHBondContact N-O 3.36Å; T434-S446 VanDerWaalsContact N-O 3.16Å; T434-S446 PolarHBondContact O-N 3.37Å; T434-S446 PolarHBondContact OG1-O 2.66Å; T434-S446 PolarHBondContact OG1-OG 2.92Å |
| 435 | V | 76.9 | Confident | 68.1 | Low | 64 Ų | 64 | 121.3 Ų | 121.3 | 39% | 0.388 | 61% | 0.609 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -118.9 | 115.7 | -178 | -173.8 | 0 | 0 | 0 | 0 | 107.9 | R433 T437 I442 | R433-V435 HydrophobicContact CG-CG2 4.21Å; V435-T437 HydrophobicContact CG1-CG2 4.04Å; V435-I442 HydrophobicContact CG1-CB 4.23Å; V435-I442 HydrophobicContact CG1-CD1 4.02Å; V435-I442 HydrophobicContact CG1-CG1 3.76Å; V435-I442 HydrophobicContact CG1-CG2 3.57Å |
| 436 | E | 73.1 | Confident | 69.3 | Low | 131 Ų | 131 | 116.3 Ų | 116.3 | 61% | 0.612 | 59% | 0.592 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -92.9 | 116.2 | 171.7 | -77.2 | -177.4 | 158.7 | 0 | 0 | 109.3 | I443 K444 | E436-I443 PolarHBondContact O-N 3.02Å; E436-K444 HydrophobicContact CB-CB 4.49Å; E436-K444 PolarHBondContact N-O 2.71Å; E436-K444 VanDerWaalsContact N-O 3.08Å |
| 437 | T | 81.9 | Confident | 70.6 | Confident | 90 Ų | 90 | 114.3 Ų | 114.3 | 55% | 0.552 | 58% | 0.58 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -112.4 | 137.4 | 176.9 | 53.5 | 0 | 0 | 0 | 0 | 111.1 | V435 E441 I442 | V435-T437 HydrophobicContact CG1-CG2 4.04Å; T437-E441 WeakPolarHBondContact CA-O 3.42Å; T437-I442 HydrophobicContact CG2-CG1 3.9Å |
| 438 | R | 63.6 | Low | 70.9 | Confident | 178 Ų | 178 | 109 Ų | 109 | 67% | 0.672 | 56% | 0.564 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -130.1 | 131.8 | 166.3 | -169 | -176.1 | 174.4 | 161.7 | 1.5 | 107.5 | G440 E441 I443 | R438-G440 PolarHBondContact O-N 3.01Å; R438-G440 VanDerWaalsContact O-N 3.16Å; R438-E441 PolarHBondContact N-O 3.3Å; R438-E441 PolarHBondContact O-N 3.31Å; R438-I443 HydrophobicContact CB-CD1 3.46Å; R438-I443 VanDerWaalsContact CB-CD1 3.46Å; R438-I443 HydrophobicContact CB-CG1 4.5Å; R438-I443 HydrophobicContact CG-CD1 4.49Å |
| 439 | D | 67.6 | Low | 71 | Confident | 152 Ų | 152 | 104.1 Ų | 104.1 | 81% | 0.813 | 55% | 0.55 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 55.3 | 32.1 | 179.8 | -50.7 | -38.5 | 0 | 0 | 0 | 113.9 | E441 | D439-E441 VanDerWaalsContact C-N 3.29Å; D439-E441 PolarHBondContact O-N 2.98Å |
| 440 | G | 74.3 | Confident | 71.1 | Confident | 74 Ų | 74 | 106.9 Ų | 106.9 | 76% | 0.763 | 56% | 0.555 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 82.8 | -6.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 115.5 | R438 | R438-G440 PolarHBondContact O-N 3.01Å; R438-G440 VanDerWaalsContact O-N 3.16Å |
| 441 | E | 67.5 | Low | 70.8 | Confident | 151 Ų | 151 | 109.3 Ų | 109.3 | 71% | 0.706 | 56% | 0.562 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -99.8 | 140.1 | 174.4 | -67.6 | -169.6 | 165.7 | 0 | 0 | 111.8 | T437 R438 D439 I443 | T437-E441 WeakPolarHBondContact CA-O 3.42Å; R438-E441 PolarHBondContact N-O 3.3Å; R438-E441 PolarHBondContact O-N 3.31Å; D439-E441 VanDerWaalsContact C-N 3.29Å; D439-E441 PolarHBondContact O-N 2.98Å; E441-I443 PolarHBondContact O-N 3.4Å |
| 442 | I | 80.4 | Confident | 70.3 | Confident | 108 Ų | 108 | 110.2 Ų | 110.2 | 55% | 0.554 | 57% | 0.567 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -79.5 | 109.5 | 178.9 | -60.6 | 170.4 | 0 | 0 | 0 | 108.5 | V435 T437 E445 | V435-I442 HydrophobicContact CG1-CB 4.23Å; V435-I442 HydrophobicContact CG1-CD1 4.02Å; V435-I442 HydrophobicContact CG1-CG1 3.76Å; V435-I442 HydrophobicContact CG1-CG2 3.57Å; T437-I442 HydrophobicContact CG2-CG1 3.9Å; I442-E445 HydrophobicContact CG2-CB 4.48Å |
