| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 45.6 | Very low | 47.3 | Very low | 243 Ų | 243 | 185.2 Ų | 185.2 | 100% | 1.197 | 90% | 0.899 | S | S | * | * | 0 | 111.3 | 0 | -76.2 | 170.8 | 147.1 | 0 | 0 | 109.4 | |||||
| 2 | R | 42.4 | Very low | 46.4 | Very low | 251 Ų | 251 | 183.9 Ų | 183.9 | 95% | 0.947 | 90% | 0.898 | S | S | * | * | trans | -140.5 | 99.1 | 168.8 | -76.7 | -177.5 | 171.5 | 166.5 | -3.3 | 106.6 | R4 | R2-R4 PolarHBondContact O-N 3.45Š| ||
| 3 | K | 48.4 | Very low | 45.5 | Very low | 204 Ų | 204 | 178.6 Ų | 178.6 | 89% | 0.887 | 89% | 0.891 | S | S | * | * | trans | -81.2 | 112.8 | 177.4 | -74.6 | -178.8 | 176.6 | 178.7 | 0 | 108 | ||||
| 4 | R | 48.1 | Very low | 44.8 | Very low | 247 Ų | 247 | 178.2 Ų | 178.2 | 93% | 0.932 | 89% | 0.892 | S | S | * | * | P | Polyproline II helix | trans | -76.1 | 125.2 | 164.5 | -82.8 | 178.9 | 157.4 | -157.8 | -5.1 | 107.7 | R2 | R2-R4 PolarHBondContact O-N 3.45Š|
| 5 | L | 51.4 | Low | 44.5 | Very low | 173 Ų | 173 | 175.4 Ų | 175.4 | 91% | 0.906 | 89% | 0.888 | S | S | * | * | P | Polyproline II helix | trans | -92.5 | 126.2 | 171.6 | -69.7 | 164.8 | 0 | 0 | 0 | 108.2 | ||
| 6 | S | 57.3 | Low | 43.9 | Very low | 118 Ų | 118 | 177 Ų | 177 | 83% | 0.825 | 89% | 0.887 | S | S | * | * | P | Polyproline II helix | trans | -88.4 | 142.5 | 176.4 | -44.5 | 0 | 0 | 0 | 0 | 110 | ||
| 7 | A | 55.9 | Low | 43.4 | Very low | 93 Ų | 93 | 170.2 Ų | 170.2 | 77% | 0.769 | 87% | 0.872 | S | S | * | * | P | Polyproline II helix | trans | -74.2 | 150.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||
| 8 | P | 53.1 | Low | 43.6 | Very low | 127 Ų | 127 | 168.5 Ų | 168.5 | 83% | 0.825 | 87% | 0.874 | S | S | * | * | P | Polyproline II helix | trans | -82.7 | 146.6 | -175.4 | 26.4 | -22.8 | 0 | 0 | 0 | 113.7 | ||
| 9 | E | 40.8 | Very low | 42.9 | Very low | 179 Ų | 179 | 163.6 Ų | 163.6 | 84% | 0.836 | 87% | 0.869 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 130.5 | 176.5 | -70.5 | -167 | 152.2 | 0 | 0 | 112.3 | ||
| 10 | L | 40.9 | Very low | 42.4 | Very low | 169 Ų | 169 | 162.5 Ų | 162.5 | 89% | 0.885 | 86% | 0.863 | S | S | * | * | trans | -85.6 | 113.4 | 171.3 | -69.1 | 169.3 | 0 | 0 | 0 | 109.7 | ||||
| 11 | R | 36.1 | Very low | 41.9 | Very low | 233 Ų | 233 | 161.6 Ų | 161.6 | 88% | 0.879 | 86% | 0.859 | S | S | * | * | trans | -89.4 | 110.5 | 169.1 | -79.8 | -171.4 | 165.4 | -177.1 | -4.2 | 110.1 | ||||
| 12 | L | 36.2 | Very low | 41.3 | Very low | 170 Ų | 170 | 154 Ų | 154 | 89% | 0.89 | 84% | 0.842 | S | S | * | * | trans | -87.7 | 109.9 | 168.5 | -79.5 | 155.4 | 0 | 0 | 0 | 109.2 | ||||
| 13 | S | 35.7 | Very low | 40.8 | Very low | 115 Ų | 115 | 147.1 Ų | 147.1 | 80% | 0.804 | 84% | 0.84 | S | S | * | * | trans | -95.3 | 105.8 | 166.8 | 54.2 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 14 | L | 35.8 | Very low | 40.2 | Very low | 173 Ų | 173 | 142.7 Ų | 142.7 | 91% | 0.906 | 83% | 0.834 | S | S | * | * | trans | -88.3 | 114.9 | 171.7 | -154.9 | 85 | 0 | 0 | 0 | 108.1 | ||||
| 15 | T | 40.3 | Very low | 40.3 | Very low | 136 Ų | 136 | 136.2 Ų | 136.2 | 83% | 0.834 | 82% | 0.824 | S | S | * | * | trans | -125.2 | 115.3 | 167.4 | 57.5 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 16 | K | 34.5 | Very low | 39.2 | Very low | 201 Ų | 201 | 133.9 Ų | 133.9 | 87% | 0.874 | 82% | 0.817 | S | S | * | * | trans | -70.9 | 138.1 | 175.5 | -179 | 177.5 | 175.2 | 179.8 | 0 | 110.3 | ||||
| 17 | G | 34.8 | Very low | 37.8 | Very low | 61 Ų | 61 | 136.8 Ų | 136.8 | 63% | 0.629 | 82% | 0.818 | S | S | * | * | trans | -67.5 | -173.8 | 165.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 18 | P | 46.8 | Very low | 36.7 | Very low | 140 Ų | 140 | 137.4 Ų | 137.4 | 91% | 0.909 | 82% | 0.817 | S | S | * | * | cis | -141.8 | -179.5 | 25.7 | 38.6 | -17.8 | 0 | 0 | 0 | 115.6 | ||||
| 19 | G | 30.4 | Very low | 35.7 | Very low | 75 Ų | 75 | 137.8 Ų | 137.8 | 77% | 0.773 | 82% | 0.817 | S | S | * | * | trans | 133.8 | 109.2 | 146.7 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 20 | N | 33.3 | Very low | 35.9 | Very low | 141 Ų | 141 | 134.7 Ų | 134.7 | 75% | 0.754 | 81% | 0.812 | S | S | * | * | 97 | 121.2 | 126.8 | -137.5 | 50.1 | 0 | 0 | 0 | 123.2 | |||||
| 21 | D | 32.9 | Very low | 35.5 | Very low | 145 Ų | 145 | 132.4 Ų | 132.4 | 78% | 0.775 | 81% | 0.81 | S | S | * | * | trans | 59.8 | 128.8 | 142.9 | -64.2 | -14.2 | 0 | 0 | 0 | 124.6 | ||||
| 22 | G | 31.5 | Very low | 35.6 | Very low | 82 Ų | 82 | 126.9 Ų | 126.9 | 85% | 0.845 | 81% | 0.807 | S | S | * | * | trans | 166.3 | 116.8 | 157.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 23 | A | 32.6 | Very low | 36.1 | Very low | 108 Ų | 108 | 123.8 Ų | 123.8 | 89% | 0.893 | 80% | 0.797 | S | S | * | * | trans | -63.5 | 161.2 | -171.1 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 24 | S | 36.3 | Very low | 36 | Very low | 111 Ų | 111 | 126 Ų | 126 | 78% | 0.776 | 80% | 0.8 | S | S | * | * | trans | -71.9 | 177.9 | 170.1 | -31.3 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 25 | P | 48.7 | Very low | 36 | Very low | 111 Ų | 111 | 121 Ų | 121 | 72% | 0.721 | 79% | 0.79 | S | S | * | * | cis | -153.6 | 176.4 | 41.3 | 41.5 | -17.4 | 0 | 0 | 0 | 120.1 | ||||
| 26 | T | 28.3 | Very low | 36.3 | Very low | 124 Ų | 124 | 119.9 Ų | 119.9 | 76% | 0.761 | 79% | 0.788 | S | S | * | * | trans | 63.9 | 118.3 | 153.7 | 51.8 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 27 | Q | 29.6 | Very low | 36.5 | Very low | 179 Ų | 179 | 115.4 Ų | 115.4 | 84% | 0.836 | 78% | 0.782 | S | S | * | * | 168.7 | 144.2 | 92.8 | -116.6 | 174.7 | 45.1 | 0 | 0 | 112.7 | |||||
| 28 | S | 31.8 | Very low | 36.9 | Very low | 106 Ų | 106 | 119.6 Ų | 119.6 | 74% | 0.741 | 79% | 0.79 | S | S | * | * | trans | 84.4 | 100.4 | 151.9 | -45 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 29 | T | 32.2 | Very low | 36.7 | Very low | 135 Ų | 135 | 120.8 Ų | 120.8 | 83% | 0.828 | 79% | 0.788 | S | S | * | * | trans | -72.3 | 175.5 | 144.3 | 50.8 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 30 | P | 46.2 | Very low | 37.4 | Very low | 114 Ų | 114 | 125.8 Ų | 125.8 | 74% | 0.74 | 79% | 0.791 | S | S | * | * | cis | -139.9 | 163.3 | 9.7 | 38.8 | -19.8 | 0 | 0 | 0 | 115.9 | ||||
| 31 | S | 30.7 | Very low | 38.4 | Very low | 120 Ų | 120 | 125.5 Ų | 125.5 | 84% | 0.839 | 79% | 0.794 | S | S | * | * | trans | 179 | 114.7 | 131 | 28.9 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 32 | S | 39.8 | Very low | 39.1 | Very low | 118 Ų | 118 | 126.1 Ų | 126.1 | 83% | 0.825 | 80% | 0.797 | S | S | * | * | trans | -108.6 | 160.6 | 149.5 | -50 | 0 | 0 | 0 | 0 | 104.8 | ||||
| 33 | P | 45.6 | Very low | 40.1 | Very low | 105 Ų | 105 | 130.1 Ų | 130.1 | 68% | 0.682 | 79% | 0.794 | S | S | * | * | -152.2 | 179.6 | 52.9 | 39.8 | -16.7 | 0 | 0 | 0 | 116.9 | |||||
| 34 | D | 34 | Very low | 40.5 | Very low | 160 Ų | 160 | 133 Ų | 133 | 86% | 0.856 | 79% | 0.794 | S | S | * | * | trans | 77.4 | 124.9 | 154.2 | -60.2 | -21.3 | 0 | 0 | 0 | 120.4 | ||||
| 35 | G | 35.2 | Very low | 40.8 | Very low | 68 Ų | 68 | 135.6 Ų | 135.6 | 70% | 0.701 | 79% | 0.794 | S | S | * | * | trans | 165.7 | 55.6 | 171.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | S37 | G35-S37 PolarHBondContact O-N 2.76Š| ||
| 36 | S | 46.8 | Very low | 41.1 | Very low | 113 Ų | 113 | 136.3 Ų | 136.3 | 79% | 0.79 | 80% | 0.796 | S | S | * | * | trans | -57.7 | 129.6 | 156.8 | 54.1 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 37 | S | 38.3 | Very low | 41.8 | Very low | 107 Ų | 107 | 136.7 Ų | 136.7 | 75% | 0.748 | 80% | 0.801 | S | S | * | * | trans | -148.8 | 100.7 | 160.9 | -48.9 | 0 | 0 | 0 | 0 | 108.3 | G35 L39 | G35-S37 PolarHBondContact O-N 2.76Å; S37-L39 PolarHBondContact O-N 2.93Å | ||
| 38 | D | 44.8 | Very low | 42.4 | Very low | 149 Ų | 149 | 133.1 Ų | 133.1 | 80% | 0.797 | 80% | 0.795 | S | S | * | * | trans | -50.6 | 125 | 161 | -60.4 | -59.7 | 0 | 0 | 0 | 109.2 | E40 | D38-E40 PolarHBondContact O-N 3.38Š| ||
| 39 | L | 42.1 | Very low | 42.9 | Very low | 165 Ų | 165 | 134.6 Ų | 134.6 | 86% | 0.864 | 80% | 0.795 | S | S | * | * | trans | -83.9 | 89.1 | 169.8 | -83.8 | 155.5 | 0 | 0 | 0 | 107.5 | S37 V41 | S37-L39 PolarHBondContact O-N 2.93Å; L39-V41 PolarHBondContact O-N 3.39Å | ||
| 40 | E | 44.2 | Very low | 43.4 | Very low | 181 Ų | 181 | 133.8 Ų | 133.8 | 85% | 0.846 | 80% | 0.795 | S | S | * | * | trans | -60 | 115.5 | 163.4 | -73.6 | -178.6 | 135 | 0 | 0 | 108.8 | D38 D42 | D38-E40 PolarHBondContact O-N 3.38Å; E40-D42 VanDerWaalsContact C-N 3.3Å; E40-D42 PolarHBondContact O-N 3.01Å | ||
| 41 | V | 54.2 | Low | 43.4 | Very low | 135 Ų | 135 | 136.1 Ų | 136.1 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | trans | -97.1 | 60.7 | 175.8 | -163.1 | 0 | 0 | 0 | 0 | 107.9 | L39 | L39-V41 PolarHBondContact O-N 3.39Š| ||
| 42 | D | 47.6 | Very low | 44.2 | Very low | 157 Ų | 157 | 138.4 Ų | 138.4 | 84% | 0.84 | 79% | 0.794 | S | S | * | * | trans | -148.4 | 56.2 | 177.2 | -133.7 | 6.6 | 0 | 0 | 0 | 111 | E40 | E40-D42 VanDerWaalsContact C-N 3.3Å; E40-D42 PolarHBondContact O-N 3.01Å | ||
| 43 | E | 52.5 | Low | 44.2 | Very low | 166 Ų | 166 | 141.4 Ų | 141.4 | 78% | 0.776 | 80% | 0.799 | S | S | * | * | trans | -163.8 | 64 | 163.6 | -127.4 | 177.6 | -177 | 0 | 0 | 110.7 | ||||
| 44 | L | 42.8 | Very low | 43.7 | Very low | 170 Ų | 170 | 143.6 Ų | 143.6 | 89% | 0.89 | 81% | 0.805 | S | S | * | * | trans | -97.9 | 72.7 | 159.6 | -80.1 | 169 | 0 | 0 | 0 | 108.4 | T46 | L44-T46 PolarHBondContact O-N 3.21Š| ||
| 45 | E | 42.6 | Very low | 43.9 | Very low | 165 Ų | 165 | 140.6 Ų | 140.6 | 77% | 0.771 | 80% | 0.797 | S | S | * | * | trans | -64.5 | 110.4 | 159.5 | -66.7 | -162.9 | 139.2 | 0 | 0 | 108.3 | ||||
| 46 | T | 53.3 | Low | 43.9 | Very low | 126 Ų | 126 | 141 Ų | 141 | 77% | 0.773 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 131.2 | 169.7 | 49.9 | 0 | 0 | 0 | 0 | 109 | L44 S48 | L44-T46 PolarHBondContact O-N 3.21Å; T46-S48 PolarHBondContact O-N 2.86Å |
| 47 | P | 43.2 | Very low | 43.6 | Very low | 131 Ų | 131 | 142 Ų | 142 | 85% | 0.851 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 126.7 | -178.8 | -17.3 | 28.9 | 0 | 0 | 0 | 111.2 | ||
| 48 | S | 42.9 | Very low | 43.8 | Very low | 104 Ų | 104 | 145.5 Ų | 145.5 | 73% | 0.727 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -70.5 | 140.6 | 164.4 | -169.1 | 0 | 0 | 0 | 0 | 110.5 | T46 | T46-S48 PolarHBondContact O-N 2.86Š|
| 49 | D | 42.4 | Very low | 43.5 | Very low | 137 Ų | 137 | 143 Ų | 143 | 73% | 0.733 | 78% | 0.78 | S | S | * | * | trans | 52.6 | 110.2 | 162.6 | -73.5 | -20.6 | 0 | 0 | 0 | 119.9 | ||||
| 50 | S | 41.8 | Very low | 43.4 | Very low | 119 Ų | 119 | 142.4 Ų | 142.4 | 83% | 0.832 | 77% | 0.772 | S | S | * | * | -166.6 | 97.2 | 123 | -78.1 | 0 | 0 | 0 | 0 | 110.7 | |||||
| 51 | E | 47.5 | Very low | 43.5 | Very low | 162 Ų | 162 | 141.5 Ų | 141.5 | 76% | 0.757 | 76% | 0.761 | S | S | * | * | 44.6 | 137.8 | 128.1 | -63.2 | -73.3 | 102.7 | 0 | 0 | 121.3 | |||||
| 52 | Q | 47.6 | Very low | 43 | Very low | 169 Ų | 169 | 138.4 Ų | 138.4 | 79% | 0.79 | 74% | 0.738 | S | S | * | * | trans | 79.3 | 69.5 | 153.7 | -70.5 | 173.6 | 0.3 | 0 | 0 | 118.4 | ||||
| 53 | L | 38.4 | Very low | 43 | Very low | 181 Ų | 181 | 137 Ų | 137 | 95% | 0.948 | 73% | 0.731 | S | S | * | * | -156.4 | 69.1 | 129.1 | -76.1 | -172.4 | 0 | 0 | 0 | 107.8 | |||||
| 54 | D | 35.7 | Very low | 42.5 | Very low | 150 Ų | 150 | 137.2 Ų | 137.2 | 80% | 0.802 | 73% | 0.731 | S | S | * | * | trans | -108.8 | 115.8 | 167.3 | -158.3 | 11.4 | 0 | 0 | 0 | 110.2 | G56 | D54-G56 PolarHBondContact O-N 3.46Š| ||
| 55 | S | 38.1 | Very low | 42.7 | Very low | 98 Ų | 98 | 134.4 Ų | 134.4 | 69% | 0.685 | 72% | 0.717 | S | S | * | * | trans | -56.9 | 100.7 | 173.5 | 48.2 | 0 | 0 | 0 | 0 | 109.2 | H57 | S55-H57 PolarHBondContact O-N 3.2Š| ||
| 56 | G | 35.8 | Very low | 42.5 | Very low | 76 Ų | 76 | 132.1 Ų | 132.1 | 78% | 0.784 | 72% | 0.716 | S | S | * | * | trans | -62.3 | 68.2 | 169.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | D54 | D54-G56 PolarHBondContact O-N 3.46Š| ||
| 57 | H | 39.5 | Very low | 42 | Very low | 134 Ų | 134 | 136.7 Ų | 136.7 | 62% | 0.62 | 72% | 0.719 | S | S | * | * | trans | -126.2 | 62.1 | 155.1 | -103.6 | -65.9 | 0 | 0 | 0 | 106.6 | S55 F59 | S55-H57 PolarHBondContact O-N 3.2Å; H57-F59 PolarHBondContact O-N 2.86Å; H57-F59 VanDerWaalsContact O-N 3.11Å | ||
| 58 | E | 43.4 | Very low | 42.1 | Very low | 180 Ų | 180 | 135 Ų | 135 | 84% | 0.841 | 72% | 0.716 | S | S | * | * | trans | -48.6 | 119.9 | 142.2 | -73.2 | -164.4 | 127.9 | 0 | 0 | 105.8 | E60 | E58-E60 PolarHBondContact O-N 3.27Š| ||
| 59 | F | 37.9 | Very low | 42.1 | Very low | 97 Ų | 97 | 138.5 Ų | 138.5 | 43% | 0.425 | 72% | 0.721 | S | S | . | * | trans | -68.8 | 79.5 | 175.8 | -80.6 | -99.2 | 0 | 0 | 0 | 107.5 | H57 W61 E62 | H57-F59 PolarHBondContact O-N 2.86Å; H57-F59 VanDerWaalsContact O-N 3.11Å; F59-W61 AromaticContact CD1-CD1 3.52Å; F59-W61 AromaticContact CD1-NE1 3.66Å; F59-W61 PolarHBondContact O-N 3.11Å; F59-E62 PolarHBondContact O-N 2.7Å; F59-E62 VanDerWaalsContact O-N 3.15Å | ||
| 60 | E | 40.6 | Very low | 42.2 | Very low | 152 Ų | 152 | 135.8 Ų | 135.8 | 71% | 0.71 | 73% | 0.726 | S | S | * | * | G | 310 helix | trans | -54.1 | -16.7 | 178.2 | -148.9 | 172.5 | -168 | 0 | 0 | 112.3 | E58 E62 D63 | E58-E60 PolarHBondContact O-N 3.27Å; E60-E62 PolarHBondContact O-N 2.8Å; E60-E62 VanDerWaalsContact O-N 3.14Å; E60-D63 PolarHBondContact O-N 3.5Å |
| 61 | W | 45.2 | Very low | 42.5 | Very low | 163 Ų | 163 | 134.8 Ų | 134.8 | 62% | 0.617 | 71% | 0.71 | S | S | * | * | G | 310 helix | trans | -66.4 | -7.8 | 174.8 | -21.9 | 94.3 | 0 | 0 | 0 | 115.1 | F59 | F59-W61 AromaticContact CD1-CD1 3.52Å; F59-W61 AromaticContact CD1-NE1 3.66Å; F59-W61 PolarHBondContact O-N 3.11Å |
| 62 | E | 44.8 | Very low | 42.4 | Very low | 70 Ų | 70 | 129.1 Ų | 129.1 | 33% | 0.327 | 70% | 0.696 | S | S | . | * | G | 310 helix | trans | -82.5 | -19.3 | 177.3 | -67.4 | -158.2 | 127.7 | 0 | 0 | 114 | F59 E60 R201 R204 | F59-E62 PolarHBondContact O-N 2.7Å; F59-E62 VanDerWaalsContact O-N 3.15Å; E60-E62 PolarHBondContact O-N 2.8Å; E60-E62 VanDerWaalsContact O-N 3.14Å; E62-R201 PolarHBondContact O-NH2 2.78Å; E62-R204 IonicContact OE1-CZ 3.36Å; E62-R204 IonicContact OE1-NH1 2.77Å; E62-R204 PolarHBondContact OE1-NH1 2.85Å |
| 63 | D | 46.6 | Very low | 42.4 | Very low | 128 Ų | 128 | 123.8 Ų | 123.8 | 68% | 0.684 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.6 | -21.5 | -173.6 | -88.9 | -16.4 | 0 | 0 | 0 | 115.4 | E60 L65 | E60-D63 PolarHBondContact O-N 3.5Å; D63-L65 PolarHBondContact O-N 3.38Å |
| 64 | E | 41.8 | Very low | 42.7 | Very low | 169 Ų | 169 | 119.8 Ų | 119.8 | 79% | 0.79 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -86.3 | 1.1 | -178.7 | -72.8 | -160.1 | 131.3 | 0 | 0 | 116.1 | ||
| 65 | L | 48.5 | Very low | 43.4 | Very low | 112 Ų | 112 | 117 Ų | 117 | 59% | 0.586 | 65% | 0.65 | S | S | * | * | S | Bend | trans | -95.4 | 133.8 | 178.1 | -63.2 | 177 | 0 | 0 | 0 | 111.5 | D63 R67 R201 | D63-L65 PolarHBondContact O-N 3.38Å; L65-R67 PolarHBondContact O-N 3.27Å; L65-R201 PolarHBondContact O-NH1 3.28Å |
| 66 | P | 38.5 | Very low | 43.8 | Very low | 116 Ų | 116 | 113.4 Ų | 113.4 | 75% | 0.753 | 63% | 0.626 | S | S | * | * | trans | -50.7 | 137.1 | -174.4 | 18 | -29.9 | 0 | 0 | 0 | 110.8 | A68 | P66-A68 PolarHBondContact O-N 2.96Š| ||
| 67 | R | 42.9 | Very low | 44.4 | Very low | 223 Ų | 223 | 112.5 Ų | 112.5 | 84% | 0.842 | 61% | 0.611 | S | S | * | * | trans | -58.2 | 108.9 | 174.1 | -72.7 | -179.7 | -179.2 | 179.4 | 0.7 | 107 | L65 E69 | L65-R67 PolarHBondContact O-N 3.27Å; R67-E69 PolarHBondContact O-N 3.05Å | ||
| 68 | A | 43.9 | Very low | 44.7 | Very low | 95 Ų | 95 | 113.9 Ų | 113.9 | 79% | 0.785 | 62% | 0.618 | S | S | * | * | trans | -59.5 | 113.9 | 166.2 | 0 | 0 | 0 | 0 | 0 | 106.9 | P66 G70 | P66-A68 PolarHBondContact O-N 2.96Å; A68-G70 PolarHBondContact O-N 3Å | ||
| 69 | E | 43.3 | Very low | 45.1 | Very low | 178 Ų | 178 | 111.2 Ų | 111.2 | 83% | 0.832 | 60% | 0.6 | S | S | * | * | trans | -55.6 | 130 | 174 | -66.4 | -178.3 | 152.6 | 0 | 0 | 108.1 | R67 L71 | R67-E69 PolarHBondContact O-N 3.05Å; E69-L71 PolarHBondContact O-N 3.18Å; E69-L71 VanDerWaalsContact O-N 3.1Å | ||
| 70 | G | 45.2 | Very low | 45.8 | Very low | 80 Ų | 80 | 110.8 Ų | 110.8 | 83% | 0.825 | 60% | 0.602 | S | S | * | * | trans | -63.4 | 113.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 109.1 | A68 G72 | A68-G70 PolarHBondContact O-N 3Å; G70-G72 PolarHBondContact O-N 3.26Å | ||
| 71 | L | 47.3 | Very low | 46.2 | Very low | 97 Ų | 97 | 105.7 Ų | 105.7 | 51% | 0.508 | 59% | 0.59 | S | S | . | * | trans | -66.7 | 127.1 | 172.7 | -61.8 | 168.8 | 0 | 0 | 0 | 108 | E69 E75 | E69-L71 PolarHBondContact O-N 3.18Å; E69-L71 VanDerWaalsContact O-N 3.1Å; L71-E75 WeakPolarHBondContact CD2-OE2 3.46Å | ||
| 72 | G | 44.5 | Very low | 46.6 | Very low | 44 Ų | 44 | 109.5 Ų | 109.5 | 45% | 0.454 | 61% | 0.605 | S | S | . | * | trans | -61.7 | 154.7 | -177.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | G70 S74 E75 A76 | G70-G72 PolarHBondContact O-N 3.26Å; G72-S74 PolarHBondContact O-N 3.3Å; G72-E75 PolarHBondContact O-N 3.32Å; G72-A76 PolarHBondContact O-N 3.28Å | ||
| 73 | A | 49.1 | Very low | 47.4 | Very low | 57 Ų | 57 | 107.6 Ų | 107.6 | 47% | 0.471 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -50.2 | -31.5 | -178.9 | 0 | 0 | 0 | 0 | 0 | 114 | A77 | A73-A77 WeakPolarHBondContact O-CB 3.46Å; A73-A77 PolarHBondContact O-N 3.46Å |
| 74 | S | 45.2 | Very low | 48.8 | Very low | 97 Ų | 97 | 102.5 Ų | 102.5 | 68% | 0.678 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -67.6 | -35 | 176.8 | -168.1 | 0 | 0 | 0 | 0 | 113.4 | G72 E78 | G72-S74 PolarHBondContact O-N 3.3Å; S74-E78 WeakPolarHBondContact O-CG 3.48Å; S74-E78 PolarHBondContact O-N 3.27Å |
| 75 | E | 48.4 | Very low | 50.9 | Low | 91 Ų | 91 | 98.3 Ų | 98.3 | 43% | 0.425 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -83.3 | -31.4 | -179.3 | -157.1 | 179.6 | 163.2 | 0 | 0 | 111.2 | L71 G72 R79 | L71-E75 WeakPolarHBondContact CD2-OE2 3.46Å; G72-E75 PolarHBondContact O-N 3.32Å; E75-R79 VanDerWaalsContact O-CG 3.31Å; E75-R79 WeakPolarHBondContact O-CG 3.17Å; E75-R79 PolarHBondContact O-N 2.83Å |
| 76 | A | 48.1 | Very low | 52.9 | Low | 23 Ų | 23 | 96.6 Ų | 96.6 | 19% | 0.19 | 55% | 0.545 | C | S | . | . | H | α-helix | trans | -63 | -43.4 | 167.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | G72 R79 L80 A169 | G72-A76 PolarHBondContact O-N 3.28Å; A76-R79 PolarHBondContact O-N 3.19Å; A76-L80 WeakPolarHBondContact O-CB 3.43Å; A76-L80 WeakPolarHBondContact O-CD1 3.46Å; A76-L80 WeakPolarHBondContact O-CG 3.46Å; A76-L80 PolarHBondContact O-N 3.48Å; A76-A169 HydrophobicContact CB-CB 4.44Å |
| 77 | A | 47.1 | Very low | 55.4 | Low | 56 Ų | 56 | 95.9 Ų | 95.9 | 46% | 0.463 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -64.7 | -40.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | A73 R79 L80 G81 | A73-A77 WeakPolarHBondContact O-CB 3.46Å; A73-A77 PolarHBondContact O-N 3.46Å; A77-R79 VanDerWaalsContact C-N 3.34Å; A77-R79 PolarHBondContact O-N 3.46Å; A77-L80 PolarHBondContact O-N 2.87Å; A77-G81 PolarHBondContact O-N 3.21Å |
| 78 | E | 46.8 | Very low | 57.8 | Low | 164 Ų | 164 | 87.4 Ų | 87.4 | 77% | 0.766 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62 | -38.7 | 172.7 | -78.7 | -109.9 | 132.6 | 0 | 0 | 112 | S74 G81 | S74-E78 WeakPolarHBondContact O-CG 3.48Å; S74-E78 PolarHBondContact O-N 3.27Å; E78-G81 PolarHBondContact O-N 3Å |
| 79 | R | 51.3 | Low | 60 | Low | 123 Ų | 123 | 86.9 Ų | 86.9 | 46% | 0.464 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -71.7 | -30.8 | 174.7 | -69.4 | -175.2 | 106.8 | 98 | 5.1 | 113.3 | E75 A76 A77 G81 C84 | E75-R79 VanDerWaalsContact O-CG 3.31Å; E75-R79 WeakPolarHBondContact O-CG 3.17Å; E75-R79 PolarHBondContact O-N 2.83Å; A76-R79 PolarHBondContact O-N 3.19Å; A77-R79 VanDerWaalsContact C-N 3.34Å; A77-R79 PolarHBondContact O-N 3.46Å; R79-G81 PolarHBondContact O-N 3.13Å; R79-C84 PolarHBondContact O-SG 2.96Å |
| 80 | L | 51.9 | Low | 62 | Low | 88 Ų | 88 | 79.2 Ų | 79.2 | 46% | 0.461 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -68.3 | -19.4 | 177.4 | -76 | 161.7 | 0 | 0 | 0 | 113.2 | A76 A77 L166 | A76-L80 WeakPolarHBondContact O-CB 3.43Å; A76-L80 WeakPolarHBondContact O-CD1 3.46Å; A76-L80 WeakPolarHBondContact O-CG 3.46Å; A76-L80 PolarHBondContact O-N 3.48Å; A77-L80 PolarHBondContact O-N 2.87Å; L80-L166 HydrophobicContact CD2-CB 4.42Å; L80-L166 HydrophobicContact CD2-CD2 4.2Å; L80-L166 VanDerWaalsContact CD2-O 3.26Å; L80-L166 WeakPolarHBondContact CD2-O 3.42Å |
| 81 | G | 50.2 | Low | 63.6 | Low | 46 Ų | 46 | 85.5 Ų | 85.5 | 47% | 0.474 | 48% | 0.48 | S | S | . | . | S | Bend | trans | -82 | -24.8 | -161.7 | 0 | 0 | 0 | 0 | 0 | 118.6 | A77 E78 R79 | A77-G81 PolarHBondContact O-N 3.21Å; E78-G81 PolarHBondContact O-N 3Å; R79-G81 PolarHBondContact O-N 3.13Å |
| 82 | R | 52.6 | Low | 65.5 | Low | 243 Ų | 243 | 85.8 Ų | 85.8 | 92% | 0.917 | 48% | 0.482 | S | S | * | . | S | Bend | trans | -176.9 | 105.2 | 176.3 | -108.9 | 170 | -66.7 | -103.1 | 2.2 | 109.3 | ||
| 83 | G | 62.1 | Low | 67.4 | Low | 30 Ų | 30 | 86.1 Ų | 86.1 | 31% | 0.309 | 49% | 0.485 | S | S | . | . | S | Bend | trans | 114.2 | 14 | 172.7 | 0 | 0 | 0 | 0 | 0 | 116.6 | W86 R100 | G83-W86 WeakPolarHBondContact O-CZ3 3.31Å; G83-R100 PolarHBondContact O-NH1 3.43Å |
| 84 | C | 75.8 | Confident | 69.4 | Low | 21 Ų | 21 | 87.6 Ų | 87.6 | 14% | 0.142 | 48% | 0.479 | C | S | . | . | S | Bend | trans | -90.7 | -18.4 | 166.1 | -89.6 | 0 | 0 | 0 | 0 | 113.5 | R79 F99 R100 L166 | R79-C84 PolarHBondContact O-SG 2.96Å; C84-F99 WeakPolarHBondContact O-CA 3.33Å; C84-R100 PolarHBondContact O-N 3.42Å; C84-L166 HydrophobicContact CB-CD2 3.81Å |
| 85 | M | 86.8 | Confident | 71.7 | Confident | 80 Ų | 80 | 88.5 Ų | 88.5 | 39% | 0.394 | 47% | 0.472 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -148.6 | 134.1 | 175.7 | -174.1 | -175.5 | 71.9 | 0 | 0 | 110.3 | R97 V98 F99 L166 | M85-R97 HydrophobicContact CG-CG 3.77Å; M85-R97 VanDerWaalsContact SD-CD 3.56Å; M85-R97 HydrophobicContact SD-CG 4.16Å; M85-V98 VanDerWaalsContact CA-O 3.24Å; M85-V98 WeakPolarHBondContact CA-O 3.37Å; M85-F99 HydrophobicContact CB-CD1 4.46Å; M85-F99 HydrophobicContact CG-CD1 4.1Å; M85-F99 HydrophobicContact CG-CE1 3.99Å; M85-F99 HydrophobicContact SD-CD1 4.21Å; M85-F99 HydrophobicContact SD-CE1 3.55Å; M85-F99 VanDerWaalsContact SD-CE1 3.55Å; M85-F99 HydrophobicContact SD-CZ 4.04Å; M85-L166 HydrophobicContact CB-CD1 4.12Å; M85-L166 HydrophobicContact CG-CD1 4.49Å; M85-L166 HydrophobicContact SD-CD1 3.83Å |
| 86 | W | 90.2 | Very high | 73.9 | Confident | 77 Ų | 77 | 86.2 Ų | 86.2 | 29% | 0.292 | 46% | 0.459 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -150.8 | 152.9 | 173.3 | 59.1 | 98.3 | 0 | 0 | 0 | 111 | G83 V98 R100 E105 | G83-W86 WeakPolarHBondContact O-CZ3 3.31Å; W86-V98 HydrophobicContact CD2-CB 4.08Å; W86-V98 HydrophobicContact CH2-CB 4.25Å; W86-V98 HydrophobicContact CH2-CG1 3.76Å; W86-V98 HydrophobicContact CZ2-CB 3.74Å; W86-V98 HydrophobicContact CZ2-CG1 3.45Å; W86-V98 VanDerWaalsContact CZ2-CG1 3.45Å; W86-V98 HydrophobicContact CZ2-CG2 4.35Å; W86-V98 HydrophobicContact CZ3-CG1 4.49Å; W86-V98 PolarHBondContact N-O 2.98Å; W86-V98 VanDerWaalsContact N-O 3.16Å; W86-V98 PolarHBondContact O-N 3Å; W86-R100 HydrophobicContact CH2-CB 3.95Å; W86-R100 HydrophobicContact CZ3-CB 3.79Å; W86-E105 WeakPolarHBondContact CH2-OE1 3.5Å |
| 87 | D | 91.3 | Very high | 76.1 | Confident | 101 Ų | 101 | 87.1 Ų | 87.1 | 54% | 0.54 | 46% | 0.458 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.3 | 140.6 | 178.3 | -68.3 | -28.6 | 0 | 0 | 0 | 110.2 | W96 R97 | D87-W96 CarbonylContact C-O 3.59Å; D87-W96 WeakPolarHBondContact CA-O 3.49Å; D87-R97 WeakPolarHBondContact OD1-CB 3.47Å; D87-R97 WeakPolarHBondContact OD1-CG 3.43Å; D87-R97 IonicContact OD1-CZ 3.64Å; D87-R97 IonicContact OD1-NE 3.38Å; D87-R97 PolarHBondContact OD1-NE 2.79Å; D87-R97 IonicContact OD1-NH2 2.93Å; D87-R97 PolarHBondContact OD1-NH2 2.95Å; D87-R97 IonicContact OD2-CZ 3.14Å; D87-R97 IonicContact OD2-NE 2.74Å; D87-R97 IonicContact OD2-NH2 3.79Å; D87-R97 PolarHBondContact OD2-NH2 3.25Å |
| 88 | V | 92.1 | Very high | 78.2 | Confident | 45 Ų | 45 | 84.7 Ų | 84.7 | 27% | 0.273 | 44% | 0.438 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.3 | 122.1 | -179.2 | -178.2 | 0 | 0 | 0 | 0 | 108 | G90 W96 V98 | V88-G90 PolarHBondContact O-N 3.3Å; V88-W96 HydrophobicContact CB-CB 4.29Å; V88-W96 PolarHBondContact N-O 3.48Å; V88-W96 WeakPolarHBondContact O-CB 3.41Å; V88-W96 PolarHBondContact O-N 3.13Å; V88-V98 HydrophobicContact CG2-CG2 3.93Å |
| 89 | A | 90.1 | Very high | 80.3 | Confident | 83 Ų | 83 | 77 Ų | 77 | 69% | 0.686 | 40% | 0.401 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -73 | 125.9 | 170.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||
| 90 | G | 86.4 | Confident | 82 | Confident | 17 Ų | 17 | 75.8 Ų | 75.8 | 18% | 0.175 | 40% | 0.397 | C | S | . | . | trans | -80.6 | 147.8 | 169.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | V88 D92 G93 R94 | V88-G90 PolarHBondContact O-N 3.3Å; G90-D92 PolarHBondContact O-N 3.22Å; G90-G93 PolarHBondContact O-N 3.01Å; G90-R94 WeakPolarHBondContact CA-O 3.4Å; G90-R94 PolarHBondContact N-O 3.36Å | ||
| 91 | E | 79.4 | Confident | 83.1 | Confident | 212 Ų | 212 | 72.9 Ų | 72.9 | 99% | 0.991 | 38% | 0.382 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.3 | -19.7 | 178.8 | -61.8 | -178.7 | 152.8 | 0 | 0 | 112.7 | ||
| 92 | D | 85.9 | Confident | 84.1 | Confident | 103 Ų | 103 | 72.7 Ų | 72.7 | 55% | 0.551 | 38% | 0.379 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.4 | 12.1 | 179 | 64.7 | -20.7 | 0 | 0 | 0 | 113.8 | G90 R94 | G90-D92 PolarHBondContact O-N 3.22Å; D92-R94 VanDerWaalsContact C-N 3.25Å; D92-R94 PolarHBondContact O-N 2.87Å; D92-R94 WeakPolarHBondContact OD1-CB 3.43Å; D92-R94 WeakPolarHBondContact OD1-CG 3.41Å; D92-R94 PolarHBondContact OD1-N 3.1Å; D92-R94 WeakPolarHBondContact OD2-CD 3.42Å; D92-R94 WeakPolarHBondContact OD2-CG 3.32Å; D92-R94 IonicContact OD2-CZ 3.81Å; D92-R94 IonicContact OD2-NE 2.89Å; D92-R94 PolarHBondContact OD2-NE 3.22Å |
| 93 | G | 84.8 | Confident | 85 | Confident | 51 Ų | 51 | 67.5 Ų | 67.5 | 53% | 0.526 | 38% | 0.377 | S | S | . | . | S | Bend | trans | 79.2 | 4 | -176.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | G90 | G90-G93 PolarHBondContact O-N 3.01Š|
| 94 | R | 90.5 | Very high | 85.7 | Confident | 88 Ų | 88 | 75.5 Ų | 75.5 | 33% | 0.332 | 40% | 0.398 | S | S | . | . | trans | -76 | 142.3 | 172.4 | -67.1 | 179.8 | -166.2 | -134.7 | 6.6 | 111.2 | G90 D92 D109 T111 Y151 | G90-R94 WeakPolarHBondContact CA-O 3.4Å; G90-R94 PolarHBondContact N-O 3.36Å; D92-R94 VanDerWaalsContact C-N 3.25Å; D92-R94 PolarHBondContact O-N 2.87Å; D92-R94 WeakPolarHBondContact OD1-CB 3.43Å; D92-R94 WeakPolarHBondContact OD1-CG 3.41Å; D92-R94 PolarHBondContact OD1-N 3.1Å; D92-R94 WeakPolarHBondContact OD2-CD 3.42Å; D92-R94 WeakPolarHBondContact OD2-CG 3.32Å; D92-R94 IonicContact OD2-CZ 3.81Å; D92-R94 IonicContact OD2-NE 2.89Å; D92-R94 PolarHBondContact OD2-NE 3.22Å; R94-D109 WeakPolarHBondContact CD-OD2 3.49Å; R94-D109 IonicContact CZ-OD2 3.97Å; R94-D109 IonicContact NE-OD2 2.74Å; R94-D109 IonicContact NH1-OD2 3.8Å; R94-D109 PolarHBondContact NH1-OD2 3.44Å; R94-T111 WeakPolarHBondContact CA-OG1 3.41Å; R94-Y151 PolarHBondContact NH1-OH 2.86Å; R94-Y151 VanDerWaalsContact NH1-OH 3.14Å | ||
| 95 | H | 93.6 | Very high | 86.3 | Confident | 116 Ų | 116 | 80 Ų | 80 | 54% | 0.537 | 42% | 0.417 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.3 | 120.2 | 172.1 | -59.5 | 86 | 0 | 0 | 0 | 108.5 | M110 T111 | H95-M110 HydrophobicContact CB-CB 4.13Å; H95-M110 WeakPolarHBondContact O-CA 3.45Å; H95-M110 WeakPolarHBondContact O-CB 3.34Å; H95-M110 PolarHBondContact O-N 3.38Å; H95-T111 PolarHBondContact N-OG1 2.97Å |
| 96 | W | 94.8 | Very high | 86.4 | Confident | 43 Ų | 43 | 78.2 Ų | 78.2 | 16% | 0.163 | 41% | 0.408 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106 | 139.9 | 177.7 | -62.8 | 90 | 0 | 0 | 0 | 110 | D87 V88 R107 V108 D109 H155 | D87-W96 CarbonylContact C-O 3.59Å; D87-W96 WeakPolarHBondContact CA-O 3.49Å; V88-W96 HydrophobicContact CB-CB 4.29Å; V88-W96 PolarHBondContact N-O 3.48Å; V88-W96 WeakPolarHBondContact O-CB 3.41Å; V88-W96 PolarHBondContact O-N 3.13Å; W96-R107 HydrophobicContact CE3-CB 4.22Å; W96-R107 HydrophobicContact CE3-CG 4.43Å; W96-V108 CarbonylContact C-O 3.55Å; W96-V108 VanDerWaalsContact CA-O 3.3Å; W96-V108 WeakPolarHBondContact CA-O 3.17Å; W96-D109 HydrophobicContact CE3-CB 3.99Å; W96-D109 HydrophobicContact CH2-CB 3.92Å; W96-D109 HydrophobicContact CZ3-CB 3.63Å; W96-H155 AromaticContact CZ3-CE1 3.86Å |
| 97 | R | 94.3 | Very high | 86.6 | Confident | 42 Ų | 42 | 80.2 Ų | 80.2 | 16% | 0.158 | 42% | 0.415 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.8 | 126.6 | 167.5 | -179 | 164.4 | -74.4 | -175.5 | 1.2 | 109.1 | M85 D87 F99 V108 M110 | M85-R97 HydrophobicContact CG-CG 3.77Å; M85-R97 VanDerWaalsContact SD-CD 3.56Å; M85-R97 HydrophobicContact SD-CG 4.16Å; D87-R97 WeakPolarHBondContact OD1-CB 3.47Å; D87-R97 WeakPolarHBondContact OD1-CG 3.43Å; D87-R97 IonicContact OD1-CZ 3.64Å; D87-R97 IonicContact OD1-NE 3.38Å; D87-R97 PolarHBondContact OD1-NE 2.79Å; D87-R97 IonicContact OD1-NH2 2.93Å; D87-R97 PolarHBondContact OD1-NH2 2.95Å; D87-R97 IonicContact OD2-CZ 3.14Å; D87-R97 IonicContact OD2-NE 2.74Å; D87-R97 IonicContact OD2-NH2 3.79Å; D87-R97 PolarHBondContact OD2-NH2 3.25Å; R97-F99 HydrophobicContact CB-CE2 4.26Å; R97-F99 VanDerWaalsContact CD-CZ 3.49Å; R97-F99 HydrophobicContact CG-CD2 4.16Å; R97-F99 HydrophobicContact CG-CE2 3.61Å; R97-F99 HydrophobicContact CG-CZ 3.84Å; R97-V108 HydrophobicContact CB-CB 4.48Å; R97-V108 PolarHBondContact N-O 2.77Å; R97-V108 PolarHBondContact O-N 3.16Å; R97-M110 HydrophobicContact CB-CG 3.48Å; R97-M110 VanDerWaalsContact CB-CG 3.48Å; R97-M110 HydrophobicContact CB-SD 3.47Å; R97-M110 WeakPolarHBondContact CB-SD 3.2Å; R97-M110 HydrophobicContact CG-SD 4.29Å |
| 98 | V | 92.3 | Very high | 86.8 | Confident | 6 Ų | 6 | 75.4 Ų | 75.4 | 4% | 0.036 | 39% | 0.389 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.4 | 125.5 | 176.6 | -168.8 | 0 | 0 | 0 | 0 | 108.1 | M85 W86 V88 E105 Q106 R107 | M85-V98 VanDerWaalsContact CA-O 3.24Å; M85-V98 WeakPolarHBondContact CA-O 3.37Å; W86-V98 HydrophobicContact CD2-CB 4.08Å; W86-V98 HydrophobicContact CH2-CB 4.25Å; W86-V98 HydrophobicContact CH2-CG1 3.76Å; W86-V98 HydrophobicContact CZ2-CB 3.74Å; W86-V98 HydrophobicContact CZ2-CG1 3.45Å; W86-V98 VanDerWaalsContact CZ2-CG1 3.45Å; W86-V98 HydrophobicContact CZ2-CG2 4.35Å; W86-V98 HydrophobicContact CZ3-CG1 4.49Å; W86-V98 PolarHBondContact N-O 2.98Å; W86-V98 VanDerWaalsContact N-O 3.16Å; W86-V98 PolarHBondContact O-N 3Å; V88-V98 HydrophobicContact CG2-CG2 3.93Å; V98-E105 HydrophobicContact CG1-CB 4.15Å; V98-Q106 WeakPolarHBondContact CA-O 3.43Å; V98-R107 HydrophobicContact CG2-CG 3.76Å |
| 99 | F | 90.7 | Very high | 86.9 | Confident | 2 Ų | 2 | 73.3 Ų | 73.3 | 1% | 0.009 | 38% | 0.376 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.5 | 125.8 | 169.5 | -64.7 | -91.8 | 0 | 0 | 0 | 108.6 | C84 M85 R97 I101 Q106 V108 Y159 L166 | C84-F99 WeakPolarHBondContact O-CA 3.33Å; M85-F99 HydrophobicContact CB-CD1 4.46Å; M85-F99 HydrophobicContact CG-CD1 4.1Å; M85-F99 HydrophobicContact CG-CE1 3.99Å; M85-F99 HydrophobicContact SD-CD1 4.21Å; M85-F99 HydrophobicContact SD-CE1 3.55Å; M85-F99 VanDerWaalsContact SD-CE1 3.55Å; M85-F99 HydrophobicContact SD-CZ 4.04Å; R97-F99 HydrophobicContact CB-CE2 4.26Å; R97-F99 VanDerWaalsContact CD-CZ 3.49Å; R97-F99 HydrophobicContact CG-CD2 4.16Å; R97-F99 HydrophobicContact CG-CE2 3.61Å; R97-F99 HydrophobicContact CG-CZ 3.84Å; F99-I101 HydrophobicContact CB-CD1 4.36Å; F99-I101 HydrophobicContact CB-CG1 4.35Å; F99-Q106 PolarHBondContact N-O 3.49Å; F99-Q106 PolarHBondContact O-N 3.48Å; F99-V108 HydrophobicContact CD2-CG2 3.76Å; F99-V108 HydrophobicContact CE2-CB 4.17Å; F99-V108 HydrophobicContact CE2-CG2 3.68Å; F99-Y159 HydrophobicContact CE2-CD2 4.28Å; F99-Y159 AromaticContact CZ-CD2 3.93Å; F99-Y159 HydrophobicContact CZ-CD2 3.93Å; F99-Y159 HydrophobicContact CZ-CE2 4.33Å; F99-L166 HydrophobicContact CD1-CD1 3.88Å; F99-L166 HydrophobicContact CE1-CD1 3.78Å |
| 100 | R | 85.6 | Confident | 87.2 | Confident | 98 Ų | 98 | 69.7 Ų | 69.7 | 37% | 0.37 | 35% | 0.346 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.2 | 108 | 173.5 | -178.7 | 179.6 | -68.3 | 148.2 | -6.4 | 109.3 | G83 C84 W86 E105 | G83-R100 PolarHBondContact O-NH1 3.43Å; C84-R100 PolarHBondContact O-N 3.42Å; W86-R100 HydrophobicContact CH2-CB 3.95Å; W86-R100 HydrophobicContact CZ3-CB 3.79Å; R100-E105 IonicContact CZ-OE1 3.22Å; R100-E105 IonicContact NE-OE1 3.64Å; R100-E105 PolarHBondContact NE-OE1 2.82Å; R100-E105 VanDerWaalsContact NE-OE1 3.14Å; R100-E105 IonicContact NH2-OE1 3.01Å; R100-E105 PolarHBondContact NH2-OE1 3.33Å |
| 101 | I | 75.9 | Confident | 87.6 | Confident | 27 Ų | 27 | 72 Ų | 72 | 14% | 0.138 | 36% | 0.356 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.5 | 93.9 | -175.1 | -66.3 | 175 | 0 | 0 | 0 | 106.8 | F99 R104 V161 E165 | F99-I101 HydrophobicContact CB-CD1 4.36Å; F99-I101 HydrophobicContact CB-CG1 4.35Å; I101-R104 PolarHBondContact N-O 3.21Å; I101-R104 PolarHBondContact O-N 3.12Å; I101-V161 HydrophobicContact CD1-CG1 4.49Å; I101-E165 WeakPolarHBondContact CB-OE2 2.93Å; I101-E165 WeakPolarHBondContact CG1-OE2 3.16Å; I101-E165 VanDerWaalsContact CG2-CD 3.42Å; I101-E165 WeakPolarHBondContact CG2-OE1 3.37Å; I101-E165 WeakPolarHBondContact CG2-OE2 3.1Å |
| 102 | G | 71.9 | Confident | 88.3 | Confident | 41 Ų | 41 | 63.8 Ų | 63.8 | 42% | 0.423 | 32% | 0.321 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 56.7 | -124 | -172.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | R104 | G102-R104 VanDerWaalsContact C-N 3.33Š|
| 103 | P | 70.4 | Confident | 88.8 | Confident | 135 Ų | 135 | 58.9 Ų | 58.9 | 88% | 0.877 | 29% | 0.294 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.2 | -4.5 | 175.9 | 34.6 | -34.6 | 0 | 0 | 0 | 113.9 | ||
| 104 | R | 77.7 | Confident | 89.3 | Confident | 197 Ų | 197 | 61.3 Ų | 61.3 | 74% | 0.743 | 29% | 0.292 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -100.9 | 135.4 | -175.6 | -55.8 | -178.1 | 99.1 | 177.7 | 6.4 | 109.9 | I101 G102 | I101-R104 PolarHBondContact N-O 3.21Å; I101-R104 PolarHBondContact O-N 3.12Å; G102-R104 VanDerWaalsContact C-N 3.33Å |
| 105 | E | 88.3 | Confident | 89.5 | Confident | 115 Ų | 115 | 61.4 Ų | 61.4 | 54% | 0.537 | 30% | 0.304 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.2 | 127.7 | 170 | -63.9 | -168.3 | 160 | 0 | 0 | 109.4 | W86 V98 R100 | W86-E105 WeakPolarHBondContact CH2-OE1 3.5Å; V98-E105 HydrophobicContact CG1-CB 4.15Å; R100-E105 IonicContact CZ-OE1 3.22Å; R100-E105 IonicContact NE-OE1 3.64Å; R100-E105 PolarHBondContact NE-OE1 2.82Å; R100-E105 VanDerWaalsContact NE-OE1 3.14Å; R100-E105 IonicContact NH2-OE1 3.01Å; R100-E105 PolarHBondContact NH2-OE1 3.33Å |
| 106 | Q | 89.1 | Confident | 89.6 | Confident | 43 Ų | 43 | 58.1 Ų | 58.1 | 20% | 0.201 | 29% | 0.287 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.2 | 119.9 | 178.9 | -176.2 | 166.9 | 69.2 | 0 | 0 | 109.8 | V98 F99 R158 | V98-Q106 WeakPolarHBondContact CA-O 3.43Å; F99-Q106 PolarHBondContact N-O 3.49Å; F99-Q106 PolarHBondContact O-N 3.48Å; Q106-R158 VanDerWaalsContact CD-CB 3.45Å; Q106-R158 VanDerWaalsContact CD-CG 3.5Å; Q106-R158 HydrophobicContact CG-CB 3.95Å; Q106-R158 HydrophobicContact CG-CG 4.02Å; Q106-R158 VanDerWaalsContact NE2-CG 3.27Å; Q106-R158 PolarHBondContact OE1-O 2.7Å |
| 107 | R | 92.9 | Very high | 89.4 | Confident | 120 Ų | 120 | 58.4 Ų | 58.4 | 45% | 0.453 | 29% | 0.29 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.6 | 132.9 | 174.4 | -104.1 | 179.2 | 152.4 | -170.9 | -8.3 | 111.7 | W96 V98 R158 | W96-R107 HydrophobicContact CE3-CB 4.22Å; W96-R107 HydrophobicContact CE3-CG 4.43Å; V98-R107 HydrophobicContact CG2-CG 3.76Å; R107-R158 PolarHBondContact O-NH1 3.41Å; R107-R158 VanDerWaalsContact O-NH1 3.11Å |
| 108 | V | 95.3 | Very high | 89.4 | Confident | 0 Ų | 0 | 63.1 Ų | 63.1 | 0% | 0 | 31% | 0.311 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.1 | 125.4 | 178.1 | 178.7 | 0 | 0 | 0 | 0 | 109 | W96 R97 F99 M110 I113 H155 R158 | W96-V108 CarbonylContact C-O 3.55Å; W96-V108 VanDerWaalsContact CA-O 3.3Å; W96-V108 WeakPolarHBondContact CA-O 3.17Å; R97-V108 HydrophobicContact CB-CB 4.48Å; R97-V108 PolarHBondContact N-O 2.77Å; R97-V108 PolarHBondContact O-N 3.16Å; F99-V108 HydrophobicContact CD2-CG2 3.76Å; F99-V108 HydrophobicContact CE2-CB 4.17Å; F99-V108 HydrophobicContact CE2-CG2 3.68Å; V108-M110 HydrophobicContact CB-SD 4.46Å; V108-M110 HydrophobicContact CG1-SD 3.89Å; V108-M110 PolarHBondContact O-N 3.44Å; V108-I113 HydrophobicContact CG1-CD1 3.46Å; V108-I113 VanDerWaalsContact CG1-CD1 3.46Å; V108-I113 HydrophobicContact CG1-CG1 4.39Å; V108-H155 HydrophobicContact CG1-CB 4.49Å; V108-R158 HydrophobicContact CG2-CB 3.64Å |
| 109 | D | 95.9 | Very high | 89.4 | Confident | 0 Ų | 0 | 62.8 Ų | 62.8 | 0% | 0 | 31% | 0.309 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.1 | 103.5 | 170.7 | -171.5 | -18.3 | 0 | 0 | 0 | 108.2 | R94 W96 T111 V112 I113 Y151 H155 | R94-D109 WeakPolarHBondContact CD-OD2 3.49Å; R94-D109 IonicContact CZ-OD2 3.97Å; R94-D109 IonicContact NE-OD2 2.74Å; R94-D109 IonicContact NH1-OD2 3.8Å; R94-D109 PolarHBondContact NH1-OD2 3.44Å; W96-D109 HydrophobicContact CE3-CB 3.99Å; W96-D109 HydrophobicContact CH2-CB 3.92Å; W96-D109 HydrophobicContact CZ3-CB 3.63Å; D109-T111 VanDerWaalsContact C-N 3.25Å; D109-T111 PolarHBondContact O-N 3.2Å; D109-T111 WeakPolarHBondContact OD1-CB 3.46Å; D109-T111 PolarHBondContact OD1-N 3.14Å; D109-T111 PolarHBondContact OD1-OG1 3.03Å; D109-V112 HydrophobicContact CB-CG2 4.01Å; D109-V112 WeakPolarHBondContact O-CG2 3.46Å; D109-I113 WeakPolarHBondContact O-CG1 3.42Å; D109-Y151 PolarHBondContact OD2-OH 3.22Å; D109-H155 PolarHBondContact N-ND1 2.83Å |
| 110 | M | 95.5 | Very high | 89.6 | Confident | 8 Ų | 8 | 63.5 Ų | 63.5 | 4% | 0.039 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -68.6 | -28.3 | 179.4 | -63.2 | -55.8 | -59.6 | 0 | 0 | 111.7 | H95 R97 V108 V112 I113 E114 K117 Y159 | H95-M110 HydrophobicContact CB-CB 4.13Å; H95-M110 WeakPolarHBondContact O-CA 3.45Å; H95-M110 WeakPolarHBondContact O-CB 3.34Å; H95-M110 PolarHBondContact O-N 3.38Å; R97-M110 HydrophobicContact CB-CG 3.48Å; R97-M110 VanDerWaalsContact CB-CG 3.48Å; R97-M110 HydrophobicContact CB-SD 3.47Å; R97-M110 WeakPolarHBondContact CB-SD 3.2Å; R97-M110 HydrophobicContact CG-SD 4.29Å; V108-M110 HydrophobicContact CB-SD 4.46Å; V108-M110 HydrophobicContact CG1-SD 3.89Å; V108-M110 PolarHBondContact O-N 3.44Å; M110-V112 VanDerWaalsContact C-N 3.31Å; M110-V112 PolarHBondContact O-N 3.46Å; M110-I113 HydrophobicContact CE-CD1 4.05Å; M110-I113 HydrophobicContact CE-CG1 4.3Å; M110-I113 PolarHBondContact O-N 3.37Å; M110-I113 HydrophobicContact SD-CD1 3.81Å; M110-I113 HydrophobicContact SD-CG1 4.27Å; M110-E114 WeakPolarHBondContact O-CB 3.41Å; M110-E114 PolarHBondContact O-N 3.27Å; M110-K117 HydrophobicContact CE-CD 3.78Å; M110-K117 HydrophobicContact CE-CG 4.33Å; M110-Y159 HydrophobicContact CE-CD2 4.24Å; M110-Y159 HydrophobicContact CE-CE2 4.06Å; M110-Y159 HydrophobicContact SD-CD2 4.24Å |