| 443 | I | 78.9 | Confident | 69.3 | Low | 118 Ų | 118 | 114.3 Ų | 114.3 | 61% | 0.605 | 59% | 0.586 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -91.4 | -28.2 | -175.8 | -61.8 | -178.7 | 0 | 0 | 0 | 111.2 | E436 R438 E441 | E436-I443 PolarHBondContact O-N 3.02Å; R438-I443 HydrophobicContact CB-CD1 3.46Å; R438-I443 VanDerWaalsContact CB-CD1 3.46Å; R438-I443 HydrophobicContact CB-CG1 4.5Å; R438-I443 HydrophobicContact CG-CD1 4.49Å; E441-I443 PolarHBondContact O-N 3.4Å |
| 444 | K | 72.6 | Confident | 68.3 | Low | 137 Ų | 137 | 115.8 Ų | 115.8 | 60% | 0.596 | 62% | 0.615 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -152.8 | 135.1 | 179.1 | -159.3 | 174.2 | 179.7 | -177.3 | 0 | 111.5 | E436 | E436-K444 HydrophobicContact CB-CB 4.49Å; E436-K444 PolarHBondContact N-O 2.71Å; E436-K444 VanDerWaalsContact N-O 3.08Å |
| 445 | E | 78.8 | Confident | 67.9 | Low | 93 Ų | 93 | 117.8 Ų | 117.8 | 44% | 0.435 | 62% | 0.622 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -127.9 | 121.3 | 177.5 | -179.5 | 162 | -113.7 | 0 | 0 | 109.7 | R433 I442 | R433-E445 IonicContact CZ-OE1 3.11Å; R433-E445 IonicContact CZ-OE2 2.77Å; R433-E445 IonicContact NE-OE1 2.66Å; R433-E445 PolarHBondContact NE-OE1 2.67Å; R433-E445 IonicContact NH2-OE1 2.76Å; R433-E445 PolarHBondContact NH2-OE1 3.06Å; R433-E445 IonicContact NH2-OE2 2.7Å; R433-E445 PolarHBondContact NH2-OE2 3.31Å; I442-E445 HydrophobicContact CG2-CB 4.48Å |
| 446 | S | 72.2 | Confident | 67.5 | Low | 59 Ų | 59 | 120.6 Ų | 120.6 | 41% | 0.413 | 63% | 0.634 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -126 | 133 | 172.8 | 60.9 | 0 | 0 | 0 | 0 | 109.7 | T434 | T434-S446 PolarHBondContact N-O 3.36Å; T434-S446 VanDerWaalsContact N-O 3.16Å; T434-S446 PolarHBondContact O-N 3.37Å; T434-S446 PolarHBondContact OG1-O 2.66Å; T434-S446 PolarHBondContact OG1-OG 2.92Å |
| 447 | T | 72.8 | Confident | 67.2 | Low | 71 Ų | 71 | 120 Ų | 120 | 44% | 0.436 | 64% | 0.636 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -117.8 | 119.3 | 178 | -55.6 | 0 | 0 | 0 | 0 | 108 | L431 | L431-T447 HydrophobicContact CD1-CG2 3.87Å; L431-T447 HydrophobicContact CD2-CG2 3.63Å; L431-T447 HydrophobicContact CG-CG2 3.61Å |
| 448 | T | 60.8 | Low | 66.3 | Low | 76 Ų | 76 | 121.8 Ų | 121.8 | 47% | 0.466 | 64% | 0.641 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -113.6 | 123.1 | 175.1 | 46.2 | 0 | 0 | 0 | 0 | 109.4 | V432 | V432-T448 PolarHBondContact N-O 2.94Å; V432-T448 PolarHBondContact O-N 3.02Å |
| 449 | E | 63.7 | Low | 66.5 | Low | 111 Ų | 111 | 118.3 Ų | 118.3 | 52% | 0.519 | 64% | 0.639 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -91 | 109.4 | 178 | -169.2 | -173.5 | 174.3 | 0 | 0 | 108.8 | L431 K451 | L431-E449 HydrophobicContact CD1-CB 4.07Å; L431-E449 HydrophobicContact CD1-CG 4.09Å; E449-K451 WeakPolarHBondContact OE1-CE 3.48Å |
| 450 | H | 59.2 | Low | 66.4 | Low | 129 Ų | 129 | 116 Ų | 116 | 60% | 0.597 | 63% | 0.627 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -91.6 | 111.4 | 168.6 | -95.1 | -69.4 | 0 | 0 | 0 | 109.1 | I430 | I430-H450 PolarHBondContact O-N 3.24Å |
| 451 | K | 58.3 | Low | 65.8 | Low | 150 Ų | 150 | 119 Ų | 119 | 65% | 0.652 | 62% | 0.617 | S | S | * | * | trans | -87.7 | 106.6 | 168.3 | -74.7 | -178.4 | 179.5 | 173.2 | 0 | 108.2 | E449 L453 | E449-K451 WeakPolarHBondContact OE1-CE 3.48Å; K451-L453 PolarHBondContact O-N 3.42Å | ||
| 452 | D | 53 | Low | 65.7 | Low | 123 Ų | 123 | 116.5 Ų | 116.5 | 66% | 0.658 | 61% | 0.611 | S | S | * | * | trans | -67.8 | 113 | 164.5 | -70 | -27 | 0 | 0 | 0 | 107.8 | ||||
| 453 | L | 49.5 | Very low | 64.5 | Low | 159 Ų | 159 | 117.3 Ų | 117.3 | 83% | 0.832 | 62% | 0.615 | S | S | * | * | trans | -72 | 144.5 | 167.4 | -80.9 | 159.1 | 0 | 0 | 0 | 108.3 | K451 | K451-L453 PolarHBondContact O-N 3.42Š| ||
| 454 | P | 53.9 | Low | 63.1 | Low | 181 Ų | 181 | 117.2 Ų | 117.2 | 100% | 1.175 | 62% | 0.616 | S | S | * | * | trans | -60.7 | 0 | -162.5 | 26.1 | -36.1 | 0 | 0 | 0 | 115.1 |
Retrieved 454 of 454 residues in 659.2 ms
(Link to these results)