| 111 | T | 94.3 | Very high | 89.9 | Confident | 64 Ų | 64 | 60.6 Ų | 60.6 | 39% | 0.393 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -59.2 | -43.6 | -178.1 | -31.2 | 0 | 0 | 0 | 0 | 111.5 | R94 H95 D109 | R94-T111 WeakPolarHBondContact CA-OG1 3.41Å; H95-T111 PolarHBondContact N-OG1 2.97Å; D109-T111 VanDerWaalsContact C-N 3.25Å; D109-T111 PolarHBondContact O-N 3.2Å; D109-T111 WeakPolarHBondContact OD1-CB 3.46Å; D109-T111 PolarHBondContact OD1-N 3.14Å; D109-T111 PolarHBondContact OD1-OG1 3.03Å |
| 112 | V | 95.5 | Very high | 90.5 | Very high | 41 Ų | 41 | 62.8 Ų | 62.8 | 25% | 0.248 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -82.8 | -25.1 | -176.4 | -55.9 | 0 | 0 | 0 | 0 | 113.2 | D109 M110 Y151 V152 H155 | D109-V112 HydrophobicContact CB-CG2 4.01Å; D109-V112 WeakPolarHBondContact O-CG2 3.46Å; M110-V112 VanDerWaalsContact C-N 3.31Å; M110-V112 PolarHBondContact O-N 3.46Å; V112-Y151 HydrophobicContact CB-CE1 4.49Å; V112-Y151 HydrophobicContact CG1-CD1 4.4Å; V112-Y151 HydrophobicContact CG1-CE1 3.94Å; V112-Y151 HydrophobicContact CG2-CD1 4.22Å; V112-Y151 HydrophobicContact CG2-CE1 3.93Å; V112-V152 HydrophobicContact CB-CG2 4.36Å; V112-H155 HydrophobicContact CG2-CB 4.25Å |
| 113 | I | 96.1 | Very high | 91.2 | Very high | 0 Ų | 0 | 61 Ų | 61 | 0% | 0 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -96.9 | -9.2 | -178.6 | 69.7 | 167.7 | 0 | 0 | 0 | 113.8 | V108 D109 M110 P115 Y116 K117 H155 L156 Y159 | V108-I113 HydrophobicContact CG1-CD1 3.46Å; V108-I113 VanDerWaalsContact CG1-CD1 3.46Å; V108-I113 HydrophobicContact CG1-CG1 4.39Å; D109-I113 WeakPolarHBondContact O-CG1 3.42Å; M110-I113 HydrophobicContact CE-CD1 4.05Å; M110-I113 HydrophobicContact CE-CG1 4.3Å; M110-I113 PolarHBondContact O-N 3.37Å; M110-I113 HydrophobicContact SD-CD1 3.81Å; M110-I113 HydrophobicContact SD-CG1 4.27Å; I113-P115 VanDerWaalsContact C-N 3.29Å; I113-P115 VanDerWaalsContact O-N 3.16Å; I113-Y116 CarbonylContact O-C 3.58Å; I113-Y116 WeakPolarHBondContact O-CA 3.44Å; I113-Y116 PolarHBondContact O-N 2.96Å; I113-K117 PolarHBondContact O-N 2.96Å; I113-K117 VanDerWaalsContact O-N 3.16Å; I113-H155 HydrophobicContact CG2-CB 3.73Å; I113-L156 HydrophobicContact CB-CD1 4.37Å; I113-L156 HydrophobicContact CG2-CB 4.24Å; I113-Y159 VanDerWaalsContact CD1-CB 3.44Å; I113-Y159 HydrophobicContact CD1-CD1 4.15Å; I113-Y159 HydrophobicContact CD1-CD2 3.75Å; I113-Y159 HydrophobicContact CD1-CG 3.5Å; I113-Y159 VanDerWaalsContact CD1-CG 3.5Å |
| 114 | E | 94.2 | Very high | 91.9 | Very high | 101 Ų | 101 | 54.8 Ų | 54.8 | 47% | 0.472 | 26% | 0.26 | S | S | . | . | G | 310 helix | trans | -46.7 | -45.1 | -178 | -166.2 | 62.9 | -149 | 0 | 0 | 113.4 | M110 Y116 K117 | M110-E114 WeakPolarHBondContact O-CB 3.41Å; M110-E114 PolarHBondContact O-N 3.27Å; E114-Y116 PolarHBondContact O-N 3.33Å; E114-K117 HydrophobicContact CG-CD 4.48Å; E114-K117 IonicContact OE1-NZ 3.46Å; E114-K117 PolarHBondContact OE1-NZ 3.44Å; E114-K117 WeakPolarHBondContact OE2-CD 3.36Å; E114-K117 IonicContact OE2-NZ 2.87Å; E114-K117 PolarHBondContact OE2-NZ 3.39Å |
| 115 | P | 94.9 | Very high | 92.2 | Very high | 90 Ų | 90 | 52 Ų | 52 | 58% | 0.584 | 25% | 0.25 | S | C | * | . | G | 310 helix | trans | -65.2 | -21 | 178.8 | -20.4 | 34.3 | 0 | 0 | 0 | 114.2 | I113 | I113-P115 VanDerWaalsContact C-N 3.29Å; I113-P115 VanDerWaalsContact O-N 3.16Å |
| 116 | Y | 95.3 | Very high | 91.7 | Very high | 47 Ų | 47 | 49 Ų | 49 | 18% | 0.184 | 24% | 0.236 | C | C | . | . | G | 310 helix | trans | -110 | -0 | -169.7 | -49.2 | -64.4 | 0 | 0 | 0 | 113.2 | I113 E114 K118 V119 Y140 P142 I146 V152 | I113-Y116 CarbonylContact O-C 3.58Å; I113-Y116 WeakPolarHBondContact O-CA 3.44Å; I113-Y116 PolarHBondContact O-N 2.96Å; E114-Y116 PolarHBondContact O-N 3.33Å; Y116-K118 PolarHBondContact O-N 2.81Å; Y116-K118 VanDerWaalsContact O-N 3.1Å; Y116-V119 VanDerWaalsContact O-CB 3.22Å; Y116-V119 WeakPolarHBondContact O-CB 3.37Å; Y116-V119 VanDerWaalsContact O-CG1 3.24Å; Y116-V119 WeakPolarHBondContact O-CG1 3.43Å; Y116-V119 PolarHBondContact O-N 2.86Å; Y116-Y140 VanDerWaalsContact CD1-O 3.31Å; Y116-Y140 WeakPolarHBondContact CD1-O 3.33Å; Y116-P142 HydrophobicContact CD1-CB 4.37Å; Y116-P142 HydrophobicContact CD1-CG 3.88Å; Y116-P142 HydrophobicContact CD2-CG 3.83Å; Y116-P142 HydrophobicContact CE1-CB 3.98Å; Y116-P142 HydrophobicContact CE1-CG 3.98Å; Y116-P142 HydrophobicContact CE2-CB 4.22Å; Y116-P142 HydrophobicContact CE2-CG 3.94Å; Y116-P142 HydrophobicContact CG-CG 3.8Å; Y116-I146 HydrophobicContact CE2-CD1 4.41Å; Y116-V152 HydrophobicContact CD2-CG1 3.84Å; Y116-V152 HydrophobicContact CE2-CG1 3.67Å |
| 117 | K | 92.2 | Very high | 91 | Very high | 49 Ų | 49 | 49.7 Ų | 49.7 | 21% | 0.213 | 25% | 0.254 | C | S | . | . | G | 310 helix | trans | -56.9 | -29.4 | -179.5 | -76.2 | 162 | 71.3 | -175.9 | 0 | 113.5 | M110 I113 E114 V119 L120 Y159 | M110-K117 HydrophobicContact CE-CD 3.78Å; M110-K117 HydrophobicContact CE-CG 4.33Å; I113-K117 PolarHBondContact O-N 2.96Å; I113-K117 VanDerWaalsContact O-N 3.16Å; E114-K117 HydrophobicContact CG-CD 4.48Å; E114-K117 IonicContact OE1-NZ 3.46Å; E114-K117 PolarHBondContact OE1-NZ 3.44Å; E114-K117 WeakPolarHBondContact OE2-CD 3.36Å; E114-K117 IonicContact OE2-NZ 2.87Å; E114-K117 PolarHBondContact OE2-NZ 3.39Å; K117-V119 PolarHBondContact O-N 3.36Å; K117-V119 VanDerWaalsContact O-N 3.12Å; K117-L120 PolarHBondContact O-N 2.96Å; K117-Y159 HydrophobicContact CB-CE1 4.44Å; K117-Y159 HydrophobicContact CG-CE1 4.24Å |
| 118 | K | 92.4 | Very high | 89.8 | Confident | 141 Ų | 141 | 51.2 Ų | 51.2 | 61% | 0.613 | 27% | 0.272 | S | S | * | . | G | 310 helix | trans | -64.6 | -10.8 | 176.1 | -62.9 | -175.7 | -179.3 | -179.5 | 0 | 113.7 | Y116 L120 Y140 | Y116-K118 PolarHBondContact O-N 2.81Å; Y116-K118 VanDerWaalsContact O-N 3.1Å; K118-L120 PolarHBondContact O-N 2.8Å; K118-Y140 HydrophobicContact CB-CD2 3.64Å; K118-Y140 HydrophobicContact CB-CE2 3.82Å; K118-Y140 HydrophobicContact CB-CG 4.02Å; K118-Y140 WeakPolarHBondContact O-CD2 3.42Å |
| 119 | V | 94.1 | Very high | 88.4 | Confident | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 29% | 0.29 | C | S | . | . | G | 310 helix | trans | -56.8 | -29.2 | 174.1 | 77.6 | 0 | 0 | 0 | 0 | 111.7 | Y116 K117 F136 A137 L141 L156 M160 | Y116-V119 VanDerWaalsContact O-CB 3.22Å; Y116-V119 WeakPolarHBondContact O-CB 3.37Å; Y116-V119 VanDerWaalsContact O-CG1 3.24Å; Y116-V119 WeakPolarHBondContact O-CG1 3.43Å; Y116-V119 PolarHBondContact O-N 2.86Å; K117-V119 PolarHBondContact O-N 3.36Å; K117-V119 VanDerWaalsContact O-N 3.12Å; V119-F136 HydrophobicContact CG2-CD2 3.92Å; V119-F136 HydrophobicContact CG2-CE2 3.52Å; V119-F136 HydrophobicContact CG2-CZ 3.96Å; V119-F136 CarbonylContact O-C 3.54Å; V119-F136 VanDerWaalsContact O-CA 3.23Å; V119-F136 WeakPolarHBondContact O-CA 3.44Å; V119-A137 PolarHBondContact O-N 3.19Å; V119-L141 HydrophobicContact CG2-CD2 3.89Å; V119-L141 HydrophobicContact CG2-CG 4.05Å; V119-L156 HydrophobicContact CG1-CD1 3.84Å; V119-L156 HydrophobicContact CG1-CD2 4.42Å; V119-L156 HydrophobicContact CG1-CG 4.35Å; V119-M160 HydrophobicContact CG1-CG 4.23Å; V119-M160 HydrophobicContact CG1-SD 3.98Å |
| 120 | L | 93.5 | Very high | 87.2 | Confident | 16 Ų | 16 | 57.7 Ų | 57.7 | 8% | 0.084 | 32% | 0.315 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.5 | 131.3 | -179.9 | -162 | 74.8 | 0 | 0 | 0 | 110.2 | K117 K118 I134 L135 M160 T163 | K117-L120 PolarHBondContact O-N 2.96Å; K118-L120 PolarHBondContact O-N 2.8Å; L120-I134 HydrophobicContact CD1-CG2 3.55Å; L120-I134 HydrophobicContact CG-CG2 4.01Å; L120-L135 CarbonylContact C-O 3.57Å; L120-L135 VanDerWaalsContact CA-O 3.31Å; L120-L135 WeakPolarHBondContact CA-O 3.19Å; L120-M160 HydrophobicContact CD2-CG 4.47Å; L120-T163 HydrophobicContact CD2-CG2 3.66Å |
| 121 | S | 91.5 | Very high | 86.5 | Confident | 37 Ų | 37 | 58.2 Ų | 58.2 | 26% | 0.259 | 32% | 0.318 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -143 | 151.9 | 174.5 | 60 | 0 | 0 | 0 | 0 | 112 | L135 | S121-L135 PolarHBondContact N-O 2.79Å; S121-L135 PolarHBondContact O-N 3.12Å; S121-L135 WeakPolarHBondContact OG-CB 3.35Å |
| 122 | H | 89.6 | Confident | 86.2 | Confident | 73 Ų | 73 | 55.3 Ų | 55.3 | 34% | 0.338 | 30% | 0.3 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.8 | 124 | 174.2 | -175.6 | -101.7 | 0 | 0 | 0 | 109.8 | G124 Y125 | H122-G124 VanDerWaalsContact CE1-CA 3.43Å; H122-G124 WeakPolarHBondContact CE1-CA 3.28Å; H122-G124 PolarHBondContact CE1-N 2.77Å; H122-G124 PolarHBondContact CE1-O 2.73Å; H122-G124 PolarHBondContact ND1-N 2.84Å; H122-G124 PolarHBondContact NE2-O 3.1Å; H122-Y125 AromaticContact CE1-CE2 3.67Å; H122-Y125 AromaticContact NE2-CE2 3.97Å; H122-Y125 AromaticContact NE2-CZ 3.95Å |
| 123 | G | 86.1 | Confident | 86 | Confident | 4 Ų | 4 | 53.5 Ų | 53.5 | 4% | 0.041 | 29% | 0.289 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.6 | 11.8 | -177 | 0 | 0 | 0 | 0 | 0 | 114.5 | V133 L135 | G123-V133 PolarHBondContact N-O 2.84Å; G123-L135 VanDerWaalsContact CA-CD1 3.46Å |
| 124 | G | 85.8 | Confident | 85.8 | Confident | 5 Ų | 5 | 53.5 Ų | 53.5 | 5% | 0.052 | 29% | 0.289 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 93.8 | -163.4 | -174.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | H122 V133 | H122-G124 VanDerWaalsContact CE1-CA 3.43Å; H122-G124 WeakPolarHBondContact CE1-CA 3.28Å; H122-G124 PolarHBondContact CE1-N 2.77Å; H122-G124 PolarHBondContact CE1-O 2.73Å; H122-G124 PolarHBondContact ND1-N 2.84Å; H122-G124 PolarHBondContact NE2-O 3.1Å; G124-V133 PolarHBondContact O-N 2.83Å |
| 125 | Y | 83.8 | Confident | 85.8 | Confident | 137 Ų | 137 | 48.7 Ų | 48.7 | 54% | 0.537 | 27% | 0.267 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.1 | 143.7 | 179.2 | -65 | -91.7 | 0 | 0 | 0 | 110.2 | H122 G129 N131 A132 | H122-Y125 AromaticContact CE1-CE2 3.67Å; H122-Y125 AromaticContact NE2-CE2 3.97Å; H122-Y125 AromaticContact NE2-CZ 3.95Å; Y125-G129 WeakPolarHBondContact CD1-O 3.27Å; Y125-N131 CarbonylContact C-O 3.56Å; Y125-N131 WeakPolarHBondContact CA-O 3.24Å; Y125-A132 HydrophobicContact CD1-CB 4.16Å; Y125-A132 HydrophobicContact CE1-CB 3.93Å |
| 126 | H | 77.4 | Confident | 85.8 | Confident | 54 Ų | 54 | 45.9 Ų | 45.9 | 25% | 0.25 | 25% | 0.245 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -115.7 | 144.7 | -178.5 | 177.9 | 67.1 | 0 | 0 | 0 | 112.5 | N131 V133 L173 L250 I251 | H126-N131 PolarHBondContact N-O 2.77Å; H126-N131 PolarHBondContact O-ND2 3.17Å; H126-V133 HydrophobicContact CB-CG2 3.64Å; H126-L173 HydrophobicContact CB-CD1 4.2Å; H126-L250 PolarHBondContact CE1-O 3.32Å; H126-L250 PolarHBondContact ND1-O 3.47Å; H126-L250 PolarHBondContact NE2-O 2.81Å; H126-L250 VanDerWaalsContact NE2-O 3.12Å; H126-I251 HydrophobicContact CB-CG2 4.19Å |
| 127 | G | 74.1 | Confident | 85.8 | Confident | 56 Ų | 56 | 43.9 Ų | 43.9 | 58% | 0.577 | 24% | 0.238 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 74.3 | -133.1 | -176.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | G129 | G127-G129 PolarHBondContact O-N 3.29Š|
| 128 | D | 67.6 | Low | 85.8 | Confident | 153 Ų | 153 | 41.7 Ų | 41.7 | 82% | 0.818 | 23% | 0.229 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -70.3 | 18.7 | -179.8 | -49.8 | -34 | 0 | 0 | 0 | 114 | L130 | D128-L130 VanDerWaalsContact C-N 3.27Å; D128-L130 PolarHBondContact O-N 3.48Å |
| 129 | G | 67.3 | Low | 85.8 | Confident | 38 Ų | 38 | 35.9 Ų | 35.9 | 39% | 0.392 | 21% | 0.206 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 80.3 | -1.8 | -176.2 | 0 | 0 | 0 | 0 | 0 | 115.1 | Y125 G127 | Y125-G129 WeakPolarHBondContact CD1-O 3.27Å; G127-G129 PolarHBondContact O-N 3.29Å |
| 130 | L | 69.6 | Low | 85.8 | Confident | 98 Ų | 98 | 39 Ų | 39 | 51% | 0.513 | 22% | 0.218 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -87.5 | -16.7 | -174.7 | -60.8 | 176 | 0 | 0 | 0 | 114.3 | D128 | D128-L130 VanDerWaalsContact C-N 3.27Å; D128-L130 PolarHBondContact O-N 3.48Å |
| 131 | N | 81.6 | Confident | 85.9 | Confident | 19 Ų | 19 | 38.6 Ų | 38.6 | 10% | 0.102 | 22% | 0.216 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -106 | 108.9 | -177.5 | -57.2 | -78.5 | 0 | 0 | 0 | 110.7 | Y125 H126 N171 R208 | Y125-N131 CarbonylContact C-O 3.56Å; Y125-N131 WeakPolarHBondContact CA-O 3.24Å; H126-N131 PolarHBondContact N-O 2.77Å; H126-N131 PolarHBondContact O-ND2 3.17Å; N131-N171 WeakPolarHBondContact CA-O 3.29Å; N131-N171 VanDerWaalsContact OD1-CB 3.28Å; N131-N171 WeakPolarHBondContact OD1-CB 3.22Å; N131-R208 PolarHBondContact ND2-NH1 3.16Å |
| 132 | A | 88.6 | Confident | 86 | Confident | 3 Ų | 3 | 36.8 Ų | 36.8 | 3% | 0.025 | 20% | 0.204 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -67 | 136.1 | 173.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | Y125 N171 Y172 L173 | Y125-A132 HydrophobicContact CD1-CB 4.16Å; Y125-A132 HydrophobicContact CE1-CB 3.93Å; A132-N171 PolarHBondContact N-O 2.82Å; A132-N171 VanDerWaalsContact N-O 3.1Å; A132-Y172 CarbonylContact O-C 3.47Å; A132-Y172 WeakPolarHBondContact O-CA 3.19Å; A132-Y172 WeakPolarHBondContact O-CB 3.35Å; A132-L173 PolarHBondContact O-N 2.93Å |
| 133 | V | 91.1 | Very high | 86.2 | Confident | 3 Ų | 3 | 40.1 Ų | 40.1 | 2% | 0.018 | 21% | 0.213 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -98.8 | 118.2 | 172.5 | -179.2 | 0 | 0 | 0 | 0 | 108 | G123 G124 H126 L135 L173 V175 I251 | G123-V133 PolarHBondContact N-O 2.84Å; G124-V133 PolarHBondContact O-N 2.83Å; H126-V133 HydrophobicContact CB-CG2 3.64Å; V133-L135 HydrophobicContact CG1-CD1 4.23Å; V133-L173 HydrophobicContact CG2-CD1 4.49Å; V133-V175 HydrophobicContact CG1-CG2 4.16Å; V133-I251 HydrophobicContact CG1-CD1 3.74Å; V133-I251 HydrophobicContact CG2-CG2 3.98Å |
| 134 | I | 92.4 | Very high | 86.6 | Confident | 0 Ų | 0 | 43.3 Ų | 43.3 | 0% | 0 | 24% | 0.235 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -116.3 | 127.3 | 180 | -52.4 | -176.9 | 0 | 0 | 0 | 107.7 | L120 L164 L167 V168 Y172 L173 L174 V175 | L120-I134 HydrophobicContact CD1-CG2 3.55Å; L120-I134 HydrophobicContact CG-CG2 4.01Å; I134-L164 HydrophobicContact CB-CD2 4.39Å; I134-L164 HydrophobicContact CD1-CD2 3.4Å; I134-L164 HydrophobicContact CG1-CD2 4.45Å; I134-L164 HydrophobicContact CG2-CD2 3.83Å; I134-L167 HydrophobicContact CD1-CB 3.97Å; I134-L167 HydrophobicContact CD1-CD1 4.1Å; I134-L167 HydrophobicContact CG1-CD1 4.42Å; I134-V168 HydrophobicContact CD1-CG2 3.92Å; I134-Y172 HydrophobicContact CD1-CD2 3.76Å; I134-Y172 HydrophobicContact CD1-CE2 4.44Å; I134-Y172 HydrophobicContact CD1-CG 4.22Å; I134-Y172 HydrophobicContact CG1-CD2 4.27Å; I134-L173 PolarHBondContact N-O 3.1Å; I134-L174 HydrophobicContact CB-CD1 4.13Å; I134-L174 HydrophobicContact CG2-CD1 4.04Å; I134-L174 CarbonylContact O-C 3.58Å; I134-L174 WeakPolarHBondContact O-CA 3.32Å; I134-V175 PolarHBondContact O-N 2.88Å |
| 135 | L | 93.9 | Very high | 86.9 | Confident | 0 Ų | 0 | 47.9 Ų | 47.9 | 0% | 0 | 27% | 0.266 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.4 | 133.1 | 179.3 | -69.3 | 103.3 | 0 | 0 | 0 | 110.4 | L120 S121 G123 V133 V175 L177 V256 | L120-L135 CarbonylContact C-O 3.57Å; L120-L135 VanDerWaalsContact CA-O 3.31Å; L120-L135 WeakPolarHBondContact CA-O 3.19Å; S121-L135 PolarHBondContact N-O 2.79Å; S121-L135 PolarHBondContact O-N 3.12Å; S121-L135 WeakPolarHBondContact OG-CB 3.35Å; G123-L135 VanDerWaalsContact CA-CD1 3.46Å; V133-L135 HydrophobicContact CG1-CD1 4.23Å; L135-V175 CarbonylContact C-O 3.6Å; L135-V175 WeakPolarHBondContact CA-O 3.3Å; L135-V175 HydrophobicContact CD2-CB 4.45Å; L135-V175 HydrophobicContact CD2-CG1 4.44Å; L135-V175 HydrophobicContact CG-CB 4.27Å; L135-L177 HydrophobicContact CD2-CD1 3.81Å; L135-L177 HydrophobicContact CD2-CG 4.29Å; L135-V256 HydrophobicContact CD1-CG1 3.71Å; L135-V256 HydrophobicContact CD1-CG2 4.33Å; L135-V256 HydrophobicContact CD2-CG1 3.22Å; L135-V256 HydrophobicContact CG-CG1 4.06Å |
| 136 | F | 95 | Very high | 87.4 | Confident | 31 Ų | 31 | 43 Ų | 43 | 14% | 0.136 | 25% | 0.249 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -112.6 | 111.8 | 168.9 | 179.4 | -89 | 0 | 0 | 0 | 109.3 | V119 L141 M160 L174 V175 H176 L177 | V119-F136 HydrophobicContact CG2-CD2 3.92Å; V119-F136 HydrophobicContact CG2-CE2 3.52Å; V119-F136 HydrophobicContact CG2-CZ 3.96Å; V119-F136 CarbonylContact O-C 3.54Å; V119-F136 VanDerWaalsContact O-CA 3.23Å; V119-F136 WeakPolarHBondContact O-CA 3.44Å; F136-L141 HydrophobicContact CE1-CD1 4.2Å; F136-L141 HydrophobicContact CE2-CD2 4.44Å; F136-L141 HydrophobicContact CZ-CD1 3.86Å; F136-L141 HydrophobicContact CZ-CD2 3.98Å; F136-L141 HydrophobicContact CZ-CG 4.09Å; F136-M160 HydrophobicContact CD2-SD 3.83Å; F136-M160 HydrophobicContact CE2-CE 4.29Å; F136-M160 HydrophobicContact CE2-SD 3.44Å; F136-M160 WeakPolarHBondContact CE2-SD 3.47Å; F136-L174 HydrophobicContact CB-CD1 4.24Å; F136-V175 PolarHBondContact N-O 3.24Å; F136-H176 AromaticContact CD1-CD2 3.12Å; F136-H176 WeakPolarHBondContact CD1-CD2 3.4Å; F136-H176 AromaticContact CD1-NE2 3.63Å; F136-H176 AromaticContact CE1-CD2 3.41Å; F136-H176 VanDerWaalsContact CE1-CD2 3.41Å; F136-H176 WeakPolarHBondContact CE1-CD2 3.33Å; F136-H176 AromaticContact CE1-NE2 3.47Å; F136-H176 WeakPolarHBondContact CE1-NE2 3.46Å; F136-H176 CarbonylContact O-C 3.56Å; F136-H176 WeakPolarHBondContact O-CA 3.48Å; F136-L177 PolarHBondContact O-N 2.98Å |
| 137 | A | 94.5 | Very high | 88.2 | Confident | 4 Ų | 4 | 45.6 Ų | 45.6 | 3% | 0.033 | 27% | 0.27 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.6 | 97.9 | -179.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | V119 C139 Y140 P259 | V119-A137 PolarHBondContact O-N 3.19Å; A137-C139 PolarHBondContact O-N 3.2Å; A137-Y140 HydrophobicContact CB-CD2 3.6Å; A137-Y140 HydrophobicContact CB-CE2 3.93Å; A137-Y140 PolarHBondContact O-N 2.7Å; A137-Y140 VanDerWaalsContact O-N 3.12Å; A137-P259 HydrophobicContact CB-CG 3.66Å |
| 138 | S | 92.4 | Very high | 89.2 | Confident | 3 Ų | 3 | 49 Ų | 49 | 2% | 0.021 | 28% | 0.275 | C | S | . | . | G | 310 helix | trans | -66.9 | -19 | -173.9 | 51.6 | 0 | 0 | 0 | 0 | 114.4 | Y140 L141 L177 S178 T181 | S138-Y140 PolarHBondContact O-N 3.11Å; S138-L141 VanDerWaalsContact O-CB 3.3Å; S138-L141 WeakPolarHBondContact O-CB 3.33Å; S138-L141 PolarHBondContact O-N 2.7Å; S138-L177 PolarHBondContact N-O 3.37Å; S138-L177 VanDerWaalsContact N-O 3.11Å; S138-L177 PolarHBondContact OG-O 2.83Å; S138-S178 VanDerWaalsContact OG-CA 3.32Å; S138-S178 WeakPolarHBondContact OG-CA 3.49Å; S138-T181 VanDerWaalsContact C-OG1 3.25Å; S138-T181 WeakPolarHBondContact CB-OG1 3.24Å; S138-T181 PolarHBondContact OG-OG1 3.34Å |
| 139 | C | 92.1 | Very high | 90.5 | Very high | 19 Ų | 19 | 43.1 Ų | 43.1 | 13% | 0.128 | 24% | 0.242 | C | C | . | . | G | 310 helix | trans | -65.9 | -18.7 | 173.6 | 61.4 | 0 | 0 | 0 | 0 | 113.8 | A137 G179 T181 Q185 | A137-C139 PolarHBondContact O-N 3.2Å; C139-G179 WeakPolarHBondContact CB-O 3.31Å; C139-T181 PolarHBondContact N-OG1 3.16Å; C139-Q185 PolarHBondContact O-NE2 2.9Å |
| 140 | Y | 94.3 | Very high | 91.7 | Very high | 67 Ų | 67 | 46.4 Ų | 46.4 | 26% | 0.263 | 25% | 0.254 | S | S | . | . | G | 310 helix | trans | -92.8 | 5.5 | 174 | -58.8 | -48.8 | 0 | 0 | 0 | 113.5 | Y116 K118 A137 S138 P259 | Y116-Y140 VanDerWaalsContact CD1-O 3.31Å; Y116-Y140 WeakPolarHBondContact CD1-O 3.33Å; K118-Y140 HydrophobicContact CB-CD2 3.64Å; K118-Y140 HydrophobicContact CB-CE2 3.82Å; K118-Y140 HydrophobicContact CB-CG 4.02Å; K118-Y140 WeakPolarHBondContact O-CD2 3.42Å; A137-Y140 HydrophobicContact CB-CD2 3.6Å; A137-Y140 HydrophobicContact CB-CE2 3.93Å; A137-Y140 PolarHBondContact O-N 2.7Å; A137-Y140 VanDerWaalsContact O-N 3.12Å; S138-Y140 PolarHBondContact O-N 3.11Å; Y140-P259 HydrophobicContact CE2-CB 4.13Å; Y140-P259 HydrophobicContact CE2-CG 3.69Å |
| 141 | L | 94.4 | Very high | 92.9 | Very high | 6 Ų | 6 | 45.1 Ų | 45.1 | 3% | 0.031 | 24% | 0.243 | C | C | . | . | S | Bend | trans | -68.4 | 147.9 | 175.6 | -78.3 | 169.3 | 0 | 0 | 0 | 111.8 | V119 F136 S138 M153 L156 Q185 P187 | V119-L141 HydrophobicContact CG2-CD2 3.89Å; V119-L141 HydrophobicContact CG2-CG 4.05Å; F136-L141 HydrophobicContact CE1-CD1 4.2Å; F136-L141 HydrophobicContact CE2-CD2 4.44Å; F136-L141 HydrophobicContact CZ-CD1 3.86Å; F136-L141 HydrophobicContact CZ-CD2 3.98Å; F136-L141 HydrophobicContact CZ-CG 4.09Å; S138-L141 VanDerWaalsContact O-CB 3.3Å; S138-L141 WeakPolarHBondContact O-CB 3.33Å; S138-L141 PolarHBondContact O-N 2.7Å; L141-M153 HydrophobicContact CD2-CE 4.38Å; L141-L156 HydrophobicContact CD2-CD2 3.94Å; L141-Q185 HydrophobicContact CB-CB 4.1Å; L141-Q185 PolarHBondContact O-NE2 2.81Å; L141-P187 HydrophobicContact CD1-CG 4.28Å |
| 142 | P | 95 | Very high | 93.6 | Very high | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 24% | 0.241 | C | C | . | . | P | Polyproline II helix | trans | -57.6 | 138.9 | 171.3 | -18.9 | 28.9 | 0 | 0 | 0 | 111.6 | Y116 I146 Y149 V152 M153 L156 | Y116-P142 HydrophobicContact CD1-CB 4.37Å; Y116-P142 HydrophobicContact CD1-CG 3.88Å; Y116-P142 HydrophobicContact CD2-CG 3.83Å; Y116-P142 HydrophobicContact CE1-CB 3.98Å; Y116-P142 HydrophobicContact CE1-CG 3.98Å; Y116-P142 HydrophobicContact CE2-CB 4.22Å; Y116-P142 HydrophobicContact CE2-CG 3.94Å; Y116-P142 HydrophobicContact CG-CG 3.8Å; P142-I146 HydrophobicContact CB-CD1 3.65Å; P142-Y149 HydrophobicContact CB-CD2 4.19Å; P142-Y149 HydrophobicContact CB-CE2 4.04Å; P142-V152 HydrophobicContact CB-CG1 4.32Å; P142-V152 HydrophobicContact CG-CG1 3.81Å; P142-M153 HydrophobicContact CB-SD 4.14Å; P142-M153 HydrophobicContact CG-SD 3.69Å; P142-L156 HydrophobicContact CG-CD2 3.96Å |
| 143 | R | 94 | Very high | 93.9 | Very high | 143 Ų | 143 | 44.6 Ų | 44.6 | 54% | 0.54 | 24% | 0.24 | S | C | . | . | P | Polyproline II helix | trans | -74.1 | 143.3 | 169.5 | -68.5 | 179.8 | 177.3 | -171.3 | -0.1 | 109.4 | S145 I146 Y149 A184 Q185 | R143-S145 PolarHBondContact O-N 3.01Å; R143-I146 WeakPolarHBondContact O-CG1 3.23Å; R143-I146 WeakPolarHBondContact O-CG2 3.47Å; R143-I146 PolarHBondContact O-N 3.45Å; R143-Y149 WeakPolarHBondContact O-CD2 3.44Å; R143-A184 CarbonylContact C-O 3.51Å; R143-A184 WeakPolarHBondContact CA-O 3.31Å; R143-Q185 HydrophobicContact CB-CG 4.47Å; R143-Q185 HydrophobicContact CG-CG 3.6Å |
| 144 | S | 93.1 | Very high | 94.1 | Very high | 70 Ų | 70 | 48.4 Ų | 48.4 | 49% | 0.49 | 26% | 0.258 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.7 | -15.7 | 178.9 | 58.9 | 0 | 0 | 0 | 0 | 114.6 | A184 | S144-A184 WeakPolarHBondContact CB-O 3.32Å; S144-A184 PolarHBondContact N-O 3.06Å; S144-A184 PolarHBondContact OG-O 3.28Å |
| 145 | S | 93.1 | Very high | 94.2 | Very high | 101 Ų | 101 | 48.8 Ų | 48.8 | 71% | 0.706 | 26% | 0.26 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.5 | -7.9 | 179.6 | 62.2 | 0 | 0 | 0 | 0 | 114.7 | R143 | R143-S145 PolarHBondContact O-N 3.01Š|
| 146 | I | 94.6 | Very high | 94.3 | Very high | 36 Ų | 36 | 48.8 Ų | 48.8 | 19% | 0.185 | 26% | 0.26 | C | S | . | . | S | Bend | trans | -72.8 | 149.9 | -178.8 | 70.8 | 171.7 | 0 | 0 | 0 | 111.2 | Y116 P142 R143 Y149 V152 | Y116-I146 HydrophobicContact CE2-CD1 4.41Å; P142-I146 HydrophobicContact CB-CD1 3.65Å; R143-I146 WeakPolarHBondContact O-CG1 3.23Å; R143-I146 WeakPolarHBondContact O-CG2 3.47Å; R143-I146 PolarHBondContact O-N 3.45Å; I146-Y149 HydrophobicContact CD1-CD2 4.37Å; I146-Y149 HydrophobicContact CG1-CD2 4.01Å; I146-Y149 PolarHBondContact O-N 3.05Å; I146-V152 HydrophobicContact CD1-CB 4.13Å; I146-V152 HydrophobicContact CD1-CG1 4.1Å; I146-V152 HydrophobicContact CD1-CG2 3.99Å |
| 147 | P | 94.4 | Very high | 94.3 | Very high | 107 Ų | 107 | 48.6 Ų | 48.6 | 70% | 0.695 | 26% | 0.259 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.9 | 146 | 171.8 | 27.2 | -35.4 | 0 | 0 | 0 | 110.6 | Y149 | P147-Y149 PolarHBondContact O-N 3.33Å; P147-Y149 VanDerWaalsContact O-N 3.16Å |
| 148 | N | 93.8 | Very high | 94.2 | Very high | 127 Ų | 127 | 51.4 Ų | 51.4 | 68% | 0.679 | 27% | 0.269 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.3 | 31.9 | 179.1 | -57.1 | -35.3 | 0 | 0 | 0 | 114 | T150 Y151 V152 | N148-T150 VanDerWaalsContact C-N 3.26Å; N148-T150 PolarHBondContact O-N 2.98Å; N148-T150 VanDerWaalsContact O-N 3.14Å; N148-Y151 WeakPolarHBondContact O-CA 3.12Å; N148-Y151 WeakPolarHBondContact O-CB 3.41Å; N148-Y151 PolarHBondContact O-N 3.18Å; N148-V152 PolarHBondContact O-N 3.2Å |
| 149 | Y | 94.4 | Very high | 94.3 | Very high | 31 Ų | 31 | 52.5 Ų | 52.5 | 12% | 0.122 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -46.8 | -46.5 | -178.7 | 175.4 | -103.7 | 0 | 0 | 0 | 113.3 | P142 R143 I146 P147 Y151 V152 M153 | P142-Y149 HydrophobicContact CB-CD2 4.19Å; P142-Y149 HydrophobicContact CB-CE2 4.04Å; R143-Y149 WeakPolarHBondContact O-CD2 3.44Å; I146-Y149 HydrophobicContact CD1-CD2 4.37Å; I146-Y149 HydrophobicContact CG1-CD2 4.01Å; I146-Y149 PolarHBondContact O-N 3.05Å; P147-Y149 PolarHBondContact O-N 3.33Å; P147-Y149 VanDerWaalsContact O-N 3.16Å; Y149-Y151 VanDerWaalsContact C-N 3.32Å; Y149-Y151 PolarHBondContact O-N 2.83Å; Y149-V152 PolarHBondContact O-N 3.36Å; Y149-M153 HydrophobicContact CD1-CG 4.08Å; Y149-M153 HydrophobicContact CD2-CG 3.84Å; Y149-M153 HydrophobicContact CE1-CG 3.69Å; Y149-M153 HydrophobicContact CE2-CG 3.44Å; Y149-M153 VanDerWaalsContact CE2-CG 3.44Å; Y149-M153 HydrophobicContact CE2-SD 3.72Å; Y149-M153 HydrophobicContact CG-CG 4.16Å; Y149-M153 WeakPolarHBondContact O-CB 3.28Å; Y149-M153 VanDerWaalsContact O-CG 3.27Å; Y149-M153 WeakPolarHBondContact O-CG 3.26Å; Y149-M153 PolarHBondContact O-N 2.85Å |
| 150 | T | 93.8 | Very high | 94.3 | Very high | 107 Ų | 107 | 52.3 Ų | 52.3 | 66% | 0.656 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -57.9 | -43.4 | 178.4 | -53.3 | 0 | 0 | 0 | 0 | 112.3 | N148 E154 | N148-T150 VanDerWaalsContact C-N 3.26Å; N148-T150 PolarHBondContact O-N 2.98Å; N148-T150 VanDerWaalsContact O-N 3.14Å; T150-E154 WeakPolarHBondContact O-CB 3.33Å; T150-E154 PolarHBondContact O-N 3.12Å |
| 151 | Y | 95.3 | Very high | 94.1 | Very high | 70 Ų | 70 | 49.6 Ų | 49.6 | 28% | 0.275 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -65.8 | -45.7 | 178.6 | -178.9 | -100 | 0 | 0 | 0 | 111.5 | R94 D109 V112 N148 Y149 E154 H155 | R94-Y151 PolarHBondContact NH1-OH 2.86Å; R94-Y151 VanDerWaalsContact NH1-OH 3.14Å; D109-Y151 PolarHBondContact OD2-OH 3.22Å; V112-Y151 HydrophobicContact CB-CE1 4.49Å; V112-Y151 HydrophobicContact CG1-CD1 4.4Å; V112-Y151 HydrophobicContact CG1-CE1 3.94Å; V112-Y151 HydrophobicContact CG2-CD1 4.22Å; V112-Y151 HydrophobicContact CG2-CE1 3.93Å; N148-Y151 WeakPolarHBondContact O-CA 3.12Å; N148-Y151 WeakPolarHBondContact O-CB 3.41Å; N148-Y151 PolarHBondContact O-N 3.18Å; Y149-Y151 VanDerWaalsContact C-N 3.32Å; Y149-Y151 PolarHBondContact O-N 2.83Å; Y151-E154 PolarHBondContact O-N 2.78Å; Y151-H155 AromaticContact CD1-CD2 3.88Å; Y151-H155 AromaticContact CD2-CD2 3.81Å; Y151-H155 AromaticContact CD2-NE2 3.89Å; Y151-H155 AromaticContact CE1-CD2 3.54Å; Y151-H155 AromaticContact CE1-NE2 3.88Å; Y151-H155 AromaticContact CE2-CD2 3.46Å; Y151-H155 VanDerWaalsContact CE2-CD2 3.46Å; Y151-H155 WeakPolarHBondContact CE2-CD2 3.48Å; Y151-H155 AromaticContact CE2-NE2 3.14Å; Y151-H155 WeakPolarHBondContact CE2-NE2 3.33Å; Y151-H155 AromaticContact CZ-CD2 3.31Å; Y151-H155 AromaticContact CZ-NE2 3.12Å; Y151-H155 PolarHBondContact O-CD2 2.82Å; Y151-H155 VanDerWaalsContact O-CD2 3.32Å; Y151-H155 PolarHBondContact O-N 3.2Å; Y151-H155 PolarHBondContact OH-NE2 2.87Å |
| 152 | V | 96.1 | Very high | 93.9 | Very high | 11 Ų | 11 | 49.4 Ų | 49.4 | 7% | 0.067 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -60.9 | -47.8 | 177.1 | 177.8 | 0 | 0 | 0 | 0 | 110.6 | V112 Y116 P142 I146 N148 Y149 E154 H155 L156 | V112-V152 HydrophobicContact CB-CG2 4.36Å; Y116-V152 HydrophobicContact CD2-CG1 3.84Å; Y116-V152 HydrophobicContact CE2-CG1 3.67Å; P142-V152 HydrophobicContact CB-CG1 4.32Å; P142-V152 HydrophobicContact CG-CG1 3.81Å; I146-V152 HydrophobicContact CD1-CB 4.13Å; I146-V152 HydrophobicContact CD1-CG1 4.1Å; I146-V152 HydrophobicContact CD1-CG2 3.99Å; N148-V152 PolarHBondContact O-N 3.2Å; Y149-V152 PolarHBondContact O-N 3.36Å; V152-E154 VanDerWaalsContact C-N 3.34Å; V152-E154 PolarHBondContact O-N 3.21Å; V152-H155 PolarHBondContact O-N 3.03Å; V152-L156 VanDerWaalsContact O-CB 3.27Å; V152-L156 WeakPolarHBondContact O-CB 3.49Å; V152-L156 PolarHBondContact O-N 2.99Å |
| 153 | M | 95.1 | Very high | 93.6 | Very high | 0 Ų | 0 | 50.6 Ų | 50.6 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -64.8 | -36.7 | 179.5 | -72.3 | -60.8 | -62.3 | 0 | 0 | 112.4 | L141 P142 Y149 L156 F157 P187 W191 | L141-M153 HydrophobicContact CD2-CE 4.38Å; P142-M153 HydrophobicContact CB-SD 4.14Å; P142-M153 HydrophobicContact CG-SD 3.69Å; Y149-M153 HydrophobicContact CD1-CG 4.08Å; Y149-M153 HydrophobicContact CD2-CG 3.84Å; Y149-M153 HydrophobicContact CE1-CG 3.69Å; Y149-M153 HydrophobicContact CE2-CG 3.44Å; Y149-M153 VanDerWaalsContact CE2-CG 3.44Å; Y149-M153 HydrophobicContact CE2-SD 3.72Å; Y149-M153 HydrophobicContact CG-CG 4.16Å; Y149-M153 WeakPolarHBondContact O-CB 3.28Å; Y149-M153 VanDerWaalsContact O-CG 3.27Å; Y149-M153 WeakPolarHBondContact O-CG 3.26Å; Y149-M153 PolarHBondContact O-N 2.85Å; M153-L156 HydrophobicContact SD-CD2 4.47Å; M153-F157 WeakPolarHBondContact O-CB 3.37Å; M153-F157 PolarHBondContact O-N 3.24Å; M153-P187 HydrophobicContact CE-CB 3.97Å; M153-P187 HydrophobicContact CE-CG 3.62Å; M153-W191 HydrophobicContact CB-CZ2 4.41Å; M153-W191 HydrophobicContact CE-CD2 4.13Å; M153-W191 HydrophobicContact CE-CE3 4.35Å; M153-W191 HydrophobicContact CE-CH2 3.8Å; M153-W191 HydrophobicContact CE-CZ2 3.49Å; M153-W191 VanDerWaalsContact CE-CZ2 3.49Å; M153-W191 HydrophobicContact CE-CZ3 4.21Å; M153-W191 WeakPolarHBondContact O-CZ2 3.33Å |
| 154 | E | 94.3 | Very high | 93.3 | Very high | 84 Ų | 84 | 44.5 Ų | 44.5 | 39% | 0.393 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -63.1 | -51.6 | 173.9 | -174.8 | 177.8 | -179 | 0 | 0 | 110.9 | T150 Y151 V152 L156 F157 R158 | T150-E154 WeakPolarHBondContact O-CB 3.33Å; T150-E154 PolarHBondContact O-N 3.12Å; Y151-E154 PolarHBondContact O-N 2.78Å; V152-E154 VanDerWaalsContact C-N 3.34Å; V152-E154 PolarHBondContact O-N 3.21Å; E154-L156 VanDerWaalsContact C-N 3.29Å; E154-L156 PolarHBondContact O-N 3.31Å; E154-F157 WeakPolarHBondContact O-CB 3.28Å; E154-F157 PolarHBondContact O-N 2.8Å; E154-R158 VanDerWaalsContact O-CG 3.29Å; E154-R158 WeakPolarHBondContact O-CG 3.49Å; E154-R158 PolarHBondContact O-N 3.12Å; E154-R158 IonicContact OE1-CZ 3.44Å; E154-R158 IonicContact OE1-NE 3.59Å; E154-R158 IonicContact OE1-NH2 2.64Å; E154-R158 PolarHBondContact OE1-NH2 3.25Å |
| 155 | H | 95.4 | Very high | 92.9 | Very high | 7 Ų | 7 | 42.4 Ų | 42.4 | 3% | 0.032 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -63.4 | -35 | 177.6 | -80.2 | -69.8 | 0 | 0 | 0 | 112.9 | W96 V108 D109 V112 I113 Y151 V152 R158 Y159 | W96-H155 AromaticContact CZ3-CE1 3.86Å; V108-H155 HydrophobicContact CG1-CB 4.49Å; D109-H155 PolarHBondContact N-ND1 2.83Å; V112-H155 HydrophobicContact CG2-CB 4.25Å; I113-H155 HydrophobicContact CG2-CB 3.73Å; Y151-H155 AromaticContact CD1-CD2 3.88Å; Y151-H155 AromaticContact CD2-CD2 3.81Å; Y151-H155 AromaticContact CD2-NE2 3.89Å; Y151-H155 AromaticContact CE1-CD2 3.54Å; Y151-H155 AromaticContact CE1-NE2 3.88Å; Y151-H155 AromaticContact CE2-CD2 3.46Å; Y151-H155 VanDerWaalsContact CE2-CD2 3.46Å; Y151-H155 WeakPolarHBondContact CE2-CD2 3.48Å; Y151-H155 AromaticContact CE2-NE2 3.14Å; Y151-H155 WeakPolarHBondContact CE2-NE2 3.33Å; Y151-H155 AromaticContact CZ-CD2 3.31Å; Y151-H155 AromaticContact CZ-NE2 3.12Å; Y151-H155 PolarHBondContact O-CD2 2.82Å; Y151-H155 VanDerWaalsContact O-CD2 3.32Å; Y151-H155 PolarHBondContact O-N 3.2Å; Y151-H155 PolarHBondContact OH-NE2 2.87Å; V152-H155 PolarHBondContact O-N 3.03Å; H155-R158 PolarHBondContact O-N 2.89Å; H155-Y159 WeakPolarHBondContact O-CB 3.26Å; H155-Y159 PolarHBondContact O-N 3.23Å |
| 156 | L | 95.7 | Very high | 92.4 | Very high | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -66.2 | -41.7 | 174.7 | -170.8 | 62.4 | 0 | 0 | 0 | 111.4 | I113 V119 L141 P142 V152 M153 E154 Y159 M160 | I113-L156 HydrophobicContact CB-CD1 4.37Å; I113-L156 HydrophobicContact CG2-CB 4.24Å; V119-L156 HydrophobicContact CG1-CD1 3.84Å; V119-L156 HydrophobicContact CG1-CD2 4.42Å; V119-L156 HydrophobicContact CG1-CG 4.35Å; L141-L156 HydrophobicContact CD2-CD2 3.94Å; P142-L156 HydrophobicContact CG-CD2 3.96Å; V152-L156 VanDerWaalsContact O-CB 3.27Å; V152-L156 WeakPolarHBondContact O-CB 3.49Å; V152-L156 PolarHBondContact O-N 2.99Å; M153-L156 HydrophobicContact SD-CD2 4.47Å; E154-L156 VanDerWaalsContact C-N 3.29Å; E154-L156 PolarHBondContact O-N 3.31Å; L156-Y159 HydrophobicContact CD1-CD1 4.43Å; L156-Y159 WeakPolarHBondContact O-CB 3.39Å; L156-Y159 PolarHBondContact O-N 3.29Å; L156-M160 HydrophobicContact CG-CE 4.29Å; L156-M160 VanDerWaalsContact O-CG 3.3Å; L156-M160 WeakPolarHBondContact O-CG 3.36Å; L156-M160 PolarHBondContact O-N 3.04Å |
| 157 | F | 93.9 | Very high | 91.7 | Very high | 28 Ų | 28 | 40.3 Ų | 40.3 | 12% | 0.123 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -59.7 | -48.1 | 173.9 | -179.5 | -116.2 | 0 | 0 | 0 | 111.6 | M153 E154 Y159 M160 V161 W191 C195 T198 | M153-F157 WeakPolarHBondContact O-CB 3.37Å; M153-F157 PolarHBondContact O-N 3.24Å; E154-F157 WeakPolarHBondContact O-CB 3.28Å; E154-F157 PolarHBondContact O-N 2.8Å; F157-Y159 VanDerWaalsContact C-N 3.31Å; F157-Y159 PolarHBondContact O-N 3.33Å; F157-M160 HydrophobicContact CD2-CE 4.41Å; F157-M160 PolarHBondContact O-N 3.26Å; F157-M160 VanDerWaalsContact O-N 3.16Å; F157-V161 HydrophobicContact CD1-CG2 4.33Å; F157-V161 HydrophobicContact CD2-CG2 4.05Å; F157-V161 HydrophobicContact CE1-CG2 3.85Å; F157-V161 HydrophobicContact CE2-CG2 3.54Å; F157-V161 HydrophobicContact CG-CG2 4.41Å; F157-V161 HydrophobicContact CZ-CG2 3.42Å; F157-V161 VanDerWaalsContact CZ-CG2 3.42Å; F157-V161 WeakPolarHBondContact O-CG2 3.19Å; F157-V161 PolarHBondContact O-N 3.3Å; F157-W191 HydrophobicContact CB-CH2 4.31Å; F157-W191 HydrophobicContact CB-CZ2 3.66Å; F157-W191 HydrophobicContact CD2-CH2 4.23Å; F157-W191 HydrophobicContact CD2-CZ2 4.32Å; F157-W191 HydrophobicContact CG-CZ2 4.27Å; F157-C195 HydrophobicContact CD2-CB 3.9Å; F157-C195 WeakPolarHBondContact CD2-SG 3.37Å; F157-C195 HydrophobicContact CE2-CB 3.41Å; F157-C195 VanDerWaalsContact CE2-CB 3.41Å; F157-C195 WeakPolarHBondContact CE2-SG 3.49Å; F157-C195 HydrophobicContact CZ-CB 3.83Å; F157-C195 WeakPolarHBondContact CZ-O 3.23Å; F157-T198 HydrophobicContact CE1-CG2 3.78Å |
| 158 | R | 92.9 | Very high | 90.5 | Very high | 63 Ų | 63 | 35.4 Ų | 35.4 | 24% | 0.238 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -58.4 | -43.4 | 177.2 | -64.3 | -175 | -175.4 | 179.6 | 2.6 | 111.7 | Q106 R107 V108 E154 H155 V161 G162 | Q106-R158 VanDerWaalsContact CD-CB 3.45Å; Q106-R158 VanDerWaalsContact CD-CG 3.5Å; Q106-R158 HydrophobicContact CG-CB 3.95Å; Q106-R158 HydrophobicContact CG-CG 4.02Å; Q106-R158 VanDerWaalsContact NE2-CG 3.27Å; Q106-R158 PolarHBondContact OE1-O 2.7Å; R107-R158 PolarHBondContact O-NH1 3.41Å; R107-R158 VanDerWaalsContact O-NH1 3.11Å; V108-R158 HydrophobicContact CG2-CB 3.64Å; E154-R158 VanDerWaalsContact O-CG 3.29Å; E154-R158 WeakPolarHBondContact O-CG 3.49Å; E154-R158 PolarHBondContact O-N 3.12Å; E154-R158 IonicContact OE1-CZ 3.44Å; E154-R158 IonicContact OE1-NE 3.59Å; E154-R158 IonicContact OE1-NH2 2.64Å; E154-R158 PolarHBondContact OE1-NH2 3.25Å; H155-R158 PolarHBondContact O-N 2.89Å; R158-V161 PolarHBondContact O-N 2.97Å; R158-G162 PolarHBondContact O-N 3.48Å |
| 159 | Y | 93.8 | Very high | 89.1 | Confident | 25 Ų | 25 | 31.8 Ų | 31.8 | 10% | 0.098 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -60 | -45.8 | 174.7 | 175.2 | -106.1 | 0 | 0 | 0 | 112.4 | F99 M110 I113 K117 H155 L156 F157 T163 | F99-Y159 HydrophobicContact CE2-CD2 4.28Å; F99-Y159 AromaticContact CZ-CD2 3.93Å; F99-Y159 HydrophobicContact CZ-CD2 3.93Å; F99-Y159 HydrophobicContact CZ-CE2 4.33Å; M110-Y159 HydrophobicContact CE-CD2 4.24Å; M110-Y159 HydrophobicContact CE-CE2 4.06Å; M110-Y159 HydrophobicContact SD-CD2 4.24Å; I113-Y159 VanDerWaalsContact CD1-CB 3.44Å; I113-Y159 HydrophobicContact CD1-CD1 4.15Å; I113-Y159 HydrophobicContact CD1-CD2 3.75Å; I113-Y159 HydrophobicContact CD1-CG 3.5Å; I113-Y159 VanDerWaalsContact CD1-CG 3.5Å; K117-Y159 HydrophobicContact CB-CE1 4.44Å; K117-Y159 HydrophobicContact CG-CE1 4.24Å; H155-Y159 WeakPolarHBondContact O-CB 3.26Å; H155-Y159 PolarHBondContact O-N 3.23Å; L156-Y159 HydrophobicContact CD1-CD1 4.43Å; L156-Y159 WeakPolarHBondContact O-CB 3.39Å; L156-Y159 PolarHBondContact O-N 3.29Å; F157-Y159 VanDerWaalsContact C-N 3.31Å; F157-Y159 PolarHBondContact O-N 3.33Å; Y159-T163 VanDerWaalsContact O-CB 3.31Å; Y159-T163 WeakPolarHBondContact O-CB 3.32Å; Y159-T163 PolarHBondContact O-N 3.48Å; Y159-T163 PolarHBondContact O-OG1 3.12Å |
| 160 | M | 92.5 | Very high | 88 | Confident | 15 Ų | 15 | 34.1 Ų | 34.1 | 7% | 0.074 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -64.3 | -46.9 | 179.2 | -71.1 | -174.9 | -64.1 | 0 | 0 | 111.6 | V119 L120 F136 L156 F157 T163 L164 W191 | V119-M160 HydrophobicContact CG1-CG 4.23Å; V119-M160 HydrophobicContact CG1-SD 3.98Å; L120-M160 HydrophobicContact CD2-CG 4.47Å; F136-M160 HydrophobicContact CD2-SD 3.83Å; F136-M160 HydrophobicContact CE2-CE 4.29Å; F136-M160 HydrophobicContact CE2-SD 3.44Å; F136-M160 WeakPolarHBondContact CE2-SD 3.47Å; L156-M160 HydrophobicContact CG-CE 4.29Å; L156-M160 VanDerWaalsContact O-CG 3.3Å; L156-M160 WeakPolarHBondContact O-CG 3.36Å; L156-M160 PolarHBondContact O-N 3.04Å; F157-M160 HydrophobicContact CD2-CE 4.41Å; F157-M160 PolarHBondContact O-N 3.26Å; F157-M160 VanDerWaalsContact O-N 3.16Å; M160-T163 PolarHBondContact O-N 2.93Å; M160-L164 WeakPolarHBondContact O-CB 3.37Å; M160-L164 WeakPolarHBondContact O-CG 3.16Å; M160-L164 PolarHBondContact O-N 2.99Å; M160-W191 HydrophobicContact CE-CH2 4.03Å |
| 161 | V | 90.3 | Very high | 87.6 | Confident | 11 Ų | 11 | 32.4 Ų | 32.4 | 7% | 0.067 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -60.6 | -51 | 176.7 | 174.8 | 0 | 0 | 0 | 0 | 110.5 | I101 F157 R158 T163 L164 E165 L199 L203 | I101-V161 HydrophobicContact CD1-CG1 4.49Å; F157-V161 HydrophobicContact CD1-CG2 4.33Å; F157-V161 HydrophobicContact CD2-CG2 4.05Å; F157-V161 HydrophobicContact CE1-CG2 3.85Å; F157-V161 HydrophobicContact CE2-CG2 3.54Å; F157-V161 HydrophobicContact CG-CG2 4.41Å; F157-V161 HydrophobicContact CZ-CG2 3.42Å; F157-V161 VanDerWaalsContact CZ-CG2 3.42Å; F157-V161 WeakPolarHBondContact O-CG2 3.19Å; F157-V161 PolarHBondContact O-N 3.3Å; R158-V161 PolarHBondContact O-N 2.97Å; V161-T163 VanDerWaalsContact C-N 3.27Å; V161-T163 PolarHBondContact O-N 3.21Å; V161-L164 PolarHBondContact O-N 2.83Å; V161-E165 HydrophobicContact CG1-CG 4.45Å; V161-E165 WeakPolarHBondContact O-CG 3.33Å; V161-E165 PolarHBondContact O-N 2.72Å; V161-L199 HydrophobicContact CG2-CD1 3.86Å; V161-L203 HydrophobicContact CG1-CD1 4.09Å |
| 162 | G | 89.6 | Confident | 87.3 | Confident | 1 Ų | 1 | 29.2 Ų | 29.2 | 1% | 0.01 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -58.3 | -38.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113 | R158 E165 L166 | R158-G162 PolarHBondContact O-N 3.48Å; G162-E165 PolarHBondContact O-N 3.36Å; G162-L166 WeakPolarHBondContact O-CG 3.44Å; G162-L166 PolarHBondContact O-N 3.02Å |
| 163 | T | 89.3 | Confident | 87.1 | Confident | 25 Ų | 25 | 29.5 Ų | 29.5 | 15% | 0.153 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -70.4 | -44.1 | 176.2 | -54.7 | 0 | 0 | 0 | 0 | 111.7 | L120 Y159 M160 V161 E165 L166 L167 | L120-T163 HydrophobicContact CD2-CG2 3.66Å; Y159-T163 VanDerWaalsContact O-CB 3.31Å; Y159-T163 WeakPolarHBondContact O-CB 3.32Å; Y159-T163 PolarHBondContact O-N 3.48Å; Y159-T163 PolarHBondContact O-OG1 3.12Å; M160-T163 PolarHBondContact O-N 2.93Å; V161-T163 VanDerWaalsContact C-N 3.27Å; V161-T163 PolarHBondContact O-N 3.21Å; T163-E165 VanDerWaalsContact C-N 3.26Å; T163-E165 PolarHBondContact O-N 2.88Å; T163-L166 PolarHBondContact O-N 3Å; T163-L167 HydrophobicContact CG2-CD1 3.8Å; T163-L167 HydrophobicContact CG2-CG 4.3Å; T163-L167 VanDerWaalsContact O-CG 3.28Å; T163-L167 WeakPolarHBondContact O-CG 3.44Å; T163-L167 PolarHBondContact O-N 3.43Å |
| 164 | L | 87.9 | Confident | 87.1 | Confident | 15 Ų | 15 | 31 Ų | 31 | 8% | 0.079 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -57.5 | -41.8 | 174.5 | -73 | 174.1 | 0 | 0 | 0 | 110.8 | I134 M160 V161 L166 L167 V168 Y172 L203 | I134-L164 HydrophobicContact CB-CD2 4.39Å; I134-L164 HydrophobicContact CD1-CD2 3.4Å; I134-L164 HydrophobicContact CG1-CD2 4.45Å; I134-L164 HydrophobicContact CG2-CD2 3.83Å; M160-L164 WeakPolarHBondContact O-CB 3.37Å; M160-L164 WeakPolarHBondContact O-CG 3.16Å; M160-L164 PolarHBondContact O-N 2.99Å; V161-L164 PolarHBondContact O-N 2.83Å; L164-L166 VanDerWaalsContact C-N 3.32Å; L164-L166 PolarHBondContact O-N 3.26Å; L164-L167 PolarHBondContact O-N 2.88Å; L164-V168 WeakPolarHBondContact O-CB 3.31Å; L164-V168 WeakPolarHBondContact O-CG2 3.43Å; L164-V168 PolarHBondContact O-N 3.3Å; L164-Y172 HydrophobicContact CD2-CE2 4.13Å; L164-L203 HydrophobicContact CB-CD1 4.13Å; L164-L203 HydrophobicContact CB-CD2 4.07Å |
| 165 | E | 85.3 | Confident | 87.1 | Confident | 26 Ų | 26 | 27.1 Ų | 27.1 | 12% | 0.121 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -67.2 | -30.8 | 179.5 | -71.7 | -161.6 | -164.4 | 0 | 0 | 114.8 | I101 V161 G162 T163 R202 L203 | I101-E165 WeakPolarHBondContact CB-OE2 2.93Å; I101-E165 WeakPolarHBondContact CG1-OE2 3.16Å; I101-E165 VanDerWaalsContact CG2-CD 3.42Å; I101-E165 WeakPolarHBondContact CG2-OE1 3.37Å; I101-E165 WeakPolarHBondContact CG2-OE2 3.1Å; V161-E165 HydrophobicContact CG1-CG 4.45Å; V161-E165 WeakPolarHBondContact O-CG 3.33Å; V161-E165 PolarHBondContact O-N 2.72Å; G162-E165 PolarHBondContact O-N 3.36Å; T163-E165 VanDerWaalsContact C-N 3.26Å; T163-E165 PolarHBondContact O-N 2.88Å; E165-R202 IonicContact OE2-NH2 3.53Å; E165-L203 HydrophobicContact CG-CD1 3.69Å; E165-L203 HydrophobicContact CG-CD2 4.02Å; E165-L203 HydrophobicContact CG-CG 4.04Å |
| 166 | L | 82.8 | Confident | 87 | Confident | 44 Ų | 44 | 28.8 Ų | 28.8 | 23% | 0.23 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -74.4 | -33.6 | 173.6 | -66.4 | 170.5 | 0 | 0 | 0 | 111.6 | L80 C84 M85 F99 G162 T163 L164 | L80-L166 HydrophobicContact CD2-CB 4.42Å; L80-L166 HydrophobicContact CD2-CD2 4.2Å; L80-L166 VanDerWaalsContact CD2-O 3.26Å; L80-L166 WeakPolarHBondContact CD2-O 3.42Å; C84-L166 HydrophobicContact CB-CD2 3.81Å; M85-L166 HydrophobicContact CB-CD1 4.12Å; M85-L166 HydrophobicContact CG-CD1 4.49Å; M85-L166 HydrophobicContact SD-CD1 3.83Å; F99-L166 HydrophobicContact CD1-CD1 3.88Å; F99-L166 HydrophobicContact CE1-CD1 3.78Å; G162-L166 WeakPolarHBondContact O-CG 3.44Å; G162-L166 PolarHBondContact O-N 3.02Å; T163-L166 PolarHBondContact O-N 3Å; L164-L166 VanDerWaalsContact C-N 3.32Å; L164-L166 PolarHBondContact O-N 3.26Å |
| 167 | L | 78.6 | Confident | 87 | Confident | 50 Ų | 50 | 28.8 Ų | 28.8 | 26% | 0.262 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -84.7 | -30.3 | -177.6 | -65.2 | 176 | 0 | 0 | 0 | 112.9 | I134 T163 L164 A169 | I134-L167 HydrophobicContact CD1-CB 3.97Å; I134-L167 HydrophobicContact CD1-CD1 4.1Å; I134-L167 HydrophobicContact CG1-CD1 4.42Å; T163-L167 HydrophobicContact CG2-CD1 3.8Å; T163-L167 HydrophobicContact CG2-CG 4.3Å; T163-L167 VanDerWaalsContact O-CG 3.28Å; T163-L167 WeakPolarHBondContact O-CG 3.44Å; T163-L167 PolarHBondContact O-N 3.43Å; L164-L167 PolarHBondContact O-N 2.88Å; L167-A169 PolarHBondContact O-N 3.33Å |
| 168 | V | 68.9 | Low | 86.8 | Confident | 3 Ų | 3 | 27.8 Ų | 27.8 | 2% | 0.018 | 15% | 0.146 | C | C | . | . | trans | -92.6 | 82.4 | -173.5 | -179.1 | 0 | 0 | 0 | 0 | 109.7 | I134 L164 Y172 L203 N206 | I134-V168 HydrophobicContact CD1-CG2 3.92Å; L164-V168 WeakPolarHBondContact O-CB 3.31Å; L164-V168 WeakPolarHBondContact O-CG2 3.43Å; L164-V168 PolarHBondContact O-N 3.3Å; V168-Y172 HydrophobicContact CB-CD1 4.03Å; V168-Y172 HydrophobicContact CB-CE1 4.37Å; V168-Y172 HydrophobicContact CG1-CD1 3.42Å; V168-Y172 VanDerWaalsContact CG1-CD1 3.42Å; V168-Y172 HydrophobicContact CG1-CE1 3.76Å; V168-Y172 HydrophobicContact CG1-CG 4.34Å; V168-Y172 HydrophobicContact CG2-CD1 3.28Å; V168-Y172 HydrophobicContact CG2-CD2 4.03Å; V168-Y172 HydrophobicContact CG2-CE1 3.65Å; V168-Y172 HydrophobicContact CG2-CE2 4.33Å; V168-Y172 HydrophobicContact CG2-CG 3.49Å; V168-Y172 VanDerWaalsContact CG2-CG 3.49Å; V168-L203 HydrophobicContact CB-CD2 3.93Å; V168-L203 HydrophobicContact CG1-CD2 4.2Å; V168-L203 HydrophobicContact CG2-CD2 4.1Å; V168-N206 HydrophobicContact CG1-CB 3.64Å | ||
| 169 | A | 64.3 | Low | 86.5 | Confident | 52 Ų | 52 | 24.8 Ų | 24.8 | 43% | 0.43 | 13% | 0.134 | S | C | . | . | S | Bend | trans | -73.1 | -44.2 | 167.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | A76 L167 | A76-A169 HydrophobicContact CB-CB 4.44Å; L167-A169 PolarHBondContact O-N 3.33Å |
| 170 | E | 71.9 | Confident | 85.8 | Confident | 80 Ų | 80 | 25.8 Ų | 25.8 | 37% | 0.374 | 15% | 0.152 | S | C | . | . | S | Bend | trans | -131 | -83.1 | -175 | -65.9 | -174 | 178.1 | 0 | 0 | 113.2 | N206 | E170-N206 WeakPolarHBondContact O-CB 3.46Å; E170-N206 PolarHBondContact O-ND2 2.91Å |
| 171 | N | 85.6 | Confident | 85.5 | Confident | 70 Ų | 70 | 26 Ų | 26 | 37% | 0.374 | 15% | 0.154 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -125.9 | 146.5 | -177.7 | -67.7 | -73 | 0 | 0 | 0 | 110.5 | N131 A132 N206 | N131-N171 WeakPolarHBondContact CA-O 3.29Å; N131-N171 VanDerWaalsContact OD1-CB 3.28Å; N131-N171 WeakPolarHBondContact OD1-CB 3.22Å; A132-N171 PolarHBondContact N-O 2.82Å; A132-N171 VanDerWaalsContact N-O 3.1Å; N171-N206 WeakPolarHBondContact CA-O 3.27Å |
| 172 | Y | 89.9 | Confident | 85.2 | Confident | 4 Ų | 4 | 28 Ų | 28 | 2% | 0.016 | 17% | 0.168 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -144.2 | 153.1 | 178.3 | 73.5 | -73.4 | 0 | 0 | 0 | 113.5 | A132 I134 L164 V168 L174 L203 N206 L207 R208 | A132-Y172 CarbonylContact O-C 3.47Å; A132-Y172 WeakPolarHBondContact O-CA 3.19Å; A132-Y172 WeakPolarHBondContact O-CB 3.35Å; I134-Y172 HydrophobicContact CD1-CD2 3.76Å; I134-Y172 HydrophobicContact CD1-CE2 4.44Å; I134-Y172 HydrophobicContact CD1-CG 4.22Å; I134-Y172 HydrophobicContact CG1-CD2 4.27Å; L164-Y172 HydrophobicContact CD2-CE2 4.13Å; V168-Y172 HydrophobicContact CB-CD1 4.03Å; V168-Y172 HydrophobicContact CB-CE1 4.37Å; V168-Y172 HydrophobicContact CG1-CD1 3.42Å; V168-Y172 VanDerWaalsContact CG1-CD1 3.42Å; V168-Y172 HydrophobicContact CG1-CE1 3.76Å; V168-Y172 HydrophobicContact CG1-CG 4.34Å; V168-Y172 HydrophobicContact CG2-CD1 3.28Å; V168-Y172 HydrophobicContact CG2-CD2 4.03Å; V168-Y172 HydrophobicContact CG2-CE1 3.65Å; V168-Y172 HydrophobicContact CG2-CE2 4.33Å; V168-Y172 HydrophobicContact CG2-CG 3.49Å; V168-Y172 VanDerWaalsContact CG2-CG 3.49Å; Y172-L174 HydrophobicContact CD2-CB 4.36Å; Y172-L174 HydrophobicContact CE2-CB 4.09Å; Y172-L203 VanDerWaalsContact CE1-O 3.28Å; Y172-L203 WeakPolarHBondContact CE1-O 3.02Å; Y172-L203 PolarHBondContact OH-O 3.49Å; Y172-N206 HydrophobicContact CD1-CB 4.24Å; Y172-N206 WeakPolarHBondContact CD1-O 3.36Å; Y172-N206 HydrophobicContact CE1-CB 4.16Å; Y172-N206 PolarHBondContact N-O 3.37Å; Y172-L207 HydrophobicContact CD2-CD1 3.97Å; Y172-L207 HydrophobicContact CE1-CB 3.88Å; Y172-L207 HydrophobicContact CE1-CD1 4.33Å; Y172-L207 HydrophobicContact CE2-CB 4.48Å; Y172-L207 HydrophobicContact CE2-CD1 3.49Å; Y172-L207 VanDerWaalsContact CE2-CD1 3.49Å; Y172-R208 PolarHBondContact O-N 3.32Å |
| 173 | L | 91.4 | Very high | 85 | Confident | 17 Ų | 17 | 35.3 Ų | 35.3 | 9% | 0.089 | 20% | 0.196 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -104.2 | 125 | 171 | -67.8 | 167.4 | 0 | 0 | 0 | 108 | H126 A132 V133 I134 R208 A209 I251 | H126-L173 HydrophobicContact CB-CD1 4.2Å; A132-L173 PolarHBondContact O-N 2.93Å; V133-L173 HydrophobicContact CG2-CD1 4.49Å; I134-L173 PolarHBondContact N-O 3.1Å; L173-R208 HydrophobicContact CD2-CB 4.01Å; L173-R208 HydrophobicContact CD2-CG 4.17Å; L173-A209 HydrophobicContact CD2-CB 3.69Å; L173-I251 HydrophobicContact CD1-CG2 4.09Å |
| 174 | L | 93.8 | Very high | 84.9 | Confident | 32 Ų | 32 | 35.9 Ų | 35.9 | 17% | 0.168 | 20% | 0.203 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -101.9 | 114.1 | 174.7 | -174.8 | 58.9 | 0 | 0 | 0 | 109 | I134 F136 Y172 L207 A209 L210 V211 | I134-L174 HydrophobicContact CB-CD1 4.13Å; I134-L174 HydrophobicContact CG2-CD1 4.04Å; I134-L174 CarbonylContact O-C 3.58Å; I134-L174 WeakPolarHBondContact O-CA 3.32Å; F136-L174 HydrophobicContact CB-CD1 4.24Å; Y172-L174 HydrophobicContact CD2-CB 4.36Å; Y172-L174 HydrophobicContact CE2-CB 4.09Å; L174-L207 HydrophobicContact CB-CD1 3.6Å; L174-A209 PolarHBondContact N-O 2.83Å; L174-L210 HydrophobicContact CB-CD1 4.05Å; L174-L210 HydrophobicContact CD2-CD1 3.93Å; L174-L210 HydrophobicContact CG-CD1 3.85Å; L174-L210 CarbonylContact O-C 3.55Å; L174-L210 WeakPolarHBondContact O-CA 3.41Å; L174-L210 WeakPolarHBondContact O-CD1 3.47Å; L174-V211 PolarHBondContact O-N 2.88Å |
| 175 | V | 94.7 | Very high | 85 | Confident | 1 Ų | 1 | 35.9 Ų | 35.9 | 1% | 0.006 | 20% | 0.203 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -99.8 | 108.2 | 178 | -177.2 | 0 | 0 | 0 | 0 | 108.8 | V133 I134 L135 F136 L177 V211 V213 L247 I251 | V133-V175 HydrophobicContact CG1-CG2 4.16Å; I134-V175 PolarHBondContact O-N 2.88Å; L135-V175 CarbonylContact C-O 3.6Å; L135-V175 WeakPolarHBondContact CA-O 3.3Å; L135-V175 HydrophobicContact CD2-CB 4.45Å; L135-V175 HydrophobicContact CD2-CG1 4.44Å; L135-V175 HydrophobicContact CG-CB 4.27Å; F136-V175 PolarHBondContact N-O 3.24Å; V175-L177 HydrophobicContact CG1-CD2 3.86Å; V175-L177 HydrophobicContact CG1-CG 4.36Å; V175-V211 CarbonylContact C-O 3.57Å; V175-V211 WeakPolarHBondContact CA-O 3.33Å; V175-V211 HydrophobicContact CG2-CB 4.46Å; V175-V213 HydrophobicContact CG1-CG2 4.03Å; V175-L247 HydrophobicContact CG1-CD1 3.81Å; V175-L247 HydrophobicContact CG1-CD2 3.97Å; V175-L247 HydrophobicContact CG2-CD1 4.11Å; V175-I251 HydrophobicContact CG2-CD1 4.06Å |
| 176 | H | 94.6 | Very high | 85.1 | Confident | 42 Ų | 42 | 35.9 Ų | 35.9 | 19% | 0.194 | 20% | 0.204 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -89.3 | 104.6 | 174.1 | 178.7 | -80.3 | 0 | 0 | 0 | 110.2 | F136 S178 L210 V211 V212 V213 | F136-H176 AromaticContact CD1-CD2 3.12Å; F136-H176 WeakPolarHBondContact CD1-CD2 3.4Å; F136-H176 AromaticContact CD1-NE2 3.63Å; F136-H176 AromaticContact CE1-CD2 3.41Å; F136-H176 VanDerWaalsContact CE1-CD2 3.41Å; F136-H176 WeakPolarHBondContact CE1-CD2 3.33Å; F136-H176 AromaticContact CE1-NE2 3.47Å; F136-H176 WeakPolarHBondContact CE1-NE2 3.46Å; F136-H176 CarbonylContact O-C 3.56Å; F136-H176 WeakPolarHBondContact O-CA 3.48Å; H176-S178 PolarHBondContact CE1-OG 2.75Å; H176-S178 VanDerWaalsContact CE1-OG 3.28Å; H176-S178 PolarHBondContact ND1-OG 2.73Å; H176-S178 PolarHBondContact O-N 3.23Å; H176-L210 HydrophobicContact CB-CD1 4.11Å; H176-V211 PolarHBondContact N-O 3.09Å; H176-V212 HydrophobicContact CB-CG1 4.36Å; H176-V212 HydrophobicContact CB-CG2 4.31Å; H176-V212 CarbonylContact O-C 3.49Å; H176-V212 WeakPolarHBondContact O-CA 3.44Å; H176-V213 PolarHBondContact O-N 3.2Å |
| 177 | L | 94.3 | Very high | 85.3 | Confident | 0 Ų | 0 | 34.3 Ų | 34.3 | 0% | 0 | 20% | 0.197 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -83.6 | 110.7 | 173.1 | -57.2 | 177.7 | 0 | 0 | 0 | 109.1 | L135 F136 S138 V175 V213 L244 L247 I258 P259 V262 | L135-L177 HydrophobicContact CD2-CD1 3.81Å; L135-L177 HydrophobicContact CD2-CG 4.29Å; F136-L177 PolarHBondContact O-N 2.98Å; S138-L177 PolarHBondContact N-O 3.37Å; S138-L177 VanDerWaalsContact N-O 3.11Å; S138-L177 PolarHBondContact OG-O 2.83Å; V175-L177 HydrophobicContact CG1-CD2 3.86Å; V175-L177 HydrophobicContact CG1-CG 4.36Å; L177-V213 HydrophobicContact CD2-CB 4.06Å; L177-V213 HydrophobicContact CD2-CG2 4.09Å; L177-L244 HydrophobicContact CD2-CD2 4.45Å; L177-L247 HydrophobicContact CD2-CD2 4.35Å; L177-I258 HydrophobicContact CD1-CG2 4.25Å; L177-P259 HydrophobicContact CD1-CG 4.45Å; L177-V262 HydrophobicContact CB-CG1 4.4Å; L177-V262 HydrophobicContact CB-CG2 4.01Å; L177-V262 HydrophobicContact CD2-CG1 4.41Å |
| 178 | S | 90.5 | Very high | 85.8 | Confident | 8 Ų | 8 | 34.9 Ų | 34.9 | 6% | 0.056 | 20% | 0.203 | C | C | . | . | trans | -87.9 | -15.3 | -177.1 | -43.3 | 0 | 0 | 0 | 0 | 113.4 | S138 H176 T181 V212 V213 H214 | S138-S178 VanDerWaalsContact OG-CA 3.32Å; S138-S178 WeakPolarHBondContact OG-CA 3.49Å; H176-S178 PolarHBondContact CE1-OG 2.75Å; H176-S178 VanDerWaalsContact CE1-OG 3.28Å; H176-S178 PolarHBondContact ND1-OG 2.73Å; H176-S178 PolarHBondContact O-N 3.23Å; S178-T181 VanDerWaalsContact O-CB 3.27Å; S178-T181 WeakPolarHBondContact O-CB 3.39Å; S178-T181 PolarHBondContact O-N 2.89Å; S178-T181 PolarHBondContact O-OG1 2.89Å; S178-V212 WeakPolarHBondContact OG-CG1 3.41Å; S178-V213 WeakPolarHBondContact CB-O 3.4Å; S178-V213 PolarHBondContact N-O 3.33Å; S178-V213 PolarHBondContact OG-O 2.93Å; S178-H214 WeakPolarHBondContact CB-O 3.47Å | ||
| 179 | G | 86.1 | Confident | 86.6 | Confident | 0 Ų | 0 | 37.1 Ų | 37.1 | 0% | 0 | 22% | 0.215 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61.6 | 135.7 | -170.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | C139 T181 V262 L265 | C139-G179 WeakPolarHBondContact CB-O 3.31Å; G179-T181 VanDerWaalsContact C-N 3.26Å; G179-T181 PolarHBondContact O-N 3.48Å; G179-V262 WeakPolarHBondContact O-CG2 3.21Å; G179-L265 VanDerWaalsContact CA-CD2 3.46Å |
| 180 | G | 79.8 | Confident | 87.7 | Confident | 46 Ų | 46 | 38.7 Ų | 38.7 | 47% | 0.474 | 22% | 0.223 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 73.9 | 9 | -179.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | S182 | G180-S182 PolarHBondContact O-N 3.26Š|
| 181 | T | 84.9 | Confident | 88.5 | Confident | 20 Ų | 20 | 37.1 Ų | 37.1 | 12% | 0.123 | 21% | 0.213 | C | C | . | . | trans | -82.2 | 118 | -178.5 | -57.1 | 0 | 0 | 0 | 0 | 111.5 | S138 C139 S178 G179 Q185 V186 Y218 | S138-T181 VanDerWaalsContact C-OG1 3.25Å; S138-T181 WeakPolarHBondContact CB-OG1 3.24Å; S138-T181 PolarHBondContact OG-OG1 3.34Å; C139-T181 PolarHBondContact N-OG1 3.16Å; S178-T181 VanDerWaalsContact O-CB 3.27Å; S178-T181 WeakPolarHBondContact O-CB 3.39Å; S178-T181 PolarHBondContact O-N 2.89Å; S178-T181 PolarHBondContact O-OG1 2.89Å; G179-T181 VanDerWaalsContact C-N 3.26Å; G179-T181 PolarHBondContact O-N 3.48Å; T181-Q185 HydrophobicContact CG2-CB 4.11Å; T181-V186 HydrophobicContact CG2-CG2 4.21Å; T181-Y218 PolarHBondContact O-OH 2.84Å | ||
| 182 | S | 85.8 | Confident | 88.6 | Confident | 51 Ų | 51 | 35.8 Ų | 35.8 | 36% | 0.357 | 21% | 0.206 | S | C | . | . | trans | -73.2 | 149.9 | 173.4 | 179.7 | 0 | 0 | 0 | 0 | 111.2 | G180 A184 Q185 | G180-S182 PolarHBondContact O-N 3.26Å; S182-A184 PolarHBondContact O-N 3.16Å; S182-A184 VanDerWaalsContact O-N 3.12Å; S182-A184 PolarHBondContact OG-N 3.49Å; S182-Q185 WeakPolarHBondContact O-CB 3.08Å; S182-Q185 PolarHBondContact O-N 2.88Å | ||
| 183 | R | 85.2 | Confident | 88.4 | Confident | 156 Ų | 156 | 39.8 Ų | 39.8 | 59% | 0.589 | 22% | 0.221 | S | C | * | . | G | 310 helix | trans | -54.1 | -32.6 | 172.5 | -175.1 | 61 | 176.6 | 125.1 | -6.5 | 112.6 | Q185 V186 | R183-Q185 PolarHBondContact O-N 3.4Å; R183-V186 PolarHBondContact O-N 3.22Å |
| 184 | A | 87.5 | Confident | 88.2 | Confident | 37 Ų | 37 | 44.2 Ų | 44.2 | 31% | 0.306 | 24% | 0.241 | S | C | . | . | G | 310 helix | trans | -67.4 | -17.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | R143 S144 S182 | R143-A184 CarbonylContact C-O 3.51Å; R143-A184 WeakPolarHBondContact CA-O 3.31Å; S144-A184 WeakPolarHBondContact CB-O 3.32Å; S144-A184 PolarHBondContact N-O 3.06Å; S144-A184 PolarHBondContact OG-O 3.28Å; S182-A184 PolarHBondContact O-N 3.16Å; S182-A184 VanDerWaalsContact O-N 3.12Å; S182-A184 PolarHBondContact OG-N 3.49Å |
| 185 | Q | 89.4 | Confident | 87.9 | Confident | 15 Ų | 15 | 43.3 Ų | 43.3 | 7% | 0.07 | 24% | 0.238 | C | C | . | . | G | 310 helix | trans | -94.6 | -14.1 | 177.8 | -63.9 | 174.7 | -80.2 | 0 | 0 | 112.6 | C139 L141 R143 T181 S182 R183 P187 | C139-Q185 PolarHBondContact O-NE2 2.9Å; L141-Q185 HydrophobicContact CB-CB 4.1Å; L141-Q185 PolarHBondContact O-NE2 2.81Å; R143-Q185 HydrophobicContact CB-CG 4.47Å; R143-Q185 HydrophobicContact CG-CG 3.6Å; T181-Q185 HydrophobicContact CG2-CB 4.11Å; S182-Q185 WeakPolarHBondContact O-CB 3.08Å; S182-Q185 PolarHBondContact O-N 2.88Å; R183-Q185 PolarHBondContact O-N 3.4Å; Q185-P187 VanDerWaalsContact O-CD 3.29Å; Q185-P187 WeakPolarHBondContact O-CD 3.17Å |
| 186 | V | 87.5 | Confident | 87.5 | Confident | 25 Ų | 25 | 44.9 Ų | 44.9 | 15% | 0.152 | 24% | 0.243 | C | C | . | . | S | Bend | trans | -72.2 | 118.6 | 180 | -179 | 0 | 0 | 0 | 0 | 108.9 | T181 R183 Y218 | T181-V186 HydrophobicContact CG2-CG2 4.21Å; R183-V186 PolarHBondContact O-N 3.22Å; V186-Y218 HydrophobicContact CG2-CE2 4.05Å |
| 187 | P | 87.4 | Confident | 87.1 | Confident | 11 Ų | 11 | 50.8 Ų | 50.8 | 7% | 0.071 | 26% | 0.264 | C | S | . | . | P | Polyproline II helix | trans | -62.5 | 152.8 | -179.1 | -22.3 | 34.5 | 0 | 0 | 0 | 112 | L141 M153 Q185 W191 I192 | L141-P187 HydrophobicContact CD1-CG 4.28Å; M153-P187 HydrophobicContact CE-CB 3.97Å; M153-P187 HydrophobicContact CE-CG 3.62Å; Q185-P187 VanDerWaalsContact O-CD 3.29Å; Q185-P187 WeakPolarHBondContact O-CD 3.17Å; P187-W191 HydrophobicContact CB-CB 4.48Å; P187-W191 HydrophobicContact CB-CD2 4.04Å; P187-W191 HydrophobicContact CB-CE3 3.53Å; P187-W191 HydrophobicContact CB-CG 4.46Å; P187-W191 HydrophobicContact CB-CZ3 4.07Å; P187-W191 HydrophobicContact CG-CE3 4.01Å; P187-W191 HydrophobicContact CG-CZ3 4.01Å; P187-I192 HydrophobicContact CB-CD1 4.29Å; P187-I192 HydrophobicContact CB-CG1 4.16Å |
| 188 | P | 88.3 | Confident | 86.7 | Confident | 62 Ų | 62 | 54.1 Ų | 54.1 | 40% | 0.403 | 29% | 0.285 | S | S | . | . | P | Polyproline II helix | trans | -66 | 153.9 | 177.2 | 27 | -32.8 | 0 | 0 | 0 | 111.8 | S190 W191 I192 | P188-S190 PolarHBondContact O-N 3.17Å; P188-W191 HydrophobicContact CG-CB 3.85Å; P188-W191 WeakPolarHBondContact O-CB 3.4Å; P188-W191 PolarHBondContact O-N 3.29Å; P188-I192 PolarHBondContact O-N 3.25Å; P188-I192 VanDerWaalsContact O-N 3.16Å |
| 189 | L | 85.8 | Confident | 86.5 | Confident | 51 Ų | 51 | 55 Ų | 55 | 27% | 0.267 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -54.1 | -39.9 | -179.4 | -175.8 | 67.3 | 0 | 0 | 0 | 113 | W191 I192 R193 F222 L225 L226 | L189-W191 VanDerWaalsContact C-N 3.31Å; L189-W191 PolarHBondContact O-N 3.24Å; L189-I192 PolarHBondContact O-N 2.82Å; L189-R193 WeakPolarHBondContact O-CB 3.39Å; L189-R193 PolarHBondContact O-N 3.12Å; L189-F222 HydrophobicContact CB-CE2 3.94Å; L189-F222 HydrophobicContact CB-CZ 4.21Å; L189-F222 HydrophobicContact CD1-CD2 4.4Å; L189-F222 HydrophobicContact CD1-CE1 4.43Å; L189-F222 HydrophobicContact CD1-CE2 3.47Å; L189-F222 VanDerWaalsContact CD1-CE2 3.47Å; L189-F222 HydrophobicContact CD1-CZ 3.46Å; L189-F222 VanDerWaalsContact CD1-CZ 3.46Å; L189-F222 HydrophobicContact CG-CE2 4.28Å; L189-F222 HydrophobicContact CG-CZ 4.45Å; L189-L225 HydrophobicContact CD2-CD2 4.34Å; L189-L226 HydrophobicContact CD1-CD1 4.25Å; L189-L226 HydrophobicContact CD1-CD2 3.3Å; L189-L226 HydrophobicContact CD1-CG 3.6Å; L189-L226 HydrophobicContact CG-CD2 4.46Å |
| 190 | S | 86.9 | Confident | 86.4 | Confident | 84 Ų | 84 | 58.4 Ų | 58.4 | 59% | 0.587 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -60.8 | -40.3 | 177.7 | 51.6 | 0 | 0 | 0 | 0 | 112.2 | P188 Q194 | P188-S190 PolarHBondContact O-N 3.17Å; S190-Q194 WeakPolarHBondContact O-CB 3.47Å; S190-Q194 PolarHBondContact O-N 2.82Å |
| 191 | W | 88.8 | Confident | 86.6 | Confident | 47 Ų | 47 | 59.1 Ų | 59.1 | 18% | 0.178 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -68.2 | -43.1 | 177.7 | -173.7 | 95.1 | 0 | 0 | 0 | 111 | M153 F157 M160 P187 P188 L189 R193 Q194 C195 | M153-W191 HydrophobicContact CB-CZ2 4.41Å; M153-W191 HydrophobicContact CE-CD2 4.13Å; M153-W191 HydrophobicContact CE-CE3 4.35Å; M153-W191 HydrophobicContact CE-CH2 3.8Å; M153-W191 HydrophobicContact CE-CZ2 3.49Å; M153-W191 VanDerWaalsContact CE-CZ2 3.49Å; M153-W191 HydrophobicContact CE-CZ3 4.21Å; M153-W191 WeakPolarHBondContact O-CZ2 3.33Å; F157-W191 HydrophobicContact CB-CH2 4.31Å; F157-W191 HydrophobicContact CB-CZ2 3.66Å; F157-W191 HydrophobicContact CD2-CH2 4.23Å; F157-W191 HydrophobicContact CD2-CZ2 4.32Å; F157-W191 HydrophobicContact CG-CZ2 4.27Å; M160-W191 HydrophobicContact CE-CH2 4.03Å; P187-W191 HydrophobicContact CB-CB 4.48Å; P187-W191 HydrophobicContact CB-CD2 4.04Å; P187-W191 HydrophobicContact CB-CE3 3.53Å; P187-W191 HydrophobicContact CB-CG 4.46Å; P187-W191 HydrophobicContact CB-CZ3 4.07Å; P187-W191 HydrophobicContact CG-CE3 4.01Å; P187-W191 HydrophobicContact CG-CZ3 4.01Å; P188-W191 HydrophobicContact CG-CB 3.85Å; P188-W191 WeakPolarHBondContact O-CB 3.4Å; P188-W191 PolarHBondContact O-N 3.29Å; L189-W191 VanDerWaalsContact C-N 3.31Å; L189-W191 PolarHBondContact O-N 3.24Å; W191-R193 PolarHBondContact O-N 3.16Å; W191-Q194 WeakPolarHBondContact O-CB 3.27Å; W191-Q194 PolarHBondContact O-N 2.96Å; W191-C195 VanDerWaalsContact CE2-SG 3.52Å; W191-C195 HydrophobicContact CE3-CB 4.49Å; W191-C195 WeakPolarHBondContact CH2-SG 3.47Å; W191-C195 VanDerWaalsContact CZ2-SG 3.55Å; W191-C195 HydrophobicContact CZ3-CB 4.37Å; W191-C195 WeakPolarHBondContact CZ3-SG 3.45Å; W191-C195 WeakPolarHBondContact O-CB 3.06Å; W191-C195 PolarHBondContact O-N 3.43Å; W191-C195 PolarHBondContact O-SG 2.83Å |
| 192 | I | 88 | Confident | 86.5 | Confident | 43 Ų | 43 | 63.3 Ų | 63.3 | 22% | 0.221 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -65 | -41.8 | 178.8 | -65.9 | 175.2 | 0 | 0 | 0 | 111.2 | P187 P188 L189 Q194 C195 Y196 F222 L226 | P187-I192 HydrophobicContact CB-CD1 4.29Å; P187-I192 HydrophobicContact CB-CG1 4.16Å; P188-I192 PolarHBondContact O-N 3.25Å; P188-I192 VanDerWaalsContact O-N 3.16Å; L189-I192 PolarHBondContact O-N 2.82Å; I192-Q194 VanDerWaalsContact C-N 3.34Å; I192-Q194 PolarHBondContact O-N 2.92Å; I192-C195 WeakPolarHBondContact O-CB 3.49Å; I192-C195 PolarHBondContact O-N 3.33Å; I192-Y196 PolarHBondContact O-N 3.25Å; I192-F222 HydrophobicContact CD1-CE1 3.39Å; I192-F222 HydrophobicContact CD1-CZ 3.53Å; I192-L226 HydrophobicContact CG2-CD1 3.65Å; I192-L226 HydrophobicContact CG2-CD2 4.49Å |
| 193 | R | 85.4 | Confident | 86.6 | Confident | 87 Ų | 87 | 60.9 Ų | 60.9 | 33% | 0.328 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -60.3 | -44.9 | 172.3 | -171.7 | -174.5 | -65.5 | 154.5 | -0.9 | 111.3 | L189 W191 C195 Y196 R197 | L189-R193 WeakPolarHBondContact O-CB 3.39Å; L189-R193 PolarHBondContact O-N 3.12Å; W191-R193 PolarHBondContact O-N 3.16Å; R193-C195 VanDerWaalsContact C-N 3.3Å; R193-C195 PolarHBondContact O-N 3.33Å; R193-Y196 PolarHBondContact O-N 3.5Å; R193-R197 WeakPolarHBondContact O-CG 3.31Å; R193-R197 PolarHBondContact O-N 3.17Å; R193-R197 VanDerWaalsContact O-N 3.09Å |
| 194 | Q | 87.1 | Confident | 86.8 | Confident | 110 Ų | 110 | 55.4 Ų | 55.4 | 51% | 0.514 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -62.7 | -39.4 | 177.8 | -175.9 | 61 | 17.9 | 0 | 0 | 111.6 | S190 W191 I192 R197 T198 | S190-Q194 WeakPolarHBondContact O-CB 3.47Å; S190-Q194 PolarHBondContact O-N 2.82Å; W191-Q194 WeakPolarHBondContact O-CB 3.27Å; W191-Q194 PolarHBondContact O-N 2.96Å; I192-Q194 VanDerWaalsContact C-N 3.34Å; I192-Q194 PolarHBondContact O-N 2.92Å; Q194-R197 PolarHBondContact O-N 3.19Å; Q194-T198 PolarHBondContact NE2-OG1 3.1Å; Q194-T198 VanDerWaalsContact O-CB 3.31Å; Q194-T198 WeakPolarHBondContact O-CB 3.37Å; Q194-T198 PolarHBondContact O-N 2.95Å; Q194-T198 PolarHBondContact O-OG1 3.42Å |
| 195 | C | 87.9 | Confident | 86.7 | Confident | 14 Ų | 14 | 58.9 Ų | 58.9 | 10% | 0.095 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -60.7 | -50.6 | 176.1 | -70.7 | 0 | 0 | 0 | 0 | 111 | F157 W191 I192 R193 R197 T198 L199 | F157-C195 HydrophobicContact CD2-CB 3.9Å; F157-C195 WeakPolarHBondContact CD2-SG 3.37Å; F157-C195 HydrophobicContact CE2-CB 3.41Å; F157-C195 VanDerWaalsContact CE2-CB 3.41Å; F157-C195 WeakPolarHBondContact CE2-SG 3.49Å; F157-C195 HydrophobicContact CZ-CB 3.83Å; F157-C195 WeakPolarHBondContact CZ-O 3.23Å; W191-C195 VanDerWaalsContact CE2-SG 3.52Å; W191-C195 HydrophobicContact CE3-CB 4.49Å; W191-C195 WeakPolarHBondContact CH2-SG 3.47Å; W191-C195 VanDerWaalsContact CZ2-SG 3.55Å; W191-C195 HydrophobicContact CZ3-CB 4.37Å; W191-C195 WeakPolarHBondContact CZ3-SG 3.45Å; W191-C195 WeakPolarHBondContact O-CB 3.06Å; W191-C195 PolarHBondContact O-N 3.43Å; W191-C195 PolarHBondContact O-SG 2.83Å; I192-C195 WeakPolarHBondContact O-CB 3.49Å; I192-C195 PolarHBondContact O-N 3.33Å; R193-C195 VanDerWaalsContact C-N 3.3Å; R193-C195 PolarHBondContact O-N 3.33Å; C195-R197 VanDerWaalsContact C-N 3.3Å; C195-R197 PolarHBondContact O-N 3.21Å; C195-T198 PolarHBondContact O-N 3.34Å; C195-L199 VanDerWaalsContact O-CB 3.3Å; C195-L199 WeakPolarHBondContact O-CB 3.38Å; C195-L199 PolarHBondContact O-N 3Å |
| 196 | Y | 86.6 | Confident | 86.6 | Confident | 33 Ų | 33 | 59.8 Ų | 59.8 | 13% | 0.129 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -59.3 | -39.1 | 178.6 | -178.5 | -101 | 0 | 0 | 0 | 112.8 | I192 R193 R204 I230 S231 F234 | I192-Y196 PolarHBondContact O-N 3.25Å; R193-Y196 PolarHBondContact O-N 3.5Å; Y196-R204 PolarHBondContact OH-NH1 3.29Å; Y196-I230 HydrophobicContact CD2-CG1 4.46Å; Y196-I230 HydrophobicContact CE2-CG2 4.1Å; Y196-S231 PolarHBondContact OH-N 2.8Å; Y196-S231 PolarHBondContact OH-OG 3.04Å; Y196-F234 HydrophobicContact CE2-CD2 4.19Å; Y196-F234 HydrophobicContact CE2-CG 4.18Å |
| 197 | R | 86 | Confident | 86.8 | Confident | 167 Ų | 167 | 58.7 Ų | 58.7 | 63% | 0.63 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -72 | -33.9 | 177.8 | -67.4 | -177.9 | 86.1 | 172.2 | 8.7 | 113.4 | R193 Q194 C195 | R193-R197 WeakPolarHBondContact O-CG 3.31Å; R193-R197 PolarHBondContact O-N 3.17Å; R193-R197 VanDerWaalsContact O-N 3.09Å; Q194-R197 PolarHBondContact O-N 3.19Å; C195-R197 VanDerWaalsContact C-N 3.3Å; C195-R197 PolarHBondContact O-N 3.21Å |
| 198 | T | 86 | Confident | 86.9 | Confident | 70 Ų | 70 | 65 Ų | 65 | 43% | 0.429 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -83.2 | -24.1 | -178.5 | -50.4 | 0 | 0 | 0 | 0 | 111.6 | F157 Q194 C195 D200 | F157-T198 HydrophobicContact CE1-CG2 3.78Å; Q194-T198 PolarHBondContact NE2-OG1 3.1Å; Q194-T198 VanDerWaalsContact O-CB 3.31Å; Q194-T198 WeakPolarHBondContact O-CB 3.37Å; Q194-T198 PolarHBondContact O-N 2.95Å; Q194-T198 PolarHBondContact O-OG1 3.42Å; C195-T198 PolarHBondContact O-N 3.34Å; T198-D200 PolarHBondContact O-N 3.19Å |
| 199 | L | 86.1 | Confident | 87.1 | Confident | 25 Ų | 25 | 62.3 Ų | 62.3 | 13% | 0.131 | 28% | 0.283 | C | S | . | . | S | Bend | trans | -64.8 | 126.4 | 178.9 | -168.3 | 69.1 | 0 | 0 | 0 | 111 | V161 C195 L203 R204 | V161-L199 HydrophobicContact CG2-CD1 3.86Å; C195-L199 VanDerWaalsContact O-CB 3.3Å; C195-L199 WeakPolarHBondContact O-CB 3.38Å; C195-L199 PolarHBondContact O-N 3Å; L199-L203 HydrophobicContact CD1-CB 4.1Å; L199-L203 HydrophobicContact CD1-CD1 3.45Å; L199-L203 VanDerWaalsContact CD1-CD1 3.45Å; L199-L203 HydrophobicContact CD1-CG 4.45Å; L199-L203 HydrophobicContact CD2-CB 4.48Å; L199-L203 HydrophobicContact CG-CB 4.08Å; L199-L203 HydrophobicContact CG-CD1 4.26Å; L199-R204 HydrophobicContact CB-CG 4.44Å; L199-R204 HydrophobicContact CD2-CG 3.65Å; L199-R204 HydrophobicContact CG-CG 4.08Å; L199-R204 PolarHBondContact O-NE 3.38Å; L199-R204 VanDerWaalsContact O-NE 3.11Å |
| 200 | D | 84.7 | Confident | 87.5 | Confident | 73 Ų | 73 | 61.1 Ų | 61.1 | 39% | 0.39 | 28% | 0.277 | S | S | . | . | trans | -56.1 | 142.9 | -178.4 | -161.5 | -57.5 | 0 | 0 | 0 | 111.4 | T198 R202 L203 R204 | T198-D200 PolarHBondContact O-N 3.19Å; D200-R202 PolarHBondContact O-N 3.32Å; D200-R202 PolarHBondContact OD1-N 3.03Å; D200-L203 PolarHBondContact O-N 2.75Å; D200-L203 VanDerWaalsContact O-N 3.17Å; D200-R204 PolarHBondContact O-N 2.9Å | ||
| 201 | R | 82.8 | Confident | 87.8 | Confident | 61 Ų | 61 | 57.5 Ų | 57.5 | 23% | 0.23 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -53.1 | -37.2 | 174.6 | -171.7 | -178.6 | -170.3 | -161.5 | 5.4 | 111 | E62 L65 R204 K205 | E62-R201 PolarHBondContact O-NH2 2.78Å; L65-R201 PolarHBondContact O-NH1 3.28Å; R201-R204 PolarHBondContact O-N 3.01Å; R201-K205 HydrophobicContact CG-CD 4.19Å; R201-K205 HydrophobicContact CG-CG 4.45Å; R201-K205 VanDerWaalsContact NE-CE 3.33Å; R201-K205 WeakPolarHBondContact O-CB 3.33Å; R201-K205 WeakPolarHBondContact O-CG 3.1Å; R201-K205 PolarHBondContact O-N 3.35Å |
| 202 | R | 84.2 | Confident | 88.1 | Confident | 107 Ų | 107 | 55.7 Ų | 55.7 | 40% | 0.404 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -58.7 | -51.3 | 177.9 | -172.4 | 179.8 | 73.3 | 179.7 | 2 | 111.3 | E165 D200 R204 K205 N206 | E165-R202 IonicContact OE2-NH2 3.53Å; D200-R202 PolarHBondContact O-N 3.32Å; D200-R202 PolarHBondContact OD1-N 3.03Å; R202-R204 VanDerWaalsContact C-N 3.29Å; R202-R204 PolarHBondContact O-N 3.48Å; R202-K205 PolarHBondContact O-N 3.45Å; R202-N206 VanDerWaalsContact O-CB 3.27Å; R202-N206 WeakPolarHBondContact O-CB 3.27Å; R202-N206 VanDerWaalsContact O-CG 3.22Å; R202-N206 PolarHBondContact O-N 2.83Å; R202-N206 PolarHBondContact O-OD1 3.44Å |
| 203 | L | 86.9 | Confident | 88.4 | Confident | 0 Ų | 0 | 53.7 Ų | 53.7 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -62.4 | -35.8 | 179.5 | -68 | 179.7 | 0 | 0 | 0 | 112.5 | V161 L164 E165 V168 Y172 L199 D200 L207 | V161-L203 HydrophobicContact CG1-CD1 4.09Å; L164-L203 HydrophobicContact CB-CD1 4.13Å; L164-L203 HydrophobicContact CB-CD2 4.07Å; E165-L203 HydrophobicContact CG-CD1 3.69Å; E165-L203 HydrophobicContact CG-CD2 4.02Å; E165-L203 HydrophobicContact CG-CG 4.04Å; V168-L203 HydrophobicContact CB-CD2 3.93Å; V168-L203 HydrophobicContact CG1-CD2 4.2Å; V168-L203 HydrophobicContact CG2-CD2 4.1Å; Y172-L203 VanDerWaalsContact CE1-O 3.28Å; Y172-L203 WeakPolarHBondContact CE1-O 3.02Å; Y172-L203 PolarHBondContact OH-O 3.49Å; L199-L203 HydrophobicContact CD1-CB 4.1Å; L199-L203 HydrophobicContact CD1-CD1 3.45Å; L199-L203 VanDerWaalsContact CD1-CD1 3.45Å; L199-L203 HydrophobicContact CD1-CG 4.45Å; L199-L203 HydrophobicContact CD2-CB 4.48Å; L199-L203 HydrophobicContact CG-CB 4.08Å; L199-L203 HydrophobicContact CG-CD1 4.26Å; D200-L203 PolarHBondContact O-N 2.75Å; D200-L203 VanDerWaalsContact O-N 3.17Å; L203-L207 PolarHBondContact O-N 2.74Å |
| 204 | R | 88.5 | Confident | 88.7 | Confident | 42 Ų | 42 | 50 Ų | 50 | 16% | 0.158 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -70.5 | -36.7 | 176.7 | -68.7 | -174.4 | -77.1 | 141.9 | -1.3 | 112.6 | E62 Y196 L199 D200 R201 R202 K237 | E62-R204 IonicContact OE1-CZ 3.36Å; E62-R204 IonicContact OE1-NH1 2.77Å; E62-R204 PolarHBondContact OE1-NH1 2.85Å; Y196-R204 PolarHBondContact OH-NH1 3.29Å; L199-R204 HydrophobicContact CB-CG 4.44Å; L199-R204 HydrophobicContact CD2-CG 3.65Å; L199-R204 HydrophobicContact CG-CG 4.08Å; L199-R204 PolarHBondContact O-NE 3.38Å; L199-R204 VanDerWaalsContact O-NE 3.11Å; D200-R204 PolarHBondContact O-N 2.9Å; R201-R204 PolarHBondContact O-N 3.01Å; R202-R204 VanDerWaalsContact C-N 3.29Å; R202-R204 PolarHBondContact O-N 3.48Å; R204-K237 PolarHBondContact O-NZ 3.16Å |
| 205 | K | 86.8 | Confident | 88.7 | Confident | 109 Ų | 109 | 45.2 Ų | 45.2 | 47% | 0.474 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -72.3 | -46.8 | 178 | -76.4 | -176.1 | 175.3 | -175.8 | 0 | 111.9 | R201 R202 L207 K237 | R201-K205 HydrophobicContact CG-CD 4.19Å; R201-K205 HydrophobicContact CG-CG 4.45Å; R201-K205 VanDerWaalsContact NE-CE 3.33Å; R201-K205 WeakPolarHBondContact O-CB 3.33Å; R201-K205 WeakPolarHBondContact O-CG 3.1Å; R201-K205 PolarHBondContact O-N 3.35Å; R202-K205 PolarHBondContact O-N 3.45Å; K205-L207 PolarHBondContact O-N 3.49Å; K205-K237 PolarHBondContact O-NZ 3.04Å |
| 206 | N | 87.8 | Confident | 88.6 | Confident | 34 Ų | 34 | 46.7 Ų | 46.7 | 18% | 0.182 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -71.5 | -14 | -176.5 | -70.4 | 13.7 | 0 | 0 | 0 | 113.8 | V168 E170 N171 Y172 R202 R208 | V168-N206 HydrophobicContact CG1-CB 3.64Å; E170-N206 WeakPolarHBondContact O-CB 3.46Å; E170-N206 PolarHBondContact O-ND2 2.91Å; N171-N206 WeakPolarHBondContact CA-O 3.27Å; Y172-N206 HydrophobicContact CD1-CB 4.24Å; Y172-N206 WeakPolarHBondContact CD1-O 3.36Å; Y172-N206 HydrophobicContact CE1-CB 4.16Å; Y172-N206 PolarHBondContact N-O 3.37Å; R202-N206 VanDerWaalsContact O-CB 3.27Å; R202-N206 WeakPolarHBondContact O-CB 3.27Å; R202-N206 VanDerWaalsContact O-CG 3.22Å; R202-N206 PolarHBondContact O-N 2.83Å; R202-N206 PolarHBondContact O-OD1 3.44Å; N206-R208 PolarHBondContact O-N 2.85Å |
| 207 | L | 90.8 | Very high | 88.5 | Confident | 3 Ų | 3 | 54.8 Ų | 54.8 | 2% | 0.016 | 24% | 0.24 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -65.7 | 117.3 | 171.3 | -179.1 | 68.9 | 0 | 0 | 0 | 109.6 | Y172 L174 L203 K205 A209 L210 F234 K237 | Y172-L207 HydrophobicContact CD2-CD1 3.97Å; Y172-L207 HydrophobicContact CE1-CB 3.88Å; Y172-L207 HydrophobicContact CE1-CD1 4.33Å; Y172-L207 HydrophobicContact CE2-CB 4.48Å; Y172-L207 HydrophobicContact CE2-CD1 3.49Å; Y172-L207 VanDerWaalsContact CE2-CD1 3.49Å; L174-L207 HydrophobicContact CB-CD1 3.6Å; L203-L207 PolarHBondContact O-N 2.74Å; K205-L207 PolarHBondContact O-N 3.49Å; L207-A209 WeakPolarHBondContact CD1-O 3.3Å; L207-L210 HydrophobicContact CD2-CB 4.25Å; L207-F234 HydrophobicContact CD2-CD2 4.16Å; L207-F234 HydrophobicContact CD2-CE2 3.37Å; L207-F234 HydrophobicContact CD2-CZ 3.75Å; L207-K237 HydrophobicContact CB-CD 4.46Å; L207-K237 HydrophobicContact CD2-CD 4.36Å; L207-K237 HydrophobicContact CG-CD 4.4Å; L207-K237 VanDerWaalsContact O-CD 3.23Å; L207-K237 WeakPolarHBondContact O-CD 3.37Å; L207-K237 WeakPolarHBondContact O-CE 3.47Å; L207-K237 PolarHBondContact O-NZ 3.24Å |
| 208 | R | 90.2 | Very high | 88.3 | Confident | 142 Ų | 142 | 49.5 Ų | 49.5 | 54% | 0.536 | 22% | 0.22 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -80.2 | -47.7 | 176.3 | -177.5 | 176.4 | 174.4 | -171.9 | -3.4 | 111.5 | N131 Y172 L173 N206 | N131-R208 PolarHBondContact ND2-NH1 3.16Å; Y172-R208 PolarHBondContact O-N 3.32Å; L173-R208 HydrophobicContact CD2-CB 4.01Å; L173-R208 HydrophobicContact CD2-CG 4.17Å; N206-R208 PolarHBondContact O-N 2.85Å |
| 209 | A | 91.6 | Very high | 88.2 | Confident | 6 Ų | 6 | 47.5 Ų | 47.5 | 5% | 0.05 | 21% | 0.208 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -150.9 | 145.8 | 176 | 0 | 0 | 0 | 0 | 0 | 111 | L173 L174 L207 V211 K237 | L173-A209 HydrophobicContact CD2-CB 3.69Å; L174-A209 PolarHBondContact N-O 2.83Å; L207-A209 WeakPolarHBondContact CD1-O 3.3Å; A209-V211 HydrophobicContact CB-CG2 4.28Å; A209-K237 CarbonylContact C-O 3.51Å; A209-K237 WeakPolarHBondContact CA-O 3.47Å |
| 210 | L | 93.5 | Very high | 88.3 | Confident | 27 Ų | 27 | 50.1 Ų | 50.1 | 14% | 0.141 | 22% | 0.219 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -103.8 | 104.1 | 165.5 | 172 | 56.5 | 0 | 0 | 0 | 107.9 | L174 H176 L207 V212 F234 K237 I238 R239 | L174-L210 HydrophobicContact CB-CD1 4.05Å; L174-L210 HydrophobicContact CD2-CD1 3.93Å; L174-L210 HydrophobicContact CG-CD1 3.85Å; L174-L210 CarbonylContact O-C 3.55Å; L174-L210 WeakPolarHBondContact O-CA 3.41Å; L174-L210 WeakPolarHBondContact O-CD1 3.47Å; H176-L210 HydrophobicContact CB-CD1 4.11Å; L207-L210 HydrophobicContact CD2-CB 4.25Å; L210-V212 HydrophobicContact CG-CG2 4.13Å; L210-F234 HydrophobicContact CD2-CE1 4.33Å; L210-F234 HydrophobicContact CD2-CZ 4.39Å; L210-K237 PolarHBondContact N-O 2.73Å; L210-I238 HydrophobicContact CB-CG1 4.32Å; L210-I238 HydrophobicContact CD2-CD1 4.37Å; L210-I238 HydrophobicContact CD2-CG1 4.18Å; L210-I238 HydrophobicContact CG-CG2 4.47Å; L210-I238 CarbonylContact O-C 3.51Å; L210-I238 WeakPolarHBondContact O-CA 3.3Å; L210-R239 PolarHBondContact O-N 2.8Å |
| 211 | V | 94.4 | Very high | 88.4 | Confident | 8 Ų | 8 | 48.9 Ų | 48.9 | 5% | 0.048 | 22% | 0.219 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -96.5 | 113.4 | -177.9 | -179.3 | 0 | 0 | 0 | 0 | 108.8 | L174 V175 H176 A209 V213 R239 L241 L247 | L174-V211 PolarHBondContact O-N 2.88Å; V175-V211 CarbonylContact C-O 3.57Å; V175-V211 WeakPolarHBondContact CA-O 3.33Å; V175-V211 HydrophobicContact CG2-CB 4.46Å; H176-V211 PolarHBondContact N-O 3.09Å; A209-V211 HydrophobicContact CB-CG2 4.28Å; V211-V213 HydrophobicContact CG1-CG2 4.13Å; V211-R239 CarbonylContact C-O 3.51Å; V211-R239 WeakPolarHBondContact CA-O 3.43Å; V211-L241 HydrophobicContact CG1-CD1 3.32Å; V211-L241 HydrophobicContact CG1-CG 3.68Å; V211-L247 HydrophobicContact CG1-CD1 4.06Å |
| 212 | V | 94.4 | Very high | 88.5 | Confident | 9 Ų | 9 | 48 Ų | 48 | 6% | 0.055 | 22% | 0.217 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -103 | 108.9 | -178.2 | -169.2 | 0 | 0 | 0 | 0 | 109 | H176 S178 L210 A215 V219 I238 R239 F240 L241 | H176-V212 HydrophobicContact CB-CG1 4.36Å; H176-V212 HydrophobicContact CB-CG2 4.31Å; H176-V212 CarbonylContact O-C 3.49Å; H176-V212 WeakPolarHBondContact O-CA 3.44Å; S178-V212 WeakPolarHBondContact OG-CG1 3.41Å; L210-V212 HydrophobicContact CG-CG2 4.13Å; V212-A215 HydrophobicContact CB-CB 4.42Å; V212-A215 HydrophobicContact CG1-CB 3.66Å; V212-V219 HydrophobicContact CG1-CG1 4.5Å; V212-I238 HydrophobicContact CG2-CG2 4.02Å; V212-R239 PolarHBondContact N-O 2.91Å; V212-F240 HydrophobicContact CB-CD1 3.75Å; V212-F240 HydrophobicContact CB-CE1 3.98Å; V212-F240 HydrophobicContact CG1-CD1 4.17Å; V212-F240 HydrophobicContact CG1-CE1 4.18Å; V212-F240 HydrophobicContact CG2-CD1 4.34Å; V212-F240 HydrophobicContact CG2-CE1 4.18Å; V212-F240 WeakPolarHBondContact O-CA 3.48Å; V212-L241 PolarHBondContact O-N 3.14Å |
| 213 | V | 94.5 | Very high | 88.5 | Confident | 0 Ų | 0 | 44.5 Ų | 44.5 | 0% | 0 | 21% | 0.206 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -95.9 | 137.2 | -177.2 | -166.8 | 0 | 0 | 0 | 0 | 110.2 | V175 H176 L177 S178 V211 A215 L241 L244 L247 | V175-V213 HydrophobicContact CG1-CG2 4.03Å; H176-V213 PolarHBondContact O-N 3.2Å; L177-V213 HydrophobicContact CD2-CB 4.06Å; L177-V213 HydrophobicContact CD2-CG2 4.09Å; S178-V213 WeakPolarHBondContact CB-O 3.4Å; S178-V213 PolarHBondContact N-O 3.33Å; S178-V213 PolarHBondContact OG-O 2.93Å; V211-V213 HydrophobicContact CG1-CG2 4.13Å; V213-A215 VanDerWaalsContact C-N 3.25Å; V213-A215 PolarHBondContact O-N 3.37Å; V213-L241 WeakPolarHBondContact CA-O 3.44Å; V213-L241 HydrophobicContact CG1-CB 4.45Å; V213-L241 HydrophobicContact CG2-CB 4.37Å; V213-L241 HydrophobicContact CG2-CD1 4.3Å; V213-L244 HydrophobicContact CG1-CD2 4.16Å; V213-L247 HydrophobicContact CG2-CB 4.47Å; V213-L247 HydrophobicContact CG2-CD1 4.17Å; V213-L247 HydrophobicContact CG2-CD2 4.21Å |
| 214 | H | 90.8 | Very high | 88.5 | Confident | 10 Ų | 10 | 46.4 Ų | 46.4 | 5% | 0.046 | 22% | 0.222 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 52.9 | 40.2 | -175.4 | -56.7 | -59.2 | 0 | 0 | 0 | 113.4 | S178 T216 L241 D242 L265 D266 | S178-H214 WeakPolarHBondContact CB-O 3.47Å; H214-T216 PolarHBondContact O-N 3.41Å; H214-T216 VanDerWaalsContact O-N 3.14Å; H214-L241 PolarHBondContact N-O 2.91Å; H214-D242 PolarHBondContact CE1-O 3.1Å; H214-D242 PolarHBondContact ND1-O 3.18Å; H214-L265 HydrophobicContact CB-CD2 3.82Å; H214-D266 IonicContact CE1-OD1 3.23Å; H214-D266 PolarHBondContact CE1-OD1 3.48Å; H214-D266 WeakPolarHBondContact NE2-CB 3.46Å; H214-D266 IonicContact NE2-OD1 3.42Å; H214-D266 PolarHBondContact NE2-OD1 2.64Å |
| 215 | A | 87.1 | Confident | 88.4 | Confident | 9 Ų | 9 | 49.5 Ų | 49.5 | 7% | 0.074 | 24% | 0.24 | C | C | . | . | trans | -61.8 | 118.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | V212 V213 V219 K220 F240 | V212-A215 HydrophobicContact CB-CB 4.42Å; V212-A215 HydrophobicContact CG1-CB 3.66Å; V213-A215 VanDerWaalsContact C-N 3.25Å; V213-A215 PolarHBondContact O-N 3.37Å; A215-V219 HydrophobicContact CB-CG1 4.31Å; A215-K220 HydrophobicContact CB-CG 4.02Å; A215-K220 WeakPolarHBondContact O-CE 3.27Å; A215-F240 HydrophobicContact CB-CD1 3.45Å; A215-F240 VanDerWaalsContact CB-CD1 3.45Å; A215-F240 HydrophobicContact CB-CE1 3.76Å | ||
| 216 | T | 86 | Confident | 88.2 | Confident | 45 Ų | 45 | 44.5 Ų | 44.5 | 28% | 0.276 | 22% | 0.219 | S | C | . | . | trans | -65.9 | 158.7 | 172.4 | 60 | 0 | 0 | 0 | 0 | 110.8 | H214 Y218 V219 K220 | H214-T216 PolarHBondContact O-N 3.41Å; H214-T216 VanDerWaalsContact O-N 3.14Å; T216-Y218 VanDerWaalsContact CB-CE1 3.45Å; T216-Y218 HydrophobicContact CG2-CD1 4.42Å; T216-Y218 HydrophobicContact CG2-CE1 3.72Å; T216-Y218 PolarHBondContact O-N 3.09Å; T216-Y218 WeakPolarHBondContact OG1-CD1 3.44Å; T216-Y218 WeakPolarHBondContact OG1-CE1 3.3Å; T216-Y218 WeakPolarHBondContact OG1-CE2 3.39Å; T216-V219 WeakPolarHBondContact O-CB 3.47Å; T216-V219 PolarHBondContact O-N 3.1Å; T216-V219 WeakPolarHBondContact OG1-CG2 3.28Å; T216-V219 PolarHBondContact OG1-N 3.15Å; T216-K220 PolarHBondContact O-N 3.35Å | ||
| 217 | W | 85.2 | Confident | 88 | Confident | 203 Ų | 203 | 50.1 Ų | 50.1 | 77% | 0.769 | 24% | 0.238 | S | C | * | . | H | α-helix | trans | -54.3 | -38.3 | 178.3 | 76.1 | -95.6 | 0 | 0 | 0 | 112.1 | V219 K220 A221 | W217-V219 PolarHBondContact O-N 3.47Å; W217-K220 PolarHBondContact O-N 2.99Å; W217-A221 HydrophobicContact CE3-CB 4.42Å; W217-A221 WeakPolarHBondContact O-CB 3.47Å; W217-A221 PolarHBondContact O-N 2.76Å |
| 218 | Y | 82.4 | Confident | 87.6 | Confident | 56 Ų | 56 | 54.3 Ų | 54.3 | 22% | 0.22 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -71.1 | -30.3 | 179.6 | 69.3 | -102 | 0 | 0 | 0 | 112 | T181 V186 T216 F222 | T181-Y218 PolarHBondContact O-OH 2.84Å; V186-Y218 HydrophobicContact CG2-CE2 4.05Å; T216-Y218 VanDerWaalsContact CB-CE1 3.45Å; T216-Y218 HydrophobicContact CG2-CD1 4.42Å; T216-Y218 HydrophobicContact CG2-CE1 3.72Å; T216-Y218 PolarHBondContact O-N 3.09Å; T216-Y218 WeakPolarHBondContact OG1-CD1 3.44Å; T216-Y218 WeakPolarHBondContact OG1-CE1 3.3Å; T216-Y218 WeakPolarHBondContact OG1-CE2 3.39Å; Y218-F222 WeakPolarHBondContact O-CB 3.43Å; Y218-F222 PolarHBondContact O-N 3.47Å |
| 219 | V | 84.2 | Confident | 87.1 | Confident | 29 Ų | 29 | 51.1 Ų | 51.1 | 18% | 0.176 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -68.6 | -43.5 | 172.6 | 170.5 | 0 | 0 | 0 | 0 | 110 | V212 A215 T216 W217 F222 L223 | V212-V219 HydrophobicContact CG1-CG1 4.5Å; A215-V219 HydrophobicContact CB-CG1 4.31Å; T216-V219 WeakPolarHBondContact O-CB 3.47Å; T216-V219 PolarHBondContact O-N 3.1Å; T216-V219 WeakPolarHBondContact OG1-CG2 3.28Å; T216-V219 PolarHBondContact OG1-N 3.15Å; W217-V219 PolarHBondContact O-N 3.47Å; V219-F222 PolarHBondContact O-N 2.88Å; V219-L223 WeakPolarHBondContact O-CB 3.39Å; V219-L223 PolarHBondContact O-N 3.3Å |
| 220 | K | 87.7 | Confident | 86.6 | Confident | 79 Ų | 79 | 51.9 Ų | 51.9 | 34% | 0.343 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -59.8 | -47.9 | 175.4 | -64.6 | -178.4 | -179 | 178.6 | 0 | 110.7 | A215 T216 W217 L223 A224 F240 D242 | A215-K220 HydrophobicContact CB-CG 4.02Å; A215-K220 WeakPolarHBondContact O-CE 3.27Å; T216-K220 PolarHBondContact O-N 3.35Å; W217-K220 PolarHBondContact O-N 2.99Å; K220-L223 PolarHBondContact O-N 3.22Å; K220-A224 PolarHBondContact O-N 3.2Å; K220-F240 HydrophobicContact CG-CD1 4.16Å; K220-F240 HydrophobicContact CG-CE1 3.9Å; K220-F240 HydrophobicContact CG-CZ 4.14Å; K220-D242 IonicContact NZ-OD1 3.64Å; K220-D242 PolarHBondContact NZ-OD1 3.2Å |
| 221 | A | 87.3 | Confident | 86.2 | Confident | 48 Ų | 48 | 52 Ų | 52 | 40% | 0.397 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -64 | -42.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | W217 L223 A224 L225 | W217-A221 HydrophobicContact CE3-CB 4.42Å; W217-A221 WeakPolarHBondContact O-CB 3.47Å; W217-A221 PolarHBondContact O-N 2.76Å; A221-L223 VanDerWaalsContact C-N 3.34Å; A221-L223 PolarHBondContact O-N 3.4Å; A221-A224 WeakPolarHBondContact O-CB 3.39Å; A221-A224 PolarHBondContact O-N 2.92Å; A221-L225 PolarHBondContact O-N 3.13Å |
| 222 | F | 84.4 | Confident | 85.8 | Confident | 43 Ų | 43 | 55.4 Ų | 55.4 | 19% | 0.189 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -62.6 | -41.2 | 177 | 177.7 | -96.6 | 0 | 0 | 0 | 112 | L189 I192 Y218 V219 A224 L225 L226 | L189-F222 HydrophobicContact CB-CE2 3.94Å; L189-F222 HydrophobicContact CB-CZ 4.21Å; L189-F222 HydrophobicContact CD1-CD2 4.4Å; L189-F222 HydrophobicContact CD1-CE1 4.43Å; L189-F222 HydrophobicContact CD1-CE2 3.47Å; L189-F222 VanDerWaalsContact CD1-CE2 3.47Å; L189-F222 HydrophobicContact CD1-CZ 3.46Å; L189-F222 VanDerWaalsContact CD1-CZ 3.46Å; L189-F222 HydrophobicContact CG-CE2 4.28Å; L189-F222 HydrophobicContact CG-CZ 4.45Å; I192-F222 HydrophobicContact CD1-CE1 3.39Å; I192-F222 HydrophobicContact CD1-CZ 3.53Å; Y218-F222 WeakPolarHBondContact O-CB 3.43Å; Y218-F222 PolarHBondContact O-N 3.47Å; V219-F222 PolarHBondContact O-N 2.88Å; F222-A224 VanDerWaalsContact C-N 3.34Å; F222-L225 PolarHBondContact O-N 2.81Å; F222-L226 HydrophobicContact CD1-CD1 3.87Å; F222-L226 HydrophobicContact CE1-CD1 3.28Å; F222-L226 HydrophobicContact CE1-CG 4.16Å; F222-L226 HydrophobicContact CZ-CD1 3.83Å; F222-L226 HydrophobicContact CZ-CG 4.36Å; F222-L226 PolarHBondContact O-N 3.22Å; F222-L226 VanDerWaalsContact O-N 3.1Å |
| 223 | L | 84.9 | Confident | 85.5 | Confident | 33 Ų | 33 | 61.4 Ų | 61.4 | 17% | 0.173 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -67.8 | -35.6 | 174.9 | -168.6 | 74.8 | 0 | 0 | 0 | 111.8 | V219 K220 A221 L225 L226 R227 I238 F240 | V219-L223 WeakPolarHBondContact O-CB 3.39Å; V219-L223 PolarHBondContact O-N 3.3Å; K220-L223 PolarHBondContact O-N 3.22Å; A221-L223 VanDerWaalsContact C-N 3.34Å; A221-L223 PolarHBondContact O-N 3.4Å; L223-L225 VanDerWaalsContact C-N 3.31Å; L223-L225 PolarHBondContact O-N 3.28Å; L223-L226 WeakPolarHBondContact O-CB 3.14Å; L223-L226 PolarHBondContact O-N 2.85Å; L223-L226 VanDerWaalsContact O-N 3.09Å; L223-R227 PolarHBondContact O-N 2.88Å; L223-R227 VanDerWaalsContact O-N 3.15Å; L223-I238 HydrophobicContact CD1-CD1 3.89Å; L223-I238 HydrophobicContact CD2-CB 4.36Å; L223-I238 HydrophobicContact CD2-CD1 3.64Å; L223-I238 HydrophobicContact CD2-CG2 3.7Å; L223-I238 HydrophobicContact CG-CD1 4.19Å; L223-F240 HydrophobicContact CD2-CE1 4.37Å; L223-F240 HydrophobicContact CD2-CE2 4.18Å; L223-F240 HydrophobicContact CD2-CZ 3.49Å; L223-F240 VanDerWaalsContact CD2-CZ 3.49Å |
| 224 | A | 86.8 | Confident | 85.2 | Confident | 40 Ų | 40 | 62.6 Ų | 62.6 | 33% | 0.331 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -60.2 | -41.6 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | K220 A221 F222 L226 R227 | K220-A224 PolarHBondContact O-N 3.2Å; A221-A224 WeakPolarHBondContact O-CB 3.39Å; A221-A224 PolarHBondContact O-N 2.92Å; F222-A224 VanDerWaalsContact C-N 3.34Å; A224-L226 PolarHBondContact O-N 2.84Å; A224-R227 VanDerWaalsContact O-CB 3.3Å; A224-R227 WeakPolarHBondContact O-CB 3.42Å; A224-R227 WeakPolarHBondContact O-CG 3.42Å; A224-R227 PolarHBondContact O-N 3.36Å |
| 225 | L | 85.8 | Confident | 85 | Confident | 106 Ų | 106 | 63.8 Ų | 63.8 | 56% | 0.555 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -66.3 | -25.3 | 174.2 | -174.8 | 64.4 | 0 | 0 | 0 | 113.1 | L189 A221 F222 L223 P228 | L189-L225 HydrophobicContact CD2-CD2 4.34Å; A221-L225 PolarHBondContact O-N 3.13Å; F222-L225 PolarHBondContact O-N 2.81Å; L223-L225 VanDerWaalsContact C-N 3.31Å; L223-L225 PolarHBondContact O-N 3.28Å; L225-P228 WeakPolarHBondContact O-CD 3.5Å |
| 226 | L | 82.3 | Confident | 85.2 | Confident | 5 Ų | 5 | 71.2 Ų | 71.2 | 3% | 0.026 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -81.3 | -16.8 | 176.3 | -84.4 | 173.7 | 0 | 0 | 0 | 114.1 | L189 I192 F222 L223 A224 P228 F229 I230 | L189-L226 HydrophobicContact CD1-CD1 4.25Å; L189-L226 HydrophobicContact CD1-CD2 3.3Å; L189-L226 HydrophobicContact CD1-CG 3.6Å; L189-L226 HydrophobicContact CG-CD2 4.46Å; I192-L226 HydrophobicContact CG2-CD1 3.65Å; I192-L226 HydrophobicContact CG2-CD2 4.49Å; F222-L226 HydrophobicContact CD1-CD1 3.87Å; F222-L226 HydrophobicContact CE1-CD1 3.28Å; F222-L226 HydrophobicContact CE1-CG 4.16Å; F222-L226 HydrophobicContact CZ-CD1 3.83Å; F222-L226 HydrophobicContact CZ-CG 4.36Å; F222-L226 PolarHBondContact O-N 3.22Å; F222-L226 VanDerWaalsContact O-N 3.1Å; L223-L226 WeakPolarHBondContact O-CB 3.14Å; L223-L226 PolarHBondContact O-N 2.85Å; L223-L226 VanDerWaalsContact O-N 3.09Å; A224-L226 PolarHBondContact O-N 2.84Å; L226-P228 VanDerWaalsContact C-CD 3.46Å; L226-F229 HydrophobicContact CD2-CD2 4.44Å; L226-F229 PolarHBondContact O-N 3.39Å; L226-I230 HydrophobicContact CB-CD1 3.91Å; L226-I230 PolarHBondContact O-N 3.11Å |
| 227 | R | 84.4 | Confident | 85.4 | Confident | 151 Ų | 151 | 71.1 Ų | 71.1 | 57% | 0.57 | 35% | 0.346 | S | S | * | . | G | 310 helix | trans | -47.5 | -46.2 | -179.4 | -74.4 | 178.6 | 175.2 | 163.5 | -2.4 | 114.7 | L223 A224 F229 I230 T235 | L223-R227 PolarHBondContact O-N 2.88Å; L223-R227 VanDerWaalsContact O-N 3.15Å; A224-R227 VanDerWaalsContact O-CB 3.3Å; A224-R227 WeakPolarHBondContact O-CB 3.42Å; A224-R227 WeakPolarHBondContact O-CG 3.42Å; A224-R227 PolarHBondContact O-N 3.36Å; R227-F229 PolarHBondContact O-N 3.49Å; R227-F229 VanDerWaalsContact O-N 3.13Å; R227-I230 PolarHBondContact O-N 3.4Å; R227-T235 HydrophobicContact CG-CG2 4.21Å |
| 228 | P | 82.5 | Confident | 85.8 | Confident | 92 Ų | 92 | 62.4 Ų | 62.4 | 60% | 0.597 | 32% | 0.315 | S | S | * | . | G | 310 helix | trans | -65.9 | -15.1 | 179.5 | 24.7 | -35.1 | 0 | 0 | 0 | 114.2 | L225 L226 | L225-P228 WeakPolarHBondContact O-CD 3.5Å; L226-P228 VanDerWaalsContact C-CD 3.46Å |
| 229 | F | 78.6 | Confident | 86.3 | Confident | 75 Ų | 75 | 66.6 Ų | 66.6 | 33% | 0.329 | 33% | 0.33 | S | S | . | . | G | 310 helix | trans | -101.7 | -5 | -179.2 | -55.2 | -74.7 | 0 | 0 | 0 | 113.3 | L226 R227 | L226-F229 HydrophobicContact CD2-CD2 4.44Å; L226-F229 PolarHBondContact O-N 3.39Å; R227-F229 PolarHBondContact O-N 3.49Å; R227-F229 VanDerWaalsContact O-N 3.13Å |
| 230 | I | 82.5 | Confident | 86.7 | Confident | 21 Ų | 21 | 68.6 Ų | 68.6 | 11% | 0.108 | 34% | 0.337 | C | S | . | . | S | Bend | trans | -119.4 | 140 | -175.3 | -64.5 | 178.4 | 0 | 0 | 0 | 107.9 | Y196 L226 R227 S232 F234 | Y196-I230 HydrophobicContact CD2-CG1 4.46Å; Y196-I230 HydrophobicContact CE2-CG2 4.1Å; L226-I230 HydrophobicContact CB-CD1 3.91Å; L226-I230 PolarHBondContact O-N 3.11Å; R227-I230 PolarHBondContact O-N 3.4Å; I230-S232 PolarHBondContact O-N 3.25Å; I230-F234 HydrophobicContact CG2-CB 3.7Å; I230-F234 HydrophobicContact CG2-CD1 3.34Å; I230-F234 HydrophobicContact CG2-CE1 4.24Å; I230-F234 HydrophobicContact CG2-CG 3.81Å |
| 231 | S | 84.8 | Confident | 87 | Confident | 29 Ų | 29 | 65.7 Ų | 65.7 | 20% | 0.203 | 33% | 0.325 | C | S | . | . | trans | -62.2 | 142.4 | -179 | 69.4 | 0 | 0 | 0 | 0 | 111.1 | Y196 K233 F234 T235 | Y196-S231 PolarHBondContact OH-N 2.8Å; Y196-S231 PolarHBondContact OH-OG 3.04Å; S231-K233 PolarHBondContact O-N 3.41Å; S231-K233 VanDerWaalsContact O-N 3.14Å; S231-F234 WeakPolarHBondContact O-CA 3.5Å; S231-F234 PolarHBondContact O-N 3.14Å; S231-F234 WeakPolarHBondContact OG-CB 2.86Å; S231-F234 PolarHBondContact OG-N 2.88Å; S231-T235 PolarHBondContact O-N 2.87Å; S231-T235 PolarHBondContact O-OG1 3.14Å | ||
| 232 | S | 85.8 | Confident | 87.1 | Confident | 81 Ų | 81 | 67.5 Ų | 67.5 | 57% | 0.566 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -53.8 | -35.9 | 176.5 | 179.7 | 0 | 0 | 0 | 0 | 111.8 | I230 F234 T235 R236 | I230-S232 PolarHBondContact O-N 3.25Å; S232-F234 PolarHBondContact O-N 3.47Å; S232-T235 PolarHBondContact O-N 2.75Å; S232-R236 WeakPolarHBondContact O-CG 3.13Å; S232-R236 PolarHBondContact O-N 2.87Å; S232-R236 VanDerWaalsContact O-N 3.16Å; S232-R236 PolarHBondContact O-NH1 3.23Å; S232-R236 PolarHBondContact OG-NH1 3.04Å |
| 233 | K | 87.4 | Confident | 87.4 | Confident | 134 Ų | 134 | 66.3 Ų | 66.3 | 58% | 0.583 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -60.3 | -42.6 | 172.8 | -69.5 | 170.6 | -175.2 | 161.7 | 0 | 112.5 | S231 | S231-K233 PolarHBondContact O-N 3.41Å; S231-K233 VanDerWaalsContact O-N 3.14Å |
| 234 | F | 87.7 | Confident | 87.7 | Confident | 25 Ų | 25 | 65.5 Ų | 65.5 | 11% | 0.11 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -72.6 | -41.8 | 178.2 | -173.6 | -80.4 | 0 | 0 | 0 | 111.6 | Y196 L207 L210 I230 S231 S232 R236 K237 I238 | Y196-F234 HydrophobicContact CE2-CD2 4.19Å; Y196-F234 HydrophobicContact CE2-CG 4.18Å; L207-F234 HydrophobicContact CD2-CD2 4.16Å; L207-F234 HydrophobicContact CD2-CE2 3.37Å; L207-F234 HydrophobicContact CD2-CZ 3.75Å; L210-F234 HydrophobicContact CD2-CE1 4.33Å; L210-F234 HydrophobicContact CD2-CZ 4.39Å; I230-F234 HydrophobicContact CG2-CB 3.7Å; I230-F234 HydrophobicContact CG2-CD1 3.34Å; I230-F234 HydrophobicContact CG2-CE1 4.24Å; I230-F234 HydrophobicContact CG2-CG 3.81Å; S231-F234 WeakPolarHBondContact O-CA 3.5Å; S231-F234 PolarHBondContact O-N 3.14Å; S231-F234 WeakPolarHBondContact OG-CB 2.86Å; S231-F234 PolarHBondContact OG-N 2.88Å; S232-F234 PolarHBondContact O-N 3.47Å; F234-R236 PolarHBondContact O-N 2.87Å; F234-K237 WeakPolarHBondContact O-CA 3.34Å; F234-K237 VanDerWaalsContact O-CB 3.26Å; F234-K237 WeakPolarHBondContact O-CB 3.32Å; F234-K237 PolarHBondContact O-N 2.95Å; F234-I238 HydrophobicContact CD1-CD1 4.12Å; F234-I238 HydrophobicContact CD1-CG1 4.42Å; F234-I238 HydrophobicContact CE1-CD1 4Å; F234-I238 HydrophobicContact CE1-CG1 4.32Å |
| 235 | T | 87.4 | Confident | 87.9 | Confident | 36 Ų | 36 | 65.4 Ų | 65.4 | 22% | 0.221 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -56.9 | -37.5 | 177 | -61 | 0 | 0 | 0 | 0 | 111.9 | R227 S231 S232 K237 I238 | R227-T235 HydrophobicContact CG-CG2 4.21Å; S231-T235 PolarHBondContact O-N 2.87Å; S231-T235 PolarHBondContact O-OG1 3.14Å; S232-T235 PolarHBondContact O-N 2.75Å; T235-K237 PolarHBondContact O-N 3.47Å; T235-I238 WeakPolarHBondContact O-CB 3.4Å; T235-I238 PolarHBondContact O-N 2.93Å; T235-I238 VanDerWaalsContact O-N 3.12Å |
| 236 | R | 90.4 | Very high | 88.2 | Confident | 164 Ų | 164 | 63.7 Ų | 63.7 | 62% | 0.619 | 31% | 0.312 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.8 | -18.6 | 174 | -73.7 | -169 | -64.8 | -85.6 | 9.3 | 114.8 | S232 F234 I238 | S232-R236 WeakPolarHBondContact O-CG 3.13Å; S232-R236 PolarHBondContact O-N 2.87Å; S232-R236 VanDerWaalsContact O-N 3.16Å; S232-R236 PolarHBondContact O-NH1 3.23Å; S232-R236 PolarHBondContact OG-NH1 3.04Å; F234-R236 PolarHBondContact O-N 2.87Å; R236-I238 VanDerWaalsContact C-N 3.28Å |
| 237 | K | 92.1 | Very high | 88.6 | Confident | 43 Ų | 43 | 63.5 Ų | 63.5 | 19% | 0.187 | 31% | 0.311 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -79.8 | -13.3 | 176 | -61.2 | 176.4 | 176.4 | -164.8 | 0 | 112.1 | R204 K205 L207 A209 L210 F234 T235 | R204-K237 PolarHBondContact O-NZ 3.16Å; K205-K237 PolarHBondContact O-NZ 3.04Å; L207-K237 HydrophobicContact CB-CD 4.46Å; L207-K237 HydrophobicContact CD2-CD 4.36Å; L207-K237 HydrophobicContact CG-CD 4.4Å; L207-K237 VanDerWaalsContact O-CD 3.23Å; L207-K237 WeakPolarHBondContact O-CD 3.37Å; L207-K237 WeakPolarHBondContact O-CE 3.47Å; L207-K237 PolarHBondContact O-NZ 3.24Å; A209-K237 CarbonylContact C-O 3.51Å; A209-K237 WeakPolarHBondContact CA-O 3.47Å; L210-K237 PolarHBondContact N-O 2.73Å; F234-K237 WeakPolarHBondContact O-CA 3.34Å; F234-K237 VanDerWaalsContact O-CB 3.26Å; F234-K237 WeakPolarHBondContact O-CB 3.32Å; F234-K237 PolarHBondContact O-N 2.95Å; T235-K237 PolarHBondContact O-N 3.47Å |
| 238 | I | 92.1 | Very high | 88.9 | Confident | 21 Ų | 21 | 58.6 Ų | 58.6 | 11% | 0.108 | 30% | 0.304 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86 | 123.7 | -173.7 | -49 | 179.5 | 0 | 0 | 0 | 109.6 | L210 V212 L223 F234 T235 R236 F240 | L210-I238 HydrophobicContact CB-CG1 4.32Å; L210-I238 HydrophobicContact CD2-CD1 4.37Å; L210-I238 HydrophobicContact CD2-CG1 4.18Å; L210-I238 HydrophobicContact CG-CG2 4.47Å; L210-I238 CarbonylContact O-C 3.51Å; L210-I238 WeakPolarHBondContact O-CA 3.3Å; V212-I238 HydrophobicContact CG2-CG2 4.02Å; L223-I238 HydrophobicContact CD1-CD1 3.89Å; L223-I238 HydrophobicContact CD2-CB 4.36Å; L223-I238 HydrophobicContact CD2-CD1 3.64Å; L223-I238 HydrophobicContact CD2-CG2 3.7Å; L223-I238 HydrophobicContact CG-CD1 4.19Å; F234-I238 HydrophobicContact CD1-CD1 4.12Å; F234-I238 HydrophobicContact CD1-CG1 4.42Å; F234-I238 HydrophobicContact CE1-CD1 4Å; F234-I238 HydrophobicContact CE1-CG1 4.32Å; T235-I238 WeakPolarHBondContact O-CB 3.4Å; T235-I238 PolarHBondContact O-N 2.93Å; T235-I238 VanDerWaalsContact O-N 3.12Å; R236-I238 VanDerWaalsContact C-N 3.28Å; I238-F240 HydrophobicContact CG2-CE2 4.34Å; I238-F240 HydrophobicContact CG2-CZ 4.26Å |
| 239 | R | 93.2 | Very high | 89.1 | Confident | 144 Ų | 144 | 62.1 Ų | 62.1 | 54% | 0.543 | 31% | 0.312 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.5 | 137.4 | 177.3 | -62.4 | -175.1 | -179.2 | -175.6 | -2.2 | 109.1 | L210 V211 V212 | L210-R239 PolarHBondContact O-N 2.8Å; V211-R239 CarbonylContact C-O 3.51Å; V211-R239 WeakPolarHBondContact CA-O 3.43Å; V212-R239 PolarHBondContact N-O 2.91Å |
| 240 | F | 93.8 | Very high | 89.5 | Confident | 71 Ų | 71 | 61.6 Ų | 61.6 | 31% | 0.311 | 31% | 0.312 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.2 | 133.8 | 175.8 | -64.9 | -77.1 | 0 | 0 | 0 | 108.9 | V212 A215 K220 L223 I238 | V212-F240 HydrophobicContact CB-CD1 3.75Å; V212-F240 HydrophobicContact CB-CE1 3.98Å; V212-F240 HydrophobicContact CG1-CD1 4.17Å; V212-F240 HydrophobicContact CG1-CE1 4.18Å; V212-F240 HydrophobicContact CG2-CD1 4.34Å; V212-F240 HydrophobicContact CG2-CE1 4.18Å; V212-F240 WeakPolarHBondContact O-CA 3.48Å; A215-F240 HydrophobicContact CB-CD1 3.45Å; A215-F240 VanDerWaalsContact CB-CD1 3.45Å; A215-F240 HydrophobicContact CB-CE1 3.76Å; K220-F240 HydrophobicContact CG-CD1 4.16Å; K220-F240 HydrophobicContact CG-CE1 3.9Å; K220-F240 HydrophobicContact CG-CZ 4.14Å; L223-F240 HydrophobicContact CD2-CE1 4.37Å; L223-F240 HydrophobicContact CD2-CE2 4.18Å; L223-F240 HydrophobicContact CD2-CZ 3.49Å; L223-F240 VanDerWaalsContact CD2-CZ 3.49Å; I238-F240 HydrophobicContact CG2-CE2 4.34Å; I238-F240 HydrophobicContact CG2-CZ 4.26Å |
| 241 | L | 93.2 | Very high | 89.7 | Confident | 18 Ų | 18 | 61 Ų | 61 | 9% | 0.094 | 31% | 0.309 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.3 | 140.6 | 172.2 | -56.1 | -178.8 | 0 | 0 | 0 | 109 | V211 V212 V213 H214 E246 L247 L250 | V211-L241 HydrophobicContact CG1-CD1 3.32Å; V211-L241 HydrophobicContact CG1-CG 3.68Å; V212-L241 PolarHBondContact O-N 3.14Å; V213-L241 WeakPolarHBondContact CA-O 3.44Å; V213-L241 HydrophobicContact CG1-CB 4.45Å; V213-L241 HydrophobicContact CG2-CB 4.37Å; V213-L241 HydrophobicContact CG2-CD1 4.3Å; H214-L241 PolarHBondContact N-O 2.91Å; L241-E246 WeakPolarHBondContact CA-OE2 3.49Å; L241-E246 HydrophobicContact CB-CB 4.25Å; L241-E246 WeakPolarHBondContact CB-OE2 3.35Å; L241-E246 HydrophobicContact CD1-CB 4.19Å; L241-E246 HydrophobicContact CD2-CB 4.1Å; L241-E246 WeakPolarHBondContact CD2-OE2 3.4Å; L241-E246 HydrophobicContact CG-CB 4.4Å; L241-L247 HydrophobicContact CD1-CB 4Å; L241-L247 HydrophobicContact CD1-CD1 4.09Å; L241-L250 HydrophobicContact CD1-CD1 3.79Å; L241-L250 HydrophobicContact CD2-CD1 4.19Å |
| 242 | D | 89.3 | Confident | 89.5 | Confident | 86 Ų | 86 | 63.2 Ų | 63.2 | 46% | 0.46 | 33% | 0.325 | S | S | . | . | S | Bend | trans | -94.3 | -15.7 | -177.1 | -65.3 | -41.5 | 0 | 0 | 0 | 112 | H214 K220 E246 H270 | H214-D242 PolarHBondContact CE1-O 3.1Å; H214-D242 PolarHBondContact ND1-O 3.18Å; K220-D242 IonicContact NZ-OD1 3.64Å; K220-D242 PolarHBondContact NZ-OD1 3.2Å; D242-E246 PolarHBondContact N-OE2 3.34Å; D242-E246 VanDerWaalsContact N-OE2 3.16Å; D242-H270 PolarHBondContact O-CE1 2.96Å |
| 243 | S | 91.3 | Very high | 89.3 | Confident | 17 Ų | 17 | 61.6 Ų | 61.6 | 12% | 0.119 | 31% | 0.31 | C | S | . | . | trans | -136.2 | 158.6 | 179.5 | 72.8 | 0 | 0 | 0 | 0 | 115.1 | G245 E246 L247 D266 H270 | S243-G245 PolarHBondContact O-N 3.14Å; S243-G245 PolarHBondContact OG-N 3.19Å; S243-E246 WeakPolarHBondContact OG-CG 3.48Å; S243-E246 PolarHBondContact OG-N 3Å; S243-L247 PolarHBondContact O-N 2.74Å; S243-D266 WeakPolarHBondContact CA-OD1 3.44Å; S243-H270 WeakPolarHBondContact CB-CE1 3.3Å; S243-H270 WeakPolarHBondContact CB-NE2 3.31Å | ||
| 244 | L | 91.5 | Very high | 88.6 | Confident | 16 Ų | 16 | 62.9 Ų | 62.9 | 8% | 0.084 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -67.9 | -24.2 | 166.2 | -68.5 | 179 | 0 | 0 | 0 | 112.3 | L177 V213 L247 A248 I258 V262 R263 D266 | L177-L244 HydrophobicContact CD2-CD2 4.45Å; V213-L244 HydrophobicContact CG1-CD2 4.16Å; L244-L247 HydrophobicContact CD2-CD2 4.26Å; L244-L247 WeakPolarHBondContact O-CB 3.34Å; L244-L247 PolarHBondContact O-N 2.89Å; L244-A248 PolarHBondContact O-N 3.24Å; L244-I258 HydrophobicContact CD1-CD1 4.19Å; L244-I258 HydrophobicContact CD1-CG2 4.17Å; L244-I258 HydrophobicContact CD2-CD1 4.04Å; L244-I258 HydrophobicContact CD2-CG2 4.38Å; L244-V262 HydrophobicContact CD1-CG1 4.49Å; L244-V262 HydrophobicContact CD2-CG1 4.14Å; L244-R263 HydrophobicContact CD1-CG 4.29Å; L244-D266 HydrophobicContact CD1-CB 3.83Å; L244-D266 HydrophobicContact CG-CB 3.99Å; L244-D266 PolarHBondContact N-OD1 3.11Å |
| 245 | G | 90.8 | Very high | 87.8 | Confident | 39 Ų | 39 | 68.2 Ų | 68.2 | 40% | 0.402 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -64.1 | -43.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | S243 L247 A248 Q249 | S243-G245 PolarHBondContact O-N 3.14Å; S243-G245 PolarHBondContact OG-N 3.19Å; G245-L247 VanDerWaalsContact C-N 3.3Å; G245-L247 PolarHBondContact O-N 3.27Å; G245-A248 WeakPolarHBondContact O-CB 3.32Å; G245-A248 PolarHBondContact O-N 2.92Å; G245-Q249 PolarHBondContact O-N 3Å |
| 246 | E | 91.1 | Very high | 87.6 | Confident | 69 Ų | 69 | 67 Ų | 67 | 32% | 0.322 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -63.4 | -37.4 | 172.7 | -73.6 | 170.5 | -159.7 | 0 | 0 | 111.8 | L241 D242 S243 A248 Q249 | L241-E246 WeakPolarHBondContact CA-OE2 3.49Å; L241-E246 HydrophobicContact CB-CB 4.25Å; L241-E246 WeakPolarHBondContact CB-OE2 3.35Å; L241-E246 HydrophobicContact CD1-CB 4.19Å; L241-E246 HydrophobicContact CD2-CB 4.1Å; L241-E246 WeakPolarHBondContact CD2-OE2 3.4Å; L241-E246 HydrophobicContact CG-CB 4.4Å; D242-E246 PolarHBondContact N-OE2 3.34Å; D242-E246 VanDerWaalsContact N-OE2 3.16Å; S243-E246 WeakPolarHBondContact OG-CG 3.48Å; S243-E246 PolarHBondContact OG-N 3Å; E246-A248 VanDerWaalsContact C-N 3.3Å; E246-A248 PolarHBondContact O-N 3.16Å; E246-Q249 PolarHBondContact O-N 3.2Å |
| 247 | L | 91.1 | Very high | 87.3 | Confident | 1 Ų | 1 | 65.1 Ų | 65.1 | 1% | 0.005 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -63.3 | -39.3 | 175 | -176.4 | 69 | 0 | 0 | 0 | 111.1 | V175 L177 V211 V213 L241 S243 L244 G245 Q249 L250 I251 L253 | V175-L247 HydrophobicContact CG1-CD1 3.81Å; V175-L247 HydrophobicContact CG1-CD2 3.97Å; V175-L247 HydrophobicContact CG2-CD1 4.11Å; L177-L247 HydrophobicContact CD2-CD2 4.35Å; V211-L247 HydrophobicContact CG1-CD1 4.06Å; V213-L247 HydrophobicContact CG2-CB 4.47Å; V213-L247 HydrophobicContact CG2-CD1 4.17Å; V213-L247 HydrophobicContact CG2-CD2 4.21Å; L241-L247 HydrophobicContact CD1-CB 4Å; L241-L247 HydrophobicContact CD1-CD1 4.09Å; S243-L247 PolarHBondContact O-N 2.74Å; L244-L247 HydrophobicContact CD2-CD2 4.26Å; L244-L247 WeakPolarHBondContact O-CB 3.34Å; L244-L247 PolarHBondContact O-N 2.89Å; G245-L247 VanDerWaalsContact C-N 3.3Å; G245-L247 PolarHBondContact O-N 3.27Å; L247-Q249 PolarHBondContact O-N 3.01Å; L247-L250 PolarHBondContact O-N 3.32Å; L247-I251 HydrophobicContact CD1-CD1 3.86Å; L247-I251 HydrophobicContact CD1-CG1 3.88Å; L247-I251 HydrophobicContact CD2-CD1 4.26Å; L247-I251 HydrophobicContact CG-CD1 3.99Å; L247-I251 HydrophobicContact CG-CG1 3.9Å; L247-I251 WeakPolarHBondContact O-CG1 3.03Å; L247-I251 PolarHBondContact O-N 3.36Å; L247-L253 HydrophobicContact CD2-CD2 3.87Å; L247-L253 HydrophobicContact CG-CD2 4.04Å |
| 248 | A | 89.8 | Confident | 87.2 | Confident | 49 Ų | 49 | 63.4 Ų | 63.4 | 41% | 0.405 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -63.5 | -27.6 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | L244 G245 E246 L250 L253 | L244-A248 PolarHBondContact O-N 3.24Å; G245-A248 WeakPolarHBondContact O-CB 3.32Å; G245-A248 PolarHBondContact O-N 2.92Å; E246-A248 VanDerWaalsContact C-N 3.3Å; E246-A248 PolarHBondContact O-N 3.16Å; A248-L250 VanDerWaalsContact C-N 3.27Å; A248-L253 HydrophobicContact CB-CD1 3.52Å; A248-L253 HydrophobicContact CB-CG 3.96Å |
| 249 | Q | 88.2 | Confident | 87.2 | Confident | 166 Ų | 166 | 62.6 Ų | 62.6 | 78% | 0.776 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -73.4 | -23.1 | 174.1 | -63.4 | 174.1 | 12.9 | 0 | 0 | 112.1 | G245 E246 L247 | G245-Q249 PolarHBondContact O-N 3Å; E246-Q249 PolarHBondContact O-N 3.2Å; L247-Q249 PolarHBondContact O-N 3.01Å |
| 250 | L | 85.3 | Confident | 87.1 | Confident | 63 Ų | 63 | 60.4 Ų | 60.4 | 33% | 0.33 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -96.9 | -31.1 | -178.1 | -65.1 | 174.8 | 0 | 0 | 0 | 113.3 | H126 L241 L247 A248 | H126-L250 PolarHBondContact CE1-O 3.32Å; H126-L250 PolarHBondContact ND1-O 3.47Å; H126-L250 PolarHBondContact NE2-O 2.81Å; H126-L250 VanDerWaalsContact NE2-O 3.12Å; L241-L250 HydrophobicContact CD1-CD1 3.79Å; L241-L250 HydrophobicContact CD2-CD1 4.19Å; L247-L250 PolarHBondContact O-N 3.32Å; A248-L250 VanDerWaalsContact C-N 3.27Å |
| 251 | I | 86.5 | Confident | 86.9 | Confident | 8 Ų | 8 | 59.3 Ų | 59.3 | 4% | 0.041 | 33% | 0.327 | C | S | . | . | S | Bend | trans | -143.8 | 150 | -178.8 | 58.1 | 163.5 | 0 | 0 | 0 | 111.4 | H126 V133 L173 V175 L247 L253 V256 | H126-I251 HydrophobicContact CB-CG2 4.19Å; V133-I251 HydrophobicContact CG1-CD1 3.74Å; V133-I251 HydrophobicContact CG2-CG2 3.98Å; L173-I251 HydrophobicContact CD1-CG2 4.09Å; V175-I251 HydrophobicContact CG2-CD1 4.06Å; L247-I251 HydrophobicContact CD1-CD1 3.86Å; L247-I251 HydrophobicContact CD1-CG1 3.88Å; L247-I251 HydrophobicContact CD2-CD1 4.26Å; L247-I251 HydrophobicContact CG-CD1 3.99Å; L247-I251 HydrophobicContact CG-CG1 3.9Å; L247-I251 WeakPolarHBondContact O-CG1 3.03Å; L247-I251 PolarHBondContact O-N 3.36Å; I251-L253 HydrophobicContact CD1-CD2 4.17Å; I251-L253 HydrophobicContact CG1-CD2 4.06Å; I251-L253 PolarHBondContact O-N 3.17Å; I251-V256 HydrophobicContact CD1-CG2 4.26Å |
| 252 | S | 81.6 | Confident | 86.8 | Confident | 77 Ų | 77 | 58.4 Ų | 58.4 | 54% | 0.538 | 32% | 0.323 | S | S | . | . | trans | -68.3 | 116.5 | 173.3 | -55.8 | 0 | 0 | 0 | 0 | 110.2 | D254 V256 | S252-D254 VanDerWaalsContact C-N 3.33Å; S252-V256 WeakPolarHBondContact O-CG2 3.4Å | ||
| 253 | L | 80.9 | Confident | 87 | Confident | 47 Ų | 47 | 58.6 Ų | 58.6 | 25% | 0.246 | 32% | 0.317 | C | S | . | . | G | 310 helix | trans | -80.9 | -10.1 | -178.5 | -62.6 | -174.9 | 0 | 0 | 0 | 114.1 | L247 A248 I251 Q255 V256 I258 | L247-L253 HydrophobicContact CD2-CD2 3.87Å; L247-L253 HydrophobicContact CG-CD2 4.04Å; A248-L253 HydrophobicContact CB-CD1 3.52Å; A248-L253 HydrophobicContact CB-CG 3.96Å; I251-L253 HydrophobicContact CD1-CD2 4.17Å; I251-L253 HydrophobicContact CG1-CD2 4.06Å; I251-L253 PolarHBondContact O-N 3.17Å; L253-Q255 PolarHBondContact O-N 3.47Å; L253-V256 HydrophobicContact CD2-CB 4.42Å; L253-V256 HydrophobicContact CD2-CG2 4.4Å; L253-V256 WeakPolarHBondContact O-CB 3.14Å; L253-V256 PolarHBondContact O-N 3.45Å; L253-I258 HydrophobicContact CD1-CD1 4.35Å; L253-I258 HydrophobicContact CD2-CD1 4.36Å |
| 254 | D | 74.2 | Confident | 87 | Confident | 160 Ų | 160 | 61.6 Ų | 61.6 | 86% | 0.856 | 33% | 0.329 | S | S | * | . | G | 310 helix | trans | -60.4 | -31.2 | -174.9 | -58.6 | -34.9 | 0 | 0 | 0 | 113.3 | S252 | S252-D254 VanDerWaalsContact C-N 3.33Š|
| 255 | Q | 70.8 | Confident | 86.9 | Confident | 138 Ų | 138 | 63.2 Ų | 63.2 | 65% | 0.645 | 34% | 0.337 | S | S | * | . | G | 310 helix | trans | -98.1 | 1.3 | -179.8 | -60.2 | -178.8 | 12.9 | 0 | 0 | 112.5 | L253 | L253-Q255 PolarHBondContact O-N 3.47Š|
| 256 | V | 82.3 | Confident | 86.9 | Confident | 11 Ų | 11 | 62.9 Ų | 62.9 | 7% | 0.067 | 33% | 0.326 | C | S | . | . | trans | -100.3 | 117.6 | -169.4 | 178.1 | 0 | 0 | 0 | 0 | 110.9 | L135 I251 S252 L253 I258 | L135-V256 HydrophobicContact CD1-CG1 3.71Å; L135-V256 HydrophobicContact CD1-CG2 4.33Å; L135-V256 HydrophobicContact CD2-CG1 3.22Å; L135-V256 HydrophobicContact CG-CG1 4.06Å; I251-V256 HydrophobicContact CD1-CG2 4.26Å; S252-V256 WeakPolarHBondContact O-CG2 3.4Å; L253-V256 HydrophobicContact CD2-CB 4.42Å; L253-V256 HydrophobicContact CD2-CG2 4.4Å; L253-V256 WeakPolarHBondContact O-CB 3.14Å; L253-V256 PolarHBondContact O-N 3.45Å; V256-I258 HydrophobicContact CG1-CG1 3.81Å; V256-I258 PolarHBondContact O-N 2.93Å; V256-I258 VanDerWaalsContact O-N 3.13Å | ||
| 257 | H | 84.3 | Confident | 86.9 | Confident | 123 Ų | 123 | 65.2 Ų | 65.2 | 57% | 0.569 | 33% | 0.332 | S | S | * | . | trans | -81.3 | 93.3 | 173 | -170.4 | 75.9 | 0 | 0 | 0 | 111.7 | ||||
| 258 | I | 90.4 | Very high | 86.8 | Confident | 8 Ų | 8 | 69.6 Ų | 69.6 | 4% | 0.041 | 36% | 0.356 | C | S | . | . | trans | -82.3 | 130.1 | 174.8 | -53.9 | 175.1 | 0 | 0 | 0 | 109.7 | L177 L244 L253 V256 V262 R263 | L177-I258 HydrophobicContact CD1-CG2 4.25Å; L244-I258 HydrophobicContact CD1-CD1 4.19Å; L244-I258 HydrophobicContact CD1-CG2 4.17Å; L244-I258 HydrophobicContact CD2-CD1 4.04Å; L244-I258 HydrophobicContact CD2-CG2 4.38Å; L253-I258 HydrophobicContact CD1-CD1 4.35Å; L253-I258 HydrophobicContact CD2-CD1 4.36Å; V256-I258 HydrophobicContact CG1-CG1 3.81Å; V256-I258 PolarHBondContact O-N 2.93Å; V256-I258 VanDerWaalsContact O-N 3.13Å; I258-V262 HydrophobicContact CG2-CB 3.91Å; I258-V262 HydrophobicContact CG2-CG1 4.01Å; I258-R263 HydrophobicContact CB-CG 4.45Å; I258-R263 HydrophobicContact CG2-CG 3.94Å; I258-R263 PolarHBondContact O-NH1 3.45Å; I258-R263 PolarHBondContact O-NH2 3.27Å | ||
| 259 | P | 92.1 | Very high | 86.6 | Confident | 3 Ų | 3 | 72 Ų | 72 | 2% | 0.019 | 36% | 0.362 | C | S | . | . | trans | -62 | 143.9 | 173.5 | -20.4 | 31.4 | 0 | 0 | 0 | 112.5 | A137 Y140 L177 A261 V262 R263 | A137-P259 HydrophobicContact CB-CG 3.66Å; Y140-P259 HydrophobicContact CE2-CB 4.13Å; Y140-P259 HydrophobicContact CE2-CG 3.69Å; L177-P259 HydrophobicContact CD1-CG 4.45Å; P259-A261 VanDerWaalsContact C-N 3.27Å; P259-A261 PolarHBondContact O-N 3.35Å; P259-V262 HydrophobicContact CB-CG2 4.04Å; P259-V262 HydrophobicContact CG-CG2 4.06Å; P259-V262 WeakPolarHBondContact O-CB 3.46Å; P259-V262 PolarHBondContact O-N 3Å; P259-R263 PolarHBondContact O-N 2.94Å | ||
| 260 | E | 90.6 | Very high | 86.3 | Confident | 99 Ų | 99 | 69 Ų | 69 | 46% | 0.463 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -62.5 | -33.9 | -179.4 | -171.3 | 55.7 | -154.3 | 0 | 0 | 112.8 | V262 R263 Q264 R267 | E260-V262 PolarHBondContact O-N 3.2Å; E260-R263 PolarHBondContact O-N 3.11Å; E260-R263 VanDerWaalsContact O-N 3.13Å; E260-R263 IonicContact OE2-NH1 2.72Å; E260-Q264 WeakPolarHBondContact O-CB 3.43Å; E260-Q264 PolarHBondContact O-N 2.92Å; E260-R267 IonicContact OE1-CZ 3.75Å; E260-R267 IonicContact OE1-NH1 3.81Å; E260-R267 PolarHBondContact OE1-NH1 3.24Å; E260-R267 IonicContact OE1-NH2 2.83Å; E260-R267 PolarHBondContact OE1-NH2 2.71Å |
| 261 | A | 90 | Very high | 85.2 | Confident | 47 Ų | 47 | 68.9 Ų | 68.9 | 39% | 0.388 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -59.7 | -30.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | P259 L265 | P259-A261 VanDerWaalsContact C-N 3.27Å; P259-A261 PolarHBondContact O-N 3.35Å; A261-L265 PolarHBondContact O-N 3.09Å |
| 262 | V | 91.6 | Very high | 83.7 | Confident | 0 Ų | 0 | 73.3 Ų | 73.3 | 0% | 0 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -77.2 | -42.9 | 176.3 | -177.4 | 0 | 0 | 0 | 0 | 110 | L177 G179 L244 I258 P259 E260 Q264 L265 D266 | L177-V262 HydrophobicContact CB-CG1 4.4Å; L177-V262 HydrophobicContact CB-CG2 4.01Å; L177-V262 HydrophobicContact CD2-CG1 4.41Å; G179-V262 WeakPolarHBondContact O-CG2 3.21Å; L244-V262 HydrophobicContact CD1-CG1 4.49Å; L244-V262 HydrophobicContact CD2-CG1 4.14Å; I258-V262 HydrophobicContact CG2-CB 3.91Å; I258-V262 HydrophobicContact CG2-CG1 4.01Å; P259-V262 HydrophobicContact CB-CG2 4.04Å; P259-V262 HydrophobicContact CG-CG2 4.06Å; P259-V262 WeakPolarHBondContact O-CB 3.46Å; P259-V262 PolarHBondContact O-N 3Å; E260-V262 PolarHBondContact O-N 3.2Å; V262-Q264 VanDerWaalsContact C-N 3.34Å; V262-Q264 PolarHBondContact O-N 3.37Å; V262-L265 PolarHBondContact O-N 2.94Å; V262-D266 PolarHBondContact O-N 3.22Å |
| 263 | R | 91.9 | Very high | 82.1 | Confident | 89 Ų | 89 | 73.3 Ų | 73.3 | 34% | 0.336 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -61.7 | -41.4 | 175.5 | -65.6 | -164.2 | -177 | 91.9 | 5.4 | 112.4 | L244 I258 P259 E260 D266 R267 | L244-R263 HydrophobicContact CD1-CG 4.29Å; I258-R263 HydrophobicContact CB-CG 4.45Å; I258-R263 HydrophobicContact CG2-CG 3.94Å; I258-R263 PolarHBondContact O-NH1 3.45Å; I258-R263 PolarHBondContact O-NH2 3.27Å; P259-R263 PolarHBondContact O-N 2.94Å; E260-R263 PolarHBondContact O-N 3.11Å; E260-R263 VanDerWaalsContact O-N 3.13Å; E260-R263 IonicContact OE2-NH1 2.72Å; R263-D266 PolarHBondContact O-N 3.33Å; R263-R267 WeakPolarHBondContact O-CG 3.35Å; R263-R267 PolarHBondContact O-N 2.87Å |
| 264 | Q | 91.2 | Very high | 80.3 | Confident | 81 Ų | 81 | 74.1 Ų | 74.1 | 38% | 0.379 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -62.1 | -46.6 | 176.2 | -175.9 | 64.8 | 56.2 | 0 | 0 | 110.7 | E260 V262 D266 R267 D268 | E260-Q264 WeakPolarHBondContact O-CB 3.43Å; E260-Q264 PolarHBondContact O-N 2.92Å; V262-Q264 VanDerWaalsContact C-N 3.34Å; V262-Q264 PolarHBondContact O-N 3.37Å; Q264-D266 VanDerWaalsContact C-N 3.33Å; Q264-D266 PolarHBondContact O-N 2.81Å; Q264-R267 WeakPolarHBondContact O-CB 3.42Å; Q264-R267 PolarHBondContact O-N 2.72Å; Q264-D268 PolarHBondContact NE2-OD1 3.49Å; Q264-D268 PolarHBondContact O-N 2.74Å |
| 265 | L | 89.9 | Confident | 78.3 | Confident | 49 Ų | 49 | 76.6 Ų | 76.6 | 26% | 0.257 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -60.8 | -42.5 | 177.5 | -178.8 | 65.7 | 0 | 0 | 0 | 112 | G179 H214 A261 V262 R267 D268 L269 | G179-L265 VanDerWaalsContact CA-CD2 3.46Å; H214-L265 HydrophobicContact CB-CD2 3.82Å; A261-L265 PolarHBondContact O-N 3.09Å; V262-L265 PolarHBondContact O-N 2.94Å; L265-R267 VanDerWaalsContact C-N 3.32Å; L265-R267 PolarHBondContact O-N 2.94Å; L265-D268 PolarHBondContact O-N 3.15Å; L265-L269 HydrophobicContact CD1-CD1 4.06Å; L265-L269 HydrophobicContact CD1-CG 4.08Å; L265-L269 HydrophobicContact CD2-CD1 4.45Å; L265-L269 HydrophobicContact CG-CD1 3.89Å; L265-L269 HydrophobicContact CG-CG 4.31Å; L265-L269 WeakPolarHBondContact O-CB 3.29Å; L265-L269 VanDerWaalsContact O-CG 3.31Å; L265-L269 WeakPolarHBondContact O-CG 3.47Å; L265-L269 PolarHBondContact O-N 2.74Å |
| 266 | D | 91.3 | Very high | 78.7 | Confident | 32 Ų | 32 | 73.5 Ų | 73.5 | 17% | 0.171 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -58.9 | -44.3 | 176.2 | -170.9 | 68.3 | 0 | 0 | 0 | 111.3 | H214 S243 L244 V262 R263 Q264 H270 | H214-D266 IonicContact CE1-OD1 3.23Å; H214-D266 PolarHBondContact CE1-OD1 3.48Å; H214-D266 WeakPolarHBondContact NE2-CB 3.46Å; H214-D266 IonicContact NE2-OD1 3.42Å; H214-D266 PolarHBondContact NE2-OD1 2.64Å; S243-D266 WeakPolarHBondContact CA-OD1 3.44Å; L244-D266 HydrophobicContact CD1-CB 3.83Å; L244-D266 HydrophobicContact CG-CB 3.99Å; L244-D266 PolarHBondContact N-OD1 3.11Å; V262-D266 PolarHBondContact O-N 3.22Å; R263-D266 PolarHBondContact O-N 3.33Å; Q264-D266 VanDerWaalsContact C-N 3.33Å; Q264-D266 PolarHBondContact O-N 2.81Å; D266-H270 WeakPolarHBondContact O-CB 3.33Å; D266-H270 PolarHBondContact O-N 3.42Å; D266-H270 VanDerWaalsContact O-N 3.11Å; D266-H270 PolarHBondContact O-ND1 3.39Å; D266-H270 IonicContact OD1-CE1 2.73Å; D266-H270 IonicContact OD1-ND1 3.51Å |
| 267 | R | 91.3 | Very high | 78.5 | Confident | 118 Ų | 118 | 76.8 Ų | 76.8 | 45% | 0.445 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -62.8 | -41.6 | 173.1 | -72.3 | -168.3 | -62.1 | -109.5 | -0.1 | 112.8 | E260 R263 Q264 L265 G271 | E260-R267 IonicContact OE1-CZ 3.75Å; E260-R267 IonicContact OE1-NH1 3.81Å; E260-R267 PolarHBondContact OE1-NH1 3.24Å; E260-R267 IonicContact OE1-NH2 2.83Å; E260-R267 PolarHBondContact OE1-NH2 2.71Å; R263-R267 WeakPolarHBondContact O-CG 3.35Å; R263-R267 PolarHBondContact O-N 2.87Å; Q264-R267 WeakPolarHBondContact O-CB 3.42Å; Q264-R267 PolarHBondContact O-N 2.72Å; L265-R267 VanDerWaalsContact C-N 3.32Å; L265-R267 PolarHBondContact O-N 2.94Å; R267-G271 WeakPolarHBondContact O-CA 3.39Å; R267-G271 PolarHBondContact O-N 3.14Å |
| 268 | D | 88.7 | Confident | 78.2 | Confident | 93 Ų | 93 | 74.2 Ų | 74.2 | 50% | 0.497 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -68.1 | -39.2 | -177.4 | -64.6 | -18.7 | 0 | 0 | 0 | 111.2 | Q264 L265 | Q264-D268 PolarHBondContact NE2-OD1 3.49Å; Q264-D268 PolarHBondContact O-N 2.74Å; L265-D268 PolarHBondContact O-N 3.15Å |
| 269 | L | 85.9 | Confident | 77.5 | Confident | 101 Ų | 101 | 78.1 Ų | 78.1 | 53% | 0.529 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -72 | -35.3 | 179.4 | -68.4 | 174.3 | 0 | 0 | 0 | 112.8 | L265 | L265-L269 HydrophobicContact CD1-CD1 4.06Å; L265-L269 HydrophobicContact CD1-CG 4.08Å; L265-L269 HydrophobicContact CD2-CD1 4.45Å; L265-L269 HydrophobicContact CG-CD1 3.89Å; L265-L269 HydrophobicContact CG-CG 4.31Å; L265-L269 WeakPolarHBondContact O-CB 3.29Å; L265-L269 VanDerWaalsContact O-CG 3.31Å; L265-L269 WeakPolarHBondContact O-CG 3.47Å; L265-L269 PolarHBondContact O-N 2.74Å |
| 270 | H | 81 | Confident | 76.6 | Confident | 102 Ų | 102 | 82.8 Ų | 82.8 | 47% | 0.472 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -105.2 | -16.1 | -175 | -59.2 | 90.3 | 0 | 0 | 0 | 114.1 | D242 S243 D266 | D242-H270 PolarHBondContact O-CE1 2.96Å; S243-H270 WeakPolarHBondContact CB-CE1 3.3Å; S243-H270 WeakPolarHBondContact CB-NE2 3.31Å; D266-H270 WeakPolarHBondContact O-CB 3.33Å; D266-H270 PolarHBondContact O-N 3.42Å; D266-H270 VanDerWaalsContact O-N 3.11Å; D266-H270 PolarHBondContact O-ND1 3.39Å; D266-H270 IonicContact OD1-CE1 2.73Å; D266-H270 IonicContact OD1-ND1 3.51Å |
| 271 | G | 63.9 | Low | 75.6 | Confident | 61 Ų | 61 | 81.7 Ų | 81.7 | 63% | 0.629 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -83.6 | -13.4 | 177 | 0 | 0 | 0 | 0 | 0 | 113.9 | R267 G273 | R267-G271 WeakPolarHBondContact O-CA 3.39Å; R267-G271 PolarHBondContact O-N 3.14Å; G271-G273 VanDerWaalsContact C-N 3.28Å; G271-G273 PolarHBondContact O-N 3.49Å |
| 272 | S | 54.7 | Low | 74.6 | Confident | 100 Ų | 100 | 84.2 Ų | 84.2 | 70% | 0.699 | 51% | 0.512 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.2 | 0 | 176.7 | -172.2 | 0 | 0 | 0 | 0 | 114.1 | ||
| 273 | G | 47.3 | Very low | 73.3 | Confident | 78 Ų | 78 | 90.7 Ų | 90.7 | 80% | 0.804 | 55% | 0.552 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.9 | 11.8 | -178.4 | 0 | 0 | 0 | 0 | 0 | 115.6 | G271 | G271-G273 VanDerWaalsContact C-N 3.28Å; G271-G273 PolarHBondContact O-N 3.49Å |
| 274 | G | 42.3 | Very low | 71.8 | Confident | 64 Ų | 64 | 90.8 Ų | 90.8 | 66% | 0.66 | 57% | 0.57 | S | S | * | * | trans | -129.2 | 69.1 | -175 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 275 | T | 33.6 | Very low | 70 | Confident | 211 Ų | 211 | 91.7 Ų | 91.7 | 100% | 1.294 | 59% | 0.587 | S | S | * | * | trans | -148.8 | 0 | 155.1 | 54.7 | 0 | 0 | 0 | 0 | 109.8 |
Retrieved 275 of 275 residues in 78.7 ms
(Link to these results)